@text This is a kinemage graphics file. You can view it in one of two ways: 1) Open it in your local copy of the free program KiNG (available at http://kinemage.biochem.duke.edu/software/king.php). To do so, either rename this file to end with ".kin" instead of "_kin.txt", (in which case drag-'n'-drop into KiNG will also work), or open it using the "All files" format option under "File | Open file..." 2) Upload it to the MolProbity web service (http://molprobity.biochem.duke.edu/) as a kinemage file, then select "View in KiNG". A kinemage display has a scrollable text window with explanatory information and a 3D graphics window with associated menus and buttons. The basic viewing functions are: 1) To rotate the image, drag slowly with the left mouse button 2) To zoom in, use slider or drag down with right mouse button 3) To identify an atom or point, click on it 4) To measure a distance, click on the two atoms successively 5) Turn graphics objects on or off with checkboxes on button panel 6) Animate with the keyboard 'a' or the Animate button for '*' groups, or with the keyboard 'b' or the 2-Animate button for '%' groups. 7) Click a *{hyperlink}* to jump to a specific view This kinemage examines backrubs at aromatic residues with "plus" chi1 (near +60 degrees) in anti-parallel beta-sheet. *{View 1}* recapitulates Figure 4 from the main text. The lowest-energy BRDEE models from one pair of starting conformations (darker, thicker lines) are initially turned on. Animate between the sets of examples for across from Gly vs. across from another amino acid type and notice that each "ensemble" matches its corresponding BRDEE model quite well. Note that this is also true for BRDEE models from the other starting conformations. (The Probe steric contacts appear to be more prominent for the "across from other" category because there are more examples present in this kinemage; they can be turned off/on via the master buttons at the bottom of the right-side panel.) *{View 2}* looks down the axis from the aromatic to its cross-strand partner, and shows that the starting examples were chosen to have low beta-sheet "fray." *{View 3}* takes a bird's eye view of the beta-sheet and helps visualize the movement of the aromatic ring toward the opposite strand. @kinemage 1 @title {Backrubs at Beta Aromatics} @whitebackground @onewidth @pdbfile {gly_avg_renumres_rota_mvcb_renumatm_ala_sup4supp.pdb} @1viewid {figure from paper} @1span 10.109128 @1zslab 226.0 @1center -10.6834 0.5464 -5.2334 @1matrix 0.6578 -0.748 0.0884 -0.7442 -0.6272 0.2299 -0.1165 -0.217 -0.9692 @2viewid {beta-sheet plane} @2span 17.754179 @2zslab 226.0 @2center -10.3296 0.5971 -6.5298 @2matrix -0.3494 -0.4874 0.8002 -0.2488 -0.7751 -0.5807 0.9033 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-7.19 {"}'P' green -11.551 1.337 -7.197 {"}'P' green -12.629 1.435 -6.942 {"}'P' green -11.87 1.379 -6.945 {"}'P' sea -11.634 1.283 -6.949 {"}'P' sea -12.302 1.332 -6.711 {"}'P' sea -12.047 1.299 -6.712 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 109 A}'P' P -12.496 1.601 -7.706 {"}'P' -12.494 1.572 -7.705 {"}'P' P -12.236 1.601 -7.706 {"}'P' -12.241 1.533 -7.704 {"}'P' P -11.978 1.562 -7.707 {"}'P' -11.991 1.505 -7.706 {"}'P' P -11.728 1.486 -7.711 {"}'P' -11.729 1.483 -7.711 {"}'P' P -12.505 1.589 -7.444 {"}'P' -12.5 1.528 -7.452 {"}'P' P -12.244 1.59 -7.444 {"}'P' -12.251 1.486 -7.457 {"}'P' P -11.986 1.553 -7.446 {"}'P' -12.007 1.46 -7.457 {"}'P' P -11.736 1.477 -7.449 {"}'P' -11.75 1.443 -7.454 {"}'P' P -12.562 1.533 -7.188 {"}'P' -12.558 1.503 -7.196 {"}'P' P -12.301 1.543 -7.188 {"}'P' -12.304 1.463 -7.21 {"}'P' P -12.041 1.513 -7.189 {"}'P' -12.057 1.432 -7.211 {"}'P' P -11.789 1.444 -7.192 {"}'P' -11.801 1.411 -7.201 {"}'P' P -12.374 1.457 -6.941 {"}'P' -12.374 1.446 -6.946 {"}'P' P -12.119 1.438 -6.942 {"}'P' -12.123 1.415 -6.952 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 109 A}'P' sky -12.927 1.552 -8.028 {"}'P' blue -13.224 1.598 -7.772 {"}'P' sky -12.982 1.514 -7.776 {"}'P' blue -13.113 1.457 -7.537 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 122 A}'P' blue -11.679 1.919 -8.196 {"}'P' blue -11.917 1.832 -8.2 {"}'P' sky -11.439 1.857 -8.014 {"}'P' sky -11.255 1.834 -7.793 {"}'P' blue -11.287 1.619 -7.294 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 122 A}'P' sea -11.656 1.714 -8.02 {"}'P' green -11.906 1.638 -8.023 {"}'P' green -12.166 1.636 -8.023 {"}'P' green -12.416 1.707 -8.02 {"}'P' sea -11.445 1.665 -7.8 {"}'P' green -11.67 1.547 -7.805 {"}'P' green -12.643 1.665 -7.8 {"}'P' sea -11.326 1.635 -7.554 {"}'P' green -11.542 1.498 -7.56 {"}'P' green -12.749 1.625 -7.554 {"}'P' green -11.496 1.477 -7.3 {"}'P' green -12.701 1.543 -7.297 {"}'P' sea -11.542 1.475 -7.04 {"}'P' green -12.749 1.603 -7.034 {"}'P' green -11.917 1.442 -6.793 {"}'P' green -12.171 1.442 -6.793 {"}'P' green -12.418 1.503 -6.791 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 122 A}'P' P -11.917 1.487 -7.808 {"}'P' -11.92 1.51 -7.795 {"}'P' P -12.171 1.487 -7.808 {"}'P' -12.166 1.531 -7.784 {"}'P' P -12.418 1.547 -7.805 {"}'P' -12.41 1.569 -7.793 {"}'P' P -11.782 1.412 -7.564 {"}'P' -11.792 1.453 -7.552 {"}'P' P -12.036 1.382 -7.565 {"}'P' -12.037 1.472 -7.54 {"}'P' P -12.29 1.409 -7.564 {"}'P' -12.269 1.5 -7.538 {"}'P' P -12.532 1.491 -7.56 {"}'P' -12.51 1.537 -7.546 {"}'P' P -11.731 1.384 -7.304 {"}'P' -11.739 1.413 -7.303 {"}'P' P -11.981 1.343 -7.306 {"}'P' -11.985 1.431 -7.302 {"}'P' P -12.233 1.357 -7.305 {"}'P' -12.217 1.458 -7.301 {"}'P' P -12.477 1.424 -7.302 {"}'P' -12.451 1.489 -7.3 {"}'P' P -11.782 1.389 -7.043 {"}'P' -11.782 1.39 -7.043 {"}'P' P -12.036 1.359 -7.045 {"}'P' -12.036 1.407 -7.053 {"}'P' P -12.29 1.386 -7.043 {"}'P' -12.279 1.435 -7.053 {"}'P' P -12.532 1.468 -7.04 {"}'P' -12.528 1.477 -7.042 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 109 A}'M' green -9.275 2.382 -6.221 {"}'M' green -9.136 2.597 -6.212 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 109 A}'M' greentint -9.131 2.193 -7.458 {"}'M' greentint -9.016 2.425 -7.447 {"}'M' greentint -8.851 2.625 -7.439 {"}'M' greentint -9.325 1.936 -7.249 {"}'M' greentint -9.274 2.184 -7.238 {"}'M' greentint -9.174 2.417 -7.228 {"}'M' greentint -9.029 2.625 -7.219 {"}'M' greentint -8.845 2.799 -7.211 {"}'M' greentint -9.419 1.918 -7.009 {"}'M' greentint -9.372 2.17 -6.998 {"}'M' greentint -9.279 2.408 -6.987 {"}'M' greentint -9.141 2.624 -6.978 {"}'M' greentint -8.966 2.81 -6.97 {"}'M' greentint -8.758 2.96 -6.963 {"}'M' greentint -9.448 2.044 -6.749 {"}'M' greentint -9.378 2.291 -6.738 {"}'M' greentint -9.263 2.521 -6.728 {"}'M' greentint -9.108 2.726 -6.719 {"}'M' greentint -8.918 2.899 -6.712 {"}'M' greentint -9.45 2.024 -6.491 {"}'M' greentint -9.381 2.272 -6.48 {"}'M' greentint -9.268 2.503 -6.47 {"}'M' greentint -9.114 2.709 -6.461 {"}'M' greentint -8.925 2.883 -6.454 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 122 A}'M' greentint -8.796 2.562 -7.279 {"}'M' greentint -8.892 2.329 -7.29 {"}'M' greentint -9.046 2.129 -7.298 {"}'M' greentint -9.246 1.976 -7.305 {"}'M' greentint -8.763 2.811 -7.269 {"}'M' greentint -8.758 2.559 -7.021 {"}'M' greentint -8.849 2.326 -7.031 {"}'M' greentint -8.995 2.122 -7.04 {"}'M' greentint -9.186 1.961 -7.047 {"}'M' greentint -8.729 2.808 -7.01 {"}'M' greentint -8.796 2.539 -6.762 {"}'M' greentint -8.892 2.306 -6.772 {"}'M' greentint -9.046 2.106 -6.781 {"}'M' greentint -9.246 1.953 -6.788 {"}'M' greentint -8.763 2.789 -6.751 {"}'M' greentint -8.899 2.531 -6.521 {"}'M' greentint -9.009 2.298 -6.531 {"}'M' greentint -9.183 2.107 -6.54 {"}'M' greentint -9.405 1.976 -6.546 {"}'M' greentint -8.863 2.786 -6.51 {"}'M' greentint -9.07 2.514 -6.315 {"}'M' greentint -9.206 2.293 -6.324 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 109 A}'M' sea -9.728 1.344 -5.169 {"}'M' green -9.654 1.591 -5.158 {"}'M' green -9.51 1.805 -5.149 {"}'M' green -9.836 1.212 -4.934 {"}'M' green -9.353 2.048 -4.897 {"}'M' green -9.861 1.068 -4.681 {"}'M' green -9.303 2.102 -4.636 {"}'M' green -9.836 1.19 -4.416 {"}'M' green -9.353 2.025 -4.38 {"}'M' green -9.728 1.3 -4.17 {"}'M' green -9.51 1.762 -4.15 {"}'M' sea -9.31 1.924 -4.143 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 109 A}'M' greentint -9.803 1.462 -4.923 {"}'M' greentint -9.707 1.695 -4.913 {"}'M' greentint -9.553 1.895 -4.904 {"}'M' greentint -9.863 1.318 -4.67 {"}'M' greentint -9.803 1.561 -4.659 {"}'M' greentint -9.684 1.782 -4.65 {"}'M' greentint -9.514 1.966 -4.642 {"}'M' greentint -9.803 1.439 -4.406 {"}'M' greentint -9.707 1.672 -4.395 {"}'M' greentint -9.553 1.872 -4.387 {"}'M' greentint -9.654 1.547 -4.159 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 122 A}'M' sea -9.567 2.049 -5.106 {"}'M' green -9.643 1.807 -5.117 {"}'M' green -9.766 1.586 -5.127 {"}'M' sea -9.932 1.394 -5.135 {"}'M' green -9.471 2.044 -4.866 {"}'M' sea -10.007 1.2 -4.902 {"}'M' green -9.955 1.168 -4.65 {"}'M' green -9.423 2.021 -4.354 {"}'M' green -9.948 1.162 -4.391 {"}'M' sea -9.473 2.003 -4.1 {"}'M' green -9.545 1.757 -4.111 {"}'M' green -9.662 1.53 -4.121 {"}'M' green -9.82 1.329 -4.13 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 122 A}'M' greentint -9.542 1.798 -4.876 {"}'M' greentint -9.658 1.57 -4.886 {"}'M' greentint -9.815 1.368 -4.895 {"}'M' greentint -9.425 2.024 -4.612 {"}'M' greentint -9.495 1.777 -4.623 {"}'M' greentint -9.61 1.546 -4.633 {"}'M' greentint -9.765 1.341 -4.642 {"}'M' greentint -9.492 1.773 -4.365 {"}'M' greentint -9.605 1.542 -4.375 {"}'M' greentint -9.759 1.336 -4.384 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ile A 58 1bgvA_60F_76G}P -12.081 -1.632 0.818 {"}-12.081 -1.632 0.818 { ca ile A 58 1bgvA_60F_76G}-11.154 -2.036 -0.239 { c ile A 58 1bgvA_60F_76G}-10.861 -0.77 -1.057 { o ile A 58 1bgvA_60F_76G}-11.811 -0.078 -1.478 { c ile A 58 1bgvA_60F_76G}P -10.861 -0.77 -1.057 { n glu A 59 1bgvA_60F_76G}-9.582 -0.505 -1.312 { ca glu A 59 1bgvA_60F_76G}-9.229 0.584 -2.253 { c glu A 59 1bgvA_60F_76G}-8.361 -0.069 -3.305 { o glu A 59 1bgvA_60F_76G}-7.5 -0.888 -2.944 { c glu A 59 1bgvA_60F_76G}P -8.361 -0.069 -3.305 { n phe A 60 1bgvA_60F_76G}-8.432 0.387 -4.557 { ca phe A 60 1bgvA_60F_76G}-7.554 -0.227 -5.541 { c phe A 60 1bgvA_60F_76G}-7.188 0.732 -6.667 { o phe A 60 1bgvA_60F_76G}-7.946 1.662 -6.992 { c phe A 60 1bgvA_60F_76G}P -7.188 0.732 -6.667 { n arg A 61 1bgvA_60F_76G}-6.093 0.386 -7.323 { ca arg A 61 1bgvA_60F_76G}-5.543 1.17 -8.457 { c arg A 61 1bgvA_60F_76G}-6.43 0.945 -9.669 { o arg A 61 1bgvA_60F_76G}-6.828 -0.198 -9.894 { c arg A 61 1bgvA_60F_76G}P -6.43 0.945 -9.669 { n val A 62 1bgvA_60F_76G}-6.686 1.972 -10.497 { ca val A 62 1bgvA_60F_76G}-7.457 1.753 -11.732 { c val A 62 1bgvA_60F_76G}-6.759 2.461 -12.903 { o val A 62 1bgvA_60F_76G}-7.072 3.607 -13.145 { n asn A 74 1bgvA_60F_76G}P -6.643 6.141 -11.773 {"}-6.643 6.141 -11.773 { ca asn A 74 1bgvA_60F_76G}-7.531 6.615 -10.716 { c asn A 74 1bgvA_60F_76G}-7.575 5.594 -9.613 { o asn A 74 1bgvA_60F_76G}-6.884 4.586 -9.672 { c asn A 74 1bgvA_60F_76G}P -7.575 5.594 -9.613 { n thr A 75 1bgvA_60F_76G}-8.33 5.927 -8.585 { ca thr A 75 1bgvA_60F_76G}-8.343 5.071 -7.432 { c thr A 75 1bgvA_60F_76G}-9.799 4.666 -7.294 { o thr A 75 1bgvA_60F_76G}-10.704 5.493 -7.495 { c thr A 75 1bgvA_60F_76G}P -9.799 4.666 -7.294 { n gly A 76 1bgvA_60F_76G}-10.038 3.376 -6.97 { ca gly A 76 1bgvA_60F_76G}-11.403 2.787 -6.775 { c gly A 76 1bgvA_60F_76G}-11.603 2.44 -5.265 { o gly A 76 1bgvA_60F_76G}-10.628 2.192 -4.53 { c gly A 76 1bgvA_60F_76G}P -11.603 2.44 -5.265 { n tyr A 77 1bgvA_60F_76G}-12.841 2.558 -4.787 { ca tyr A 77 1bgvA_60F_76G}-13.143 2.302 -3.38 { c tyr A 77 1bgvA_60F_76G}-14.374 1.412 -3.339 { o tyr A 77 1bgvA_60F_76G}-15.323 1.604 -4.096 { c tyr A 77 1bgvA_60F_76G}P -14.374 1.412 -3.339 { n arg A 78 1bgvA_60F_76G}-14.457 0.604 -2.276 { ca arg A 78 1bgvA_60F_76G}-15.755 0.012 -1.938 { c arg A 78 1bgvA_60F_76G}-15.658 -0.149 -0.404 { o arg A 78 1bgvA_60F_76G}-14.776 -0.849 0.092 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 58 1bgvA_60F_76G}P -12.081 -1.632 0.818 { ca ile A 58 1bgvA_60F_76G}P -11.154 -2.036 -0.239 { n glu A 59 1bgvA_60F_76G}P -9.582 -0.505 -1.312 { ca glu A 59 1bgvA_60F_76G}P -9.229 0.584 -2.253 { n phe A 60 1bgvA_60F_76G}P -8.432 0.387 -4.557 { ca phe A 60 1bgvA_60F_76G}P -7.554 -0.227 -5.541 { n arg A 61 1bgvA_60F_76G}P -6.093 0.386 -7.323 { ca arg A 61 1bgvA_60F_76G}P -5.543 1.17 -8.457 { n val A 62 1bgvA_60F_76G}P -6.686 1.972 -10.497 { ca val A 62 1bgvA_60F_76G}P -7.457 1.753 -11.732 { n asn A 74 1bgvA_60F_76G}P -6.643 6.141 -11.773 { ca asn A 74 1bgvA_60F_76G}P -7.531 6.615 -10.716 { n thr A 75 1bgvA_60F_76G}P -8.33 5.927 -8.585 { ca thr A 75 1bgvA_60F_76G}P -8.343 5.071 -7.432 { n gly A 76 1bgvA_60F_76G}P -10.038 3.376 -6.97 { ca gly A 76 1bgvA_60F_76G}P -11.403 2.787 -6.775 {"}P -11.403 2.787 -6.775 { n tyr A 77 1bgvA_60F_76G}P -12.841 2.558 -4.787 { ca tyr A 77 1bgvA_60F_76G}P -13.143 2.302 -3.38 { n arg A 78 1bgvA_60F_76G}P -14.457 0.604 -2.276 { ca arg A 78 1bgvA_60F_76G}P -15.755 0.012 -1.938 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ile A 58 1bgvA_60F_76G}P -11.154 -2.036 -0.239 {"}-11.154 -2.036 -0.239 { ca glu A 59 1bgvA_60F_76G}-9.229 0.584 -2.253 { ca phe A 60 1bgvA_60F_76G}-7.554 -0.227 -5.541 { ca arg A 61 1bgvA_60F_76G}-5.543 1.17 -8.457 { ca val A 62 1bgvA_60F_76G}-7.457 1.753 -11.732 { ca asn A 74 1bgvA_60F_76G}-7.531 6.615 -10.716 { ca thr A 75 1bgvA_60F_76G}-8.343 5.071 -7.432 { ca gly A 76 1bgvA_60F_76G}-11.403 2.787 -6.775 { ca tyr A 77 1bgvA_60F_76G}-13.143 2.302 -3.38 { ca arg A 78 1bgvA_60F_76G}-15.755 0.012 -1.938 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile A 58 1bgvA_60F_76G}P -11.154 -2.036 -0.239 { ca glu A 59 1bgvA_60F_76G}P -9.229 0.584 -2.253 { ca phe A 60 1bgvA_60F_76G}P -7.554 -0.227 -5.541 { cb phe A 60 1bgvA_60F_76G}-8.214 -1.52 -6.144 { cg phe A 60 1bgvA_60F_76G}-9.671 -1.331 -6.543 { cd1 phe A 60 1bgvA_60F_76G}-10.684 -1.342 -5.579 { ce1 phe A 60 1bgvA_60F_76G}-12.041 -1.19 -5.917 { cz phe A 60 1bgvA_60F_76G}-12.391 -0.97 -7.226 { cg phe A 60 1bgvA_60F_76G}P -9.671 -1.331 -6.543 { cd2 phe A 60 1bgvA_60F_76G}-10.047 -1.084 -7.888 { ce2 phe A 60 1bgvA_60F_76G}-11.403 -0.942 -8.226 { cz phe A 60 1bgvA_60F_76G}ghost -12.391 -0.97 -7.226 { ca arg A 61 1bgvA_60F_76G}P -5.543 1.17 -8.457 { ca val A 62 1bgvA_60F_76G}P -7.457 1.753 -11.732 { ca asn A 74 1bgvA_60F_76G}P -7.531 6.615 -10.716 { ca thr A 75 1bgvA_60F_76G}P -8.343 5.071 -7.432 { ca tyr A 77 1bgvA_60F_76G}P -13.143 2.302 -3.38 { ca arg A 78 1bgvA_60F_76G}P -15.755 0.012 -1.938 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 60 1bgvA_60F_76G}P -8.214 -1.52 -6.144 {"}P -8.214 -1.52 -6.144 { cd1 phe A 60 1bgvA_60F_76G}P -10.684 -1.342 -5.579 { cd2 phe A 60 1bgvA_60F_76G}P -10.047 -1.084 -7.888 { ce1 phe A 60 1bgvA_60F_76G}P -12.041 -1.19 -5.917 { ce2 phe A 60 1bgvA_60F_76G}P -11.403 -0.942 -8.226 { cz phe A 60 1bgvA_60F_76G}P -12.391 -0.97 -7.226 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 60 1bgvA_60F_76G}P -7.554 -0.227 -5.541 { cb phe A 60 1bgvA_60F_76G}-8.214 -1.52 -6.144 { cg phe A 60 1bgvA_60F_76G}-9.671 -1.331 -6.543 { cd1 phe A 60 1bgvA_60F_76G}-10.684 -1.342 -5.579 { ce1 phe A 60 1bgvA_60F_76G}-12.041 -1.19 -5.917 { cz phe A 60 1bgvA_60F_76G}-12.391 -0.97 -7.226 { cg phe A 60 1bgvA_60F_76G}P -9.671 -1.331 -6.543 { cd2 phe A 60 1bgvA_60F_76G}-10.047 -1.084 -7.888 { ce2 phe A 60 1bgvA_60F_76G}-11.403 -0.942 -8.226 { cz phe A 60 1bgvA_60F_76G}ghost -12.391 -0.97 -7.226 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 60 1bgvA_60F_76G}P -8.214 -1.52 -6.144 {"}P -8.214 -1.52 -6.144 { cd1 phe A 60 1bgvA_60F_76G}P -10.684 -1.342 -5.579 { cd2 phe A 60 1bgvA_60F_76G}P -10.047 -1.084 -7.888 { ce1 phe A 60 1bgvA_60F_76G}P -12.041 -1.19 -5.917 { ce2 phe A 60 1bgvA_60F_76G}P -11.403 -0.942 -8.226 { cz phe A 60 1bgvA_60F_76G}P -12.391 -0.97 -7.226 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 60 A}'P' sky -11.791 0.763 -8.282 {"}'P' sky -11.273 0.802 -8.281 {"}'P' sky -11.015 0.763 -8.282 {"}'P' sky -12.048 0.672 -8.025 {"}'P' blue -10.773 0.678 -8.024 {"}'P' sky -10.826 0.645 -7.767 {"}'P' sky -10.907 0.58 -7.52 {"}'P' sky -11.084 0.5 -7.287 { CZ PHE 60 A}'P' blue -12.391 0.685 -7.794 {"}'P' sky -12.136 0.665 -7.795 {"}'P' sky -12.521 0.774 -7.281 {"}'P' blue -12.53 0.762 -7.019 {"}'P' blue -11.309 0.393 -7.036 {"}'P' blue -12.326 0.716 -6.763 {"}'P' sky -12.066 0.686 -6.764 {"}'P' sky -11.814 0.617 -6.767 {"}'P' sky -11.576 0.51 -6.772 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 60 A}'P' sea -11.533 0.802 -8.281 {"}'P' sea -11.799 0.75 -8.021 {"}'P' green -11.542 0.79 -8.019 {"}'P' green -11.281 0.791 -8.019 {"}'P' sea -11.023 0.754 -8.021 {"}'P' green -11.855 0.685 -7.765 {"}'P' green -11.599 0.734 -7.763 {"}'P' green -11.338 0.744 -7.763 {"}'P' green -11.078 0.714 -7.764 {"}'P' green -11.666 0.636 -7.517 {"}'P' green -11.411 0.658 -7.516 {"}'P' green -11.156 0.639 -7.517 {"}'P' sea -11.339 0.533 -7.286 { CZ PHE 60 A}'P' sea -12.334 0.751 -7.541 {"}'P' green -12.074 0.722 -7.542 {"}'P' green -11.822 0.654 -7.545 {"}'P' sea -12.261 0.774 -7.281 {"}'P' green -12.003 0.735 -7.282 {"}'P' green -11.753 0.659 -7.286 {"}'P' sea -11.518 0.546 -7.291 {"}'P' sea -12.269 0.763 -7.019 {"}'P' green -12.011 0.726 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1cb8A_578Y_473}ghost -12.496 1.438 -8.569 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 578 1cb8A_578Y_473}P -9.188 -0.938 -7.089 {"}P -9.188 -0.938 -7.089 { cd1 tyr A 578 1cb8A_578Y_473}P -10.172 0.797 -8.685 { cd2 tyr A 578 1cb8A_578Y_473}P -11.608 -0.204 -7.041 { ce1 tyr A 578 1cb8A_578Y_473}P -11.245 1.566 -9.168 { ce2 tyr A 578 1cb8A_578Y_473}P -12.687 0.558 -7.515 { oh tyr A 578 1cb8A_578Y_473}P -13.54 2.227 -8.964 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 578 A}'P' green -11.283 1.452 -6.579 {"}'P' green -11.361 1.377 -6.332 {"}'P' green -11.289 1.238 -6.102 {"}'P' green -11.551 1.114 -5.891 { CZ TYR 578 A}'P' green -12.759 2.324 -7.083 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CD2 TYR 578 A}'P' P -11.616 1.396 -6.331 {"}'P' -11.616 1.32 -6.365 {"}'P' P -11.801 1.26 -6.101 {"}'P' -11.791 1.185 -6.15 {"}'P' P -11.544 1.271 -6.101 {"}'P' -11.545 1.239 -6.121 {"}'P' P -12.063 1.037 -5.895 {"}'P' -12.061 1.032 -5.9 {"}'P' P -11.811 1.1 -5.892 {"}'P' -11.809 1.088 -5.903 { CE2 TYR 578 A}'P' P -12.95 2.136 -6.806 {"}'P' -12.948 2.126 -6.811 {"}'P' P -12.695 2.158 -6.805 {"}'P' -12.695 2.072 -6.843 {"}'P' P -12.44 2.139 -6.806 {"}'P' -12.462 2.001 -6.868 {"}'P' P -12.191 2.08 -6.809 {"}'P' -12.241 1.929 -6.879 {"}'P' P -11.955 1.984 -6.813 {"}'P' -12.019 1.858 -6.875 {"}'P' P -11.736 1.852 -6.819 {"}'P' -11.789 1.779 -6.857 {"}'P' P -11.541 1.687 -6.826 {"}'P' -11.551 1.676 -6.832 {"}'P' P -13.131 1.968 -6.578 {"}'P' -13.131 1.967 -6.578 {"}'P' P -12.88 2.022 -6.575 {"}'P' -12.868 1.931 -6.633 {"}'P' P -11.686 1.656 -6.591 {"}'P' -11.758 1.577 -6.658 {"}'P' P -13.142 1.799 -6.369 {"}'P' -13.138 1.787 -6.38 {"}'P' P -12.89 1.862 -6.366 {"}'P' -12.874 1.76 -6.456 {"}'P' P -11.703 1.46 -6.383 {"}'P' -11.77 1.398 -6.461 {"}'P' P -13.128 1.607 -6.185 {"}'P' -13.126 1.604 -6.189 {"}'P' P -12.88 1.676 -6.182 {"}'P' -12.866 1.595 -6.279 {"}'P' P -11.916 1.408 -6.194 {"}'P' -11.991 1.326 -6.322 {"}'P' P -12.95 1.444 -6.029 {"}'P' -12.945 1.426 -6.06 {"}'P' P -12.695 1.48 -6.027 {"}'P' -12.695 1.408 -6.143 {"}'P' P -12.44 1.448 -6.029 {"}'P' -12.466 1.353 -6.188 {"}'P' P -12.201 1.352 -6.033 {"}'P' -12.248 1.276 -6.175 {"}'P' P -11.996 1.197 -6.04 {"}'P' -12.03 1.166 -6.112 {"}'P' P -12.819 1.236 -5.907 {"}'P' -12.819 1.236 -5.908 {"}'P' P -12.555 1.236 -5.907 {"}'P' -12.56 1.211 -5.968 {"}'P' P -12.307 1.146 -5.911 {"}'P' -12.32 1.127 -5.964 { CZ TYR 578 A}'P' P -12.504 2.36 -7.081 {"}'P' -12.504 2.357 -7.086 {"}'P' P -12.249 2.328 -7.083 {"}'P' -12.254 2.311 -7.112 {"}'P' P -12.01 2.232 -7.087 {"}'P' -12.02 2.216 -7.117 {"}'P' P -11.805 2.077 -7.094 {"}'P' -11.808 2.074 -7.101 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 TYR 578 A}'P' P -12.623 2.033 -6.575 {"}'P' -12.63 1.864 -6.683 {"}'P' P -12.368 2 -6.576 {"}'P' -12.415 1.786 -6.716 {"}'P' P -12.122 1.925 -6.579 {"}'P' -12.208 1.717 -6.721 {"}'P' P -11.892 1.809 -6.585 {"}'P' -11.99 1.656 -6.699 {"}'P' P -12.63 1.876 -6.365 {"}'P' -12.638 1.694 -6.524 {"}'P' P -12.372 1.841 -6.367 {"}'P' -12.428 1.616 -6.568 {"}'P' P -12.126 1.757 -6.37 {"}'P' -12.223 1.551 -6.567 {"}'P' P -11.9 1.629 -6.376 {"}'P' -12.003 1.489 -6.524 {"}'P' P -12.623 1.689 -6.182 {"}'P' -12.631 1.543 -6.355 {"}'P' P -12.369 1.648 -6.183 {"}'P' -12.419 1.474 -6.396 {"}'P' P -12.129 1.553 -6.188 {"}'P' -12.211 1.408 -6.381 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 473 A}'P' green -11.696 1.984 -7.06 {"}'P' green -11.351 1.508 -6.534 {"}'P' green -11.383 1.293 -6.035 {"}'P' green -11.638 1.149 -5.781 {"}'P' green -11.878 1.063 -5.784 {"}'P' green -12.132 1.033 -5.786 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 473 A}'P' P -12.14 2.235 -7.165 {"}'P' -12.14 2.233 -7.117 {"}'P' P -12.01 2.009 -7.145 {"}'P' -12.018 2.019 -7.076 {"}'P' P -12.27 2.009 -7.145 {"}'P' -12.259 2.023 -7.047 {"}'P' P -12.4 2.234 -7.136 {"}'P' -12.388 2.231 -7.083 {"}'P' P -11.879 1.795 -7.068 {"}'P' -11.902 1.829 -6.974 {"}'P' P -12.132 1.723 -7.071 {"}'P' -12.133 1.799 -6.894 {"}'P' P -12.575 1.969 -7.061 {"}'P' -12.526 1.993 -6.941 {"}'P' P -12.648 2.222 -7.049 {"}'P' -12.64 2.221 -7.034 {"}'P' P -11.581 1.755 -6.93 {"}'P' -11.586 1.759 -6.923 {"}'P' P -11.775 1.593 -6.937 {"}'P' -11.815 1.657 -6.835 {"}'P' P -12.825 1.975 -6.921 {"}'P' -12.765 1.993 -6.839 {"}'P' P -11.535 1.531 -6.755 {"}'P' -11.551 1.548 -6.735 {"}'P' P -11.752 1.388 -6.761 {"}'P' -11.801 1.487 -6.666 {"}'P' P -12.905 1.715 -6.747 {"}'P' -12.792 1.784 -6.636 {"}'P' P -13.015 1.95 -6.736 {"}'P' -12.97 1.962 -6.698 {"}'P' P -11.541 1.339 -6.541 {"}'P' -11.573 1.385 -6.512 {"}'P' P -11.766 1.221 -6.546 {"}'P' -11.807 1.327 -6.486 {"}'P' P -12.929 1.508 -6.534 {"}'P' -12.807 1.613 -6.45 {"}'P' P -13.073 1.717 -6.525 {"}'P' -13.003 1.752 -6.484 {"}'P' P -11.422 1.309 -6.295 {"}'P' -11.439 1.329 -6.288 {"}'P' P -11.638 1.172 -6.301 {"}'P' -11.678 1.253 -6.276 {"}'P' P -11.878 1.086 -6.305 {"}'P' -11.905 1.199 -6.273 {"}'P' P -12.132 1.056 -6.306 {"}'P' -12.133 1.215 -6.262 {"}'P' P -12.386 1.083 -6.305 {"}'P' -12.344 1.269 -6.252 {"}'P' P -12.628 1.165 -6.301 {"}'P' -12.546 1.336 -6.25 {"}'P' P -12.845 1.299 -6.295 {"}'P' -12.75 1.418 -6.255 {"}'P' P -13.027 1.478 -6.287 {"}'P' -12.959 1.532 -6.265 {"}'P' P -13.164 1.694 -6.278 {"}'P' -13.162 1.694 -6.277 {"}'P' P -11.592 1.151 -6.041 {"}'P' -11.607 1.18 -6.04 {"}'P' P -11.827 1.058 -6.045 {"}'P' -11.844 1.119 -6.042 {"}'P' P -12.077 1.017 -6.047 {"}'P' -12.08 1.07 -6.045 {"}'P' P -12.329 1.031 -6.046 {"}'P' -12.316 1.112 -6.043 {"}'P' P -12.573 1.098 -6.043 {"}'P' -12.54 1.181 -6.04 {"}'P' P -12.797 1.217 -6.038 {"}'P' -12.76 1.27 -6.036 {"}'P' P -12.989 1.38 -6.031 {"}'P' -12.98 1.389 -6.031 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 473 A}'P' P -12.386 1.787 -7.068 {"}'P' -12.343 1.856 -6.881 {"}'P' P -12.013 1.506 -6.941 {"}'P' -12.038 1.637 -6.758 {"}'P' P -12.267 1.506 -6.941 {"}'P' -12.236 1.67 -6.713 {"}'P' P -12.505 1.593 -6.937 {"}'P' -12.419 1.732 -6.716 {"}'P' P -12.699 1.755 -6.93 {"}'P' -12.599 1.832 -6.764 {"}'P' P -12.002 1.312 -6.764 {"}'P' -12.03 1.493 -6.605 {"}'P' P -12.262 1.31 -6.764 {"}'P' -12.23 1.536 -6.566 {"}'P' P -12.512 1.381 -6.761 {"}'P' -12.414 1.594 -6.558 {"}'P' P -12.733 1.52 -6.755 {"}'P' -12.6 1.668 -6.585 {"}'P' P -12.013 1.161 -6.549 {"}'P' -12.036 1.347 -6.448 {"}'P' P -12.267 1.161 -6.549 {"}'P' -12.238 1.395 -6.422 {"}'P' P -12.514 1.221 -6.546 {"}'P' -12.424 1.453 -6.414 {"}'P' P -12.739 1.339 -6.541 {"}'P' -12.611 1.52 -6.425 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 578 A}'M' green -8.761 3.281 -6.171 {"}'M' green -9.021 2.71 -5.735 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 578 A}'M' greentint -9.289 2.759 -6.961 {"}'M' greentint -9.151 2.975 -6.952 {"}'M' greentint -9.458 2.395 -6.723 {"}'M' greentint -9.388 2.642 -6.712 {"}'M' greentint -9.273 2.872 -6.702 {"}'M' greentint -9.118 3.077 -6.693 {"}'M' greentint -8.928 3.25 -6.686 {"}'M' greentint -9.46 2.375 -6.465 {"}'M' greentint -9.391 2.623 -6.454 {"}'M' greentint -9.278 2.854 -6.444 {"}'M' greentint -9.124 3.06 -6.435 {"}'M' greentint -8.935 3.234 -6.428 {"}'M' greentint -9.428 2.244 -6.217 {"}'M' greentint -9.38 2.495 -6.206 {"}'M' greentint -9.285 2.733 -6.195 {"}'M' greentint -9.146 2.948 -6.186 {"}'M' greentint -8.97 3.133 -6.178 {"}'M' greentint -9.286 2.473 -5.966 {"}'M' greentint -9.188 2.706 -5.955 {"}'M' greentint -9.044 2.915 -5.946 {"}'M' greentint -8.861 3.091 -5.939 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 473 A}'M' greentint -9.114 2.943 -6.966 {"}'M' greentint -9.25 2.722 -6.975 {"}'M' greentint -8.943 2.942 -6.758 {"}'M' greentint -9.053 2.708 -6.769 {"}'M' greentint -9.227 2.518 -6.777 {"}'M' greentint -9.449 2.386 -6.783 {"}'M' greentint -8.907 3.197 -6.747 {"}'M' greentint -8.84 2.929 -6.517 {"}'M' greentint -8.936 2.696 -6.528 {"}'M' greentint -9.09 2.496 -6.536 {"}'M' greentint -9.29 2.343 -6.543 {"}'M' greentint -8.807 3.178 -6.507 {"}'M' greentint -8.802 2.926 -6.259 {"}'M' greentint -8.893 2.693 -6.269 {"}'M' greentint -9.039 2.489 -6.278 {"}'M' greentint -9.23 2.328 -6.285 {"}'M' greentint -8.773 3.175 -6.248 {"}'M' greentint -8.84 2.906 -6 {"}'M' greentint -8.936 2.673 -6.01 {"}'M' greentint -9.09 2.473 -6.019 {"}'M' greentint -9.29 2.32 -6.026 {"}'M' greentint -8.807 3.156 -5.989 {"}'M' greentint -9.053 2.665 -5.769 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 578 A}'M' greentint -9.607 1.993 -5.127 {"}'M' greentint -9.938 1.727 -4.88 {"}'M' greentint -9.768 1.911 -4.872 {"}'M' greentint -9.557 2.047 -4.866 {"}'M' greentint -9.319 2.126 -4.862 {"}'M' greentint -9.961 1.617 -4.625 {"}'M' greentint -9.807 1.817 -4.617 {"}'M' greentint -9.607 1.97 -4.61 {"}'M' greentint -9.374 2.067 -4.606 {"}'M' greentint -9.124 2.1 -4.604 {"}'M' greentint -9.908 1.492 -4.389 {"}'M' greentint -9.764 1.707 -4.38 {"}'M' greentint -9.564 1.869 -4.373 {"}'M' greentint -9.325 1.966 -4.369 {"}'M' greentint -9.068 1.988 -4.368 {"}'M' greentint -9.725 1.487 -4.182 {"}'M' greentint -9.55 1.679 -4.174 {"}'M' greentint -9.318 1.795 -4.169 {"}'M' greentint -9.059 1.819 -4.168 {"}'M' greentint -9.381 1.537 -4.021 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 473 A}'M' green -10.023 1.362 -4.496 {"}'M' green -9.248 1.577 -3.974 {"}'M' green -9.466 1.44 -3.98 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 473 A}'M' greentint -9.451 2.045 -5.119 {"}'M' greentint -9.661 1.897 -5.125 {"}'M' greentint -9.234 2.015 -4.929 {"}'M' greentint -9.421 1.835 -4.937 {"}'M' greentint -9.645 1.704 -4.942 {"}'M' greentint -9.893 1.628 -4.946 {"}'M' greentint -9.066 2.001 -4.71 {"}'M' greentint -9.232 1.809 -4.718 {"}'M' greentint -9.432 1.654 -4.725 {"}'M' greentint -9.66 1.542 -4.73 {"}'M' greentint -9.905 1.479 -4.732 {"}'M' greentint -8.958 1.985 -4.469 {"}'M' greentint -9.115 1.783 -4.478 {"}'M' greentint -9.307 1.615 -4.485 {"}'M' greentint -9.528 1.485 -4.491 {"}'M' greentint -9.77 1.4 -4.495 {"}'M' greentint -9.065 1.756 -4.225 {"}'M' greentint -9.255 1.583 -4.233 {"}'M' greentint -9.474 1.448 -4.238 {"}'M' greentint -9.714 1.355 -4.243 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n tyr A 183 1dg6A_185Y_276}P -11.694 -1.818 1.053 {"}-11.694 -1.818 1.053 { ca tyr A 183 1dg6A_185Y_276}-10.935 -2.302 -0.092 { c tyr A 183 1dg6A_185Y_276}-10.694 -1.111 -1.012 { o tyr A 183 1dg6A_185Y_276}-11.657 -0.447 -1.443 { c tyr A 183 1dg6A_185Y_276}P -10.694 -1.111 -1.012 { n ile A 184 1dg6A_185Y_276}-9.424 -0.835 -1.275 { ca ile A 184 1dg6A_185Y_276}-8.993 0.335 -2.069 { c ile A 184 1dg6A_185Y_276}-8.32 -0.195 -3.324 { o ile A 184 1dg6A_185Y_276}-7.532 -1.157 -3.199 { c ile A 184 1dg6A_185Y_276}P -8.32 -0.195 -3.324 { n tyr A 185 1dg6A_185Y_276}-8.581 0.37 -4.501 { ca tyr A 185 1dg6A_185Y_276}-7.938 -0.142 -5.696 { c tyr A 185 1dg6A_185Y_276}-7.681 1 -6.673 { o tyr A 185 1dg6A_185Y_276}-8.327 2.067 -6.641 { c tyr A 185 1dg6A_185Y_276}P -7.681 1 -6.673 { n ser A 186 1dg6A_185Y_276}-6.767 0.765 -7.618 { ca ser A 186 1dg6A_185Y_276}-6.56 1.689 -8.729 { c ser A 186 1dg6A_185Y_276}-6.078 0.93 -9.934 { o ser A 186 1dg6A_185Y_276}-5.302 -0.032 -9.788 { c ser A 186 1dg6A_185Y_276}P -6.078 0.93 -9.934 { n gln A 187 1dg6A_185Y_276}-6.5 1.387 -11.141 { ca gln A 187 1dg6A_185Y_276}-5.897 0.933 -12.402 { c gln A 187 1dg6A_185Y_276}-5.329 2.177 -13.079 { o gln A 187 1dg6A_185Y_276}-6.01 3.197 -13.179 { n phe A 274 1dg6A_185Y_276}P -8.515 4.558 -13.288 {"}-8.515 4.558 -13.288 { ca phe A 274 1dg6A_185Y_276}-9.547 4.819 -12.284 { c phe A 274 1dg6A_185Y_276}-9.049 4.468 -10.905 { o phe A 274 1dg6A_185Y_276}-7.979 3.844 -10.734 { c phe A 274 1dg6A_185Y_276}P -9.049 4.468 -10.905 { n phe A 275 1dg6A_185Y_276}-9.81 4.875 -9.908 { ca phe A 275 1dg6A_185Y_276}-9.448 4.76 -8.494 { c phe A 275 1dg6A_185Y_276}-10.727 4.604 -7.692 { o phe A 275 1dg6A_185Y_276}-11.687 5.343 -7.961 { c phe A 275 1dg6A_185Y_276}P -10.727 4.604 -7.692 { n gly A 276 1dg6A_185Y_276}-10.768 3.704 -6.739 { ca gly A 276 1dg6A_185Y_276}-12.018 3.517 -6.008 { c gly A 276 1dg6A_185Y_276}-11.752 2.874 -4.672 { o gly A 276 1dg6A_185Y_276}-10.659 2.447 -4.308 { c gly A 276 1dg6A_185Y_276}P -11.752 2.874 -4.672 { n ala A 277 1dg6A_185Y_276}-12.851 2.766 -3.901 { ca ala A 277 1dg6A_185Y_276}-12.791 2.129 -2.603 { c ala A 277 1dg6A_185Y_276}-14.191 1.777 -2.125 { o ala A 277 1dg6A_185Y_276}-15.141 2.495 -2.499 { c ala A 277 1dg6A_185Y_276}P -14.191 1.777 -2.125 { n phe A 278 1dg6A_185Y_276}-14.317 0.777 -1.267 { ca phe A 278 1dg6A_185Y_276}-15.618 0.517 -0.667 { c phe A 278 1dg6A_185Y_276}-15.403 -0.06 0.726 { o phe A 278 1dg6A_185Y_276}-14.426 -0.71 1.001 @vectorlist {mc H} off nobutton color= gray 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1dg6A_185Y_276}P -14.317 0.777 -1.267 { ca phe A 278 1dg6A_185Y_276}P -15.618 0.517 -0.667 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca tyr A 183 1dg6A_185Y_276}P -10.935 -2.302 -0.092 {"}-10.935 -2.302 -0.092 { ca ile A 184 1dg6A_185Y_276}-8.993 0.335 -2.069 { ca tyr A 185 1dg6A_185Y_276}-7.938 -0.142 -5.696 { ca ser A 186 1dg6A_185Y_276}-6.56 1.689 -8.729 { ca gln A 187 1dg6A_185Y_276}-5.897 0.933 -12.402 { ca phe A 274 1dg6A_185Y_276}P -9.547 4.819 -12.284 {"}-9.547 4.819 -12.284 { ca phe A 275 1dg6A_185Y_276}-9.448 4.76 -8.494 { ca gly A 276 1dg6A_185Y_276}-12.018 3.517 -6.008 { ca ala A 277 1dg6A_185Y_276}-12.791 2.129 -2.603 { ca phe A 278 1dg6A_185Y_276}-15.618 0.517 -0.667 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca tyr A 183 1dg6A_185Y_276}P -10.935 -2.302 -0.092 { ca ile A 184 1dg6A_185Y_276}P -8.993 0.335 -2.069 { ca tyr A 185 1dg6A_185Y_276}P -7.938 -0.142 -5.696 { cb tyr A 185 1dg6A_185Y_276}-8.848 -1.217 -6.393 { cg tyr A 185 1dg6A_185Y_276}-10.167 -0.613 -6.859 { cd1 tyr A 185 1dg6A_185Y_276}-11.268 -0.569 -5.986 { ce1 tyr A 185 1dg6A_185Y_276}-12.481 -0.038 -6.382 { cz tyr A 185 1dg6A_185Y_276}-12.584 0.454 -7.674 { oh tyr A 185 1dg6A_185Y_276}-13.791 1.007 -8.028 { cg tyr A 185 1dg6A_185Y_276}P -10.167 -0.613 -6.859 { cd2 tyr A 185 1dg6A_185Y_276}-10.351 -0.139 -8.155 { ce2 tyr A 185 1dg6A_185Y_276}-11.536 0.437 -8.555 { cz tyr A 185 1dg6A_185Y_276}ghost -12.584 0.454 -7.674 { ca ser A 186 1dg6A_185Y_276}P -6.56 1.689 -8.729 { ca gln A 187 1dg6A_185Y_276}P -5.897 0.933 -12.402 { ca phe A 274 1dg6A_185Y_276}P -9.547 4.819 -12.284 { ca phe A 275 1dg6A_185Y_276}P -9.448 4.76 -8.494 { ca ala A 277 1dg6A_185Y_276}P -12.791 2.129 -2.603 { ca phe A 278 1dg6A_185Y_276}P -15.618 0.517 -0.667 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 185 1dg6A_185Y_276}P -8.848 -1.217 -6.393 {"}P -8.848 -1.217 -6.393 { cd1 tyr A 185 1dg6A_185Y_276}P -11.268 -0.569 -5.986 { cd2 tyr A 185 1dg6A_185Y_276}P -10.351 -0.139 -8.155 { ce1 tyr A 185 1dg6A_185Y_276}P -12.481 -0.038 -6.382 { ce2 tyr A 185 1dg6A_185Y_276}P -11.536 0.437 -8.555 { oh tyr A 185 1dg6A_185Y_276}P -13.791 1.007 -8.028 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 185 1dg6A_185Y_276}P -7.938 -0.142 -5.696 { cb tyr A 185 1dg6A_185Y_276}-8.848 -1.217 -6.393 { cg tyr A 185 1dg6A_185Y_276}-10.167 -0.613 -6.859 { cd1 tyr A 185 1dg6A_185Y_276}-11.268 -0.569 -5.986 { ce1 tyr A 185 1dg6A_185Y_276}-12.481 -0.038 -6.382 { cz tyr A 185 1dg6A_185Y_276}-12.584 0.454 -7.674 { oh tyr A 185 1dg6A_185Y_276}-13.791 1.007 -8.028 { cg tyr A 185 1dg6A_185Y_276}P -10.167 -0.613 -6.859 { cd2 tyr A 185 1dg6A_185Y_276}-10.351 -0.139 -8.155 { ce2 tyr A 185 1dg6A_185Y_276}-11.536 0.437 -8.555 { cz tyr A 185 1dg6A_185Y_276}ghost -12.584 0.454 -7.674 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 185 1dg6A_185Y_276}P -8.848 -1.217 -6.393 {"}P -8.848 -1.217 -6.393 { cd1 tyr A 185 1dg6A_185Y_276}P -11.268 -0.569 -5.986 { cd2 tyr A 185 1dg6A_185Y_276}P -10.351 -0.139 -8.155 { ce1 tyr A 185 1dg6A_185Y_276}P -12.481 -0.038 -6.382 { ce2 tyr A 185 1dg6A_185Y_276}P -11.536 0.437 -8.555 { oh tyr A 185 1dg6A_185Y_276}P -13.791 1.007 -8.028 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 185 A}'P' sky -13.126 1.576 -6.181 {"}'P' sky -12.933 1.589 -5.921 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 185 A}'P' sea -13.119 1.591 -6.442 {"}'P' green -12.869 1.667 -6.438 {"}'P' green -12.611 1.706 -6.437 {"}'P' green -12.351 1.706 -6.437 {"}'P' green -12.877 1.654 -6.177 {"}'P' green -12.62 1.694 -6.175 { CZ TYR 185 A}'P' sea -12.714 2.198 -7.729 {"}'P' green -12.98 2.146 -7.469 {"}'P' green -12.204 2.15 -7.469 {"}'P' green -12.007 2.041 -7.215 {"}'P' green -13.331 1.872 -6.972 {"}'P' green -13.266 1.768 -6.741 {"}'P' green -13.039 1.695 -6.528 {"}'P' green -12.269 1.737 -6.526 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 185 A}'P' P -12.723 2.186 -7.467 {"}'P' -12.721 2.162 -7.47 {"}'P' P -12.462 2.187 -7.467 {"}'P' -12.463 2.176 -7.469 {"}'P' P -13.036 2.081 -7.213 {"}'P' -13.023 2.035 -7.226 {"}'P' P -12.78 2.13 -7.211 {"}'P' -12.769 2.04 -7.236 {"}'P' P -12.519 2.14 -7.211 {"}'P' -12.522 2.052 -7.235 {"}'P' P -12.259 2.11 -7.212 {"}'P' -12.267 2.072 -7.223 {"}'P' P -13.095 1.971 -6.968 {"}'P' -13.08 1.926 -6.989 {"}'P' P -12.847 2.032 -6.965 {"}'P' -12.83 1.931 -7.011 {"}'P' P -12.592 2.054 -6.964 {"}'P' -12.592 1.94 -7.015 {"}'P' P -12.337 2.035 -6.965 {"}'P' -12.349 1.958 -6.999 {"}'P' P -12.088 1.976 -6.968 {"}'P' -12.089 1.973 -6.969 {"}'P' P -13.028 1.864 -6.737 {"}'P' -13.017 1.829 -6.759 {"}'P' P -12.777 1.918 -6.734 {"}'P' -12.766 1.84 -6.784 {"}'P' P -12.52 1.929 -6.734 {"}'P' -12.523 1.852 -6.783 {"}'P' P -12.265 1.896 -6.735 {"}'P' -12.272 1.865 -6.755 {"}'P' P -12.787 1.758 -6.525 {"}'P' -12.785 1.746 -6.536 {"}'P' P -12.527 1.772 -6.524 {"}'P' -12.528 1.758 -6.536 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 185 A}'P' blue -13.417 2.343 -7.84 {"}'P' sky -13.177 2.252 -7.844 {"}'P' blue -13.727 2.334 -7.587 { HH TYR 185 A}'P' sky -13.926 2.355 -7.178 {"}'P' sky -13.977 2.323 -6.921 {"}'P' sky -13.912 2.004 -6.486 {"}'P' sky -13.704 1.847 -6.493 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 185 A}'P' sea -13.474 2.298 -7.588 {"}'P' green -13.232 2.214 -7.592 {"}'P' sea -13.609 2.219 -7.35 {"}'P' green -13.363 2.157 -7.353 {"}'P' green -13.348 1.995 -7.14 { HH TYR 185 A}'P' sea -13.698 2.25 -7.183 {"}'P' green -13.504 2.092 -7.19 {"}'P' green -13.744 2.226 -6.925 {"}'P' green -13.544 2.073 -6.932 {"}'P' green -13.39 1.873 -6.94 {"}'P' sea -13.918 2.189 -6.685 {"}'P' green -13.694 2.062 -6.691 {"}'P' green -13.516 1.874 -6.699 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 276 A}'P' sky -12.95 2.492 -7.666 {"}'P' blue -13.728 2.659 -7.112 {"}'P' blue -13.814 2.639 -6.866 {"}'P' sky -13.813 2.516 -6.61 {"}'P' sky -13.409 1.982 -6.373 {"}'P' sky -13.591 2.161 -6.365 {"}'P' sky -13.078 1.882 -6.13 {"}'P' sky -12.826 1.951 -5.905 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 276 A}'P' green -12.339 2.298 -7.535 {"}'P' green -12.577 2.211 -7.539 {"}'P' green -12.831 2.211 -7.539 {"}'P' sea -13.069 2.298 -7.535 {"}'P' sea -13.263 2.46 -7.528 {"}'P' green -12.099 2.236 -7.353 {"}'P' green -13.297 2.225 -7.353 {"}'P' sea -13.469 2.42 -7.345 {"}'P' green -13.303 2.044 -7.139 {"}'P' green -13.493 2.213 -7.132 {"}'P' sea -13.637 2.422 -7.123 {"}'P' green -13.409 2.004 -6.893 {"}'P' green -13.591 2.183 -6.885 {"}'P' sea -13.728 2.399 -6.876 {"}'P' green -12.156 1.856 -6.639 {"}'P' green -13.137 1.803 -6.641 {"}'P' sea -13.361 1.922 -6.636 {"}'P' green -13.553 2.085 -6.629 {"}'P' sea -13.707 2.286 -6.62 {"}'P' green -12.442 1.768 -6.382 {"}'P' green -12.696 1.738 -6.384 {"}'P' green -12.95 1.765 -6.382 {"}'P' green -12.577 1.821 -6.132 {"}'P' sea -12.831 1.821 -6.132 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 276 A}'P' P -12.316 2.093 -7.359 {"}'P' -12.326 2.113 -7.339 {"}'P' P -12.566 2.017 -7.362 {"}'P' -12.575 2.075 -7.311 {"}'P' P -12.826 2.015 -7.362 {"}'P' -12.819 2.067 -7.316 {"}'P' P -13.076 2.086 -7.359 {"}'P' -13.074 2.092 -7.354 {"}'P' P -12.105 2.044 -7.139 {"}'P' -12.106 2.046 -7.138 {"}'P' P -12.33 1.926 -7.144 {"}'P' -12.357 1.994 -7.105 {"}'P' P -12.577 1.866 -7.147 {"}'P' -12.59 1.972 -7.089 {"}'P' P -12.831 1.866 -7.147 {"}'P' -12.819 1.963 -7.094 {"}'P' P -13.078 1.926 -7.144 {"}'P' -13.06 1.971 -7.119 {"}'P' P -12.202 1.877 -6.899 {"}'P' -12.22 1.914 -6.888 {"}'P' P -12.442 1.791 -6.903 {"}'P' -12.465 1.885 -6.876 {"}'P' P -12.696 1.761 -6.904 {"}'P' -12.697 1.871 -6.874 {"}'P' P -12.95 1.788 -6.903 {"}'P' -12.932 1.866 -6.881 {"}'P' P -13.192 1.87 -6.899 {"}'P' -13.186 1.881 -6.896 {"}'P' P -12.391 1.763 -6.643 {"}'P' -12.401 1.798 -6.642 {"}'P' P -12.641 1.722 -6.645 {"}'P' -12.644 1.78 -6.642 {"}'P' P -12.893 1.736 -6.644 {"}'P' -12.887 1.774 -6.643 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 185 A}'M' green -9.667 2.178 -6.253 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 185 A}'M' greentint -9.621 2.455 -7.008 {"}'M' greentint -9.528 2.693 -6.997 {"}'M' greentint -9.39 2.909 -6.988 {"}'M' greentint -9.215 3.095 -6.98 {"}'M' greentint -9.697 2.329 -6.759 {"}'M' greentint -9.627 2.576 -6.748 {"}'M' greentint -9.512 2.806 -6.738 {"}'M' greentint -9.357 3.011 -6.729 {"}'M' greentint -9.167 3.184 -6.722 {"}'M' greentint -9.699 2.309 -6.501 {"}'M' greentint -9.63 2.557 -6.49 {"}'M' greentint -9.517 2.788 -6.48 {"}'M' greentint -9.363 2.994 -6.471 {"}'M' greentint -9.174 3.168 -6.464 {"}'M' greentint -9.619 2.429 -6.242 {"}'M' greentint -9.524 2.667 -6.231 {"}'M' greentint -9.385 2.882 -6.222 {"}'M' greentint -9.209 3.067 -6.214 {"}'M' greentint -9.525 2.407 -6.002 {"}'M' greentint -9.427 2.64 -5.991 {"}'M' greentint -9.283 2.849 -5.982 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 276 A}'M' greentint -9.178 2.894 -6.968 {"}'M' greentint -9.288 2.66 -6.979 {"}'M' greentint -9.462 2.47 -6.987 {"}'M' greentint -9.142 3.149 -6.957 {"}'M' greentint -9.075 2.881 -6.727 {"}'M' greentint -9.171 2.648 -6.738 {"}'M' greentint -9.325 2.448 -6.746 {"}'M' greentint -9.525 2.295 -6.753 {"}'M' greentint -9.042 3.13 -6.717 {"}'M' greentint -9.037 2.878 -6.469 {"}'M' greentint -9.128 2.645 -6.479 {"}'M' greentint -9.274 2.441 -6.488 {"}'M' greentint -9.465 2.28 -6.495 {"}'M' greentint -9.691 2.171 -6.499 {"}'M' greentint -9.008 3.127 -6.458 {"}'M' greentint -9.075 2.858 -6.21 {"}'M' greentint -9.171 2.625 -6.22 {"}'M' greentint -9.325 2.425 -6.229 {"}'M' greentint -9.525 2.272 -6.236 {"}'M' greentint -9.042 3.108 -6.199 {"}'M' greentint -9.178 2.85 -5.969 {"}'M' greentint -9.288 2.617 -5.979 {"}'M' greentint -9.462 2.426 -5.988 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 185 A}'M' greentint -9.842 1.745 -5.118 {"}'M' greentint -10.135 1.402 -4.892 {"}'M' greentint -10.039 1.635 -4.882 {"}'M' greentint -9.885 1.835 -4.873 {"}'M' greentint -9.685 1.988 -4.866 {"}'M' greentint -9.452 2.084 -4.862 {"}'M' greentint -10.195 1.258 -4.639 {"}'M' greentint -10.135 1.501 -4.628 {"}'M' greentint -10.016 1.722 -4.619 {"}'M' greentint -9.846 1.906 -4.611 {"}'M' greentint -9.635 2.042 -4.605 {"}'M' greentint -9.397 2.121 -4.601 {"}'M' greentint -10.135 1.379 -4.375 {"}'M' greentint -10.039 1.612 -4.364 {"}'M' greentint -9.885 1.812 -4.356 {"}'M' greentint -9.685 1.965 -4.349 {"}'M' greentint -9.452 2.062 -4.345 {"}'M' greentint -10.06 1.24 -4.139 {"}'M' greentint -9.986 1.487 -4.128 {"}'M' greentint -9.842 1.702 -4.119 {"}'M' greentint -9.642 1.864 -4.112 {"}'M' greentint -9.403 1.961 -4.108 {"}'M' greentint -9.803 1.482 -3.921 {"}'M' greentint -9.628 1.674 -3.913 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 276 A}'M' green -9.798 1.773 -5.182 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 276 A}'M' greentint -9.507 1.98 -4.953 {"}'M' greentint -9.63 1.759 -4.963 {"}'M' greentint -9.796 1.567 -4.971 {"}'M' greentint -9.996 1.412 -4.978 {"}'M' greentint -9.406 1.971 -4.712 {"}'M' greentint -9.522 1.743 -4.722 {"}'M' greentint -9.679 1.541 -4.731 {"}'M' greentint -9.871 1.373 -4.738 {"}'M' greentint -10.092 1.243 -4.744 {"}'M' greentint -9.359 1.95 -4.459 {"}'M' greentint -9.474 1.719 -4.469 {"}'M' greentint -9.629 1.514 -4.478 {"}'M' greentint -9.819 1.341 -4.486 {"}'M' greentint -10.038 1.206 -4.491 {"}'M' greentint -9.356 1.946 -4.201 {"}'M' greentint -9.469 1.715 -4.211 {"}'M' greentint -9.623 1.509 -4.22 {"}'M' greentint -9.812 1.335 -4.227 {"}'M' greentint -10.03 1.198 -4.233 {"}'M' greentint -9.526 1.703 -3.957 {"}'M' greentint -9.684 1.502 -3.966 {"}'M' greentint -9.878 1.334 -3.973 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n asp A 65 1eu8A_67F_298G}P -10.106 -3.425 -0.542 {"}-10.106 -3.425 -0.542 { ca asp A 65 1eu8A_67F_298G}-11.103 -2.394 -0.245 { c asp A 65 1eu8A_67F_298G}-10.966 -1.203 -1.175 { o asp A 65 1eu8A_67F_298G}-11.956 -0.616 -1.604 { c asp A 65 1eu8A_67F_298G}P -10.966 -1.203 -1.175 { n val A 66 1eu8A_67F_298G}-9.723 -0.837 -1.455 { ca val A 66 1eu8A_67F_298G}-9.428 0.293 -2.321 { c val A 66 1eu8A_67F_298G}-8.287 -0.147 -3.231 { o val A 66 1eu8A_67F_298G}-7.479 -0.989 -2.846 { c val A 66 1eu8A_67F_298G}P -8.287 -0.147 -3.231 { n phe A 67 1eu8A_67F_298G}-8.211 0.421 -4.429 { ca phe A 67 1eu8A_67F_298G}-7.183 0.005 -5.378 { c phe A 67 1eu8A_67F_298G}-7.073 0.951 -6.57 { o phe A 67 1eu8A_67F_298G}-7.942 1.792 -6.791 { c phe A 67 1eu8A_67F_298G}P -7.073 0.951 -6.57 { n leu A 68 1eu8A_67F_298G}-5.999 0.808 -7.338 { ca leu A 68 1eu8A_67F_298G}-5.815 1.655 -8.507 { c leu A 68 1eu8A_67F_298G}-6.195 0.871 -9.756 { o leu A 68 1eu8A_67F_298G}-5.959 -0.336 -9.837 { c leu A 68 1eu8A_67F_298G}P -6.195 0.871 -9.756 { n met A 69 1eu8A_67F_298G}-6.793 1.571 -10.719 { ca met A 69 1eu8A_67F_298G}-7.215 0.977 -11.982 { c met A 69 1eu8A_67F_298G}-6.628 1.778 -13.138 { o met A 69 1eu8A_67F_298G}-6.579 3.015 -13.107 { n his A 296 1eu8A_67F_298G}P -6.241 5.449 -11.717 {"}-6.241 5.449 -11.717 { ca his A 296 1eu8A_67F_298G}-7.299 6.053 -10.936 { c his A 296 1eu8A_67F_298G}-7.617 5.204 -9.719 { o his A 296 1eu8A_67F_298G}-7.533 3.973 -9.759 { c his A 296 1eu8A_67F_298G}P -7.617 5.204 -9.719 { n ile A 297 1eu8A_67F_298G}-7.997 5.869 -8.637 { ca ile A 297 1eu8A_67F_298G}-8.298 5.173 -7.402 { c ile A 297 1eu8A_67F_298G}-9.807 5.001 -7.204 { o ile A 297 1eu8A_67F_298G}-10.598 5.92 -7.447 { c ile A 297 1eu8A_67F_298G}P -9.807 5.001 -7.204 { n gly A 298 1eu8A_67F_298G}-10.194 3.801 -6.781 { ca gly A 298 1eu8A_67F_298G}-11.596 3.494 -6.564 { c gly A 298 1eu8A_67F_298G}-11.828 2.605 -5.355 { o gly A 298 1eu8A_67F_298G}-10.893 2.011 -4.822 { c gly A 298 1eu8A_67F_298G}P -11.828 2.605 -5.355 { n ile A 299 1eu8A_67F_298G}-13.084 2.515 -4.934 { ca ile A 299 1eu8A_67F_298G}-13.458 1.714 -3.779 { c ile A 299 1eu8A_67F_298G}-14.332 0.529 -4.183 { o ile A 299 1eu8A_67F_298G}-15.279 0.666 -4.952 { c ile A 299 1eu8A_67F_298G}P -14.332 0.529 -4.183 { n ser A 300 1eu8A_67F_298G}-13.999 -0.64 -3.651 { ca ser A 300 1eu8A_67F_298G}-14.747 -1.858 -3.947 { c ser A 300 1eu8A_67F_298G}-16.17 -1.797 -3.409 { o ser A 300 1eu8A_67F_298G}-16.395 -1.385 -2.272 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n asp A 65 1eu8A_67F_298G}P -10.106 -3.425 -0.542 { ca asp A 65 1eu8A_67F_298G}P -11.103 -2.394 -0.245 { n val A 66 1eu8A_67F_298G}P -9.723 -0.837 -1.455 { ca val A 66 1eu8A_67F_298G}P -9.428 0.293 -2.321 { n phe A 67 1eu8A_67F_298G}P -8.211 0.421 -4.429 { ca phe A 67 1eu8A_67F_298G}P -7.183 0.005 -5.378 { n leu A 68 1eu8A_67F_298G}P -5.999 0.808 -7.338 { ca leu A 68 1eu8A_67F_298G}P -5.815 1.655 -8.507 { n met A 69 1eu8A_67F_298G}P -6.793 1.571 -10.719 { ca met A 69 1eu8A_67F_298G}P -7.215 0.977 -11.982 { n his A 296 1eu8A_67F_298G}P -6.241 5.449 -11.717 { ca his A 296 1eu8A_67F_298G}P -7.299 6.053 -10.936 { n ile A 297 1eu8A_67F_298G}P -7.997 5.869 -8.637 { ca ile A 297 1eu8A_67F_298G}P -8.298 5.173 -7.402 { n gly A 298 1eu8A_67F_298G}P -10.194 3.801 -6.781 { ca gly A 298 1eu8A_67F_298G}P -11.596 3.494 -6.564 {"}P -11.596 3.494 -6.564 { n ile A 299 1eu8A_67F_298G}P -13.084 2.515 -4.934 { ca ile A 299 1eu8A_67F_298G}P -13.458 1.714 -3.779 { n ser A 300 1eu8A_67F_298G}P -13.999 -0.64 -3.651 { ca ser A 300 1eu8A_67F_298G}P -14.747 -1.858 -3.947 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca asp A 65 1eu8A_67F_298G}P -11.103 -2.394 -0.245 {"}-11.103 -2.394 -0.245 { ca val A 66 1eu8A_67F_298G}-9.428 0.293 -2.321 { ca phe A 67 1eu8A_67F_298G}-7.183 0.005 -5.378 { ca leu A 68 1eu8A_67F_298G}-5.815 1.655 -8.507 { ca met A 69 1eu8A_67F_298G}-7.215 0.977 -11.982 { ca his A 296 1eu8A_67F_298G}P -7.299 6.053 -10.936 {"}-7.299 6.053 -10.936 { ca ile A 297 1eu8A_67F_298G}-8.298 5.173 -7.402 { ca gly A 298 1eu8A_67F_298G}-11.596 3.494 -6.564 { ca ile A 299 1eu8A_67F_298G}-13.458 1.714 -3.779 { ca ser A 300 1eu8A_67F_298G}-14.747 -1.858 -3.947 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca asp A 65 1eu8A_67F_298G}P -11.103 -2.394 -0.245 { ca val A 66 1eu8A_67F_298G}P -9.428 0.293 -2.321 { ca phe A 67 1eu8A_67F_298G}P -7.183 0.005 -5.378 { ca leu A 68 1eu8A_67F_298G}P -5.815 1.655 -8.507 { ca met A 69 1eu8A_67F_298G}P -7.215 0.977 -11.982 { ca his A 296 1eu8A_67F_298G}P -7.299 6.053 -10.936 { ca ile A 297 1eu8A_67F_298G}P -8.298 5.173 -7.402 { ca ile A 299 1eu8A_67F_298G}P -13.458 1.714 -3.779 { ca ser A 300 1eu8A_67F_298G}P -14.747 -1.858 -3.947 @subgroup {sidechain} off @vectorlist {sc} color= blue alpha= 0.2353 master= {sidechain} { ca phe A 67 1eu8A_67F_298G}P -7.183 0.005 -5.378 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 67 A}'M' green -9.312 2.054 -6.909 {"}'M' green -8.563 3.044 -6.866 {"}'M' green -9.314 2.034 -6.651 {"}'M' green -8.715 2.75 -6.125 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 67 A}'M' greentint -9.143 2.418 -7.147 {"}'M' greentint -9.005 2.634 -7.138 {"}'M' greentint -8.83 2.82 -7.13 {"}'M' greentint -9.242 2.301 -6.898 {"}'M' greentint -9.127 2.531 -6.888 {"}'M' greentint -8.972 2.736 -6.879 {"}'M' greentint -8.782 2.909 -6.872 {"}'M' greentint -9.245 2.282 -6.64 {"}'M' greentint -9.132 2.513 -6.63 {"}'M' greentint -8.978 2.719 -6.621 {"}'M' greentint -8.789 2.893 -6.614 {"}'M' greentint -8.571 3.029 -6.608 {"}'M' greentint -9.234 2.154 -6.392 {"}'M' greentint -9.139 2.392 -6.381 {"}'M' greentint -9 2.607 -6.372 {"}'M' greentint -8.824 2.792 -6.364 {"}'M' greentint -8.615 2.94 -6.357 {"}'M' greentint -9.042 2.365 -6.141 {"}'M' greentint -8.898 2.574 -6.132 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 298 A}'M' green -9.243 2.265 -7.121 {"}'M' green -9.317 2.125 -6.885 {"}'M' green -8.601 3.057 -6.845 {"}'M' green -8.567 3.054 -6.586 {"}'M' green -8.737 2.777 -6.097 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 298 A}'M' greentint -8.737 2.821 -7.096 {"}'M' greentint -8.847 2.587 -7.107 {"}'M' greentint -9.021 2.397 -7.115 {"}'M' greentint -8.634 2.808 -6.855 {"}'M' greentint -8.73 2.575 -6.866 {"}'M' greentint -8.884 2.375 -6.874 {"}'M' greentint -9.084 2.222 -6.881 {"}'M' greentint -8.596 2.805 -6.597 {"}'M' greentint -8.687 2.572 -6.607 {"}'M' greentint -8.833 2.368 -6.616 {"}'M' greentint -9.024 2.207 -6.623 {"}'M' greentint -9.25 2.098 -6.627 {"}'M' greentint -8.634 2.785 -6.338 {"}'M' greentint -8.73 2.552 -6.348 {"}'M' greentint -8.884 2.352 -6.357 {"}'M' greentint -9.084 2.199 -6.364 {"}'M' greentint -8.847 2.544 -6.107 {"}'M' greentint -9.021 2.353 -6.116 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 67 A}'M' green -9.681 1.285 -5.25 {"}'M' green -9.607 1.532 -5.239 {"}'M' green -9.463 1.746 -5.23 {"}'M' sea -9.756 0.904 -5.025 {"}'M' green -9.789 1.153 -5.015 {"}'M' green -9.506 1.836 -4.985 {"}'M' sea -9.306 1.989 -4.978 {"}'M' green -9.814 1.009 -4.762 {"}'M' green -9.467 1.907 -4.723 {"}'M' green -9.789 1.131 -4.497 {"}'M' green -9.506 1.813 -4.468 {"}'M' green -9.681 1.241 -4.251 {"}'M' green -9.607 1.488 -4.24 {"}'M' sea -9.463 1.703 -4.231 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 67 A}'M' greentint -9.756 1.403 -5.004 {"}'M' greentint -9.66 1.636 -4.994 {"}'M' greentint -9.816 1.259 -4.751 {"}'M' greentint -9.756 1.502 -4.74 {"}'M' greentint -9.637 1.723 -4.731 {"}'M' greentint -9.756 1.38 -4.487 {"}'M' greentint -9.66 1.613 -4.476 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 298 A}'M' green -9.569 1.781 -5.216 {"}'M' green -9.64 1.535 -5.226 {"}'M' green -9.756 1.307 -5.236 {"}'M' sea -9.913 1.105 -5.245 {"}'M' green -9.863 1.078 -4.992 {"}'M' green -9.499 2.017 -4.951 {"}'M' green -9.857 1.073 -4.734 {"}'M' green -9.499 2.014 -4.693 {"}'M' green -9.571 1.74 -4.45 {"}'M' green -9.918 1.066 -4.48 {"}'M' sea -9.546 1.994 -4.439 {"}'M' sea -9.664 1.74 -4.209 {"}'M' green -9.738 1.497 -4.22 {"}'M' sea -9.86 1.275 -4.229 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 298 A}'M' greentint -9.523 1.761 -4.962 {"}'M' greentint -9.593 1.514 -4.973 {"}'M' greentint -9.708 1.283 -4.983 {"}'M' greentint -9.521 1.758 -4.704 {"}'M' greentint -9.59 1.51 -4.715 {"}'M' greentint -9.703 1.279 -4.725 {"}'M' greentint -9.643 1.494 -4.461 {"}'M' greentint -9.76 1.267 -4.471 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 5 1ezmA_15Y_7G}P -6.222 5.914 -11.289 {"}-6.222 5.914 -11.289 { ca gly A 5 1ezmA_15Y_7G}-6.564 6.529 -10.035 { c gly A 5 1ezmA_15Y_7G}-7.342 5.526 -9.198 { o gly A 5 1ezmA_15Y_7G}-7.54 4.374 -9.639 { c gly A 5 1ezmA_15Y_7G}P -7.342 5.526 -9.198 { n pro A 6 1ezmA_15Y_7G}-7.686 5.883 -7.963 { ca pro A 6 1ezmA_15Y_7G}-8.272 4.941 -7.026 { c pro A 6 1ezmA_15Y_7G}-9.723 4.646 -7.348 { o pro A 6 1ezmA_15Y_7G}-10.432 5.346 -8.072 { c pro A 6 1ezmA_15Y_7G}P -9.723 4.646 -7.348 { n gly A 7 1ezmA_15Y_7G}-10.163 3.58 -6.689 { ca gly A 7 1ezmA_15Y_7G}-11.521 3.087 -6.79 { c gly A 7 1ezmA_15Y_7G}-11.747 2.268 -5.511 { o gly A 7 1ezmA_15Y_7G}-10.838 2.055 -4.683 { c gly A 7 1ezmA_15Y_7G}P -11.747 2.268 -5.511 { n gly A 8 1ezmA_15Y_7G}-12.99 1.834 -5.355 { ca gly A 8 1ezmA_15Y_7G}-13.353 1.032 -4.193 { c gly A 8 1ezmA_15Y_7G}-13.912 1.832 -3.041 { o gly A 8 1ezmA_15Y_7G}-14.251 3.03 -3.165 { c gly A 8 1ezmA_15Y_7G}P -13.912 1.832 -3.041 { n asn A 9 1ezmA_15Y_7G}-14.029 1.203 -1.888 { ca asn A 9 1ezmA_15Y_7G}-14.575 1.891 -0.732 { c asn A 9 1ezmA_15Y_7G}-14.117 1.208 0.556 { o asn A 9 1ezmA_15Y_7G}-13.345 0.234 0.524 { n gly A 13 1ezmA_15Y_7G}P -12.444 -2.411 0.012 {"}-12.444 -2.411 0.012 { ca gly A 13 1ezmA_15Y_7G}-11.048 -2.044 -0.056 { c gly A 13 1ezmA_15Y_7G}-10.778 -1.067 -1.191 { o gly A 13 1ezmA_15Y_7G}-11.626 -0.803 -2.032 { c gly A 13 1ezmA_15Y_7G}P -10.778 -1.067 -1.191 { n lys A 14 1ezmA_15Y_7G}-9.577 -0.517 -1.172 { ca lys A 14 1ezmA_15Y_7G}-9.124 0.436 -2.169 { c lys A 14 1ezmA_15Y_7G}-8.3 -0.286 -3.215 { o lys A 14 1ezmA_15Y_7G}-7.601 -1.26 -2.877 { c lys A 14 1ezmA_15Y_7G}P -8.3 -0.286 -3.215 { n tyr A 15 1ezmA_15Y_7G}-8.42 0.096 -4.474 { ca tyr A 15 1ezmA_15Y_7G}-7.635 -0.524 -5.541 { c tyr A 15 1ezmA_15Y_7G}-7.358 0.659 -6.478 { o tyr A 15 1ezmA_15Y_7G}-7.987 1.745 -6.353 { c tyr A 15 1ezmA_15Y_7G}P -7.358 0.659 -6.478 { n thr A 16 1ezmA_15Y_7G}-6.455 0.451 -7.434 { ca thr A 16 1ezmA_15Y_7G}-6.061 1.462 -8.385 { c thr A 16 1ezmA_15Y_7G}-6.137 1.043 -9.823 { o thr A 16 1ezmA_15Y_7G}-5.585 0.006 -10.22 { c thr A 16 1ezmA_15Y_7G}P -6.137 1.043 -9.823 { n tyr A 17 1ezmA_15Y_7G}-6.807 1.87 -10.625 { ca tyr A 17 1ezmA_15Y_7G}-6.951 1.612 -12.055 { c tyr A 17 1ezmA_15Y_7G}-5.572 1.985 -12.614 { o tyr A 17 1ezmA_15Y_7G}-4.968 2.986 -12.208 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 5 1ezmA_15Y_7G}P -6.222 5.914 -11.289 { ca gly A 5 1ezmA_15Y_7G}P -6.564 6.529 -10.035 {"}P -6.564 6.529 -10.035 { ca pro A 6 1ezmA_15Y_7G}P -8.272 4.941 -7.026 { n gly A 7 1ezmA_15Y_7G}P -10.163 3.58 -6.689 { ca gly A 7 1ezmA_15Y_7G}P -11.521 3.087 -6.79 {"}P -11.521 3.087 -6.79 { n gly A 8 1ezmA_15Y_7G}P -12.99 1.834 -5.355 { ca gly A 8 1ezmA_15Y_7G}P -13.353 1.032 -4.193 {"}P -13.353 1.032 -4.193 { n asn A 9 1ezmA_15Y_7G}P -14.029 1.203 -1.888 { ca asn A 9 1ezmA_15Y_7G}P -14.575 1.891 -0.732 { n gly A 13 1ezmA_15Y_7G}P -12.444 -2.411 0.012 { ca gly A 13 1ezmA_15Y_7G}P -11.048 -2.044 -0.056 {"}P -11.048 -2.044 -0.056 { n lys A 14 1ezmA_15Y_7G}P -9.577 -0.517 -1.172 { ca lys A 14 1ezmA_15Y_7G}P -9.124 0.436 -2.169 { n tyr A 15 1ezmA_15Y_7G}P -8.42 0.096 -4.474 { ca tyr A 15 1ezmA_15Y_7G}P -7.635 -0.524 -5.541 { n thr A 16 1ezmA_15Y_7G}P -6.455 0.451 -7.434 { ca thr A 16 1ezmA_15Y_7G}P -6.061 1.462 -8.385 { n tyr A 17 1ezmA_15Y_7G}P -6.807 1.87 -10.625 { ca tyr A 17 1ezmA_15Y_7G}P -6.951 1.612 -12.055 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 5 1ezmA_15Y_7G}P -6.564 6.529 -10.035 {"}-6.564 6.529 -10.035 { ca pro A 6 1ezmA_15Y_7G}-8.272 4.941 -7.026 { ca gly A 7 1ezmA_15Y_7G}-11.521 3.087 -6.79 { ca gly A 8 1ezmA_15Y_7G}-13.353 1.032 -4.193 { ca asn A 9 1ezmA_15Y_7G}-14.575 1.891 -0.732 { ca gly A 13 1ezmA_15Y_7G}P -11.048 -2.044 -0.056 {"}-11.048 -2.044 -0.056 { ca lys A 14 1ezmA_15Y_7G}-9.124 0.436 -2.169 { ca tyr A 15 1ezmA_15Y_7G}-7.635 -0.524 -5.541 { ca thr A 16 1ezmA_15Y_7G}-6.061 1.462 -8.385 { ca tyr A 17 1ezmA_15Y_7G}-6.951 1.612 -12.055 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca pro A 6 1ezmA_15Y_7G}P -8.272 4.941 -7.026 { n pro A 6 1ezmA_15Y_7G}P -7.686 5.883 -7.963 { ca asn A 9 1ezmA_15Y_7G}P -14.575 1.891 -0.732 { ca lys A 14 1ezmA_15Y_7G}P -9.124 0.436 -2.169 { ca tyr A 15 1ezmA_15Y_7G}P -7.635 -0.524 -5.541 { ca thr A 16 1ezmA_15Y_7G}P -6.061 1.462 -8.385 { ca tyr A 17 1ezmA_15Y_7G}P -6.951 1.612 -12.055 @subgroup {sidechain} off @vectorlist {sc} color= blue alpha= 0.2353 master= {sidechain} { ca tyr A 15 1ezmA_15Y_7G}P -7.635 -0.524 -5.541 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 15 A}'P' sky -11.496 1.299 -8.581 {"}'P' sky -10.866 1.264 -7.811 {"}'P' sky -10.919 1.231 -7.554 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 15 A}'P' sea -11.956 1.302 -8.33 {"}'P' green -11.7 1.353 -8.328 {"}'P' green -11.439 1.365 -8.328 {"}'P' sea -11.179 1.336 -8.329 {"}'P' sea -12.134 1.273 -8.073 {"}'P' green -11.884 1.349 -8.069 {"}'P' green -11.366 1.388 -8.068 {"}'P' green -11.108 1.349 -8.069 {"}'P' green -12.141 1.258 -7.812 {"}'P' green -11.116 1.34 -7.808 {"}'P' sea -12.194 1.182 -7.556 {"}'P' green -11.948 1.271 -7.552 {"}'P' green -11.171 1.3 -7.551 {"}'P' sea -12.007 1.161 -7.307 {"}'P' green -11.759 1.222 -7.304 {"}'P' green -11.504 1.244 -7.303 {"}'P' sea -11.249 1.225 -7.304 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 15 A}'P' P -11.626 1.388 -8.068 {"}'P' -11.625 1.375 -8.067 {"}'P' P -11.892 1.336 -7.808 {"}'P' -11.891 1.332 -7.809 {"}'P' P -11.635 1.376 -7.806 {"}'P' -11.632 1.34 -7.811 {"}'P' P -11.374 1.377 -7.806 {"}'P' -11.375 1.358 -7.809 {"}'P' P -11.692 1.32 -7.55 {"}'P' -11.691 1.313 -7.552 {"}'P' P -11.431 1.33 -7.55 {"}'P' -11.431 1.328 -7.55 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 7 A}'P' sky -11.515 1.594 -8.456 {"}'P' sky -11.775 1.592 -8.456 {"}'P' sky -11.054 1.621 -8.233 {"}'P' sky -10.935 1.591 -7.987 {"}'P' sky -10.896 1.575 -7.727 {"}'P' sky -12.31 1.499 -7.73 {"}'P' sky -12.027 1.459 -7.224 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 7 A}'P' green -11.279 1.503 -8.238 {"}'P' green -11.526 1.443 -8.241 {"}'P' green -11.78 1.443 -8.241 {"}'P' sea -12.027 1.503 -8.238 {"}'P' green -11.151 1.454 -7.993 {"}'P' green -11.899 1.365 -7.997 {"}'P' sea -12.141 1.447 -7.993 {"}'P' green -11.105 1.433 -7.733 {"}'P' green -12.086 1.38 -7.735 {"}'P' green -11.151 1.431 -7.473 {"}'P' green -11.391 1.345 -7.476 {"}'P' green -11.645 1.315 -7.478 {"}'P' green -11.899 1.342 -7.476 {"}'P' sea -12.141 1.424 -7.473 {"}'P' sea -11.78 1.398 -7.226 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 7 A}'P' P -11.391 1.368 -7.997 {"}'P' -11.394 1.379 -7.994 {"}'P' P -11.645 1.338 -7.998 {"}'P' -11.645 1.362 -7.991 {"}'P' P -11.34 1.34 -7.737 {"}'P' -11.343 1.352 -7.737 {"}'P' P -11.59 1.299 -7.739 {"}'P' -11.592 1.334 -7.737 {"}'P' P -11.842 1.313 -7.738 {"}'P' -11.84 1.324 -7.738 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 15 A}'M' green -8.608 2.997 -6.428 {"}'M' green -9.359 1.987 -6.213 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 15 A}'M' greentint -9.05 2.587 -6.7 {"}'M' greentint -9.287 2.254 -6.46 {"}'M' greentint -9.172 2.484 -6.45 {"}'M' greentint -9.017 2.689 -6.441 {"}'M' greentint -8.827 2.862 -6.434 {"}'M' greentint -9.29 2.235 -6.202 {"}'M' greentint -9.177 2.466 -6.192 {"}'M' greentint -9.023 2.672 -6.183 {"}'M' greentint -8.834 2.846 -6.176 {"}'M' greentint -8.616 2.982 -6.17 {"}'M' greentint -9.279 2.107 -5.954 {"}'M' greentint -9.184 2.345 -5.943 {"}'M' greentint -9.045 2.56 -5.934 {"}'M' greentint -8.869 2.745 -5.926 {"}'M' greentint -8.66 2.893 -5.919 {"}'M' greentint -9.087 2.318 -5.703 {"}'M' greentint -8.943 2.527 -5.694 {"}'M' greentint -8.76 2.703 -5.687 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 7 A}'M' green -9.336 2.12 -6.373 {"}'M' green -8.62 3.052 -6.333 {"}'M' green -8.866 2.539 -5.595 {"}'M' green -9.04 2.348 -5.604 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 7 A}'M' greentint -8.756 2.816 -6.584 {"}'M' greentint -8.866 2.582 -6.595 {"}'M' greentint -9.04 2.392 -6.603 {"}'M' greentint -9.262 2.26 -6.609 {"}'M' greentint -8.653 2.803 -6.343 {"}'M' greentint -8.749 2.57 -6.354 {"}'M' greentint -8.903 2.37 -6.362 {"}'M' greentint -9.103 2.217 -6.369 {"}'M' greentint -8.615 2.8 -6.085 {"}'M' greentint -8.706 2.567 -6.095 {"}'M' greentint -8.852 2.363 -6.104 {"}'M' greentint -9.043 2.202 -6.111 {"}'M' greentint -9.269 2.093 -6.115 {"}'M' greentint -8.653 2.78 -5.826 {"}'M' greentint -8.749 2.547 -5.836 {"}'M' greentint -8.903 2.347 -5.845 {"}'M' greentint -9.103 2.194 -5.852 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 15 A}'M' green -9.823 1.207 -5.266 {"}'M' green -9.679 1.421 -5.257 {"}'M' green -9.479 1.584 -5.25 {"}'M' green -10.005 0.828 -5.042 {"}'M' green -9.522 1.664 -5.005 {"}'M' green -9.472 1.718 -4.744 {"}'M' green -10.005 0.806 -4.524 {"}'M' green -9.897 0.916 -4.278 {"}'M' green -9.823 1.163 -4.267 {"}'M' green -9.679 1.378 -4.258 {"}'M' green -9.479 1.54 -4.251 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 15 A}'M' greentint -9.972 1.078 -5.031 {"}'M' greentint -9.876 1.311 -5.021 {"}'M' greentint -9.722 1.511 -5.012 {"}'M' greentint -10.032 0.934 -4.778 {"}'M' greentint -9.972 1.177 -4.767 {"}'M' greentint -9.853 1.398 -4.758 {"}'M' greentint -9.683 1.582 -4.75 {"}'M' greentint -9.972 1.055 -4.514 {"}'M' greentint -9.876 1.288 -4.503 {"}'M' greentint -9.722 1.488 -4.495 {"}'M' greentint -9.522 1.641 -4.488 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 7 A}'M' green -9.686 1.588 -5.328 {"}'M' green -9.809 1.367 -5.338 {"}'M' green -9.975 1.175 -5.346 {"}'M' sea -9.514 1.825 -5.077 {"}'M' green -10.05 0.981 -5.113 {"}'M' green -9.468 1.805 -4.823 {"}'M' green -9.466 1.802 -4.565 {"}'M' sea -9.516 1.784 -4.311 {"}'M' green -9.588 1.538 -4.322 {"}'M' green -10.057 0.942 -4.348 {"}'M' green -9.805 1.319 -4.09 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 7 A}'M' greentint -9.585 1.579 -5.087 {"}'M' greentint -9.701 1.351 -5.097 {"}'M' greentint -9.858 1.149 -5.106 {"}'M' greentint -9.538 1.558 -4.834 {"}'M' greentint -9.653 1.327 -4.844 {"}'M' greentint -9.808 1.122 -4.853 {"}'M' greentint -9.998 0.949 -4.861 {"}'M' greentint -9.535 1.554 -4.576 {"}'M' greentint -9.648 1.323 -4.586 {"}'M' greentint -9.802 1.117 -4.595 {"}'M' greentint -9.991 0.943 -4.602 {"}'M' greentint -9.705 1.311 -4.332 {"}'M' greentint -9.863 1.11 -4.341 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 79 A}'P' blue -11.323 0.718 -8.179 {"}'P' blue -11.062 0.73 -8.179 {"}'P' blue -10.802 0.701 -8.18 {"}'P' blue -11.507 0.714 -7.92 {"}'P' sky -11.249 0.753 -7.919 {"}'P' sky -10.989 0.753 -7.919 {"}'P' blue -10.731 0.714 -7.92 {"}'P' blue -11.258 0.741 -7.657 {"}'P' blue -10.997 0.742 -7.657 {"}'P' blue -10.739 0.705 -7.659 {"}'P' blue -11.054 0.695 -7.401 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 8 A}'P' blue -10.796 1.151 -8.161 {"}'P' blue -11.05 1.121 -8.162 {"}'P' blue -11.304 1.148 -8.161 {"}'P' blue -10.745 1.123 -7.901 {"}'P' sky -10.995 1.082 -7.903 {"}'P' sky -11.247 1.096 -7.902 {"}'P' blue -11.491 1.163 -7.899 {"}'P' blue -10.796 1.128 -7.64 {"}'P' blue -11.05 1.098 -7.642 {"}'P' blue -11.304 1.125 -7.64 @subgroup {1->2} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { O PHE 79 A}'M' P -8.882 2.713 -6.555 {"}'M' -8.877 2.708 -6.555 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 79 A}'M' greentint -8.79 2.412 -7.283 {"}'M' greentint -8.625 2.612 -7.275 {"}'M' greentint -8.418 2.768 -7.268 {"}'M' greentint -9.048 2.171 -7.074 {"}'M' greentint -8.948 2.404 -7.064 {"}'M' greentint -8.803 2.612 -7.055 {"}'M' greentint -8.619 2.786 -7.047 {"}'M' greentint -8.404 2.92 -7.041 {"}'M' greentint -8.166 3.008 -7.038 {"}'M' greentint -9.146 2.157 -6.834 {"}'M' greentint -9.053 2.395 -6.823 {"}'M' greentint -8.915 2.611 -6.814 {"}'M' greentint -8.74 2.797 -6.806 {"}'M' greentint -8.532 2.947 -6.799 {"}'M' greentint -8.3 3.054 -6.794 {"}'M' greentint -9.152 2.278 -6.574 {"}'M' greentint -9.037 2.508 -6.564 {"}'M' greentint -8.692 2.886 -6.548 {"}'M' greentint -8.473 3.021 -6.542 {"}'M' greentint -8.233 3.114 -6.538 {"}'M' greentint -9.155 2.259 -6.316 {"}'M' greentint -9.042 2.49 -6.306 {"}'M' greentint -8.888 2.696 -6.297 {"}'M' greentint -8.699 2.87 -6.29 {"}'M' greentint -8.481 3.006 -6.284 {"}'M' greentint -8.241 3.101 -6.28 {"}'M' greentint -9.049 2.369 -6.057 {"}'M' greentint -8.91 2.584 -6.048 {"}'M' greentint -8.734 2.769 -6.04 {"}'M' greentint -8.525 2.917 -6.033 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H AGLY 8 A}'M' P -8.348 2.353 -6.674 {"}'M' -8.35 2.355 -6.674 {"}'M' P -8.399 2.337 -6.415 {"}'M' -8.402 2.341 -6.416 @dotlist {x} color= sky width= 1 master= {H-bonds} { H AGLY 8 A}'M' greentint -8.252 2.806 -7.154 {"}'M' greentint -8.362 2.572 -7.165 {"}'M' greentint -8.536 2.382 -7.173 {"}'M' greentint -8.758 2.25 -7.179 {"}'M' greentint -8.149 2.793 -6.913 {"}'M' greentint -8.245 2.56 -6.924 {"}'M' greentint -8.399 2.36 -6.932 {"}'M' greentint -8.599 2.207 -6.939 {"}'M' greentint -8.832 2.11 -6.943 {"}'M' greentint -9.082 2.077 -6.945 {"}'M' greentint -8.116 3.042 -6.903 {"}'M' greentint -8.111 2.79 -6.655 {"}'M' greentint -8.202 2.557 -6.665 {"}'M' greentint -8.539 2.192 -6.681 {"}'M' greentint -8.765 2.083 -6.685 {"}'M' greentint -9.011 2.034 -6.688 {"}'M' greentint -8.082 3.039 -6.644 {"}'M' greentint -8.149 2.77 -6.396 {"}'M' greentint -8.245 2.537 -6.406 {"}'M' greentint -8.599 2.184 -6.422 {"}'M' greentint -8.832 2.088 -6.426 {"}'M' greentint -9.082 2.055 -6.428 {"}'M' greentint -8.116 3.02 -6.385 {"}'M' greentint -8.252 2.762 -6.155 {"}'M' greentint -8.362 2.529 -6.165 {"}'M' greentint -8.536 2.338 -6.174 {"}'M' greentint -8.758 2.207 -6.18 {"}'M' greentint -9.009 2.147 -6.182 {"}'M' greentint -8.216 3.017 -6.144 {"}'M' greentint -8.423 2.745 -5.949 {"}'M' greentint -8.559 2.524 -5.958 {"}'M' greentint -8.767 2.368 -5.965 {"}'M' greentint -9.017 2.297 -5.968 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 79 A}'M' green -9.828 1.297 -5.357 {"}'M' green -9.484 1.674 -5.341 {"}'M' green -9.294 1.828 -4.575 {"}'M' green -9.484 1.63 -4.342 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 79 A}'M' greentint -9.684 1.511 -5.348 {"}'M' greentint -9.977 1.168 -5.122 {"}'M' greentint -9.881 1.401 -5.112 {"}'M' greentint -9.727 1.601 -5.103 {"}'M' greentint -9.527 1.754 -5.096 {"}'M' greentint -10.037 1.024 -4.869 {"}'M' greentint -9.977 1.267 -4.858 {"}'M' greentint -9.858 1.488 -4.849 {"}'M' greentint -9.688 1.672 -4.841 {"}'M' greentint -9.477 1.808 -4.835 {"}'M' greentint -9.977 1.145 -4.605 {"}'M' greentint -9.881 1.378 -4.594 {"}'M' greentint -9.727 1.578 -4.586 {"}'M' greentint -9.527 1.731 -4.579 {"}'M' greentint -9.828 1.253 -4.358 {"}'M' greentint -9.684 1.468 -4.349 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 8 A}'M' green -9.703 1.53 -5.435 {"}'M' green -9.869 1.338 -5.443 {"}'M' green -9.362 1.968 -4.92 {"}'M' green -10.111 0.977 -4.963 {"}'M' green -9.36 1.965 -4.662 {"}'M' green -10.103 0.969 -4.705 {"}'M' green -9.482 1.701 -4.419 {"}'M' green -9.951 1.105 -4.445 {"}'M' green -9.699 1.482 -4.187 {"}'M' green -9.863 1.289 -4.196 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 8 A}'M' greentint -9.479 1.742 -5.184 {"}'M' greentint -9.595 1.514 -5.194 {"}'M' greentint -9.752 1.312 -5.203 {"}'M' greentint -9.944 1.144 -5.21 {"}'M' greentint -9.432 1.721 -4.931 {"}'M' greentint -9.547 1.49 -4.941 {"}'M' greentint -9.702 1.285 -4.95 {"}'M' greentint -9.892 1.112 -4.958 {"}'M' greentint -9.429 1.717 -4.673 {"}'M' greentint -9.542 1.486 -4.683 {"}'M' greentint -9.696 1.28 -4.692 {"}'M' greentint -9.885 1.106 -4.699 {"}'M' greentint -9.599 1.474 -4.429 {"}'M' greentint -9.757 1.273 -4.438 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n val A 92 1gzcA_94F_211G}P -12.066 -2.78 -0.098 {"}-12.066 -2.78 -0.098 { ca val A 92 1gzcA_94F_211G}-10.73 -2.605 -0.658 { c val A 92 1gzcA_94F_211G}-10.617 -1.266 -1.356 { o val A 92 1gzcA_94F_211G}-11.61 -0.739 -1.898 { c val A 92 1gzcA_94F_211G}P -10.617 -1.266 -1.356 { n phe A 93 1gzcA_94F_211G}-9.422 -0.678 -1.284 { ca phe A 93 1gzcA_94F_211G}-9.117 0.545 -2.02 { c phe A 93 1gzcA_94F_211G}-8.371 0.052 -3.259 { o phe A 93 1gzcA_94F_211G}-7.496 -0.834 -3.151 { c phe A 93 1gzcA_94F_211G}P -8.371 0.052 -3.259 { n phe A 94 1gzcA_94F_211G}-8.667 0.586 -4.446 { ca phe A 94 1gzcA_94F_211G}-7.968 0.067 -5.624 { c phe A 94 1gzcA_94F_211G}-7.68 1.132 -6.666 { o phe A 94 1gzcA_94F_211G}-8.391 2.116 -6.737 { c phe A 94 1gzcA_94F_211G}P -7.68 1.132 -6.666 { n met A 95 1gzcA_94F_211G}-6.642 0.903 -7.478 { ca met A 95 1gzcA_94F_211G}-6.242 1.834 -8.543 { c met A 95 1gzcA_94F_211G}-5.988 0.934 -9.774 { o met A 95 1gzcA_94F_211G}-5.311 -0.095 -9.666 { c met A 95 1gzcA_94F_211G}P -5.988 0.934 -9.774 { n gly A 96 1gzcA_94F_211G}-6.529 1.299 -10.935 { ca gly A 96 1gzcA_94F_211G}-6.321 0.427 -12.101 { c gly A 96 1gzcA_94F_211G}-6.803 1.127 -13.358 { o gly A 96 1gzcA_94F_211G}-7.062 2.321 -13.323 { n asp A 209 1gzcA_94F_211G}P -8.04 5.027 -12.62 {"}-8.04 5.027 -12.62 { ca asp A 209 1gzcA_94F_211G}-9.185 5.518 -11.855 { c asp A 209 1gzcA_94F_211G}-8.84 4.987 -10.443 { o asp A 209 1gzcA_94F_211G}-8.163 3.928 -10.297 { c asp A 209 1gzcA_94F_211G}P -8.84 4.987 -10.443 { n val A 210 1gzcA_94F_211G}-9.309 5.709 -9.426 { ca val A 210 1gzcA_94F_211G}-9.156 5.278 -8.032 { c val A 210 1gzcA_94F_211G}-10.539 5.063 -7.439 { o val A 210 1gzcA_94F_211G}-11.483 5.792 -7.724 { c val A 210 1gzcA_94F_211G}P -10.539 5.063 -7.439 { n gly A 211 1gzcA_94F_211G}-10.664 4.025 -6.625 { ca gly A 211 1gzcA_94F_211G}-11.962 3.762 -6.049 { c gly A 211 1gzcA_94F_211G}-11.937 2.877 -4.806 { o gly A 211 1gzcA_94F_211G}-10.861 2.501 -4.289 { c gly A 211 1gzcA_94F_211G}P -11.937 2.877 -4.806 { n leu A 212 1gzcA_94F_211G}-13.144 2.648 -4.28 { ca leu A 212 1gzcA_94F_211G}-13.342 1.771 -3.123 { c leu A 212 1gzcA_94F_211G}-14.358 0.74 -3.547 { o leu A 212 1gzcA_94F_211G}-15.267 1.072 -4.291 { c leu A 212 1gzcA_94F_211G}P -14.358 0.74 -3.547 { n ser A 213 1gzcA_94F_211G}-14.256 -0.499 -3.047 { ca ser A 213 1gzcA_94F_211G}-15.224 -1.544 -3.452 { c ser A 213 1gzcA_94F_211G}-15.479 -2.443 -2.236 { o ser A 213 1gzcA_94F_211G}-14.619 -2.574 -1.35 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 92 1gzcA_94F_211G}P -12.066 -2.78 -0.098 { ca val A 92 1gzcA_94F_211G}P -10.73 -2.605 -0.658 { n phe A 93 1gzcA_94F_211G}P -9.422 -0.678 -1.284 { ca phe A 93 1gzcA_94F_211G}P -9.117 0.545 -2.02 { n phe A 94 1gzcA_94F_211G}P -8.667 0.586 -4.446 { ca phe A 94 1gzcA_94F_211G}P -7.968 0.067 -5.624 { n met A 95 1gzcA_94F_211G}P -6.642 0.903 -7.478 { ca met A 95 1gzcA_94F_211G}P -6.242 1.834 -8.543 { n gly A 96 1gzcA_94F_211G}P -6.529 1.299 -10.935 { ca gly A 96 1gzcA_94F_211G}P -6.321 0.427 -12.101 {"}P -6.321 0.427 -12.101 { n asp A 209 1gzcA_94F_211G}P -8.04 5.027 -12.62 { ca asp A 209 1gzcA_94F_211G}P -9.185 5.518 -11.855 { n val A 210 1gzcA_94F_211G}P -9.309 5.709 -9.426 { ca val A 210 1gzcA_94F_211G}P -9.156 5.278 -8.032 { n gly A 211 1gzcA_94F_211G}P -10.664 4.025 -6.625 { ca gly A 211 1gzcA_94F_211G}P -11.962 3.762 -6.049 {"}P -11.962 3.762 -6.049 { n leu A 212 1gzcA_94F_211G}P -13.144 2.648 -4.28 { ca leu A 212 1gzcA_94F_211G}P -13.342 1.771 -3.123 { n ser A 213 1gzcA_94F_211G}P -14.256 -0.499 -3.047 { ca ser A 213 1gzcA_94F_211G}P -15.224 -1.544 -3.452 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca val A 92 1gzcA_94F_211G}P -10.73 -2.605 -0.658 {"}-10.73 -2.605 -0.658 { ca phe A 93 1gzcA_94F_211G}-9.117 0.545 -2.02 { ca phe A 94 1gzcA_94F_211G}-7.968 0.067 -5.624 { ca met A 95 1gzcA_94F_211G}-6.242 1.834 -8.543 { ca gly A 96 1gzcA_94F_211G}-6.321 0.427 -12.101 { ca asp A 209 1gzcA_94F_211G}P -9.185 5.518 -11.855 {"}-9.185 5.518 -11.855 { ca val A 210 1gzcA_94F_211G}-9.156 5.278 -8.032 { ca gly A 211 1gzcA_94F_211G}-11.962 3.762 -6.049 { ca leu A 212 1gzcA_94F_211G}-13.342 1.771 -3.123 { ca ser A 213 1gzcA_94F_211G}-15.224 -1.544 -3.452 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca val A 92 1gzcA_94F_211G}P -10.73 -2.605 -0.658 { ca phe A 93 1gzcA_94F_211G}P -9.117 0.545 -2.02 { ca phe A 94 1gzcA_94F_211G}P -7.968 0.067 -5.624 { cb phe A 94 1gzcA_94F_211G}-8.758 -1.095 -6.28 { cg phe A 94 1gzcA_94F_211G}-10.115 -0.683 -6.912 { cd1 phe A 94 1gzcA_94F_211G}-11.219 -0.406 -6.11 { ce1 phe A 94 1gzcA_94F_211G}-12.436 0.034 -6.673 { cz phe A 94 1gzcA_94F_211G}-12.545 0.184 -8.044 { cg phe A 94 1gzcA_94F_211G}P -10.115 -0.683 -6.912 { cd2 phe A 94 1gzcA_94F_211G}-10.249 -0.533 -8.292 { ce2 phe A 94 1gzcA_94F_211G}-11.474 -0.095 -8.856 { cz phe A 94 1gzcA_94F_211G}ghost -12.545 0.184 -8.044 { ca met A 95 1gzcA_94F_211G}P -6.242 1.834 -8.543 {"}P -6.242 1.834 -8.543 { ca asp A 209 1gzcA_94F_211G}P -9.185 5.518 -11.855 { ca val A 210 1gzcA_94F_211G}P -9.156 5.278 -8.032 { ca leu A 212 1gzcA_94F_211G}P -13.342 1.771 -3.123 { ca ser A 213 1gzcA_94F_211G}P -15.224 -1.544 -3.452 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 94 1gzcA_94F_211G}P -8.758 -1.095 -6.28 {"}P -8.758 -1.095 -6.28 { cd1 phe A 94 1gzcA_94F_211G}P -11.219 -0.406 -6.11 { cd2 phe A 94 1gzcA_94F_211G}P -10.249 -0.533 -8.292 { ce1 phe A 94 1gzcA_94F_211G}P -12.436 0.034 -6.673 { ce2 phe A 94 1gzcA_94F_211G}P -11.474 -0.095 -8.856 { cz phe A 94 1gzcA_94F_211G}P -12.545 0.184 -8.044 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 94 1gzcA_94F_211G}P -7.968 0.067 -5.624 { cb phe A 94 1gzcA_94F_211G}-8.758 -1.095 -6.28 { cg phe A 94 1gzcA_94F_211G}-10.115 -0.683 -6.912 { cd1 phe A 94 1gzcA_94F_211G}-11.219 -0.406 -6.11 { ce1 phe A 94 1gzcA_94F_211G}-12.436 0.034 -6.673 { cz phe A 94 1gzcA_94F_211G}-12.545 0.184 -8.044 { cg phe A 94 1gzcA_94F_211G}P -10.115 -0.683 -6.912 { cd2 phe A 94 1gzcA_94F_211G}-10.249 -0.533 -8.292 { ce2 phe A 94 1gzcA_94F_211G}-11.474 -0.095 -8.856 { cz phe A 94 1gzcA_94F_211G}ghost -12.545 0.184 -8.044 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 94 1gzcA_94F_211G}P -8.758 -1.095 -6.28 {"}P -8.758 -1.095 -6.28 { cd1 phe A 94 1gzcA_94F_211G}P -11.219 -0.406 -6.11 { cd2 phe A 94 1gzcA_94F_211G}P -10.249 -0.533 -8.292 { ce1 phe A 94 1gzcA_94F_211G}P -12.436 0.034 -6.673 { ce2 phe A 94 1gzcA_94F_211G}P -11.474 -0.095 -8.856 { cz phe A 94 1gzcA_94F_211G}P -12.545 0.184 -8.044 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 94 A}'P' blue -12.64 1.743 -6.988 {"}'P' blue -12.379 1.755 -6.988 {"}'P' blue -12.824 1.739 -6.729 {"}'P' sky -12.566 1.778 -6.728 {"}'P' blue -12.306 1.778 -6.728 {"}'P' blue -12.832 1.726 -6.468 { CZ PHE 94 A}'P' blue -12.741 1.86 -7.581 {"}'P' blue -12.48 1.87 -7.581 {"}'P' blue -12.808 1.762 -7.335 {"}'P' blue -12.553 1.784 -7.334 {"}'P' blue -12.298 1.765 -7.335 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 211 A}'P' blue -12.47 2.261 -7.364 {"}'P' blue -12.724 2.261 -7.364 {"}'P' blue -12.335 2.186 -7.12 {"}'P' blue -12.589 2.156 -7.121 {"}'P' blue -12.843 2.183 -7.12 {"}'P' blue -12.284 2.158 -6.86 {"}'P' sky -12.534 2.117 -6.862 {"}'P' blue -12.786 2.131 -6.861 {"}'P' blue -12.589 2.133 -6.601 {"}'P' blue -12.843 2.16 -6.599 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 94 A}'M' green -9.592 2.742 -7.093 {"}'M' green -9.012 3.368 -6.812 {"}'M' green -9.589 2.456 -6.098 {"}'M' green -8.95 3.209 -6.065 {"}'M' green -9.324 2.693 -5.867 {"}'M' green -9.158 2.891 -5.859 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 94 A}'M' greentint -9.454 2.958 -7.084 {"}'M' greentint -9.279 3.144 -7.076 {"}'M' greentint -9.691 2.625 -6.844 {"}'M' greentint -9.576 2.855 -6.834 {"}'M' greentint -9.421 3.06 -6.825 {"}'M' greentint -9.231 3.233 -6.818 {"}'M' greentint -9.694 2.606 -6.586 {"}'M' greentint -9.581 2.837 -6.576 {"}'M' greentint -9.427 3.043 -6.567 {"}'M' greentint -9.238 3.217 -6.56 {"}'M' greentint -9.02 3.353 -6.554 {"}'M' greentint -9.683 2.478 -6.338 {"}'M' greentint -9.588 2.716 -6.327 {"}'M' greentint -9.449 2.931 -6.318 {"}'M' greentint -9.273 3.116 -6.31 {"}'M' greentint -9.064 3.264 -6.303 {"}'M' greentint -9.491 2.689 -6.087 {"}'M' greentint -9.347 2.898 -6.078 {"}'M' greentint -9.164 3.074 -6.071 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 211 A}'M' green -9.274 3.17 -7.084 {"}'M' green -8.967 3.405 -6.625 {"}'M' green -9.213 2.892 -5.887 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 211 A}'M' greentint -9.41 2.949 -7.093 {"}'M' greentint -9.103 3.169 -6.876 {"}'M' greentint -9.213 2.935 -6.887 {"}'M' greentint -9.387 2.745 -6.895 {"}'M' greentint -9.609 2.613 -6.901 {"}'M' greentint -9 3.156 -6.635 {"}'M' greentint -9.096 2.923 -6.646 {"}'M' greentint -9.25 2.723 -6.654 {"}'M' greentint -9.45 2.57 -6.661 {"}'M' greentint -9.683 2.473 -6.665 {"}'M' greentint -8.962 3.153 -6.377 {"}'M' greentint -9.053 2.92 -6.387 {"}'M' greentint -9.199 2.716 -6.396 {"}'M' greentint -9.39 2.555 -6.403 {"}'M' greentint -9.616 2.446 -6.407 {"}'M' greentint -9 3.133 -6.118 {"}'M' greentint -9.096 2.9 -6.128 {"}'M' greentint -9.25 2.7 -6.137 {"}'M' greentint -9.45 2.547 -6.144 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 94 A}'M' greentint -10.112 1.707 -5.095 {"}'M' greentint -9.968 1.921 -5.086 {"}'M' greentint -10.261 1.578 -4.86 {"}'M' greentint -10.165 1.811 -4.85 {"}'M' greentint -10.011 2.011 -4.841 {"}'M' greentint -9.811 2.164 -4.834 {"}'M' greentint -10.321 1.434 -4.607 {"}'M' greentint -10.261 1.677 -4.596 {"}'M' greentint -10.142 1.898 -4.587 {"}'M' greentint -9.972 2.082 -4.579 {"}'M' greentint -9.761 2.218 -4.573 {"}'M' greentint -9.523 2.297 -4.569 {"}'M' greentint -10.294 1.306 -4.353 {"}'M' greentint -10.261 1.555 -4.343 {"}'M' greentint -10.165 1.788 -4.332 {"}'M' greentint -10.011 1.988 -4.324 {"}'M' greentint -9.811 2.141 -4.317 {"}'M' greentint -9.578 2.238 -4.313 {"}'M' greentint -10.186 1.416 -4.107 {"}'M' greentint -10.112 1.663 -4.096 {"}'M' greentint -9.968 1.878 -4.087 {"}'M' greentint -9.768 2.04 -4.08 {"}'M' greentint -9.529 2.137 -4.076 {"}'M' greentint -9.929 1.658 -3.889 {"}'M' greentint -9.754 1.85 -3.881 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 211 A}'M' green -10.08 1.388 -3.954 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 211 A}'M' greentint -9.709 2.034 -4.934 {"}'M' greentint -9.832 1.813 -4.944 {"}'M' greentint -9.998 1.621 -4.952 {"}'M' greentint -10.198 1.466 -4.959 {"}'M' greentint -9.537 2.271 -4.683 {"}'M' greentint -9.608 2.025 -4.693 {"}'M' greentint -9.724 1.797 -4.703 {"}'M' greentint -9.881 1.595 -4.712 {"}'M' greentint -10.073 1.427 -4.719 {"}'M' greentint -10.294 1.297 -4.725 {"}'M' greentint -9.491 2.251 -4.429 {"}'M' greentint -9.561 2.004 -4.44 {"}'M' greentint -9.676 1.773 -4.45 {"}'M' greentint -9.831 1.568 -4.459 {"}'M' greentint -10.021 1.395 -4.467 {"}'M' greentint -10.24 1.26 -4.472 {"}'M' greentint -9.558 2 -4.182 {"}'M' greentint -9.671 1.769 -4.192 {"}'M' greentint -9.825 1.563 -4.201 {"}'M' greentint -10.014 1.389 -4.208 {"}'M' greentint -10.232 1.252 -4.214 {"}'M' greentint -9.611 1.984 -3.928 {"}'M' greentint -9.728 1.757 -3.938 {"}'M' greentint -9.886 1.556 -3.947 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n phe A 767 1hn0A_873Y_769}P -8.72 5.004 -12.97 {"}-8.72 5.004 -12.97 { ca phe A 767 1hn0A_873Y_769}-9.841 4.545 -12.107 { c phe A 767 1hn0A_873Y_769}-9.311 4.407 -10.701 { o phe A 767 1hn0A_873Y_769}-8.312 3.715 -10.508 { c phe A 767 1hn0A_873Y_769}P -9.311 4.407 -10.701 { n ile A 768 1hn0A_873Y_769}-9.979 5 -9.699 { ca ile A 768 1hn0A_873Y_769}-9.59 4.722 -8.321 { c ile A 768 1hn0A_873Y_769}-10.835 4.474 -7.474 { o ile A 768 1hn0A_873Y_769}-11.914 4.982 -7.807 { c ile A 768 1hn0A_873Y_769}P -10.835 4.474 -7.474 { n gly A 769 1hn0A_873Y_769}-10.665 3.69 -6.414 { ca gly A 769 1hn0A_873Y_769}-11.76 3.258 -5.557 { c gly A 769 1hn0A_873Y_769}-11.247 3.255 -4.127 { o gly A 769 1hn0A_873Y_769}-10.1 2.892 -3.879 { c gly A 769 1hn0A_873Y_769}P -11.247 3.255 -4.127 { n ser A 770 1hn0A_873Y_769}-12.099 3.64 -3.179 { ca ser A 770 1hn0A_873Y_769}-11.714 3.611 -1.779 { c ser A 770 1hn0A_873Y_769}-12.954 3.28 -0.964 { o ser A 770 1hn0A_873Y_769}-14.087 3.339 -1.48 { c ser A 770 1hn0A_873Y_769}P -12.954 3.28 -0.964 { n asn A 771 1hn0A_873Y_769}-12.713 2.984 0.315 { ca asn A 771 1hn0A_873Y_769}-13.798 2.836 1.293 { c asn A 771 1hn0A_873Y_769}-14.803 1.801 0.843 { o asn A 771 1hn0A_873Y_769}-16.029 1.999 0.97 { n ala A 871 1hn0A_873Y_769}P -11.6 -1.632 1.552 {"}-11.6 -1.632 1.552 { ca ala A 871 1hn0A_873Y_769}-10.854 -2.023 0.353 { c ala A 871 1hn0A_873Y_769}-10.73 -0.872 -0.676 { o ala A 871 1hn0A_873Y_769}-11.475 0.137 -0.646 { c ala A 871 1hn0A_873Y_769}P -10.73 -0.872 -0.676 { n ser A 872 1hn0A_873Y_769}-9.801 -1.019 -1.618 { ca ser A 872 1hn0A_873Y_769}-9.481 0.076 -2.504 { c ser A 872 1hn0A_873Y_769}-8.886 -0.497 -3.791 { o ser A 872 1hn0A_873Y_769}-8.505 -1.641 -3.803 { c ser A 872 1hn0A_873Y_769}P -8.886 -0.497 -3.791 { n tyr A 873 1hn0A_873Y_769}-8.835 0.295 -4.847 { ca tyr A 873 1hn0A_873Y_769}-8.096 -0.092 -6.073 { c tyr A 873 1hn0A_873Y_769}-7.596 1.126 -6.816 { o tyr A 873 1hn0A_873Y_769}-8.036 2.276 -6.577 { c tyr A 873 1hn0A_873Y_769}P -7.596 1.126 -6.816 { n glu A 874 1hn0A_873Y_769}-6.665 0.891 -7.743 { ca glu A 874 1hn0A_873Y_769}-6.33 1.849 -8.772 { c glu A 874 1hn0A_873Y_769}-5.946 1.041 -9.995 { o glu A 874 1hn0A_873Y_769}-5.305 0.023 -9.856 { c glu A 874 1hn0A_873Y_769}P -5.946 1.041 -9.995 { n tyr A 875 1hn0A_873Y_769}-6.312 1.515 -11.178 { ca tyr A 875 1hn0A_873Y_769}-5.819 0.962 -12.443 { c tyr A 875 1hn0A_873Y_769}-6.009 1.987 -13.514 { o tyr A 875 1hn0A_873Y_769}-6.679 3.002 -13.314 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 767 1hn0A_873Y_769}P -8.72 5.004 -12.97 { ca phe A 767 1hn0A_873Y_769}P -9.841 4.545 -12.107 { n ile A 768 1hn0A_873Y_769}P -9.979 5 -9.699 { ca ile A 768 1hn0A_873Y_769}P -9.59 4.722 -8.321 { n gly A 769 1hn0A_873Y_769}P -10.665 3.69 -6.414 { ca gly A 769 1hn0A_873Y_769}P -11.76 3.258 -5.557 {"}P -11.76 3.258 -5.557 { n ser A 770 1hn0A_873Y_769}P -12.099 3.64 -3.179 { ca ser A 770 1hn0A_873Y_769}P -11.714 3.611 -1.779 { n asn A 771 1hn0A_873Y_769}P -12.713 2.984 0.315 { ca asn A 771 1hn0A_873Y_769}P -13.798 2.836 1.293 { n ala A 871 1hn0A_873Y_769}P -11.6 -1.632 1.552 { ca ala A 871 1hn0A_873Y_769}P -10.854 -2.023 0.353 { n ser A 872 1hn0A_873Y_769}P -9.801 -1.019 -1.618 { ca ser A 872 1hn0A_873Y_769}P -9.481 0.076 -2.504 { n tyr A 873 1hn0A_873Y_769}P -8.835 0.295 -4.847 { ca tyr A 873 1hn0A_873Y_769}P -8.096 -0.092 -6.073 { n glu A 874 1hn0A_873Y_769}P -6.665 0.891 -7.743 { ca glu A 874 1hn0A_873Y_769}P -6.33 1.849 -8.772 { n tyr A 875 1hn0A_873Y_769}P -6.312 1.515 -11.178 { ca tyr A 875 1hn0A_873Y_769}P -5.819 0.962 -12.443 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca phe A 767 1hn0A_873Y_769}P -9.841 4.545 -12.107 {"}-9.841 4.545 -12.107 { ca ile A 768 1hn0A_873Y_769}-9.59 4.722 -8.321 { ca gly A 769 1hn0A_873Y_769}-11.76 3.258 -5.557 { ca ser A 770 1hn0A_873Y_769}-11.714 3.611 -1.779 { ca asn A 771 1hn0A_873Y_769}-13.798 2.836 1.293 { ca ala A 871 1hn0A_873Y_769}P -10.854 -2.023 0.353 {"}-10.854 -2.023 0.353 { ca ser A 872 1hn0A_873Y_769}-9.481 0.076 -2.504 { ca tyr A 873 1hn0A_873Y_769}-8.096 -0.092 -6.073 { ca glu A 874 1hn0A_873Y_769}-6.33 1.849 -8.772 { ca tyr A 875 1hn0A_873Y_769}-5.819 0.962 -12.443 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca phe A 767 1hn0A_873Y_769}P -9.841 4.545 -12.107 { ca ile A 768 1hn0A_873Y_769}P -9.59 4.722 -8.321 { ca ser A 770 1hn0A_873Y_769}P -11.714 3.611 -1.779 { ca asn A 771 1hn0A_873Y_769}P -13.798 2.836 1.293 { ca ala A 871 1hn0A_873Y_769}P -10.854 -2.023 0.353 { ca ser A 872 1hn0A_873Y_769}P -9.481 0.076 -2.504 { ca tyr A 873 1hn0A_873Y_769}P -8.096 -0.092 -6.073 { cb tyr A 873 1hn0A_873Y_769}-8.985 -0.926 -7.023 { cg tyr A 873 1hn0A_873Y_769}-10.218 -0.157 -7.519 { cd1 tyr A 873 1hn0A_873Y_769}-10.126 0.719 -8.603 { ce1 tyr A 873 1hn0A_873Y_769}-11.255 1.4 -9.071 { cz tyr A 873 1hn0A_873Y_769}-12.475 1.242 -8.433 { oh tyr A 873 1hn0A_873Y_769}-13.544 1.969 -8.885 { cg tyr A 873 1hn0A_873Y_769}P -10.218 -0.157 -7.519 { cd2 tyr A 873 1hn0A_873Y_769}-11.452 -0.294 -6.892 { ce2 tyr A 873 1hn0A_873Y_769}-12.606 0.365 -7.363 { cz tyr A 873 1hn0A_873Y_769}ghost -12.475 1.242 -8.433 { ca glu A 874 1hn0A_873Y_769}P -6.33 1.849 -8.772 { ca tyr A 875 1hn0A_873Y_769}P -5.819 0.962 -12.443 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 873 1hn0A_873Y_769}P -8.985 -0.926 -7.023 {"}P -8.985 -0.926 -7.023 { cd1 tyr A 873 1hn0A_873Y_769}P -10.126 0.719 -8.603 { cd2 tyr A 873 1hn0A_873Y_769}P -11.452 -0.294 -6.892 { ce1 tyr A 873 1hn0A_873Y_769}P -11.255 1.4 -9.071 { ce2 tyr A 873 1hn0A_873Y_769}P -12.606 0.365 -7.363 { oh tyr A 873 1hn0A_873Y_769}P -13.544 1.969 -8.885 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 873 1hn0A_873Y_769}P -8.096 -0.092 -6.073 { cb tyr A 873 1hn0A_873Y_769}-8.985 -0.926 -7.023 { cg tyr A 873 1hn0A_873Y_769}-10.218 -0.157 -7.519 { cd1 tyr A 873 1hn0A_873Y_769}-10.126 0.719 -8.603 { ce1 tyr A 873 1hn0A_873Y_769}-11.255 1.4 -9.071 { cz tyr A 873 1hn0A_873Y_769}-12.475 1.242 -8.433 { oh tyr A 873 1hn0A_873Y_769}-13.544 1.969 -8.885 { cg tyr A 873 1hn0A_873Y_769}P -10.218 -0.157 -7.519 { cd2 tyr A 873 1hn0A_873Y_769}-11.452 -0.294 -6.892 { ce2 tyr A 873 1hn0A_873Y_769}-12.606 0.365 -7.363 { cz tyr A 873 1hn0A_873Y_769}ghost -12.475 1.242 -8.433 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 873 1hn0A_873Y_769}P -8.985 -0.926 -7.023 {"}P -8.985 -0.926 -7.023 { cd1 tyr A 873 1hn0A_873Y_769}P -10.126 0.719 -8.603 { cd2 tyr A 873 1hn0A_873Y_769}P -11.452 -0.294 -6.892 { ce1 tyr A 873 1hn0A_873Y_769}P -11.255 1.4 -9.071 { ce2 tyr A 873 1hn0A_873Y_769}P -12.606 0.365 -7.363 { oh tyr A 873 1hn0A_873Y_769}P -13.544 1.969 -8.885 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 873 A}'P' sky -11.127 1.362 -6.43 {"}'P' sky -11.395 1.024 -5.742 { CZ TYR 873 A}'P' sky -11.527 1.906 -7.12 {"}'P' sky -12.975 2.028 -6.951 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 873 A}'P' sea -11.33 1.439 -6.685 {"}'P' green -11.387 1.392 -6.429 {"}'P' green -11.46 1.306 -6.182 {"}'P' sea -11.205 1.287 -6.183 {"}'P' green -11.645 1.17 -5.952 {"}'P' green -11.388 1.181 -5.952 {"}'P' sea -11.907 0.947 -5.746 {"}'P' sea -11.655 1.01 -5.743 { CZ TYR 873 A}'P' sea -12.668 2.36 -7.1 {"}'P' green -12.411 2.373 -7.1 {"}'P' green -12.157 2.332 -7.101 {"}'P' green -11.917 2.237 -7.106 {"}'P' sea -11.704 2.092 -7.112 {"}'P' green -12.738 2.128 -6.947 {"}'P' green -11.784 1.881 -6.958 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 873 A}'P' P -12.869 1.943 -6.654 {"}'P' -12.868 1.936 -6.657 {"}'P' P -12.614 1.965 -6.653 {"}'P' -12.614 1.885 -6.688 {"}'P' P -12.359 1.946 -6.654 {"}'P' -12.378 1.824 -6.709 {"}'P' P -12.11 1.887 -6.657 {"}'P' -12.15 1.765 -6.713 {"}'P' P -11.874 1.791 -6.661 {"}'P' -11.917 1.707 -6.702 {"}'P' P -11.655 1.659 -6.667 {"}'P' -11.672 1.636 -6.679 {"}'P' P -12.799 1.829 -6.423 {"}'P' -12.789 1.756 -6.47 {"}'P' P -12.542 1.84 -6.423 {"}'P' -12.548 1.698 -6.513 {"}'P' P -12.041 1.732 -6.427 {"}'P' -12.103 1.581 -6.531 {"}'P' P -11.811 1.616 -6.433 {"}'P' -11.869 1.525 -6.501 {"}'P' P -11.605 1.463 -6.439 {"}'P' -11.623 1.444 -6.456 {"}'P' P -12.809 1.669 -6.214 {"}'P' -12.798 1.601 -6.274 {"}'P' P -12.549 1.683 -6.213 {"}'P' -12.555 1.548 -6.331 {"}'P' P -12.045 1.564 -6.218 {"}'P' -12.107 1.433 -6.344 {"}'P' P -11.819 1.436 -6.224 {"}'P' -11.87 1.367 -6.297 {"}'P' P -12.799 1.483 -6.03 {"}'P' -12.792 1.445 -6.075 {"}'P' P -12.542 1.496 -6.03 {"}'P' -12.547 1.407 -6.135 {"}'P' P -12.288 1.455 -6.031 {"}'P' -12.318 1.352 -6.157 {"}'P' P -12.048 1.36 -6.036 {"}'P' -12.089 1.287 -6.132 {"}'P' P -11.835 1.215 -6.042 {"}'P' -11.853 1.196 -6.072 {"}'P' P -12.614 1.287 -5.875 {"}'P' -12.614 1.267 -5.908 {"}'P' P -12.359 1.255 -5.877 {"}'P' -12.369 1.22 -5.936 {"}'P' P -12.12 1.159 -5.881 {"}'P' -12.131 1.142 -5.912 { CZ TYR 873 A}'P' P -12.483 2.164 -6.945 {"}'P' -12.483 2.163 -6.947 {"}'P' P -12.228 2.132 -6.947 {"}'P' -12.232 2.118 -6.971 {"}'P' P -11.989 2.036 -6.951 {"}'P' -11.995 2.027 -6.967 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 TYR 873 A}'P' P -12.287 1.807 -6.424 {"}'P' -12.325 1.635 -6.536 {"}'P' P -12.291 1.648 -6.215 {"}'P' -12.331 1.488 -6.358 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 769 A}'P' sky -12.834 2.294 -6.761 {"}'P' sky -11.208 1.561 -6.138 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 769 A}'P' green -12.105 2.305 -7.016 {"}'P' green -12.365 2.304 -6.987 {"}'P' sea -11.661 2.054 -6.911 {"}'P' green -12.613 2.292 -6.9 {"}'P' sea -11.316 1.578 -6.385 {"}'P' green -11.506 1.409 -6.392 {"}'P' green -11.387 1.379 -6.146 {"}'P' sea -11.348 1.363 -5.886 {"}'P' green -11.557 1.221 -5.892 {"}'P' green -11.792 1.128 -5.896 {"}'P' sea -11.603 1.219 -5.632 {"}'P' sea -11.843 1.133 -5.635 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 769 A}'P' P -11.975 2.079 -6.996 {"}'P' -11.976 2.08 -6.99 {"}'P' P -12.235 2.079 -6.996 {"}'P' -12.231 2.084 -6.962 {"}'P' P -11.844 1.865 -6.919 {"}'P' -11.845 1.867 -6.915 {"}'P' P -12.097 1.793 -6.922 {"}'P' -12.097 1.827 -6.844 {"}'P' P -12.351 1.857 -6.919 {"}'P' -12.333 1.886 -6.84 {"}'P' P -12.54 2.039 -6.912 {"}'P' -12.535 2.042 -6.897 {"}'P' P -11.74 1.663 -6.788 {"}'P' -11.754 1.685 -6.753 {"}'P' P -11.978 1.576 -6.792 {"}'P' -11.993 1.655 -6.683 {"}'P' P -12.232 1.576 -6.792 {"}'P' -12.212 1.68 -6.647 {"}'P' P -12.47 1.663 -6.788 {"}'P' -12.419 1.745 -6.658 {"}'P' P -12.664 1.825 -6.781 {"}'P' -12.622 1.858 -6.711 {"}'P' P -11.717 1.458 -6.612 {"}'P' -11.743 1.51 -6.562 {"}'P' P -11.967 1.382 -6.615 {"}'P' -11.986 1.507 -6.505 {"}'P' P -12.698 1.59 -6.606 {"}'P' -12.62 1.677 -6.506 {"}'P' P -12.87 1.785 -6.598 {"}'P' -12.832 1.808 -6.561 {"}'P' P -11.731 1.291 -6.397 {"}'P' -11.755 1.354 -6.362 {"}'P' P -11.978 1.231 -6.4 {"}'P' -11.995 1.367 -6.326 {"}'P' P -12.704 1.409 -6.392 {"}'P' -12.622 1.525 -6.317 {"}'P' P -12.894 1.578 -6.385 {"}'P' -12.838 1.626 -6.347 {"}'P' P -11.603 1.242 -6.152 {"}'P' -11.611 1.259 -6.147 {"}'P' P -11.843 1.156 -6.156 {"}'P' -11.856 1.211 -6.14 {"}'P' P -12.097 1.126 -6.157 {"}'P' -12.098 1.239 -6.126 {"}'P' P -12.351 1.153 -6.156 {"}'P' -12.321 1.287 -6.118 {"}'P' P -12.593 1.235 -6.152 {"}'P' -12.539 1.348 -6.118 {"}'P' P -12.81 1.369 -6.146 {"}'P' -12.762 1.43 -6.126 {"}'P' P -12.992 1.548 -6.138 {"}'P' -12.99 1.55 -6.138 {"}'P' P -12.042 1.087 -5.898 {"}'P' -12.042 1.098 -5.897 {"}'P' P -12.294 1.101 -5.897 {"}'P' -12.288 1.14 -5.896 {"}'P' P -12.538 1.168 -5.894 {"}'P' -12.524 1.203 -5.893 {"}'P' P -12.762 1.287 -5.889 {"}'P' -12.76 1.289 -5.889 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 769 A}'P' P -12.227 1.38 -6.615 {"}'P' -12.204 1.542 -6.473 {"}'P' P -12.477 1.451 -6.612 {"}'P' -12.41 1.596 -6.474 {"}'P' P -12.232 1.231 -6.4 {"}'P' -12.21 1.407 -6.305 {"}'P' P -12.479 1.291 -6.397 {"}'P' -12.414 1.458 -6.302 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 873 A}'M' green -9.237 2.902 -6.933 {"}'M' green -9.099 3.118 -6.924 {"}'M' green -9.406 2.538 -6.695 {"}'M' green -8.876 3.393 -6.658 {"}'M' green -9.376 2.387 -6.189 {"}'M' green -8.709 3.424 -6.143 {"}'M' green -9.086 2.621 -5.717 {"}'M' green -8.969 2.853 -5.707 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 873 A}'M' greentint -9.336 2.785 -6.684 {"}'M' greentint -9.221 3.015 -6.674 {"}'M' greentint -9.066 3.22 -6.665 {"}'M' greentint -9.408 2.518 -6.437 {"}'M' greentint -9.339 2.766 -6.426 {"}'M' greentint -9.226 2.997 -6.416 {"}'M' greentint -9.072 3.203 -6.407 {"}'M' greentint -8.883 3.377 -6.4 {"}'M' greentint -9.328 2.638 -6.178 {"}'M' greentint -9.233 2.876 -6.167 {"}'M' greentint -9.094 3.091 -6.158 {"}'M' greentint -8.918 3.276 -6.15 {"}'M' greentint -9.234 2.616 -5.938 {"}'M' greentint -9.136 2.849 -5.927 {"}'M' greentint -8.992 3.058 -5.918 {"}'M' greentint -8.809 3.234 -5.911 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 769 A}'M' green -9.448 2.56 -6.664 {"}'M' green -9.289 2.494 -5.907 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 769 A}'M' greentint -9.113 3.117 -6.847 {"}'M' greentint -9.249 2.896 -6.856 {"}'M' greentint -8.942 3.116 -6.639 {"}'M' greentint -9.052 2.882 -6.65 {"}'M' greentint -9.226 2.692 -6.658 {"}'M' greentint -8.906 3.371 -6.628 {"}'M' greentint -8.839 3.103 -6.398 {"}'M' greentint -8.935 2.87 -6.409 {"}'M' greentint -9.089 2.67 -6.417 {"}'M' greentint -9.289 2.517 -6.424 {"}'M' greentint -8.806 3.352 -6.388 {"}'M' greentint -8.801 3.1 -6.14 {"}'M' greentint -8.892 2.867 -6.15 {"}'M' greentint -9.038 2.663 -6.159 {"}'M' greentint -9.229 2.502 -6.166 {"}'M' greentint -8.772 3.349 -6.129 {"}'M' greentint -8.839 3.08 -5.881 {"}'M' greentint -8.935 2.847 -5.891 {"}'M' greentint -9.089 2.647 -5.9 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 873 A}'M' green -10.094 1.77 -4.872 {"}'M' green -9.225 2.187 -4.853 {"}'M' green -10.117 1.66 -4.617 {"}'M' green -9.03 2.11 -4.598 {"}'M' green -10.064 1.535 -4.381 {"}'M' green -9.881 1.53 -4.174 {"}'M' green -9.537 1.58 -4.013 {"}'M' green -9.288 1.651 -4.01 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 873 A}'M' greentint -9.924 1.954 -4.864 {"}'M' greentint -9.713 2.09 -4.858 {"}'M' greentint -9.475 2.169 -4.854 {"}'M' greentint -9.963 1.86 -4.609 {"}'M' greentint -9.763 2.013 -4.602 {"}'M' greentint -9.53 2.11 -4.598 {"}'M' greentint -9.28 2.143 -4.596 {"}'M' greentint -9.92 1.75 -4.372 {"}'M' greentint -9.72 1.912 -4.365 {"}'M' greentint -9.481 2.009 -4.361 {"}'M' greentint -9.224 2.031 -4.36 {"}'M' greentint -9.706 1.722 -4.166 {"}'M' greentint -9.474 1.838 -4.161 {"}'M' greentint -9.215 1.862 -4.16 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 769 A}'M' green -9.456 2.248 -4.943 {"}'M' green -9.908 2.015 -4.953 {"}'M' green -9.239 2.218 -4.753 {"}'M' green -10.157 1.814 -4.771 {"}'M' green -9.071 2.204 -4.534 {"}'M' green -10.163 1.669 -4.557 {"}'M' green -9.12 1.986 -4.302 {"}'M' green -10.028 1.565 -4.32 {"}'M' green -9.26 1.786 -4.057 {"}'M' green -9.719 1.558 -4.067 {"}'M' green -9.971 1.511 -4.069 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 769 A}'M' greentint -9.666 2.1 -4.949 {"}'M' greentint -9.426 2.038 -4.761 {"}'M' greentint -9.65 1.907 -4.766 {"}'M' greentint -9.898 1.831 -4.77 {"}'M' greentint -9.237 2.012 -4.542 {"}'M' greentint -9.437 1.857 -4.549 {"}'M' greentint -9.665 1.745 -4.554 {"}'M' greentint -9.91 1.682 -4.556 {"}'M' greentint -9.312 1.818 -4.309 {"}'M' greentint -9.533 1.688 -4.315 {"}'M' greentint -9.775 1.603 -4.319 {"}'M' greentint -9.479 1.651 -4.062 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n phe B 83 1htrB_101F_85G}P -6.624 6.015 -11.307 {"}-6.624 6.015 -11.307 { ca phe B 83 1htrB_101F_85G}-7.167 6.722 -10.151 { c phe B 83 1htrB_101F_85G}-7.558 5.593 -9.194 { o phe B 83 1htrB_101F_85G}-7.539 4.444 -9.571 { c phe B 83 1htrB_101F_85G}P -7.558 5.593 -9.194 { n phe B 84 1htrB_101F_85G}-7.903 5.945 -7.951 { ca phe B 84 1htrB_101F_85G}-8.289 4.944 -6.986 { c phe B 84 1htrB_101F_85G}-9.814 4.715 -6.966 { o phe B 84 1htrB_101F_85G}-10.586 5.683 -6.976 { c phe B 84 1htrB_101F_85G}P -9.814 4.715 -6.966 { n gly B 85 1htrB_101F_85G}-10.201 3.446 -6.833 { ca gly B 85 1htrB_101F_85G}-11.594 3.071 -6.751 { c gly B 85 1htrB_101F_85G}-11.683 2.218 -5.495 { o gly B 85 1htrB_101F_85G}-10.66 1.845 -4.833 { c gly B 85 1htrB_101F_85G}P -11.683 2.218 -5.495 { n tyr B 86 1htrB_101F_85G}-12.917 1.927 -5.1 { ca tyr B 86 1htrB_101F_85G}-13.168 1.206 -3.857 { c tyr B 86 1htrB_101F_85G}-14.184 0.185 -4.212 { o tyr B 86 1htrB_101F_85G}-15.211 0.49 -4.834 { c tyr B 86 1htrB_101F_85G}P -14.184 0.185 -4.212 { n asp B 87 1htrB_101F_85G}-13.996 -1.079 -3.891 { ca asp B 87 1htrB_101F_85G}-15.025 -2.091 -4.249 { c asp B 87 1htrB_101F_85G}-14.742 -3.31 -3.373 { o asp B 87 1htrB_101F_85G}-13.785 -3.295 -2.576 { n gln B 99 1htrB_101F_85G}P -12.616 -1.996 -0.463 {"}-12.616 -1.996 -0.463 { ca gln B 99 1htrB_101F_85G}-11.179 -2.107 -0.499 { c gln B 99 1htrB_101F_85G}-10.642 -1.116 -1.522 { o gln B 99 1htrB_101F_85G}-11.134 -1.097 -2.65 { c gln B 99 1htrB_101F_85G}P -10.642 -1.116 -1.522 { n glu B 100 1htrB_101F_85G}-9.611 -0.334 -1.201 { ca glu B 100 1htrB_101F_85G}-9.065 0.603 -2.19 { c glu B 100 1htrB_101F_85G}-8.167 -0.086 -3.174 { o glu B 100 1htrB_101F_85G}-7.425 -1.019 -2.827 { c glu B 100 1htrB_101F_85G}P -8.167 -0.086 -3.174 { n phe B 101 1htrB_101F_85G}-8.233 0.242 -4.454 { ca phe B 101 1htrB_101F_85G}-7.336 -0.399 -5.429 { c phe B 101 1htrB_101F_85G}-7.138 0.608 -6.555 { o phe B 101 1htrB_101F_85G}-7.925 1.573 -6.714 { c phe B 101 1htrB_101F_85G}P -7.138 0.608 -6.555 { n gly B 102 1htrB_101F_85G}-6.058 0.478 -7.302 { ca gly B 102 1htrB_101F_85G}-5.794 1.42 -8.373 { c gly B 102 1htrB_101F_85G}-6.324 0.859 -9.677 { o gly B 102 1htrB_101F_85G}-6.237 -0.36 -9.971 { c gly B 102 1htrB_101F_85G}P -6.324 0.859 -9.677 { n leu B 103 1htrB_101F_85G}-6.869 1.769 -10.467 { ca leu B 103 1htrB_101F_85G}-7.371 1.442 -11.754 { c leu B 103 1htrB_101F_85G}-6.525 2.186 -12.79 { o leu B 103 1htrB_101F_85G}-6.461 3.448 -12.82 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe B 83 1htrB_101F_85G}P -6.624 6.015 -11.307 { ca phe B 83 1htrB_101F_85G}P -7.167 6.722 -10.151 { n phe B 84 1htrB_101F_85G}P -7.903 5.945 -7.951 { ca phe B 84 1htrB_101F_85G}P -8.289 4.944 -6.986 { n gly B 85 1htrB_101F_85G}P -10.201 3.446 -6.833 { ca gly B 85 1htrB_101F_85G}P -11.594 3.071 -6.751 {"}P -11.594 3.071 -6.751 { n tyr B 86 1htrB_101F_85G}P -12.917 1.927 -5.1 { ca tyr B 86 1htrB_101F_85G}P -13.168 1.206 -3.857 { n asp B 87 1htrB_101F_85G}P -13.996 -1.079 -3.891 { ca asp B 87 1htrB_101F_85G}P -15.025 -2.091 -4.249 { n gln B 99 1htrB_101F_85G}P -12.616 -1.996 -0.463 { ca gln B 99 1htrB_101F_85G}P -11.179 -2.107 -0.499 { n glu B 100 1htrB_101F_85G}P -9.611 -0.334 -1.201 { ca glu B 100 1htrB_101F_85G}P -9.065 0.603 -2.19 { n phe B 101 1htrB_101F_85G}P -8.233 0.242 -4.454 { ca phe B 101 1htrB_101F_85G}P -7.336 -0.399 -5.429 { n gly B 102 1htrB_101F_85G}P -6.058 0.478 -7.302 { ca gly B 102 1htrB_101F_85G}P -5.794 1.42 -8.373 {"}P -5.794 1.42 -8.373 { n leu B 103 1htrB_101F_85G}P -6.869 1.769 -10.467 { ca leu B 103 1htrB_101F_85G}P -7.371 1.442 -11.754 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca phe B 83 1htrB_101F_85G}P -7.167 6.722 -10.151 {"}-7.167 6.722 -10.151 { ca phe B 84 1htrB_101F_85G}-8.289 4.944 -6.986 { ca gly B 85 1htrB_101F_85G}-11.594 3.071 -6.751 { ca tyr B 86 1htrB_101F_85G}-13.168 1.206 -3.857 { ca asp B 87 1htrB_101F_85G}-15.025 -2.091 -4.249 { ca gln B 99 1htrB_101F_85G}P -11.179 -2.107 -0.499 {"}-11.179 -2.107 -0.499 { ca glu B 100 1htrB_101F_85G}-9.065 0.603 -2.19 { ca phe B 101 1htrB_101F_85G}-7.336 -0.399 -5.429 { ca gly B 102 1htrB_101F_85G}-5.794 1.42 -8.373 { ca leu B 103 1htrB_101F_85G}-7.371 1.442 -11.754 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca phe B 83 1htrB_101F_85G}P -7.167 6.722 -10.151 { ca phe B 84 1htrB_101F_85G}P -8.289 4.944 -6.986 { ca tyr B 86 1htrB_101F_85G}P -13.168 1.206 -3.857 { ca asp B 87 1htrB_101F_85G}P -15.025 -2.091 -4.249 { ca gln B 99 1htrB_101F_85G}P -11.179 -2.107 -0.499 { ca glu B 100 1htrB_101F_85G}P -9.065 0.603 -2.19 { ca phe B 101 1htrB_101F_85G}P -7.336 -0.399 -5.429 { ca leu B 103 1htrB_101F_85G}P -7.371 1.442 -11.754 @subgroup {sidechain} off @vectorlist {sc} color= blue alpha= 0.2353 master= {sidechain} { ca phe B 101 1htrB_101F_85G}P -7.336 -0.399 -5.429 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 101 B}'M' greentint -9.121 1.975 -7.321 {"}'M' greentint -9.021 2.208 -7.311 {"}'M' greentint -8.876 2.416 -7.302 {"}'M' greentint -9.219 1.961 -7.081 {"}'M' greentint -9.126 2.199 -7.07 {"}'M' greentint -8.988 2.415 -7.061 {"}'M' greentint -8.813 2.601 -7.053 {"}'M' greentint -8.605 2.751 -7.046 {"}'M' greentint -9.295 1.835 -6.832 {"}'M' greentint -9.225 2.082 -6.821 {"}'M' greentint -9.11 2.312 -6.811 {"}'M' greentint -8.955 2.517 -6.802 {"}'M' greentint -8.765 2.69 -6.795 {"}'M' greentint -9.297 1.815 -6.574 {"}'M' greentint -9.228 2.063 -6.563 {"}'M' greentint -9.115 2.294 -6.553 {"}'M' greentint -8.961 2.5 -6.544 {"}'M' greentint -8.772 2.674 -6.537 {"}'M' greentint -9.217 1.935 -6.315 {"}'M' greentint -9.122 2.173 -6.304 {"}'M' greentint -8.983 2.388 -6.295 {"}'M' greentint -8.807 2.573 -6.287 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 85 B}'M' greentint -8.736 2.451 -7.29 {"}'M' greentint -8.846 2.217 -7.301 {"}'M' greentint -9.02 2.027 -7.309 {"}'M' greentint -8.633 2.438 -7.049 {"}'M' greentint -8.729 2.205 -7.06 {"}'M' greentint -8.883 2.005 -7.068 {"}'M' greentint -9.083 1.852 -7.075 {"}'M' greentint -8.6 2.687 -7.039 {"}'M' greentint -8.595 2.435 -6.791 {"}'M' greentint -8.686 2.202 -6.801 {"}'M' greentint -8.832 1.998 -6.81 {"}'M' greentint -9.023 1.837 -6.817 {"}'M' greentint -9.249 1.728 -6.821 {"}'M' greentint -8.566 2.684 -6.78 {"}'M' greentint -8.633 2.415 -6.532 {"}'M' greentint -8.729 2.182 -6.542 {"}'M' greentint -8.883 1.982 -6.551 {"}'M' greentint -9.083 1.829 -6.558 {"}'M' greentint -8.6 2.665 -6.521 {"}'M' greentint -8.736 2.407 -6.291 {"}'M' greentint -8.846 2.174 -6.301 {"}'M' greentint -9.02 1.983 -6.31 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 101 B}'M' greentint -9.723 1.058 -5.331 {"}'M' greentint -9.649 1.305 -5.32 {"}'M' greentint -9.505 1.519 -5.311 {"}'M' greentint -9.831 0.926 -5.096 {"}'M' greentint -9.798 1.176 -5.085 {"}'M' greentint -9.702 1.409 -5.075 {"}'M' greentint -9.548 1.609 -5.066 {"}'M' greentint -9.348 1.762 -5.059 {"}'M' greentint -9.856 0.782 -4.843 {"}'M' greentint -9.858 1.032 -4.832 {"}'M' greentint -9.798 1.275 -4.821 {"}'M' greentint -9.679 1.496 -4.812 {"}'M' greentint -9.509 1.68 -4.804 {"}'M' greentint -9.298 1.816 -4.798 {"}'M' greentint -9.831 0.904 -4.578 {"}'M' greentint -9.798 1.153 -4.568 {"}'M' greentint -9.702 1.386 -4.557 {"}'M' greentint -9.548 1.586 -4.549 {"}'M' greentint -9.348 1.739 -4.542 {"}'M' greentint -9.723 1.014 -4.332 {"}'M' greentint -9.649 1.261 -4.321 {"}'M' greentint -9.505 1.476 -4.312 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 85 B}'M' green -9.508 1.378 -5.478 {"}'M' green -9.631 1.157 -5.488 {"}'M' green -9.266 1.851 -4.962 {"}'M' green -9.266 1.848 -4.704 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 85 B}'M' greentint -9.336 1.615 -5.227 {"}'M' greentint -9.407 1.369 -5.237 {"}'M' greentint -9.523 1.141 -5.247 {"}'M' greentint -9.68 0.939 -5.256 {"}'M' greentint -9.29 1.595 -4.973 {"}'M' greentint -9.36 1.348 -4.984 {"}'M' greentint -9.475 1.117 -4.994 {"}'M' greentint -9.63 0.912 -5.003 {"}'M' greentint -9.82 0.739 -5.011 {"}'M' greentint -9.288 1.592 -4.715 {"}'M' greentint -9.357 1.344 -4.726 {"}'M' greentint -9.47 1.113 -4.736 {"}'M' greentint -9.624 0.907 -4.745 {"}'M' greentint -9.813 0.733 -4.752 {"}'M' greentint -9.338 1.574 -4.461 {"}'M' greentint -9.41 1.328 -4.472 {"}'M' greentint -9.527 1.101 -4.482 {"}'M' greentint -9.685 0.9 -4.491 {"}'M' greentint -9.505 1.331 -4.231 {"}'M' greentint -9.627 1.109 -4.24 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n val A 4 1j31A_6Y_231G}P -11.349 -0.678 1.446 {"}-11.349 -0.678 1.446 { ca val A 4 1j31A_6Y_231G}-10.368 -1.316 0.551 { c val A 4 1j31A_6Y_231G}-10.529 -0.684 -0.814 { o val A 4 1j31A_6Y_231G}-11.558 -0.067 -1.096 { c val A 4 1j31A_6Y_231G}P -10.529 -0.684 -0.814 { n gly A 5 1j31A_6Y_231G}-9.527 -0.843 -1.673 { ca gly A 5 1j31A_6Y_231G}-9.664 -0.215 -2.976 { c gly A 5 1j31A_6Y_231G}-8.762 -0.763 -4.054 { o gly A 5 1j31A_6Y_231G}-7.83 -1.534 -3.784 { c gly A 5 1j31A_6Y_231G}P -8.762 -0.763 -4.054 { n tyr A 6 1j31A_6Y_231G}-9.099 -0.412 -5.299 { ca tyr A 6 1j31A_6Y_231G}-8.259 -0.754 -6.439 { c tyr A 6 1j31A_6Y_231G}-7.561 0.515 -6.901 { o tyr A 6 1j31A_6Y_231G}-8.049 1.636 -6.644 { c tyr A 6 1j31A_6Y_231G}P -7.561 0.515 -6.901 { n ile A 7 1j31A_6Y_231G}-6.397 0.326 -7.503 { ca ile A 7 1j31A_6Y_231G}-5.625 1.412 -8.1 { c ile A 7 1j31A_6Y_231G}-5.641 1.12 -9.607 { o ile A 7 1j31A_6Y_231G}-4.985 0.169 -10.046 { c ile A 7 1j31A_6Y_231G}P -5.641 1.12 -9.607 { n gln A 8 1j31A_6Y_231G}-6.396 1.91 -10.39 { ca gln A 8 1j31A_6Y_231G}-6.452 1.707 -11.842 { c gln A 8 1j31A_6Y_231G}-5.445 2.671 -12.429 { o gln A 8 1j31A_6Y_231G}-5.646 3.877 -12.394 { n glu A 229 1j31A_6Y_231G}P -7.536 6.085 -12.081 {"}-7.536 6.085 -12.081 { ca glu A 229 1j31A_6Y_231G}-8.358 6.511 -10.954 { c glu A 229 1j31A_6Y_231G}-8.28 5.477 -9.834 { o glu A 229 1j31A_6Y_231G}-7.774 4.374 -10.026 { c glu A 229 1j31A_6Y_231G}P -8.28 5.477 -9.834 { n ile A 230 1j31A_6Y_231G}-8.768 5.836 -8.658 { ca ile A 230 1j31A_6Y_231G}-8.824 4.879 -7.549 { c ile A 230 1j31A_6Y_231G}-10.323 4.633 -7.264 { o ile A 230 1j31A_6Y_231G}-11.188 5.379 -7.729 { c ile A 230 1j31A_6Y_231G}P -10.323 4.633 -7.264 { n gly A 231 1j31A_6Y_231G}-10.623 3.543 -6.565 { ca gly A 231 1j31A_6Y_231G}-11.972 3.197 -6.19 { c gly A 231 1j31A_6Y_231G}-11.834 2.621 -4.797 { o gly A 231 1j31A_6Y_231G}-11.251 1.543 -4.634 { c gly A 231 1j31A_6Y_231G}P -11.834 2.621 -4.797 { n val A 232 1j31A_6Y_231G}-12.345 3.344 -3.791 { ca val A 232 1j31A_6Y_231G}-12.244 2.91 -2.402 { c val A 232 1j31A_6Y_231G}-13.643 2.779 -1.827 { o val A 232 1j31A_6Y_231G}-14.444 3.716 -1.907 { c val A 232 1j31A_6Y_231G}P -13.643 2.779 -1.827 { n val A 233 1j31A_6Y_231G}-13.938 1.622 -1.244 { ca val A 233 1j31A_6Y_231G}-15.249 1.405 -0.647 { c val A 233 1j31A_6Y_231G}-15.168 0.64 0.67 { o val A 233 1j31A_6Y_231G}-14.225 -0.114 0.918 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 4 1j31A_6Y_231G}P -11.349 -0.678 1.446 { ca val A 4 1j31A_6Y_231G}P -10.368 -1.316 0.551 { n gly A 5 1j31A_6Y_231G}P -9.527 -0.843 -1.673 { ca gly A 5 1j31A_6Y_231G}P -9.664 -0.215 -2.976 {"}P -9.664 -0.215 -2.976 { n tyr A 6 1j31A_6Y_231G}P -9.099 -0.412 -5.299 { ca tyr A 6 1j31A_6Y_231G}P -8.259 -0.754 -6.439 { n ile A 7 1j31A_6Y_231G}P -6.397 0.326 -7.503 { ca ile A 7 1j31A_6Y_231G}P -5.625 1.412 -8.1 { n gln A 8 1j31A_6Y_231G}P -6.396 1.91 -10.39 { ca gln A 8 1j31A_6Y_231G}P -6.452 1.707 -11.842 { n glu A 229 1j31A_6Y_231G}P -7.536 6.085 -12.081 { ca glu A 229 1j31A_6Y_231G}P -8.358 6.511 -10.954 { n ile A 230 1j31A_6Y_231G}P -8.768 5.836 -8.658 { ca ile A 230 1j31A_6Y_231G}P -8.824 4.879 -7.549 { n gly A 231 1j31A_6Y_231G}P -10.623 3.543 -6.565 { ca gly A 231 1j31A_6Y_231G}P -11.972 3.197 -6.19 {"}P -11.972 3.197 -6.19 { n val A 232 1j31A_6Y_231G}P -12.345 3.344 -3.791 { ca val A 232 1j31A_6Y_231G}P -12.244 2.91 -2.402 { n val A 233 1j31A_6Y_231G}P -13.938 1.622 -1.244 { ca val A 233 1j31A_6Y_231G}P -15.249 1.405 -0.647 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca val A 4 1j31A_6Y_231G}P -10.368 -1.316 0.551 {"}-10.368 -1.316 0.551 { ca gly A 5 1j31A_6Y_231G}-9.664 -0.215 -2.976 { ca tyr A 6 1j31A_6Y_231G}-8.259 -0.754 -6.439 { ca ile A 7 1j31A_6Y_231G}-5.625 1.412 -8.1 { ca gln A 8 1j31A_6Y_231G}-6.452 1.707 -11.842 { ca glu A 229 1j31A_6Y_231G}P -8.358 6.511 -10.954 {"}-8.358 6.511 -10.954 { ca ile A 230 1j31A_6Y_231G}-8.824 4.879 -7.549 { ca gly A 231 1j31A_6Y_231G}-11.972 3.197 -6.19 { ca val A 232 1j31A_6Y_231G}-12.244 2.91 -2.402 { ca val A 233 1j31A_6Y_231G}-15.249 1.405 -0.647 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca val A 4 1j31A_6Y_231G}P -10.368 -1.316 0.551 { ca tyr A 6 1j31A_6Y_231G}P -8.259 -0.754 -6.439 { cb tyr A 6 1j31A_6Y_231G}-9.06 -1.327 -7.644 { cg tyr A 6 1j31A_6Y_231G}-10.24 -0.483 -8.11 { cd1 tyr A 6 1j31A_6Y_231G}-10.068 0.757 -8.784 { ce1 tyr A 6 1j31A_6Y_231G}-11.208 1.515 -9.211 { cz tyr A 6 1j31A_6Y_231G}-12.49 1.019 -8.944 { oh tyr A 6 1j31A_6Y_231G}-13.63 1.755 -9.257 { cg tyr A 6 1j31A_6Y_231G}P -10.24 -0.483 -8.11 { cd2 tyr A 6 1j31A_6Y_231G}-11.534 -0.929 -7.887 { ce2 tyr A 6 1j31A_6Y_231G}-12.651 -0.185 -8.301 { cz tyr A 6 1j31A_6Y_231G}ghost -12.49 1.019 -8.944 { ca ile A 7 1j31A_6Y_231G}P -5.625 1.412 -8.1 { ca gln A 8 1j31A_6Y_231G}P -6.452 1.707 -11.842 { ca glu A 229 1j31A_6Y_231G}P -8.358 6.511 -10.954 { ca ile A 230 1j31A_6Y_231G}P -8.824 4.879 -7.549 { ca val A 232 1j31A_6Y_231G}P -12.244 2.91 -2.402 { ca val A 233 1j31A_6Y_231G}P -15.249 1.405 -0.647 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 6 1j31A_6Y_231G}P -9.06 -1.327 -7.644 {"}P -9.06 -1.327 -7.644 { cd1 tyr A 6 1j31A_6Y_231G}P -10.068 0.757 -8.784 { cd2 tyr A 6 1j31A_6Y_231G}P -11.534 -0.929 -7.887 { ce1 tyr A 6 1j31A_6Y_231G}P -11.208 1.515 -9.211 { ce2 tyr A 6 1j31A_6Y_231G}P -12.651 -0.185 -8.301 { oh tyr A 6 1j31A_6Y_231G}P -13.63 1.755 -9.257 @subgroup {sidechain} off @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 6 1j31A_6Y_231G}P -8.259 -0.754 -6.439 { cb tyr A 6 1j31A_6Y_231G}-9.06 -1.327 -7.644 { cg tyr A 6 1j31A_6Y_231G}-10.24 -0.483 -8.11 { cd1 tyr A 6 1j31A_6Y_231G}-10.068 0.757 -8.784 { ce1 tyr A 6 1j31A_6Y_231G}-11.208 1.515 -9.211 { cz tyr A 6 1j31A_6Y_231G}-12.49 1.019 -8.944 { oh tyr A 6 1j31A_6Y_231G}-13.63 1.755 -9.257 { cg tyr A 6 1j31A_6Y_231G}P -10.24 -0.483 -8.11 { cd2 tyr A 6 1j31A_6Y_231G}-11.534 -0.929 -7.887 { ce2 tyr A 6 1j31A_6Y_231G}-12.651 -0.185 -8.301 { cz tyr A 6 1j31A_6Y_231G}ghost -12.49 1.019 -8.944 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 6 1j31A_6Y_231G}P -9.06 -1.327 -7.644 {"}P -9.06 -1.327 -7.644 { cd1 tyr A 6 1j31A_6Y_231G}P -10.068 0.757 -8.784 { cd2 tyr A 6 1j31A_6Y_231G}P -11.534 -0.929 -7.887 { ce1 tyr A 6 1j31A_6Y_231G}P -11.208 1.515 -9.211 { ce2 tyr A 6 1j31A_6Y_231G}P -12.651 -0.185 -8.301 { oh tyr A 6 1j31A_6Y_231G}P -13.63 1.755 -9.257 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 6 A}'P' sky -12.854 1.119 -7.152 {"}'P' sky -12.09 1.014 -7.156 {"}'P' blue -12.587 0.946 -6.968 {"}'P' blue -12.333 0.905 -6.969 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 6 A}'P' green -12.11 2.495 -8.076 {"}'P' green -11.899 2.647 -8.069 {"}'P' green -11.649 2.564 -7.881 {"}'P' green -11.659 1.692 -7.529 {"}'P' green -11.473 1.884 -7.521 { CE2 TYR 6 A}'P' sea -12.594 1.133 -7.151 {"}'P' sea -12.336 1.098 -7.153 { CZ TYR 6 A}'P' green -13.158 1.947 -7.619 {"}'P' green -12.755 1.388 -7.254 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 6 A}'P' P -11.876 2.443 -7.886 {"}'P' -11.869 2.433 -7.901 {"}'P' P -11.708 2.301 -7.729 {"}'P' -11.699 2.287 -7.756 {"}'P' P -11.79 1.934 -7.615 {"}'P' -11.777 1.925 -7.65 {"}'P' P -11.588 2.103 -7.607 {"}'P' -11.585 2.1 -7.616 { CZ TYR 6 A}'P' P -12.683 2.483 -8.004 {"}'P' -12.681 2.475 -8.009 {"}'P' P -12.426 2.494 -8.004 {"}'P' -12.427 2.471 -8.018 {"}'P' P -12.171 2.461 -8.005 {"}'P' -12.173 2.45 -8.012 {"}'P' P -12.945 2.26 -7.798 {"}'P' -12.933 2.228 -7.828 {"}'P' P -12.693 2.323 -7.795 {"}'P' -12.681 2.246 -7.863 {"}'P' P -12.433 2.337 -7.794 {"}'P' -12.437 2.242 -7.877 {"}'P' P -12.175 2.302 -7.796 {"}'P' -12.195 2.222 -7.867 {"}'P' P -12.931 2.068 -7.614 {"}'P' -12.907 2.011 -7.686 {"}'P' P -12.683 2.137 -7.611 {"}'P' -12.665 2.032 -7.736 {"}'P' P -12.426 2.15 -7.611 {"}'P' -12.433 2.027 -7.755 {"}'P' P -12.172 2.109 -7.612 {"}'P' -12.201 2.007 -7.737 {"}'P' P -11.932 2.014 -7.617 {"}'P' -11.963 1.96 -7.688 {"}'P' P -12.99 1.805 -7.462 {"}'P' -12.973 1.778 -7.512 {"}'P' P -12.753 1.905 -7.458 {"}'P' -12.731 1.83 -7.585 {"}'P' P -12.498 1.941 -7.456 {"}'P' -12.497 1.838 -7.622 {"}'P' P -12.243 1.909 -7.458 {"}'P' -12.268 1.819 -7.609 {"}'P' P -12.004 1.813 -7.462 {"}'P' -12.034 1.765 -7.551 {"}'P' P -11.799 1.658 -7.469 {"}'P' -11.799 1.658 -7.47 {"}'P' P -12.87 1.607 -7.34 {"}'P' -12.859 1.591 -7.383 {"}'P' P -12.622 1.697 -7.336 {"}'P' -12.612 1.648 -7.453 {"}'P' P -12.358 1.697 -7.336 {"}'P' -12.369 1.643 -7.464 {"}'P' P -12.11 1.607 -7.34 {"}'P' -12.127 1.581 -7.411 {"}'P' P -12.499 1.461 -7.251 {"}'P' -12.498 1.449 -7.298 {"}'P' P -12.24 1.397 -7.254 {"}'P' -12.242 1.394 -7.267 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 6 A}'P' blue -13.203 2.55 -8.187 {"}'P' sky -13.261 2.341 -8.04 {"}'P' sky -13.384 2.14 -7.933 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 231 A}'P' blue -12.094 1.34 -6.936 {"}'P' sky -12.344 1.299 -6.938 {"}'P' sky -12.596 1.313 -6.937 {"}'P' sky -12.84 1.38 -6.934 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 231 A}'P' sea -11.972 2.773 -7.929 {"}'P' green -11.899 2.52 -7.94 {"}'P' green -11.678 2.506 -7.801 {"}'P' green -11.527 2.248 -7.627 {"}'P' green -11.474 1.999 -7.416 {"}'P' green -11.618 1.79 -7.425 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 231 A}'P' P -12.407 2.517 -8.056 {"}'P' -12.407 2.517 -8.053 {"}'P' P -12.277 2.291 -8.036 {"}'P' -12.286 2.304 -7.951 {"}'P' P -12.537 2.291 -8.036 {"}'P' -12.527 2.305 -7.945 {"}'P' P -11.963 2.266 -7.951 {"}'P' -11.982 2.274 -7.905 {"}'P' P -12.146 2.077 -7.959 {"}'P' -12.175 2.121 -7.838 {"}'P' P -12.399 2.005 -7.962 {"}'P' -12.4 2.075 -7.799 {"}'P' P -12.653 2.069 -7.959 {"}'P' -12.622 2.12 -7.821 {"}'P' P -12.842 2.251 -7.952 {"}'P' -12.818 2.263 -7.893 {"}'P' P -11.722 2.257 -7.812 {"}'P' -11.746 2.264 -7.778 {"}'P' P -11.848 2.037 -7.821 {"}'P' -11.88 2.062 -7.768 {"}'P' P -12.042 1.875 -7.828 {"}'P' -12.085 1.944 -7.718 {"}'P' P -12.28 1.788 -7.832 {"}'P' -12.301 1.899 -7.678 {"}'P' P -12.534 1.788 -7.832 {"}'P' -12.512 1.903 -7.672 {"}'P' P -12.772 1.875 -7.828 {"}'P' -12.722 1.955 -7.701 {"}'P' P -12.966 2.037 -7.821 {"}'P' -12.927 2.067 -7.757 {"}'P' P -11.633 2.011 -7.637 {"}'P' -11.648 2.02 -7.622 {"}'P' P -11.802 1.813 -7.646 {"}'P' -11.822 1.835 -7.62 {"}'P' P -12.019 1.67 -7.652 {"}'P' -12.057 1.748 -7.577 {"}'P' P -12.269 1.594 -7.655 {"}'P' -12.288 1.714 -7.55 {"}'P' P -12.529 1.592 -7.655 {"}'P' -12.511 1.719 -7.544 {"}'P' P -12.779 1.663 -7.652 {"}'P' -12.735 1.758 -7.561 {"}'P' P -13 1.802 -7.646 {"}'P' -12.961 1.845 -7.597 {"}'P' P -12.033 1.503 -7.437 {"}'P' -12.05 1.546 -7.413 {"}'P' P -12.28 1.443 -7.44 {"}'P' -12.289 1.518 -7.399 {"}'P' P -12.534 1.443 -7.44 {"}'P' -12.524 1.524 -7.396 {"}'P' P -12.781 1.503 -7.437 {"}'P' -12.758 1.561 -7.404 {"}'P' P -13.006 1.621 -7.432 {"}'P' -12.995 1.637 -7.422 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 6 A}'M' sky -8.937 2.664 -6.983 {"}'M' sky -9.389 1.747 -6.256 {"}'M' sky -8.982 2.213 -5.774 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 6 A}'M' sea -9.25 2.262 -7 {"}'M' sea -9.112 2.478 -6.991 {"}'M' sea -9.419 1.898 -6.762 {"}'M' green -9.349 2.145 -6.751 {"}'M' green -9.079 2.58 -6.732 {"}'M' sea -8.889 2.753 -6.725 {"}'M' sea -9.421 1.878 -6.504 {"}'M' green -8.896 2.737 -6.467 {"}'M' green -9.341 1.998 -6.245 {"}'M' green -8.931 2.636 -6.217 {"}'M' sea -8.722 2.784 -6.21 {"}'M' sea -9.247 1.976 -6.005 {"}'M' green -9.149 2.209 -5.994 {"}'M' green -9.005 2.418 -5.985 {"}'M' sea -8.822 2.594 -5.978 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 6 A}'M' greentint -9.234 2.375 -6.741 {"}'M' greentint -9.352 2.126 -6.493 {"}'M' greentint -9.239 2.357 -6.483 {"}'M' greentint -9.085 2.563 -6.474 {"}'M' greentint -9.246 2.236 -6.234 {"}'M' greentint -9.107 2.451 -6.225 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 231 A}'M' sea -9.277 2.664 -6.967 {"}'M' sea -9.413 2.443 -6.976 {"}'M' green -9.106 2.663 -6.759 {"}'M' green -9.216 2.429 -6.77 {"}'M' green -9.39 2.239 -6.778 {"}'M' sea -9.612 2.107 -6.784 {"}'M' sea -9.07 2.918 -6.748 {"}'M' green -9.453 2.064 -6.544 {"}'M' sea -8.97 2.899 -6.508 {"}'M' green -8.965 2.647 -6.26 {"}'M' green -9.393 2.049 -6.286 {"}'M' sea -9.619 1.94 -6.29 {"}'M' sea -8.936 2.896 -6.249 {"}'M' green -9.003 2.627 -6.001 {"}'M' green -9.099 2.394 -6.011 {"}'M' green -9.253 2.194 -6.02 {"}'M' sea -9.453 2.041 -6.027 {"}'M' sea -9.216 2.386 -5.77 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 231 A}'M' greentint -9.003 2.65 -6.518 {"}'M' greentint -9.099 2.417 -6.529 {"}'M' greentint -9.253 2.217 -6.537 {"}'M' greentint -9.056 2.414 -6.27 {"}'M' greentint -9.202 2.21 -6.279 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 6 A}'M' green -10.611 0.791 -5.762 {"}'M' green -10.411 0.944 -5.755 {"}'M' green -10.861 0.457 -5.517 {"}'M' green -10.123 1.077 -5.49 {"}'M' green -10.861 0.335 -5.264 {"}'M' green -10.786 0.196 -5.028 {"}'M' green -10.623 0.196 -4.821 {"}'M' green -10.365 0.302 -4.657 {"}'M' green -10.185 0.488 -4.649 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 6 A}'M' greentint -10.742 0.678 -5.508 {"}'M' greentint -10.572 0.862 -5.5 {"}'M' greentint -10.361 0.998 -5.494 {"}'M' greentint -10.765 0.568 -5.253 {"}'M' greentint -10.611 0.768 -5.245 {"}'M' greentint -10.411 0.921 -5.238 {"}'M' greentint -10.178 1.018 -5.234 {"}'M' greentint -10.712 0.443 -5.017 {"}'M' greentint -10.568 0.658 -5.008 {"}'M' greentint -10.368 0.82 -5.001 {"}'M' greentint -10.129 0.917 -4.997 {"}'M' greentint -10.529 0.438 -4.81 {"}'M' greentint -10.354 0.63 -4.802 {"}'M' greentint -10.122 0.746 -4.797 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 231 A}'M' green -10.445 1.099 -5.689 {"}'M' green -10.607 0.899 -5.698 {"}'M' green -10.817 0.751 -5.704 {"}'M' green -10.249 1.086 -5.498 {"}'M' green -10.099 1.076 -5.279 {"}'M' green -9.998 1.067 -5.038 {"}'M' green -10.926 0.254 -5.074 {"}'M' green -10.066 0.815 -4.795 {"}'M' green -10.63 0.302 -4.817 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 231 A}'M' greentint -10.39 0.869 -5.508 {"}'M' greentint -10.577 0.689 -5.516 {"}'M' greentint -10.801 0.558 -5.521 {"}'M' greentint -10.222 0.855 -5.289 {"}'M' greentint -10.388 0.663 -5.297 {"}'M' greentint -10.588 0.508 -5.304 {"}'M' greentint -10.816 0.396 -5.309 {"}'M' greentint -10.114 0.839 -5.048 {"}'M' greentint -10.271 0.637 -5.057 {"}'M' greentint -10.463 0.469 -5.064 {"}'M' greentint -10.684 0.339 -5.07 {"}'M' greentint -10.221 0.61 -4.804 {"}'M' greentint -10.411 0.437 -4.812 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n met B 212 1jmxB_214Y_234}P -12.317 -2.375 0.233 {"}-12.317 -2.375 0.233 { ca met B 212 1jmxB_214Y_234}-10.903 -2.284 -0.095 { c met B 212 1jmxB_214Y_234}-10.727 -1.212 -1.152 { o met B 212 1jmxB_214Y_234}-11.644 -0.957 -1.927 { c met B 212 1jmxB_214Y_234}P -10.727 -1.212 -1.152 { n leu B 213 1jmxB_214Y_234}-9.575 -0.542 -1.145 { ca leu B 213 1jmxB_214Y_234}-9.276 0.456 -2.165 { c leu B 213 1jmxB_214Y_234}-8.519 -0.282 -3.268 { o leu B 213 1jmxB_214Y_234}-7.959 -1.365 -3.049 { c leu B 213 1jmxB_214Y_234}P -8.519 -0.282 -3.268 { n tyr B 214 1jmxB_214Y_234}-8.538 0.292 -4.46 { ca tyr B 214 1jmxB_214Y_234}-7.825 -0.267 -5.591 { c tyr B 214 1jmxB_214Y_234}-7.444 0.877 -6.515 { o tyr B 214 1jmxB_214Y_234}-7.924 1.996 -6.344 { c tyr B 214 1jmxB_214Y_234}P -7.444 0.877 -6.515 { n thr B 215 1jmxB_214Y_234}-6.508 0.622 -7.423 { ca thr B 215 1jmxB_214Y_234}-6.104 1.624 -8.397 { c thr B 215 1jmxB_214Y_234}-6.347 0.981 -9.745 { o thr B 215 1jmxB_214Y_234}-6.352 -0.247 -9.859 { c thr B 215 1jmxB_214Y_234}P -6.347 0.981 -9.745 { n ile B 216 1jmxB_214Y_234}-6.602 1.796 -10.756 { ca ile B 216 1jmxB_214Y_234}-6.845 1.269 -12.091 { c ile B 216 1jmxB_214Y_234}-6.429 2.308 -13.118 { o ile B 216 1jmxB_214Y_234}-6.51 3.507 -12.859 { n leu B 232 1jmxB_214Y_234}P -6.305 6.153 -11.549 {"}-6.305 6.153 -11.549 { ca leu B 232 1jmxB_214Y_234}-7.454 6.457 -10.704 { c leu B 232 1jmxB_214Y_234}-7.501 5.584 -9.448 { o leu B 232 1jmxB_214Y_234}-6.962 4.476 -9.424 { c leu B 232 1jmxB_214Y_234}P -7.501 5.584 -9.448 { n tyr B 233 1jmxB_214Y_234}-8.13 6.102 -8.398 { ca tyr B 233 1jmxB_214Y_234}-8.313 5.34 -7.175 { c tyr B 233 1jmxB_214Y_234}-9.779 4.945 -7.143 { o tyr B 233 1jmxB_214Y_234}-10.656 5.717 -7.535 { c tyr B 233 1jmxB_214Y_234}P -9.779 4.945 -7.143 { n gly B 234 1jmxB_214Y_234}-10.032 3.715 -6.729 { ca gly B 234 1jmxB_214Y_234}-11.387 3.231 -6.656 { c gly B 234 1jmxB_214Y_234}-11.691 2.654 -5.293 { o gly B 234 1jmxB_214Y_234}-10.81 2.481 -4.442 { c gly B 234 1jmxB_214Y_234}P -11.691 2.654 -5.293 { n tyr B 235 1jmxB_214Y_234}-12.963 2.35 -5.101 { ca tyr B 235 1jmxB_214Y_234}-13.461 1.786 -3.869 { c tyr B 235 1jmxB_214Y_234}-14.352 0.62 -4.262 { o tyr B 235 1jmxB_214Y_234}-15.21 0.733 -5.139 { c tyr B 235 1jmxB_214Y_234}P -14.352 0.62 -4.262 { n leu B 236 1jmxB_214Y_234}-14.102 -0.512 -3.628 { ca leu B 236 1jmxB_214Y_234}-14.858 -1.726 -3.863 { c leu B 236 1jmxB_214Y_234}-15.519 -2.041 -2.531 { o leu B 236 1jmxB_214Y_234}-15.006 -1.669 -1.482 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n met B 212 1jmxB_214Y_234}P -12.317 -2.375 0.233 { ca met B 212 1jmxB_214Y_234}P -10.903 -2.284 -0.095 { n leu B 213 1jmxB_214Y_234}P -9.575 -0.542 -1.145 { ca leu B 213 1jmxB_214Y_234}P -9.276 0.456 -2.165 { n tyr B 214 1jmxB_214Y_234}P -8.538 0.292 -4.46 { ca tyr B 214 1jmxB_214Y_234}P -7.825 -0.267 -5.591 { n thr B 215 1jmxB_214Y_234}P -6.508 0.622 -7.423 { ca thr B 215 1jmxB_214Y_234}P -6.104 1.624 -8.397 { n ile B 216 1jmxB_214Y_234}P -6.602 1.796 -10.756 { ca ile B 216 1jmxB_214Y_234}P -6.845 1.269 -12.091 { n leu B 232 1jmxB_214Y_234}P -6.305 6.153 -11.549 { ca leu B 232 1jmxB_214Y_234}P -7.454 6.457 -10.704 { n tyr B 233 1jmxB_214Y_234}P -8.13 6.102 -8.398 { ca tyr B 233 1jmxB_214Y_234}P -8.313 5.34 -7.175 { n gly B 234 1jmxB_214Y_234}P -10.032 3.715 -6.729 { ca gly B 234 1jmxB_214Y_234}P -11.387 3.231 -6.656 {"}P -11.387 3.231 -6.656 { n tyr B 235 1jmxB_214Y_234}P -12.963 2.35 -5.101 { ca tyr B 235 1jmxB_214Y_234}P -13.461 1.786 -3.869 { n leu B 236 1jmxB_214Y_234}P -14.102 -0.512 -3.628 { ca leu B 236 1jmxB_214Y_234}P -14.858 -1.726 -3.863 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca met B 212 1jmxB_214Y_234}P -10.903 -2.284 -0.095 {"}-10.903 -2.284 -0.095 { ca leu B 213 1jmxB_214Y_234}-9.276 0.456 -2.165 { ca tyr B 214 1jmxB_214Y_234}-7.825 -0.267 -5.591 { ca thr B 215 1jmxB_214Y_234}-6.104 1.624 -8.397 { ca ile B 216 1jmxB_214Y_234}-6.845 1.269 -12.091 { ca leu B 232 1jmxB_214Y_234}P -7.454 6.457 -10.704 {"}-7.454 6.457 -10.704 { ca tyr B 233 1jmxB_214Y_234}-8.313 5.34 -7.175 { ca gly B 234 1jmxB_214Y_234}-11.387 3.231 -6.656 { ca tyr B 235 1jmxB_214Y_234}-13.461 1.786 -3.869 { ca leu B 236 1jmxB_214Y_234}-14.858 -1.726 -3.863 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca met B 212 1jmxB_214Y_234}P -10.903 -2.284 -0.095 { ca leu B 213 1jmxB_214Y_234}P -9.276 0.456 -2.165 { ca tyr B 214 1jmxB_214Y_234}P -7.825 -0.267 -5.591 { cb tyr B 214 1jmxB_214Y_234}-8.679 -1.312 -6.334 { cg tyr B 214 1jmxB_214Y_234}-9.93 -0.792 -7.013 { cd1 tyr B 214 1jmxB_214Y_234}-9.883 -0.276 -8.309 { ce1 tyr B 214 1jmxB_214Y_234}-11.042 0.162 -8.953 { cz tyr B 214 1jmxB_214Y_234}-12.261 0.09 -8.297 { oh tyr B 214 1jmxB_214Y_234}-13.396 0.518 -8.924 { cg tyr B 214 1jmxB_214Y_234}P -9.93 -0.792 -7.013 { cd2 tyr B 214 1jmxB_214Y_234}-11.172 -0.855 -6.372 { ce2 tyr B 214 1jmxB_214Y_234}-12.342 -0.415 -7.009 { cz tyr B 214 1jmxB_214Y_234}ghost -12.261 0.09 -8.297 { ca thr B 215 1jmxB_214Y_234}P -6.104 1.624 -8.397 { ca ile B 216 1jmxB_214Y_234}P -6.845 1.269 -12.091 { ca leu B 232 1jmxB_214Y_234}P -7.454 6.457 -10.704 { ca tyr B 233 1jmxB_214Y_234}P -8.313 5.34 -7.175 { ca tyr B 235 1jmxB_214Y_234}P -13.461 1.786 -3.869 { ca leu B 236 1jmxB_214Y_234}P -14.858 -1.726 -3.863 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr B 214 1jmxB_214Y_234}P -8.679 -1.312 -6.334 {"}P -8.679 -1.312 -6.334 { cd1 tyr B 214 1jmxB_214Y_234}P -9.883 -0.276 -8.309 { cd2 tyr B 214 1jmxB_214Y_234}P -11.172 -0.855 -6.372 { ce1 tyr B 214 1jmxB_214Y_234}P -11.042 0.162 -8.953 { ce2 tyr B 214 1jmxB_214Y_234}P -12.342 -0.415 -7.009 { oh tyr B 214 1jmxB_214Y_234}P -13.396 0.518 -8.924 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr B 214 1jmxB_214Y_234}P -7.825 -0.267 -5.591 { cb tyr B 214 1jmxB_214Y_234}-8.679 -1.312 -6.334 { cg tyr B 214 1jmxB_214Y_234}-9.93 -0.792 -7.013 { cd1 tyr B 214 1jmxB_214Y_234}-9.883 -0.276 -8.309 { ce1 tyr B 214 1jmxB_214Y_234}-11.042 0.162 -8.953 { cz tyr B 214 1jmxB_214Y_234}-12.261 0.09 -8.297 { oh tyr B 214 1jmxB_214Y_234}-13.396 0.518 -8.924 { cg tyr B 214 1jmxB_214Y_234}P -9.93 -0.792 -7.013 { cd2 tyr B 214 1jmxB_214Y_234}-11.172 -0.855 -6.372 { ce2 tyr B 214 1jmxB_214Y_234}-12.342 -0.415 -7.009 { cz tyr B 214 1jmxB_214Y_234}ghost -12.261 0.09 -8.297 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr B 214 1jmxB_214Y_234}P -8.679 -1.312 -6.334 {"}P -8.679 -1.312 -6.334 { cd1 tyr B 214 1jmxB_214Y_234}P -9.883 -0.276 -8.309 { cd2 tyr B 214 1jmxB_214Y_234}P -11.172 -0.855 -6.372 { ce1 tyr B 214 1jmxB_214Y_234}P -11.042 0.162 -8.953 { ce2 tyr B 214 1jmxB_214Y_234}P -12.342 -0.415 -7.009 { oh tyr B 214 1jmxB_214Y_234}P -13.396 0.518 -8.924 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 214 B}'P' sky -12.472 1.329 -7.064 {"}'P' sky -12.22 1.318 -6.802 {"}'P' sky -11.477 1.093 -6.812 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 214 B}'P' green -11.494 1.789 -8.492 {"}'P' green -11.238 1.838 -8.49 {"}'P' sea -10.977 1.848 -8.49 {"}'P' green -11.05 1.762 -8.243 {"}'P' sea -10.795 1.743 -8.244 {"}'P' sea -10.723 1.604 -8.014 {"}'P' green -10.985 1.48 -7.803 {"}'P' sea -10.727 1.445 -7.805 {"}'P' green -10.978 1.293 -7.62 { CE2 TYR 214 B}'P' green -11.704 1.214 -7.069 {"}'P' sea -11.469 1.101 -7.074 {"}'P' sea -11.962 1.281 -6.804 {"}'P' sea -11.712 1.205 -6.807 { CZ TYR 214 B}'P' green -12.131 1.834 -8.352 {"}'P' green -11.873 1.795 -8.353 {"}'P' green -11.623 1.719 -8.357 {"}'P' green -12.4 1.822 -8.09 {"}'P' green -12.457 1.766 -7.834 {"}'P' green -12.524 1.668 -7.588 {"}'P' green -12.454 1.554 -7.357 {"}'P' green -12.204 1.408 -7.147 {"}'P' green -11.946 1.373 -7.149 {"}'P' green -11.7 1.289 -7.152 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 214 B}'P' P -11.305 1.74 -8.244 {"}'P' -11.301 1.717 -8.255 {"}'P' P -11.235 1.626 -8.013 {"}'P' -11.229 1.583 -8.041 {"}'P' P -10.978 1.637 -8.013 {"}'P' -10.978 1.633 -8.015 {"}'P' P -11.245 1.466 -7.804 {"}'P' -11.241 1.443 -7.825 { CZ TYR 214 B}'P' P -12.139 1.823 -8.09 {"}'P' -12.141 1.787 -8.095 {"}'P' P -11.881 1.786 -8.092 {"}'P' -11.899 1.707 -8.102 {"}'P' P -11.631 1.71 -8.095 {"}'P' -11.66 1.636 -8.105 {"}'P' P -12.196 1.776 -7.834 {"}'P' -12.198 1.708 -7.852 {"}'P' P -11.936 1.746 -7.835 {"}'P' -11.96 1.624 -7.869 {"}'P' P -11.684 1.677 -7.838 {"}'P' -11.729 1.553 -7.874 {"}'P' P -11.446 1.57 -7.843 {"}'P' -11.488 1.494 -7.866 {"}'P' P -12.269 1.69 -7.587 {"}'P' -12.269 1.644 -7.607 {"}'P' P -12.014 1.671 -7.588 {"}'P' -12.031 1.564 -7.636 {"}'P' P -11.765 1.612 -7.591 {"}'P' -11.805 1.492 -7.647 {"}'P' P -11.529 1.516 -7.595 {"}'P' -11.572 1.431 -7.637 {"}'P' P -11.31 1.384 -7.601 {"}'P' -11.324 1.364 -7.611 {"}'P' P -12.197 1.565 -7.357 {"}'P' -12.198 1.54 -7.373 {"}'P' P -11.942 1.532 -7.358 {"}'P' -11.956 1.467 -7.4 {"}'P' P -11.696 1.457 -7.361 {"}'P' -11.72 1.398 -7.402 {"}'P' P -11.466 1.341 -7.367 {"}'P' -11.477 1.325 -7.378 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 234 B}'P' sky -11.419 1.394 -6.964 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 234 B}'P' sea -11.285 2.073 -8.498 {"}'P' sea -11.538 2.001 -8.501 {"}'P' sea -10.987 2.033 -8.36 {"}'P' green -11.181 1.871 -8.367 {"}'P' green -11.419 1.784 -8.371 {"}'P' green -11.673 1.784 -8.371 {"}'P' green -11.911 1.871 -8.367 {"}'P' green -10.941 1.809 -8.185 {"}'P' sea -10.757 1.786 -7.964 {"}'P' green -10.947 1.617 -7.971 {"}'P' green -10.828 1.587 -7.725 {"}'P' green -11.044 1.45 -7.731 {"}'P' green -12.433 1.756 -7.717 {"}'P' sea -10.998 1.429 -7.471 {"}'P' green -11.233 1.336 -7.475 {"}'P' green -12.395 1.658 -7.461 {"}'P' green -11.538 1.311 -7.216 {"}'P' green -12.251 1.555 -7.205 {"}'P' sea -11.673 1.394 -6.964 {"}'P' sea -11.92 1.455 -6.962 {"}'P' sea -12.145 1.573 -6.957 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 234 B}'P' P -11.158 1.666 -8.191 {"}'P' -11.168 1.686 -8.171 {"}'P' P -11.408 1.59 -8.194 {"}'P' -11.413 1.625 -8.164 {"}'P' P -11.668 1.588 -8.194 {"}'P' -11.661 1.639 -8.15 {"}'P' P -11.918 1.659 -8.191 {"}'P' -11.896 1.707 -8.145 {"}'P' P -12.139 1.798 -8.185 {"}'P' -12.13 1.807 -8.174 {"}'P' P -11.172 1.499 -7.976 {"}'P' -11.186 1.536 -7.955 {"}'P' P -11.419 1.439 -7.979 {"}'P' -11.426 1.495 -7.948 {"}'P' P -11.673 1.439 -7.979 {"}'P' -11.66 1.546 -7.921 {"}'P' P -11.92 1.499 -7.976 {"}'P' -11.878 1.608 -7.914 {"}'P' P -12.145 1.617 -7.971 {"}'P' -12.098 1.684 -7.928 {"}'P' P -12.335 1.786 -7.964 {"}'P' -12.328 1.792 -7.959 {"}'P' P -11.284 1.364 -7.735 {"}'P' -11.29 1.387 -7.728 {"}'P' P -11.538 1.334 -7.736 {"}'P' -11.539 1.433 -7.709 {"}'P' P -11.792 1.361 -7.735 {"}'P' -11.762 1.494 -7.697 {"}'P' P -12.034 1.443 -7.731 {"}'P' -11.978 1.559 -7.696 {"}'P' P -12.251 1.577 -7.725 {"}'P' -12.204 1.637 -7.705 {"}'P' P -11.483 1.295 -7.477 {"}'P' -11.485 1.344 -7.475 {"}'P' P -11.735 1.309 -7.476 {"}'P' -11.72 1.402 -7.472 {"}'P' P -11.979 1.376 -7.473 {"}'P' -11.943 1.468 -7.469 {"}'P' P -12.203 1.495 -7.468 {"}'P' -12.169 1.543 -7.466 {"}'P' P -11.792 1.338 -7.214 {"}'P' -11.788 1.354 -7.217 {"}'P' P -12.034 1.42 -7.211 {"}'P' -12.03 1.428 -7.212 @subgroup {1->2} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { O TYR 214 B}'M' P -9.109 2.735 -6.441 {"}'M' -9.106 2.733 -6.441 {"}'M' P -8.954 2.94 -6.432 {"}'M' -8.953 2.939 -6.432 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 214 B}'M' greentint -8.862 2.639 -7.16 {"}'M' greentint -8.697 2.839 -7.152 {"}'M' greentint -9.12 2.398 -6.951 {"}'M' greentint -9.02 2.631 -6.941 {"}'M' greentint -8.875 2.839 -6.932 {"}'M' greentint -8.691 3.013 -6.924 {"}'M' greentint -8.476 3.147 -6.918 {"}'M' greentint -9.265 2.132 -6.722 {"}'M' greentint -9.218 2.384 -6.711 {"}'M' greentint -9.125 2.622 -6.7 {"}'M' greentint -8.987 2.838 -6.691 {"}'M' greentint -8.812 3.024 -6.683 {"}'M' greentint -8.604 3.174 -6.676 {"}'M' greentint -9.294 2.258 -6.462 {"}'M' greentint -9.224 2.505 -6.451 {"}'M' greentint -8.764 3.113 -6.425 {"}'M' greentint -8.545 3.248 -6.419 {"}'M' greentint -9.296 2.238 -6.204 {"}'M' greentint -9.227 2.486 -6.193 {"}'M' greentint -9.114 2.717 -6.183 {"}'M' greentint -8.96 2.923 -6.174 {"}'M' greentint -8.771 3.097 -6.167 {"}'M' greentint -8.553 3.233 -6.161 {"}'M' greentint -9.216 2.358 -5.945 {"}'M' greentint -9.121 2.596 -5.934 {"}'M' greentint -8.982 2.811 -5.925 {"}'M' greentint -8.806 2.996 -5.917 {"}'M' greentint -8.597 3.144 -5.91 {"}'M' greentint -9.024 2.569 -5.694 {"}'M' greentint -8.88 2.778 -5.685 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H GLY 234 B}'M' P -8.453 2.582 -6.469 {"}'M' -8.453 2.582 -6.469 {"}'M' P -8.599 2.378 -6.478 {"}'M' -8.603 2.382 -6.477 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 234 B}'M' greentint -8.674 2.832 -7.166 {"}'M' greentint -8.81 2.611 -7.175 {"}'M' greentint -8.503 2.831 -6.958 {"}'M' greentint -8.613 2.597 -6.969 {"}'M' greentint -8.787 2.407 -6.977 {"}'M' greentint -9.009 2.275 -6.983 {"}'M' greentint -8.467 3.086 -6.947 {"}'M' greentint -8.4 2.818 -6.717 {"}'M' greentint -8.496 2.585 -6.728 {"}'M' greentint -8.65 2.385 -6.736 {"}'M' greentint -8.85 2.232 -6.743 {"}'M' greentint -9.083 2.135 -6.747 {"}'M' greentint -8.367 3.067 -6.707 {"}'M' greentint -8.362 2.815 -6.459 {"}'M' greentint -8.79 2.217 -6.485 {"}'M' greentint -9.016 2.108 -6.489 {"}'M' greentint -9.262 2.059 -6.492 {"}'M' greentint -8.366 3.312 -6.437 {"}'M' greentint -8.333 3.064 -6.448 {"}'M' greentint -8.4 2.795 -6.2 {"}'M' greentint -8.496 2.562 -6.21 {"}'M' greentint -8.65 2.362 -6.219 {"}'M' greentint -8.85 2.209 -6.226 {"}'M' greentint -9.083 2.113 -6.23 {"}'M' greentint -8.4 3.294 -6.179 {"}'M' greentint -8.367 3.045 -6.189 {"}'M' greentint -8.503 2.787 -5.959 {"}'M' greentint -8.613 2.554 -5.969 {"}'M' greentint -8.787 2.363 -5.978 {"}'M' greentint -9.009 2.232 -5.984 {"}'M' greentint -9.26 2.172 -5.986 {"}'M' greentint -8.467 3.042 -5.948 {"}'M' greentint -8.674 2.77 -5.753 {"}'M' greentint -8.81 2.549 -5.762 {"}'M' greentint -9.018 2.393 -5.769 {"}'M' greentint -8.626 3.025 -5.742 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 214 B}'M' green -9.818 1.526 -5.146 {"}'M' green -9.674 1.74 -5.137 {"}'M' green -9.967 1.397 -4.911 {"}'M' green -9.517 1.983 -4.885 {"}'M' green -10.027 1.253 -4.658 {"}'M' green -9.467 2.037 -4.624 {"}'M' sea -10 1.125 -4.404 {"}'M' sea -9.284 2.057 -4.364 {"}'M' sea -9.892 1.235 -4.158 {"}'M' green -9.818 1.482 -4.147 {"}'M' green -9.674 1.697 -4.138 {"}'M' green -9.474 1.859 -4.131 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 214 B}'M' greentint -9.871 1.63 -4.901 {"}'M' greentint -9.717 1.83 -4.892 {"}'M' greentint -9.967 1.496 -4.647 {"}'M' greentint -9.848 1.717 -4.638 {"}'M' greentint -9.678 1.901 -4.63 {"}'M' greentint -9.967 1.374 -4.394 {"}'M' greentint -9.871 1.607 -4.383 {"}'M' greentint -9.717 1.807 -4.375 {"}'M' greentint -9.517 1.96 -4.368 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 234 B}'M' sea -9.658 2.014 -5.087 {"}'M' green -9.781 1.793 -5.097 {"}'M' green -9.947 1.601 -5.105 {"}'M' sea -9.486 2.251 -4.836 {"}'M' green -9.557 2.005 -4.846 {"}'M' green -10.022 1.407 -4.872 {"}'M' sea -9.44 2.231 -4.582 {"}'M' sea -10.189 1.24 -4.625 {"}'M' sea -9.438 2.228 -4.324 {"}'M' green -9.507 1.98 -4.335 {"}'M' green -9.963 1.369 -4.361 {"}'M' sea -10.181 1.232 -4.367 {"}'M' green -9.56 1.964 -4.081 {"}'M' green -9.677 1.737 -4.091 {"}'M' green -9.835 1.536 -4.1 {"}'M' sea -10.029 1.368 -4.107 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 234 B}'M' greentint -9.673 1.777 -4.856 {"}'M' greentint -9.83 1.575 -4.865 {"}'M' greentint -9.51 1.984 -4.593 {"}'M' greentint -9.625 1.753 -4.603 {"}'M' greentint -9.78 1.548 -4.612 {"}'M' greentint -9.97 1.375 -4.62 {"}'M' greentint -9.62 1.749 -4.345 {"}'M' greentint -9.774 1.543 -4.354 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu A 565 1kdgA_567F_583}P -11.813 -1.556 1.257 {"}-11.813 -1.556 1.257 { ca leu A 565 1kdgA_567F_583}-11.016 -1.964 0.105 { c leu A 565 1kdgA_567F_583}-10.69 -0.759 -0.744 { o leu A 565 1kdgA_567F_583}-11.519 0.097 -0.944 { c leu A 565 1kdgA_567F_583}P -10.69 -0.759 -0.744 { n asn A 566 1kdgA_567F_583}-9.485 -0.749 -1.294 { ca asn A 566 1kdgA_567F_583}-9.051 0.272 -2.214 { c asn A 566 1kdgA_567F_583}-8.439 -0.346 -3.415 { o asn A 566 1kdgA_567F_583}-7.756 -1.397 -3.269 { c asn A 566 1kdgA_567F_583}P -8.439 -0.346 -3.415 { n phe A 567 1kdgA_567F_583}-8.623 0.284 -4.578 { ca phe A 567 1kdgA_567F_583}-8.042 -0.249 -5.833 { c phe A 567 1kdgA_567F_583}-7.655 0.87 -6.755 { o phe A 567 1kdgA_567F_583}-8.181 1.975 -6.679 { c phe A 567 1kdgA_567F_583}P -7.655 0.87 -6.755 { n trp A 568 1kdgA_567F_583}-6.742 0.564 -7.67 { ca trp A 568 1kdgA_567F_583}-6.33 1.546 -8.651 { c trp A 568 1kdgA_567F_583}-6.179 0.934 -10.013 { o trp A 568 1kdgA_567F_583}-5.891 -0.288 -10.128 { c trp A 568 1kdgA_567F_583}P -6.179 0.934 -10.013 { n arg A 569 1kdgA_567F_583}-6.261 1.774 -11.037 { ca arg A 569 1kdgA_567F_583}-6.069 1.348 -12.409 { c arg A 569 1kdgA_567F_583}-5.613 2.501 -13.27 { o arg A 569 1kdgA_567F_583}-6.112 3.599 -13.176 { n ala A 581 1kdgA_567F_583}P -7.279 5.825 -11.924 {"}-7.279 5.825 -11.924 { ca ala A 581 1kdgA_567F_583}-8.558 5.833 -11.247 { c ala A 581 1kdgA_567F_583}-8.323 5.122 -9.929 { o ala A 581 1kdgA_567F_583}-7.457 4.212 -9.83 { c ala A 581 1kdgA_567F_583}P -8.323 5.122 -9.929 { n gln A 582 1kdgA_567F_583}-9.008 5.596 -8.886 { ca gln A 582 1kdgA_567F_583}-9.01 4.95 -7.583 { c gln A 582 1kdgA_567F_583}-10.421 4.623 -7.177 { o gln A 582 1kdgA_567F_583}-11.306 5.402 -7.367 { c gln A 582 1kdgA_567F_583}P -10.421 4.623 -7.177 { n gly A 583 1kdgA_567F_583}-10.597 3.447 -6.611 { ca gly A 583 1kdgA_567F_583}-11.832 3.077 -5.994 { c gly A 583 1kdgA_567F_583}-11.641 2.946 -4.487 { o gly A 583 1kdgA_567F_583}-10.572 2.491 -3.966 { c gly A 583 1kdgA_567F_583}P -11.641 2.946 -4.487 { n thr A 584 1kdgA_567F_583}-12.692 3.332 -3.76 { ca thr A 584 1kdgA_567F_583}-12.737 3.121 -2.331 { c thr A 584 1kdgA_567F_583}-14.105 2.452 -2.056 { o thr A 584 1kdgA_567F_583}-15.152 2.994 -2.426 { c thr A 584 1kdgA_567F_583}P -14.105 2.452 -2.056 { n val A 585 1kdgA_567F_583}-14.098 1.33 -1.354 { ca val A 585 1kdgA_567F_583}-15.323 0.624 -1.055 { c val A 585 1kdgA_567F_583}-15.624 0.684 0.447 { o val A 585 1kdgA_567F_583}-14.726 0.516 1.266 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 565 1kdgA_567F_583}P -11.813 -1.556 1.257 { ca leu A 565 1kdgA_567F_583}P -11.016 -1.964 0.105 { n asn A 566 1kdgA_567F_583}P -9.485 -0.749 -1.294 { ca asn A 566 1kdgA_567F_583}P -9.051 0.272 -2.214 { n phe A 567 1kdgA_567F_583}P -8.623 0.284 -4.578 { ca phe A 567 1kdgA_567F_583}P -8.042 -0.249 -5.833 { n trp A 568 1kdgA_567F_583}P -6.742 0.564 -7.67 { ca trp A 568 1kdgA_567F_583}P -6.33 1.546 -8.651 { n arg A 569 1kdgA_567F_583}P -6.261 1.774 -11.037 { ca arg A 569 1kdgA_567F_583}P -6.069 1.348 -12.409 { n ala A 581 1kdgA_567F_583}P -7.279 5.825 -11.924 { ca ala A 581 1kdgA_567F_583}P -8.558 5.833 -11.247 { n gln A 582 1kdgA_567F_583}P -9.008 5.596 -8.886 { ca gln A 582 1kdgA_567F_583}P -9.01 4.95 -7.583 { n gly A 583 1kdgA_567F_583}P -10.597 3.447 -6.611 { ca gly A 583 1kdgA_567F_583}P -11.832 3.077 -5.994 {"}P -11.832 3.077 -5.994 { n thr A 584 1kdgA_567F_583}P -12.692 3.332 -3.76 { ca thr A 584 1kdgA_567F_583}P -12.737 3.121 -2.331 { n val A 585 1kdgA_567F_583}P -14.098 1.33 -1.354 { ca val A 585 1kdgA_567F_583}P -15.323 0.624 -1.055 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca leu A 565 1kdgA_567F_583}P -11.016 -1.964 0.105 {"}-11.016 -1.964 0.105 { ca asn A 566 1kdgA_567F_583}-9.051 0.272 -2.214 { ca phe A 567 1kdgA_567F_583}-8.042 -0.249 -5.833 { ca trp A 568 1kdgA_567F_583}-6.33 1.546 -8.651 { ca arg A 569 1kdgA_567F_583}-6.069 1.348 -12.409 { ca ala A 581 1kdgA_567F_583}P -8.558 5.833 -11.247 {"}-8.558 5.833 -11.247 { ca gln A 582 1kdgA_567F_583}-9.01 4.95 -7.583 { ca gly A 583 1kdgA_567F_583}-11.832 3.077 -5.994 { ca thr A 584 1kdgA_567F_583}-12.737 3.121 -2.331 { ca val A 585 1kdgA_567F_583}-15.323 0.624 -1.055 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca leu A 565 1kdgA_567F_583}P -11.016 -1.964 0.105 { ca asn A 566 1kdgA_567F_583}P -9.051 0.272 -2.214 { ca phe A 567 1kdgA_567F_583}P -8.042 -0.249 -5.833 { cb phe A 567 1kdgA_567F_583}-8.975 -1.239 -6.496 { cg phe A 567 1kdgA_567F_583}-10.255 -0.684 -7.026 { cd1 phe A 567 1kdgA_567F_583}-10.409 -0.213 -8.315 { ce1 phe A 567 1kdgA_567F_583}-11.649 0.216 -8.789 { cz phe A 567 1kdgA_567F_583}-12.784 0.17 -7.962 { cg phe A 567 1kdgA_567F_583}P -10.255 -0.684 -7.026 { cd2 phe A 567 1kdgA_567F_583}-11.405 -0.73 -6.215 { ce2 phe A 567 1kdgA_567F_583}-12.664 -0.334 -6.7 { cz phe A 567 1kdgA_567F_583}ghost -12.784 0.17 -7.962 { ca trp A 568 1kdgA_567F_583}P -6.33 1.546 -8.651 { ca arg A 569 1kdgA_567F_583}P -6.069 1.348 -12.409 { ca ala A 581 1kdgA_567F_583}P -8.558 5.833 -11.247 { ca gln A 582 1kdgA_567F_583}P -9.01 4.95 -7.583 { ca thr A 584 1kdgA_567F_583}P -12.737 3.121 -2.331 { ca val A 585 1kdgA_567F_583}P -15.323 0.624 -1.055 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 567 1kdgA_567F_583}P -8.975 -1.239 -6.496 {"}P -8.975 -1.239 -6.496 { cd1 phe A 567 1kdgA_567F_583}P -10.409 -0.213 -8.315 { cd2 phe A 567 1kdgA_567F_583}P -11.405 -0.73 -6.215 { ce1 phe A 567 1kdgA_567F_583}P -11.649 0.216 -8.789 { ce2 phe A 567 1kdgA_567F_583}P -12.664 -0.334 -6.7 { cz phe A 567 1kdgA_567F_583}P -12.784 0.17 -7.962 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 567 1kdgA_567F_583}P -8.042 -0.249 -5.833 { cb phe A 567 1kdgA_567F_583}-8.975 -1.239 -6.496 { cg phe A 567 1kdgA_567F_583}-10.255 -0.684 -7.026 { cd1 phe A 567 1kdgA_567F_583}-10.409 -0.213 -8.315 { ce1 phe A 567 1kdgA_567F_583}-11.649 0.216 -8.789 { cz phe A 567 1kdgA_567F_583}-12.784 0.17 -7.962 { cg phe A 567 1kdgA_567F_583}P -10.255 -0.684 -7.026 { cd2 phe A 567 1kdgA_567F_583}-11.405 -0.73 -6.215 { ce2 phe A 567 1kdgA_567F_583}-12.664 -0.334 -6.7 { cz phe A 567 1kdgA_567F_583}ghost -12.784 0.17 -7.962 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 567 1kdgA_567F_583}P -8.975 -1.239 -6.496 {"}P -8.975 -1.239 -6.496 { cd1 phe A 567 1kdgA_567F_583}P -10.409 -0.213 -8.315 { cd2 phe A 567 1kdgA_567F_583}P -11.405 -0.73 -6.215 { ce1 phe A 567 1kdgA_567F_583}P -11.649 0.216 -8.789 { ce2 phe A 567 1kdgA_567F_583}P -12.664 -0.334 -6.7 { cz phe A 567 1kdgA_567F_583}P -12.784 0.17 -7.962 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 567 A}'P' sky -11.405 0.925 -6.783 {"}'P' sky -11.275 1.014 -6.27 {"}'P' sky -11.283 1.003 -6.008 {"}'P' sky -11.601 0.946 -5.752 { CE1 PHE 567 A}'P' blue -11.842 1.68 -7.849 {"}'P' sky -11.592 1.534 -7.639 {"}'P' sky -11.585 1.347 -7.456 {"}'P' blue -11.331 1.306 -7.457 {"}'P' blue -11.402 1.106 -7.303 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 567 A}'P' sea -11.348 0.991 -6.53 {"}'P' green -11.535 1.014 -6.27 {"}'P' sea -11.544 1.002 -6.008 { CZ PHE 567 A}'P' green -12.719 1.856 -7.499 {"}'P' green -11.969 1.65 -7.508 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 567 A}'P' P -12.276 1.371 -6.756 {"}'P' -12.313 1.207 -6.751 {"}'P' P -12.026 1.295 -6.76 {"}'P' -12.073 1.175 -6.755 {"}'P' P -11.791 1.182 -6.765 {"}'P' -11.813 1.143 -6.763 {"}'P' P -13.06 1.358 -6.495 {"}'P' -13.06 1.355 -6.496 {"}'P' P -12.803 1.398 -6.493 {"}'P' -12.794 1.291 -6.506 {"}'P' P -12.542 1.399 -6.493 {"}'P' -12.554 1.221 -6.515 {"}'P' P -12.284 1.362 -6.495 {"}'P' -12.327 1.169 -6.518 {"}'P' P -12.034 1.286 -6.498 {"}'P' -12.091 1.141 -6.516 {"}'P' P -11.799 1.174 -6.503 {"}'P' -11.833 1.114 -6.511 {"}'P' P -12.86 1.342 -6.237 {"}'P' -12.853 1.282 -6.254 {"}'P' P -12.599 1.352 -6.237 {"}'P' -12.604 1.218 -6.273 {"}'P' P -12.339 1.322 -6.238 {"}'P' -12.37 1.163 -6.282 {"}'P' P -12.087 1.253 -6.241 {"}'P' -12.133 1.128 -6.277 {"}'P' P -11.849 1.146 -6.246 {"}'P' -11.877 1.095 -6.261 {"}'P' P -12.672 1.266 -5.99 {"}'P' -12.672 1.221 -6.01 {"}'P' P -12.417 1.247 -5.991 {"}'P' -12.429 1.17 -6.025 {"}'P' P -12.168 1.188 -5.994 {"}'P' -12.189 1.126 -6.023 {"}'P' P -11.932 1.092 -5.998 {"}'P' -11.938 1.08 -6.003 { CZ PHE 567 A}'P' P -12.459 1.826 -7.5 {"}'P' -12.46 1.821 -7.501 {"}'P' P -12.207 1.757 -7.503 {"}'P' -12.211 1.748 -7.506 {"}'P' P -12.792 1.77 -7.252 {"}'P' -12.792 1.734 -7.268 {"}'P' P -12.537 1.751 -7.253 {"}'P' -12.55 1.666 -7.291 {"}'P' P -12.288 1.692 -7.256 {"}'P' -12.319 1.598 -7.3 {"}'P' P -12.052 1.596 -7.26 {"}'P' -12.086 1.53 -7.292 {"}'P' P -11.833 1.464 -7.266 {"}'P' -11.842 1.451 -7.272 {"}'P' P -12.977 1.634 -7.022 {"}'P' -12.973 1.609 -7.038 {"}'P' P -12.72 1.645 -7.022 {"}'P' -12.724 1.547 -7.084 {"}'P' P -12.465 1.612 -7.023 {"}'P' -12.495 1.477 -7.111 {"}'P' P -12.219 1.537 -7.026 {"}'P' -12.271 1.412 -7.112 {"}'P' P -11.989 1.421 -7.032 {"}'P' -12.038 1.345 -7.088 {"}'P' P -11.783 1.268 -7.038 {"}'P' -11.793 1.257 -7.047 {"}'P' P -12.987 1.474 -6.813 {"}'P' -12.983 1.45 -6.835 {"}'P' P -12.727 1.488 -6.812 {"}'P' -12.731 1.395 -6.893 {"}'P' P -12.469 1.453 -6.814 {"}'P' -12.5 1.328 -6.925 {"}'P' P -12.223 1.369 -6.817 {"}'P' -12.273 1.262 -6.92 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 583 A}'P' blue -11.745 1.924 -7.477 {"}'P' sky -11.801 1.264 -5.72 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 583 A}'P' green -11.824 1.533 -7.354 {"}'P' sea -11.432 1.233 -6.452 {"}'P' sea -11.471 1.227 -6.192 {"}'P' sea -11.59 1.235 -5.944 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 583 A}'P' P -12.181 1.663 -7.488 {"}'P' -12.181 1.677 -7.455 {"}'P' P -12.435 1.727 -7.485 {"}'P' -12.426 1.741 -7.446 {"}'P' P -12.062 1.446 -7.358 {"}'P' -12.071 1.494 -7.292 {"}'P' P -12.316 1.446 -7.358 {"}'P' -12.301 1.522 -7.252 {"}'P' P -12.554 1.533 -7.354 {"}'P' -12.516 1.593 -7.258 {"}'P' P -12.748 1.695 -7.347 {"}'P' -12.723 1.715 -7.305 {"}'P' P -11.801 1.328 -7.178 {"}'P' -11.808 1.342 -7.165 {"}'P' P -12.051 1.252 -7.181 {"}'P' -12.064 1.337 -7.107 {"}'P' P -12.311 1.25 -7.181 {"}'P' -12.293 1.376 -7.071 {"}'P' P -12.561 1.321 -7.178 {"}'P' -12.507 1.438 -7.067 {"}'P' P -12.782 1.46 -7.172 {"}'P' -12.722 1.527 -7.095 {"}'P' P -12.954 1.655 -7.164 {"}'P' -12.936 1.666 -7.146 {"}'P' P -11.815 1.161 -6.963 {"}'P' -11.822 1.178 -6.953 {"}'P' P -12.062 1.101 -6.966 {"}'P' -12.073 1.191 -6.917 {"}'P' P -12.316 1.101 -6.966 {"}'P' -12.299 1.236 -6.893 {"}'P' P -12.563 1.161 -6.963 {"}'P' -12.511 1.295 -6.887 {"}'P' P -12.788 1.279 -6.958 {"}'P' -12.723 1.371 -6.899 {"}'P' P -12.978 1.448 -6.951 {"}'P' -12.941 1.479 -6.926 {"}'P' P -11.687 1.112 -6.718 {"}'P' -11.688 1.114 -6.717 {"}'P' P -11.927 1.026 -6.722 {"}'P' -11.95 1.121 -6.695 {"}'P' P -12.181 0.996 -6.723 {"}'P' -12.182 1.157 -6.679 {"}'P' P -12.435 1.023 -6.722 {"}'P' -12.396 1.199 -6.672 {"}'P' P -12.677 1.105 -6.718 {"}'P' -12.612 1.24 -6.678 {"}'P' P -12.894 1.239 -6.712 {"}'P' -12.846 1.3 -6.692 {"}'P' P -11.876 0.998 -6.462 {"}'P' -11.901 1.086 -6.458 {"}'P' P -12.126 0.957 -6.464 {"}'P' -12.135 1.122 -6.457 {"}'P' P -12.378 0.971 -6.463 {"}'P' -12.346 1.165 -6.455 {"}'P' P -12.622 1.038 -6.46 {"}'P' -12.556 1.204 -6.453 {"}'P' P -12.846 1.157 -6.455 {"}'P' -12.781 1.251 -6.451 {"}'P' P -13.038 1.32 -6.448 {"}'P' -13.026 1.332 -6.448 {"}'P' P -11.927 1.003 -6.201 {"}'P' -11.943 1.072 -6.214 {"}'P' P -12.181 0.973 -6.203 {"}'P' -12.182 1.106 -6.227 {"}'P' P -12.435 1 -6.201 {"}'P' -12.403 1.148 -6.229 {"}'P' P -12.677 1.082 -6.198 {"}'P' -12.625 1.192 -6.221 {"}'P' P -12.894 1.217 -6.192 {"}'P' -12.863 1.256 -6.202 {"}'P' P -12.062 1.056 -5.951 {"}'P' -12.065 1.084 -5.963 {"}'P' P -12.316 1.056 -5.951 {"}'P' -12.309 1.117 -5.978 {"}'P' P -12.563 1.117 -5.949 {"}'P' -12.545 1.166 -5.971 {"}'P' P -12.788 1.235 -5.944 {"}'P' -12.787 1.237 -5.944 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 567 A}'M' greentint -9.377 2.377 -7.286 {"}'M' greentint -9.277 2.61 -7.276 {"}'M' greentint -9.522 2.111 -7.057 {"}'M' greentint -9.475 2.363 -7.046 {"}'M' greentint -9.382 2.601 -7.035 {"}'M' greentint -9.244 2.817 -7.026 {"}'M' greentint -9.069 3.003 -7.018 {"}'M' greentint -9.575 1.981 -6.808 {"}'M' greentint -9.551 2.237 -6.797 {"}'M' greentint -9.481 2.484 -6.786 {"}'M' greentint -9.366 2.714 -6.776 {"}'M' greentint -9.211 2.919 -6.767 {"}'M' greentint -9.021 3.092 -6.76 {"}'M' greentint -9.575 1.961 -6.55 {"}'M' greentint -9.553 2.217 -6.539 {"}'M' greentint -9.484 2.465 -6.528 {"}'M' greentint -9.371 2.696 -6.518 {"}'M' greentint -9.217 2.902 -6.509 {"}'M' greentint -9.028 3.076 -6.502 {"}'M' greentint -9.521 2.086 -6.291 {"}'M' greentint -9.473 2.337 -6.28 {"}'M' greentint -9.378 2.575 -6.269 {"}'M' greentint -9.239 2.79 -6.26 {"}'M' greentint -9.063 2.975 -6.252 {"}'M' greentint -9.429 2.066 -6.05 {"}'M' greentint -9.379 2.315 -6.04 {"}'M' greentint -9.281 2.548 -6.029 {"}'M' greentint -9.137 2.757 -6.02 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 583 A}'M' greentint -9.232 2.516 -7.289 {"}'M' greentint -9.368 2.295 -7.298 {"}'M' greentint -9.061 2.515 -7.081 {"}'M' greentint -9.171 2.281 -7.092 {"}'M' greentint -9.345 2.091 -7.1 {"}'M' greentint -9.025 2.77 -7.07 {"}'M' greentint -8.958 2.502 -6.84 {"}'M' greentint -9.054 2.269 -6.851 {"}'M' greentint -9.208 2.069 -6.859 {"}'M' greentint -9.408 1.916 -6.866 {"}'M' greentint -8.958 3.001 -6.819 {"}'M' greentint -8.925 2.751 -6.83 {"}'M' greentint -8.92 2.499 -6.582 {"}'M' greentint -9.011 2.266 -6.592 {"}'M' greentint -9.157 2.062 -6.601 {"}'M' greentint -9.348 1.901 -6.608 {"}'M' greentint -8.924 2.996 -6.56 {"}'M' greentint -8.891 2.748 -6.571 {"}'M' greentint -8.958 2.479 -6.323 {"}'M' greentint -9.054 2.246 -6.333 {"}'M' greentint -9.208 2.046 -6.342 {"}'M' greentint -9.408 1.893 -6.349 {"}'M' greentint -8.958 2.978 -6.302 {"}'M' greentint -8.925 2.729 -6.312 {"}'M' greentint -9.061 2.471 -6.082 {"}'M' greentint -9.171 2.238 -6.092 {"}'M' greentint -9.345 2.047 -6.101 {"}'M' greentint -9.025 2.726 -6.071 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 567 A}'M' green -9.982 1.624 -4.923 {"}'M' green -9.628 1.977 -4.907 {"}'M' green -9.34 2.11 -4.642 {"}'M' green -10.003 1.229 -4.18 {"}'M' green -9.84 1.229 -3.973 {"}'M' green -9.339 1.779 -3.949 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 567 A}'M' greentint -9.828 1.824 -4.914 {"}'M' greentint -10.078 1.49 -4.669 {"}'M' greentint -9.959 1.711 -4.66 {"}'M' greentint -9.789 1.895 -4.652 {"}'M' greentint -9.578 2.031 -4.646 {"}'M' greentint -10.078 1.368 -4.416 {"}'M' greentint -9.982 1.601 -4.405 {"}'M' greentint -9.828 1.801 -4.397 {"}'M' greentint -9.628 1.954 -4.39 {"}'M' greentint -9.395 2.051 -4.386 {"}'M' greentint -9.929 1.476 -4.169 {"}'M' greentint -9.785 1.691 -4.16 {"}'M' greentint -9.585 1.853 -4.153 {"}'M' greentint -9.346 1.95 -4.149 {"}'M' greentint -9.746 1.471 -3.962 {"}'M' greentint -9.571 1.663 -3.954 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 583 A}'M' green -9.57 2.034 -4.83 {"}'M' green -10.122 1.506 -4.853 {"}'M' green -10.137 1.344 -4.641 {"}'M' green -9.272 1.994 -4.117 {"}'M' green -9.382 1.759 -3.869 {"}'M' green -9.725 1.379 -3.885 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 583 A}'M' greentint -9.711 1.817 -4.84 {"}'M' greentint -9.898 1.637 -4.848 {"}'M' greentint -9.42 2.024 -4.611 {"}'M' greentint -9.543 1.803 -4.621 {"}'M' greentint -9.709 1.611 -4.629 {"}'M' greentint -9.909 1.456 -4.636 {"}'M' greentint -9.319 2.015 -4.37 {"}'M' greentint -9.435 1.787 -4.38 {"}'M' greentint -9.592 1.585 -4.389 {"}'M' greentint -9.784 1.417 -4.396 {"}'M' greentint -10.005 1.287 -4.402 {"}'M' greentint -9.387 1.763 -4.127 {"}'M' greentint -9.542 1.558 -4.136 {"}'M' greentint -9.732 1.385 -4.144 {"}'M' greentint -9.951 1.25 -4.149 {"}'M' greentint -9.536 1.553 -3.878 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ile A 142 1khbA_144F_157}P -12.043 -2.115 0.155 {"}-12.043 -2.115 0.155 { ca ile A 142 1khbA_144F_157}-10.948 -2.402 -0.769 { c ile A 142 1khbA_144F_157}-10.531 -1.118 -1.51 { o ile A 142 1khbA_144F_157}-11.261 -0.661 -2.397 { c ile A 142 1khbA_144F_157}P -10.531 -1.118 -1.51 { n pro A 143 1khbA_144F_157}-9.391 -0.506 -1.159 { ca pro A 143 1khbA_144F_157}-8.909 0.646 -1.917 { c pro A 143 1khbA_144F_157}-8.144 0.067 -3.117 { o pro A 143 1khbA_144F_157}-7.218 -0.738 -2.941 { c pro A 143 1khbA_144F_157}P -8.144 0.067 -3.117 { n phe A 144 1khbA_144F_157}-8.497 0.482 -4.324 { ca phe A 144 1khbA_144F_157}-7.791 -0.086 -5.451 { c phe A 144 1khbA_144F_157}-7.445 0.954 -6.524 { o phe A 144 1khbA_144F_157}-8.198 1.896 -6.776 { c phe A 144 1khbA_144F_157}P -7.445 0.954 -6.524 { n ser A 145 1khbA_144F_157}-6.383 0.664 -7.249 { ca ser A 145 1khbA_144F_157}-5.955 1.524 -8.357 { c ser A 145 1khbA_144F_157}-6.1 0.781 -9.688 { o ser A 145 1khbA_144F_157}-5.591 -0.375 -9.813 { c ser A 145 1khbA_144F_157}P -6.1 0.781 -9.688 { n met A 146 1khbA_144F_157}-6.755 1.428 -10.66 { ca met A 146 1khbA_144F_157}-6.855 0.935 -12.046 { c met A 146 1khbA_144F_157}-5.749 1.667 -12.81 { o met A 146 1khbA_144F_157}-5.801 2.891 -12.947 { n lys A 155 1khbA_144F_157}P -6.85 5.633 -12.217 {"}-6.85 5.633 -12.217 { ca lys A 155 1khbA_144F_157}-8.018 6.104 -11.51 { c lys A 155 1khbA_144F_157}-8.162 5.186 -10.303 { o lys A 155 1khbA_144F_157}-7.825 3.995 -10.417 { c lys A 155 1khbA_144F_157}P -8.162 5.186 -10.303 { n ile A 156 1khbA_144F_157}-8.61 5.747 -9.198 { ca ile A 156 1khbA_144F_157}-8.785 4.969 -7.967 { c ile A 156 1khbA_144F_157}-10.254 4.759 -7.593 { o ile A 156 1khbA_144F_157}-11.127 5.616 -7.849 { c ile A 156 1khbA_144F_157}P -10.254 4.759 -7.593 { n gly A 157 1khbA_144F_157}-10.542 3.655 -6.92 { ca gly A 157 1khbA_144F_157}-11.883 3.412 -6.456 { c gly A 157 1khbA_144F_157}-11.788 2.827 -5.07 { o gly A 157 1khbA_144F_157}-10.709 2.439 -4.583 { c gly A 157 1khbA_144F_157}P -11.788 2.827 -5.07 { n ile A 158 1khbA_144F_157}-12.92 2.807 -4.398 { ca ile A 158 1khbA_144F_157}-13.007 2.145 -3.105 { c ile A 158 1khbA_144F_157}-14.137 1.168 -3.268 { o ile A 158 1khbA_144F_157}-15.218 1.61 -3.624 { c ile A 158 1khbA_144F_157}P -14.137 1.168 -3.268 { n glu A 159 1khbA_144F_157}-13.933 -0.15 -3.069 { ca glu A 159 1khbA_144F_157}-15.097 -1.034 -3.237 { c glu A 159 1khbA_144F_157}-15.472 -1.552 -1.874 { o glu A 159 1khbA_144F_157}-14.63 -2.12 -1.217 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 142 1khbA_144F_157}P -12.043 -2.115 0.155 { ca ile A 142 1khbA_144F_157}P -10.948 -2.402 -0.769 { ca pro A 143 1khbA_144F_157}P -8.909 0.646 -1.917 { n phe A 144 1khbA_144F_157}P -8.497 0.482 -4.324 { ca phe A 144 1khbA_144F_157}P -7.791 -0.086 -5.451 { n ser A 145 1khbA_144F_157}P -6.383 0.664 -7.249 { ca ser A 145 1khbA_144F_157}P -5.955 1.524 -8.357 { n met A 146 1khbA_144F_157}P -6.755 1.428 -10.66 { ca met A 146 1khbA_144F_157}P -6.855 0.935 -12.046 { n lys A 155 1khbA_144F_157}P -6.85 5.633 -12.217 { ca lys A 155 1khbA_144F_157}P -8.018 6.104 -11.51 { n ile A 156 1khbA_144F_157}P -8.61 5.747 -9.198 { ca ile A 156 1khbA_144F_157}P -8.785 4.969 -7.967 { n gly A 157 1khbA_144F_157}P -10.542 3.655 -6.92 { ca gly A 157 1khbA_144F_157}P -11.883 3.412 -6.456 {"}P -11.883 3.412 -6.456 { n ile A 158 1khbA_144F_157}P -12.92 2.807 -4.398 { ca ile A 158 1khbA_144F_157}P -13.007 2.145 -3.105 { n glu A 159 1khbA_144F_157}P -13.933 -0.15 -3.069 { ca glu A 159 1khbA_144F_157}P -15.097 -1.034 -3.237 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ile A 142 1khbA_144F_157}P -10.948 -2.402 -0.769 {"}-10.948 -2.402 -0.769 { ca pro A 143 1khbA_144F_157}-8.909 0.646 -1.917 { ca phe A 144 1khbA_144F_157}-7.791 -0.086 -5.451 { ca ser A 145 1khbA_144F_157}-5.955 1.524 -8.357 { ca met A 146 1khbA_144F_157}-6.855 0.935 -12.046 { ca lys A 155 1khbA_144F_157}P -8.018 6.104 -11.51 {"}-8.018 6.104 -11.51 { ca ile A 156 1khbA_144F_157}-8.785 4.969 -7.967 { ca gly A 157 1khbA_144F_157}-11.883 3.412 -6.456 { ca ile A 158 1khbA_144F_157}-13.007 2.145 -3.105 { ca glu A 159 1khbA_144F_157}-15.097 -1.034 -3.237 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile A 142 1khbA_144F_157}P -10.948 -2.402 -0.769 { ca pro A 143 1khbA_144F_157}P -8.909 0.646 -1.917 { n pro A 143 1khbA_144F_157}P -9.391 -0.506 -1.159 { ca phe A 144 1khbA_144F_157}P -7.791 -0.086 -5.451 { cb phe A 144 1khbA_144F_157}-8.614 -1.268 -6.094 { cg phe A 144 1khbA_144F_157}-9.976 -0.845 -6.697 { cd1 phe A 144 1khbA_144F_157}-10.098 -0.568 -8.071 { ce1 phe A 144 1khbA_144F_157}-11.312 -0.12 -8.627 { cz phe A 144 1khbA_144F_157}-12.458 -0.006 -7.831 { cg phe A 144 1khbA_144F_157}P -9.976 -0.845 -6.697 { cd2 phe A 144 1khbA_144F_157}-11.113 -0.729 -5.913 { ce2 phe A 144 1khbA_144F_157}-12.34 -0.283 -6.438 { cz phe A 144 1khbA_144F_157}ghost -12.458 -0.006 -7.831 { ca ser A 145 1khbA_144F_157}P -5.955 1.524 -8.357 { ca met A 146 1khbA_144F_157}P -6.855 0.935 -12.046 { ca lys A 155 1khbA_144F_157}P -8.018 6.104 -11.51 { ca ile A 156 1khbA_144F_157}P -8.785 4.969 -7.967 { ca ile A 158 1khbA_144F_157}P -13.007 2.145 -3.105 { ca glu A 159 1khbA_144F_157}P -15.097 -1.034 -3.237 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 144 1khbA_144F_157}P -8.614 -1.268 -6.094 {"}P -8.614 -1.268 -6.094 { cd1 phe A 144 1khbA_144F_157}P -10.098 -0.568 -8.071 { cd2 phe A 144 1khbA_144F_157}P -11.113 -0.729 -5.913 { ce1 phe A 144 1khbA_144F_157}P -11.312 -0.12 -8.627 { ce2 phe A 144 1khbA_144F_157}P -12.34 -0.283 -6.438 { cz phe A 144 1khbA_144F_157}P -12.458 -0.006 -7.831 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 144 1khbA_144F_157}P -7.791 -0.086 -5.451 { cb phe A 144 1khbA_144F_157}-8.614 -1.268 -6.094 { cg phe A 144 1khbA_144F_157}-9.976 -0.845 -6.697 { cd1 phe A 144 1khbA_144F_157}-10.098 -0.568 -8.071 { ce1 phe A 144 1khbA_144F_157}-11.312 -0.12 -8.627 { cz phe A 144 1khbA_144F_157}-12.458 -0.006 -7.831 { cg phe A 144 1khbA_144F_157}P -9.976 -0.845 -6.697 { cd2 phe A 144 1khbA_144F_157}-11.113 -0.729 -5.913 { ce2 phe A 144 1khbA_144F_157}-12.34 -0.283 -6.438 { cz phe A 144 1khbA_144F_157}ghost -12.458 -0.006 -7.831 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 144 1khbA_144F_157}P -8.614 -1.268 -6.094 {"}P -8.614 -1.268 -6.094 { cd1 phe A 144 1khbA_144F_157}P -10.098 -0.568 -8.071 { cd2 phe A 144 1khbA_144F_157}P -11.113 -0.729 -5.913 { ce1 phe A 144 1khbA_144F_157}P -11.312 -0.12 -8.627 { ce2 phe A 144 1khbA_144F_157}P -12.34 -0.283 -6.438 { cz phe A 144 1khbA_144F_157}P -12.458 -0.006 -7.831 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 144 A}'P' sky -12.8 1.375 -6.755 {"}'P' sky -12.728 1.422 -6.494 { CZ PHE 144 A}'P' sky -12.401 1.715 -8.146 {"}'P' sky -13.156 1.532 -7.374 {"}'P' sky -12.902 1.404 -6.894 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 144 A}'P' sea -12.544 1.426 -6.753 {"}'P' sea -12.283 1.438 -6.753 {"}'P' sea -12.023 1.409 -6.754 {"}'P' sea -12.47 1.461 -6.493 { CZ PHE 144 A}'P' sea -12.846 1.699 -7.887 {"}'P' green -12.588 1.738 -7.886 {"}'P' green -12.328 1.738 -7.886 {"}'P' green -12.07 1.699 -7.887 {"}'P' sea -13.103 1.608 -7.63 {"}'P' green -12.854 1.686 -7.626 {"}'P' green -12.078 1.69 -7.626 {"}'P' sea -11.828 1.614 -7.629 {"}'P' green -12.91 1.621 -7.37 {"}'P' green -11.881 1.581 -7.372 {"}'P' sea -12.969 1.511 -7.125 {"}'P' green -12.721 1.572 -7.122 {"}'P' green -11.962 1.516 -7.125 {"}'P' green -12.651 1.458 -6.891 {"}'P' green -12.394 1.469 -6.891 {"}'P' sea -12.139 1.436 -6.892 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 144 A}'P' P -12.597 1.726 -7.624 {"}'P' -12.595 1.704 -7.627 {"}'P' P -12.336 1.727 -7.624 {"}'P' -12.338 1.697 -7.628 {"}'P' P -12.654 1.67 -7.368 {"}'P' -12.65 1.638 -7.377 {"}'P' P -12.393 1.68 -7.368 {"}'P' -12.395 1.63 -7.381 {"}'P' P -12.133 1.65 -7.369 {"}'P' -12.137 1.631 -7.374 {"}'P' P -12.466 1.594 -7.121 {"}'P' -12.466 1.574 -7.13 {"}'P' P -12.211 1.575 -7.122 {"}'P' -12.212 1.571 -7.124 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 157 A}'P' sky -11.904 1.684 -6.917 {"}'P' sky -12.78 1.712 -6.668 {"}'P' sky -12.528 1.781 -6.443 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 157 A}'P' sea -12.018 1.923 -7.897 {"}'P' green -12.268 1.847 -7.9 {"}'P' green -12.528 1.845 -7.9 {"}'P' sea -12.778 1.916 -7.897 {"}'P' sea -11.807 1.874 -7.677 {"}'P' green -12.032 1.756 -7.682 {"}'P' green -12.78 1.756 -7.682 {"}'P' sea -13.005 1.874 -7.677 {"}'P' green -11.904 1.707 -7.437 {"}'P' green -12.894 1.7 -7.437 {"}'P' sea -13.111 1.834 -7.431 {"}'P' sea -11.858 1.686 -7.177 {"}'P' green -12.093 1.593 -7.181 {"}'P' green -12.839 1.633 -7.179 {"}'P' sea -13.063 1.752 -7.174 {"}'P' green -12.144 1.598 -6.92 {"}'P' green -12.398 1.568 -6.922 {"}'P' green -12.652 1.595 -6.92 {"}'P' sea -12.894 1.677 -6.917 {"}'P' sea -12.279 1.651 -6.67 {"}'P' sea -12.533 1.651 -6.67 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 157 A}'P' P -12.279 1.696 -7.685 {"}'P' -12.281 1.71 -7.677 {"}'P' P -12.533 1.696 -7.685 {"}'P' -12.531 1.713 -7.675 {"}'P' P -12.144 1.621 -7.441 {"}'P' -12.15 1.643 -7.434 {"}'P' P -12.398 1.591 -7.442 {"}'P' -12.398 1.642 -7.428 {"}'P' P -12.652 1.618 -7.441 {"}'P' -12.645 1.65 -7.432 {"}'P' P -12.343 1.552 -7.183 {"}'P' -12.344 1.581 -7.182 {"}'P' P -12.595 1.566 -7.182 {"}'P' -12.592 1.587 -7.181 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 144 A}'M' green -9.149 2.739 -7.364 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 144 A}'M' greentint -9.294 2.531 -7.373 {"}'M' greentint -9.492 2.284 -7.143 {"}'M' greentint -9.399 2.522 -7.132 {"}'M' greentint -9.261 2.738 -7.123 {"}'M' greentint -9.086 2.924 -7.115 {"}'M' greentint -9.568 2.158 -6.894 {"}'M' greentint -9.498 2.405 -6.883 {"}'M' greentint -9.383 2.635 -6.873 {"}'M' greentint -9.228 2.84 -6.864 {"}'M' greentint -9.038 3.013 -6.857 {"}'M' greentint -9.57 2.138 -6.636 {"}'M' greentint -9.501 2.386 -6.625 {"}'M' greentint -9.388 2.617 -6.615 {"}'M' greentint -9.234 2.823 -6.606 {"}'M' greentint -9.045 2.997 -6.599 {"}'M' greentint -9.49 2.258 -6.377 {"}'M' greentint -9.395 2.496 -6.366 {"}'M' greentint -9.256 2.711 -6.357 {"}'M' greentint -9.08 2.896 -6.349 {"}'M' greentint -9.298 2.469 -6.126 {"}'M' greentint -9.154 2.678 -6.117 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 157 A}'M' greentint -9.051 2.715 -7.204 {"}'M' greentint -9.161 2.481 -7.215 {"}'M' greentint -9.335 2.291 -7.223 {"}'M' greentint -8.948 2.702 -6.963 {"}'M' greentint -9.044 2.469 -6.974 {"}'M' greentint -9.198 2.269 -6.982 {"}'M' greentint -9.398 2.116 -6.989 {"}'M' greentint -8.915 2.951 -6.953 {"}'M' greentint -8.91 2.699 -6.705 {"}'M' greentint -9.001 2.466 -6.715 {"}'M' greentint -9.147 2.262 -6.724 {"}'M' greentint -9.338 2.101 -6.731 {"}'M' greentint -9.564 1.992 -6.735 {"}'M' greentint -8.881 2.948 -6.694 {"}'M' greentint -8.948 2.679 -6.446 {"}'M' greentint -9.044 2.446 -6.456 {"}'M' greentint -9.198 2.246 -6.465 {"}'M' greentint -9.398 2.093 -6.472 {"}'M' greentint -8.915 2.929 -6.435 {"}'M' greentint -9.051 2.671 -6.205 {"}'M' greentint -9.161 2.438 -6.215 {"}'M' greentint -9.335 2.247 -6.224 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 144 A}'M' greentint -10.066 1.296 -5.028 {"}'M' greentint -9.992 1.543 -5.017 {"}'M' greentint -9.848 1.757 -5.008 {"}'M' greentint -9.648 1.92 -5.001 {"}'M' greentint -10.174 1.164 -4.793 {"}'M' greentint -10.141 1.414 -4.782 {"}'M' greentint -10.045 1.647 -4.772 {"}'M' greentint -9.891 1.847 -4.763 {"}'M' greentint -9.691 2 -4.756 {"}'M' greentint -9.458 2.096 -4.752 {"}'M' greentint -10.201 1.27 -4.529 {"}'M' greentint -10.141 1.513 -4.518 {"}'M' greentint -10.022 1.734 -4.509 {"}'M' greentint -9.852 1.918 -4.501 {"}'M' greentint -9.641 2.054 -4.495 {"}'M' greentint -9.403 2.133 -4.491 {"}'M' greentint -10.141 1.391 -4.265 {"}'M' greentint -10.045 1.624 -4.254 {"}'M' greentint -9.891 1.824 -4.246 {"}'M' greentint -9.691 1.977 -4.239 {"}'M' greentint -9.458 2.074 -4.235 {"}'M' greentint -9.992 1.499 -4.018 {"}'M' greentint -9.848 1.714 -4.009 {"}'M' greentint -9.648 1.876 -4.002 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 157 A}'M' green -9.554 1.925 -3.981 {"}'M' green -10.039 1.354 -4.006 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 157 A}'M' greentint -9.456 1.963 -4.987 {"}'M' greentint -9.572 1.735 -4.997 {"}'M' greentint -9.729 1.533 -5.006 {"}'M' greentint -9.921 1.365 -5.013 {"}'M' greentint -9.409 1.942 -4.734 {"}'M' greentint -9.524 1.711 -4.744 {"}'M' greentint -9.679 1.506 -4.753 {"}'M' greentint -9.869 1.333 -4.761 {"}'M' greentint -10.088 1.198 -4.766 {"}'M' greentint -9.406 1.938 -4.476 {"}'M' greentint -9.519 1.707 -4.486 {"}'M' greentint -9.673 1.501 -4.495 {"}'M' greentint -9.862 1.327 -4.502 {"}'M' greentint -10.08 1.19 -4.508 {"}'M' greentint -9.459 1.922 -4.222 {"}'M' greentint -9.576 1.695 -4.232 {"}'M' greentint -9.734 1.494 -4.241 {"}'M' greentint -9.928 1.326 -4.248 {"}'M' greentint -10.15 1.199 -4.254 {"}'M' greentint -9.676 1.703 -3.99 {"}'M' greentint -9.84 1.51 -3.999 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n thr A 143 1lwdA_145F_179}P -11.772 -1.434 0.998 {"}-11.772 -1.434 0.998 { ca thr A 143 1lwdA_145F_179}-11.143 -2.151 -0.092 { c thr A 143 1lwdA_145F_179}-10.877 -1.076 -1.14 { o thr A 143 1lwdA_145F_179}-11.809 -0.558 -1.747 { c thr A 143 1lwdA_145F_179}P -10.877 -1.076 -1.14 { n asp A 144 1lwdA_145F_179}-9.611 -0.719 -1.334 { ca asp A 144 1lwdA_145F_179}-9.271 0.303 -2.312 { c asp A 144 1lwdA_145F_179}-8.277 -0.249 -3.315 { o asp A 144 1lwdA_145F_179}-7.503 -1.158 -3.006 { c asp A 144 1lwdA_145F_179}P -8.277 -0.249 -3.315 { n phe A 145 1lwdA_145F_179}-8.301 0.305 -4.521 { ca phe A 145 1lwdA_145F_179}-7.429 -0.177 -5.577 { c phe A 145 1lwdA_145F_179}-7.126 0.874 -6.63 { o phe A 145 1lwdA_145F_179}-7.844 1.864 -6.775 { c phe A 145 1lwdA_145F_179}P -7.126 0.874 -6.63 { n val A 146 1lwdA_145F_179}-6.054 0.636 -7.374 { ca val A 146 1lwdA_145F_179}-5.67 1.523 -8.456 { c val A 146 1lwdA_145F_179}-6.169 0.904 -9.761 { o val A 146 1lwdA_145F_179}-6.083 -0.308 -9.957 { c val A 146 1lwdA_145F_179}P -6.169 0.904 -9.761 { n val A 147 1lwdA_145F_179}-6.709 1.745 -10.634 { ca val A 147 1lwdA_145F_179}-7.201 1.321 -11.942 { c val A 147 1lwdA_145F_179}-6.144 1.833 -12.919 { o val A 147 1lwdA_145F_179}-5.789 3.01 -12.883 { n gly A 177 1lwdA_145F_179}P -7.125 5.553 -12.717 {"}-7.125 5.553 -12.717 { ca gly A 177 1lwdA_145F_179}-7.676 6.236 -11.562 { c gly A 177 1lwdA_145F_179}-7.646 5.366 -10.322 { o gly A 177 1lwdA_145F_179}-6.826 4.451 -10.217 { c gly A 177 1lwdA_145F_179}P -7.646 5.366 -10.322 { n val A 178 1lwdA_145F_179}-8.53 5.657 -9.371 { ca val A 178 1lwdA_145F_179}-8.61 4.883 -8.137 { c val A 178 1lwdA_145F_179}-10.059 4.636 -7.765 { o val A 178 1lwdA_145F_179}-10.949 5.413 -8.125 { c val A 178 1lwdA_145F_179}P -10.059 4.636 -7.765 { n gly A 179 1lwdA_145F_179}-10.284 3.548 -7.042 { ca gly A 179 1lwdA_145F_179}-11.626 3.212 -6.616 { c gly A 179 1lwdA_145F_179}-11.564 2.582 -5.245 { o gly A 179 1lwdA_145F_179}-10.515 2.086 -4.835 { c gly A 179 1lwdA_145F_179}P -11.564 2.582 -5.245 { n met A 180 1lwdA_145F_179}-12.676 2.627 -4.518 { ca met A 180 1lwdA_145F_179}-12.718 2.007 -3.204 { c met A 180 1lwdA_145F_179}-14.141 1.766 -2.754 { o met A 180 1lwdA_145F_179}-15.079 2.406 -3.227 { c met A 180 1lwdA_145F_179}P -14.141 1.766 -2.754 { n gly A 181 1lwdA_145F_179}-14.282 0.82 -1.838 { ca gly A 181 1lwdA_145F_179}-15.579 0.505 -1.289 { c gly A 181 1lwdA_145F_179}-15.39 0.401 0.206 { o gly A 181 1lwdA_145F_179}-14.338 -0.051 0.668 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 143 1lwdA_145F_179}P -11.772 -1.434 0.998 { ca thr A 143 1lwdA_145F_179}P -11.143 -2.151 -0.092 { n asp A 144 1lwdA_145F_179}P -9.611 -0.719 -1.334 { ca asp A 144 1lwdA_145F_179}P -9.271 0.303 -2.312 { n phe A 145 1lwdA_145F_179}P -8.301 0.305 -4.521 { ca phe A 145 1lwdA_145F_179}P -7.429 -0.177 -5.577 { n val A 146 1lwdA_145F_179}P -6.054 0.636 -7.374 { ca val A 146 1lwdA_145F_179}P -5.67 1.523 -8.456 { n val A 147 1lwdA_145F_179}P -6.709 1.745 -10.634 { ca val A 147 1lwdA_145F_179}P -7.201 1.321 -11.942 { n gly A 177 1lwdA_145F_179}P -7.125 5.553 -12.717 { ca gly A 177 1lwdA_145F_179}P -7.676 6.236 -11.562 {"}P -7.676 6.236 -11.562 { n val A 178 1lwdA_145F_179}P -8.53 5.657 -9.371 { ca val A 178 1lwdA_145F_179}P -8.61 4.883 -8.137 { n gly A 179 1lwdA_145F_179}P -10.284 3.548 -7.042 { ca gly A 179 1lwdA_145F_179}P -11.626 3.212 -6.616 {"}P -11.626 3.212 -6.616 { n met A 180 1lwdA_145F_179}P -12.676 2.627 -4.518 { ca met A 180 1lwdA_145F_179}P -12.718 2.007 -3.204 { n gly A 181 1lwdA_145F_179}P -14.282 0.82 -1.838 { ca gly A 181 1lwdA_145F_179}P -15.579 0.505 -1.289 {"}P -15.579 0.505 -1.289 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca thr A 143 1lwdA_145F_179}P -11.143 -2.151 -0.092 {"}-11.143 -2.151 -0.092 { ca asp A 144 1lwdA_145F_179}-9.271 0.303 -2.312 { ca phe A 145 1lwdA_145F_179}-7.429 -0.177 -5.577 { ca val A 146 1lwdA_145F_179}-5.67 1.523 -8.456 { ca val A 147 1lwdA_145F_179}-7.201 1.321 -11.942 { ca gly A 177 1lwdA_145F_179}-7.676 6.236 -11.562 { ca val A 178 1lwdA_145F_179}-8.61 4.883 -8.137 { ca gly A 179 1lwdA_145F_179}-11.626 3.212 -6.616 { ca met A 180 1lwdA_145F_179}-12.718 2.007 -3.204 { ca gly A 181 1lwdA_145F_179}-15.579 0.505 -1.289 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca thr A 143 1lwdA_145F_179}P -11.143 -2.151 -0.092 { ca asp A 144 1lwdA_145F_179}P -9.271 0.303 -2.312 { ca phe A 145 1lwdA_145F_179}P -7.429 -0.177 -5.577 { cb phe A 145 1lwdA_145F_179}-8.089 -1.37 -6.273 { cg phe A 145 1lwdA_145F_179}-9.507 -1.104 -6.711 { cd1 phe A 145 1lwdA_145F_179}-10.561 -1.217 -5.809 { ce1 phe A 145 1lwdA_145F_179}-11.87 -0.926 -6.196 { cz phe A 145 1lwdA_145F_179}-12.134 -0.517 -7.497 { cg phe A 145 1lwdA_145F_179}P -9.507 -1.104 -6.711 { cd2 phe A 145 1lwdA_145F_179}-9.785 -0.695 -8.012 { ce2 phe A 145 1lwdA_145F_179}-11.088 -0.401 -8.409 { cz phe A 145 1lwdA_145F_179}ghost -12.134 -0.517 -7.497 { ca val A 146 1lwdA_145F_179}P -5.67 1.523 -8.456 { ca val A 147 1lwdA_145F_179}P -7.201 1.321 -11.942 { ca val A 178 1lwdA_145F_179}P -8.61 4.883 -8.137 { ca met A 180 1lwdA_145F_179}P -12.718 2.007 -3.204 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 145 1lwdA_145F_179}P -8.089 -1.37 -6.273 {"}P -8.089 -1.37 -6.273 { cd1 phe A 145 1lwdA_145F_179}P -10.561 -1.217 -5.809 { cd2 phe A 145 1lwdA_145F_179}P -9.785 -0.695 -8.012 { ce1 phe A 145 1lwdA_145F_179}P -11.87 -0.926 -6.196 { ce2 phe A 145 1lwdA_145F_179}P -11.088 -0.401 -8.409 { cz phe A 145 1lwdA_145F_179}P -12.134 -0.517 -7.497 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 145 1lwdA_145F_179}P -7.429 -0.177 -5.577 { cb phe A 145 1lwdA_145F_179}-8.089 -1.37 -6.273 { cg phe A 145 1lwdA_145F_179}-9.507 -1.104 -6.711 { cd1 phe A 145 1lwdA_145F_179}-10.561 -1.217 -5.809 { ce1 phe A 145 1lwdA_145F_179}-11.87 -0.926 -6.196 { cz phe A 145 1lwdA_145F_179}-12.134 -0.517 -7.497 { cg phe A 145 1lwdA_145F_179}P -9.507 -1.104 -6.711 { cd2 phe A 145 1lwdA_145F_179}-9.785 -0.695 -8.012 { ce2 phe A 145 1lwdA_145F_179}-11.088 -0.401 -8.409 { cz phe A 145 1lwdA_145F_179}ghost -12.134 -0.517 -7.497 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 145 1lwdA_145F_179}P -8.089 -1.37 -6.273 {"}P -8.089 -1.37 -6.273 { cd1 phe A 145 1lwdA_145F_179}P -10.561 -1.217 -5.809 { cd2 phe A 145 1lwdA_145F_179}P -9.785 -0.695 -8.012 { ce1 phe A 145 1lwdA_145F_179}P -11.87 -0.926 -6.196 { ce2 phe A 145 1lwdA_145F_179}P -11.088 -0.401 -8.409 { cz phe A 145 1lwdA_145F_179}P -12.134 -0.517 -7.497 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 145 A}'P' blue -11.733 1.213 -8.208 {"}'P' blue -11.484 1.291 -8.204 {"}'P' blue -11.786 1.137 -7.952 {"}'P' blue -11.54 1.226 -7.948 {"}'P' blue -11.284 1.275 -7.946 {"}'P' blue -11.351 1.177 -7.7 { CZ PHE 145 A}'P' blue -12.134 1.138 -8.065 {"}'P' blue -12.594 1.141 -7.814 {"}'P' sky -12.338 1.192 -7.812 {"}'P' sky -11.817 1.175 -7.813 {"}'P' blue -11.496 1.112 -7.557 {"}'P' blue -11.504 1.103 -7.295 {"}'P' blue -12.586 1.11 -7.036 {"}'P' sky -11.809 1.139 -7.035 {"}'P' blue -11.557 1.07 -7.038 {"}'P' blue -12.142 1.083 -6.787 {"}'P' blue -11.887 1.064 -6.788 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 145 A}'P' sea -12.077 1.204 -7.812 {"}'P' sea -12.522 1.188 -7.553 {"}'P' sea -12.264 1.227 -7.552 {"}'P' green -12.004 1.227 -7.552 {"}'P' sea -11.746 1.188 -7.553 {"}'P' sea -12.53 1.175 -7.292 {"}'P' green -12.273 1.215 -7.29 {"}'P' green -12.012 1.216 -7.29 {"}'P' sea -11.754 1.179 -7.292 {"}'P' sea -12.33 1.159 -7.034 {"}'P' sea -12.069 1.169 -7.034 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 179 A}'P' blue -11.489 1.672 -7.877 {"}'P' blue -11.714 1.554 -7.882 {"}'P' sky -11.961 1.494 -7.885 {"}'P' sky -12.215 1.494 -7.885 {"}'P' blue -12.462 1.554 -7.882 {"}'P' blue -11.37 1.642 -7.631 {"}'P' sky -11.586 1.505 -7.637 {"}'P' sky -12.576 1.498 -7.637 {"}'P' sky -11.54 1.484 -7.377 {"}'P' blue -11.586 1.482 -7.117 {"}'P' sky -12.576 1.475 -7.117 {"}'P' sky -11.961 1.449 -6.87 {"}'P' sky -12.215 1.449 -6.87 {"}'P' blue -12.462 1.51 -6.868 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 179 A}'P' sea -11.826 1.419 -7.641 {"}'P' sea -12.08 1.389 -7.642 {"}'P' sea -12.334 1.416 -7.641 {"}'P' sea -11.775 1.391 -7.381 {"}'P' green -12.025 1.35 -7.383 {"}'P' green -12.277 1.364 -7.382 {"}'P' sea -12.521 1.431 -7.379 {"}'P' sea -11.826 1.396 -7.12 {"}'P' sea -12.08 1.366 -7.122 {"}'P' sea -12.334 1.393 -7.12 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 145 A}'M' green -9.04 2.266 -7.382 {"}'M' green -8.795 2.707 -7.363 {"}'M' green -8.944 2.437 -6.125 {"}'M' green -8.8 2.646 -6.116 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 145 A}'M' greentint -8.94 2.499 -7.372 {"}'M' greentint -9.138 2.252 -7.142 {"}'M' greentint -9.045 2.49 -7.131 {"}'M' greentint -8.907 2.706 -7.122 {"}'M' greentint -8.732 2.892 -7.114 {"}'M' greentint -9.214 2.126 -6.893 {"}'M' greentint -9.144 2.373 -6.882 {"}'M' greentint -9.029 2.603 -6.872 {"}'M' greentint -8.874 2.808 -6.863 {"}'M' greentint -8.684 2.981 -6.856 {"}'M' greentint -9.216 2.106 -6.635 {"}'M' greentint -9.147 2.354 -6.624 {"}'M' greentint -9.034 2.585 -6.614 {"}'M' greentint -8.88 2.791 -6.605 {"}'M' greentint -8.691 2.965 -6.598 {"}'M' greentint -9.136 2.226 -6.376 {"}'M' greentint -9.041 2.464 -6.365 {"}'M' greentint -8.902 2.679 -6.356 {"}'M' greentint -8.726 2.864 -6.348 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 179 A}'M' greentint -8.745 2.681 -7.259 {"}'M' greentint -8.855 2.447 -7.27 {"}'M' greentint -9.029 2.257 -7.278 {"}'M' greentint -8.642 2.668 -7.018 {"}'M' greentint -8.738 2.435 -7.029 {"}'M' greentint -8.892 2.235 -7.037 {"}'M' greentint -9.092 2.082 -7.044 {"}'M' greentint -8.609 2.917 -7.008 {"}'M' greentint -8.604 2.665 -6.76 {"}'M' greentint -8.695 2.432 -6.77 {"}'M' greentint -8.841 2.228 -6.779 {"}'M' greentint -9.032 2.067 -6.786 {"}'M' greentint -8.575 2.914 -6.749 {"}'M' greentint -8.642 2.645 -6.501 {"}'M' greentint -8.738 2.412 -6.511 {"}'M' greentint -8.892 2.212 -6.52 {"}'M' greentint -9.092 2.059 -6.527 {"}'M' greentint -8.609 2.895 -6.49 {"}'M' greentint -8.745 2.637 -6.26 {"}'M' greentint -8.855 2.404 -6.27 {"}'M' greentint -9.029 2.213 -6.279 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 145 A}'M' greentint -9.497 1.467 -5.473 {"}'M' greentint -9.754 1.207 -5.277 {"}'M' greentint -9.68 1.454 -5.266 {"}'M' greentint -9.536 1.668 -5.257 {"}'M' greentint -9.336 1.831 -5.25 {"}'M' greentint -9.862 1.075 -5.042 {"}'M' greentint -9.829 1.325 -5.031 {"}'M' greentint -9.733 1.558 -5.021 {"}'M' greentint -9.579 1.758 -5.012 {"}'M' greentint -9.379 1.911 -5.005 {"}'M' greentint -9.146 2.007 -5.001 {"}'M' greentint -9.887 0.931 -4.789 {"}'M' greentint -9.889 1.181 -4.778 {"}'M' greentint -9.829 1.424 -4.767 {"}'M' greentint -9.71 1.645 -4.758 {"}'M' greentint -9.54 1.829 -4.75 {"}'M' greentint -9.329 1.965 -4.744 {"}'M' greentint -9.862 1.053 -4.524 {"}'M' greentint -9.829 1.302 -4.514 {"}'M' greentint -9.733 1.535 -4.503 {"}'M' greentint -9.579 1.735 -4.495 {"}'M' greentint -9.379 1.888 -4.488 {"}'M' greentint -9.754 1.163 -4.278 {"}'M' greentint -9.68 1.41 -4.267 {"}'M' greentint -9.536 1.625 -4.258 {"}'M' greentint -9.336 1.787 -4.251 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 179 A}'M' greentint -9.486 1.398 -5.49 {"}'M' greentint -9.191 1.856 -5.229 {"}'M' greentint -9.262 1.61 -5.239 {"}'M' greentint -9.378 1.382 -5.249 {"}'M' greentint -9.535 1.18 -5.258 {"}'M' greentint -9.727 1.012 -5.265 {"}'M' greentint -9.145 1.836 -4.975 {"}'M' greentint -9.215 1.589 -4.986 {"}'M' greentint -9.33 1.358 -4.996 {"}'M' greentint -9.485 1.153 -5.005 {"}'M' greentint -9.675 0.98 -5.013 {"}'M' greentint -9.143 1.833 -4.717 {"}'M' greentint -9.212 1.585 -4.728 {"}'M' greentint -9.325 1.354 -4.738 {"}'M' greentint -9.479 1.148 -4.747 {"}'M' greentint -9.668 0.974 -4.754 {"}'M' greentint -9.193 1.815 -4.463 {"}'M' greentint -9.265 1.569 -4.474 {"}'M' greentint -9.382 1.342 -4.484 {"}'M' greentint -9.54 1.141 -4.493 {"}'M' greentint -9.734 0.973 -4.5 {"}'M' greentint -9.36 1.572 -4.233 {"}'M' greentint -9.482 1.35 -4.242 {"}'M' greentint -9.646 1.157 -4.251 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 4 1mk0A_6Y_19G}P -11.89 -3.303 -0.462 {"}-11.89 -3.303 -0.462 { ca gly A 4 1mk0A_6Y_19G}-10.892 -2.303 -0.143 { c gly A 4 1mk0A_6Y_19G}-10.744 -1.241 -1.208 { o gly A 4 1mk0A_6Y_19G}-11.66 -0.993 -1.996 { c gly A 4 1mk0A_6Y_19G}P -10.744 -1.241 -1.208 { n ile A 5 1mk0A_6Y_19G}-9.571 -0.622 -1.223 { ca ile A 5 1mk0A_6Y_19G}-9.256 0.436 -2.17 { c ile A 5 1mk0A_6Y_19G}-8.345 -0.129 -3.249 { o ile A 5 1mk0A_6Y_19G}-7.443 -0.92 -2.965 { c ile A 5 1mk0A_6Y_19G}P -8.345 -0.129 -3.249 { n tyr A 6 1mk0A_6Y_19G}-8.576 0.284 -4.489 { ca tyr A 6 1mk0A_6Y_19G}-7.775 -0.205 -5.6 { c tyr A 6 1mk0A_6Y_19G}-7.396 0.92 -6.55 { o tyr A 6 1mk0A_6Y_19G}-7.897 2.038 -6.444 { c tyr A 6 1mk0A_6Y_19G}P -7.396 0.92 -6.55 { n gln A 7 1mk0A_6Y_19G}-6.5 0.611 -7.48 { ca gln A 7 1mk0A_6Y_19G}-6.103 1.574 -8.492 { c gln A 7 1mk0A_6Y_19G}-6.165 0.873 -9.844 { o gln A 7 1mk0A_6Y_19G}-5.932 -0.335 -9.942 { c gln A 7 1mk0A_6Y_19G}P -6.165 0.873 -9.844 { n ile A 8 1mk0A_6Y_19G}-6.53 1.631 -10.874 { ca ile A 8 1mk0A_6Y_19G}-6.572 1.128 -12.242 { c ile A 8 1mk0A_6Y_19G}-5.56 2.039 -12.916 { o ile A 8 1mk0A_6Y_19G}-5.785 3.242 -13.034 { n tyr A 17 1mk0A_6Y_19G}P -6.697 5.576 -11.662 {"}-6.697 5.576 -11.662 { ca tyr A 17 1mk0A_6Y_19G}-8.066 5.802 -11.229 { c tyr A 17 1mk0A_6Y_19G}-8.115 5.076 -9.888 { o tyr A 17 1mk0A_6Y_19G}-7.776 3.895 -9.812 { c tyr A 17 1mk0A_6Y_19G}P -8.115 5.076 -9.888 { n val A 18 1mk0A_6Y_19G}-8.507 5.781 -8.834 { ca val A 18 1mk0A_6Y_19G}-8.606 5.18 -7.508 { c val A 18 1mk0A_6Y_19G}-10.071 4.913 -7.187 { o val A 18 1mk0A_6Y_19G}-10.924 5.765 -7.398 { c val A 18 1mk0A_6Y_19G}P -10.071 4.913 -7.187 { n gly A 19 1mk0A_6Y_19G}-10.366 3.72 -6.682 { ca gly A 19 1mk0A_6Y_19G}-11.742 3.4 -6.349 { c gly A 19 1mk0A_6Y_19G}-11.845 2.463 -5.163 { o gly A 19 1mk0A_6Y_19G}-10.837 2.082 -4.579 { c gly A 19 1mk0A_6Y_19G}P -11.845 2.463 -5.163 { n ser A 20 1mk0A_6Y_19G}-13.072 2.102 -4.8 { ca ser A 20 1mk0A_6Y_19G}-13.303 1.193 -3.682 { c ser A 20 1mk0A_6Y_19G}-14.245 0.09 -4.146 { o ser A 20 1mk0A_6Y_19G}-15.076 0.306 -5.025 { c ser A 20 1mk0A_6Y_19G}P -14.245 0.09 -4.146 { n ala A 21 1mk0A_6Y_19G}-14.122 -1.097 -3.565 { ca ala A 21 1mk0A_6Y_19G}-14.983 -2.193 -3.986 { c ala A 21 1mk0A_6Y_19G}-15.344 -3.171 -2.889 { o ala A 21 1mk0A_6Y_19G}-14.575 -3.388 -1.948 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 4 1mk0A_6Y_19G}P -11.89 -3.303 -0.462 { ca gly A 4 1mk0A_6Y_19G}P -10.892 -2.303 -0.143 {"}P -10.892 -2.303 -0.143 { n ile A 5 1mk0A_6Y_19G}P -9.571 -0.622 -1.223 { ca ile A 5 1mk0A_6Y_19G}P -9.256 0.436 -2.17 { n tyr A 6 1mk0A_6Y_19G}P -8.576 0.284 -4.489 { ca tyr A 6 1mk0A_6Y_19G}P -7.775 -0.205 -5.6 { n gln A 7 1mk0A_6Y_19G}P -6.5 0.611 -7.48 { ca gln A 7 1mk0A_6Y_19G}P -6.103 1.574 -8.492 { n ile A 8 1mk0A_6Y_19G}P -6.53 1.631 -10.874 { ca ile A 8 1mk0A_6Y_19G}P -6.572 1.128 -12.242 { n tyr A 17 1mk0A_6Y_19G}P -6.697 5.576 -11.662 { ca tyr A 17 1mk0A_6Y_19G}P -8.066 5.802 -11.229 { n val A 18 1mk0A_6Y_19G}P -8.507 5.781 -8.834 { ca val A 18 1mk0A_6Y_19G}P -8.606 5.18 -7.508 { n gly A 19 1mk0A_6Y_19G}P -10.366 3.72 -6.682 { ca gly A 19 1mk0A_6Y_19G}P -11.742 3.4 -6.349 {"}P -11.742 3.4 -6.349 { n ser A 20 1mk0A_6Y_19G}P -13.072 2.102 -4.8 { ca ser A 20 1mk0A_6Y_19G}P -13.303 1.193 -3.682 { n ala A 21 1mk0A_6Y_19G}P -14.122 -1.097 -3.565 { ca ala A 21 1mk0A_6Y_19G}P -14.983 -2.193 -3.986 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 4 1mk0A_6Y_19G}P -10.892 -2.303 -0.143 {"}-10.892 -2.303 -0.143 { ca ile A 5 1mk0A_6Y_19G}-9.256 0.436 -2.17 { ca tyr A 6 1mk0A_6Y_19G}-7.775 -0.205 -5.6 { ca gln A 7 1mk0A_6Y_19G}-6.103 1.574 -8.492 { ca ile A 8 1mk0A_6Y_19G}-6.572 1.128 -12.242 { ca tyr A 17 1mk0A_6Y_19G}P -8.066 5.802 -11.229 {"}-8.066 5.802 -11.229 { ca val A 18 1mk0A_6Y_19G}-8.606 5.18 -7.508 { ca gly A 19 1mk0A_6Y_19G}-11.742 3.4 -6.349 { ca ser A 20 1mk0A_6Y_19G}-13.303 1.193 -3.682 { ca ala A 21 1mk0A_6Y_19G}-14.983 -2.193 -3.986 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile A 5 1mk0A_6Y_19G}P -9.256 0.436 -2.17 { ca tyr A 6 1mk0A_6Y_19G}P -7.775 -0.205 -5.6 { cb tyr A 6 1mk0A_6Y_19G}-8.569 -1.261 -6.373 { cg tyr A 6 1mk0A_6Y_19G}-9.827 -0.704 -7.005 { cd1 tyr A 6 1mk0A_6Y_19G}-9.776 -0.014 -8.219 { ce1 tyr A 6 1mk0A_6Y_19G}-10.915 0.558 -8.769 { cz tyr A 6 1mk0A_6Y_19G}-12.123 0.445 -8.102 { oh tyr A 6 1mk0A_6Y_19G}-13.247 1.026 -8.622 { cg tyr A 6 1mk0A_6Y_19G}P -9.827 -0.704 -7.005 { cd2 tyr A 6 1mk0A_6Y_19G}-11.055 -0.809 -6.36 { ce2 tyr A 6 1mk0A_6Y_19G}-12.201 -0.238 -6.899 { cz tyr A 6 1mk0A_6Y_19G}ghost -12.123 0.445 -8.102 { ca gln A 7 1mk0A_6Y_19G}P -6.103 1.574 -8.492 { ca ile A 8 1mk0A_6Y_19G}P -6.572 1.128 -12.242 { ca tyr A 17 1mk0A_6Y_19G}P -8.066 5.802 -11.229 { ca val A 18 1mk0A_6Y_19G}P -8.606 5.18 -7.508 { ca ser A 20 1mk0A_6Y_19G}P -13.303 1.193 -3.682 { ca ala A 21 1mk0A_6Y_19G}P -14.983 -2.193 -3.986 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 6 1mk0A_6Y_19G}P -8.569 -1.261 -6.373 {"}P -8.569 -1.261 -6.373 { cd1 tyr A 6 1mk0A_6Y_19G}P -9.776 -0.014 -8.219 { cd2 tyr A 6 1mk0A_6Y_19G}P -11.055 -0.809 -6.36 { ce1 tyr A 6 1mk0A_6Y_19G}P -10.915 0.558 -8.769 { ce2 tyr A 6 1mk0A_6Y_19G}P -12.201 -0.238 -6.899 { oh tyr A 6 1mk0A_6Y_19G}P -13.247 1.026 -8.622 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 6 1mk0A_6Y_19G}P -7.775 -0.205 -5.6 { cb tyr A 6 1mk0A_6Y_19G}-8.569 -1.261 -6.373 { cg tyr A 6 1mk0A_6Y_19G}-9.827 -0.704 -7.005 { cd1 tyr A 6 1mk0A_6Y_19G}-9.776 -0.014 -8.219 { ce1 tyr A 6 1mk0A_6Y_19G}-10.915 0.558 -8.769 { cz tyr A 6 1mk0A_6Y_19G}-12.123 0.445 -8.102 { oh tyr A 6 1mk0A_6Y_19G}-13.247 1.026 -8.622 { cg tyr A 6 1mk0A_6Y_19G}P -9.827 -0.704 -7.005 { cd2 tyr A 6 1mk0A_6Y_19G}-11.055 -0.809 -6.36 { ce2 tyr A 6 1mk0A_6Y_19G}-12.201 -0.238 -6.899 { cz tyr A 6 1mk0A_6Y_19G}ghost -12.123 0.445 -8.102 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 6 1mk0A_6Y_19G}P -8.569 -1.261 -6.373 {"}P -8.569 -1.261 -6.373 { cd1 tyr A 6 1mk0A_6Y_19G}P -9.776 -0.014 -8.219 { cd2 tyr A 6 1mk0A_6Y_19G}P -11.055 -0.809 -6.36 { ce1 tyr A 6 1mk0A_6Y_19G}P -10.915 0.558 -8.769 { ce2 tyr A 6 1mk0A_6Y_19G}P -12.201 -0.238 -6.899 { oh tyr A 6 1mk0A_6Y_19G}P -13.247 1.026 -8.622 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 6 A}'P' blue -11.367 2.185 -8.308 {"}'P' sky -11.426 2.075 -8.063 {"}'P' blue -11.178 2.136 -8.06 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ TYR 6 A}'P' green -12.511 2.15 -8.158 {"}'P' green -12.253 2.189 -8.157 {"}'P' green -11.993 2.189 -8.157 {"}'P' green -12.821 1.983 -7.645 {"}'P' green -11.546 2.032 -7.643 {"}'P' green -12.87 1.863 -7.4 {"}'P' green -12.805 1.759 -7.169 {"}'P' green -12.326 1.749 -6.953 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 6 A}'P' P -12.519 2.137 -7.897 {"}'P' -12.51 2.098 -7.902 {"}'P' P -12.262 2.177 -7.895 {"}'P' -12.256 2.103 -7.904 {"}'P' P -12.001 2.178 -7.895 {"}'P' -12.005 2.116 -7.903 {"}'P' P -11.743 2.141 -7.897 {"}'P' -11.744 2.134 -7.898 {"}'P' P -12.575 2.072 -7.641 {"}'P' -12.556 2.004 -7.66 {"}'P' P -12.319 2.121 -7.639 {"}'P' -12.305 2.003 -7.672 {"}'P' P -12.058 2.131 -7.639 {"}'P' -12.062 2.014 -7.671 {"}'P' P -11.798 2.101 -7.64 {"}'P' -11.811 2.037 -7.658 {"}'P' P -12.634 1.962 -7.396 {"}'P' -12.62 1.92 -7.416 {"}'P' P -12.386 2.023 -7.393 {"}'P' -12.369 1.922 -7.439 {"}'P' P -12.131 2.045 -7.392 {"}'P' -12.131 1.929 -7.443 {"}'P' P -11.876 2.026 -7.393 {"}'P' -11.888 1.947 -7.428 {"}'P' P -11.627 1.967 -7.396 {"}'P' -11.629 1.962 -7.398 {"}'P' P -12.567 1.855 -7.165 {"}'P' -12.563 1.841 -7.173 {"}'P' P -12.316 1.909 -7.162 {"}'P' -12.308 1.853 -7.198 {"}'P' P -12.059 1.92 -7.162 {"}'P' -12.061 1.863 -7.198 {"}'P' P -11.804 1.887 -7.163 {"}'P' -11.807 1.874 -7.172 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 6 A}'P' sky -12.873 2.362 -8.434 {"}'P' sky -12.633 2.271 -8.438 {"}'P' sky -12.413 2.137 -8.444 {"}'P' sky -13.183 2.353 -8.181 {"}'P' sky -13.319 2.249 -7.944 {"}'P' sky -13.312 2.103 -7.73 { HH TYR 6 A}'P' blue -13.422 2.019 -7.594 {"}'P' blue -13.372 1.855 -7.36 {"}'P' blue -13.194 1.667 -7.368 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 6 A}'P' sea -12.93 2.317 -8.182 {"}'P' green -12.688 2.233 -8.186 {"}'P' green -13.065 2.238 -7.944 {"}'P' green -12.819 2.176 -7.947 {"}'P' green -13.053 2.088 -7.731 {"}'P' sea -13.063 1.905 -7.548 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 19 A}'P' sky -12.478 2.543 -8.292 {"}'P' blue -11.458 2.485 -7.97 {"}'P' sky -13.165 2.473 -7.749 {"}'P' blue -13.081 2.136 -7.255 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 19 A}'P' green -12.105 2.262 -8.165 {"}'P' green -12.359 2.262 -8.165 {"}'P' green -12.597 2.349 -8.161 {"}'P' sea -12.791 2.511 -8.154 {"}'P' green -12.604 2.137 -7.985 {"}'P' green -12.825 2.276 -7.979 {"}'P' sea -12.997 2.471 -7.971 {"}'P' green -11.633 2.095 -7.765 {"}'P' green -12.831 2.095 -7.765 {"}'P' green -13.021 2.264 -7.758 {"}'P' green -11.514 2.065 -7.519 {"}'P' green -12.937 2.055 -7.519 {"}'P' sea -13.119 2.234 -7.511 {"}'P' green -12.478 1.816 -7.008 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 19 A}'P' P -11.844 2.144 -7.985 {"}'P' -11.848 2.152 -7.977 {"}'P' P -12.094 2.068 -7.988 {"}'P' -12.101 2.114 -7.948 {"}'P' P -12.354 2.066 -7.988 {"}'P' -12.348 2.107 -7.953 {"}'P' P -11.858 1.977 -7.77 {"}'P' -11.884 2.043 -7.733 {"}'P' P -12.105 1.917 -7.773 {"}'P' -12.118 2.022 -7.716 {"}'P' P -12.359 1.917 -7.773 {"}'P' -12.347 2.014 -7.72 {"}'P' P -12.606 1.977 -7.77 {"}'P' -12.588 2.022 -7.744 {"}'P' P -11.73 1.928 -7.525 {"}'P' -11.753 1.976 -7.51 {"}'P' P -11.97 1.842 -7.529 {"}'P' -11.996 1.951 -7.498 {"}'P' P -12.224 1.812 -7.53 {"}'P' -12.225 1.939 -7.495 {"}'P' P -12.478 1.839 -7.529 {"}'P' -12.457 1.934 -7.502 {"}'P' P -12.72 1.921 -7.525 {"}'P' -12.708 1.946 -7.518 {"}'P' P -11.684 1.907 -7.265 {"}'P' -11.686 1.911 -7.265 {"}'P' P -11.919 1.814 -7.269 {"}'P' -11.937 1.879 -7.266 {"}'P' P -12.169 1.773 -7.271 {"}'P' -12.174 1.864 -7.267 {"}'P' P -12.421 1.787 -7.27 {"}'P' -12.41 1.857 -7.267 {"}'P' P -12.665 1.854 -7.267 {"}'P' -12.66 1.866 -7.267 {"}'P' P -12.224 1.789 -7.01 {"}'P' -12.224 1.797 -7.011 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 6 A}'M' green -8.848 2.881 -7.032 {"}'M' green -9.291 2.044 -6.573 {"}'M' green -9.237 2.149 -6.056 {"}'M' green -8.779 3.038 -6.017 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 6 A}'M' greentint -9.093 2.44 -7.051 {"}'M' greentint -8.993 2.673 -7.041 {"}'M' greentint -9.238 2.174 -6.822 {"}'M' greentint -9.191 2.426 -6.811 {"}'M' greentint -9.098 2.664 -6.8 {"}'M' greentint -8.96 2.88 -6.791 {"}'M' greentint -8.785 3.066 -6.783 {"}'M' greentint -9.267 2.3 -6.562 {"}'M' greentint -9.197 2.547 -6.551 {"}'M' greentint -9.082 2.777 -6.541 {"}'M' greentint -8.927 2.982 -6.532 {"}'M' greentint -8.737 3.155 -6.525 {"}'M' greentint -9.269 2.28 -6.304 {"}'M' greentint -9.2 2.528 -6.293 {"}'M' greentint -9.087 2.759 -6.283 {"}'M' greentint -8.933 2.965 -6.274 {"}'M' greentint -8.744 3.139 -6.267 {"}'M' greentint -9.189 2.4 -6.045 {"}'M' greentint -9.094 2.638 -6.034 {"}'M' greentint -8.955 2.853 -6.025 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 19 A}'M' green -9.156 2.344 -7.033 {"}'M' green -8.836 2.979 -6.004 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 19 A}'M' greentint -8.872 2.768 -7.014 {"}'M' greentint -8.982 2.534 -7.025 {"}'M' greentint -8.769 2.755 -6.773 {"}'M' greentint -8.865 2.522 -6.784 {"}'M' greentint -9.019 2.322 -6.792 {"}'M' greentint -9.219 2.169 -6.799 {"}'M' greentint -8.736 3.004 -6.763 {"}'M' greentint -8.731 2.752 -6.515 {"}'M' greentint -8.822 2.519 -6.525 {"}'M' greentint -8.968 2.315 -6.534 {"}'M' greentint -9.159 2.154 -6.541 {"}'M' greentint -8.702 3.001 -6.504 {"}'M' greentint -8.769 2.732 -6.256 {"}'M' greentint -8.865 2.499 -6.266 {"}'M' greentint -9.019 2.299 -6.275 {"}'M' greentint -9.219 2.146 -6.282 {"}'M' greentint -8.736 2.982 -6.245 {"}'M' greentint -8.872 2.724 -6.015 {"}'M' greentint -8.982 2.491 -6.025 {"}'M' greentint -9.156 2.3 -6.034 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 6 A}'M' greentint -10.147 1.079 -5.237 {"}'M' greentint -10.073 1.326 -5.226 {"}'M' greentint -9.929 1.54 -5.217 {"}'M' greentint -9.729 1.703 -5.21 {"}'M' greentint -10.255 0.947 -5.002 {"}'M' greentint -10.222 1.197 -4.991 {"}'M' greentint -10.126 1.43 -4.981 {"}'M' greentint -9.972 1.63 -4.972 {"}'M' greentint -9.772 1.783 -4.965 {"}'M' greentint -9.539 1.879 -4.961 {"}'M' greentint -10.282 1.053 -4.738 {"}'M' greentint -10.222 1.296 -4.727 {"}'M' greentint -10.103 1.517 -4.718 {"}'M' greentint -9.933 1.701 -4.71 {"}'M' greentint -9.722 1.837 -4.704 {"}'M' greentint -9.484 1.916 -4.7 {"}'M' greentint -10.255 0.925 -4.484 {"}'M' greentint -10.222 1.174 -4.474 {"}'M' greentint -10.126 1.407 -4.463 {"}'M' greentint -9.972 1.607 -4.455 {"}'M' greentint -9.772 1.76 -4.448 {"}'M' greentint -9.539 1.857 -4.444 {"}'M' greentint -10.147 1.035 -4.238 {"}'M' greentint -10.073 1.282 -4.227 {"}'M' greentint -9.929 1.497 -4.218 {"}'M' greentint -9.729 1.659 -4.211 {"}'M' greentint -9.89 1.277 -4.02 {"}'M' greentint -9.715 1.469 -4.012 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 19 A}'M' greentint -9.685 1.615 -5.224 {"}'M' greentint -9.808 1.394 -5.234 {"}'M' greentint -9.974 1.202 -5.242 {"}'M' greentint -9.513 1.852 -4.973 {"}'M' greentint -9.584 1.606 -4.983 {"}'M' greentint -9.7 1.378 -4.993 {"}'M' greentint -9.857 1.176 -5.002 {"}'M' greentint -10.049 1.008 -5.009 {"}'M' greentint -9.467 1.832 -4.719 {"}'M' greentint -9.537 1.585 -4.73 {"}'M' greentint -9.652 1.354 -4.74 {"}'M' greentint -9.807 1.149 -4.749 {"}'M' greentint -9.997 0.976 -4.757 {"}'M' greentint -10.216 0.841 -4.762 {"}'M' greentint -9.465 1.829 -4.461 {"}'M' greentint -9.534 1.581 -4.472 {"}'M' greentint -9.647 1.35 -4.482 {"}'M' greentint -9.801 1.144 -4.491 {"}'M' greentint -9.99 0.97 -4.498 {"}'M' greentint -10.208 0.833 -4.504 {"}'M' greentint -9.587 1.565 -4.218 {"}'M' greentint -9.704 1.338 -4.228 {"}'M' greentint -9.862 1.137 -4.237 {"}'M' greentint -10.056 0.969 -4.244 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n arg A 90 1nlsA_213F_92G}P -7.497 5.255 -12.714 {"}-7.497 5.255 -12.714 { ca arg A 90 1nlsA_213F_92G}-8.585 5.718 -11.833 { c arg A 90 1nlsA_213F_92G}-8.361 5.079 -10.455 { o arg A 90 1nlsA_213F_92G}-7.753 4.018 -10.34 { c arg A 90 1nlsA_213F_92G}P -8.361 5.079 -10.455 { n val A 91 1nlsA_213F_92G}-8.888 5.762 -9.427 { ca val A 91 1nlsA_213F_92G}-8.834 5.269 -8.045 { c val A 91 1nlsA_213F_92G}-10.294 5.02 -7.57 { o val A 91 1nlsA_213F_92G}-11.226 5.687 -8.013 { c val A 91 1nlsA_213F_92G}P -10.294 5.02 -7.57 { n gly A 92 1nlsA_213F_92G}-10.436 4.013 -6.686 { ca gly A 92 1nlsA_213F_92G}-11.764 3.614 -6.293 { c gly A 92 1nlsA_213F_92G}-11.818 2.829 -4.995 { o gly A 92 1nlsA_213F_92G}-10.798 2.47 -4.4 { c gly A 92 1nlsA_213F_92G}P -11.818 2.829 -4.995 { n leu A 93 1nlsA_213F_92G}-13.068 2.584 -4.597 { ca leu A 93 1nlsA_213F_92G}-13.407 1.667 -3.492 { c leu A 93 1nlsA_213F_92G}-14.273 0.536 -4.051 { o leu A 93 1nlsA_213F_92G}-15.153 0.799 -4.889 { c leu A 93 1nlsA_213F_92G}P -14.273 0.536 -4.051 { n ser A 94 1nlsA_213F_92G}-14.084 -0.665 -3.577 { ca ser A 94 1nlsA_213F_92G}-14.847 -1.856 -4.034 { c ser A 94 1nlsA_213F_92G}-15.243 -2.664 -2.792 { o ser A 94 1nlsA_213F_92G}-14.546 -2.685 -1.788 { n ala A 211 1nlsA_213F_92G}P -12.124 -2.907 -0.371 {"}-12.124 -2.907 -0.371 { ca ala A 211 1nlsA_213F_92G}-10.763 -2.612 -0.848 { c ala A 211 1nlsA_213F_92G}-10.72 -1.17 -1.401 { o ala A 211 1nlsA_213F_92G}-11.654 -0.676 -2.033 { c ala A 211 1nlsA_213F_92G}P -10.72 -1.17 -1.401 { n phe A 212 1nlsA_213F_92G}-9.561 -0.528 -1.19 { ca phe A 212 1nlsA_213F_92G}-9.151 0.669 -1.977 { c phe A 212 1nlsA_213F_92G}-8.307 0.154 -3.135 { o phe A 212 1nlsA_213F_92G}-7.403 -0.68 -2.933 { c phe A 212 1nlsA_213F_92G}P -8.307 0.154 -3.135 { n phe A 213 1nlsA_213F_92G}-8.599 0.613 -4.349 { ca phe A 213 1nlsA_213F_92G}-7.864 0.086 -5.52 { c phe A 213 1nlsA_213F_92G}-7.522 1.23 -6.486 { o phe A 213 1nlsA_213F_92G}-8.093 2.305 -6.508 { c phe A 213 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-8.248 {"}'P' blue -12.036 1.96 -8.248 {"}'P' sky -12.61 1.854 -7.994 {"}'P' sky -12.354 1.903 -7.992 {"}'P' sky -11.833 1.883 -7.993 {"}'P' sky -12.669 1.744 -7.749 {"}'P' sky -11.662 1.749 -7.749 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 213 A}'P' sea -12.69 1.708 -7.411 {"}'P' green -12.434 1.759 -7.409 {"}'P' green -12.173 1.771 -7.409 {"}'P' sea -11.913 1.742 -7.41 {"}'P' green -12.618 1.755 -7.15 {"}'P' green -12.36 1.794 -7.149 {"}'P' green -12.1 1.794 -7.149 {"}'P' green -11.842 1.755 -7.15 {"}'P' sea -12.626 1.742 -6.889 {"}'P' green -12.369 1.782 -6.887 {"}'P' green -12.108 1.783 -6.887 {"}'P' sea -11.85 1.746 -6.889 {"}'P' sea -12.426 1.726 -6.631 {"}'P' sea -12.165 1.736 -6.631 { CZ PHE 213 A}'P' sea -12.093 1.913 -7.992 {"}'P' sea -12.421 1.805 -7.746 {"}'P' sea -12.166 1.827 -7.745 {"}'P' sea -11.911 1.808 -7.746 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 92 A}'P' blue -12.078 2.326 -8.041 {"}'P' blue -12.332 2.326 -8.041 {"}'P' sky -11.817 2.208 -7.861 {"}'P' blue -12.577 2.201 -7.861 {"}'P' sky -11.831 2.041 -7.646 {"}'P' sky -12.579 2.041 -7.646 {"}'P' sky -11.703 1.992 -7.401 {"}'P' sky -12.693 1.985 -7.401 {"}'P' sky -11.657 1.971 -7.141 {"}'P' sky -12.862 2.037 -7.138 {"}'P' sky -12.579 1.997 -6.632 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 92 A}'P' sea -12.067 2.132 -7.864 {"}'P' sea -12.327 2.13 -7.864 {"}'P' sea -12.078 1.981 -7.649 {"}'P' sea -12.332 1.981 -7.649 {"}'P' sea -11.943 1.906 -7.405 {"}'P' green -12.197 1.876 -7.406 {"}'P' green -12.451 1.903 -7.405 {"}'P' green -11.892 1.878 -7.145 {"}'P' green -12.142 1.837 -7.147 {"}'P' green -12.394 1.851 -7.146 {"}'P' sea -12.638 1.918 -7.143 {"}'P' green -11.943 1.883 -6.884 {"}'P' green -12.197 1.853 -6.886 {"}'P' green -12.451 1.88 -6.884 {"}'P' sea -12.693 1.962 -6.881 {"}'P' sea -12.332 1.936 -6.634 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 213 A}'M' green -9.463 2.567 -6.626 {"}'M' green -8.714 3.557 -6.583 {"}'M' green -9.291 2.645 -5.869 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 213 A}'M' greentint -9.294 2.931 -6.864 {"}'M' greentint -9.156 3.147 -6.855 {"}'M' greentint -8.981 3.333 -6.847 {"}'M' greentint -9.393 2.814 -6.615 {"}'M' greentint -9.278 3.044 -6.605 {"}'M' greentint -9.123 3.249 -6.596 {"}'M' greentint -8.933 3.422 -6.589 {"}'M' greentint -9.465 2.547 -6.368 {"}'M' greentint -9.396 2.795 -6.357 {"}'M' greentint -9.283 3.026 -6.347 {"}'M' greentint -9.129 3.232 -6.338 {"}'M' greentint -8.94 3.406 -6.331 {"}'M' greentint -8.722 3.542 -6.325 {"}'M' greentint -9.385 2.667 -6.109 {"}'M' greentint -9.29 2.905 -6.098 {"}'M' greentint -9.151 3.12 -6.089 {"}'M' greentint -8.975 3.305 -6.081 {"}'M' greentint -8.766 3.453 -6.074 {"}'M' greentint -9.193 2.878 -5.858 {"}'M' greentint -9.049 3.087 -5.849 {"}'M' greentint -8.866 3.263 -5.842 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 92 A}'M' greentint -9.164 3.057 -6.993 {"}'M' greentint -8.857 3.277 -6.776 {"}'M' greentint -8.967 3.043 -6.787 {"}'M' greentint -9.141 2.853 -6.795 {"}'M' greentint -9.363 2.721 -6.801 {"}'M' greentint -8.754 3.264 -6.535 {"}'M' greentint -8.85 3.031 -6.546 {"}'M' greentint -9.004 2.831 -6.554 {"}'M' greentint -9.204 2.678 -6.561 {"}'M' greentint -9.437 2.581 -6.565 {"}'M' greentint -8.721 3.513 -6.525 {"}'M' greentint -8.716 3.261 -6.277 {"}'M' greentint -8.807 3.028 -6.287 {"}'M' greentint -8.953 2.824 -6.296 {"}'M' greentint -9.144 2.663 -6.303 {"}'M' greentint -9.37 2.554 -6.307 {"}'M' greentint -8.687 3.51 -6.266 {"}'M' greentint -8.754 3.241 -6.018 {"}'M' greentint -8.85 3.008 -6.028 {"}'M' greentint -9.004 2.808 -6.037 {"}'M' greentint -9.204 2.655 -6.044 {"}'M' greentint -8.967 3 -5.787 {"}'M' greentint -9.141 2.809 -5.796 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 213 A}'M' greentint -10.15 1.447 -5.044 {"}'M' greentint -10.076 1.694 -5.033 {"}'M' greentint -9.932 1.908 -5.024 {"}'M' greentint -9.732 2.071 -5.017 {"}'M' greentint -10.258 1.315 -4.809 {"}'M' greentint -10.225 1.565 -4.798 {"}'M' greentint -10.129 1.798 -4.788 {"}'M' greentint -9.975 1.998 -4.779 {"}'M' greentint -9.775 2.151 -4.772 {"}'M' greentint -9.542 2.247 -4.768 {"}'M' greentint -10.285 1.421 -4.545 {"}'M' greentint -10.225 1.664 -4.534 {"}'M' greentint -10.106 1.885 -4.525 {"}'M' greentint -9.936 2.069 -4.517 {"}'M' greentint -9.725 2.205 -4.511 {"}'M' greentint -9.487 2.284 -4.507 {"}'M' greentint -10.258 1.293 -4.291 {"}'M' greentint -10.225 1.542 -4.281 {"}'M' greentint -10.129 1.775 -4.27 {"}'M' greentint -9.975 1.975 -4.262 {"}'M' greentint -9.775 2.128 -4.255 {"}'M' greentint -9.542 2.225 -4.251 {"}'M' greentint -10.15 1.403 -4.045 {"}'M' greentint -10.076 1.65 -4.034 {"}'M' greentint -9.932 1.865 -4.025 {"}'M' greentint -9.732 2.027 -4.018 {"}'M' greentint -9.893 1.645 -3.827 {"}'M' greentint -9.718 1.837 -3.819 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 92 A}'M' greentint -9.646 2.003 -5.045 {"}'M' greentint -9.769 1.782 -5.055 {"}'M' greentint -9.935 1.59 -5.063 {"}'M' greentint -10.135 1.435 -5.07 {"}'M' greentint -9.474 2.24 -4.794 {"}'M' greentint -9.545 1.994 -4.804 {"}'M' greentint -9.661 1.766 -4.814 {"}'M' greentint -9.818 1.564 -4.823 {"}'M' greentint -10.01 1.396 -4.83 {"}'M' greentint -10.231 1.266 -4.836 {"}'M' greentint -9.428 2.22 -4.54 {"}'M' greentint -9.498 1.973 -4.551 {"}'M' greentint -9.613 1.742 -4.561 {"}'M' greentint -9.768 1.537 -4.57 {"}'M' greentint -9.958 1.364 -4.578 {"}'M' greentint -10.177 1.229 -4.583 {"}'M' greentint -9.426 2.217 -4.282 {"}'M' greentint -9.495 1.969 -4.293 {"}'M' greentint -9.608 1.738 -4.303 {"}'M' greentint -9.762 1.532 -4.312 {"}'M' greentint -9.951 1.358 -4.319 {"}'M' greentint -10.169 1.221 -4.325 {"}'M' greentint -9.548 1.953 -4.039 {"}'M' greentint -9.665 1.726 -4.049 {"}'M' greentint -9.823 1.525 -4.058 {"}'M' greentint -10.017 1.357 -4.065 {"}'M' greentint -9.765 1.734 -3.807 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n phe A 662 1o91A_664Y_701}P -11.724 -1.791 1.149 {"}-11.724 -1.791 1.149 { ca phe A 662 1o91A_664Y_701}-10.961 -2.167 -0.031 { c phe A 662 1o91A_664Y_701}-10.637 -0.924 -0.84 { o phe A 662 1o91A_664Y_701}-11.432 0.011 -0.9 { c phe A 662 1o91A_664Y_701}P -10.637 -0.924 -0.84 { n ala A 663 1o91A_664Y_701}-9.464 -0.918 -1.462 { ca ala A 663 1o91A_664Y_701}-9.044 0.207 -2.283 { c ala A 663 1o91A_664Y_701}-8.367 -0.346 -3.526 { o ala A 663 1o91A_664Y_701}-7.668 -1.356 -3.462 { c ala A 663 1o91A_664Y_701}P -8.367 -0.346 -3.526 { n tyr A 664 1o91A_664Y_701}-8.58 0.306 -4.661 { ca tyr A 664 1o91A_664Y_701}-7.973 -0.155 -5.898 { c tyr A 664 1o91A_664Y_701}-7.619 1.001 -6.811 { o tyr A 664 1o91A_664Y_701}-8.256 2.057 -6.782 { c tyr A 664 1o91A_664Y_701}P -7.619 1.001 -6.811 { n his A 665 1o91A_664Y_701}-6.581 0.795 -7.611 { ca his A 665 1o91A_664Y_701}-6.11 1.804 -8.547 { c his A 665 1o91A_664Y_701}-5.793 1.1 -9.852 { o his A 665 1o91A_664Y_701}-4.964 0.188 -9.885 { c his A 665 1o91A_664Y_701}P -5.793 1.1 -9.852 { n val A 666 1o91A_664Y_701}-6.457 1.515 -10.924 { ca val A 666 1o91A_664Y_701}-6.24 0.894 -12.221 { c val A 666 1o91A_664Y_701}-5.82 1.888 -13.294 { o val A 666 1o91A_664Y_701}-6.417 2.957 -13.444 { n ala A 699 1o91A_664Y_701}P -7.563 5.559 -12.727 {"}-7.563 5.559 -12.727 { ca ala A 699 1o91A_664Y_701}-8.835 5.759 -12.044 { c ala A 699 1o91A_664Y_701}-8.77 4.905 -10.78 { o ala A 699 1o91A_664Y_701}-8.124 3.856 -10.766 { c ala A 699 1o91A_664Y_701}P -8.77 4.905 -10.78 { n ser A 700 1o91A_664Y_701}-9.435 5.344 -9.719 { ca ser A 700 1o91A_664Y_701}-9.392 4.601 -8.47 { c ser A 700 1o91A_664Y_701}-10.757 4.45 -7.826 { o ser A 700 1o91A_664Y_701}-11.747 5.024 -8.281 { c ser A 700 1o91A_664Y_701}P -10.757 4.45 -7.826 { n gly A 701 1o91A_664Y_701}-10.785 3.677 -6.745 { ca gly A 701 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-0.585 -6.947 { cd2 tyr A 664 1o91A_664Y_701}-11.355 -0.752 -6.068 { ce2 tyr A 664 1o91A_664Y_701}-12.62 -0.243 -6.367 { cz tyr A 664 1o91A_664Y_701}ghost -12.819 0.442 -7.558 { ca his A 665 1o91A_664Y_701}P -6.11 1.804 -8.547 { ca val A 666 1o91A_664Y_701}P -6.24 0.894 -12.221 { ca ala A 699 1o91A_664Y_701}P -8.835 5.759 -12.044 { ca ser A 700 1o91A_664Y_701}P -9.392 4.601 -8.47 { ca ser A 702 1o91A_664Y_701}P -12.493 2.286 -2.445 { ca ala A 703 1o91A_664Y_701}P -15.332 0.829 -0.427 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 664 1o91A_664Y_701}P -8.911 -1.141 -6.611 {"}P -8.911 -1.141 -6.611 { cd1 tyr A 664 1o91A_664Y_701}P -10.503 0.108 -8.137 { cd2 tyr A 664 1o91A_664Y_701}P -11.355 -0.752 -6.068 { ce1 tyr A 664 1o91A_664Y_701}P -11.771 0.624 -8.448 { ce2 tyr A 664 1o91A_664Y_701}P -12.62 -0.243 -6.367 { oh tyr A 664 1o91A_664Y_701}P -14.068 0.938 -7.859 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 664 1o91A_664Y_701}P -7.973 -0.155 -5.898 { cb tyr A 664 1o91A_664Y_701}-8.911 -1.141 -6.611 { cg tyr A 664 1o91A_664Y_701}-10.281 -0.585 -6.947 { cd1 tyr A 664 1o91A_664Y_701}-10.503 0.108 -8.137 { ce1 tyr A 664 1o91A_664Y_701}-11.771 0.624 -8.448 { cz tyr A 664 1o91A_664Y_701}-12.819 0.442 -7.558 { oh tyr A 664 1o91A_664Y_701}-14.068 0.938 -7.859 { cg tyr A 664 1o91A_664Y_701}P -10.281 -0.585 -6.947 { cd2 tyr A 664 1o91A_664Y_701}-11.355 -0.752 -6.068 { ce2 tyr A 664 1o91A_664Y_701}-12.62 -0.243 -6.367 { cz tyr A 664 1o91A_664Y_701}ghost -12.819 0.442 -7.558 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 664 1o91A_664Y_701}P -8.911 -1.141 -6.611 {"}P -8.911 -1.141 -6.611 { cd1 tyr A 664 1o91A_664Y_701}P -10.503 0.108 -8.137 { cd2 tyr A 664 1o91A_664Y_701}P -11.355 -0.752 -6.068 { ce1 tyr A 664 1o91A_664Y_701}P -11.771 0.624 -8.448 { ce2 tyr A 664 1o91A_664Y_701}P -12.62 -0.243 -6.367 { oh tyr A 664 1o91A_664Y_701}P -14.068 0.938 -7.859 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 664 A}'P' blue -12.469 2.162 -7.991 {"}'P' blue -12.223 2.251 -7.987 {"}'P' sky -12.034 2.202 -7.739 { CE2 TYR 664 A}'P' sky -12.816 1.433 -5.904 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 664 A}'P' sea -12.282 2.141 -7.742 {"}'P' sea -11.964 2.088 -7.508 { CE2 TYR 664 A}'P' sea -12.498 1.49 -6.16 { CZ TYR 664 A}'P' green -12.949 2.186 -7.613 {"}'P' green -12.689 2.186 -7.613 {"}'P' green -12.004 1.922 -7.104 {"}'P' green -12.258 1.641 -6.413 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 664 A}'P' P -13.215 2.134 -7.353 {"}'P' -13.212 2.119 -7.355 {"}'P' P -12.958 2.174 -7.351 {"}'P' -12.952 2.098 -7.361 {"}'P' P -12.697 2.175 -7.351 {"}'P' -12.704 2.078 -7.363 {"}'P' P -12.439 2.138 -7.353 {"}'P' -12.455 2.068 -7.362 {"}'P' P -12.189 2.062 -7.356 {"}'P' -12.192 2.056 -7.357 {"}'P' P -13.271 2.069 -7.097 {"}'P' -13.257 2.018 -7.112 {"}'P' P -13.015 2.118 -7.095 {"}'P' -13 1.989 -7.131 {"}'P' P -12.754 2.128 -7.095 {"}'P' -12.76 1.964 -7.14 {"}'P' P -12.494 2.098 -7.096 {"}'P' -12.522 1.955 -7.136 {"}'P' P -12.242 2.029 -7.099 {"}'P' -12.27 1.954 -7.121 {"}'P' P -13.33 1.959 -6.852 {"}'P' -13.318 1.922 -6.869 {"}'P' P -13.082 2.02 -6.849 {"}'P' -13.062 1.899 -6.904 {"}'P' P -12.827 2.042 -6.848 {"}'P' -12.826 1.871 -6.924 {"}'P' P -12.572 2.023 -6.849 {"}'P' -12.598 1.858 -6.923 {"}'P' P -12.323 1.964 -6.852 {"}'P' -12.358 1.857 -6.901 {"}'P' P -12.087 1.868 -6.856 {"}'P' -12.098 1.845 -6.867 {"}'P' P -13.263 1.852 -6.621 {"}'P' -13.254 1.824 -6.639 {"}'P' P -13.012 1.906 -6.618 {"}'P' -12.999 1.809 -6.681 {"}'P' P -12.755 1.917 -6.618 {"}'P' -12.76 1.789 -6.699 {"}'P' P -12.5 1.884 -6.619 {"}'P' -12.523 1.778 -6.688 {"}'P' P -12.254 1.809 -6.622 {"}'P' -12.272 1.764 -6.653 {"}'P' P -13.022 1.746 -6.409 {"}'P' -13.018 1.722 -6.43 {"}'P' P -12.762 1.76 -6.408 {"}'P' -12.764 1.711 -6.451 {"}'P' P -12.504 1.725 -6.41 {"}'P' -12.512 1.693 -6.439 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 664 A}'P' sky -13.454 2.183 -7.675 {"}'P' sky -13.751 2.229 -7.419 {"}'P' sky -13.886 2.15 -7.181 { HH TYR 664 A}'P' blue -13.991 2.088 -6.982 {"}'P' blue -14.037 2.064 -6.724 {"}'P' sky -13.837 1.911 -6.731 {"}'P' blue -13.987 1.9 -6.49 {"}'P' blue -13.809 1.712 -6.498 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 664 A}'P' sea -13.509 2.145 -7.423 {"}'P' sea -13.64 2.088 -7.184 {"}'P' sea -13.625 1.926 -6.971 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 701 A}'P' blue -13.546 2.545 -7.328 {"}'P' sky -13.695 2.289 -6.87 {"}'P' sky -13.674 2.176 -6.614 {"}'P' blue -13.558 2.051 -6.359 {"}'P' blue -12.793 1.841 -5.899 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 701 A}'P' sea -12.112 2.35 -7.522 {"}'P' green -13.036 2.188 -7.529 {"}'P' sea -13.436 2.31 -7.339 {"}'P' sea -13.604 2.312 -7.117 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 701 A}'P' P -12.544 2.101 -7.533 {"}'P' -12.548 2.121 -7.506 {"}'P' P -12.798 2.101 -7.533 {"}'P' -12.793 2.127 -7.497 {"}'P' P -12.283 1.983 -7.353 {"}'P' -12.301 2.019 -7.318 {"}'P' P -12.533 1.907 -7.356 {"}'P' -12.547 1.998 -7.276 {"}'P' P -12.793 1.905 -7.356 {"}'P' -12.779 2.007 -7.267 {"}'P' P -13.043 1.976 -7.353 {"}'P' -13.014 2.04 -7.292 {"}'P' P -13.264 2.115 -7.347 {"}'P' -13.262 2.117 -7.345 {"}'P' P -12.072 1.934 -7.133 {"}'P' -12.079 1.944 -7.127 {"}'P' P -12.297 1.816 -7.138 {"}'P' -12.333 1.907 -7.086 {"}'P' P -12.544 1.756 -7.141 {"}'P' -12.563 1.906 -7.059 {"}'P' P -12.798 1.756 -7.141 {"}'P' -12.778 1.918 -7.053 {"}'P' P -13.045 1.816 -7.138 {"}'P' -12.998 1.938 -7.069 {"}'P' P -13.27 1.934 -7.133 {"}'P' -13.236 1.983 -7.102 {"}'P' P -12.169 1.767 -6.893 {"}'P' -12.197 1.824 -6.876 {"}'P' P -12.409 1.681 -6.897 {"}'P' -12.441 1.816 -6.859 {"}'P' P -12.663 1.651 -6.898 {"}'P' -12.664 1.826 -6.85 {"}'P' P -12.917 1.678 -6.897 {"}'P' -12.881 1.84 -6.851 {"}'P' P -13.159 1.76 -6.893 {"}'P' -13.11 1.862 -6.862 {"}'P' P -13.376 1.894 -6.887 {"}'P' -13.359 1.916 -6.88 {"}'P' P -12.123 1.746 -6.633 {"}'P' -12.124 1.749 -6.633 {"}'P' P -12.358 1.653 -6.637 {"}'P' -12.379 1.73 -6.634 {"}'P' P -12.608 1.612 -6.639 {"}'P' -12.614 1.735 -6.634 {"}'P' P -12.86 1.626 -6.638 {"}'P' -12.84 1.749 -6.633 {"}'P' P -13.104 1.693 -6.635 {"}'P' -13.073 1.772 -6.632 {"}'P' P -13.328 1.812 -6.63 {"}'P' -13.322 1.82 -6.63 {"}'P' P -12.409 1.658 -6.376 {"}'P' -12.41 1.661 -6.377 {"}'P' P -12.663 1.628 -6.378 {"}'P' -12.663 1.662 -6.384 {"}'P' P -12.917 1.655 -6.376 {"}'P' -12.911 1.681 -6.381 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 664 A}'M' green -9.457 2.683 -7.138 {"}'M' green -9.319 2.899 -7.129 {"}'M' green -9.626 2.319 -6.9 {"}'M' green -9.096 3.174 -6.863 {"}'M' green -9.628 2.299 -6.642 {"}'M' green -9.596 2.168 -6.394 {"}'M' green -8.929 3.205 -6.348 {"}'M' green -9.029 3.015 -6.116 {"}'M' green -9.189 2.634 -5.912 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 664 A}'M' greentint -9.556 2.566 -6.889 {"}'M' greentint -9.441 2.796 -6.879 {"}'M' greentint -9.286 3.001 -6.87 {"}'M' greentint -9.559 2.547 -6.631 {"}'M' greentint -9.446 2.778 -6.621 {"}'M' greentint -9.292 2.984 -6.612 {"}'M' greentint -9.103 3.158 -6.605 {"}'M' greentint -9.548 2.419 -6.383 {"}'M' greentint -9.453 2.657 -6.372 {"}'M' greentint -9.314 2.872 -6.363 {"}'M' greentint -9.138 3.057 -6.355 {"}'M' greentint -9.454 2.397 -6.143 {"}'M' greentint -9.356 2.63 -6.132 {"}'M' greentint -9.212 2.839 -6.123 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 701 A}'M' green -9.325 2.988 -7.086 {"}'M' green -9.461 2.767 -7.095 {"}'M' green -9.66 2.431 -6.903 {"}'M' green -9.118 3.242 -6.867 {"}'M' green -9.018 3.223 -6.627 {"}'M' green -9.667 2.264 -6.409 {"}'M' green -8.984 3.22 -6.368 {"}'M' green -9.501 2.365 -6.146 {"}'M' green -9.264 2.71 -5.889 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 701 A}'M' greentint -9.154 2.987 -6.878 {"}'M' greentint -9.264 2.753 -6.889 {"}'M' greentint -9.438 2.563 -6.897 {"}'M' greentint -9.051 2.974 -6.637 {"}'M' greentint -9.147 2.741 -6.648 {"}'M' greentint -9.301 2.541 -6.656 {"}'M' greentint -9.501 2.388 -6.663 {"}'M' greentint -9.013 2.971 -6.379 {"}'M' greentint -9.104 2.738 -6.389 {"}'M' greentint -9.25 2.534 -6.398 {"}'M' greentint -9.441 2.373 -6.405 {"}'M' greentint -9.051 2.951 -6.12 {"}'M' greentint -9.147 2.718 -6.13 {"}'M' greentint -9.301 2.518 -6.139 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 664 A}'M' greentint -9.932 1.515 -5.231 {"}'M' greentint -9.788 1.729 -5.222 {"}'M' greentint -9.588 1.892 -5.215 {"}'M' greentint -10.081 1.386 -4.996 {"}'M' greentint -9.985 1.619 -4.986 {"}'M' greentint -9.831 1.819 -4.977 {"}'M' greentint -9.631 1.972 -4.97 {"}'M' greentint -9.398 2.068 -4.966 {"}'M' greentint -10.141 1.242 -4.743 {"}'M' greentint -10.081 1.485 -4.732 {"}'M' greentint -9.962 1.706 -4.723 {"}'M' greentint -9.792 1.89 -4.715 {"}'M' greentint -9.581 2.026 -4.709 {"}'M' greentint -9.343 2.105 -4.705 {"}'M' greentint -10.114 1.114 -4.489 {"}'M' greentint -10.081 1.363 -4.479 {"}'M' greentint -9.985 1.596 -4.468 {"}'M' greentint -9.831 1.796 -4.46 {"}'M' greentint -9.631 1.949 -4.453 {"}'M' greentint -9.398 2.046 -4.449 {"}'M' greentint -10.006 1.224 -4.243 {"}'M' greentint -9.932 1.471 -4.232 {"}'M' greentint -9.788 1.686 -4.223 {"}'M' greentint -9.588 1.848 -4.216 {"}'M' greentint -9.349 1.945 -4.212 {"}'M' greentint -9.749 1.466 -4.025 {"}'M' greentint -9.574 1.658 -4.017 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 701 A}'M' greentint -9.712 1.688 -5.312 {"}'M' greentint -9.421 1.895 -5.083 {"}'M' greentint -9.544 1.674 -5.093 {"}'M' greentint -9.71 1.482 -5.101 {"}'M' greentint -9.91 1.327 -5.108 {"}'M' greentint -9.32 1.886 -4.842 {"}'M' greentint -9.436 1.658 -4.852 {"}'M' greentint -9.593 1.456 -4.861 {"}'M' greentint -9.785 1.288 -4.868 {"}'M' greentint -10.006 1.158 -4.874 {"}'M' greentint -9.273 1.865 -4.589 {"}'M' greentint -9.388 1.634 -4.599 {"}'M' greentint -9.543 1.429 -4.608 {"}'M' greentint -9.733 1.256 -4.616 {"}'M' greentint -9.952 1.121 -4.621 {"}'M' greentint -9.27 1.861 -4.331 {"}'M' greentint -9.383 1.63 -4.341 {"}'M' greentint -9.537 1.424 -4.35 {"}'M' greentint -9.726 1.25 -4.357 {"}'M' greentint -9.944 1.113 -4.363 {"}'M' greentint -9.323 1.845 -4.077 {"}'M' greentint -9.44 1.618 -4.087 {"}'M' greentint -9.598 1.417 -4.096 {"}'M' greentint -9.792 1.249 -4.103 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu A 259 1oygA_261F_314}P -12.314 -2.324 -0.098 {"}-12.314 -2.324 -0.098 { ca leu A 259 1oygA_261F_314}-11.021 -2.307 -0.776 { c leu A 259 1oygA_261F_314}-10.9 -0.995 -1.524 { o leu A 259 1oygA_261F_314}-11.827 -0.592 -2.214 { c leu A 259 1oygA_261F_314}P -10.9 -0.995 -1.524 { n val A 260 1oygA_261F_314}-9.761 -0.329 -1.37 { ca val A 260 1oygA_261F_314}-9.39 0.788 -2.227 { c val A 260 1oygA_261F_314}-8.22 0.299 -3.082 { o val A 260 1oygA_261F_314}-7.335 -0.384 -2.589 { c val A 260 1oygA_261F_314}P -8.22 0.299 -3.082 { n phe A 261 1oygA_261F_314}-8.222 0.63 -4.365 { ca phe A 261 1oygA_261F_314}-7.33 -0.025 -5.309 { c phe A 261 1oygA_261F_314}-6.951 0.894 -6.458 { o phe A 261 1oygA_261F_314}-7.61 1.899 -6.708 { c phe A 261 1oygA_261F_314}P -6.951 0.894 -6.458 { n glu A 262 1oygA_261F_314}-5.875 0.547 -7.148 { ca glu A 262 1oygA_261F_314}-5.535 1.205 -8.402 { c glu A 262 1oygA_261F_314}-6.46 0.742 -9.521 { o glu A 262 1oygA_261F_314}-6.685 -0.452 -9.704 { c glu A 262 1oygA_261F_314}P -6.46 0.742 -9.521 { n ala A 263 1oygA_261F_314}-6.946 1.693 -10.302 { ca ala A 263 1oygA_261F_314}-7.817 1.39 -11.425 { c ala A 263 1oygA_261F_314}-7.715 2.471 -12.486 { o ala A 263 1oygA_261F_314}-6.821 3.321 -12.45 { n ala A 312 1oygA_261F_314}P -7.256 6.099 -11.593 {"}-7.256 6.099 -11.593 { ca ala A 312 1oygA_261F_314}-8.218 6.301 -10.516 { c ala A 312 1oygA_261F_314}-7.829 5.466 -9.308 { o ala A 312 1oygA_261F_314}-7.238 4.399 -9.454 { c ala A 312 1oygA_261F_314}P -7.829 5.466 -9.308 { n leu A 313 1oygA_261F_314}-8.131 5.972 -8.118 { ca leu A 313 1oygA_261F_314}-8.134 5.145 -6.919 { c leu A 313 1oygA_261F_314}-9.586 4.76 -6.676 { o leu A 313 1oygA_261F_314}-10.417 5.599 -6.315 { c leu A 313 1oygA_261F_314}P -9.586 4.76 -6.676 { n gly A 314 1oygA_261F_314}-9.898 3.499 -6.959 { ca gly A 314 1oygA_261F_314}-11.249 2.98 -6.857 { c gly A 314 1oygA_261F_314}-11.597 2.469 -5.479 { o gly A 314 1oygA_261F_314}-10.73 2.322 -4.631 { c gly A 314 1oygA_261F_314}P -11.597 2.469 -5.479 { n met A 315 1oygA_261F_314}-12.879 2.204 -5.264 { ca met A 315 1oygA_261F_314}-13.373 1.668 -4.004 { c met A 315 1oygA_261F_314}-14.531 0.711 -4.261 { o met A 315 1oygA_261F_314}-15.39 0.974 -5.096 { c met A 315 1oygA_261F_314}P -14.531 0.711 -4.261 { n ile A 316 1oygA_261F_314}-14.527 -0.407 -3.542 { ca ile A 316 1oygA_261F_314}-15.682 -1.294 -3.453 { c ile A 316 1oygA_261F_314}-15.926 -1.64 -1.989 { o ile A 316 1oygA_261F_314}-14.996 -1.627 -1.18 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 259 1oygA_261F_314}P -12.314 -2.324 -0.098 { ca leu A 259 1oygA_261F_314}P -11.021 -2.307 -0.776 { n val A 260 1oygA_261F_314}P -9.761 -0.329 -1.37 { ca val A 260 1oygA_261F_314}P -9.39 0.788 -2.227 { n phe A 261 1oygA_261F_314}P -8.222 0.63 -4.365 { ca phe A 261 1oygA_261F_314}P -7.33 -0.025 -5.309 { n glu A 262 1oygA_261F_314}P -5.875 0.547 -7.148 { ca glu A 262 1oygA_261F_314}P -5.535 1.205 -8.402 { n ala A 263 1oygA_261F_314}P -6.946 1.693 -10.302 { ca ala A 263 1oygA_261F_314}P -7.817 1.39 -11.425 { n ala A 312 1oygA_261F_314}P -7.256 6.099 -11.593 { ca ala A 312 1oygA_261F_314}P -8.218 6.301 -10.516 { n leu A 313 1oygA_261F_314}P -8.131 5.972 -8.118 { ca leu A 313 1oygA_261F_314}P -8.134 5.145 -6.919 { n gly A 314 1oygA_261F_314}P -9.898 3.499 -6.959 { ca gly A 314 1oygA_261F_314}P -11.249 2.98 -6.857 {"}P -11.249 2.98 -6.857 { n met A 315 1oygA_261F_314}P -12.879 2.204 -5.264 { ca met A 315 1oygA_261F_314}P -13.373 1.668 -4.004 { n ile A 316 1oygA_261F_314}P -14.527 -0.407 -3.542 { ca ile A 316 1oygA_261F_314}P -15.682 -1.294 -3.453 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca leu A 259 1oygA_261F_314}P -11.021 -2.307 -0.776 {"}-11.021 -2.307 -0.776 { ca val A 260 1oygA_261F_314}-9.39 0.788 -2.227 { ca phe A 261 1oygA_261F_314}-7.33 -0.025 -5.309 { ca glu A 262 1oygA_261F_314}-5.535 1.205 -8.402 { ca ala A 263 1oygA_261F_314}-7.817 1.39 -11.425 { ca ala A 312 1oygA_261F_314}P -8.218 6.301 -10.516 {"}-8.218 6.301 -10.516 { ca leu A 313 1oygA_261F_314}-8.134 5.145 -6.919 { ca gly A 314 1oygA_261F_314}-11.249 2.98 -6.857 { ca met A 315 1oygA_261F_314}-13.373 1.668 -4.004 { ca ile A 316 1oygA_261F_314}-15.682 -1.294 -3.453 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca leu A 259 1oygA_261F_314}P -11.021 -2.307 -0.776 { ca val A 260 1oygA_261F_314}P -9.39 0.788 -2.227 { ca phe A 261 1oygA_261F_314}P -7.33 -0.025 -5.309 { cb phe A 261 1oygA_261F_314}-7.991 -1.302 -5.859 { cg phe A 261 1oygA_261F_314}-9.388 -1.094 -6.386 { cd1 phe A 261 1oygA_261F_314}-9.607 -0.813 -7.729 { ce1 phe A 261 1oygA_261F_314}-10.895 -0.623 -8.213 { cz phe A 261 1oygA_261F_314}-11.975 -0.706 -7.354 { cg phe A 261 1oygA_261F_314}P -9.388 -1.094 -6.386 { cd2 phe A 261 1oygA_261F_314}-10.482 -1.181 -5.541 { ce2 phe A 261 1oygA_261F_314}-11.767 -0.986 -6.021 { cz phe A 261 1oygA_261F_314}ghost -11.975 -0.706 -7.354 { ca glu A 262 1oygA_261F_314}P -5.535 1.205 -8.402 { ca ala A 263 1oygA_261F_314}P -7.817 1.39 -11.425 { ca ala A 312 1oygA_261F_314}P -8.218 6.301 -10.516 { ca leu A 313 1oygA_261F_314}P -8.134 5.145 -6.919 { ca met A 315 1oygA_261F_314}P -13.373 1.668 -4.004 { ca ile A 316 1oygA_261F_314}P -15.682 -1.294 -3.453 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 261 1oygA_261F_314}P -7.991 -1.302 -5.859 {"}P -7.991 -1.302 -5.859 { cd1 phe A 261 1oygA_261F_314}P -9.607 -0.813 -7.729 { cd2 phe A 261 1oygA_261F_314}P -10.482 -1.181 -5.541 { ce1 phe A 261 1oygA_261F_314}P -10.895 -0.623 -8.213 { ce2 phe A 261 1oygA_261F_314}P -11.767 -0.986 -6.021 { cz phe A 261 1oygA_261F_314}P -11.975 -0.706 -7.354 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 261 1oygA_261F_314}P -7.33 -0.025 -5.309 { cb phe A 261 1oygA_261F_314}-7.991 -1.302 -5.859 { cg phe A 261 1oygA_261F_314}-9.388 -1.094 -6.386 { cd1 phe A 261 1oygA_261F_314}-9.607 -0.813 -7.729 { ce1 phe A 261 1oygA_261F_314}-10.895 -0.623 -8.213 { cz phe A 261 1oygA_261F_314}-11.975 -0.706 -7.354 { cg phe A 261 1oygA_261F_314}P -9.388 -1.094 -6.386 { cd2 phe A 261 1oygA_261F_314}-10.482 -1.181 -5.541 { ce2 phe A 261 1oygA_261F_314}-11.767 -0.986 -6.021 { cz phe A 261 1oygA_261F_314}ghost -11.975 -0.706 -7.354 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 261 1oygA_261F_314}P -7.991 -1.302 -5.859 {"}P -7.991 -1.302 -5.859 { cd1 phe A 261 1oygA_261F_314}P -9.607 -0.813 -7.729 { cd2 phe A 261 1oygA_261F_314}P -10.482 -1.181 -5.541 { ce1 phe A 261 1oygA_261F_314}P -10.895 -0.623 -8.213 { ce2 phe A 261 1oygA_261F_314}P -11.767 -0.986 -6.021 { cz phe A 261 1oygA_261F_314}P -11.975 -0.706 -7.354 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 261 A}'P' sky -11.355 1.035 -8.53 {"}'P' sky -11.099 1.086 -8.528 {"}'P' blue -10.838 1.098 -8.528 {"}'P' sky -11.768 0.893 -8.278 {"}'P' sky -10.515 1.073 -8.008 {"}'P' sky -10.831 0.852 -7.273 { CZ PHE 261 A}'P' blue -11.919 0.845 -8.162 {"}'P' blue -12.23 0.929 -7.923 {"}'P' blue -12.363 0.999 -7.41 {"}'P' sky -12.114 1.026 -7.147 {"}'P' sky -11.11 0.802 -7.157 {"}'P' sky -11.91 0.98 -6.891 {"}'P' sky -11.65 0.95 -6.892 {"}'P' sky -11.398 0.881 -6.895 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 261 A}'P' sea -11.533 1.006 -8.273 {"}'P' green -11.283 1.082 -8.269 {"}'P' green -11.025 1.121 -8.268 {"}'P' sea -10.765 1.121 -8.268 {"}'P' green -11.54 0.991 -8.012 {"}'P' green -11.291 1.069 -8.008 {"}'P' green -11.034 1.109 -8.006 {"}'P' green -10.773 1.11 -8.006 {"}'P' green -11.347 1.004 -7.752 {"}'P' green -10.83 1.063 -7.75 {"}'P' sea -10.57 1.033 -7.751 {"}'P' green -11.158 0.955 -7.504 {"}'P' green -10.903 0.977 -7.503 {"}'P' sea -10.648 0.958 -7.504 {"}'P' sea -11.088 0.841 -7.273 { CZ PHE 261 A}'P' sea -11.975 0.949 -7.922 {"}'P' sea -11.72 0.929 -7.923 {"}'P' sea -12.179 1.003 -7.669 {"}'P' green -11.918 1.015 -7.669 {"}'P' green -11.658 0.986 -7.67 {"}'P' sea -12.105 1.038 -7.409 {"}'P' green -11.845 1.038 -7.409 {"}'P' green -11.587 0.999 -7.41 {"}'P' green -11.337 0.923 -7.414 {"}'P' green -11.853 1.027 -7.147 {"}'P' green -11.595 0.99 -7.149 {"}'P' sea -11.345 0.914 -7.152 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 261 A}'P' P -11.091 1.053 -7.75 {"}'P' -11.09 1.048 -7.752 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 314 A}'P' sky -11.496 1.29 -8.352 {"}'P' sky -11.748 1.201 -8.134 {"}'P' sky -12.079 1.279 -7.883 {"}'P' sky -10.617 1.273 -7.623 {"}'P' sky -12.223 1.36 -7.619 {"}'P' sky -10.656 1.267 -7.363 {"}'P' sky -11 1.157 -7.12 {"}'P' blue -11.236 1.229 -6.895 {"}'P' sky -11.496 1.226 -6.895 {"}'P' sky -11.746 1.297 -6.892 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 314 A}'P' sea -10.986 1.368 -8.349 {"}'P' sea -11.236 1.292 -8.352 {"}'P' sea -10.775 1.319 -8.129 {"}'P' green -11 1.201 -8.134 {"}'P' green -11.247 1.141 -8.137 {"}'P' green -11.501 1.141 -8.137 {"}'P' sea -10.656 1.289 -7.883 {"}'P' green -10.872 1.152 -7.889 {"}'P' green -11.366 1.036 -7.894 {"}'P' green -11.62 1.063 -7.893 {"}'P' sea -11.862 1.145 -7.889 {"}'P' green -10.826 1.131 -7.629 {"}'P' green -11.061 1.038 -7.633 {"}'P' green -11.311 0.997 -7.635 {"}'P' green -11.563 1.011 -7.634 {"}'P' green -11.807 1.078 -7.631 {"}'P' sea -12.031 1.197 -7.626 {"}'P' sea -10.872 1.129 -7.369 {"}'P' green -11.112 1.043 -7.372 {"}'P' green -11.366 1.013 -7.374 {"}'P' green -11.62 1.04 -7.372 {"}'P' green -11.862 1.122 -7.369 {"}'P' sea -12.079 1.257 -7.363 {"}'P' sea -11.247 1.096 -7.122 {"}'P' green -11.501 1.096 -7.122 {"}'P' green -11.748 1.157 -7.12 {"}'P' sea -11.973 1.275 -7.115 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 314 A}'P' P -11.112 1.066 -7.893 {"}'P' -11.114 1.074 -7.89 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 261 A}'M' greentint -8.721 2.057 -7.546 {"}'M' greentint -8.663 2.31 -7.535 {"}'M' greentint -8.548 2.542 -7.524 {"}'M' greentint -8.383 2.742 -7.516 {"}'M' greentint -8.857 2.053 -7.326 {"}'M' greentint -8.806 2.301 -7.315 {"}'M' greentint -8.706 2.534 -7.305 {"}'M' greentint -8.561 2.742 -7.296 {"}'M' greentint -8.377 2.916 -7.288 {"}'M' greentint -8.951 2.035 -7.086 {"}'M' greentint -8.904 2.287 -7.075 {"}'M' greentint -8.811 2.525 -7.064 {"}'M' greentint -8.673 2.741 -7.055 {"}'M' greentint -8.498 2.927 -7.047 {"}'M' greentint -8.29 3.077 -7.04 {"}'M' greentint -8.98 2.161 -6.826 {"}'M' greentint -8.91 2.408 -6.815 {"}'M' greentint -8.795 2.638 -6.805 {"}'M' greentint -8.64 2.843 -6.796 {"}'M' greentint -8.45 3.016 -6.789 {"}'M' greentint -8.913 2.389 -6.557 {"}'M' greentint -8.8 2.62 -6.547 {"}'M' greentint -8.646 2.826 -6.538 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 314 A}'M' greentint -8.294 2.584 -7.53 {"}'M' greentint -8.39 2.351 -7.541 {"}'M' greentint -8.544 2.151 -7.549 {"}'M' greentint -8.261 2.833 -7.52 {"}'M' greentint -8.256 2.581 -7.272 {"}'M' greentint -8.347 2.348 -7.282 {"}'M' greentint -8.493 2.144 -7.291 {"}'M' greentint -8.684 1.983 -7.298 {"}'M' greentint -8.227 2.83 -7.261 {"}'M' greentint -8.294 2.561 -7.013 {"}'M' greentint -8.39 2.328 -7.023 {"}'M' greentint -8.544 2.128 -7.032 {"}'M' greentint -8.744 1.975 -7.039 {"}'M' greentint -8.294 3.06 -6.992 {"}'M' greentint -8.261 2.811 -7.002 {"}'M' greentint -8.397 2.553 -6.772 {"}'M' greentint -8.507 2.32 -6.782 {"}'M' greentint -8.681 2.129 -6.791 {"}'M' greentint -8.903 1.998 -6.797 {"}'M' greentint -8.361 2.808 -6.761 {"}'M' greentint -8.568 2.536 -6.566 {"}'M' greentint -8.704 2.315 -6.575 {"}'M' greentint -8.912 2.159 -6.582 {"}'M' greentint -8.52 2.791 -6.555 {"}'M' greentint -8.79 2.542 -6.406 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 261 A}'M' green -9.672 1.473 -5.259 {"}'M' green -9.598 1.72 -5.248 {"}'M' green -9.454 1.934 -5.239 {"}'M' green -9.78 1.341 -5.024 {"}'M' green -9.297 2.177 -4.987 {"}'M' green -9.805 1.197 -4.771 {"}'M' green -9.247 2.231 -4.726 {"}'M' green -9.297 2.154 -4.47 {"}'M' green -9.672 1.429 -4.26 {"}'M' green -9.454 1.891 -4.24 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 261 A}'M' greentint -9.747 1.591 -5.013 {"}'M' greentint -9.651 1.824 -5.003 {"}'M' greentint -9.497 2.024 -4.994 {"}'M' greentint -9.807 1.447 -4.76 {"}'M' greentint -9.747 1.69 -4.749 {"}'M' greentint -9.628 1.911 -4.74 {"}'M' greentint -9.458 2.095 -4.732 {"}'M' greentint -9.78 1.319 -4.506 {"}'M' greentint -9.747 1.568 -4.496 {"}'M' greentint -9.651 1.801 -4.485 {"}'M' greentint -9.497 2.001 -4.477 {"}'M' greentint -9.598 1.676 -4.249 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 314 A}'M' green -9.502 2.097 -5.265 {"}'M' green -9.578 1.855 -5.276 {"}'M' green -9.701 1.634 -5.286 {"}'M' green -9.89 1.216 -4.809 {"}'M' green -9.336 2.328 -4.76 {"}'M' green -9.883 1.21 -4.55 {"}'M' sea -9.336 2.325 -4.502 {"}'M' green -9.408 2.051 -4.259 {"}'M' green -9.755 1.377 -4.289 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 314 A}'M' greentint -9.406 2.092 -5.025 {"}'M' greentint -9.477 1.846 -5.035 {"}'M' greentint -9.593 1.618 -5.045 {"}'M' greentint -9.75 1.416 -5.054 {"}'M' greentint -9.36 2.072 -4.771 {"}'M' greentint -9.43 1.825 -4.782 {"}'M' greentint -9.545 1.594 -4.792 {"}'M' greentint -9.7 1.389 -4.801 {"}'M' greentint -9.358 2.069 -4.513 {"}'M' greentint -9.427 1.821 -4.524 {"}'M' greentint -9.54 1.59 -4.534 {"}'M' greentint -9.694 1.384 -4.543 {"}'M' greentint -9.48 1.805 -4.27 {"}'M' greentint -9.597 1.578 -4.28 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n thr B 200 1pbyB_202F_220}P -12.066 -2.353 0.237 {"}-12.066 -2.353 0.237 { ca thr B 200 1pbyB_202F_220}-10.654 -2.14 -0.048 { c thr B 200 1pbyB_202F_220}-10.482 -1.154 -1.198 { o thr B 200 1pbyB_202F_220}-11.28 -1.113 -2.127 { c thr B 200 1pbyB_202F_220}P -10.482 -1.154 -1.198 { n pro B 201 1pbyB_202F_220}-9.452 -0.313 -1.122 { ca pro B 201 1pbyB_202F_220}-9.304 0.587 -2.226 { c pro B 201 1pbyB_202F_220}-8.668 -0.256 -3.339 { o pro B 201 1pbyB_202F_220}-8.157 -1.345 -3.078 { c pro B 201 1pbyB_202F_220}P -8.668 -0.256 -3.339 { n phe B 202 1pbyB_202F_220}-8.743 0.22 -4.57 { ca phe B 202 1pbyB_202F_220}-8.108 -0.475 -5.671 { c phe B 202 1pbyB_202F_220}-7.621 0.62 -6.601 { o phe B 202 1pbyB_202F_220}-8.112 1.757 -6.55 { c phe B 202 1pbyB_202F_220}P -7.621 0.62 -6.601 { n tyr B 203 1pbyB_202F_220}-6.636 0.297 -7.423 { ca tyr B 203 1pbyB_202F_220}-6.076 1.299 -8.306 { c tyr B 203 1pbyB_202F_220}-6.216 0.905 -9.764 { o tyr B 203 1pbyB_202F_220}-6.061 -0.255 -10.125 { c tyr B 203 1pbyB_202F_220}P -6.216 0.905 -9.764 { n thr B 204 1pbyB_202F_220}-6.527 1.89 -10.597 { ca thr B 204 1pbyB_202F_220}-6.741 1.629 -12.004 { c thr B 204 1pbyB_202F_220}-6.401 2.878 -12.823 { o thr B 204 1pbyB_202F_220}-5.792 3.819 -12.313 { n arg B 218 1pbyB_202F_220}P -6.595 6.495 -11.455 {"}-6.595 6.495 -11.455 { ca arg B 218 1pbyB_202F_220}-7.699 6.7 -10.533 { c arg B 218 1pbyB_202F_220}-7.707 5.713 -9.362 { o arg B 218 1pbyB_202F_220}-7.213 4.587 -9.469 { c arg B 218 1pbyB_202F_220}P -7.707 5.713 -9.362 { n thr B 219 1pbyB_202F_220}-8.284 6.163 -8.251 { ca thr B 219 1pbyB_202F_220}-8.423 5.359 -7.051 { c thr B 219 1pbyB_202F_220}-9.884 4.926 -6.963 { o thr B 219 1pbyB_202F_220}-10.791 5.756 -7.014 { c thr B 219 1pbyB_202F_220}P -9.884 4.926 -6.963 { n gly B 220 1pbyB_202F_220}-10.104 3.626 -6.84 { ca gly B 220 1pbyB_202F_220}-11.457 3.129 -6.741 { c gly B 220 1pbyB_202F_220}-11.68 2.503 -5.386 { o gly B 220 1pbyB_202F_220}-10.735 2.282 -4.628 { c gly B 220 1pbyB_202F_220}P -11.68 2.503 -5.386 {"}P -11.68 2.503 -5.386 { c aleu B 221 1pbyB_202F_220}P -14.124 0.364 -4.089 { c bleu B 221 1pbyB_202F_220}P -14.116 0.356 -4.106 { c aleu B 221 1pbyB_202F_220}P -14.124 0.364 -4.089 { c bleu B 221 1pbyB_202F_220}P -14.116 0.356 -4.106 { c aleu B 221 1pbyB_202F_220}P -14.124 0.364 -4.089 { n leu B 222 1pbyB_202F_220}-13.731 -0.765 -3.512 { ca leu B 222 1pbyB_202F_220}-14.46 -2.009 -3.705 { c leu B 222 1pbyB_202F_220}-15.183 -2.282 -2.389 { o leu B 222 1pbyB_202F_220}-14.564 -2.286 -1.332 { c bleu B 221 1pbyB_202F_220}P -14.116 0.356 -4.106 { n leu B 222 1pbyB_202F_220}-13.731 -0.765 -3.512 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr B 200 1pbyB_202F_220}P -12.066 -2.353 0.237 { ca thr B 200 1pbyB_202F_220}P -10.654 -2.14 -0.048 { ca pro B 201 1pbyB_202F_220}P -9.304 0.587 -2.226 { n phe B 202 1pbyB_202F_220}P -8.743 0.22 -4.57 { ca phe B 202 1pbyB_202F_220}P -8.108 -0.475 -5.671 { n tyr B 203 1pbyB_202F_220}P -6.636 0.297 -7.423 { ca tyr B 203 1pbyB_202F_220}P -6.076 1.299 -8.306 { n thr B 204 1pbyB_202F_220}P -6.527 1.89 -10.597 { ca thr B 204 1pbyB_202F_220}P -6.741 1.629 -12.004 { n arg B 218 1pbyB_202F_220}P -6.595 6.495 -11.455 { ca arg B 218 1pbyB_202F_220}P -7.699 6.7 -10.533 { n thr B 219 1pbyB_202F_220}P -8.284 6.163 -8.251 { ca thr B 219 1pbyB_202F_220}P -8.423 5.359 -7.051 { n gly B 220 1pbyB_202F_220}P -10.104 3.626 -6.84 { ca gly B 220 1pbyB_202F_220}P -11.457 3.129 -6.741 {"}P -11.457 3.129 -6.741 { n leu B 222 1pbyB_202F_220}P -13.731 -0.765 -3.512 { ca leu B 222 1pbyB_202F_220}P -14.46 -2.009 -3.705 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca thr B 200 1pbyB_202F_220}P -10.654 -2.14 -0.048 {"}-10.654 -2.14 -0.048 { ca pro B 201 1pbyB_202F_220}-9.304 0.587 -2.226 { ca phe B 202 1pbyB_202F_220}-8.108 -0.475 -5.671 { ca tyr B 203 1pbyB_202F_220}-6.076 1.299 -8.306 { ca thr B 204 1pbyB_202F_220}-6.741 1.629 -12.004 { ca arg B 218 1pbyB_202F_220}P -7.699 6.7 -10.533 {"}-7.699 6.7 -10.533 { ca thr B 219 1pbyB_202F_220}-8.423 5.359 -7.051 { ca gly B 220 1pbyB_202F_220}-11.457 3.129 -6.741 {"}P -11.457 3.129 -6.741 { ca leu B 222 1pbyB_202F_220}P -14.46 -2.009 -3.705 {"}P -14.46 -2.009 -3.705 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca thr B 200 1pbyB_202F_220}P -10.654 -2.14 -0.048 { ca pro B 201 1pbyB_202F_220}P -9.304 0.587 -2.226 { n pro B 201 1pbyB_202F_220}P -9.452 -0.313 -1.122 { ca phe B 202 1pbyB_202F_220}P -8.108 -0.475 -5.671 { cb phe B 202 1pbyB_202F_220}-9.069 -1.493 -6.361 { cg phe B 202 1pbyB_202F_220}-10.205 -0.872 -7.132 { cd1 phe B 202 1pbyB_202F_220}-10.018 -0.419 -8.436 { ce1 phe B 202 1pbyB_202F_220}-11.087 0.081 -9.182 { cz phe B 202 1pbyB_202F_220}-12.364 0.137 -8.617 { cg phe B 202 1pbyB_202F_220}P -10.205 -0.872 -7.132 { cd2 phe B 202 1pbyB_202F_220}-11.482 -0.807 -6.578 { ce2 phe B 202 1pbyB_202F_220}-12.56 -0.307 -7.311 { cz phe B 202 1pbyB_202F_220}ghost -12.364 0.137 -8.617 { ca tyr B 203 1pbyB_202F_220}P -6.076 1.299 -8.306 { ca thr B 204 1pbyB_202F_220}P -6.741 1.629 -12.004 { ca arg B 218 1pbyB_202F_220}P -7.699 6.7 -10.533 { ca thr B 219 1pbyB_202F_220}P -8.423 5.359 -7.051 { ca leu B 222 1pbyB_202F_220}P -14.46 -2.009 -3.705 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe B 202 1pbyB_202F_220}P -9.069 -1.493 -6.361 {"}P -9.069 -1.493 -6.361 { cd1 phe B 202 1pbyB_202F_220}P -10.018 -0.419 -8.436 { cd2 phe B 202 1pbyB_202F_220}P -11.482 -0.807 -6.578 { ce1 phe B 202 1pbyB_202F_220}P -11.087 0.081 -9.182 { ce2 phe B 202 1pbyB_202F_220}P -12.56 -0.307 -7.311 { cz phe B 202 1pbyB_202F_220}P -12.364 0.137 -8.617 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe B 202 1pbyB_202F_220}P -8.108 -0.475 -5.671 { cb phe B 202 1pbyB_202F_220}-9.069 -1.493 -6.361 { cg phe B 202 1pbyB_202F_220}-10.205 -0.872 -7.132 { cd1 phe B 202 1pbyB_202F_220}-10.018 -0.419 -8.436 { ce1 phe B 202 1pbyB_202F_220}-11.087 0.081 -9.182 { cz phe B 202 1pbyB_202F_220}-12.364 0.137 -8.617 { cg phe B 202 1pbyB_202F_220}P -10.205 -0.872 -7.132 { cd2 phe B 202 1pbyB_202F_220}-11.482 -0.807 -6.578 { ce2 phe B 202 1pbyB_202F_220}-12.56 -0.307 -7.311 { cz phe B 202 1pbyB_202F_220}ghost -12.364 0.137 -8.617 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe B 202 1pbyB_202F_220}P -9.069 -1.493 -6.361 {"}P -9.069 -1.493 -6.361 { cd1 phe B 202 1pbyB_202F_220}P -10.018 -0.419 -8.436 { cd2 phe B 202 1pbyB_202F_220}P -11.482 -0.807 -6.578 { ce1 phe B 202 1pbyB_202F_220}P -11.087 0.081 -9.182 { ce2 phe B 202 1pbyB_202F_220}P -12.56 -0.307 -7.311 { cz phe B 202 1pbyB_202F_220}P -12.364 0.137 -8.617 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 202 B}'P' sky -11.022 1.767 -8.719 {"}'P' sky -10.84 1.662 -8.473 {"}'P' sky -10.768 1.523 -8.243 {"}'P' sky -10.772 1.364 -8.034 {"}'P' sky -11.095 1.003 -7.694 { CE2 PHE 202 B}'P' sky -12.69 1.437 -7.366 {"}'P' sky -12.699 1.425 -7.104 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 202 B}'P' sea -11.539 1.708 -8.721 {"}'P' sea -11.283 1.757 -8.719 {"}'P' green -11.35 1.659 -8.473 {"}'P' green -11.095 1.681 -8.472 {"}'P' green -11.023 1.556 -8.242 {"}'P' green -11.03 1.399 -8.032 {"}'P' sea -11.023 1.212 -7.849 { CE2 PHE 202 B}'P' green -12.43 1.437 -7.366 {"}'P' green -11.687 1.209 -7.376 {"}'P' sea -11.472 1.062 -7.382 {"}'P' green -12.438 1.426 -7.104 {"}'P' green -12.18 1.389 -7.106 {"}'P' green -11.93 1.313 -7.109 {"}'P' green -11.695 1.201 -7.114 {"}'P' sea -11.478 1.056 -7.121 {"}'P' sea -11.983 1.28 -6.852 {"}'P' sea -11.745 1.173 -6.857 { CZ PHE 202 B}'P' green -12.242 1.87 -8.41 {"}'P' green -12.56 1.813 -8.154 {"}'P' green -12.627 1.715 -7.908 {"}'P' green -12.557 1.601 -7.677 {"}'P' green -11.363 1.235 -7.693 {"}'P' green -11.577 1.208 -7.478 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 202 B}'P' P -11.28 1.545 -8.242 {"}'P' -11.279 1.541 -8.244 { CE2 PHE 202 B}'P' P -12.172 1.398 -7.367 {"}'P' -12.176 1.381 -7.367 {"}'P' P -11.922 1.322 -7.371 {"}'P' -11.932 1.296 -7.37 { CZ PHE 202 B}'P' P -11.984 1.833 -8.412 {"}'P' -11.992 1.797 -8.416 {"}'P' P -11.734 1.757 -8.415 {"}'P' -11.749 1.72 -8.42 {"}'P' P -11.499 1.645 -8.42 {"}'P' -11.499 1.644 -8.42 {"}'P' P -12.299 1.823 -8.154 {"}'P' -12.301 1.773 -8.167 {"}'P' P -12.039 1.793 -8.155 {"}'P' -12.06 1.688 -8.184 {"}'P' P -11.787 1.724 -8.158 {"}'P' -11.828 1.613 -8.19 {"}'P' P -11.549 1.617 -8.163 {"}'P' -11.588 1.546 -8.185 {"}'P' P -12.372 1.737 -7.907 {"}'P' -12.372 1.68 -7.932 {"}'P' P -12.117 1.718 -7.908 {"}'P' -12.136 1.597 -7.962 {"}'P' P -11.868 1.659 -7.911 {"}'P' -11.913 1.521 -7.975 {"}'P' P -11.632 1.563 -7.915 {"}'P' -11.686 1.457 -7.967 {"}'P' P -11.413 1.431 -7.921 {"}'P' -11.443 1.39 -7.943 {"}'P' P -12.3 1.612 -7.677 {"}'P' -12.302 1.551 -7.715 {"}'P' P -12.045 1.579 -7.678 {"}'P' -12.068 1.474 -7.746 {"}'P' P -11.799 1.504 -7.681 {"}'P' -11.841 1.403 -7.751 {"}'P' P -11.569 1.388 -7.687 {"}'P' -11.604 1.333 -7.728 {"}'P' P -12.307 1.455 -7.467 {"}'P' -12.308 1.447 -7.475 {"}'P' P -12.049 1.42 -7.469 {"}'P' -12.06 1.377 -7.507 {"}'P' P -11.803 1.336 -7.472 {"}'P' -11.82 1.301 -7.506 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 220 B}'P' sky -11.383 2 -8.604 {"}'P' sky -11.085 1.96 -8.466 {"}'P' sky -10.87 1.934 -8.282 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 220 B}'P' green -11.279 1.798 -8.473 {"}'P' green -11.517 1.711 -8.477 {"}'P' green -11.039 1.736 -8.291 {"}'P' green -11.256 1.593 -8.297 {"}'P' green -12.409 1.92 -8.283 {"}'P' sea -10.855 1.713 -8.07 {"}'P' green -11.045 1.544 -8.077 {"}'P' sea -10.926 1.514 -7.831 {"}'P' green -11.142 1.377 -7.837 {"}'P' green -12.493 1.585 -7.567 {"}'P' sea -11.382 1.268 -7.32 {"}'P' green -11.636 1.238 -7.322 {"}'P' green -12.349 1.482 -7.311 {"}'P' sea -12.531 1.661 -7.303 {"}'P' sea -11.517 1.321 -7.07 {"}'P' green -11.771 1.321 -7.07 {"}'P' green -12.018 1.382 -7.068 {"}'P' green -12.243 1.5 -7.063 {"}'P' sea -12.433 1.669 -7.055 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 220 B}'P' P -11.771 1.711 -8.477 {"}'P' -11.767 1.729 -8.452 {"}'P' P -12.009 1.798 -8.473 {"}'P' -12.002 1.809 -8.455 {"}'P' P -11.506 1.517 -8.3 {"}'P' -11.511 1.552 -8.269 {"}'P' P -11.766 1.515 -8.3 {"}'P' -11.755 1.595 -8.23 {"}'P' P -12.016 1.586 -8.297 {"}'P' -11.98 1.664 -8.223 {"}'P' P -12.237 1.725 -8.291 {"}'P' -12.205 1.76 -8.251 {"}'P' P -11.27 1.426 -8.082 {"}'P' -11.271 1.428 -8.082 {"}'P' P -11.517 1.366 -8.085 {"}'P' -11.526 1.438 -8.046 {"}'P' P -11.771 1.366 -8.085 {"}'P' -11.756 1.491 -8.017 {"}'P' P -12.018 1.426 -8.082 {"}'P' -11.968 1.555 -8.009 {"}'P' P -12.243 1.544 -8.077 {"}'P' -12.182 1.63 -8.022 {"}'P' P -12.433 1.713 -8.07 {"}'P' -12.406 1.736 -8.051 {"}'P' P -11.382 1.291 -7.841 {"}'P' -11.388 1.313 -7.834 {"}'P' P -11.636 1.261 -7.842 {"}'P' -11.637 1.359 -7.815 {"}'P' P -11.89 1.288 -7.841 {"}'P' -11.86 1.421 -7.803 {"}'P' P -12.132 1.37 -7.837 {"}'P' -12.075 1.489 -7.802 {"}'P' P -12.349 1.504 -7.831 {"}'P' -12.297 1.57 -7.809 {"}'P' P -12.531 1.683 -7.823 {"}'P' -12.529 1.685 -7.823 {"}'P' P -11.581 1.222 -7.583 {"}'P' -11.582 1.251 -7.582 {"}'P' P -11.833 1.236 -7.582 {"}'P' -11.821 1.31 -7.579 {"}'P' P -12.077 1.303 -7.579 {"}'P' -12.047 1.379 -7.576 {"}'P' P -12.301 1.422 -7.574 {"}'P' -12.274 1.461 -7.573 {"}'P' P -11.89 1.265 -7.32 {"}'P' -11.886 1.285 -7.324 {"}'P' P -12.132 1.347 -7.317 {"}'P' -12.123 1.366 -7.321 @subgroup {1->2} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { O PHE 202 B}'M' P -9.142 2.701 -6.638 {"}'M' -9.133 2.692 -6.637 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 202 B}'M' greentint -9.165 2.168 -7.377 {"}'M' greentint -9.05 2.4 -7.366 {"}'M' greentint -8.885 2.6 -7.358 {"}'M' greentint -8.678 2.756 -7.351 {"}'M' greentint -9.308 2.159 -7.157 {"}'M' greentint -9.208 2.392 -7.147 {"}'M' greentint -9.063 2.6 -7.138 {"}'M' greentint -8.879 2.774 -7.13 {"}'M' greentint -8.664 2.908 -7.124 {"}'M' greentint -9.406 2.145 -6.917 {"}'M' greentint -9.313 2.383 -6.906 {"}'M' greentint -9.175 2.599 -6.897 {"}'M' greentint -9 2.785 -6.889 {"}'M' greentint -8.792 2.935 -6.882 {"}'M' greentint -8.56 3.042 -6.877 {"}'M' greentint -9.482 2.019 -6.668 {"}'M' greentint -9.412 2.266 -6.657 {"}'M' greentint -9.297 2.496 -6.647 {"}'M' greentint -8.952 2.874 -6.631 {"}'M' greentint -8.733 3.009 -6.625 {"}'M' greentint -8.493 3.102 -6.621 {"}'M' greentint -9.415 2.247 -6.399 {"}'M' greentint -9.302 2.478 -6.389 {"}'M' greentint -9.148 2.684 -6.38 {"}'M' greentint -8.959 2.858 -6.373 {"}'M' greentint -8.741 2.994 -6.367 {"}'M' greentint -9.309 2.357 -6.14 {"}'M' greentint -9.17 2.572 -6.131 {"}'M' greentint -8.994 2.757 -6.123 {"}'M' greentint -8.785 2.905 -6.116 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H GLY 220 B}'M' P -8.655 2.248 -6.837 {"}'M' -8.66 2.253 -6.836 {"}'M' P -8.706 2.232 -6.578 {"}'M' -8.719 2.246 -6.583 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 220 B}'M' greentint -8.559 2.701 -7.317 {"}'M' greentint -8.669 2.467 -7.328 {"}'M' greentint -8.843 2.277 -7.336 {"}'M' greentint -9.065 2.145 -7.342 {"}'M' greentint -8.456 2.688 -7.076 {"}'M' greentint -8.552 2.455 -7.087 {"}'M' greentint -8.706 2.255 -7.095 {"}'M' greentint -8.906 2.102 -7.102 {"}'M' greentint -9.139 2.005 -7.106 {"}'M' greentint -8.423 2.937 -7.066 {"}'M' greentint -8.418 2.685 -6.818 {"}'M' greentint -8.509 2.452 -6.828 {"}'M' greentint -8.846 2.087 -6.844 {"}'M' greentint -9.072 1.978 -6.848 {"}'M' greentint -9.318 1.929 -6.851 {"}'M' greentint -8.389 2.934 -6.807 {"}'M' greentint -8.456 2.665 -6.559 {"}'M' greentint -8.552 2.432 -6.569 {"}'M' greentint -8.906 2.079 -6.585 {"}'M' greentint -9.139 1.983 -6.589 {"}'M' greentint -9.389 1.95 -6.591 {"}'M' greentint -8.423 2.915 -6.548 {"}'M' greentint -8.559 2.657 -6.318 {"}'M' greentint -8.669 2.424 -6.328 {"}'M' greentint -8.843 2.233 -6.337 {"}'M' greentint -9.065 2.102 -6.343 {"}'M' greentint -9.316 2.042 -6.345 {"}'M' greentint -8.523 2.912 -6.307 {"}'M' greentint -8.73 2.64 -6.112 {"}'M' greentint -8.866 2.419 -6.121 {"}'M' greentint -9.074 2.263 -6.128 {"}'M' greentint -9.324 2.192 -6.131 {"}'M' greentint -8.682 2.895 -6.101 {"}'M' greentint -8.952 2.646 -5.952 {"}'M' greentint -9.132 2.46 -5.961 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 202 B}'M' greentint -10.007 1.45 -5.307 {"}'M' greentint -9.863 1.664 -5.298 {"}'M' greentint -9.663 1.827 -5.291 {"}'M' greentint -10.156 1.321 -5.072 {"}'M' greentint -10.06 1.554 -5.062 {"}'M' greentint -9.906 1.754 -5.053 {"}'M' greentint -9.706 1.907 -5.046 {"}'M' greentint -9.473 2.003 -5.042 {"}'M' greentint -10.216 1.177 -4.819 {"}'M' greentint -10.156 1.42 -4.808 {"}'M' greentint -10.037 1.641 -4.799 {"}'M' greentint -9.867 1.825 -4.791 {"}'M' greentint -9.656 1.961 -4.785 {"}'M' greentint -9.418 2.04 -4.781 {"}'M' greentint -10.189 1.049 -4.565 {"}'M' greentint -10.156 1.298 -4.555 {"}'M' greentint -10.06 1.531 -4.544 {"}'M' greentint -9.906 1.731 -4.536 {"}'M' greentint -9.706 1.884 -4.529 {"}'M' greentint -9.473 1.981 -4.525 {"}'M' greentint -10.081 1.159 -4.319 {"}'M' greentint -10.007 1.406 -4.308 {"}'M' greentint -9.863 1.621 -4.299 {"}'M' greentint -9.663 1.783 -4.292 {"}'M' greentint -9.824 1.401 -4.101 {"}'M' greentint -9.649 1.593 -4.093 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 220 B}'M' greentint -9.583 1.815 -5.273 {"}'M' greentint -9.706 1.594 -5.283 {"}'M' greentint -9.872 1.402 -5.291 {"}'M' greentint -10.072 1.247 -5.298 {"}'M' greentint -9.482 1.806 -5.032 {"}'M' greentint -9.598 1.578 -5.042 {"}'M' greentint -9.755 1.376 -5.051 {"}'M' greentint -9.947 1.208 -5.058 {"}'M' greentint -10.168 1.078 -5.064 {"}'M' greentint -9.365 2.032 -4.768 {"}'M' greentint -9.435 1.785 -4.779 {"}'M' greentint -9.55 1.554 -4.789 {"}'M' greentint -9.705 1.349 -4.798 {"}'M' greentint -9.895 1.176 -4.806 {"}'M' greentint -10.114 1.041 -4.811 {"}'M' greentint -9.432 1.781 -4.521 {"}'M' greentint -9.545 1.55 -4.531 {"}'M' greentint -9.699 1.344 -4.54 {"}'M' greentint -9.888 1.17 -4.547 {"}'M' greentint -10.106 1.033 -4.553 {"}'M' greentint -9.485 1.765 -4.267 {"}'M' greentint -9.602 1.538 -4.277 {"}'M' greentint -9.76 1.337 -4.286 {"}'M' greentint -9.954 1.169 -4.293 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ile A 201 1phmA_321Y_203}P -6.305 5.533 -11.45 {"}-6.305 5.533 -11.45 { ca ile A 201 1phmA_321Y_203}-7.465 6.062 -10.763 { c ile A 201 1phmA_321Y_203}-7.791 5.188 -9.594 { o ile A 201 1phmA_321Y_203}-7.806 3.953 -9.711 { c ile A 201 1phmA_321Y_203}P -7.791 5.188 -9.594 { n ala A 202 1phmA_321Y_203}-7.992 5.837 -8.442 { ca ala A 202 1phmA_321Y_203}-8.335 5.161 -7.215 { c ala A 202 1phmA_321Y_203}-9.822 4.91 -7.199 { o ala A 202 1phmA_321Y_203}-10.606 5.734 -7.667 { c ala A 202 1phmA_321Y_203}P -9.822 4.91 -7.199 { n gly A 203 1phmA_321Y_203}-10.213 3.786 -6.608 { ca gly A 203 1phmA_321Y_203}-11.613 3.448 -6.524 { c gly A 203 1phmA_321Y_203}-11.791 2.615 -5.286 { o gly A 203 1phmA_321Y_203}-10.816 2.321 -4.562 { c gly A 203 1phmA_321Y_203}P -11.791 2.615 -5.286 { n met A 204 1phmA_321Y_203}-13.025 2.192 -5.043 { ca met A 204 1phmA_321Y_203}-13.33 1.431 -3.851 { c met A 204 1phmA_321Y_203}-14.229 0.249 -4.168 { o met A 204 1phmA_321Y_203}-15.229 0.391 -4.888 { c met A 204 1phmA_321Y_203}P -14.229 0.249 -4.168 { n tyr A 205 1phmA_321Y_203}-13.875 -0.908 -3.624 { ca tyr A 205 1phmA_321Y_203}-14.696 -2.088 -3.797 { c tyr A 205 1phmA_321Y_203}-15.169 -2.386 -2.402 { o tyr A 205 1phmA_321Y_203}-14.374 -2.792 -1.548 { n ile A 319 1phmA_321Y_203}P -12.153 -2.089 0.166 {"}-12.153 -2.089 0.166 { ca ile A 319 1phmA_321Y_203}-10.968 -2.456 -0.543 { c ile A 319 1phmA_321Y_203}-10.634 -1.314 -1.461 { o ile A 319 1phmA_321Y_203}-11.332 -1.076 -2.463 { c ile A 319 1phmA_321Y_203}P -10.634 -1.314 -1.461 { n met A 320 1phmA_321Y_203}-9.545 -0.613 -1.162 { ca met A 320 1phmA_321Y_203}-9.153 0.51 -1.988 { c met A 320 1phmA_321Y_203}-8.194 0.023 -3.047 { o met A 320 1phmA_321Y_203}-7.179 -0.613 -2.735 { c met A 320 1phmA_321Y_203}P -8.194 0.023 -3.047 { n tyr A 321 1phmA_321Y_203}-8.41 0.461 -4.278 { ca tyr A 321 1phmA_321Y_203}-7.597 -0.027 -5.388 { c tyr A 321 1phmA_321Y_203}-7.28 1.051 -6.375 { o tyr A 321 1phmA_321Y_203}-7.816 2.146 -6.279 { c tyr A 321 1phmA_321Y_203}P -7.28 1.051 -6.375 { n tyr A 322 1phmA_321Y_203}-6.416 0.733 -7.341 { ca tyr A 322 1phmA_321Y_203}-6.139 1.64 -8.439 { c tyr A 322 1phmA_321Y_203}-6.34 0.837 -9.729 { o tyr A 322 1phmA_321Y_203}-6.242 -0.421 -9.727 { c tyr A 322 1phmA_321Y_203}P -6.34 0.837 -9.729 { n met A 323 1phmA_321Y_203}-6.671 1.545 -10.802 { ca met A 323 1phmA_321Y_203}-6.869 0.915 -12.113 { c met A 323 1phmA_321Y_203}-6.273 1.855 -13.136 { o met A 323 1phmA_321Y_203}-6.117 3.048 -12.866 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 201 1phmA_321Y_203}P -6.305 5.533 -11.45 { ca ile A 201 1phmA_321Y_203}P -7.465 6.062 -10.763 { n ala A 202 1phmA_321Y_203}P -7.992 5.837 -8.442 { ca ala A 202 1phmA_321Y_203}P -8.335 5.161 -7.215 { n gly A 203 1phmA_321Y_203}P -10.213 3.786 -6.608 { ca gly A 203 1phmA_321Y_203}P -11.613 3.448 -6.524 {"}P -11.613 3.448 -6.524 { n met A 204 1phmA_321Y_203}P -13.025 2.192 -5.043 { ca met A 204 1phmA_321Y_203}P -13.33 1.431 -3.851 { n tyr A 205 1phmA_321Y_203}P -13.875 -0.908 -3.624 { ca tyr A 205 1phmA_321Y_203}P -14.696 -2.088 -3.797 { n ile A 319 1phmA_321Y_203}P -12.153 -2.089 0.166 { ca ile A 319 1phmA_321Y_203}P -10.968 -2.456 -0.543 { n met A 320 1phmA_321Y_203}P -9.545 -0.613 -1.162 { ca met A 320 1phmA_321Y_203}P -9.153 0.51 -1.988 { n tyr A 321 1phmA_321Y_203}P -8.41 0.461 -4.278 { ca tyr A 321 1phmA_321Y_203}P -7.597 -0.027 -5.388 { n tyr A 322 1phmA_321Y_203}P -6.416 0.733 -7.341 { ca tyr A 322 1phmA_321Y_203}P -6.139 1.64 -8.439 { n met A 323 1phmA_321Y_203}P -6.671 1.545 -10.802 { ca met A 323 1phmA_321Y_203}P -6.869 0.915 -12.113 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ile A 201 1phmA_321Y_203}P -7.465 6.062 -10.763 {"}-7.465 6.062 -10.763 { ca ala A 202 1phmA_321Y_203}-8.335 5.161 -7.215 { ca gly A 203 1phmA_321Y_203}-11.613 3.448 -6.524 { ca met A 204 1phmA_321Y_203}-13.33 1.431 -3.851 { ca tyr A 205 1phmA_321Y_203}-14.696 -2.088 -3.797 { ca ile A 319 1phmA_321Y_203}-10.968 -2.456 -0.543 { ca met A 320 1phmA_321Y_203}-9.153 0.51 -1.988 { ca tyr A 321 1phmA_321Y_203}-7.597 -0.027 -5.388 { ca tyr A 322 1phmA_321Y_203}-6.139 1.64 -8.439 { ca met A 323 1phmA_321Y_203}-6.869 0.915 -12.113 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile A 201 1phmA_321Y_203}P -7.465 6.062 -10.763 { ca ala A 202 1phmA_321Y_203}P -8.335 5.161 -7.215 { ca met A 204 1phmA_321Y_203}P -13.33 1.431 -3.851 { ca tyr A 205 1phmA_321Y_203}P -14.696 -2.088 -3.797 { ca ile A 319 1phmA_321Y_203}P -10.968 -2.456 -0.543 { ca met A 320 1phmA_321Y_203}P -9.153 0.51 -1.988 { ca tyr A 321 1phmA_321Y_203}P -7.597 -0.027 -5.388 { cb tyr A 321 1phmA_321Y_203}-8.424 -1.111 -6.149 { cg tyr A 321 1phmA_321Y_203}-9.748 -0.607 -6.759 { cd1 tyr A 321 1phmA_321Y_203}-9.754 0.178 -7.904 { ce1 tyr A 321 1phmA_321Y_203}-10.939 0.648 -8.466 { cz tyr A 321 1phmA_321Y_203}-12.126 0.322 -7.879 { oh tyr A 321 1phmA_321Y_203}-13.286 0.824 -8.43 { cg tyr A 321 1phmA_321Y_203}P -9.748 -0.607 -6.759 { cd2 tyr A 321 1phmA_321Y_203}-10.974 -0.918 -6.187 { ce2 tyr A 321 1phmA_321Y_203}-12.16 -0.463 -6.742 { cz tyr A 321 1phmA_321Y_203}ghost -12.126 0.322 -7.879 { ca tyr A 322 1phmA_321Y_203}P -6.139 1.64 -8.439 { ca met A 323 1phmA_321Y_203}P -6.869 0.915 -12.113 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 321 1phmA_321Y_203}P -8.424 -1.111 -6.149 {"}P -8.424 -1.111 -6.149 { cd1 tyr A 321 1phmA_321Y_203}P -9.754 0.178 -7.904 { cd2 tyr A 321 1phmA_321Y_203}P -10.974 -0.918 -6.187 { ce1 tyr A 321 1phmA_321Y_203}P -10.939 0.648 -8.466 { ce2 tyr A 321 1phmA_321Y_203}P -12.16 -0.463 -6.742 { oh tyr A 321 1phmA_321Y_203}P -13.286 0.824 -8.43 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 321 1phmA_321Y_203}P -7.597 -0.027 -5.388 { cb tyr A 321 1phmA_321Y_203}-8.424 -1.111 -6.149 { cg tyr A 321 1phmA_321Y_203}-9.748 -0.607 -6.759 { cd1 tyr A 321 1phmA_321Y_203}-9.754 0.178 -7.904 { ce1 tyr A 321 1phmA_321Y_203}-10.939 0.648 -8.466 { cz tyr A 321 1phmA_321Y_203}-12.126 0.322 -7.879 { oh tyr A 321 1phmA_321Y_203}-13.286 0.824 -8.43 { cg tyr A 321 1phmA_321Y_203}P -9.748 -0.607 -6.759 { cd2 tyr A 321 1phmA_321Y_203}-10.974 -0.918 -6.187 { ce2 tyr A 321 1phmA_321Y_203}-12.16 -0.463 -6.742 { cz tyr A 321 1phmA_321Y_203}ghost -12.126 0.322 -7.879 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 321 1phmA_321Y_203}P -8.424 -1.111 -6.149 {"}P -8.424 -1.111 -6.149 { cd1 tyr A 321 1phmA_321Y_203}P -9.754 0.178 -7.904 { cd2 tyr A 321 1phmA_321Y_203}P -10.974 -0.918 -6.187 { ce1 tyr A 321 1phmA_321Y_203}P -10.939 0.648 -8.466 { ce2 tyr A 321 1phmA_321Y_203}P -12.16 -0.463 -6.742 { oh tyr A 321 1phmA_321Y_203}P -13.286 0.824 -8.43 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 321 A}'P' green -11.577 2.277 -8.526 {"}'P' green -11.335 2.34 -8.261 {"}'P' green -11.078 2.38 -8.259 {"}'P' sea -10.874 2.334 -8.003 {"}'P' green -10.947 2.248 -7.756 { CZ TYR 321 A}'P' green -12.33 2.031 -8.194 {"}'P' green -12.637 1.839 -7.173 {"}'P' green -12.319 1.786 -6.939 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 321 A}'P' P -11.819 2.148 -8.27 {"}'P' -11.81 2.134 -8.271 {"}'P' P -11.584 2.262 -8.265 {"}'P' -11.574 2.235 -8.268 {"}'P' P -11.866 2.062 -8.014 {"}'P' -11.828 2.003 -8.033 {"}'P' P -11.637 2.186 -8.009 {"}'P' -11.596 2.097 -8.036 {"}'P' P -11.391 2.275 -8.005 {"}'P' -11.37 2.2 -8.026 {"}'P' P -11.135 2.324 -8.003 {"}'P' -11.133 2.311 -8.007 {"}'P' P -11.686 2.066 -7.764 {"}'P' -11.634 1.969 -7.813 {"}'P' P -11.45 2.165 -7.76 {"}'P' -11.416 2.064 -7.807 {"}'P' P -11.202 2.226 -7.757 {"}'P' -11.193 2.17 -7.782 {"}'P' P -11.621 1.962 -7.533 {"}'P' -11.586 1.893 -7.582 {"}'P' P -11.383 2.058 -7.529 {"}'P' -11.362 1.991 -7.573 {"}'P' P -11.132 2.112 -7.526 {"}'P' -11.129 2.092 -7.539 {"}'P' P -11.394 1.889 -7.32 {"}'P' -11.391 1.879 -7.329 { CZ TYR 321 A}'P' P -12.069 2.043 -8.194 {"}'P' -12.069 2.037 -8.193 {"}'P' P -12.514 2.027 -7.935 {"}'P' -12.513 2.024 -7.935 {"}'P' P -12.256 2.066 -7.934 {"}'P' -12.251 1.994 -7.931 {"}'P' P -11.996 2.066 -7.934 {"}'P' -12.003 1.969 -7.931 {"}'P' P -12.522 2.014 -7.674 {"}'P' -12.513 1.974 -7.679 {"}'P' P -12.265 2.054 -7.672 {"}'P' -12.255 1.938 -7.686 {"}'P' P -12.004 2.055 -7.672 {"}'P' -12.014 1.91 -7.69 {"}'P' P -11.746 2.018 -7.674 {"}'P' -11.772 1.901 -7.688 {"}'P' P -12.578 1.949 -7.418 {"}'P' -12.574 1.935 -7.422 {"}'P' P -12.322 1.998 -7.416 {"}'P' -12.311 1.904 -7.442 {"}'P' P -12.061 2.008 -7.416 {"}'P' -12.066 1.874 -7.452 {"}'P' P -11.801 1.978 -7.417 {"}'P' -11.824 1.861 -7.45 {"}'P' P -12.389 1.9 -7.17 {"}'P' -12.385 1.877 -7.181 {"}'P' P -12.134 1.922 -7.169 {"}'P' -12.134 1.853 -7.2 {"}'P' P -11.879 1.903 -7.17 {"}'P' -11.89 1.835 -7.2 {"}'P' P -11.63 1.844 -7.173 {"}'P' -11.638 1.821 -7.183 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 321 A}'P' sky -12.912 2.16 -8.242 {"}'P' sky -13.104 2.036 -7.752 {"}'P' blue -13.092 1.886 -7.539 { HH TYR 321 A}'P' blue -12.748 2.307 -8.576 {"}'P' sky -12.524 2.18 -8.582 {"}'P' blue -12.346 1.992 -8.59 {"}'P' blue -12.992 2.193 -8.374 {"}'P' sky -12.742 2.122 -8.377 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 321 A}'P' sea -12.672 2.069 -8.246 {"}'P' sea -12.969 2.115 -7.99 {"}'P' green -12.727 2.031 -7.994 {"}'P' sea -12.858 1.974 -7.755 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 203 A}'P' sky -12.493 2.462 -8.351 {"}'P' sky -12.699 2.422 -8.168 {"}'P' sky -12.867 2.424 -7.946 {"}'P' blue -12.958 2.401 -7.699 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 203 A}'P' green -11.375 2.462 -8.351 {"}'P' green -11.569 2.3 -8.358 {"}'P' green -11.807 2.213 -8.362 {"}'P' green -11.16 2.436 -8.167 {"}'P' green -12.306 2.088 -8.182 {"}'P' sea -12.527 2.227 -8.176 {"}'P' green -11.001 2.424 -7.946 {"}'P' green -12.533 2.046 -7.962 {"}'P' sea -12.723 2.215 -7.955 {"}'P' green -12.639 2.006 -7.716 {"}'P' sea -12.821 2.185 -7.708 {"}'P' green -12.308 1.884 -6.953 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 203 A}'P' P -11.329 2.238 -8.176 {"}'P' -11.351 2.262 -8.147 {"}'P' P -11.546 2.095 -8.182 {"}'P' -11.572 2.148 -8.131 {"}'P' P -11.796 2.019 -8.185 {"}'P' -11.802 2.06 -8.15 {"}'P' P -12.056 2.017 -8.185 {"}'P' -12.055 2.027 -8.177 {"}'P' P -11.145 2.215 -7.955 {"}'P' -11.175 2.241 -7.934 {"}'P' P -11.335 2.046 -7.962 {"}'P' -11.389 2.123 -7.913 {"}'P' P -11.56 1.928 -7.967 {"}'P' -11.599 2.028 -7.91 {"}'P' P -11.807 1.868 -7.97 {"}'P' -11.816 1.943 -7.929 {"}'P' P -12.061 1.868 -7.97 {"}'P' -12.05 1.955 -7.922 {"}'P' P -12.308 1.928 -7.967 {"}'P' -12.287 1.982 -7.936 {"}'P' P -11.037 2.198 -7.708 {"}'P' -11.045 2.205 -7.705 {"}'P' P -11.216 2.016 -7.716 {"}'P' -11.267 2.078 -7.695 {"}'P' P -11.432 1.879 -7.722 {"}'P' -11.481 1.978 -7.692 {"}'P' P -11.672 1.793 -7.726 {"}'P' -11.695 1.888 -7.699 {"}'P' P -11.926 1.763 -7.727 {"}'P' -11.927 1.901 -7.689 {"}'P' P -12.18 1.79 -7.726 {"}'P' -12.151 1.918 -7.69 {"}'P' P -12.422 1.872 -7.722 {"}'P' -12.387 1.944 -7.701 {"}'P' P -11.177 2 -7.456 {"}'P' -11.191 2.017 -7.455 {"}'P' P -11.386 1.858 -7.462 {"}'P' -11.413 1.909 -7.46 {"}'P' P -11.621 1.765 -7.466 {"}'P' -11.643 1.845 -7.463 {"}'P' P -11.871 1.724 -7.468 {"}'P' -11.878 1.857 -7.462 {"}'P' P -12.123 1.738 -7.467 {"}'P' -12.101 1.873 -7.461 {"}'P' P -12.367 1.805 -7.464 {"}'P' -12.332 1.894 -7.461 {"}'P' P -12.591 1.924 -7.459 {"}'P' -12.582 1.936 -7.459 {"}'P' P -11.672 1.77 -7.205 {"}'P' -11.682 1.813 -7.213 {"}'P' P -11.926 1.74 -7.207 {"}'P' -11.926 1.823 -7.222 {"}'P' P -12.18 1.767 -7.205 {"}'P' -12.164 1.841 -7.219 {"}'P' P -12.422 1.849 -7.202 {"}'P' -12.41 1.873 -7.207 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 321 A}'M' green -8.912 2.781 -6.876 {"}'M' green -9.157 2.282 -6.657 {"}'M' green -9.156 2.257 -5.891 {"}'M' green -9.014 2.486 -5.64 {"}'M' green -8.772 2.928 -5.62 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 321 A}'M' greentint -9.11 2.534 -6.646 {"}'M' greentint -9.017 2.772 -6.635 {"}'M' greentint -8.879 2.988 -6.626 {"}'M' greentint -8.704 3.174 -6.618 {"}'M' greentint -9.186 2.408 -6.397 {"}'M' greentint -9.116 2.655 -6.386 {"}'M' greentint -9.001 2.885 -6.376 {"}'M' greentint -8.846 3.09 -6.367 {"}'M' greentint -8.656 3.263 -6.36 {"}'M' greentint -9.188 2.388 -6.139 {"}'M' greentint -9.119 2.636 -6.128 {"}'M' greentint -9.006 2.867 -6.118 {"}'M' greentint -8.852 3.073 -6.109 {"}'M' greentint -8.663 3.247 -6.102 {"}'M' greentint -9.108 2.508 -5.88 {"}'M' greentint -9.013 2.746 -5.869 {"}'M' greentint -8.874 2.961 -5.86 {"}'M' greentint -8.698 3.146 -5.852 {"}'M' greentint -8.916 2.719 -5.629 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 203 A}'M' greentint -8.763 2.894 -6.704 {"}'M' greentint -8.873 2.66 -6.715 {"}'M' greentint -9.047 2.47 -6.723 {"}'M' greentint -8.66 2.881 -6.463 {"}'M' greentint -8.756 2.648 -6.474 {"}'M' greentint -8.91 2.448 -6.482 {"}'M' greentint -9.11 2.295 -6.489 {"}'M' greentint -8.627 3.13 -6.453 {"}'M' greentint -8.622 2.878 -6.205 {"}'M' greentint -8.713 2.645 -6.215 {"}'M' greentint -8.859 2.441 -6.224 {"}'M' greentint -9.05 2.28 -6.231 {"}'M' greentint -8.593 3.127 -6.194 {"}'M' greentint -8.66 2.858 -5.946 {"}'M' greentint -8.756 2.625 -5.956 {"}'M' greentint -8.91 2.425 -5.965 {"}'M' greentint -9.11 2.272 -5.972 {"}'M' greentint -8.627 3.108 -5.935 {"}'M' greentint -8.763 2.85 -5.705 {"}'M' greentint -8.873 2.617 -5.715 {"}'M' greentint -9.047 2.426 -5.724 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 321 A}'M' green -9.969 1.271 -5.022 {"}'M' green -9.551 1.895 -4.995 {"}'M' green -10.077 1.139 -4.787 {"}'M' green -10.077 1.117 -4.269 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 321 A}'M' greentint -9.895 1.518 -5.011 {"}'M' greentint -9.751 1.732 -5.002 {"}'M' greentint -10.044 1.389 -4.776 {"}'M' greentint -9.948 1.622 -4.766 {"}'M' greentint -9.794 1.822 -4.757 {"}'M' greentint -9.594 1.975 -4.75 {"}'M' greentint -10.104 1.245 -4.523 {"}'M' greentint -10.044 1.488 -4.512 {"}'M' greentint -9.925 1.709 -4.503 {"}'M' greentint -9.755 1.893 -4.495 {"}'M' greentint -9.544 2.029 -4.489 {"}'M' greentint -10.044 1.366 -4.259 {"}'M' greentint -9.948 1.599 -4.248 {"}'M' greentint -9.794 1.799 -4.24 {"}'M' greentint -9.594 1.952 -4.233 {"}'M' greentint -9.895 1.474 -4.012 {"}'M' greentint -9.751 1.689 -4.003 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 203 A}'M' green -9.787 1.633 -5.217 {"}'M' green -10.028 1.247 -4.992 {"}'M' green -9.446 2.071 -4.702 {"}'M' green -9.444 2.068 -4.444 {"}'M' green -10.187 1.072 -4.487 {"}'M' green -9.494 2.05 -4.19 {"}'M' green -9.661 1.807 -3.96 {"}'M' green -9.947 1.392 -3.978 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 203 A}'M' greentint -9.563 1.845 -4.966 {"}'M' greentint -9.679 1.617 -4.976 {"}'M' greentint -9.836 1.415 -4.985 {"}'M' greentint -9.516 1.824 -4.713 {"}'M' greentint -9.631 1.593 -4.723 {"}'M' greentint -9.786 1.388 -4.732 {"}'M' greentint -9.976 1.215 -4.74 {"}'M' greentint -9.513 1.82 -4.455 {"}'M' greentint -9.626 1.589 -4.465 {"}'M' greentint -9.78 1.383 -4.474 {"}'M' greentint -9.969 1.209 -4.481 {"}'M' greentint -9.566 1.804 -4.201 {"}'M' greentint -9.683 1.577 -4.211 {"}'M' greentint -9.841 1.376 -4.22 {"}'M' greentint -10.035 1.208 -4.227 {"}'M' greentint -9.783 1.585 -3.969 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n phe B 143 1pk6B_145Y_183}P -11.37 -1.52 1.481 {"}-11.37 -1.52 1.481 { ca phe B 143 1pk6B_145Y_183}-10.961 -2.057 0.192 { c phe B 143 1pk6B_145Y_183}-10.685 -0.92 -0.783 { o phe B 143 1pk6B_145Y_183}-11.42 0.073 -0.819 { c phe B 143 1pk6B_145Y_183}P -10.685 -0.92 -0.783 { n thr B 144 1pk6B_145Y_183}-9.638 -1.087 -1.582 { ca thr B 144 1pk6B_145Y_183}-9.246 -0.046 -2.513 { c thr B 144 1pk6B_145Y_183}-8.497 -0.563 -3.742 { o thr B 144 1pk6B_145Y_183}-7.935 -1.662 -3.734 { c thr B 144 1pk6B_145Y_183}P -8.497 -0.563 -3.742 { n tyr B 145 1pk6B_145Y_183}-8.505 0.229 -4.808 { ca tyr B 145 1pk6B_145Y_183}-7.791 -0.168 -6.002 { c tyr B 145 1pk6B_145Y_183}-7.38 1.05 -6.807 { o tyr B 145 1pk6B_145Y_183}-7.943 2.142 -6.658 { c tyr B 145 1pk6B_145Y_183}P -7.38 1.05 -6.807 { n his B 146 1pk6B_145Y_183}-6.365 0.847 -7.635 { ca his B 146 1pk6B_145Y_183}-5.87 1.879 -8.535 { c his B 146 1pk6B_145Y_183}-5.694 1.131 -9.847 { o his B 146 1pk6B_145Y_183}-4.906 0.189 -9.948 { c his B 146 1pk6B_145Y_183}P -5.694 1.131 -9.847 { n ala B 147 1pk6B_145Y_183}-6.451 1.532 -10.854 { ca ala B 147 1pk6B_145Y_183}-6.379 0.863 -12.146 { c ala B 147 1pk6B_145Y_183}-5.842 1.743 -13.265 { o ala B 147 1pk6B_145Y_183}-6.394 2.819 -13.524 { n thr B 181 1pk6B_145Y_183}P -7.085 5.397 -12.421 {"}-7.085 5.397 -12.421 { ca thr B 181 1pk6B_145Y_183}-8.277 5.732 -11.672 { c thr B 181 1pk6B_145Y_183}-8.309 4.977 -10.356 { o thr B 181 1pk6B_145Y_183}-7.552 4.024 -10.153 { c thr B 181 1pk6B_145Y_183}P -8.309 4.977 -10.356 { n thr B 182 1pk6B_145Y_183}-9.185 5.405 -9.463 { ca thr B 182 1pk6B_145Y_183}-9.255 4.752 -8.18 { c thr B 182 1pk6B_145Y_183}-10.66 4.695 -7.593 { o thr B 182 1pk6B_145Y_183}-11.553 5.457 -7.975 { c thr B 182 1pk6B_145Y_183}P -10.66 4.695 -7.593 { n gly B 183 1pk6B_145Y_183}-10.828 3.758 -6.666 { ca gly B 183 1pk6B_145Y_183}-12.093 3.559 -5.992 { c gly B 183 1pk6B_145Y_183}-11.755 2.949 -4.648 { o gly B 183 1pk6B_145Y_183}-10.672 2.366 -4.479 { c gly B 183 1pk6B_145Y_183}P -11.755 2.949 -4.648 { n gly B 184 1pk6B_145Y_183}-12.67 3.089 -3.695 { ca gly B 184 1pk6B_145Y_183}-12.455 2.55 -2.364 { c gly B 184 1pk6B_145Y_183}-13.757 2.44 -1.593 { o gly B 184 1pk6B_145Y_183}-14.728 3.163 -1.867 { c gly B 184 1pk6B_145Y_183}P -13.757 2.44 -1.593 { n met B 185 1pk6B_145Y_183}-13.772 1.547 -0.606 { ca met B 185 1pk6B_145Y_183}-14.976 1.34 0.188 { c met B 185 1pk6B_145Y_183}-14.707 0.67 1.531 { o met B 185 1pk6B_145Y_183}-13.849 -0.227 1.641 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe B 143 1pk6B_145Y_183}P -11.37 -1.52 1.481 { ca phe B 143 1pk6B_145Y_183}P -10.961 -2.057 0.192 { n thr B 144 1pk6B_145Y_183}P -9.638 -1.087 -1.582 { ca thr B 144 1pk6B_145Y_183}P -9.246 -0.046 -2.513 { n tyr B 145 1pk6B_145Y_183}P -8.505 0.229 -4.808 { ca tyr B 145 1pk6B_145Y_183}P -7.791 -0.168 -6.002 { n his B 146 1pk6B_145Y_183}P -6.365 0.847 -7.635 { ca his B 146 1pk6B_145Y_183}P -5.87 1.879 -8.535 { n ala B 147 1pk6B_145Y_183}P -6.451 1.532 -10.854 { ca ala B 147 1pk6B_145Y_183}P -6.379 0.863 -12.146 { n thr B 181 1pk6B_145Y_183}P -7.085 5.397 -12.421 { ca thr B 181 1pk6B_145Y_183}P -8.277 5.732 -11.672 { n thr B 182 1pk6B_145Y_183}P -9.185 5.405 -9.463 { ca thr B 182 1pk6B_145Y_183}P -9.255 4.752 -8.18 { n gly B 183 1pk6B_145Y_183}P -10.828 3.758 -6.666 { ca gly B 183 1pk6B_145Y_183}P -12.093 3.559 -5.992 {"}P -12.093 3.559 -5.992 { n gly B 184 1pk6B_145Y_183}P -12.67 3.089 -3.695 { ca gly B 184 1pk6B_145Y_183}P -12.455 2.55 -2.364 {"}P -12.455 2.55 -2.364 { n met B 185 1pk6B_145Y_183}P -13.772 1.547 -0.606 { ca met B 185 1pk6B_145Y_183}P -14.976 1.34 0.188 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca phe B 143 1pk6B_145Y_183}P -10.961 -2.057 0.192 {"}-10.961 -2.057 0.192 { ca thr B 144 1pk6B_145Y_183}-9.246 -0.046 -2.513 { ca tyr B 145 1pk6B_145Y_183}-7.791 -0.168 -6.002 { ca his B 146 1pk6B_145Y_183}-5.87 1.879 -8.535 { ca ala B 147 1pk6B_145Y_183}-6.379 0.863 -12.146 { ca thr B 181 1pk6B_145Y_183}P -8.277 5.732 -11.672 {"}-8.277 5.732 -11.672 { ca thr B 182 1pk6B_145Y_183}-9.255 4.752 -8.18 { ca gly B 183 1pk6B_145Y_183}-12.093 3.559 -5.992 { ca gly B 184 1pk6B_145Y_183}-12.455 2.55 -2.364 { ca met B 185 1pk6B_145Y_183}-14.976 1.34 0.188 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca phe B 143 1pk6B_145Y_183}P -10.961 -2.057 0.192 { ca thr B 144 1pk6B_145Y_183}P -9.246 -0.046 -2.513 { ca tyr B 145 1pk6B_145Y_183}P -7.791 -0.168 -6.002 { cb tyr B 145 1pk6B_145Y_183}-8.653 -1.083 -6.882 { cg tyr B 145 1pk6B_145Y_183}-9.774 -0.375 -7.608 { cd1 tyr B 145 1pk6B_145Y_183}-9.556 0.24 -8.843 { ce1 tyr B 145 1pk6B_145Y_183}-10.562 0.941 -9.48 { cz tyr B 145 1pk6B_145Y_183}-11.801 1.035 -8.884 { oh tyr B 145 1pk6B_145Y_183}-12.788 1.745 -9.518 { cg tyr B 145 1pk6B_145Y_183}P -9.774 -0.375 -7.608 { cd2 tyr B 145 1pk6B_145Y_183}-11.037 -0.272 -7.036 { ce2 tyr B 145 1pk6B_145Y_183}-12.05 0.43 -7.662 { cz tyr B 145 1pk6B_145Y_183}ghost -11.801 1.035 -8.884 { ca his B 146 1pk6B_145Y_183}P -5.87 1.879 -8.535 { ca ala B 147 1pk6B_145Y_183}P -6.379 0.863 -12.146 { ca thr B 181 1pk6B_145Y_183}P -8.277 5.732 -11.672 { ca thr B 182 1pk6B_145Y_183}P -9.255 4.752 -8.18 { ca met B 185 1pk6B_145Y_183}P -14.976 1.34 0.188 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr B 145 1pk6B_145Y_183}P -8.653 -1.083 -6.882 {"}P -8.653 -1.083 -6.882 { cd1 tyr B 145 1pk6B_145Y_183}P -9.556 0.24 -8.843 { cd2 tyr B 145 1pk6B_145Y_183}P -11.037 -0.272 -7.036 { ce1 tyr B 145 1pk6B_145Y_183}P -10.562 0.941 -9.48 { ce2 tyr B 145 1pk6B_145Y_183}P -12.05 0.43 -7.662 { oh tyr B 145 1pk6B_145Y_183}P -12.788 1.745 -9.518 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr B 145 1pk6B_145Y_183}P -7.791 -0.168 -6.002 { cb tyr B 145 1pk6B_145Y_183}-8.653 -1.083 -6.882 { cg tyr B 145 1pk6B_145Y_183}-9.774 -0.375 -7.608 { cd1 tyr B 145 1pk6B_145Y_183}-9.556 0.24 -8.843 { ce1 tyr B 145 1pk6B_145Y_183}-10.562 0.941 -9.48 { cz tyr B 145 1pk6B_145Y_183}-11.801 1.035 -8.884 { oh tyr B 145 1pk6B_145Y_183}-12.788 1.745 -9.518 { cg tyr B 145 1pk6B_145Y_183}P -9.774 -0.375 -7.608 { cd2 tyr B 145 1pk6B_145Y_183}-11.037 -0.272 -7.036 { ce2 tyr B 145 1pk6B_145Y_183}-12.05 0.43 -7.662 { cz tyr B 145 1pk6B_145Y_183}ghost -11.801 1.035 -8.884 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr B 145 1pk6B_145Y_183}P -8.653 -1.083 -6.882 {"}P -8.653 -1.083 -6.882 { cd1 tyr B 145 1pk6B_145Y_183}P -9.556 0.24 -8.843 { cd2 tyr B 145 1pk6B_145Y_183}P -11.037 -0.272 -7.036 { ce1 tyr B 145 1pk6B_145Y_183}P -10.562 0.941 -9.48 { ce2 tyr B 145 1pk6B_145Y_183}P -12.05 0.43 -7.662 { oh tyr B 145 1pk6B_145Y_183}P -12.788 1.745 -9.518 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 145 B}'P' sky -12.688 2.059 -7.722 { CZ TYR 145 B}'P' blue -12.702 2.214 -7.957 {"}'P' sky -12.483 2.349 -7.951 {"}'P' blue -12.245 2.445 -7.947 {"}'P' sky -12.004 2.339 -7.735 { HE2 TYR 145 B}'P' blue -13.293 1.428 -6.896 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 145 B}'P' sea -12.93 1.93 -7.466 {"}'P' green -12.695 2.044 -7.461 {"}'P' green -12.446 2.122 -7.457 {"}'P' green -12.189 2.162 -7.455 {"}'P' sea -11.928 2.163 -7.455 {"}'P' green -12.977 1.844 -7.21 {"}'P' green -11.985 2.116 -7.199 {"}'P' green -13.014 1.714 -6.966 {"}'P' green -12.058 2.03 -6.952 {"}'P' green -12.951 1.609 -6.735 {"}'P' sea -12.741 1.562 -6.52 {"}'P' green -12.505 1.671 -6.516 {"}'P' green -12.253 1.734 -6.513 { CZ TYR 145 B}'P' sea -12.492 2.167 -7.742 {"}'P' sea -12.256 2.276 -7.738 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 145 B}'P' P -12.748 1.968 -7.205 {"}'P' -12.738 1.947 -7.211 {"}'P' P -12.502 2.057 -7.201 {"}'P' -12.49 2.013 -7.214 {"}'P' P -12.246 2.106 -7.199 {"}'P' -12.243 2.085 -7.205 {"}'P' P -12.797 1.848 -6.96 {"}'P' -12.785 1.827 -6.971 {"}'P' P -12.561 1.947 -6.956 {"}'P' -12.542 1.891 -6.982 {"}'P' P -12.313 2.008 -6.953 {"}'P' -12.305 1.958 -6.976 {"}'P' P -12.732 1.744 -6.729 {"}'P' -12.731 1.741 -6.731 {"}'P' P -12.494 1.84 -6.725 {"}'P' -12.484 1.81 -6.744 {"}'P' P -12.243 1.894 -6.722 {"}'P' -12.24 1.878 -6.732 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 183 B}'P' blue -12.305 2.695 -7.637 {"}'P' sky -12.488 2.506 -7.645 {"}'P' sky -12.741 2.434 -7.648 {"}'P' sky -12.19 2.466 -7.507 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 183 B}'P' sea -12.384 2.304 -7.514 {"}'P' green -12.622 2.217 -7.518 {"}'P' sea -12.876 2.217 -7.518 {"}'P' green -12.144 2.242 -7.332 {"}'P' green -12.871 2.021 -7.341 {"}'P' green -11.96 2.219 -7.111 {"}'P' sea -13.123 1.932 -7.123 {"}'P' green -12.031 2.02 -6.872 {"}'P' green -12.995 1.794 -6.882 {"}'P' green -12.201 1.862 -6.618 {"}'P' green -12.686 1.728 -6.624 {"}'P' green -12.938 1.742 -6.623 {"}'P' sea -12.487 1.774 -6.361 {"}'P' sea -12.741 1.744 -6.363 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 183 B}'P' P -12.361 2.099 -7.338 {"}'P' -12.365 2.106 -7.331 {"}'P' P -12.611 2.023 -7.341 {"}'P' -12.612 2.035 -7.331 {"}'P' P -12.15 2.05 -7.118 {"}'P' -12.16 2.064 -7.109 {"}'P' P -12.375 1.932 -7.123 {"}'P' -12.395 1.982 -7.095 {"}'P' P -12.622 1.872 -7.126 {"}'P' -12.628 1.919 -7.1 {"}'P' P -12.876 1.872 -7.126 {"}'P' -12.876 1.873 -7.125 {"}'P' P -12.247 1.883 -6.878 {"}'P' -12.265 1.921 -6.866 {"}'P' P -12.487 1.797 -6.882 {"}'P' -12.5 1.852 -6.866 {"}'P' P -12.741 1.767 -6.883 {"}'P' -12.741 1.794 -6.876 {"}'P' P -12.436 1.769 -6.622 {"}'P' -12.438 1.774 -6.622 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 145 B}'M' sky -9.006 2.984 -7.005 {"}'M' sky -9.337 2.148 -6.787 {"}'M' sky -9.337 2.128 -6.529 {"}'M' sky -9.191 2.233 -6.029 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 145 B}'M' sea -9.237 2.53 -7.025 {"}'M' sea -9.144 2.768 -7.014 {"}'M' green -9.313 2.404 -6.776 {"}'M' green -9.243 2.651 -6.765 {"}'M' green -9.128 2.881 -6.755 {"}'M' sea -8.973 3.086 -6.746 {"}'M' green -9.315 2.384 -6.518 {"}'M' green -9.246 2.632 -6.507 {"}'M' green -9.133 2.863 -6.497 {"}'M' sea -9.283 2.253 -6.27 {"}'M' green -9.235 2.504 -6.259 {"}'M' green -9.14 2.742 -6.248 {"}'M' green -9.001 2.957 -6.239 {"}'M' sea -9.141 2.482 -6.019 {"}'M' sea -9.043 2.715 -6.008 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 183 B}'M' -9.445 2.909 -7.09 {"}'M' -9.558 2.484 -6.901 {"}'M' -9.238 3.163 -6.871 {"}'M' -9.621 2.309 -6.667 {"}'M' -9.274 2.864 -5.883 {"}'M' -9.384 2.631 -5.893 @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 183 B}'M' sea -9.274 2.908 -6.882 {"}'M' sea -9.384 2.674 -6.893 {"}'M' green -9.171 2.895 -6.641 {"}'M' green -9.267 2.662 -6.652 {"}'M' green -9.421 2.462 -6.66 {"}'M' sea -9.138 3.144 -6.631 {"}'M' green -9.133 2.892 -6.383 {"}'M' green -9.224 2.659 -6.393 {"}'M' green -9.37 2.455 -6.402 {"}'M' sea -9.561 2.294 -6.409 {"}'M' green -9.171 2.872 -6.124 {"}'M' green -9.267 2.639 -6.134 {"}'M' sea -9.421 2.439 -6.143 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 145 B}'M' green -9.617 1.713 -5.338 {"}'M' green -9.91 1.37 -5.112 {"}'M' green -9.46 1.956 -5.086 {"}'M' green -9.943 1.098 -4.605 {"}'M' green -9.227 2.03 -4.565 {"}'M' green -9.835 1.208 -4.359 {"}'M' green -9.578 1.45 -4.141 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 145 B}'M' greentint -9.814 1.603 -5.102 {"}'M' greentint -9.66 1.803 -5.093 {"}'M' greentint -9.97 1.226 -4.859 {"}'M' greentint -9.91 1.469 -4.848 {"}'M' greentint -9.791 1.69 -4.839 {"}'M' greentint -9.621 1.874 -4.831 {"}'M' greentint -9.41 2.01 -4.825 {"}'M' greentint -9.91 1.347 -4.595 {"}'M' greentint -9.814 1.58 -4.584 {"}'M' greentint -9.66 1.78 -4.576 {"}'M' greentint -9.46 1.933 -4.569 {"}'M' greentint -9.761 1.455 -4.348 {"}'M' greentint -9.617 1.67 -4.339 {"}'M' greentint -9.417 1.832 -4.332 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 183 B}'M' green -9.811 1.692 -5.353 {"}'M' green -10.009 1.331 -5.149 {"}'M' green -9.348 2.136 -4.873 {"}'M' green -10.105 1.162 -4.915 {"}'M' green -9.302 2.116 -4.619 {"}'M' green -10.051 1.125 -4.662 {"}'M' green -9.539 1.622 -4.128 {"}'M' green -9.697 1.421 -4.137 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 183 B}'M' greentint -9.52 1.899 -5.124 {"}'M' greentint -9.643 1.678 -5.134 {"}'M' greentint -9.809 1.486 -5.142 {"}'M' greentint -9.419 1.89 -4.883 {"}'M' greentint -9.535 1.662 -4.893 {"}'M' greentint -9.692 1.46 -4.902 {"}'M' greentint -9.884 1.292 -4.909 {"}'M' greentint -9.372 1.869 -4.63 {"}'M' greentint -9.487 1.638 -4.64 {"}'M' greentint -9.642 1.433 -4.649 {"}'M' greentint -9.832 1.26 -4.657 {"}'M' greentint -9.369 1.865 -4.372 {"}'M' greentint -9.482 1.634 -4.382 {"}'M' greentint -9.636 1.428 -4.391 {"}'M' greentint -9.825 1.254 -4.398 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n phe C 140 1pk6C_142Y_177}P -11.328 -1.664 1.362 {"}-11.328 -1.664 1.362 { ca phe C 140 1pk6C_142Y_177}-10.951 -2.145 0.03 { c phe C 140 1pk6C_142Y_177}-10.668 -0.919 -0.835 { o phe C 140 1pk6C_142Y_177}-11.414 0.064 -0.793 { c phe C 140 1pk6C_142Y_177}P -10.668 -0.919 -0.835 { n val C 141 1pk6C_142Y_177}-9.584 -0.983 -1.6 { ca val C 141 1pk6C_142Y_177}-9.188 0.118 -2.464 { c val C 141 1pk6C_142Y_177}-8.436 -0.429 -3.686 { o val C 141 1pk6C_142Y_177}-7.78 -1.481 -3.617 { c val C 141 1pk6C_142Y_177}P -8.436 -0.429 -3.686 { n tyr C 142 1pk6C_142Y_177}-8.57 0.259 -4.815 { ca tyr C 142 1pk6C_142Y_177}-7.888 -0.16 -6.028 { c tyr C 142 1pk6C_142Y_177}-7.456 1.081 -6.805 { o tyr C 142 1pk6C_142Y_177}-8.023 2.165 -6.634 { c tyr C 142 1pk6C_142Y_177}P -7.456 1.081 -6.805 { n his C 143 1pk6C_142Y_177}-6.432 0.905 -7.636 { ca his C 143 1pk6C_142Y_177}-5.902 1.949 -8.508 { c his C 143 1pk6C_142Y_177}-5.62 1.2 -9.81 { o his C 143 1pk6C_142Y_177}-4.65 0.436 -9.901 { c his C 143 1pk6C_142Y_177}P -5.62 1.2 -9.81 { n ala C 144 1pk6C_142Y_177}-6.48 1.414 -10.804 { ca ala C 144 1pk6C_142Y_177}-6.373 0.742 -12.105 { c ala C 144 1pk6C_142Y_177}-5.976 1.667 -13.257 { o ala C 144 1pk6C_142Y_177}-6.664 2.656 -13.531 { n asn C 175 1pk6C_142Y_177}P -7.748 4.983 -12.606 {"}-7.748 4.983 -12.606 { ca asn C 175 1pk6C_142Y_177}-9.099 4.934 -12.075 { c asn C 175 1pk6C_142Y_177}-8.947 4.419 -10.634 { o asn C 175 1pk6C_142Y_177}-8.338 3.357 -10.408 { c asn C 175 1pk6C_142Y_177}P -8.947 4.419 -10.634 { n ser C 176 1pk6C_142Y_177}-9.479 5.159 -9.669 { ca ser C 176 1pk6C_142Y_177}-9.372 4.722 -8.284 { c ser C 176 1pk6C_142Y_177}-10.739 4.598 -7.635 { o ser C 176 1pk6C_142Y_177}-11.719 5.252 -8.036 { c ser C 176 1pk6C_142Y_177}P -10.739 4.598 -7.635 { n gly C 177 1pk6C_142Y_177}-10.797 3.746 -6.621 { ca gly C 177 1pk6C_142Y_177}-12.039 3.526 -5.92 { c gly C 177 1pk6C_142Y_177}-11.788 2.783 -4.625 { o gly C 177 1pk6C_142Y_177}-10.755 2.105 -4.467 { c gly C 177 1pk6C_142Y_177}P -11.788 2.783 -4.625 { n gly C 178 1pk6C_142Y_177}-12.738 2.898 -3.704 { ca gly C 178 1pk6C_142Y_177}-12.596 2.237 -2.422 { c gly C 178 1pk6C_142Y_177}-13.823 2.348 -1.544 { o gly C 178 1pk6C_142Y_177}-14.676 3.218 -1.749 { c gly C 178 1pk6C_142Y_177}P -13.823 2.348 -1.544 { n val C 179 1pk6C_142Y_177}-13.898 1.47 -0.546 { ca val C 179 1pk6C_142Y_177}-15.051 1.449 0.346 { c val C 179 1pk6C_142Y_177}-14.785 0.641 1.619 { o val C 179 1pk6C_142Y_177}-14.004 -0.322 1.608 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe C 140 1pk6C_142Y_177}P -11.328 -1.664 1.362 { ca phe C 140 1pk6C_142Y_177}P -10.951 -2.145 0.03 { n val C 141 1pk6C_142Y_177}P -9.584 -0.983 -1.6 { ca val C 141 1pk6C_142Y_177}P -9.188 0.118 -2.464 { n tyr C 142 1pk6C_142Y_177}P -8.57 0.259 -4.815 { ca tyr C 142 1pk6C_142Y_177}P -7.888 -0.16 -6.028 { n his C 143 1pk6C_142Y_177}P -6.432 0.905 -7.636 { ca his C 143 1pk6C_142Y_177}P -5.902 1.949 -8.508 { n ala C 144 1pk6C_142Y_177}P -6.48 1.414 -10.804 { ca ala C 144 1pk6C_142Y_177}P -6.373 0.742 -12.105 { n asn C 175 1pk6C_142Y_177}P -7.748 4.983 -12.606 { ca asn C 175 1pk6C_142Y_177}P -9.099 4.934 -12.075 { n ser C 176 1pk6C_142Y_177}P -9.479 5.159 -9.669 { ca ser C 176 1pk6C_142Y_177}P -9.372 4.722 -8.284 { n gly C 177 1pk6C_142Y_177}P -10.797 3.746 -6.621 { ca gly C 177 1pk6C_142Y_177}P -12.039 3.526 -5.92 {"}P -12.039 3.526 -5.92 { n gly C 178 1pk6C_142Y_177}P -12.738 2.898 -3.704 { ca gly C 178 1pk6C_142Y_177}P -12.596 2.237 -2.422 {"}P -12.596 2.237 -2.422 { n val C 179 1pk6C_142Y_177}P -13.898 1.47 -0.546 { ca val C 179 1pk6C_142Y_177}P -15.051 1.449 0.346 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca phe C 140 1pk6C_142Y_177}P -10.951 -2.145 0.03 {"}-10.951 -2.145 0.03 { ca val C 141 1pk6C_142Y_177}-9.188 0.118 -2.464 { ca tyr C 142 1pk6C_142Y_177}-7.888 -0.16 -6.028 { ca his C 143 1pk6C_142Y_177}-5.902 1.949 -8.508 { ca ala C 144 1pk6C_142Y_177}-6.373 0.742 -12.105 { ca asn C 175 1pk6C_142Y_177}P -9.099 4.934 -12.075 {"}-9.099 4.934 -12.075 { ca ser C 176 1pk6C_142Y_177}-9.372 4.722 -8.284 { ca gly C 177 1pk6C_142Y_177}-12.039 3.526 -5.92 { ca gly C 178 1pk6C_142Y_177}-12.596 2.237 -2.422 { ca val C 179 1pk6C_142Y_177}-15.051 1.449 0.346 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca phe C 140 1pk6C_142Y_177}P -10.951 -2.145 0.03 { ca val C 141 1pk6C_142Y_177}P -9.188 0.118 -2.464 { ca tyr C 142 1pk6C_142Y_177}P -7.888 -0.16 -6.028 { cb tyr C 142 1pk6C_142Y_177}-8.816 -1.006 -6.906 { cg tyr C 142 1pk6C_142Y_177}-9.93 -0.223 -7.564 { cd1 tyr C 142 1pk6C_142Y_177}-9.701 0.511 -8.742 { ce1 tyr C 142 1pk6C_142Y_177}-10.691 1.313 -9.284 { cz tyr C 142 1pk6C_142Y_177}-11.922 1.396 -8.657 { oh tyr C 142 1pk6C_142Y_177}-12.895 2.207 -9.187 { cg tyr C 142 1pk6C_142Y_177}P -9.93 -0.223 -7.564 { cd2 tyr C 142 1pk6C_142Y_177}-11.18 -0.128 -6.96 { ce2 tyr C 142 1pk6C_142Y_177}-12.176 0.672 -7.494 { cz tyr C 142 1pk6C_142Y_177}ghost -11.922 1.396 -8.657 { ca his C 143 1pk6C_142Y_177}P -5.902 1.949 -8.508 { ca ala C 144 1pk6C_142Y_177}P -6.373 0.742 -12.105 { ca asn C 175 1pk6C_142Y_177}P -9.099 4.934 -12.075 { ca ser C 176 1pk6C_142Y_177}P -9.372 4.722 -8.284 { ca val C 179 1pk6C_142Y_177}P -15.051 1.449 0.346 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr C 142 1pk6C_142Y_177}P -8.816 -1.006 -6.906 {"}P -8.816 -1.006 -6.906 { cd1 tyr C 142 1pk6C_142Y_177}P -9.701 0.511 -8.742 { cd2 tyr C 142 1pk6C_142Y_177}P -11.18 -0.128 -6.96 { ce1 tyr C 142 1pk6C_142Y_177}P -10.691 1.313 -9.284 { ce2 tyr C 142 1pk6C_142Y_177}P -12.176 0.672 -7.494 { oh tyr C 142 1pk6C_142Y_177}P -12.895 2.207 -9.187 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr C 142 1pk6C_142Y_177}P -7.888 -0.16 -6.028 { cb tyr C 142 1pk6C_142Y_177}-8.816 -1.006 -6.906 { cg tyr C 142 1pk6C_142Y_177}-9.93 -0.223 -7.564 { cd1 tyr C 142 1pk6C_142Y_177}-9.701 0.511 -8.742 { ce1 tyr C 142 1pk6C_142Y_177}-10.691 1.313 -9.284 { cz tyr C 142 1pk6C_142Y_177}-11.922 1.396 -8.657 { oh tyr C 142 1pk6C_142Y_177}-12.895 2.207 -9.187 { cg tyr C 142 1pk6C_142Y_177}P -9.93 -0.223 -7.564 { cd2 tyr C 142 1pk6C_142Y_177}-11.18 -0.128 -6.96 { ce2 tyr C 142 1pk6C_142Y_177}-12.176 0.672 -7.494 { cz tyr C 142 1pk6C_142Y_177}ghost -11.922 1.396 -8.657 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr C 142 1pk6C_142Y_177}P -8.816 -1.006 -6.906 {"}P -8.816 -1.006 -6.906 { cd1 tyr C 142 1pk6C_142Y_177}P -9.701 0.511 -8.742 { cd2 tyr C 142 1pk6C_142Y_177}P -11.18 -0.128 -6.96 { ce1 tyr C 142 1pk6C_142Y_177}P -10.691 1.313 -9.284 { ce2 tyr C 142 1pk6C_142Y_177}P -12.176 0.672 -7.494 { oh tyr C 142 1pk6C_142Y_177}P -12.895 2.207 -9.187 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HE2 TYR 142 C}'P' sky -13.41 1.656 -6.705 {"}'P' blue -13.361 1.555 -6.468 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 142 C}'P' green -12.867 1.804 -6.352 { CZ TYR 142 C}'P' sea -13.016 2.405 -7.737 {"}'P' green -12.823 2.575 -7.73 {"}'P' green -12.604 2.71 -7.724 {"}'P' green -12.366 2.806 -7.72 {"}'P' green -12.115 2.86 -7.717 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 142 C}'P' P -13.056 2.172 -7.298 {"}'P' -13.044 2.152 -7.3 {"}'P' P -12.821 2.286 -7.293 {"}'P' -12.789 2.206 -7.303 {"}'P' P -12.572 2.364 -7.289 {"}'P' -12.548 2.259 -7.302 {"}'P' P -13.103 2.086 -7.042 {"}'P' -13.074 2.041 -7.057 {"}'P' P -12.874 2.21 -7.037 {"}'P' -12.819 2.089 -7.073 {"}'P' P -12.628 2.299 -7.033 {"}'P' -12.582 2.133 -7.08 {"}'P' P -12.372 2.348 -7.031 {"}'P' -12.354 2.193 -7.074 {"}'P' P -12.111 2.358 -7.031 {"}'P' -12.114 2.266 -7.056 {"}'P' P -13.14 1.956 -6.798 {"}'P' -13.121 1.931 -6.812 {"}'P' P -12.923 2.09 -6.792 {"}'P' -12.868 1.986 -6.844 {"}'P' P -12.687 2.189 -6.788 {"}'P' -12.632 2.027 -6.863 {"}'P' P -12.439 2.25 -6.785 {"}'P' -12.41 2.079 -6.862 {"}'P' P -12.184 2.272 -6.784 {"}'P' -12.184 2.148 -6.839 {"}'P' P -13.077 1.851 -6.567 {"}'P' -13.073 1.845 -6.572 {"}'P' P -12.858 1.986 -6.561 {"}'P' -12.82 1.911 -6.614 {"}'P' P -12.62 2.082 -6.557 {"}'P' -12.582 1.962 -6.636 {"}'P' P -12.369 2.136 -6.554 {"}'P' -12.353 2.018 -6.63 {"}'P' P -12.631 1.913 -6.348 {"}'P' -12.617 1.875 -6.383 {"}'P' P -12.379 1.976 -6.345 {"}'P' -12.372 1.933 -6.383 { CZ TYR 142 C}'P' P -12.824 2.376 -7.522 {"}'P' -12.813 2.364 -7.536 {"}'P' P -12.613 2.528 -7.515 {"}'P' -12.591 2.491 -7.553 {"}'P' P -12.377 2.637 -7.511 {"}'P' -12.364 2.6 -7.545 {"}'P' P -12.125 2.7 -7.508 {"}'P' -12.124 2.695 -7.513 {"}'P' P -12.363 2.445 -7.327 {"}'P' -12.34 2.392 -7.395 {"}'P' P -12.115 2.514 -7.324 {"}'P' -12.109 2.484 -7.36 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 142 C}'P' blue -12.711 3.086 -8.113 {"}'P' blue -13.264 2.793 -7.97 {"}'P' sky -13.023 2.88 -7.966 {"}'P' blue -13.337 2.395 -7.872 {"}'P' sky -13.155 2.583 -7.864 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 142 C}'P' sea -12.767 2.88 -7.966 {"}'P' sea -12.903 2.655 -7.861 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 177 C}'P' sky -12.729 3 -7.724 {"}'P' sky -12.989 2.999 -7.695 {"}'P' sky -13.164 2.734 -7.62 {"}'P' blue -13.237 2.987 -7.608 {"}'P' blue -13.288 2.52 -7.489 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 177 C}'P' green -12.599 2.774 -7.704 {"}'P' sea -12.859 2.774 -7.704 {"}'P' sea -12.469 2.999 -7.695 {"}'P' green -12.975 2.552 -7.627 {"}'P' sea -12.221 3.003 -7.608 {"}'P' sea -13.094 2.358 -7.496 {"}'P' green -13.217 1.93 -6.86 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 177 C}'P' P -12.285 2.749 -7.619 {"}'P' -12.286 2.749 -7.616 {"}'P' P -12.468 2.56 -7.627 {"}'P' -12.479 2.577 -7.58 {"}'P' P -12.721 2.488 -7.63 {"}'P' -12.721 2.498 -7.606 {"}'P' P -12.17 2.52 -7.489 {"}'P' -12.196 2.541 -7.445 {"}'P' P -12.364 2.358 -7.496 {"}'P' -12.392 2.403 -7.424 {"}'P' P -12.602 2.271 -7.5 {"}'P' -12.61 2.314 -7.44 {"}'P' P -12.856 2.271 -7.5 {"}'P' -12.854 2.278 -7.49 {"}'P' P -12.124 2.296 -7.314 {"}'P' -12.155 2.329 -7.275 {"}'P' P -12.341 2.153 -7.32 {"}'P' -12.383 2.238 -7.238 {"}'P' P -12.591 2.077 -7.323 {"}'P' -12.607 2.18 -7.233 {"}'P' P -12.851 2.075 -7.323 {"}'P' -12.841 2.144 -7.263 {"}'P' P -13.101 2.146 -7.32 {"}'P' -13.101 2.146 -7.32 {"}'P' P -12.13 2.104 -7.1 {"}'P' -12.198 2.2 -7.039 {"}'P' P -12.355 1.986 -7.105 {"}'P' -12.414 2.138 -7.019 {"}'P' P -12.602 1.926 -7.108 {"}'P' -12.622 2.088 -7.02 {"}'P' P -12.856 1.926 -7.108 {"}'P' -12.841 2.045 -7.043 {"}'P' P -13.103 1.986 -7.105 {"}'P' -13.088 2.026 -7.083 {"}'P' P -12.227 1.937 -6.86 {"}'P' -12.298 2.082 -6.816 {"}'P' P -12.467 1.851 -6.864 {"}'P' -12.51 2.03 -6.813 {"}'P' P -12.721 1.821 -6.865 {"}'P' -12.722 1.981 -6.821 {"}'P' P -12.975 1.848 -6.864 {"}'P' -12.954 1.939 -6.838 {"}'P' P -12.181 1.916 -6.6 {"}'P' -12.232 2.012 -6.596 {"}'P' P -12.416 1.823 -6.604 {"}'P' -12.453 1.955 -6.598 {"}'P' P -12.666 1.782 -6.606 {"}'P' -12.672 1.905 -6.601 {"}'P' P -12.918 1.796 -6.605 {"}'P' -12.907 1.863 -6.602 {"}'P' P -12.467 1.828 -6.343 {"}'P' -12.478 1.873 -6.352 {"}'P' P -12.721 1.798 -6.345 {"}'P' -12.721 1.823 -6.349 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 142 C}'M' sea -9.317 2.553 -7.001 {"}'M' green -9.224 2.791 -6.99 {"}'M' sea -9.086 3.007 -6.981 {"}'M' green -9.393 2.427 -6.752 {"}'M' green -9.053 3.109 -6.722 {"}'M' sea -8.863 3.282 -6.715 {"}'M' sea -9.417 2.151 -6.505 {"}'M' green -9.395 2.407 -6.494 {"}'M' sea -8.87 3.266 -6.457 {"}'M' green -9.363 2.276 -6.246 {"}'M' green -8.905 3.165 -6.207 {"}'M' sea -9.271 2.256 -6.005 {"}'M' green -9.221 2.505 -5.995 {"}'M' green -9.123 2.738 -5.984 {"}'M' green -8.979 2.947 -5.975 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 142 C}'M' greentint -9.323 2.674 -6.741 {"}'M' greentint -9.208 2.904 -6.731 {"}'M' greentint -9.326 2.655 -6.483 {"}'M' greentint -9.213 2.886 -6.473 {"}'M' greentint -9.059 3.092 -6.464 {"}'M' greentint -9.315 2.527 -6.235 {"}'M' greentint -9.22 2.765 -6.224 {"}'M' greentint -9.081 2.98 -6.215 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 177 C}'M' sea -9.362 2.992 -7 {"}'M' sea -9.498 2.771 -7.009 {"}'M' green -9.191 2.991 -6.792 {"}'M' green -9.301 2.757 -6.803 {"}'M' green -9.475 2.567 -6.811 {"}'M' sea -9.155 3.246 -6.781 {"}'M' green -9.538 2.392 -6.577 {"}'M' green -9.055 3.227 -6.541 {"}'M' green -9.478 2.377 -6.319 {"}'M' green -9.021 3.224 -6.282 {"}'M' green -9.088 2.955 -6.034 {"}'M' green -9.184 2.722 -6.044 {"}'M' green -9.338 2.522 -6.053 {"}'M' sea -9.538 2.369 -6.06 {"}'M' sea -9.055 3.205 -6.023 {"}'M' sea -9.191 2.947 -5.793 {"}'M' sea -9.301 2.714 -5.803 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 177 C}'M' greentint -9.088 2.978 -6.551 {"}'M' greentint -9.184 2.745 -6.562 {"}'M' greentint -9.338 2.545 -6.57 {"}'M' greentint -9.05 2.975 -6.293 {"}'M' greentint -9.141 2.742 -6.303 {"}'M' greentint -9.287 2.538 -6.312 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 142 C}'M' greentint -10.094 1.095 -5.169 {"}'M' greentint -10.061 1.345 -5.158 {"}'M' greentint -9.965 1.578 -5.148 {"}'M' greentint -9.811 1.778 -5.139 {"}'M' greentint -9.611 1.931 -5.132 {"}'M' greentint -10.119 0.951 -4.916 {"}'M' greentint -10.121 1.201 -4.905 {"}'M' greentint -10.061 1.444 -4.894 {"}'M' greentint -9.942 1.665 -4.885 {"}'M' greentint -9.772 1.849 -4.877 {"}'M' greentint -9.561 1.985 -4.871 {"}'M' greentint -10.094 1.073 -4.651 {"}'M' greentint -10.061 1.322 -4.641 {"}'M' greentint -9.965 1.555 -4.63 {"}'M' greentint -9.811 1.755 -4.622 {"}'M' greentint -9.611 1.908 -4.615 {"}'M' greentint -9.378 2.005 -4.611 {"}'M' greentint -9.986 1.183 -4.405 {"}'M' greentint -9.912 1.43 -4.394 {"}'M' greentint -9.768 1.645 -4.385 {"}'M' greentint -9.568 1.807 -4.378 {"}'M' greentint -9.823 1.183 -4.198 {"}'M' greentint -9.729 1.425 -4.187 {"}'M' greentint -9.554 1.617 -4.179 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 177 C}'M' greentint -9.753 1.648 -5.331 {"}'M' greentint -9.894 1.431 -5.341 {"}'M' greentint -9.527 1.88 -5.101 {"}'M' greentint -9.603 1.638 -5.112 {"}'M' greentint -9.726 1.417 -5.122 {"}'M' greentint -9.892 1.225 -5.13 {"}'M' greentint -10.092 1.07 -5.137 {"}'M' greentint -9.431 1.875 -4.861 {"}'M' greentint -9.502 1.629 -4.871 {"}'M' greentint -9.618 1.401 -4.881 {"}'M' greentint -9.775 1.199 -4.89 {"}'M' greentint -9.967 1.031 -4.897 {"}'M' greentint -9.385 1.855 -4.607 {"}'M' greentint -9.455 1.608 -4.618 {"}'M' greentint -9.57 1.377 -4.628 {"}'M' greentint -9.725 1.172 -4.637 {"}'M' greentint -9.915 0.999 -4.645 {"}'M' greentint -9.383 1.852 -4.349 {"}'M' greentint -9.452 1.604 -4.36 {"}'M' greentint -9.565 1.373 -4.37 {"}'M' greentint -9.719 1.167 -4.379 {"}'M' greentint -9.908 0.993 -4.386 {"}'M' greentint -9.622 1.361 -4.116 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n glu A 36 1pkoA_99F_38G}P -8.064 5.181 -12.528 {"}-8.064 5.181 -12.528 { ca glu A 36 1pkoA_99F_38G}-9.366 4.996 -11.906 { c glu A 36 1pkoA_99F_38G}-8.978 4.582 -10.483 { o glu A 36 1pkoA_99F_38G}-8.157 3.676 -10.277 { c glu A 36 1pkoA_99F_38G}P -8.978 4.582 -10.483 { n val A 37 1pkoA_99F_38G}-9.551 5.249 -9.489 { ca val A 37 1pkoA_99F_38G}-9.197 4.963 -8.093 { c val A 37 1pkoA_99F_38G}-10.521 4.798 -7.392 { o val A 37 1pkoA_99F_38G}-11.388 5.669 -7.456 { c val A 37 1pkoA_99F_38G}P -10.521 4.798 -7.392 { n gly A 38 1pkoA_99F_38G}-10.685 3.664 -6.725 { ca gly A 38 1pkoA_99F_38G}-11.961 3.435 -6.069 { c gly A 38 1pkoA_99F_38G}-11.858 2.759 -4.738 { o gly A 38 1pkoA_99F_38G}-10.825 2.222 -4.349 { c gly A 38 1pkoA_99F_38G}P -11.858 2.759 -4.738 { n trp A 39 1pkoA_99F_38G}-12.982 2.828 -4.039 { ca trp A 39 1pkoA_99F_38G}-13.108 2.208 -2.736 { c trp A 39 1pkoA_99F_38G}-14.403 1.411 -2.719 { o trp A 39 1pkoA_99F_38G}-15.437 1.887 -3.18 { c trp A 39 1pkoA_99F_38G}P -14.403 1.411 -2.719 { n tyr A 40 1pkoA_99F_38G}-14.35 0.19 -2.211 { ca tyr A 40 1pkoA_99F_38G}-15.6 -0.552 -2.103 { c tyr A 40 1pkoA_99F_38G}-15.634 -1.314 -0.802 { o tyr A 40 1pkoA_99F_38G}-14.618 -1.44 -0.133 { n thr A 97 1pkoA_99F_38G}P -11.93 -1.977 0.606 {"}-11.93 -1.977 0.606 { ca thr A 97 1pkoA_99F_38G}-10.925 -2.317 -0.378 { c thr A 97 1pkoA_99F_38G}-10.695 -1.068 -1.242 { o thr A 97 1pkoA_99F_38G}-11.639 -0.465 -1.75 { c thr A 97 1pkoA_99F_38G}P -10.695 -1.068 -1.242 {"}P -10.695 -1.068 -1.242 { c acys A 98 1pkoA_99F_38G}P -8.32 -0.111 -3.418 { c bcys A 98 1pkoA_99F_38G}P -8.418 -0.158 -3.429 { c acys A 98 1pkoA_99F_38G}P -8.32 -0.111 -3.418 { c bcys A 98 1pkoA_99F_38G}P -8.418 -0.158 -3.429 { c acys A 98 1pkoA_99F_38G}P -8.32 -0.111 -3.418 { n phe A 99 1pkoA_99F_38G}-8.622 0.43 -4.591 { ca phe A 99 1pkoA_99F_38G}-7.956 -0.073 -5.797 { c phe A 99 1pkoA_99F_38G}-7.533 1.062 -6.688 { o phe A 99 1pkoA_99F_38G}-8.082 2.163 -6.629 { c bcys A 98 1pkoA_99F_38G}P -8.418 -0.158 -3.429 { n phe A 99 1pkoA_99F_38G}-8.622 0.43 -4.591 { c phe A 99 1pkoA_99F_38G}P -7.533 1.062 -6.688 { n phe A 100 1pkoA_99F_38G}-6.483 0.792 -7.457 { ca phe A 100 1pkoA_99F_38G}-5.978 1.723 -8.462 { c phe A 100 1pkoA_99F_38G}-5.926 0.926 -9.76 { o phe A 100 1pkoA_99F_38G}-5.369 -0.183 -9.787 { c phe A 100 1pkoA_99F_38G}P -5.926 0.926 -9.76 { n arg A 101 1pkoA_99F_38G}-6.495 1.49 -10.817 { ca arg A 101 1pkoA_99F_38G}-6.489 0.802 -12.092 { c arg A 101 1pkoA_99F_38G}-5.905 1.726 -13.152 { o arg A 101 1pkoA_99F_38G}-6.334 2.864 -13.333 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 36 1pkoA_99F_38G}P -8.064 5.181 -12.528 { ca glu A 36 1pkoA_99F_38G}P -9.366 4.996 -11.906 { n val A 37 1pkoA_99F_38G}P -9.551 5.249 -9.489 { ca val A 37 1pkoA_99F_38G}P -9.197 4.963 -8.093 { n gly A 38 1pkoA_99F_38G}P -10.685 3.664 -6.725 { ca gly A 38 1pkoA_99F_38G}P -11.961 3.435 -6.069 {"}P -11.961 3.435 -6.069 { n trp A 39 1pkoA_99F_38G}P -12.982 2.828 -4.039 { ca trp A 39 1pkoA_99F_38G}P -13.108 2.208 -2.736 { n tyr A 40 1pkoA_99F_38G}P -14.35 0.19 -2.211 { ca tyr A 40 1pkoA_99F_38G}P -15.6 -0.552 -2.103 { n thr A 97 1pkoA_99F_38G}P -11.93 -1.977 0.606 { ca thr A 97 1pkoA_99F_38G}P -10.925 -2.317 -0.378 { n phe A 99 1pkoA_99F_38G}P -8.622 0.43 -4.591 { ca phe A 99 1pkoA_99F_38G}P -7.956 -0.073 -5.797 { n phe A 100 1pkoA_99F_38G}P -6.483 0.792 -7.457 { ca phe A 100 1pkoA_99F_38G}P -5.978 1.723 -8.462 { n arg A 101 1pkoA_99F_38G}P -6.495 1.49 -10.817 { ca arg A 101 1pkoA_99F_38G}P -6.489 0.802 -12.092 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca glu A 36 1pkoA_99F_38G}P -9.366 4.996 -11.906 {"}-9.366 4.996 -11.906 { ca val A 37 1pkoA_99F_38G}-9.197 4.963 -8.093 { ca gly A 38 1pkoA_99F_38G}-11.961 3.435 -6.069 { ca trp A 39 1pkoA_99F_38G}-13.108 2.208 -2.736 { ca tyr A 40 1pkoA_99F_38G}-15.6 -0.552 -2.103 { ca thr A 97 1pkoA_99F_38G}P -10.925 -2.317 -0.378 {"}-10.925 -2.317 -0.378 {"}P -10.925 -2.317 -0.378 { ca phe A 99 1pkoA_99F_38G}P -7.956 -0.073 -5.797 {"}P -7.956 -0.073 -5.797 { ca phe A 100 1pkoA_99F_38G}-5.978 1.723 -8.462 { ca arg A 101 1pkoA_99F_38G}-6.489 0.802 -12.092 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca glu A 36 1pkoA_99F_38G}P -9.366 4.996 -11.906 { ca val A 37 1pkoA_99F_38G}P -9.197 4.963 -8.093 { ca trp A 39 1pkoA_99F_38G}P -13.108 2.208 -2.736 { ca tyr A 40 1pkoA_99F_38G}P -15.6 -0.552 -2.103 { ca thr A 97 1pkoA_99F_38G}P -10.925 -2.317 -0.378 { ca phe A 99 1pkoA_99F_38G}P -7.956 -0.073 -5.797 { cb phe A 99 1pkoA_99F_38G}-8.857 -1.039 -6.574 { cg phe A 99 1pkoA_99F_38G}-9.983 -0.376 -7.301 { cd1 phe A 99 1pkoA_99F_38G}-9.811 0.083 -8.611 { ce1 phe A 99 1pkoA_99F_38G}-10.874 0.654 -9.315 { cz phe A 99 1pkoA_99F_38G}-12.116 0.776 -8.727 { cg phe A 99 1pkoA_99F_38G}P -9.983 -0.376 -7.301 { cd2 phe A 99 1pkoA_99F_38G}-11.234 -0.248 -6.705 { ce2 phe A 99 1pkoA_99F_38G}-12.309 0.327 -7.41 { cz phe A 99 1pkoA_99F_38G}ghost -12.116 0.776 -8.727 { ca phe A 100 1pkoA_99F_38G}P -5.978 1.723 -8.462 { ca arg A 101 1pkoA_99F_38G}P -6.489 0.802 -12.092 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 99 1pkoA_99F_38G}P -8.857 -1.039 -6.574 {"}P -8.857 -1.039 -6.574 { cd1 phe A 99 1pkoA_99F_38G}P -9.811 0.083 -8.611 { cd2 phe A 99 1pkoA_99F_38G}P -11.234 -0.248 -6.705 { ce1 phe A 99 1pkoA_99F_38G}P -10.874 0.654 -9.315 { ce2 phe A 99 1pkoA_99F_38G}P -12.309 0.327 -7.41 { cz phe A 99 1pkoA_99F_38G}P -12.116 0.776 -8.727 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 99 1pkoA_99F_38G}P -7.956 -0.073 -5.797 { cb phe A 99 1pkoA_99F_38G}-8.857 -1.039 -6.574 { cg phe A 99 1pkoA_99F_38G}-9.983 -0.376 -7.301 { cd1 phe A 99 1pkoA_99F_38G}-9.811 0.083 -8.611 { ce1 phe A 99 1pkoA_99F_38G}-10.874 0.654 -9.315 { cz phe A 99 1pkoA_99F_38G}-12.116 0.776 -8.727 { cg phe A 99 1pkoA_99F_38G}P -9.983 -0.376 -7.301 { cd2 phe A 99 1pkoA_99F_38G}-11.234 -0.248 -6.705 { ce2 phe A 99 1pkoA_99F_38G}-12.309 0.327 -7.41 { cz phe A 99 1pkoA_99F_38G}ghost -12.116 0.776 -8.727 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 99 1pkoA_99F_38G}P -8.857 -1.039 -6.574 {"}P -8.857 -1.039 -6.574 { cd1 phe A 99 1pkoA_99F_38G}P -9.811 0.083 -8.611 { cd2 phe A 99 1pkoA_99F_38G}P -11.234 -0.248 -6.705 { ce1 phe A 99 1pkoA_99F_38G}P -10.874 0.654 -9.315 { ce2 phe A 99 1pkoA_99F_38G}P -12.309 0.327 -7.41 { cz phe A 99 1pkoA_99F_38G}P -12.116 0.776 -8.727 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 99 A}'P' sky -12.863 2.194 -8.025 {"}'P' sky -12.124 2.376 -8.017 {"}'P' sky -13.017 1.955 -7.8 {"}'P' sky -11.797 2.218 -7.788 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 99 A}'P' green -12.947 1.956 -7.47 {"}'P' green -11.921 2.032 -7.466 {"}'P' green -13.189 1.827 -7.214 {"}'P' green -13.236 1.741 -6.958 {"}'P' green -13.056 1.745 -6.708 {"}'P' green -12.991 1.641 -6.477 { CZ PHE 99 A}'P' sea -12.627 2.293 -8.021 {"}'P' sea -12.379 2.354 -8.018 {"}'P' green -12.798 2.09 -7.794 {"}'P' green -12.56 2.186 -7.79 {"}'P' green -12.309 2.24 -7.787 {"}'P' sea -12.052 2.251 -7.787 {"}'P' green -12.059 2.094 -7.577 {"}'P' sea -11.801 2.059 -7.579 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 99 A}'P' P -12.697 2.032 -7.466 {"}'P' -12.688 1.992 -7.465 {"}'P' P -12.439 2.071 -7.465 {"}'P' -12.435 2.019 -7.463 {"}'P' P -12.179 2.071 -7.465 {"}'P' -12.18 2.053 -7.464 {"}'P' P -12.954 1.941 -7.209 {"}'P' -12.935 1.894 -7.214 {"}'P' P -12.705 2.019 -7.205 {"}'P' -12.68 1.909 -7.219 {"}'P' P -12.448 2.059 -7.203 {"}'P' -12.438 1.932 -7.219 {"}'P' P -12.187 2.06 -7.203 {"}'P' -12.193 1.97 -7.214 {"}'P' P -11.929 2.023 -7.205 {"}'P' -11.931 2.011 -7.206 {"}'P' P -13.007 1.865 -6.953 {"}'P' -12.987 1.821 -6.966 {"}'P' P -12.761 1.954 -6.949 {"}'P' -12.728 1.835 -6.983 {"}'P' P -12.505 2.003 -6.947 {"}'P' -12.487 1.852 -6.989 {"}'P' P -12.244 2.013 -6.947 {"}'P' -12.248 1.888 -6.981 {"}'P' P -11.984 1.983 -6.948 {"}'P' -11.994 1.933 -6.962 {"}'P' P -12.82 1.844 -6.704 {"}'P' -12.796 1.773 -6.737 {"}'P' P -12.572 1.905 -6.701 {"}'P' -12.553 1.793 -6.752 {"}'P' P -12.317 1.927 -6.7 {"}'P' -12.317 1.822 -6.747 {"}'P' P -12.062 1.908 -6.701 {"}'P' -12.07 1.859 -6.723 {"}'P' P -12.753 1.737 -6.473 {"}'P' -12.748 1.72 -6.484 {"}'P' P -12.502 1.791 -6.47 {"}'P' -12.496 1.749 -6.497 {"}'P' P -12.245 1.802 -6.47 {"}'P' -12.246 1.777 -6.485 { CZ PHE 99 A}'P' P -12.319 2.08 -7.578 {"}'P' -12.318 2.077 -7.58 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 38 A}'P' sky -12.465 2.65 -7.878 {"}'P' sky -12.151 2.625 -7.793 {"}'P' sky -12.841 2.428 -7.801 {"}'P' sky -11.821 2.37 -7.479 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 38 A}'P' sea -12.334 2.436 -7.801 {"}'P' green -12.587 2.364 -7.804 {"}'P' sea -12.036 2.396 -7.663 {"}'P' green -12.23 2.234 -7.67 {"}'P' green -12.468 2.147 -7.674 {"}'P' green -12.722 2.147 -7.674 {"}'P' sea -12.96 2.234 -7.67 {"}'P' green -11.99 2.172 -7.488 {"}'P' green -12.967 2.022 -7.494 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 38 A}'P' P -12.207 2.029 -7.494 {"}'P' -12.215 2.044 -7.48 {"}'P' P -12.457 1.953 -7.497 {"}'P' -12.463 1.996 -7.46 {"}'P' P -12.717 1.951 -7.497 {"}'P' -12.713 1.978 -7.473 {"}'P' P -11.996 1.98 -7.274 {"}'P' -12.012 2.003 -7.26 {"}'P' P -12.221 1.862 -7.279 {"}'P' -12.254 1.947 -7.231 {"}'P' P -12.468 1.802 -7.282 {"}'P' -12.482 1.916 -7.22 {"}'P' P -12.722 1.802 -7.282 {"}'P' -12.71 1.895 -7.231 {"}'P' P -12.969 1.862 -7.279 {"}'P' -12.957 1.893 -7.262 {"}'P' P -11.877 1.95 -7.028 {"}'P' -11.886 1.961 -7.024 {"}'P' P -12.093 1.813 -7.034 {"}'P' -12.136 1.9 -7.007 {"}'P' P -12.333 1.727 -7.038 {"}'P' -12.367 1.868 -6.998 {"}'P' P -12.587 1.697 -7.039 {"}'P' -12.588 1.843 -6.999 {"}'P' P -12.841 1.724 -7.038 {"}'P' -12.819 1.822 -7.01 {"}'P' P -13.083 1.806 -7.034 {"}'P' -13.074 1.823 -7.029 {"}'P' P -12.047 1.792 -6.774 {"}'P' -12.078 1.85 -6.772 {"}'P' P -12.282 1.699 -6.778 {"}'P' -12.314 1.814 -6.773 {"}'P' P -12.532 1.658 -6.78 {"}'P' -12.539 1.788 -6.774 {"}'P' P -12.784 1.672 -6.779 {"}'P' -12.769 1.766 -6.775 {"}'P' P -13.028 1.739 -6.776 {"}'P' -13.02 1.759 -6.776 {"}'P' P -12.333 1.704 -6.517 {"}'P' -12.345 1.756 -6.527 {"}'P' P -12.587 1.674 -6.519 {"}'P' -12.587 1.729 -6.529 {"}'P' P -12.841 1.701 -6.517 {"}'P' -12.838 1.714 -6.52 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 99 A}'M' green -9.278 2.565 -7.236 {"}'M' green -9.178 2.798 -7.226 {"}'M' green -9.28 2.503 -5.99 {"}'M' green -9.182 2.736 -5.979 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 99 A}'M' greentint -9.423 2.299 -7.007 {"}'M' greentint -9.376 2.551 -6.996 {"}'M' greentint -9.283 2.789 -6.985 {"}'M' greentint -9.145 3.005 -6.976 {"}'M' greentint -9.476 2.169 -6.758 {"}'M' greentint -9.452 2.425 -6.747 {"}'M' greentint -9.382 2.672 -6.736 {"}'M' greentint -9.267 2.902 -6.726 {"}'M' greentint -9.112 3.107 -6.717 {"}'M' greentint -9.476 2.149 -6.5 {"}'M' greentint -9.454 2.405 -6.489 {"}'M' greentint -9.385 2.653 -6.478 {"}'M' greentint -9.272 2.884 -6.468 {"}'M' greentint -9.118 3.09 -6.459 {"}'M' greentint -9.422 2.274 -6.241 {"}'M' greentint -9.374 2.525 -6.23 {"}'M' greentint -9.279 2.763 -6.219 {"}'M' greentint -9.14 2.978 -6.21 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 38 A}'M' green -9.138 2.968 -7.128 {"}'M' green -9.071 3.199 -6.877 {"}'M' green -9.037 3.194 -6.618 {"}'M' green -9.071 3.176 -6.36 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 38 A}'M' greentint -9.174 2.713 -7.139 {"}'M' greentint -9.284 2.479 -7.15 {"}'M' greentint -9.071 2.7 -6.898 {"}'M' greentint -9.167 2.467 -6.909 {"}'M' greentint -9.321 2.267 -6.917 {"}'M' greentint -9.038 2.949 -6.888 {"}'M' greentint -9.033 2.697 -6.64 {"}'M' greentint -9.124 2.464 -6.65 {"}'M' greentint -9.27 2.26 -6.659 {"}'M' greentint -9.461 2.099 -6.666 {"}'M' greentint -9.004 2.946 -6.629 {"}'M' greentint -9.071 2.677 -6.381 {"}'M' greentint -9.167 2.444 -6.391 {"}'M' greentint -9.321 2.244 -6.4 {"}'M' greentint -9.038 2.927 -6.37 {"}'M' greentint -9.174 2.669 -6.14 {"}'M' greentint -9.284 2.436 -6.15 {"}'M' greentint -9.138 2.924 -6.129 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H APHE 99 A}'M' greentint -10.063 1.56 -5.218 {"}'M' greentint -9.919 1.774 -5.209 {"}'M' greentint -10.245 1.181 -4.994 {"}'M' greentint -10.212 1.431 -4.983 {"}'M' greentint -10.116 1.664 -4.973 {"}'M' greentint -9.962 1.864 -4.964 {"}'M' greentint -9.762 2.017 -4.957 {"}'M' greentint -10.27 1.037 -4.741 {"}'M' greentint -10.272 1.287 -4.73 {"}'M' greentint -10.212 1.53 -4.719 {"}'M' greentint -10.093 1.751 -4.71 {"}'M' greentint -9.923 1.935 -4.702 {"}'M' greentint -9.712 2.071 -4.696 {"}'M' greentint -9.474 2.15 -4.692 {"}'M' greentint -10.245 1.159 -4.476 {"}'M' greentint -10.212 1.408 -4.466 {"}'M' greentint -10.116 1.641 -4.455 {"}'M' greentint -9.962 1.841 -4.447 {"}'M' greentint -9.762 1.994 -4.44 {"}'M' greentint -9.529 2.091 -4.436 {"}'M' greentint -10.134 1.011 -4.241 {"}'M' greentint -10.137 1.269 -4.23 {"}'M' greentint -10.063 1.516 -4.219 {"}'M' greentint -9.919 1.731 -4.21 {"}'M' greentint -9.719 1.893 -4.203 {"}'M' greentint -9.48 1.99 -4.199 {"}'M' greentint -9.974 1.269 -4.023 {"}'M' greentint -9.88 1.511 -4.012 {"}'M' greentint -9.705 1.703 -4.004 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 38 A}'M' greentint -9.823 1.765 -5.213 {"}'M' greentint -9.964 1.548 -5.223 {"}'M' greentint -9.597 1.997 -4.983 {"}'M' greentint -9.673 1.755 -4.994 {"}'M' greentint -9.796 1.534 -5.004 {"}'M' greentint -9.962 1.342 -5.012 {"}'M' greentint -10.162 1.187 -5.019 {"}'M' greentint -9.501 1.992 -4.743 {"}'M' greentint -9.572 1.746 -4.753 {"}'M' greentint -9.688 1.518 -4.763 {"}'M' greentint -9.845 1.316 -4.772 {"}'M' greentint -10.037 1.148 -4.779 {"}'M' greentint -10.258 1.018 -4.785 {"}'M' greentint -9.455 1.972 -4.489 {"}'M' greentint -9.525 1.725 -4.5 {"}'M' greentint -9.64 1.494 -4.51 {"}'M' greentint -9.795 1.289 -4.519 {"}'M' greentint -9.985 1.116 -4.527 {"}'M' greentint -10.204 0.981 -4.532 {"}'M' greentint -9.453 1.969 -4.231 {"}'M' greentint -9.522 1.721 -4.242 {"}'M' greentint -9.635 1.49 -4.252 {"}'M' greentint -9.789 1.284 -4.261 {"}'M' greentint -9.978 1.11 -4.268 {"}'M' greentint -9.575 1.705 -3.988 {"}'M' greentint -9.692 1.478 -3.998 {"}'M' greentint -9.85 1.277 -4.007 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n phe A 44 1pl3A_119F_46G}P -7.676 5.481 -12.633 {"}-7.676 5.481 -12.633 { ca phe A 44 1pl3A_119F_46G}-8.445 6.002 -11.51 { c phe A 44 1pl3A_119F_46G}-8.239 5.155 -10.282 { o phe A 44 1pl3A_119F_46G}-7.637 4.06 -10.328 { c phe A 44 1pl3A_119F_46G}P -8.239 5.155 -10.282 { n ile A 45 1pl3A_119F_46G}-8.701 5.688 -9.168 { ca ile A 45 1pl3A_119F_46G}-8.684 5.006 -7.893 { c ile A 45 1pl3A_119F_46G}-10.111 4.797 -7.439 { o ile A 45 1pl3A_119F_46G}-10.974 5.698 -7.577 { c ile A 45 1pl3A_119F_46G}P -10.111 4.797 -7.439 { n gly A 46 1pl3A_119F_46G}-10.381 3.595 -6.909 { ca gly A 46 1pl3A_119F_46G}-11.688 3.348 -6.351 { c gly A 46 1pl3A_119F_46G}-11.688 2.736 -5 { o gly A 46 1pl3A_119F_46G}-10.641 2.419 -4.472 { c gly A 46 1pl3A_119F_46G}P -11.688 2.736 -5 { n glu A 47 1pl3A_119F_46G}-12.879 2.573 -4.423 { ca glu A 47 1pl3A_119F_46G}-13.052 1.777 -3.224 { c glu A 47 1pl3A_119F_46G}-14.416 1.106 -3.175 { o glu A 47 1pl3A_119F_46G}-15.406 1.6 -3.723 { c glu A 47 1pl3A_119F_46G}P -14.416 1.106 -3.175 { n val A 48 1pl3A_119F_46G}-14.437 -0.063 -2.578 { ca val A 48 1pl3A_119F_46G}-15.667 -0.753 -2.197 { c val A 48 1pl3A_119F_46G}-15.547 -0.926 -0.686 { o val A 48 1pl3A_119F_46G}-14.559 -1.419 -0.219 { n trp A 117 1pl3A_119F_46G}P -11.94 -2.227 0.241 {"}-11.94 -2.227 0.241 { ca trp A 117 1pl3A_119F_46G}-11.021 -2.423 -0.845 { c trp A 117 1pl3A_119F_46G}-10.752 -1.121 -1.517 { o trp A 117 1pl3A_119F_46G}-11.643 -0.557 -2.095 { c trp A 117 1pl3A_119F_46G}P -10.752 -1.121 -1.517 { n val A 118 1pl3A_119F_46G}-9.523 -0.627 -1.376 { ca val A 118 1pl3A_119F_46G}-9.067 0.573 -2.039 { c val A 118 1pl3A_119F_46G}-8.064 0.207 -3.113 { o val A 118 1pl3A_119F_46G}-7.034 -0.447 -2.834 { c val A 118 1pl3A_119F_46G}P -8.064 0.207 -3.113 { n phe A 119 1pl3A_119F_46G}-8.357 0.641 -4.33 { ca phe A 119 1pl3A_119F_46G}-7.644 0.141 -5.503 { c phe A 119 1pl3A_119F_46G}-7.301 1.203 -6.503 { o phe A 119 1pl3A_119F_46G}-7.949 2.224 -6.604 { c phe A 119 1pl3A_119F_46G}P -7.301 1.203 -6.503 { n arg A 120 1pl3A_119F_46G}-6.232 0.914 -7.243 { ca arg A 120 1pl3A_119F_46G}-5.831 1.657 -8.41 { c arg A 120 1pl3A_119F_46G}-6.112 0.785 -9.621 { o arg A 120 1pl3A_119F_46G}-5.791 -0.421 -9.661 { c arg A 120 1pl3A_119F_46G}P -6.112 0.785 -9.621 { n cys A 121 1pl3A_119F_46G}-6.747 1.388 -10.599 { ca cys A 121 1pl3A_119F_46G}-7.09 0.734 -11.849 { c cys A 121 1pl3A_119F_46G}-6.389 1.493 -12.987 { o cys A 121 1pl3A_119F_46G}-6.824 2.532 -13.404 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 44 1pl3A_119F_46G}P -7.676 5.481 -12.633 { ca phe A 44 1pl3A_119F_46G}P -8.445 6.002 -11.51 { n ile A 45 1pl3A_119F_46G}P -8.701 5.688 -9.168 { ca ile A 45 1pl3A_119F_46G}P -8.684 5.006 -7.893 { n gly A 46 1pl3A_119F_46G}P -10.381 3.595 -6.909 { ca gly A 46 1pl3A_119F_46G}P -11.688 3.348 -6.351 {"}P -11.688 3.348 -6.351 { n glu A 47 1pl3A_119F_46G}P -12.879 2.573 -4.423 { ca glu A 47 1pl3A_119F_46G}P -13.052 1.777 -3.224 { n val A 48 1pl3A_119F_46G}P -14.437 -0.063 -2.578 { ca val A 48 1pl3A_119F_46G}P -15.667 -0.753 -2.197 { n trp A 117 1pl3A_119F_46G}P -11.94 -2.227 0.241 { ca trp A 117 1pl3A_119F_46G}P -11.021 -2.423 -0.845 { n val A 118 1pl3A_119F_46G}P -9.523 -0.627 -1.376 { ca val A 118 1pl3A_119F_46G}P -9.067 0.573 -2.039 { n phe A 119 1pl3A_119F_46G}P -8.357 0.641 -4.33 { ca phe A 119 1pl3A_119F_46G}P -7.644 0.141 -5.503 { n arg A 120 1pl3A_119F_46G}P -6.232 0.914 -7.243 { ca arg A 120 1pl3A_119F_46G}P -5.831 1.657 -8.41 { n cys A 121 1pl3A_119F_46G}P -6.747 1.388 -10.599 { ca cys A 121 1pl3A_119F_46G}P -7.09 0.734 -11.849 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca phe A 44 1pl3A_119F_46G}P -8.445 6.002 -11.51 {"}-8.445 6.002 -11.51 { ca ile A 45 1pl3A_119F_46G}-8.684 5.006 -7.893 { ca gly A 46 1pl3A_119F_46G}-11.688 3.348 -6.351 { ca glu A 47 1pl3A_119F_46G}-13.052 1.777 -3.224 { ca val A 48 1pl3A_119F_46G}-15.667 -0.753 -2.197 { ca trp A 117 1pl3A_119F_46G}P -11.021 -2.423 -0.845 {"}-11.021 -2.423 -0.845 { ca val A 118 1pl3A_119F_46G}-9.067 0.573 -2.039 { ca phe A 119 1pl3A_119F_46G}-7.644 0.141 -5.503 { ca arg A 120 1pl3A_119F_46G}-5.831 1.657 -8.41 { ca cys A 121 1pl3A_119F_46G}-7.09 0.734 -11.849 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca phe A 44 1pl3A_119F_46G}P -8.445 6.002 -11.51 { ca ile A 45 1pl3A_119F_46G}P -8.684 5.006 -7.893 { ca glu A 47 1pl3A_119F_46G}P -13.052 1.777 -3.224 { ca val A 48 1pl3A_119F_46G}P -15.667 -0.753 -2.197 { ca trp A 117 1pl3A_119F_46G}P -11.021 -2.423 -0.845 { ca val A 118 1pl3A_119F_46G}P -9.067 0.573 -2.039 { ca phe A 119 1pl3A_119F_46G}P -7.644 0.141 -5.503 { cb phe A 119 1pl3A_119F_46G}-8.38 -1.019 -6.181 { cg phe A 119 1pl3A_119F_46G}-9.735 -0.66 -6.731 { cd1 phe A 119 1pl3A_119F_46G}-10.854 -0.764 -5.933 { ce1 phe A 119 1pl3A_119F_46G}-12.088 -0.394 -6.415 { cz phe A 119 1pl3A_119F_46G}-12.197 0.071 -7.725 { cg phe A 119 1pl3A_119F_46G}P -9.735 -0.66 -6.731 { cd2 phe A 119 1pl3A_119F_46G}-9.864 -0.159 -8.018 { ce2 phe A 119 1pl3A_119F_46G}-11.088 0.203 -8.504 { cz phe A 119 1pl3A_119F_46G}ghost -12.197 0.071 -7.725 { ca arg A 120 1pl3A_119F_46G}P -5.831 1.657 -8.41 { ca cys A 121 1pl3A_119F_46G}P -7.09 0.734 -11.849 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 119 1pl3A_119F_46G}P -8.38 -1.019 -6.181 {"}P -8.38 -1.019 -6.181 { cd1 phe A 119 1pl3A_119F_46G}P -10.854 -0.764 -5.933 { cd2 phe A 119 1pl3A_119F_46G}P -9.864 -0.159 -8.018 { ce1 phe A 119 1pl3A_119F_46G}P -12.088 -0.394 -6.415 { ce2 phe A 119 1pl3A_119F_46G}P -11.088 0.203 -8.504 { cz phe A 119 1pl3A_119F_46G}P -12.197 0.071 -7.725 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 119 1pl3A_119F_46G}P -7.644 0.141 -5.503 { cb phe A 119 1pl3A_119F_46G}-8.38 -1.019 -6.181 { cg phe A 119 1pl3A_119F_46G}-9.735 -0.66 -6.731 { cd1 phe A 119 1pl3A_119F_46G}-10.854 -0.764 -5.933 { ce1 phe A 119 1pl3A_119F_46G}-12.088 -0.394 -6.415 { cz phe A 119 1pl3A_119F_46G}-12.197 0.071 -7.725 { cg phe A 119 1pl3A_119F_46G}P -9.735 -0.66 -6.731 { cd2 phe A 119 1pl3A_119F_46G}-9.864 -0.159 -8.018 { ce2 phe A 119 1pl3A_119F_46G}-11.088 0.203 -8.504 { cz phe A 119 1pl3A_119F_46G}ghost -12.197 0.071 -7.725 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 119 1pl3A_119F_46G}P -8.38 -1.019 -6.181 {"}P -8.38 -1.019 -6.181 { cd1 phe A 119 1pl3A_119F_46G}P -10.854 -0.764 -5.933 { cd2 phe A 119 1pl3A_119F_46G}P -9.864 -0.159 -8.018 { ce1 phe A 119 1pl3A_119F_46G}P -12.088 -0.394 -6.415 { ce2 phe A 119 1pl3A_119F_46G}P -11.088 0.203 -8.504 { cz phe A 119 1pl3A_119F_46G}P -12.197 0.071 -7.725 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 119 A}'P' sky -12.476 1.311 -6.471 {"}'P' sky -12.218 1.35 -6.47 { CE2 PHE 119 A}'P' sky -11.786 1.741 -8.047 {"}'P' sky -11.54 1.83 -8.043 {"}'P' sky -11.351 1.781 -7.795 {"}'P' sky -11.281 1.667 -7.564 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 119 A}'P' sea -11.599 1.72 -7.798 { CZ PHE 119 A}'P' sea -12.401 1.78 -8.04 {"}'P' sea -12.14 1.792 -8.04 {"}'P' green -12.585 1.776 -7.781 {"}'P' green -11.809 1.776 -7.781 {"}'P' green -12.842 1.685 -7.524 {"}'P' green -11.567 1.691 -7.523 {"}'P' green -12.895 1.609 -7.268 {"}'P' green -11.62 1.658 -7.266 {"}'P' green -12.708 1.588 -7.019 {"}'P' green -11.701 1.593 -7.019 {"}'P' green -12.641 1.481 -6.788 {"}'P' green -12.39 1.535 -6.785 {"}'P' green -12.133 1.546 -6.785 {"}'P' green -11.878 1.513 -6.786 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 119 A}'P' P -12.327 1.815 -7.78 {"}'P' -12.327 1.806 -7.779 {"}'P' P -12.067 1.815 -7.78 {"}'P' -12.067 1.811 -7.78 {"}'P' P -12.593 1.763 -7.52 {"}'P' -12.586 1.731 -7.524 {"}'P' P -12.336 1.803 -7.518 {"}'P' -12.33 1.726 -7.528 {"}'P' P -12.075 1.804 -7.518 {"}'P' -12.08 1.732 -7.527 {"}'P' P -11.817 1.767 -7.52 {"}'P' -11.822 1.746 -7.523 {"}'P' P -12.649 1.698 -7.264 {"}'P' -12.64 1.663 -7.274 {"}'P' P -12.393 1.747 -7.262 {"}'P' -12.382 1.657 -7.287 {"}'P' P -12.132 1.757 -7.262 {"}'P' -12.135 1.659 -7.289 {"}'P' P -11.872 1.727 -7.263 {"}'P' -11.883 1.674 -7.278 {"}'P' P -12.46 1.649 -7.016 {"}'P' -12.452 1.601 -7.038 {"}'P' P -12.205 1.671 -7.015 {"}'P' -12.205 1.602 -7.046 {"}'P' P -11.95 1.652 -7.016 {"}'P' -11.957 1.611 -7.034 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 46 A}'P' sky -11.638 2.037 -7.794 {"}'P' sky -11.454 2.014 -7.573 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 46 A}'P' green -11.855 1.894 -7.8 {"}'P' green -12.105 1.818 -7.803 {"}'P' green -12.365 1.816 -7.803 {"}'P' green -12.615 1.887 -7.8 {"}'P' green -11.644 1.845 -7.58 {"}'P' green -12.842 1.845 -7.58 {"}'P' sea -11.525 1.815 -7.334 {"}'P' green -11.695 1.657 -7.08 {"}'P' sea -12.9 1.723 -7.077 {"}'P' green -11.741 1.655 -6.82 {"}'P' green -11.981 1.569 -6.823 {"}'P' green -12.489 1.566 -6.823 {"}'P' green -12.731 1.648 -6.82 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 46 A}'P' P -11.869 1.727 -7.585 {"}'P' -11.878 1.75 -7.572 {"}'P' P -12.116 1.667 -7.588 {"}'P' -12.124 1.731 -7.553 {"}'P' P -12.37 1.667 -7.588 {"}'P' -12.363 1.728 -7.555 {"}'P' P -12.617 1.727 -7.585 {"}'P' -12.611 1.742 -7.577 {"}'P' P -11.741 1.678 -7.34 {"}'P' -11.748 1.694 -7.335 {"}'P' P -11.981 1.592 -7.344 {"}'P' -12 1.671 -7.322 {"}'P' P -12.235 1.562 -7.345 {"}'P' -12.236 1.664 -7.317 {"}'P' P -12.489 1.589 -7.344 {"}'P' -12.472 1.663 -7.323 {"}'P' P -12.731 1.671 -7.34 {"}'P' -12.726 1.68 -7.337 {"}'P' P -11.93 1.564 -7.084 {"}'P' -11.944 1.614 -7.082 {"}'P' P -12.18 1.523 -7.086 {"}'P' -12.184 1.604 -7.082 {"}'P' P -12.432 1.537 -7.085 {"}'P' -12.421 1.602 -7.082 {"}'P' P -12.676 1.604 -7.082 {"}'P' -12.672 1.613 -7.082 {"}'P' P -12.235 1.539 -6.825 {"}'P' -12.235 1.553 -6.827 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 119 A}'M' greentint -9.06 2.382 -7.442 {"}'M' greentint -9.002 2.635 -7.431 {"}'M' greentint -9.196 2.125 -7.233 {"}'M' greentint -9.196 2.378 -7.222 {"}'M' greentint -9.145 2.626 -7.211 {"}'M' greentint -9.045 2.859 -7.201 {"}'M' greentint -8.9 3.067 -7.192 {"}'M' greentint -9.289 2.105 -6.993 {"}'M' greentint -9.29 2.36 -6.982 {"}'M' greentint -9.243 2.612 -6.971 {"}'M' greentint -9.15 2.85 -6.96 {"}'M' greentint -9.012 3.066 -6.951 {"}'M' greentint -9.319 1.974 -6.744 {"}'M' greentint -9.343 2.23 -6.733 {"}'M' greentint -9.319 2.486 -6.722 {"}'M' greentint -9.249 2.733 -6.711 {"}'M' greentint -9.134 2.963 -6.701 {"}'M' greentint -8.979 3.168 -6.692 {"}'M' greentint -9.343 2.21 -6.475 {"}'M' greentint -9.321 2.466 -6.464 {"}'M' greentint -9.252 2.714 -6.453 {"}'M' greentint -9.139 2.945 -6.443 {"}'M' greentint -8.985 3.151 -6.434 {"}'M' greentint -9.289 2.335 -6.216 {"}'M' greentint -9.241 2.586 -6.205 {"}'M' greentint -9.146 2.824 -6.194 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 46 A}'M' greentint -8.91 2.604 -7.374 {"}'M' greentint -9.02 2.37 -7.385 {"}'M' greentint -8.874 2.859 -7.363 {"}'M' greentint -8.807 2.591 -7.133 {"}'M' greentint -8.903 2.358 -7.144 {"}'M' greentint -9.057 2.158 -7.152 {"}'M' greentint -8.807 3.09 -7.112 {"}'M' greentint -8.774 2.84 -7.123 {"}'M' greentint -8.769 2.588 -6.875 {"}'M' greentint -8.86 2.355 -6.885 {"}'M' greentint -9.006 2.151 -6.894 {"}'M' greentint -9.197 1.99 -6.901 {"}'M' greentint -8.773 3.085 -6.853 {"}'M' greentint -8.74 2.837 -6.864 {"}'M' greentint -8.807 2.568 -6.616 {"}'M' greentint -8.903 2.335 -6.626 {"}'M' greentint -9.057 2.135 -6.635 {"}'M' greentint -9.257 1.982 -6.642 {"}'M' greentint -8.807 3.067 -6.595 {"}'M' greentint -8.774 2.818 -6.605 {"}'M' greentint -8.91 2.56 -6.375 {"}'M' greentint -9.02 2.327 -6.385 {"}'M' greentint -9.194 2.136 -6.394 {"}'M' greentint -8.915 3.07 -6.353 {"}'M' greentint -8.874 2.815 -6.364 {"}'M' greentint -9.081 2.543 -6.169 {"}'M' greentint -9.217 2.322 -6.178 {"}'M' greentint -9.033 2.798 -6.158 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 119 A}'M' greentint -9.921 1.463 -5.023 {"}'M' greentint -9.847 1.71 -5.012 {"}'M' greentint -9.703 1.924 -5.003 {"}'M' greentint -9.503 2.087 -4.996 {"}'M' greentint -10.029 1.331 -4.788 {"}'M' greentint -9.996 1.581 -4.777 {"}'M' greentint -9.9 1.814 -4.767 {"}'M' greentint -9.746 2.014 -4.758 {"}'M' greentint -9.546 2.167 -4.751 {"}'M' greentint -9.313 2.263 -4.747 {"}'M' greentint -10.054 1.187 -4.535 {"}'M' greentint -10.056 1.437 -4.524 {"}'M' greentint -9.996 1.68 -4.513 {"}'M' greentint -9.877 1.901 -4.504 {"}'M' greentint -9.707 2.085 -4.496 {"}'M' greentint -9.496 2.221 -4.49 {"}'M' greentint -9.258 2.3 -4.486 {"}'M' greentint -10.029 1.309 -4.27 {"}'M' greentint -9.996 1.558 -4.26 {"}'M' greentint -9.9 1.791 -4.249 {"}'M' greentint -9.746 1.991 -4.241 {"}'M' greentint -9.546 2.144 -4.234 {"}'M' greentint -9.313 2.241 -4.23 {"}'M' greentint -9.921 1.419 -4.024 {"}'M' greentint -9.847 1.666 -4.013 {"}'M' greentint -9.703 1.881 -4.004 {"}'M' greentint -9.503 2.043 -3.997 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 46 A}'M' greentint -9.489 1.952 -5.117 {"}'M' greentint -9.612 1.731 -5.127 {"}'M' greentint -9.778 1.539 -5.135 {"}'M' greentint -9.317 2.189 -4.866 {"}'M' greentint -9.388 1.943 -4.876 {"}'M' greentint -9.504 1.715 -4.886 {"}'M' greentint -9.661 1.513 -4.895 {"}'M' greentint -9.853 1.345 -4.902 {"}'M' greentint -9.271 2.169 -4.612 {"}'M' greentint -9.341 1.922 -4.623 {"}'M' greentint -9.456 1.691 -4.633 {"}'M' greentint -9.611 1.486 -4.642 {"}'M' greentint -9.801 1.313 -4.65 {"}'M' greentint -10.02 1.178 -4.655 {"}'M' greentint -9.269 2.166 -4.354 {"}'M' greentint -9.338 1.918 -4.365 {"}'M' greentint -9.451 1.687 -4.375 {"}'M' greentint -9.605 1.481 -4.384 {"}'M' greentint -9.794 1.307 -4.391 {"}'M' greentint -10.012 1.17 -4.397 {"}'M' greentint -9.319 2.148 -4.1 {"}'M' greentint -9.391 1.902 -4.111 {"}'M' greentint -9.508 1.675 -4.121 {"}'M' greentint -9.666 1.474 -4.13 {"}'M' greentint -9.86 1.306 -4.137 {"}'M' greentint -9.486 1.905 -3.87 {"}'M' greentint -9.608 1.683 -3.879 {"}'M' greentint -9.772 1.49 -3.888 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n thr A 132 1qj4A_134F_145}P -12.268 -1.479 1.068 {"}-12.268 -1.479 1.068 { ca thr A 132 1qj4A_134F_145}-11.103 -1.855 0.323 { c thr A 132 1qj4A_134F_145}-10.889 -0.889 -0.83 { o thr A 132 1qj4A_134F_145}-11.83 -0.225 -1.291 { c thr A 132 1qj4A_134F_145}P -10.889 -0.889 -0.83 { n tyr A 133 1qj4A_134F_145}-9.647 -0.813 -1.285 { ca tyr A 133 1qj4A_134F_145}-9.246 0.123 -2.302 { c tyr A 133 1qj4A_134F_145}-8.465 -0.576 -3.405 { o tyr A 133 1qj4A_134F_145}-7.823 -1.62 -3.193 { c tyr A 133 1qj4A_134F_145}P -8.465 -0.576 -3.405 { n phe A 134 1qj4A_134F_145}-8.48 0.023 -4.595 { ca phe A 134 1qj4A_134F_145}-7.69 -0.458 -5.714 { c phe A 134 1qj4A_134F_145}-7.352 0.731 -6.597 { o phe A 134 1qj4A_134F_145}-7.907 1.816 -6.414 { c phe A 134 1qj4A_134F_145}P -7.352 0.731 -6.597 { n thr A 135 1qj4A_134F_145}-6.44 0.509 -7.538 { ca thr A 135 1qj4A_134F_145}-6.152 1.577 -8.484 { c thr A 135 1qj4A_134F_145}-6.319 1.045 -9.908 { o thr A 135 1qj4A_134F_145}-6.104 -0.148 -10.185 { c thr A 135 1qj4A_134F_145}P -6.319 1.045 -9.908 { n tyr A 136 1qj4A_134F_145}-6.714 1.965 -10.767 { ca tyr A 136 1qj4A_134F_145}-6.738 1.672 -12.193 { c tyr A 136 1qj4A_134F_145}-6.306 2.937 -12.919 { o tyr A 136 1qj4A_134F_145}-6.296 4.021 -12.379 { n ile A 143 1qj4A_134F_145}P -6.449 6.323 -10.881 {"}-6.449 6.323 -10.881 { ca ile A 143 1qj4A_134F_145}-7.68 6.56 -10.151 { c ile A 143 1qj4A_134F_145}-7.737 5.543 -9.011 { o ile A 143 1qj4A_134F_145}-7.442 4.38 -9.214 { c ile A 143 1qj4A_134F_145}P -7.737 5.543 -9.011 { n thr A 144 1qj4A_134F_145}-8.13 6.068 -7.838 { ca thr A 144 1qj4A_134F_145}-8.353 5.193 -6.68 { c thr A 144 1qj4A_134F_145}-9.809 4.79 -6.642 { o thr A 144 1qj4A_134F_145}-10.68 5.639 -6.526 { c thr A 144 1qj4A_134F_145}P -9.809 4.79 -6.642 { n gly A 145 1qj4A_134F_145}-10.071 3.504 -6.782 { ca gly A 145 1qj4A_134F_145}-11.411 2.97 -6.627 { c gly A 145 1qj4A_134F_145}-11.562 2.43 -5.189 { o gly A 145 1qj4A_134F_145}-10.601 2.187 -4.488 { c gly A 145 1qj4A_134F_145}P -11.562 2.43 -5.189 { n leu A 146 1qj4A_134F_145}-12.837 2.243 -4.811 { ca leu A 146 1qj4A_134F_145}-13.153 1.692 -3.489 { c leu A 146 1qj4A_134F_145}-14.356 0.777 -3.612 { o leu A 146 1qj4A_134F_145}-15.21 0.897 -4.49 { c leu A 146 1qj4A_134F_145}P -14.356 0.777 -3.612 { n lys A 147 1qj4A_134F_145}-14.413 -0.138 -2.667 { ca lys A 147 1qj4A_134F_145}-15.589 -0.97 -2.439 { c lys A 147 1qj4A_134F_145}-15.926 -0.839 -0.952 { o lys A 147 1qj4A_134F_145}-15.134 -1.203 -0.059 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 132 1qj4A_134F_145}P -12.268 -1.479 1.068 { ca thr A 132 1qj4A_134F_145}P -11.103 -1.855 0.323 { n tyr A 133 1qj4A_134F_145}P -9.647 -0.813 -1.285 { ca tyr A 133 1qj4A_134F_145}P -9.246 0.123 -2.302 { n phe A 134 1qj4A_134F_145}P -8.48 0.023 -4.595 { ca phe A 134 1qj4A_134F_145}P -7.69 -0.458 -5.714 { n thr A 135 1qj4A_134F_145}P -6.44 0.509 -7.538 { ca thr A 135 1qj4A_134F_145}P -6.152 1.577 -8.484 { n tyr A 136 1qj4A_134F_145}P -6.714 1.965 -10.767 { ca tyr A 136 1qj4A_134F_145}P -6.738 1.672 -12.193 { n ile A 143 1qj4A_134F_145}P -6.449 6.323 -10.881 { ca ile A 143 1qj4A_134F_145}P -7.68 6.56 -10.151 { n thr A 144 1qj4A_134F_145}P -8.13 6.068 -7.838 { ca thr A 144 1qj4A_134F_145}P -8.353 5.193 -6.68 { n gly A 145 1qj4A_134F_145}P -10.071 3.504 -6.782 { ca gly A 145 1qj4A_134F_145}P -11.411 2.97 -6.627 {"}P -11.411 2.97 -6.627 { n leu A 146 1qj4A_134F_145}P -12.837 2.243 -4.811 { ca leu A 146 1qj4A_134F_145}P -13.153 1.692 -3.489 { n lys A 147 1qj4A_134F_145}P -14.413 -0.138 -2.667 { ca lys A 147 1qj4A_134F_145}P -15.589 -0.97 -2.439 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca thr A 132 1qj4A_134F_145}P -11.103 -1.855 0.323 {"}-11.103 -1.855 0.323 { ca tyr A 133 1qj4A_134F_145}-9.246 0.123 -2.302 { ca phe A 134 1qj4A_134F_145}-7.69 -0.458 -5.714 { ca thr A 135 1qj4A_134F_145}-6.152 1.577 -8.484 { ca tyr A 136 1qj4A_134F_145}-6.738 1.672 -12.193 { ca ile A 143 1qj4A_134F_145}P -7.68 6.56 -10.151 {"}-7.68 6.56 -10.151 { ca thr A 144 1qj4A_134F_145}-8.353 5.193 -6.68 { ca gly A 145 1qj4A_134F_145}-11.411 2.97 -6.627 { ca leu A 146 1qj4A_134F_145}-13.153 1.692 -3.489 { ca lys A 147 1qj4A_134F_145}-15.589 -0.97 -2.439 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca thr A 132 1qj4A_134F_145}P -11.103 -1.855 0.323 { ca tyr A 133 1qj4A_134F_145}P -9.246 0.123 -2.302 { ca phe A 134 1qj4A_134F_145}P -7.69 -0.458 -5.714 { cb phe A 134 1qj4A_134F_145}-8.48 -1.545 -6.455 { cg phe A 134 1qj4A_134F_145}-9.815 -1.103 -7.025 { cd1 phe A 134 1qj4A_134F_145}-10.964 -1.091 -6.213 { ce1 phe A 134 1qj4A_134F_145}-12.188 -0.641 -6.696 { cz phe A 134 1qj4A_134F_145}-12.296 -0.206 -8 { cg phe A 134 1qj4A_134F_145}P -9.815 -1.103 -7.025 { cd2 phe A 134 1qj4A_134F_145}-9.964 -0.694 -8.329 { ce2 phe A 134 1qj4A_134F_145}-11.177 -0.231 -8.834 { cz phe A 134 1qj4A_134F_145}ghost -12.296 -0.206 -8 { ca thr A 135 1qj4A_134F_145}P -6.152 1.577 -8.484 { ca tyr A 136 1qj4A_134F_145}P -6.738 1.672 -12.193 { ca ile A 143 1qj4A_134F_145}P -7.68 6.56 -10.151 { ca thr A 144 1qj4A_134F_145}P -8.353 5.193 -6.68 { ca leu A 146 1qj4A_134F_145}P -13.153 1.692 -3.489 { ca lys A 147 1qj4A_134F_145}P -15.589 -0.97 -2.439 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 134 1qj4A_134F_145}P -8.48 -1.545 -6.455 {"}P -8.48 -1.545 -6.455 { cd1 phe A 134 1qj4A_134F_145}P -10.964 -1.091 -6.213 { cd2 phe A 134 1qj4A_134F_145}P -9.964 -0.694 -8.329 { ce1 phe A 134 1qj4A_134F_145}P -12.188 -0.641 -6.696 { ce2 phe A 134 1qj4A_134F_145}P -11.177 -0.231 -8.834 { cz phe A 134 1qj4A_134F_145}P -12.296 -0.206 -8 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 134 1qj4A_134F_145}P -7.69 -0.458 -5.714 { cb phe A 134 1qj4A_134F_145}-8.48 -1.545 -6.455 { cg phe A 134 1qj4A_134F_145}-9.815 -1.103 -7.025 { cd1 phe A 134 1qj4A_134F_145}-10.964 -1.091 -6.213 { ce1 phe A 134 1qj4A_134F_145}-12.188 -0.641 -6.696 { cz phe A 134 1qj4A_134F_145}-12.296 -0.206 -8 { cg phe A 134 1qj4A_134F_145}P -9.815 -1.103 -7.025 { cd2 phe A 134 1qj4A_134F_145}-9.964 -0.694 -8.329 { ce2 phe A 134 1qj4A_134F_145}-11.177 -0.231 -8.834 { cz phe A 134 1qj4A_134F_145}ghost -12.296 -0.206 -8 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 134 1qj4A_134F_145}P -8.48 -1.545 -6.455 {"}P -8.48 -1.545 -6.455 { cd1 phe A 134 1qj4A_134F_145}P -10.964 -1.091 -6.213 { cd2 phe A 134 1qj4A_134F_145}P -9.964 -0.694 -8.329 { ce1 phe A 134 1qj4A_134F_145}P -12.188 -0.641 -6.696 { ce2 phe A 134 1qj4A_134F_145}P -11.177 -0.231 -8.834 { cz phe A 134 1qj4A_134F_145}P -12.296 -0.206 -8 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 134 A}'P' blue -11.16 0.737 -7.026 {"}'P' sky -12.318 1.103 -6.751 {"}'P' sky -11.315 0.875 -6.761 { CE2 PHE 134 A}'P' sky -11.573 1.461 -8.629 {"}'P' sky -11.316 1.501 -8.627 {"}'P' sky -10.852 1.425 -8.372 {"}'P' sky -10.681 1.291 -8.128 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 134 A}'P' green -12.058 1.103 -6.751 {"}'P' green -11.8 1.064 -6.752 {"}'P' sea -11.55 0.988 -6.756 { CE2 PHE 134 A}'P' green -11.629 1.396 -8.373 {"}'P' green -11.373 1.445 -8.371 {"}'P' sea -11.112 1.455 -8.371 {"}'P' green -11.185 1.369 -8.124 {"}'P' green -10.93 1.35 -8.125 {"}'P' green -10.858 1.211 -7.895 {"}'P' green -11.12 1.087 -7.684 {"}'P' sea -10.862 1.052 -7.686 { CZ PHE 134 A}'P' green -11.979 1.486 -8.316 {"}'P' green -11.727 1.418 -8.319 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 134 A}'P' P -11.44 1.347 -8.125 {"}'P' -11.437 1.331 -8.132 {"}'P' P -11.113 1.244 -7.894 {"}'P' -11.113 1.244 -7.894 { CZ PHE 134 A}'P' P -12.166 1.538 -8.055 {"}'P' -12.168 1.505 -8.054 {"}'P' P -11.908 1.499 -8.056 {"}'P' -11.924 1.426 -8.054 {"}'P' P -11.658 1.423 -8.06 {"}'P' -11.685 1.356 -8.057 {"}'P' P -12.435 1.526 -7.793 {"}'P' -12.434 1.516 -7.795 {"}'P' P -12.174 1.527 -7.793 {"}'P' -12.181 1.429 -7.805 {"}'P' P -11.916 1.49 -7.795 {"}'P' -11.948 1.345 -7.813 {"}'P' P -11.666 1.414 -7.798 {"}'P' -11.719 1.279 -7.815 {"}'P' P -11.431 1.302 -7.803 {"}'P' -11.476 1.223 -7.814 {"}'P' P -12.492 1.47 -7.537 {"}'P' -12.491 1.463 -7.539 {"}'P' P -12.231 1.48 -7.537 {"}'P' -12.235 1.378 -7.565 {"}'P' P -11.971 1.45 -7.538 {"}'P' -12.002 1.291 -7.582 {"}'P' P -11.719 1.381 -7.541 {"}'P' -11.777 1.222 -7.587 {"}'P' P -11.481 1.274 -7.546 {"}'P' -11.539 1.168 -7.578 {"}'P' P -11.262 1.133 -7.552 {"}'P' -11.282 1.107 -7.56 {"}'P' P -12.304 1.394 -7.29 {"}'P' -12.304 1.342 -7.313 {"}'P' P -12.049 1.375 -7.291 {"}'P' -12.067 1.262 -7.342 {"}'P' P -11.8 1.316 -7.294 {"}'P' -11.841 1.19 -7.352 {"}'P' P -11.564 1.22 -7.298 {"}'P' -11.61 1.13 -7.342 {"}'P' P -11.345 1.088 -7.304 {"}'P' -11.362 1.065 -7.316 {"}'P' P -12.232 1.269 -7.06 {"}'P' -12.232 1.258 -7.066 {"}'P' P -11.977 1.236 -7.061 {"}'P' -11.987 1.187 -7.093 {"}'P' P -11.731 1.161 -7.064 {"}'P' -11.749 1.117 -7.094 {"}'P' P -11.501 1.045 -7.07 {"}'P' -11.503 1.042 -7.072 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 145 A}'P' sky -11.58 1.707 -8.432 {"}'P' sky -11.029 1.739 -8.291 {"}'P' sky -11.214 1.161 -6.893 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 145 A}'P' green -11.223 1.577 -8.298 {"}'P' green -11.461 1.49 -8.302 {"}'P' green -10.983 1.515 -8.116 {"}'P' green -11.2 1.372 -8.122 {"}'P' sea -10.799 1.492 -7.895 {"}'P' green -10.989 1.323 -7.902 {"}'P' sea -10.87 1.293 -7.656 {"}'P' green -11.086 1.156 -7.662 {"}'P' green -11.461 1.1 -6.895 {"}'P' sea -11.71 1.23 -6.668 {"}'P' sea -11.96 1.301 -6.665 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 145 A}'P' P -11.45 1.296 -8.125 {"}'P' -11.452 1.313 -8.111 {"}'P' P -11.71 1.294 -8.125 {"}'P' -11.703 1.344 -8.081 {"}'P' P -11.96 1.365 -8.122 {"}'P' -11.938 1.413 -8.077 {"}'P' P -12.181 1.504 -8.116 {"}'P' -12.173 1.513 -8.106 {"}'P' P -11.214 1.205 -7.907 {"}'P' -11.221 1.222 -7.898 {"}'P' P -11.461 1.145 -7.91 {"}'P' -11.47 1.214 -7.872 {"}'P' P -11.715 1.145 -7.91 {"}'P' -11.7 1.266 -7.844 {"}'P' P -11.962 1.205 -7.907 {"}'P' -11.914 1.327 -7.837 {"}'P' P -12.187 1.323 -7.902 {"}'P' -12.132 1.401 -7.852 {"}'P' P -12.377 1.492 -7.895 {"}'P' -12.361 1.505 -7.884 {"}'P' P -11.326 1.07 -7.666 {"}'P' -11.339 1.123 -7.651 {"}'P' P -11.58 1.04 -7.667 {"}'P' -11.581 1.172 -7.63 {"}'P' P -11.834 1.067 -7.666 {"}'P' -11.797 1.234 -7.619 {"}'P' P -12.076 1.149 -7.662 {"}'P' -12.006 1.295 -7.618 {"}'P' P -12.293 1.283 -7.656 {"}'P' -12.226 1.367 -7.628 {"}'P' P -12.475 1.462 -7.648 {"}'P' -12.461 1.473 -7.644 {"}'P' P -11.275 1.042 -7.406 {"}'P' -11.279 1.057 -7.406 {"}'P' P -11.525 1.001 -7.408 {"}'P' -11.53 1.101 -7.404 {"}'P' P -11.777 1.015 -7.407 {"}'P' -11.753 1.161 -7.401 {"}'P' P -12.021 1.082 -7.404 {"}'P' -11.965 1.223 -7.398 {"}'P' P -12.245 1.201 -7.399 {"}'P' -12.183 1.291 -7.395 {"}'P' P -12.437 1.364 -7.392 {"}'P' -12.416 1.385 -7.391 {"}'P' P -11.58 1.017 -7.147 {"}'P' -11.58 1.064 -7.155 {"}'P' P -11.834 1.044 -7.145 {"}'P' -11.816 1.124 -7.161 {"}'P' P -12.076 1.126 -7.142 {"}'P' -12.044 1.193 -7.156 {"}'P' P -12.293 1.261 -7.136 {"}'P' -12.278 1.279 -7.141 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 134 A}'M' greentint -8.772 2.237 -7.431 {"}'M' greentint -8.639 2.456 -7.422 {"}'M' greentint -9.018 1.974 -7.252 {"}'M' greentint -8.96 2.227 -7.241 {"}'M' greentint -8.845 2.459 -7.23 {"}'M' greentint -8.68 2.659 -7.222 {"}'M' greentint -8.473 2.815 -7.215 {"}'M' greentint -9.154 1.97 -7.032 {"}'M' greentint -9.103 2.218 -7.021 {"}'M' greentint -9.003 2.451 -7.011 {"}'M' greentint -8.858 2.659 -7.002 {"}'M' greentint -8.674 2.833 -6.994 {"}'M' greentint -8.459 2.967 -6.988 {"}'M' greentint -9.248 1.952 -6.792 {"}'M' greentint -9.201 2.204 -6.781 {"}'M' greentint -9.108 2.442 -6.77 {"}'M' greentint -8.97 2.658 -6.761 {"}'M' greentint -8.795 2.844 -6.753 {"}'M' greentint -8.587 2.994 -6.746 {"}'M' greentint -9.277 2.078 -6.532 {"}'M' greentint -9.207 2.325 -6.521 {"}'M' greentint -9.092 2.555 -6.511 {"}'M' greentint -8.937 2.76 -6.502 {"}'M' greentint -8.747 2.933 -6.495 {"}'M' greentint -9.21 2.306 -6.263 {"}'M' greentint -9.097 2.537 -6.253 {"}'M' greentint -8.943 2.743 -6.244 {"}'M' greentint -8.754 2.917 -6.237 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 145 A}'M' greentint -8.445 2.579 -7.269 {"}'M' greentint -8.541 2.346 -7.28 {"}'M' greentint -8.695 2.146 -7.288 {"}'M' greentint -8.895 1.993 -7.295 {"}'M' greentint -8.407 2.576 -7.011 {"}'M' greentint -8.498 2.343 -7.021 {"}'M' greentint -8.644 2.139 -7.03 {"}'M' greentint -8.835 1.978 -7.037 {"}'M' greentint -9.061 1.869 -7.041 {"}'M' greentint -8.378 2.825 -7 {"}'M' greentint -8.445 2.556 -6.752 {"}'M' greentint -8.541 2.323 -6.762 {"}'M' greentint -8.695 2.123 -6.771 {"}'M' greentint -8.895 1.97 -6.778 {"}'M' greentint -9.128 1.874 -6.782 {"}'M' greentint -8.445 3.055 -6.731 {"}'M' greentint -8.412 2.806 -6.741 {"}'M' greentint -8.548 2.548 -6.511 {"}'M' greentint -8.658 2.315 -6.521 {"}'M' greentint -8.832 2.124 -6.53 {"}'M' greentint -9.054 1.993 -6.536 {"}'M' greentint -8.512 2.803 -6.5 {"}'M' greentint -8.719 2.531 -6.305 {"}'M' greentint -8.855 2.31 -6.314 {"}'M' greentint -9.063 2.154 -6.321 {"}'M' greentint -8.671 2.786 -6.294 {"}'M' greentint -8.941 2.537 -6.145 {"}'M' greentint -9.121 2.351 -6.154 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 134 A}'M' green -9.812 1.224 -5.283 {"}'M' green -9.668 1.438 -5.274 {"}'M' green -9.223 1.814 -4.757 {"}'M' green -9.886 0.933 -4.295 {"}'M' green -9.629 1.175 -4.077 {"}'M' green -9.454 1.367 -4.069 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 134 A}'M' greentint -9.961 1.095 -5.048 {"}'M' greentint -9.865 1.328 -5.038 {"}'M' greentint -9.711 1.528 -5.029 {"}'M' greentint -9.511 1.681 -5.022 {"}'M' greentint -10.021 0.951 -4.795 {"}'M' greentint -9.961 1.194 -4.784 {"}'M' greentint -9.842 1.415 -4.775 {"}'M' greentint -9.672 1.599 -4.767 {"}'M' greentint -9.461 1.735 -4.761 {"}'M' greentint -9.961 1.072 -4.531 {"}'M' greentint -9.865 1.305 -4.52 {"}'M' greentint -9.711 1.505 -4.512 {"}'M' greentint -9.511 1.658 -4.505 {"}'M' greentint -9.278 1.755 -4.501 {"}'M' greentint -9.812 1.18 -4.284 {"}'M' greentint -9.668 1.395 -4.275 {"}'M' greentint -9.468 1.557 -4.268 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 145 A}'M' green -9.449 1.72 -5.133 {"}'M' green -9.938 1.152 -5.158 {"}'M' green -10.034 0.983 -4.924 {"}'M' green -9.972 0.938 -4.413 {"}'M' green -9.468 1.443 -4.137 {"}'M' green -9.82 1.074 -4.153 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 145 A}'M' greentint -9.572 1.499 -5.143 {"}'M' greentint -9.738 1.307 -5.151 {"}'M' greentint -9.348 1.711 -4.892 {"}'M' greentint -9.464 1.483 -4.902 {"}'M' greentint -9.621 1.281 -4.911 {"}'M' greentint -9.813 1.113 -4.918 {"}'M' greentint -9.301 1.69 -4.639 {"}'M' greentint -9.416 1.459 -4.649 {"}'M' greentint -9.571 1.254 -4.658 {"}'M' greentint -9.761 1.081 -4.666 {"}'M' greentint -9.98 0.946 -4.671 {"}'M' greentint -9.298 1.686 -4.381 {"}'M' greentint -9.411 1.455 -4.391 {"}'M' greentint -9.565 1.249 -4.4 {"}'M' greentint -9.754 1.075 -4.407 {"}'M' greentint -9.626 1.242 -4.146 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ser A 78 1qj8A_80Y_112G}P -12.091 -2.063 0.872 {"}-12.091 -2.063 0.872 { ca ser A 78 1qj8A_80Y_112G}-10.935 -2.267 0.022 { c ser A 78 1qj8A_80Y_112G}-10.736 -1.051 -0.874 { o ser A 78 1qj8A_80Y_112G}-11.703 -0.326 -1.127 { c ser A 78 1qj8A_80Y_112G}P -10.736 -1.051 -0.874 { n ile A 79 1qj8A_80Y_112G}-9.512 -0.882 -1.366 { ca ile A 79 1qj8A_80Y_112G}-9.15 0.232 -2.225 { c ile A 79 1qj8A_80Y_112G}-8.485 -0.344 -3.48 { o ile A 79 1qj8A_80Y_112G}-7.774 -1.365 -3.432 { c ile A 79 1qj8A_80Y_112G}P -8.485 -0.344 -3.48 { n tyr A 80 1qj8A_80Y_112G}-8.567 0.361 -4.618 { ca tyr A 80 1qj8A_80Y_112G}-7.901 -0.124 -5.83 { c tyr A 80 1qj8A_80Y_112G}-7.496 1.037 -6.717 { o tyr A 80 1qj8A_80Y_112G}-8.064 2.137 -6.605 { c tyr A 80 1qj8A_80Y_112G}P -7.496 1.037 -6.717 { n gly A 81 1qj8A_80Y_112G}-6.525 0.74 -7.55 { ca gly A 81 1qj8A_80Y_112G}-6.041 1.742 -8.53 { c gly A 81 1qj8A_80Y_112G}-6.011 0.994 -9.868 { o gly A 81 1qj8A_80Y_112G}-5.654 -0.222 -9.832 { c gly A 81 1qj8A_80Y_112G}P -6.011 0.994 -9.868 { n val A 82 1qj8A_80Y_112G}-6.387 1.621 -10.923 { ca val A 82 1qj8A_80Y_112G}-6.382 0.947 -12.239 { c val A 82 1qj8A_80Y_112G}-5.756 1.824 -13.312 { o val A 82 1qj8A_80Y_112G}-5.713 3.1 -13.229 { n gly A 110 1qj8A_80Y_112G}P -7.538 5.154 -12.924 {"}-7.538 5.154 -12.924 { ca gly A 110 1qj8A_80Y_112G}-8.717 5.409 -12.045 { c gly A 110 1qj8A_80Y_112G}-8.407 4.849 -10.668 { o gly A 110 1qj8A_80Y_112G}-7.307 4.302 -10.485 { c gly A 110 1qj8A_80Y_112G}P -8.407 4.849 -10.668 { n ala A 111 1qj8A_80Y_112G}-9.325 5.161 -9.746 { ca ala A 111 1qj8A_80Y_112G}-9.104 4.637 -8.38 { c ala A 111 1qj8A_80Y_112G}-10.445 4.522 -7.733 { o ala A 111 1qj8A_80Y_112G}-11.402 5.224 -8.159 { c ala A 111 1qj8A_80Y_112G}P -10.445 4.522 -7.733 { n gly A 112 1qj8A_80Y_112G}-10.579 3.567 -6.793 { ca gly A 112 1qj8A_80Y_112G}-11.931 3.501 -6.193 { c gly A 112 1qj8A_80Y_112G}-11.85 2.772 -4.876 { o gly A 112 1qj8A_80Y_112G}-10.763 2.466 -4.382 { c gly A 112 1qj8A_80Y_112G}P -11.85 2.772 -4.876 { n leu A 113 1qj8A_80Y_112G}-13.022 2.682 -4.245 { ca leu A 113 1qj8A_80Y_112G}-13.208 1.991 -2.983 { c leu A 113 1qj8A_80Y_112G}-14.387 1.009 -3.159 { o leu A 113 1qj8A_80Y_112G}-15.38 1.383 -3.789 { c leu A 113 1qj8A_80Y_112G}P -14.387 1.009 -3.159 { n gln A 114 1qj8A_80Y_112G}-14.353 -0.1 -2.466 { ca gln A 114 1qj8A_80Y_112G}-15.432 -1.107 -2.47 { c gln A 114 1qj8A_80Y_112G}-15.723 -1.451 -1.037 { o gln A 114 1qj8A_80Y_112G}-14.792 -1.817 -0.303 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 78 1qj8A_80Y_112G}P -12.091 -2.063 0.872 { ca ser A 78 1qj8A_80Y_112G}P -10.935 -2.267 0.022 { n ile A 79 1qj8A_80Y_112G}P -9.512 -0.882 -1.366 { ca ile A 79 1qj8A_80Y_112G}P -9.15 0.232 -2.225 { n tyr A 80 1qj8A_80Y_112G}P -8.567 0.361 -4.618 { ca tyr A 80 1qj8A_80Y_112G}P -7.901 -0.124 -5.83 { n gly A 81 1qj8A_80Y_112G}P -6.525 0.74 -7.55 { ca gly A 81 1qj8A_80Y_112G}P -6.041 1.742 -8.53 {"}P -6.041 1.742 -8.53 { n val A 82 1qj8A_80Y_112G}P -6.387 1.621 -10.923 { ca val A 82 1qj8A_80Y_112G}P -6.382 0.947 -12.239 { n gly A 110 1qj8A_80Y_112G}P -7.538 5.154 -12.924 { ca gly A 110 1qj8A_80Y_112G}P -8.717 5.409 -12.045 {"}P -8.717 5.409 -12.045 { n ala A 111 1qj8A_80Y_112G}P -9.325 5.161 -9.746 { ca ala A 111 1qj8A_80Y_112G}P -9.104 4.637 -8.38 { n gly A 112 1qj8A_80Y_112G}P -10.579 3.567 -6.793 { ca gly A 112 1qj8A_80Y_112G}P -11.931 3.501 -6.193 {"}P -11.931 3.501 -6.193 { n leu A 113 1qj8A_80Y_112G}P -13.022 2.682 -4.245 { ca leu A 113 1qj8A_80Y_112G}P -13.208 1.991 -2.983 { n gln A 114 1qj8A_80Y_112G}P -14.353 -0.1 -2.466 { ca gln A 114 1qj8A_80Y_112G}P -15.432 -1.107 -2.47 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ser A 78 1qj8A_80Y_112G}P -10.935 -2.267 0.022 {"}-10.935 -2.267 0.022 { ca ile A 79 1qj8A_80Y_112G}-9.15 0.232 -2.225 { ca tyr A 80 1qj8A_80Y_112G}-7.901 -0.124 -5.83 { ca gly A 81 1qj8A_80Y_112G}-6.041 1.742 -8.53 { ca val A 82 1qj8A_80Y_112G}-6.382 0.947 -12.239 { ca gly A 110 1qj8A_80Y_112G}P -8.717 5.409 -12.045 {"}-8.717 5.409 -12.045 { ca ala A 111 1qj8A_80Y_112G}-9.104 4.637 -8.38 { ca gly A 112 1qj8A_80Y_112G}-11.931 3.501 -6.193 { ca leu A 113 1qj8A_80Y_112G}-13.208 1.991 -2.983 { ca gln A 114 1qj8A_80Y_112G}-15.432 -1.107 -2.47 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ser A 78 1qj8A_80Y_112G}P -10.935 -2.267 0.022 { ca ile A 79 1qj8A_80Y_112G}P -9.15 0.232 -2.225 {"}P -9.15 0.232 -2.225 { ca tyr A 80 1qj8A_80Y_112G}P -7.901 -0.124 -5.83 { cb tyr A 80 1qj8A_80Y_112G}-8.767 -1.129 -6.57 { cg tyr A 80 1qj8A_80Y_112G}-10.167 -0.65 -6.925 { cd1 tyr A 80 1qj8A_80Y_112G}-10.362 0.112 -8.056 { ce1 tyr A 80 1qj8A_80Y_112G}-11.623 0.565 -8.382 { cz tyr A 80 1qj8A_80Y_112G}-12.715 0.155 -7.602 { oh tyr A 80 1qj8A_80Y_112G}-13.974 0.568 -7.979 { cg tyr A 80 1qj8A_80Y_112G}P -10.167 -0.65 -6.925 { cd2 tyr A 80 1qj8A_80Y_112G}-11.235 -0.96 -6.126 { ce2 tyr A 80 1qj8A_80Y_112G}-12.533 -0.589 -6.445 { cz tyr A 80 1qj8A_80Y_112G}ghost -12.715 0.155 -7.602 { ca val A 82 1qj8A_80Y_112G}P -6.382 0.947 -12.239 { ca ala A 111 1qj8A_80Y_112G}P -9.104 4.637 -8.38 { ca leu A 113 1qj8A_80Y_112G}P -13.208 1.991 -2.983 { ca gln A 114 1qj8A_80Y_112G}P -15.432 -1.107 -2.47 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 80 1qj8A_80Y_112G}P -8.767 -1.129 -6.57 {"}P -8.767 -1.129 -6.57 { cd1 tyr A 80 1qj8A_80Y_112G}P -10.362 0.112 -8.056 { cd2 tyr A 80 1qj8A_80Y_112G}P -11.235 -0.96 -6.126 { ce1 tyr A 80 1qj8A_80Y_112G}P -11.623 0.565 -8.382 { ce2 tyr A 80 1qj8A_80Y_112G}P -12.533 -0.589 -6.445 { oh tyr A 80 1qj8A_80Y_112G}P -13.974 0.568 -7.979 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 80 1qj8A_80Y_112G}P -7.901 -0.124 -5.83 { cb tyr A 80 1qj8A_80Y_112G}-8.767 -1.129 -6.57 { cg tyr A 80 1qj8A_80Y_112G}-10.167 -0.65 -6.925 { cd1 tyr A 80 1qj8A_80Y_112G}-10.362 0.112 -8.056 { ce1 tyr A 80 1qj8A_80Y_112G}-11.623 0.565 -8.382 { cz tyr A 80 1qj8A_80Y_112G}-12.715 0.155 -7.602 { oh tyr A 80 1qj8A_80Y_112G}-13.974 0.568 -7.979 { cg tyr A 80 1qj8A_80Y_112G}P -10.167 -0.65 -6.925 { cd2 tyr A 80 1qj8A_80Y_112G}-11.235 -0.96 -6.126 { ce2 tyr A 80 1qj8A_80Y_112G}-12.533 -0.589 -6.445 { cz tyr A 80 1qj8A_80Y_112G}ghost -12.715 0.155 -7.602 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 80 1qj8A_80Y_112G}P -8.767 -1.129 -6.57 {"}P -8.767 -1.129 -6.57 { cd1 tyr A 80 1qj8A_80Y_112G}P -10.362 0.112 -8.056 { cd2 tyr A 80 1qj8A_80Y_112G}P -11.235 -0.96 -6.126 { ce1 tyr A 80 1qj8A_80Y_112G}P -11.623 0.565 -8.382 { ce2 tyr A 80 1qj8A_80Y_112G}P -12.533 -0.589 -6.445 { oh tyr A 80 1qj8A_80Y_112G}P -13.974 0.568 -7.979 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 80 A}'P' sky -12.55 1.979 -7.93 {"}'P' sky -12.075 2.192 -7.921 {"}'P' sky -11.819 2.241 -7.919 { CZ TYR 80 A}'P' sky -13.103 1.86 -7.658 {"}'P' sky -13.36 1.769 -7.401 {"}'P' blue -13.413 1.693 -7.145 {"}'P' sky -13.226 1.672 -6.896 {"}'P' blue -13.159 1.565 -6.665 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 80 A}'P' sea -12.321 2.103 -7.925 {"}'P' green -12.37 1.983 -7.68 {"}'P' green -12.134 2.082 -7.676 {"}'P' sea -11.886 2.143 -7.673 {"}'P' green -12.305 1.879 -7.449 {"}'P' green -12.067 1.975 -7.445 {"}'P' sea -12.078 1.806 -7.236 { CZ TYR 80 A}'P' sea -12.845 1.899 -7.657 {"}'P' sea -12.585 1.899 -7.657 {"}'P' sea -13.111 1.847 -7.397 {"}'P' green -12.854 1.887 -7.395 {"}'P' green -12.593 1.888 -7.395 {"}'P' green -12.335 1.851 -7.397 {"}'P' sea -13.167 1.782 -7.141 {"}'P' green -12.911 1.831 -7.139 {"}'P' green -12.65 1.841 -7.139 {"}'P' green -12.39 1.811 -7.14 {"}'P' sea -12.138 1.742 -7.143 {"}'P' green -12.978 1.733 -6.893 {"}'P' green -12.723 1.755 -6.892 {"}'P' green -12.468 1.736 -6.893 {"}'P' sea -12.219 1.677 -6.896 {"}'P' sea -12.908 1.619 -6.662 {"}'P' sea -12.651 1.63 -6.662 {"}'P' sea -12.396 1.597 -6.663 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 80 A}'P' blue -13.415 1.775 -7.543 {"}'P' blue -13.546 1.718 -7.304 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 112 A}'P' blue -12.064 2.553 -7.807 {"}'P' sky -12.258 2.391 -7.814 {"}'P' sky -12.496 2.304 -7.818 {"}'P' sky -12.995 2.179 -7.638 {"}'P' sky -13.222 2.137 -7.418 {"}'P' sky -13.328 2.097 -7.172 {"}'P' sky -13.28 2.015 -6.915 {"}'P' sky -13.111 1.94 -6.658 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 112 A}'P' sea -12.018 2.329 -7.632 {"}'P' green -12.235 2.186 -7.638 {"}'P' sea -12.485 2.11 -7.641 {"}'P' sea -12.745 2.108 -7.641 {"}'P' green -12.024 2.137 -7.418 {"}'P' green -12.249 2.019 -7.423 {"}'P' green -12.496 1.959 -7.426 {"}'P' green -12.75 1.959 -7.426 {"}'P' green -12.997 2.019 -7.423 {"}'P' sea -12.121 1.97 -7.178 {"}'P' green -12.361 1.884 -7.182 {"}'P' green -12.615 1.854 -7.183 {"}'P' green -12.869 1.881 -7.182 {"}'P' green -13.111 1.963 -7.178 {"}'P' green -12.31 1.856 -6.922 {"}'P' green -12.56 1.815 -6.924 {"}'P' green -12.812 1.829 -6.923 {"}'P' sea -13.056 1.896 -6.92 {"}'P' sea -12.361 1.861 -6.661 {"}'P' sea -12.615 1.831 -6.663 {"}'P' sea -12.869 1.858 -6.661 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 80 A}'M' green -8.946 3.137 -6.178 {"}'M' green -9.02 2.919 -5.946 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 80 A}'M' greentint -9.405 2.273 -6.983 {"}'M' greentint -9.358 2.525 -6.972 {"}'M' greentint -9.265 2.763 -6.961 {"}'M' greentint -9.127 2.979 -6.952 {"}'M' greentint -9.458 2.143 -6.734 {"}'M' greentint -9.434 2.399 -6.723 {"}'M' greentint -9.364 2.646 -6.712 {"}'M' greentint -9.249 2.876 -6.702 {"}'M' greentint -9.094 3.081 -6.693 {"}'M' greentint -9.458 2.123 -6.476 {"}'M' greentint -9.436 2.379 -6.465 {"}'M' greentint -9.367 2.627 -6.454 {"}'M' greentint -9.254 2.858 -6.444 {"}'M' greentint -9.1 3.064 -6.435 {"}'M' greentint -9.404 2.248 -6.217 {"}'M' greentint -9.356 2.499 -6.206 {"}'M' greentint -9.261 2.737 -6.195 {"}'M' greentint -9.122 2.952 -6.186 {"}'M' greentint -9.262 2.477 -5.966 {"}'M' greentint -9.164 2.71 -5.955 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 112 A}'M' greentint -9.058 2.695 -6.979 {"}'M' greentint -9.168 2.461 -6.99 {"}'M' greentint -9.342 2.271 -6.998 {"}'M' greentint -9.022 2.95 -6.968 {"}'M' greentint -8.955 2.682 -6.738 {"}'M' greentint -9.051 2.449 -6.749 {"}'M' greentint -9.205 2.249 -6.757 {"}'M' greentint -9.405 2.096 -6.764 {"}'M' greentint -8.955 3.181 -6.717 {"}'M' greentint -8.922 2.931 -6.728 {"}'M' greentint -8.917 2.679 -6.48 {"}'M' greentint -9.008 2.446 -6.49 {"}'M' greentint -9.154 2.242 -6.499 {"}'M' greentint -9.345 2.081 -6.506 {"}'M' greentint -8.921 3.176 -6.458 {"}'M' greentint -8.888 2.928 -6.469 {"}'M' greentint -8.955 2.659 -6.221 {"}'M' greentint -9.051 2.426 -6.231 {"}'M' greentint -9.205 2.226 -6.24 {"}'M' greentint -9.405 2.073 -6.247 {"}'M' greentint -8.922 2.909 -6.21 {"}'M' greentint -9.058 2.651 -5.98 {"}'M' greentint -9.168 2.418 -5.99 {"}'M' greentint -9.022 2.906 -5.969 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 80 A}'M' green -9.846 1.614 -5.203 {"}'M' green -9.702 1.828 -5.194 {"}'M' green -10.028 1.213 -4.461 {"}'M' green -9.312 2.145 -4.421 {"}'M' green -9.92 1.323 -4.215 {"}'M' green -9.663 1.565 -3.997 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 80 A}'M' greentint -9.995 1.485 -4.968 {"}'M' greentint -9.899 1.718 -4.958 {"}'M' greentint -9.745 1.918 -4.949 {"}'M' greentint -9.545 2.071 -4.942 {"}'M' greentint -10.055 1.341 -4.715 {"}'M' greentint -9.995 1.584 -4.704 {"}'M' greentint -9.876 1.805 -4.695 {"}'M' greentint -9.706 1.989 -4.687 {"}'M' greentint -9.495 2.125 -4.681 {"}'M' greentint -9.995 1.462 -4.451 {"}'M' greentint -9.899 1.695 -4.44 {"}'M' greentint -9.745 1.895 -4.432 {"}'M' greentint -9.545 2.048 -4.425 {"}'M' greentint -9.846 1.57 -4.204 {"}'M' greentint -9.702 1.785 -4.195 {"}'M' greentint -9.502 1.947 -4.188 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 112 A}'M' green -10.1 1.431 -5.052 {"}'M' green -9.439 2.236 -4.776 {"}'M' green -9.393 2.216 -4.522 {"}'M' green -10.142 1.225 -4.565 {"}'M' green -9.513 1.949 -4.021 {"}'M' green -9.63 1.722 -4.031 {"}'M' green -9.788 1.521 -4.04 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 112 A}'M' greentint -9.611 1.999 -5.027 {"}'M' greentint -9.734 1.778 -5.037 {"}'M' greentint -9.9 1.586 -5.045 {"}'M' greentint -9.51 1.99 -4.786 {"}'M' greentint -9.626 1.762 -4.796 {"}'M' greentint -9.783 1.56 -4.805 {"}'M' greentint -9.975 1.392 -4.812 {"}'M' greentint -9.463 1.969 -4.533 {"}'M' greentint -9.578 1.738 -4.543 {"}'M' greentint -9.733 1.533 -4.552 {"}'M' greentint -9.923 1.36 -4.56 {"}'M' greentint -9.46 1.965 -4.275 {"}'M' greentint -9.573 1.734 -4.285 {"}'M' greentint -9.727 1.528 -4.294 {"}'M' greentint -9.916 1.354 -4.301 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n tyr A 8 1qjpA_40F_10G}P -7.64 5.485 -12.765 {"}-7.64 5.485 -12.765 { ca tyr A 8 1qjpA_40F_10G}-8.789 5.548 -11.879 { c tyr A 8 1qjpA_40F_10G}-8.438 4.977 -10.513 { o tyr A 8 1qjpA_40F_10G}-7.5 4.213 -10.331 { c tyr A 8 1qjpA_40F_10G}P -8.438 4.977 -10.513 { n thr A 9 1qjpA_40F_10G}-9.269 5.341 -9.544 { ca thr A 9 1qjpA_40F_10G}-9.058 4.9 -8.177 { c thr A 9 1qjpA_40F_10G}-10.426 4.707 -7.545 { o thr A 9 1qjpA_40F_10G}-11.374 5.439 -7.817 { c thr A 9 1qjpA_40F_10G}P -10.426 4.707 -7.545 { n gly A 10 1qjpA_40F_10G}-10.505 3.722 -6.662 { ca gly A 10 1qjpA_40F_10G}-11.805 3.411 -6.081 { c gly A 10 1qjpA_40F_10G}-11.71 2.741 -4.718 { o gly A 10 1qjpA_40F_10G}-10.607 2.462 -4.24 { c gly A 10 1qjpA_40F_10G}P -11.71 2.741 -4.718 { n ala A 11 1qjpA_40F_10G}-12.91 2.539 -4.155 { ca ala A 11 1qjpA_40F_10G}-12.971 1.93 -2.847 { c ala A 11 1qjpA_40F_10G}-14.164 0.974 -2.915 { o ala A 11 1qjpA_40F_10G}-15.063 1.098 -3.748 { c ala A 11 1qjpA_40F_10G}P -14.164 0.974 -2.915 { n lys A 12 1qjpA_40F_10G}-14.123 0.014 -2.032 { ca lys A 12 1qjpA_40F_10G}-15.176 -1 -1.965 { c lys A 12 1qjpA_40F_10G}-15.481 -1.41 -0.539 { o lys A 12 1qjpA_40F_10G}-14.753 -1.172 0.426 { n gly A 38 1qjpA_40F_10G}P -11.966 -2.119 0.93 {"}-11.966 -2.119 0.93 { ca gly A 38 1qjpA_40F_10G}-10.763 -2.142 0.11 { c gly A 38 1qjpA_40F_10G}-10.664 -0.911 -0.754 { o gly A 38 1qjpA_40F_10G}-11.52 -0.047 -0.784 { c gly A 38 1qjpA_40F_10G}P -10.664 -0.911 -0.754 { n ala A 39 1qjpA_40F_10G}-9.513 -0.864 -1.419 { ca ala A 39 1qjpA_40F_10G}-9.214 0.21 -2.319 { c ala A 39 1qjpA_40F_10G}-8.575 -0.428 -3.542 { o ala A 39 1qjpA_40F_10G}-8.009 -1.517 -3.457 { c ala A 39 1qjpA_40F_10G}P -8.575 -0.428 -3.542 { n phe A 40 1qjpA_40F_10G}-8.745 0.259 -4.666 { ca phe A 40 1qjpA_40F_10G}-8.135 -0.228 -5.893 { c phe A 40 1qjpA_40F_10G}-7.762 0.978 -6.744 { o phe A 40 1qjpA_40F_10G}-8.303 2.087 -6.661 { c phe A 40 1qjpA_40F_10G}P -7.762 0.978 -6.744 { n gly A 41 1qjpA_40F_10G}-6.774 0.719 -7.602 { ca gly A 41 1qjpA_40F_10G}-6.364 1.738 -8.555 { c gly A 41 1qjpA_40F_10G}-6.064 1.036 -9.883 { o gly A 41 1qjpA_40F_10G}-5.665 -0.118 -9.853 { c gly A 41 1qjpA_40F_10G}P -6.064 1.036 -9.883 { n gly A 42 1qjpA_40F_10G}-6.305 1.717 -10.998 { ca gly A 42 1qjpA_40F_10G}-6.058 1.041 -12.258 { c gly A 42 1qjpA_40F_10G}-5.695 1.973 -13.379 { o gly A 42 1qjpA_40F_10G}-5.807 3.187 -13.236 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 8 1qjpA_40F_10G}P -7.64 5.485 -12.765 { ca tyr A 8 1qjpA_40F_10G}P -8.789 5.548 -11.879 { n thr A 9 1qjpA_40F_10G}P -9.269 5.341 -9.544 { ca thr A 9 1qjpA_40F_10G}P -9.058 4.9 -8.177 { n gly A 10 1qjpA_40F_10G}P -10.505 3.722 -6.662 { ca gly A 10 1qjpA_40F_10G}P -11.805 3.411 -6.081 {"}P -11.805 3.411 -6.081 { n ala A 11 1qjpA_40F_10G}P -12.91 2.539 -4.155 { ca ala A 11 1qjpA_40F_10G}P -12.971 1.93 -2.847 { n lys A 12 1qjpA_40F_10G}P -14.123 0.014 -2.032 { ca lys A 12 1qjpA_40F_10G}P -15.176 -1 -1.965 { n gly A 38 1qjpA_40F_10G}P -11.966 -2.119 0.93 { ca gly A 38 1qjpA_40F_10G}P -10.763 -2.142 0.11 {"}P -10.763 -2.142 0.11 { n ala A 39 1qjpA_40F_10G}P -9.513 -0.864 -1.419 { ca ala A 39 1qjpA_40F_10G}P -9.214 0.21 -2.319 { n phe A 40 1qjpA_40F_10G}P -8.745 0.259 -4.666 { ca phe A 40 1qjpA_40F_10G}P -8.135 -0.228 -5.893 { n gly A 41 1qjpA_40F_10G}P -6.774 0.719 -7.602 { ca gly A 41 1qjpA_40F_10G}P -6.364 1.738 -8.555 {"}P -6.364 1.738 -8.555 { n gly A 42 1qjpA_40F_10G}P -6.305 1.717 -10.998 { ca gly A 42 1qjpA_40F_10G}P -6.058 1.041 -12.258 {"}P -6.058 1.041 -12.258 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca tyr A 8 1qjpA_40F_10G}P -8.789 5.548 -11.879 {"}-8.789 5.548 -11.879 { ca thr A 9 1qjpA_40F_10G}-9.058 4.9 -8.177 { ca gly A 10 1qjpA_40F_10G}-11.805 3.411 -6.081 { ca ala A 11 1qjpA_40F_10G}-12.971 1.93 -2.847 { ca lys A 12 1qjpA_40F_10G}-15.176 -1 -1.965 { ca gly A 38 1qjpA_40F_10G}P -10.763 -2.142 0.11 {"}-10.763 -2.142 0.11 { ca ala A 39 1qjpA_40F_10G}-9.214 0.21 -2.319 { ca phe A 40 1qjpA_40F_10G}-8.135 -0.228 -5.893 { ca gly A 41 1qjpA_40F_10G}-6.364 1.738 -8.555 { ca gly A 42 1qjpA_40F_10G}-6.058 1.041 -12.258 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca tyr A 8 1qjpA_40F_10G}P -8.789 5.548 -11.879 { ca thr A 9 1qjpA_40F_10G}P -9.058 4.9 -8.177 { ca ala A 11 1qjpA_40F_10G}P -12.971 1.93 -2.847 { ca lys A 12 1qjpA_40F_10G}P -15.176 -1 -1.965 { ca ala A 39 1qjpA_40F_10G}P -9.214 0.21 -2.319 { ca phe A 40 1qjpA_40F_10G}P -8.135 -0.228 -5.893 { cb phe A 40 1qjpA_40F_10G}-9.025 -1.247 -6.625 { cg phe A 40 1qjpA_40F_10G}-10.341 -0.705 -7.104 { cd1 phe A 40 1qjpA_40F_10G}-11.464 -0.758 -6.294 { ce1 phe A 40 1qjpA_40F_10G}-12.697 -0.28 -6.692 { cz phe A 40 1qjpA_40F_10G}-12.795 0.275 -7.973 { cg phe A 40 1qjpA_40F_10G}P -10.341 -0.705 -7.104 { cd2 phe A 40 1qjpA_40F_10G}-10.488 -0.154 -8.36 { ce2 phe A 40 1qjpA_40F_10G}-11.687 0.368 -8.788 { cz phe A 40 1qjpA_40F_10G}ghost -12.795 0.275 -7.973 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 40 1qjpA_40F_10G}P -9.025 -1.247 -6.625 {"}P -9.025 -1.247 -6.625 { cd1 phe A 40 1qjpA_40F_10G}P -11.464 -0.758 -6.294 { cd2 phe A 40 1qjpA_40F_10G}P -10.488 -0.154 -8.36 { ce1 phe A 40 1qjpA_40F_10G}P -12.697 -0.28 -6.692 { ce2 phe A 40 1qjpA_40F_10G}P -11.687 0.368 -8.788 { cz phe A 40 1qjpA_40F_10G}P -12.795 0.275 -7.973 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 40 1qjpA_40F_10G}P -8.135 -0.228 -5.893 { cb phe A 40 1qjpA_40F_10G}-9.025 -1.247 -6.625 { cg phe A 40 1qjpA_40F_10G}-10.341 -0.705 -7.104 { cd1 phe A 40 1qjpA_40F_10G}-11.464 -0.758 -6.294 { ce1 phe A 40 1qjpA_40F_10G}-12.697 -0.28 -6.692 { cz phe A 40 1qjpA_40F_10G}-12.795 0.275 -7.973 { cg phe A 40 1qjpA_40F_10G}P -10.341 -0.705 -7.104 { cd2 phe A 40 1qjpA_40F_10G}-10.488 -0.154 -8.36 { ce2 phe A 40 1qjpA_40F_10G}-11.687 0.368 -8.788 { cz phe A 40 1qjpA_40F_10G}ghost -12.795 0.275 -7.973 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 40 1qjpA_40F_10G}P -9.025 -1.247 -6.625 {"}P -9.025 -1.247 -6.625 { cd1 phe A 40 1qjpA_40F_10G}P -11.464 -0.758 -6.294 { cd2 phe A 40 1qjpA_40F_10G}P -10.488 -0.154 -8.36 { ce1 phe A 40 1qjpA_40F_10G}P -12.697 -0.28 -6.692 { ce2 phe A 40 1qjpA_40F_10G}P -11.687 0.368 -8.788 { cz phe A 40 1qjpA_40F_10G}P -12.795 0.275 -7.973 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 40 A}'P' sky -12.059 1.349 -6.752 {"}'P' blue -13.093 1.412 -6.487 {"}'P' sky -12.067 1.34 -6.49 {"}'P' blue -12.893 1.396 -6.229 {"}'P' sky -12.632 1.406 -6.229 {"}'P' sky -12.372 1.376 -6.23 { CE2 PHE 40 A}'P' blue -11.95 1.946 -8.079 {"}'P' sky -11.88 1.832 -7.848 {"}'P' blue -11.623 1.843 -7.848 {"}'P' blue -11.63 1.686 -7.638 {"}'P' blue -11.623 1.499 -7.455 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 40 A}'P' sea -12.836 1.452 -6.485 {"}'P' sea -12.575 1.453 -6.485 {"}'P' sea -12.317 1.416 -6.487 { CZ PHE 40 A}'P' sea -12.934 2.007 -7.766 {"}'P' green -12.673 2.008 -7.766 {"}'P' green -12.415 1.971 -7.768 {"}'P' sea -12.165 1.895 -7.771 {"}'P' green -12.991 1.951 -7.51 {"}'P' green -12.218 1.862 -7.514 {"}'P' green -11.98 1.755 -7.519 {"}'P' green -13.058 1.853 -7.264 {"}'P' green -12.063 1.701 -7.271 {"}'P' sea -11.844 1.569 -7.277 {"}'P' sea -13.239 1.685 -7.036 {"}'P' green -12.988 1.739 -7.033 {"}'P' green -12 1.526 -7.043 {"}'P' sea -12.998 1.579 -6.824 {"}'P' green -12.738 1.593 -6.823 {"}'P' green -12.48 1.558 -6.825 {"}'P' green -12.234 1.474 -6.828 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 40 A}'P' P -12.73 1.961 -7.51 {"}'P' -12.73 1.95 -7.513 {"}'P' P -12.47 1.931 -7.511 {"}'P' -12.475 1.904 -7.518 {"}'P' P -12.803 1.875 -7.263 {"}'P' -12.803 1.843 -7.277 {"}'P' P -12.548 1.856 -7.264 {"}'P' -12.557 1.798 -7.29 {"}'P' P -12.299 1.797 -7.267 {"}'P' -12.312 1.758 -7.285 {"}'P' P -12.731 1.75 -7.033 {"}'P' -12.732 1.721 -7.051 {"}'P' P -12.476 1.717 -7.034 {"}'P' -12.484 1.678 -7.059 {"}'P' P -12.23 1.642 -7.037 {"}'P' -12.233 1.634 -7.043 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 10 A}'P' blue -11.754 2.1 -7.527 {"}'P' sky -12.097 1.632 -6.556 {"}'P' sky -12.847 1.711 -6.553 {"}'P' sky -12.232 1.685 -6.306 {"}'P' sky -12.486 1.685 -6.306 {"}'P' sky -12.733 1.746 -6.304 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 10 A}'P' sea -12.232 2.075 -7.713 {"}'P' green -12.486 2.075 -7.713 {"}'P' sea -12.724 2.162 -7.709 {"}'P' sea -11.971 1.957 -7.533 {"}'P' green -12.221 1.881 -7.536 {"}'P' green -12.952 2.089 -7.527 {"}'P' green -11.985 1.79 -7.318 {"}'P' green -12.958 1.908 -7.313 {"}'P' sea -13.148 2.077 -7.306 {"}'P' sea -11.857 1.741 -7.073 {"}'P' green -12.097 1.655 -7.077 {"}'P' green -13.064 1.868 -7.067 {"}'P' sea -12.046 1.627 -6.817 {"}'P' green -12.296 1.586 -6.819 {"}'P' green -12.548 1.6 -6.818 {"}'P' green -12.792 1.667 -6.815 {"}'P' sea -13.016 1.786 -6.81 {"}'P' sea -12.351 1.602 -6.558 {"}'P' sea -12.605 1.629 -6.556 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 10 A}'P' P -12.481 1.879 -7.536 {"}'P' -12.478 1.901 -7.517 {"}'P' P -12.731 1.95 -7.533 {"}'P' -12.729 1.956 -7.528 {"}'P' P -12.232 1.73 -7.321 {"}'P' -12.235 1.756 -7.307 {"}'P' P -12.486 1.73 -7.321 {"}'P' -12.479 1.785 -7.291 {"}'P' P -12.733 1.79 -7.318 {"}'P' -12.717 1.831 -7.295 {"}'P' P -12.351 1.625 -7.078 {"}'P' -12.351 1.659 -7.069 {"}'P' P -12.605 1.652 -7.077 {"}'P' -12.595 1.697 -7.064 {"}'P' P -12.847 1.734 -7.073 {"}'P' -12.839 1.749 -7.069 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 40 A}'M' greentint -9.597 2.475 -7.028 {"}'M' greentint -9.504 2.713 -7.017 {"}'M' greentint -9.366 2.929 -7.008 {"}'M' greentint -9.191 3.115 -7 {"}'M' greentint -8.983 3.265 -6.993 {"}'M' greentint -9.673 2.349 -6.779 {"}'M' greentint -9.603 2.596 -6.768 {"}'M' greentint -9.488 2.826 -6.758 {"}'M' greentint -9.333 3.031 -6.749 {"}'M' greentint -9.143 3.204 -6.742 {"}'M' greentint -8.924 3.339 -6.736 {"}'M' greentint -9.675 2.329 -6.521 {"}'M' greentint -9.606 2.577 -6.51 {"}'M' greentint -9.493 2.808 -6.5 {"}'M' greentint -9.339 3.014 -6.491 {"}'M' greentint -9.15 3.188 -6.484 {"}'M' greentint -8.932 3.324 -6.478 {"}'M' greentint -9.643 2.198 -6.273 {"}'M' greentint -9.595 2.449 -6.262 {"}'M' greentint -9.5 2.687 -6.251 {"}'M' greentint -9.361 2.902 -6.242 {"}'M' greentint -9.185 3.087 -6.234 {"}'M' greentint -8.976 3.235 -6.227 {"}'M' greentint -9.501 2.427 -6.022 {"}'M' greentint -9.403 2.66 -6.011 {"}'M' greentint -9.259 2.869 -6.002 {"}'M' greentint -9.076 3.045 -5.995 {"}'M' greentint -8.862 3.18 -5.989 {"}'M' greentint -9.353 2.432 -5.801 {"}'M' greentint -9.236 2.664 -5.791 {"}'M' greentint -9.07 2.862 -5.783 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 10 A}'M' greentint -9.082 2.933 -7.068 {"}'M' greentint -9.218 2.712 -7.077 {"}'M' greentint -9.426 2.555 -7.084 {"}'M' greentint -9.034 3.188 -7.056 {"}'M' greentint -8.911 2.932 -6.86 {"}'M' greentint -9.021 2.698 -6.871 {"}'M' greentint -9.195 2.508 -6.879 {"}'M' greentint -9.417 2.376 -6.885 {"}'M' greentint -8.875 3.187 -6.849 {"}'M' greentint -8.808 2.919 -6.619 {"}'M' greentint -8.904 2.686 -6.63 {"}'M' greentint -9.058 2.486 -6.638 {"}'M' greentint -9.258 2.333 -6.645 {"}'M' greentint -9.491 2.236 -6.649 {"}'M' greentint -8.775 3.168 -6.609 {"}'M' greentint -8.77 2.916 -6.361 {"}'M' greentint -8.861 2.683 -6.371 {"}'M' greentint -9.007 2.479 -6.38 {"}'M' greentint -9.198 2.318 -6.387 {"}'M' greentint -9.424 2.209 -6.391 {"}'M' greentint -9.67 2.16 -6.394 {"}'M' greentint -8.741 3.165 -6.35 {"}'M' greentint -8.808 2.896 -6.102 {"}'M' greentint -8.904 2.663 -6.112 {"}'M' greentint -9.058 2.463 -6.121 {"}'M' greentint -9.258 2.31 -6.128 {"}'M' greentint -9.491 2.214 -6.132 {"}'M' greentint -8.775 3.146 -6.091 {"}'M' greentint -8.911 2.888 -5.861 {"}'M' greentint -9.021 2.655 -5.871 {"}'M' greentint -9.195 2.464 -5.88 {"}'M' greentint -9.417 2.333 -5.886 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 40 A}'M' greentint -10.202 1.367 -4.998 {"}'M' greentint -10.106 1.6 -4.988 {"}'M' greentint -9.952 1.8 -4.979 {"}'M' greentint -9.752 1.953 -4.972 {"}'M' greentint -9.519 2.049 -4.968 {"}'M' greentint -10.262 1.223 -4.745 {"}'M' greentint -10.202 1.466 -4.734 {"}'M' greentint -10.083 1.687 -4.725 {"}'M' greentint -9.913 1.871 -4.717 {"}'M' greentint -9.702 2.007 -4.711 {"}'M' greentint -9.464 2.086 -4.707 {"}'M' greentint -10.202 1.344 -4.481 {"}'M' greentint -10.106 1.577 -4.47 {"}'M' greentint -9.952 1.777 -4.462 {"}'M' greentint -9.752 1.93 -4.455 {"}'M' greentint -9.519 2.027 -4.451 {"}'M' greentint -10.127 1.205 -4.245 {"}'M' greentint -10.053 1.452 -4.234 {"}'M' greentint -9.909 1.667 -4.225 {"}'M' greentint -9.709 1.829 -4.218 {"}'M' greentint -9.47 1.926 -4.214 {"}'M' greentint -9.87 1.447 -4.027 {"}'M' greentint -9.695 1.639 -4.019 {"}'M' greentint -9.463 1.755 -4.014 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 10 A}'M' green -10.226 1.128 -4.428 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 10 A}'M' greentint -9.746 1.788 -5.114 {"}'M' greentint -9.933 1.608 -5.122 {"}'M' greentint -9.455 1.995 -4.885 {"}'M' greentint -9.578 1.774 -4.895 {"}'M' greentint -9.744 1.582 -4.903 {"}'M' greentint -9.944 1.427 -4.91 {"}'M' greentint -10.172 1.315 -4.915 {"}'M' greentint -9.354 1.986 -4.644 {"}'M' greentint -9.47 1.758 -4.654 {"}'M' greentint -9.627 1.556 -4.663 {"}'M' greentint -9.819 1.388 -4.67 {"}'M' greentint -10.04 1.258 -4.676 {"}'M' greentint -9.307 1.965 -4.391 {"}'M' greentint -9.422 1.734 -4.401 {"}'M' greentint -9.577 1.529 -4.41 {"}'M' greentint -9.767 1.356 -4.418 {"}'M' greentint -9.986 1.221 -4.423 {"}'M' greentint -9.417 1.73 -4.143 {"}'M' greentint -9.571 1.524 -4.152 {"}'M' greentint -9.76 1.35 -4.159 {"}'M' greentint -9.978 1.213 -4.165 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n asp A 92 1qjpA_94Y_126G}P -12.087 -2.643 -0.022 {"}-12.087 -2.643 -0.022 { ca asp A 92 1qjpA_94Y_126G}-10.794 -2.533 -0.649 { c asp A 92 1qjpA_94Y_126G}-10.694 -1.14 -1.253 { o asp A 92 1qjpA_94Y_126G}-11.679 -0.573 -1.702 { c asp A 92 1qjpA_94Y_126G}P -10.694 -1.14 -1.253 { n ile A 93 1qjpA_94Y_126G}-9.484 -0.639 -1.235 { ca ile A 93 1qjpA_94Y_126G}-9.139 0.564 -1.976 { c ile A 93 1qjpA_94Y_126G}-8.397 -0.013 -3.187 { o ile A 93 1qjpA_94Y_126G}-7.702 -1.022 -3.108 { c ile A 93 1qjpA_94Y_126G}P -8.397 -0.013 -3.187 { n tyr A 94 1qjpA_94Y_126G}-8.541 0.595 -4.361 { ca tyr A 94 1qjpA_94Y_126G}-7.848 0.07 -5.513 { c tyr A 94 1qjpA_94Y_126G}-7.554 1.166 -6.517 { o tyr A 94 1qjpA_94Y_126G}-8.096 2.255 -6.463 { c tyr A 94 1qjpA_94Y_126G}P -7.554 1.166 -6.517 { n thr A 95 1qjpA_94Y_126G}-6.599 0.819 -7.368 { ca thr A 95 1qjpA_94Y_126G}-6.258 1.656 -8.505 { c thr A 95 1qjpA_94Y_126G}-6.268 0.743 -9.717 { o thr A 95 1qjpA_94Y_126G}-5.956 -0.451 -9.718 { c thr A 95 1qjpA_94Y_126G}P -6.268 0.743 -9.717 { n arg A 96 1qjpA_94Y_126G}-6.539 1.359 -10.874 { ca arg A 96 1qjpA_94Y_126G}-6.481 0.678 -12.146 { c arg A 96 1qjpA_94Y_126G}-5.616 1.492 -13.091 { o arg A 96 1qjpA_94Y_126G}-5.575 2.704 -12.959 { n ala A 124 1qjpA_94Y_126G}P -7.53 4.785 -12.734 {"}-7.53 4.785 -12.734 { ca ala A 124 1qjpA_94Y_126G}-8.675 4.974 -11.869 { c ala A 124 1qjpA_94Y_126G}-8.269 4.736 -10.419 { o ala A 124 1qjpA_94Y_126G}-7.291 4.052 -10.137 { c ala A 124 1qjpA_94Y_126G}P -8.269 4.736 -10.419 { n gly A 125 1qjpA_94Y_126G}-9.073 5.325 -9.527 { ca gly A 125 1qjpA_94Y_126G}-8.95 5.047 -8.113 { c gly A 125 1qjpA_94Y_126G}-10.371 4.789 -7.619 { o gly A 125 1qjpA_94Y_126G}-11.274 5.498 -8.03 { c gly A 125 1qjpA_94Y_126G}P -10.371 4.789 -7.619 { n gly A 126 1qjpA_94Y_126G}-10.478 3.854 -6.692 { ca gly A 126 1qjpA_94Y_126G}-11.821 3.595 -6.208 { c gly A 126 1qjpA_94Y_126G}-11.823 2.806 -4.92 { o gly A 126 1qjpA_94Y_126G}-10.776 2.446 -4.384 { c gly A 126 1qjpA_94Y_126G}P -11.823 2.806 -4.92 { n val A 127 1qjpA_94Y_126G}-13.038 2.537 -4.463 { ca val A 127 1qjpA_94Y_126G}-13.246 1.687 -3.286 { c val A 127 1qjpA_94Y_126G}-14.284 0.66 -3.74 { o val A 127 1qjpA_94Y_126G}-15.184 0.936 -4.542 { c val A 127 1qjpA_94Y_126G}P -14.284 0.66 -3.74 { n glu A 128 1qjpA_94Y_126G}-14.12 -0.548 -3.253 { ca glu A 128 1qjpA_94Y_126G}-15.042 -1.64 -3.539 { c glu A 128 1qjpA_94Y_126G}-15.466 -2.298 -2.228 { o glu A 128 1qjpA_94Y_126G}-14.601 -2.63 -1.43 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n asp A 92 1qjpA_94Y_126G}P -12.087 -2.643 -0.022 { ca asp A 92 1qjpA_94Y_126G}P -10.794 -2.533 -0.649 { n ile A 93 1qjpA_94Y_126G}P -9.484 -0.639 -1.235 { ca ile A 93 1qjpA_94Y_126G}P -9.139 0.564 -1.976 { n tyr A 94 1qjpA_94Y_126G}P -8.541 0.595 -4.361 { ca tyr A 94 1qjpA_94Y_126G}P -7.848 0.07 -5.513 { n thr A 95 1qjpA_94Y_126G}P -6.599 0.819 -7.368 { ca thr A 95 1qjpA_94Y_126G}P -6.258 1.656 -8.505 { n arg A 96 1qjpA_94Y_126G}P -6.539 1.359 -10.874 { ca arg A 96 1qjpA_94Y_126G}P -6.481 0.678 -12.146 { n ala A 124 1qjpA_94Y_126G}P -7.53 4.785 -12.734 { ca ala A 124 1qjpA_94Y_126G}P -8.675 4.974 -11.869 { n gly A 125 1qjpA_94Y_126G}P -9.073 5.325 -9.527 { ca gly A 125 1qjpA_94Y_126G}P -8.95 5.047 -8.113 {"}P -8.95 5.047 -8.113 { n gly A 126 1qjpA_94Y_126G}P -10.478 3.854 -6.692 { ca gly A 126 1qjpA_94Y_126G}P -11.821 3.595 -6.208 {"}P -11.821 3.595 -6.208 { n val A 127 1qjpA_94Y_126G}P -13.038 2.537 -4.463 { ca val A 127 1qjpA_94Y_126G}P -13.246 1.687 -3.286 { n glu A 128 1qjpA_94Y_126G}P -14.12 -0.548 -3.253 { ca glu A 128 1qjpA_94Y_126G}P -15.042 -1.64 -3.539 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca asp A 92 1qjpA_94Y_126G}P -10.794 -2.533 -0.649 {"}-10.794 -2.533 -0.649 { ca ile A 93 1qjpA_94Y_126G}-9.139 0.564 -1.976 { ca tyr A 94 1qjpA_94Y_126G}-7.848 0.07 -5.513 { ca thr A 95 1qjpA_94Y_126G}-6.258 1.656 -8.505 { ca arg A 96 1qjpA_94Y_126G}-6.481 0.678 -12.146 { ca ala A 124 1qjpA_94Y_126G}-8.675 4.974 -11.869 { ca gly A 125 1qjpA_94Y_126G}-8.95 5.047 -8.113 { ca gly A 126 1qjpA_94Y_126G}-11.821 3.595 -6.208 { ca val A 127 1qjpA_94Y_126G}-13.246 1.687 -3.286 { ca glu A 128 1qjpA_94Y_126G}-15.042 -1.64 -3.539 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca asp A 92 1qjpA_94Y_126G}P -10.794 -2.533 -0.649 { ca ile A 93 1qjpA_94Y_126G}P -9.139 0.564 -1.976 { ca tyr A 94 1qjpA_94Y_126G}P -7.848 0.07 -5.513 { cb tyr A 94 1qjpA_94Y_126G}-8.705 -1.009 -6.215 { cg tyr A 94 1qjpA_94Y_126G}-9.908 -0.504 -6.981 { cd1 tyr A 94 1qjpA_94Y_126G}-9.851 0.008 -8.272 { ce1 tyr A 94 1qjpA_94Y_126G}-10.962 0.481 -8.932 { cz tyr A 94 1qjpA_94Y_126G}-12.174 0.491 -8.279 { oh tyr A 94 1qjpA_94Y_126G}-13.285 0.951 -8.908 { cg tyr A 94 1qjpA_94Y_126G}P -9.908 -0.504 -6.981 { cd2 tyr A 94 1qjpA_94Y_126G}-11.144 -0.464 -6.357 { ce2 tyr A 94 1qjpA_94Y_126G}-12.277 0.01 -6.977 { cz tyr A 94 1qjpA_94Y_126G}ghost -12.174 0.491 -8.279 { ca thr A 95 1qjpA_94Y_126G}P -6.258 1.656 -8.505 {"}P -6.258 1.656 -8.505 { ca arg A 96 1qjpA_94Y_126G}P -6.481 0.678 -12.146 { ca ala A 124 1qjpA_94Y_126G}P -8.675 4.974 -11.869 { ca val A 127 1qjpA_94Y_126G}P -13.246 1.687 -3.286 { ca glu A 128 1qjpA_94Y_126G}P -15.042 -1.64 -3.539 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 94 1qjpA_94Y_126G}P -8.705 -1.009 -6.215 {"}P -8.705 -1.009 -6.215 { cd1 tyr A 94 1qjpA_94Y_126G}P -9.851 0.008 -8.272 { cd2 tyr A 94 1qjpA_94Y_126G}P -11.144 -0.464 -6.357 { ce1 tyr A 94 1qjpA_94Y_126G}P -10.962 0.481 -8.932 { ce2 tyr A 94 1qjpA_94Y_126G}P -12.277 0.01 -6.977 { oh tyr A 94 1qjpA_94Y_126G}P -13.285 0.951 -8.908 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 94 1qjpA_94Y_126G}P -7.848 0.07 -5.513 { cb tyr A 94 1qjpA_94Y_126G}-8.705 -1.009 -6.215 { cg tyr A 94 1qjpA_94Y_126G}-9.908 -0.504 -6.981 { cd1 tyr A 94 1qjpA_94Y_126G}-9.851 0.008 -8.272 { ce1 tyr A 94 1qjpA_94Y_126G}-10.962 0.481 -8.932 { cz tyr A 94 1qjpA_94Y_126G}-12.174 0.491 -8.279 { oh tyr A 94 1qjpA_94Y_126G}-13.285 0.951 -8.908 { cg tyr A 94 1qjpA_94Y_126G}P -9.908 -0.504 -6.981 { cd2 tyr A 94 1qjpA_94Y_126G}-11.144 -0.464 -6.357 { ce2 tyr A 94 1qjpA_94Y_126G}-12.277 0.01 -6.977 { cz tyr A 94 1qjpA_94Y_126G}ghost -12.174 0.491 -8.279 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 94 1qjpA_94Y_126G}P -8.705 -1.009 -6.215 {"}P -8.705 -1.009 -6.215 { cd1 tyr A 94 1qjpA_94Y_126G}P -9.851 0.008 -8.272 { cd2 tyr A 94 1qjpA_94Y_126G}P -11.144 -0.464 -6.357 { ce1 tyr A 94 1qjpA_94Y_126G}P -10.962 0.481 -8.932 { ce2 tyr A 94 1qjpA_94Y_126G}P -12.277 0.01 -6.977 { oh tyr A 94 1qjpA_94Y_126G}P -13.285 0.951 -8.908 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 94 A}'P' sky -12.915 1.639 -7.037 {"}'P' blue -12.922 1.624 -6.776 {"}'P' sky -12.729 1.637 -6.516 {"}'P' sky -12.473 1.686 -6.514 { CZ TYR 94 A}'P' sky -11.597 2.078 -7.82 {"}'P' sky -11.609 1.858 -7.343 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 94 A}'P' sea -12.665 1.715 -7.033 {"}'P' green -12.407 1.754 -7.032 {"}'P' green -12.147 1.754 -7.032 {"}'P' sea -11.889 1.715 -7.033 {"}'P' sea -12.673 1.702 -6.772 {"}'P' green -12.416 1.742 -6.77 {"}'P' sea -12.155 1.743 -6.77 { CZ TYR 94 A}'P' sea -12.57 2.183 -8.074 {"}'P' sea -12.313 2.223 -8.072 {"}'P' sea -12.052 2.224 -8.072 {"}'P' sea -12.872 2.029 -7.822 {"}'P' green -12.626 2.118 -7.818 {"}'P' green -12.37 2.167 -7.816 {"}'P' green -12.109 2.177 -7.816 {"}'P' sea -11.849 2.147 -7.817 {"}'P' sea -12.921 1.909 -7.577 {"}'P' green -12.685 2.008 -7.573 {"}'P' green -11.927 2.072 -7.57 {"}'P' sea -11.678 2.013 -7.573 {"}'P' sea -12.856 1.805 -7.346 {"}'P' green -12.618 1.901 -7.342 {"}'P' green -12.11 1.966 -7.339 {"}'P' green -11.855 1.933 -7.34 {"}'P' sea -12.629 1.732 -7.133 {"}'P' green -12.377 1.795 -7.13 {"}'P' green -12.117 1.809 -7.129 {"}'P' sea -11.859 1.774 -7.131 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 94 A}'P' P -12.437 2.069 -7.57 {"}'P' -12.435 2.057 -7.575 {"}'P' P -12.182 2.091 -7.569 {"}'P' -12.182 2.078 -7.575 {"}'P' P -12.367 1.955 -7.339 {"}'P' -12.365 1.946 -7.345 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 94 A}'P' blue -13.091 2.013 -8.017 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 126 A}'P' sky -12.02 2.453 -7.915 {"}'P' sky -12.75 2.453 -7.915 {"}'P' sky -11.78 2.391 -7.733 {"}'P' blue -12.978 2.38 -7.733 {"}'P' sky -12.984 2.199 -7.519 {"}'P' sky -11.667 2.169 -7.273 {"}'P' sky -11.837 2.011 -7.019 {"}'P' sky -12.818 1.958 -7.021 {"}'P' sky -12.873 2.002 -6.759 {"}'P' sky -12.512 1.976 -6.512 {"}'P' blue -12.759 2.037 -6.51 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 126 A}'P' sea -12.258 2.366 -7.919 {"}'P' sea -12.512 2.366 -7.919 {"}'P' green -11.997 2.248 -7.739 {"}'P' green -12.247 2.172 -7.742 {"}'P' green -12.507 2.17 -7.742 {"}'P' sea -12.757 2.241 -7.739 {"}'P' sea -11.786 2.199 -7.519 {"}'P' green -12.011 2.081 -7.524 {"}'P' green -12.759 2.081 -7.524 {"}'P' green -11.883 2.032 -7.279 {"}'P' green -12.123 1.946 -7.283 {"}'P' green -12.631 1.943 -7.283 {"}'P' sea -12.873 2.025 -7.279 {"}'P' sea -12.072 1.918 -7.023 {"}'P' green -12.322 1.877 -7.025 {"}'P' sea -12.574 1.891 -7.024 {"}'P' sea -12.123 1.923 -6.762 {"}'P' green -12.377 1.893 -6.764 {"}'P' sea -12.631 1.92 -6.762 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 126 A}'P' P -12.258 2.021 -7.527 {"}'P' -12.26 2.04 -7.517 {"}'P' P -12.512 2.021 -7.527 {"}'P' -12.511 2.026 -7.524 {"}'P' P -12.377 1.916 -7.284 {"}'P' -12.377 1.916 -7.284 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 94 A}'M' greentint -9.39 2.643 -6.83 {"}'M' greentint -9.297 2.881 -6.819 {"}'M' greentint -9.159 3.097 -6.81 {"}'M' greentint -8.984 3.283 -6.802 {"}'M' greentint -9.466 2.517 -6.581 {"}'M' greentint -9.396 2.764 -6.57 {"}'M' greentint -9.281 2.994 -6.56 {"}'M' greentint -9.126 3.199 -6.551 {"}'M' greentint -8.936 3.372 -6.544 {"}'M' greentint -9.468 2.497 -6.323 {"}'M' greentint -9.399 2.745 -6.312 {"}'M' greentint -9.286 2.976 -6.302 {"}'M' greentint -9.132 3.182 -6.293 {"}'M' greentint -8.943 3.356 -6.286 {"}'M' greentint -9.388 2.617 -6.064 {"}'M' greentint -9.293 2.855 -6.053 {"}'M' greentint -9.154 3.07 -6.044 {"}'M' greentint -8.978 3.255 -6.036 {"}'M' greentint -9.294 2.595 -5.824 {"}'M' greentint -9.196 2.828 -5.813 {"}'M' greentint -9.052 3.037 -5.804 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 126 A}'M' greentint -9.214 2.868 -7.022 {"}'M' greentint -8.907 3.088 -6.805 {"}'M' greentint -9.017 2.854 -6.816 {"}'M' greentint -9.191 2.664 -6.824 {"}'M' greentint -9.413 2.532 -6.83 {"}'M' greentint -8.871 3.343 -6.794 {"}'M' greentint -8.804 3.075 -6.564 {"}'M' greentint -8.9 2.842 -6.575 {"}'M' greentint -9.054 2.642 -6.583 {"}'M' greentint -9.254 2.489 -6.59 {"}'M' greentint -8.771 3.324 -6.554 {"}'M' greentint -8.766 3.072 -6.306 {"}'M' greentint -8.857 2.839 -6.316 {"}'M' greentint -9.003 2.635 -6.325 {"}'M' greentint -9.194 2.474 -6.332 {"}'M' greentint -9.42 2.365 -6.336 {"}'M' greentint -8.737 3.321 -6.295 {"}'M' greentint -8.804 3.052 -6.047 {"}'M' greentint -8.9 2.819 -6.057 {"}'M' greentint -9.054 2.619 -6.066 {"}'M' greentint -9.254 2.466 -6.073 {"}'M' greentint -8.771 3.302 -6.036 {"}'M' greentint -8.907 3.044 -5.806 {"}'M' greentint -9.017 2.811 -5.816 {"}'M' greentint -9.191 2.62 -5.825 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 94 A}'M' greentint -9.959 1.549 -5.02 {"}'M' greentint -9.885 1.796 -5.009 {"}'M' greentint -9.741 2.01 -5 {"}'M' greentint -10.067 1.417 -4.785 {"}'M' greentint -10.034 1.667 -4.774 {"}'M' greentint -9.938 1.9 -4.764 {"}'M' greentint -9.784 2.1 -4.755 {"}'M' greentint -9.584 2.253 -4.748 {"}'M' greentint -10.092 1.273 -4.532 {"}'M' greentint -10.094 1.523 -4.521 {"}'M' greentint -10.034 1.766 -4.51 {"}'M' greentint -9.915 1.987 -4.501 {"}'M' greentint -9.745 2.171 -4.493 {"}'M' greentint -9.534 2.307 -4.487 {"}'M' greentint -10.067 1.395 -4.267 {"}'M' greentint -10.034 1.644 -4.257 {"}'M' greentint -9.938 1.877 -4.246 {"}'M' greentint -9.784 2.077 -4.238 {"}'M' greentint -9.584 2.23 -4.231 {"}'M' greentint -9.959 1.505 -4.021 {"}'M' greentint -9.885 1.752 -4.01 {"}'M' greentint -9.741 1.967 -4.001 {"}'M' greentint -9.541 2.129 -3.994 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 126 A}'M' greentint -9.624 1.979 -5.029 {"}'M' greentint -9.747 1.758 -5.039 {"}'M' greentint -9.913 1.566 -5.047 {"}'M' greentint -9.452 2.216 -4.778 {"}'M' greentint -9.523 1.97 -4.788 {"}'M' greentint -9.639 1.742 -4.798 {"}'M' greentint -9.796 1.54 -4.807 {"}'M' greentint -9.988 1.372 -4.814 {"}'M' greentint -9.406 2.196 -4.524 {"}'M' greentint -9.476 1.949 -4.535 {"}'M' greentint -9.591 1.718 -4.545 {"}'M' greentint -9.746 1.513 -4.554 {"}'M' greentint -9.936 1.34 -4.562 {"}'M' greentint -9.404 2.193 -4.266 {"}'M' greentint -9.473 1.945 -4.277 {"}'M' greentint -9.586 1.714 -4.287 {"}'M' greentint -9.74 1.508 -4.296 {"}'M' greentint -9.929 1.334 -4.303 {"}'M' greentint -9.454 2.175 -4.012 {"}'M' greentint -9.526 1.929 -4.023 {"}'M' greentint -9.643 1.702 -4.033 {"}'M' greentint -9.801 1.501 -4.042 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ile E 83 1qrpE_101F_85G}P -6.178 5.659 -11.282 {"}-6.178 5.659 -11.282 { ca ile E 83 1qrpE_101F_85G}-7.16 6.251 -10.389 { c ile E 83 1qrpE_101F_85G}-7.578 5.238 -9.328 { o ile E 83 1qrpE_101F_85G}-7.491 4.029 -9.516 { c ile E 83 1qrpE_101F_85G}P -7.578 5.238 -9.328 { n leu E 84 1qrpE_101F_85G}-7.819 5.741 -8.112 { ca leu E 84 1qrpE_101F_85G}-8.263 4.92 -6.994 { c leu E 84 1qrpE_101F_85G}-9.784 4.793 -6.995 { o leu E 84 1qrpE_101F_85G}-10.525 5.724 -7.264 { c leu E 84 1qrpE_101F_85G}P -9.784 4.793 -6.995 { n gly E 85 1qrpE_101F_85G}-10.199 3.571 -6.748 { ca gly E 85 1qrpE_101F_85G}-11.629 3.234 -6.559 { c gly E 85 1qrpE_101F_85G}-11.744 2.223 -5.43 { o gly E 85 1qrpE_101F_85G}-10.75 1.702 -4.955 { c gly E 85 1qrpE_101F_85G}P -11.744 2.223 -5.43 { n tyr E 86 1qrpE_101F_85G}-12.993 1.984 -5.002 { ca tyr E 86 1qrpE_101F_85G}-13.322 0.992 -3.961 { c tyr E 86 1qrpE_101F_85G}-14.206 -0.08 -4.578 { o tyr E 86 1qrpE_101F_85G}-15.095 0.207 -5.375 { c tyr E 86 1qrpE_101F_85G}P -14.206 -0.08 -4.578 { n asp E 87 1qrpE_101F_85G}-13.955 -1.33 -4.173 { ca asp E 87 1qrpE_101F_85G}-14.813 -2.466 -4.499 { c asp E 87 1qrpE_101F_85G}-14.44 -3.668 -3.638 { o asp E 87 1qrpE_101F_85G}-13.558 -3.572 -2.785 { n gln E 99 1qrpE_101F_85G}P -12.483 -2.31 -0.402 {"}-12.483 -2.31 -0.402 { ca gln E 99 1qrpE_101F_85G}-11.053 -2.292 -0.67 { c gln E 99 1qrpE_101F_85G}-10.767 -1.223 -1.728 { o gln E 99 1qrpE_101F_85G}-11.343 -1.234 -2.811 { c gln E 99 1qrpE_101F_85G}P -10.767 -1.223 -1.728 { n ile E 100 1qrpE_101F_85G}-9.91 -0.313 -1.325 { ca ile E 100 1qrpE_101F_85G}-9.29 0.689 -2.223 { c ile E 100 1qrpE_101F_85G}-8.213 -0.007 -3.06 { o ile E 100 1qrpE_101F_85G}-7.446 -0.851 -2.59 { c ile E 100 1qrpE_101F_85G}P -8.213 -0.007 -3.06 { n phe E 101 1qrpE_101F_85G}-8.256 0.298 -4.357 { ca phe E 101 1qrpE_101F_85G}-7.273 -0.194 -5.327 { c phe E 101 1qrpE_101F_85G}-7.148 0.774 -6.51 { o phe E 101 1qrpE_101F_85G}-7.981 1.635 -6.718 { c phe E 101 1qrpE_101F_85G}P -7.148 0.774 -6.51 { n gly E 102 1qrpE_101F_85G}-6.016 0.635 -7.181 { ca gly E 102 1qrpE_101F_85G}-5.72 1.384 -8.405 { c gly E 102 1qrpE_101F_85G}-6.301 0.708 -9.651 { o gly E 102 1qrpE_101F_85G}-6.222 -0.504 -9.854 { c gly E 102 1qrpE_101F_85G}P -6.301 0.708 -9.651 { n leu E 103 1qrpE_101F_85G}-6.905 1.546 -10.448 { ca leu E 103 1qrpE_101F_85G}-7.374 1.208 -11.812 { c leu E 103 1qrpE_101F_85G}-6.393 1.896 -12.756 { o leu E 103 1qrpE_101F_85G}-6.33 3.119 -12.804 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile E 83 1qrpE_101F_85G}P -6.178 5.659 -11.282 { ca ile E 83 1qrpE_101F_85G}P -7.16 6.251 -10.389 { n leu E 84 1qrpE_101F_85G}P -7.819 5.741 -8.112 { ca leu E 84 1qrpE_101F_85G}P -8.263 4.92 -6.994 { n gly E 85 1qrpE_101F_85G}P -10.199 3.571 -6.748 { ca gly E 85 1qrpE_101F_85G}P -11.629 3.234 -6.559 {"}P -11.629 3.234 -6.559 { n tyr E 86 1qrpE_101F_85G}P -12.993 1.984 -5.002 { ca tyr E 86 1qrpE_101F_85G}P -13.322 0.992 -3.961 { n asp E 87 1qrpE_101F_85G}P -13.955 -1.33 -4.173 { ca asp E 87 1qrpE_101F_85G}P -14.813 -2.466 -4.499 { n gln E 99 1qrpE_101F_85G}P -12.483 -2.31 -0.402 { ca gln E 99 1qrpE_101F_85G}P -11.053 -2.292 -0.67 { n ile E 100 1qrpE_101F_85G}P -9.91 -0.313 -1.325 { ca ile E 100 1qrpE_101F_85G}P -9.29 0.689 -2.223 { n phe E 101 1qrpE_101F_85G}P -8.256 0.298 -4.357 { ca phe E 101 1qrpE_101F_85G}P -7.273 -0.194 -5.327 { n gly E 102 1qrpE_101F_85G}P -6.016 0.635 -7.181 { ca gly E 102 1qrpE_101F_85G}P -5.72 1.384 -8.405 {"}P -5.72 1.384 -8.405 { n leu E 103 1qrpE_101F_85G}P -6.905 1.546 -10.448 { ca leu E 103 1qrpE_101F_85G}P -7.374 1.208 -11.812 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ile E 83 1qrpE_101F_85G}P -7.16 6.251 -10.389 {"}-7.16 6.251 -10.389 { ca leu E 84 1qrpE_101F_85G}-8.263 4.92 -6.994 { ca gly E 85 1qrpE_101F_85G}-11.629 3.234 -6.559 { ca tyr E 86 1qrpE_101F_85G}-13.322 0.992 -3.961 { ca asp E 87 1qrpE_101F_85G}-14.813 -2.466 -4.499 { ca gln E 99 1qrpE_101F_85G}P -11.053 -2.292 -0.67 {"}-11.053 -2.292 -0.67 { ca ile E 100 1qrpE_101F_85G}-9.29 0.689 -2.223 { ca phe E 101 1qrpE_101F_85G}-7.273 -0.194 -5.327 { ca gly E 102 1qrpE_101F_85G}-5.72 1.384 -8.405 { ca leu E 103 1qrpE_101F_85G}-7.374 1.208 -11.812 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile E 83 1qrpE_101F_85G}P -7.16 6.251 -10.389 { ca leu E 84 1qrpE_101F_85G}P -8.263 4.92 -6.994 { ca tyr E 86 1qrpE_101F_85G}P -13.322 0.992 -3.961 { ca asp E 87 1qrpE_101F_85G}P -14.813 -2.466 -4.499 { ca gln E 99 1qrpE_101F_85G}P -11.053 -2.292 -0.67 { ca ile E 100 1qrpE_101F_85G}P -9.29 0.689 -2.223 { ca phe E 101 1qrpE_101F_85G}P -7.273 -0.194 -5.327 { ca leu E 103 1qrpE_101F_85G}P -7.374 1.208 -11.812 @subgroup {sidechain} off @vectorlist {sc} color= blue alpha= 0.2353 master= {sidechain} { ca phe E 101 1qrpE_101F_85G}P -7.273 -0.194 -5.327 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 101 E}'M' green -8.654 2.783 -6.284 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 101 E}'M' greentint -9.077 2.27 -7.315 {"}'M' greentint -8.932 2.478 -7.306 {"}'M' greentint -9.275 2.023 -7.085 {"}'M' greentint -9.182 2.261 -7.074 {"}'M' greentint -9.044 2.477 -7.065 {"}'M' greentint -8.869 2.663 -7.057 {"}'M' greentint -8.661 2.813 -7.05 {"}'M' greentint -9.351 1.897 -6.836 {"}'M' greentint -9.281 2.144 -6.825 {"}'M' greentint -9.166 2.374 -6.815 {"}'M' greentint -9.011 2.579 -6.806 {"}'M' greentint -8.821 2.752 -6.799 {"}'M' greentint -8.602 2.887 -6.793 {"}'M' greentint -9.353 1.877 -6.578 {"}'M' greentint -9.284 2.125 -6.567 {"}'M' greentint -9.171 2.356 -6.557 {"}'M' greentint -9.017 2.562 -6.548 {"}'M' greentint -8.828 2.736 -6.541 {"}'M' greentint -8.61 2.872 -6.535 {"}'M' greentint -9.273 1.997 -6.319 {"}'M' greentint -9.178 2.235 -6.308 {"}'M' greentint -9.039 2.45 -6.299 {"}'M' greentint -8.863 2.635 -6.291 {"}'M' greentint -9.081 2.208 -6.068 {"}'M' greentint -8.937 2.417 -6.059 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 85 E}'M' greentint -8.755 2.561 -7.181 {"}'M' greentint -8.865 2.327 -7.192 {"}'M' greentint -9.039 2.137 -7.2 {"}'M' greentint -8.652 2.548 -6.94 {"}'M' greentint -8.748 2.315 -6.951 {"}'M' greentint -8.902 2.115 -6.959 {"}'M' greentint -9.102 1.962 -6.966 {"}'M' greentint -9.335 1.865 -6.97 {"}'M' greentint -8.619 2.797 -6.93 {"}'M' greentint -8.614 2.545 -6.682 {"}'M' greentint -8.705 2.312 -6.692 {"}'M' greentint -8.851 2.108 -6.701 {"}'M' greentint -9.042 1.947 -6.708 {"}'M' greentint -9.268 1.838 -6.712 {"}'M' greentint -8.585 2.794 -6.671 {"}'M' greentint -8.652 2.525 -6.423 {"}'M' greentint -8.748 2.292 -6.433 {"}'M' greentint -8.902 2.092 -6.442 {"}'M' greentint -9.102 1.939 -6.449 {"}'M' greentint -9.335 1.843 -6.453 {"}'M' greentint -8.619 2.775 -6.412 {"}'M' greentint -8.755 2.517 -6.182 {"}'M' greentint -8.865 2.284 -6.192 {"}'M' greentint -9.039 2.093 -6.201 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 101 E}'M' greentint -9.655 1.044 -5.46 {"}'M' greentint -9.561 1.286 -5.449 {"}'M' greentint -9.815 0.768 -5.265 {"}'M' greentint -9.818 1.026 -5.253 {"}'M' greentint -9.744 1.273 -5.242 {"}'M' greentint -9.6 1.487 -5.233 {"}'M' greentint -9.4 1.65 -5.226 {"}'M' greentint -9.893 0.645 -5.028 {"}'M' greentint -9.926 0.894 -5.018 {"}'M' greentint -9.893 1.144 -5.007 {"}'M' greentint -9.797 1.377 -4.997 {"}'M' greentint -9.643 1.577 -4.988 {"}'M' greentint -9.443 1.73 -4.981 {"}'M' greentint -9.951 0.75 -4.765 {"}'M' greentint -9.953 1 -4.754 {"}'M' greentint -9.893 1.243 -4.743 {"}'M' greentint -9.774 1.464 -4.734 {"}'M' greentint -9.604 1.648 -4.726 {"}'M' greentint -9.393 1.784 -4.72 {"}'M' greentint -9.926 0.872 -4.5 {"}'M' greentint -9.893 1.121 -4.49 {"}'M' greentint -9.797 1.354 -4.479 {"}'M' greentint -9.643 1.554 -4.471 {"}'M' greentint -9.443 1.707 -4.464 {"}'M' greentint -9.818 0.982 -4.254 {"}'M' greentint -9.744 1.229 -4.243 {"}'M' greentint -9.6 1.444 -4.234 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 85 E}'M' green -9.881 0.773 -4.371 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 85 E}'M' greentint -9.426 1.472 -5.349 {"}'M' greentint -9.497 1.226 -5.359 {"}'M' greentint -9.613 0.998 -5.369 {"}'M' greentint -9.38 1.452 -5.095 {"}'M' greentint -9.45 1.205 -5.106 {"}'M' greentint -9.565 0.974 -5.116 {"}'M' greentint -9.72 0.769 -5.125 {"}'M' greentint -9.356 1.708 -5.084 {"}'M' greentint -9.378 1.449 -4.837 {"}'M' greentint -9.447 1.201 -4.848 {"}'M' greentint -9.56 0.97 -4.858 {"}'M' greentint -9.714 0.764 -4.867 {"}'M' greentint -9.903 0.59 -4.874 {"}'M' greentint -9.356 1.705 -4.826 {"}'M' greentint -9.428 1.431 -4.583 {"}'M' greentint -9.5 1.185 -4.594 {"}'M' greentint -9.617 0.958 -4.604 {"}'M' greentint -9.775 0.757 -4.613 {"}'M' greentint -9.403 1.685 -4.572 {"}'M' greentint -9.521 1.431 -4.342 {"}'M' greentint -9.595 1.188 -4.353 {"}'M' greentint -9.717 0.966 -4.362 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n cys A 513 1rwhA_624Y_515}P -8.841 5.031 -12.926 {"}-8.841 5.031 -12.926 { ca cys A 513 1rwhA_624Y_515}-9.952 4.53 -12.14 { c cys A 513 1rwhA_624Y_515}-9.496 4.295 -10.7 { o cys A 513 1rwhA_624Y_515}-8.634 3.401 -10.465 { c cys A 513 1rwhA_624Y_515}P -9.496 4.295 -10.7 { n leu A 514 1rwhA_624Y_515}-10.037 5.053 -9.772 { ca leu A 514 1rwhA_624Y_515}-9.673 4.947 -8.346 { c leu A 514 1rwhA_624Y_515}-10.85 4.473 -7.513 { o leu A 514 1rwhA_624Y_515}-11.981 4.957 -7.757 { c leu A 514 1rwhA_624Y_515}P -10.85 4.473 -7.513 { n gly A 515 1rwhA_624Y_515}-10.623 3.582 -6.553 { ca gly A 515 1rwhA_624Y_515}-11.672 3.132 -5.683 { c gly A 515 1rwhA_624Y_515}-11.156 3.123 -4.255 { o gly A 515 1rwhA_624Y_515}-9.987 2.792 -3.999 { c gly A 515 1rwhA_624Y_515}P -11.156 3.123 -4.255 { n ala A 516 1rwhA_624Y_515}-12.018 3.459 -3.313 { ca ala A 516 1rwhA_624Y_515}-11.631 3.53 -1.921 { c ala A 516 1rwhA_624Y_515}-12.818 3.243 -1.024 { o ala A 516 1rwhA_624Y_515}-13.991 3.317 -1.431 { c ala A 516 1rwhA_624Y_515}P -12.818 3.243 -1.024 { n asp A 517 1rwhA_624Y_515}-12.513 2.969 0.242 { ca asp A 517 1rwhA_624Y_515}-13.498 2.849 1.288 { c asp A 517 1rwhA_624Y_515}-14.491 1.738 0.991 { o asp A 517 1rwhA_624Y_515}-15.688 1.889 1.317 { n gly A 622 1rwhA_624Y_515}P -11.442 -1.37 1.587 {"}-11.442 -1.37 1.587 { ca gly A 622 1rwhA_624Y_515}-10.791 -1.865 0.388 { c gly A 622 1rwhA_624Y_515}-10.643 -0.769 -0.67 { o gly A 622 1rwhA_624Y_515}-11.311 0.273 -0.582 { c gly A 622 1rwhA_624Y_515}P -10.643 -0.769 -0.67 { n ser A 623 1rwhA_624Y_515}-9.758 -0.999 -1.608 { ca ser A 623 1rwhA_624Y_515}-9.41 0.027 -2.585 { c ser A 623 1rwhA_624Y_515}-8.959 -0.586 -3.887 { o ser A 623 1rwhA_624Y_515}-8.656 -1.798 -3.933 { c ser A 623 1rwhA_624Y_515}P -8.959 -0.586 -3.887 { n tyr A 624 1rwhA_624Y_515}-8.893 0.197 -4.946 { ca tyr A 624 1rwhA_624Y_515}-8.29 -0.221 -6.189 { c tyr A 624 1rwhA_624Y_515}-7.691 1.003 -6.856 { o tyr A 624 1rwhA_624Y_515}-8.121 2.163 -6.598 { c tyr A 624 1rwhA_624Y_515}P -7.691 1.003 -6.856 { n ala A 625 1rwhA_624Y_515}-6.821 0.789 -7.813 { ca ala A 625 1rwhA_624Y_515}-6.267 1.871 -8.611 { c ala A 625 1rwhA_624Y_515}-5.759 1.261 -9.901 { o ala A 625 1rwhA_624Y_515}-4.875 0.387 -9.859 { c ala A 625 1rwhA_624Y_515}P -5.759 1.261 -9.901 { n tyr A 626 1rwhA_624Y_515}-6.338 1.612 -11.036 { ca tyr A 626 1rwhA_624Y_515}-5.91 1.086 -12.318 { c tyr A 626 1rwhA_624Y_515}-6.205 2.109 -13.406 { o tyr A 626 1rwhA_624Y_515}-6.853 3.13 -13.164 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n cys A 513 1rwhA_624Y_515}P -8.841 5.031 -12.926 { ca cys A 513 1rwhA_624Y_515}P -9.952 4.53 -12.14 { n leu A 514 1rwhA_624Y_515}P -10.037 5.053 -9.772 { ca leu A 514 1rwhA_624Y_515}P -9.673 4.947 -8.346 { n gly A 515 1rwhA_624Y_515}P -10.623 3.582 -6.553 { ca gly A 515 1rwhA_624Y_515}P -11.672 3.132 -5.683 {"}P -11.672 3.132 -5.683 { n ala A 516 1rwhA_624Y_515}P -12.018 3.459 -3.313 { ca ala A 516 1rwhA_624Y_515}P -11.631 3.53 -1.921 { n asp A 517 1rwhA_624Y_515}P -12.513 2.969 0.242 { ca asp A 517 1rwhA_624Y_515}P -13.498 2.849 1.288 { n gly A 622 1rwhA_624Y_515}P -11.442 -1.37 1.587 { ca gly A 622 1rwhA_624Y_515}P -10.791 -1.865 0.388 {"}P -10.791 -1.865 0.388 { n ser A 623 1rwhA_624Y_515}P -9.758 -0.999 -1.608 { ca ser A 623 1rwhA_624Y_515}P -9.41 0.027 -2.585 { n tyr A 624 1rwhA_624Y_515}P -8.893 0.197 -4.946 { ca tyr A 624 1rwhA_624Y_515}P -8.29 -0.221 -6.189 { n ala A 625 1rwhA_624Y_515}P -6.821 0.789 -7.813 { ca ala A 625 1rwhA_624Y_515}P -6.267 1.871 -8.611 { n tyr A 626 1rwhA_624Y_515}P -6.338 1.612 -11.036 { ca tyr A 626 1rwhA_624Y_515}P -5.91 1.086 -12.318 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca cys A 513 1rwhA_624Y_515}P -9.952 4.53 -12.14 {"}-9.952 4.53 -12.14 { ca leu A 514 1rwhA_624Y_515}-9.673 4.947 -8.346 { ca gly A 515 1rwhA_624Y_515}-11.672 3.132 -5.683 { ca ala A 516 1rwhA_624Y_515}-11.631 3.53 -1.921 { ca asp A 517 1rwhA_624Y_515}-13.498 2.849 1.288 { ca gly A 622 1rwhA_624Y_515}P -10.791 -1.865 0.388 {"}-10.791 -1.865 0.388 { ca ser A 623 1rwhA_624Y_515}-9.41 0.027 -2.585 { ca tyr A 624 1rwhA_624Y_515}-8.29 -0.221 -6.189 { ca ala A 625 1rwhA_624Y_515}-6.267 1.871 -8.611 { ca tyr A 626 1rwhA_624Y_515}-5.91 1.086 -12.318 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca cys A 513 1rwhA_624Y_515}P -9.952 4.53 -12.14 { ca leu A 514 1rwhA_624Y_515}P -9.673 4.947 -8.346 { ca ala A 516 1rwhA_624Y_515}P -11.631 3.53 -1.921 { ca asp A 517 1rwhA_624Y_515}P -13.498 2.849 1.288 { ca ser A 623 1rwhA_624Y_515}P -9.41 0.027 -2.585 { ca tyr A 624 1rwhA_624Y_515}P -8.29 -0.221 -6.189 { cb tyr A 624 1rwhA_624Y_515}-9.257 -0.951 -7.14 { cg tyr A 624 1rwhA_624Y_515}-10.431 -0.143 -7.595 { cd1 tyr A 624 1rwhA_624Y_515}-10.302 0.801 -8.633 { ce1 tyr A 624 1rwhA_624Y_515}-11.391 1.567 -9.069 { cz tyr A 624 1rwhA_624Y_515}-12.623 1.389 -8.426 { oh tyr A 624 1rwhA_624Y_515}-13.696 2.118 -8.835 { cg tyr A 624 1rwhA_624Y_515}P -10.431 -0.143 -7.595 { cd2 tyr A 624 1rwhA_624Y_515}-11.665 -0.272 -7.01 { ce2 tyr A 624 1rwhA_624Y_515}-12.788 0.45 -7.439 { cz tyr A 624 1rwhA_624Y_515}ghost -12.623 1.389 -8.426 { ca ala A 625 1rwhA_624Y_515}P -6.267 1.871 -8.611 { ca tyr A 626 1rwhA_624Y_515}P -5.91 1.086 -12.318 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 624 1rwhA_624Y_515}P -9.257 -0.951 -7.14 {"}P -9.257 -0.951 -7.14 { cd1 tyr A 624 1rwhA_624Y_515}P -10.302 0.801 -8.633 { cd2 tyr A 624 1rwhA_624Y_515}P -11.665 -0.272 -7.01 { ce1 tyr A 624 1rwhA_624Y_515}P -11.391 1.567 -9.069 { ce2 tyr A 624 1rwhA_624Y_515}P -12.788 0.45 -7.439 { oh tyr A 624 1rwhA_624Y_515}P -13.696 2.118 -8.835 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 624 1rwhA_624Y_515}P -8.29 -0.221 -6.189 { cb tyr A 624 1rwhA_624Y_515}-9.257 -0.951 -7.14 { cg tyr A 624 1rwhA_624Y_515}-10.431 -0.143 -7.595 { cd1 tyr A 624 1rwhA_624Y_515}-10.302 0.801 -8.633 { ce1 tyr A 624 1rwhA_624Y_515}-11.391 1.567 -9.069 { cz tyr A 624 1rwhA_624Y_515}-12.623 1.389 -8.426 { oh tyr A 624 1rwhA_624Y_515}-13.696 2.118 -8.835 { cg tyr A 624 1rwhA_624Y_515}P -10.431 -0.143 -7.595 { cd2 tyr A 624 1rwhA_624Y_515}-11.665 -0.272 -7.01 { ce2 tyr A 624 1rwhA_624Y_515}-12.788 0.45 -7.439 { cz tyr A 624 1rwhA_624Y_515}ghost -12.623 1.389 -8.426 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 624 1rwhA_624Y_515}P -9.257 -0.951 -7.14 {"}P -9.257 -0.951 -7.14 { cd1 tyr A 624 1rwhA_624Y_515}P -10.302 0.801 -8.633 { cd2 tyr A 624 1rwhA_624Y_515}P -11.665 -0.272 -7.01 { ce1 tyr A 624 1rwhA_624Y_515}P -11.391 1.567 -9.069 { ce2 tyr A 624 1rwhA_624Y_515}P -12.788 0.45 -7.439 { oh tyr A 624 1rwhA_624Y_515}P -13.696 2.118 -8.835 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 624 A}'P' blue -10.942 1.374 -6.889 {"}'P' blue -10.875 1.267 -6.658 { CE1 TYR 624 A}'P' blue -11.261 1.717 -7.33 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 624 A}'P' green -11.285 1.424 -6.805 {"}'P' green -11.169 1.25 -6.304 {"}'P' green -11.35 1.011 -5.862 { CZ TYR 624 A}'P' green -11.675 2.053 -7.113 {"}'P' green -11.543 1.832 -7.123 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CD2 TYR 624 A}'P' P -11.6 1.414 -6.547 {"}'P' -11.603 1.331 -6.569 {"}'P' P -11.34 1.384 -6.548 {"}'P' -11.342 1.373 -6.551 {"}'P' P -11.673 1.328 -6.3 {"}'P' -11.673 1.214 -6.351 {"}'P' P -11.418 1.309 -6.301 {"}'P' -11.426 1.257 -6.324 {"}'P' P -11.858 1.192 -6.07 {"}'P' -11.845 1.099 -6.13 {"}'P' P -11.601 1.203 -6.07 {"}'P' -11.604 1.135 -6.113 {"}'P' P -11.346 1.17 -6.071 {"}'P' -11.346 1.167 -6.073 {"}'P' P -12.12 0.969 -5.864 {"}'P' -12.12 0.968 -5.865 {"}'P' P -11.868 1.032 -5.861 {"}'P' -11.864 1.008 -5.882 {"}'P' P -11.608 1.046 -5.86 {"}'P' -11.608 1.04 -5.866 { CE2 TYR 624 A}'P' P -12.796 2.05 -6.729 {"}'P' -12.796 2.017 -6.744 {"}'P' P -12.541 2.031 -6.73 {"}'P' -12.558 1.924 -6.778 {"}'P' P -12.292 1.972 -6.733 {"}'P' -12.341 1.823 -6.802 {"}'P' P -12.056 1.876 -6.737 {"}'P' -12.132 1.727 -6.81 {"}'P' P -11.837 1.744 -6.743 {"}'P' -11.918 1.634 -6.802 {"}'P' P -11.642 1.579 -6.75 {"}'P' -11.693 1.529 -6.78 {"}'P' P -12.981 1.914 -6.499 {"}'P' -12.978 1.897 -6.51 {"}'P' P -12.724 1.925 -6.499 {"}'P' -12.728 1.817 -6.568 {"}'P' P -11.787 1.548 -6.515 {"}'P' -11.887 1.438 -6.608 {"}'P' P -12.991 1.754 -6.29 {"}'P' -12.987 1.729 -6.313 {"}'P' P -12.731 1.768 -6.289 {"}'P' -12.736 1.655 -6.388 {"}'P' P -11.804 1.352 -6.307 {"}'P' -11.889 1.273 -6.406 {"}'P' P -12.981 1.568 -6.106 {"}'P' -12.979 1.556 -6.12 {"}'P' P -12.724 1.581 -6.106 {"}'P' -12.728 1.498 -6.204 {"}'P' P -12.017 1.3 -6.118 {"}'P' -12.091 1.219 -6.244 {"}'P' P -12.796 1.372 -5.951 {"}'P' -12.796 1.352 -5.984 {"}'P' P -12.541 1.34 -5.953 {"}'P' -12.556 1.285 -6.046 {"}'P' P -12.302 1.244 -5.957 {"}'P' -12.336 1.189 -6.059 {"}'P' P -12.097 1.089 -5.964 {"}'P' -12.123 1.065 -6.019 {"}'P' P -12.408 1.038 -5.835 {"}'P' -12.409 1.038 -5.836 { CZ TYR 624 A}'P' P -12.631 2.311 -6.938 {"}'P' -12.631 2.31 -6.94 {"}'P' P -12.376 2.279 -6.94 {"}'P' -12.384 2.248 -6.992 {"}'P' P -12.137 2.183 -6.944 {"}'P' -12.163 2.14 -7.024 {"}'P' P -11.932 2.028 -6.951 {"}'P' -11.968 1.994 -7.029 {"}'P' P -11.773 1.825 -6.96 {"}'P' -11.801 1.811 -7.008 {"}'P' P -12.491 2.067 -6.818 {"}'P' -12.498 2.03 -6.907 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 TYR 624 A}'P' P -12.469 1.892 -6.5 {"}'P' -12.508 1.715 -6.616 {"}'P' P -12.223 1.817 -6.503 {"}'P' -12.307 1.614 -6.642 {"}'P' P -11.993 1.701 -6.509 {"}'P' -12.104 1.527 -6.638 {"}'P' P -12.473 1.733 -6.291 {"}'P' -12.517 1.556 -6.449 {"}'P' P -12.227 1.649 -6.294 {"}'P' -12.316 1.459 -6.476 {"}'P' P -12.001 1.521 -6.3 {"}'P' -12.11 1.373 -6.458 {"}'P' P -12.47 1.54 -6.107 {"}'P' -12.507 1.412 -6.264 {"}'P' P -12.23 1.445 -6.112 {"}'P' -12.301 1.319 -6.279 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 515 A}'P' green -11.559 1.924 -7.038 {"}'P' green -11.398 1.471 -6.733 {"}'P' green -11.214 1.448 -6.512 {"}'P' green -11.246 1.233 -6.013 {"}'P' green -11.741 1.003 -5.762 {"}'P' green -11.995 0.973 -5.764 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 515 A}'P' P -12.003 2.175 -7.143 {"}'P' -12.003 2.172 -7.082 {"}'P' P -11.873 1.949 -7.123 {"}'P' -11.881 1.959 -7.052 {"}'P' P -12.133 1.949 -7.123 {"}'P' -12.119 1.967 -7.001 {"}'P' P -12.263 2.174 -7.114 {"}'P' -12.243 2.17 -7.026 {"}'P' P -11.742 1.735 -7.046 {"}'P' -11.75 1.748 -7.011 {"}'P' P -11.995 1.663 -7.049 {"}'P' -11.995 1.712 -6.935 {"}'P' P -12.249 1.727 -7.046 {"}'P' -12.217 1.779 -6.904 {"}'P' P -12.438 1.909 -7.039 {"}'P' -12.391 1.933 -6.922 {"}'P' P -12.511 2.162 -7.027 {"}'P' -12.478 2.159 -6.961 {"}'P' P -11.638 1.533 -6.915 {"}'P' -11.652 1.555 -6.881 {"}'P' P -11.876 1.446 -6.919 {"}'P' -11.893 1.534 -6.797 {"}'P' P -12.562 1.695 -6.908 {"}'P' -12.472 1.765 -6.758 {"}'P' P -12.688 1.915 -6.899 {"}'P' -12.634 1.931 -6.825 {"}'P' P -12.732 2.164 -6.888 {"}'P' -12.725 2.163 -6.878 {"}'P' P -11.615 1.328 -6.739 {"}'P' -11.636 1.371 -6.698 {"}'P' P -11.865 1.252 -6.742 {"}'P' -11.885 1.38 -6.63 {"}'P' P -12.768 1.655 -6.725 {"}'P' -12.654 1.725 -6.613 {"}'P' P -12.878 1.89 -6.714 {"}'P' -12.828 1.904 -6.672 {"}'P' P -11.404 1.279 -6.519 {"}'P' -11.43 1.316 -6.495 {"}'P' P -11.629 1.161 -6.524 {"}'P' -11.667 1.259 -6.469 {"}'P' P -11.876 1.101 -6.527 {"}'P' -11.893 1.234 -6.455 {"}'P' P -12.792 1.448 -6.512 {"}'P' -12.661 1.56 -6.423 {"}'P' P -12.936 1.657 -6.503 {"}'P' -12.85 1.7 -6.454 {"}'P' P -13.027 1.894 -6.492 {"}'P' -13.024 1.895 -6.491 {"}'P' P -11.285 1.249 -6.273 {"}'P' -11.291 1.256 -6.271 {"}'P' P -11.501 1.112 -6.279 {"}'P' -11.539 1.188 -6.256 {"}'P' P -11.741 1.026 -6.283 {"}'P' -11.77 1.148 -6.248 {"}'P' P -11.995 0.996 -6.284 {"}'P' -11.996 1.117 -6.25 {"}'P' P -12.249 1.023 -6.283 {"}'P' -12.212 1.188 -6.236 {"}'P' P -12.491 1.105 -6.279 {"}'P' -12.41 1.273 -6.229 {"}'P' P -12.708 1.239 -6.273 {"}'P' -12.605 1.368 -6.23 {"}'P' P -12.89 1.418 -6.265 {"}'P' -12.804 1.486 -6.237 {"}'P' P -13.027 1.634 -6.256 {"}'P' -13.001 1.646 -6.249 {"}'P' P -11.455 1.091 -6.019 {"}'P' -11.467 1.114 -6.018 {"}'P' P -11.69 0.998 -6.023 {"}'P' -11.709 1.066 -6.02 {"}'P' P -11.94 0.957 -6.025 {"}'P' -11.944 1.032 -6.022 {"}'P' P -12.192 0.971 -6.024 {"}'P' -12.182 1.034 -6.022 {"}'P' P -12.436 1.038 -6.021 {"}'P' -12.404 1.12 -6.018 {"}'P' P -12.66 1.157 -6.016 {"}'P' -12.616 1.221 -6.013 {"}'P' P -12.852 1.32 -6.009 {"}'P' -12.825 1.346 -6.008 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 515 A}'P' P -12.13 1.446 -6.919 {"}'P' -12.105 1.576 -6.738 {"}'P' P -12.368 1.533 -6.915 {"}'P' -12.294 1.653 -6.724 {"}'P' P -12.125 1.25 -6.742 {"}'P' -12.099 1.436 -6.579 {"}'P' P -12.375 1.321 -6.739 {"}'P' -12.286 1.513 -6.556 {"}'P' P -12.596 1.46 -6.733 {"}'P' -12.468 1.603 -6.57 {"}'P' P -12.13 1.101 -6.527 {"}'P' -12.106 1.298 -6.42 {"}'P' P -12.377 1.161 -6.524 {"}'P' -12.294 1.375 -6.402 {"}'P' P -12.602 1.279 -6.519 {"}'P' -12.475 1.459 -6.403 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 624 A}'M' greentint -9.415 2.551 -6.965 {"}'M' greentint -9.322 2.789 -6.954 {"}'M' greentint -9.184 3.005 -6.945 {"}'M' greentint -9.009 3.191 -6.937 {"}'M' greentint -9.491 2.425 -6.716 {"}'M' greentint -9.421 2.672 -6.705 {"}'M' greentint -9.306 2.902 -6.695 {"}'M' greentint -9.151 3.107 -6.686 {"}'M' greentint -8.961 3.28 -6.679 {"}'M' greentint -9.493 2.405 -6.458 {"}'M' greentint -9.424 2.653 -6.447 {"}'M' greentint -9.311 2.884 -6.437 {"}'M' greentint -9.157 3.09 -6.428 {"}'M' greentint -8.968 3.264 -6.421 {"}'M' greentint -9.461 2.274 -6.21 {"}'M' greentint -9.413 2.525 -6.199 {"}'M' greentint -9.318 2.763 -6.188 {"}'M' greentint -9.179 2.978 -6.179 {"}'M' greentint -9.003 3.163 -6.171 {"}'M' greentint -8.794 3.311 -6.164 {"}'M' greentint -9.319 2.503 -5.959 {"}'M' greentint -9.221 2.736 -5.948 {"}'M' greentint -9.077 2.945 -5.939 {"}'M' greentint -8.894 3.121 -5.932 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 515 A}'M' greentint -9.07 2.947 -7.09 {"}'M' greentint -9.206 2.726 -7.099 {"}'M' greentint -8.899 2.946 -6.882 {"}'M' greentint -9.009 2.712 -6.893 {"}'M' greentint -9.183 2.522 -6.901 {"}'M' greentint -9.405 2.39 -6.907 {"}'M' greentint -8.863 3.201 -6.871 {"}'M' greentint -8.796 2.933 -6.641 {"}'M' greentint -8.892 2.7 -6.652 {"}'M' greentint -9.046 2.5 -6.66 {"}'M' greentint -9.246 2.347 -6.667 {"}'M' greentint -9.479 2.25 -6.671 {"}'M' greentint -8.763 3.182 -6.631 {"}'M' greentint -8.758 2.93 -6.383 {"}'M' greentint -8.849 2.697 -6.393 {"}'M' greentint -8.995 2.493 -6.402 {"}'M' greentint -9.186 2.332 -6.409 {"}'M' greentint -9.412 2.223 -6.413 {"}'M' greentint -8.729 3.179 -6.372 {"}'M' greentint -8.796 2.91 -6.124 {"}'M' greentint -8.892 2.677 -6.134 {"}'M' greentint -9.046 2.477 -6.143 {"}'M' greentint -9.246 2.324 -6.15 {"}'M' greentint -8.763 3.16 -6.113 {"}'M' greentint -8.899 2.902 -5.883 {"}'M' greentint -9.009 2.669 -5.893 {"}'M' greentint -9.183 2.478 -5.902 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 624 A}'M' green -10.069 1.71 -4.939 {"}'M' green -8.946 1.916 -4.429 {"}'M' green -9.263 1.591 -4.077 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 624 A}'M' greentint -9.899 1.894 -4.931 {"}'M' greentint -9.688 2.03 -4.925 {"}'M' greentint -9.45 2.109 -4.921 {"}'M' greentint -9.2 2.127 -4.92 {"}'M' greentint -10.092 1.6 -4.684 {"}'M' greentint -9.938 1.8 -4.676 {"}'M' greentint -9.738 1.953 -4.669 {"}'M' greentint -9.505 2.05 -4.665 {"}'M' greentint -9.255 2.083 -4.663 {"}'M' greentint -9.005 2.05 -4.665 {"}'M' greentint -10.039 1.475 -4.448 {"}'M' greentint -9.895 1.69 -4.439 {"}'M' greentint -9.695 1.852 -4.432 {"}'M' greentint -9.456 1.949 -4.428 {"}'M' greentint -9.199 1.971 -4.427 {"}'M' greentint -9.856 1.47 -4.241 {"}'M' greentint -9.681 1.662 -4.233 {"}'M' greentint -9.449 1.778 -4.228 {"}'M' greentint -9.19 1.802 -4.227 {"}'M' greentint -9.512 1.52 -4.08 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 515 A}'M' green -9.343 2.148 -5.063 {"}'M' green -9.126 2.118 -4.873 {"}'M' green -8.958 2.104 -4.654 {"}'M' green -9.858 1.411 -4.189 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 515 A}'M' greentint -9.553 2 -5.069 {"}'M' greentint -9.795 1.915 -5.073 {"}'M' greentint -9.313 1.938 -4.881 {"}'M' greentint -9.537 1.807 -4.886 {"}'M' greentint -9.785 1.731 -4.89 {"}'M' greentint -10.044 1.714 -4.891 {"}'M' greentint -9.124 1.912 -4.662 {"}'M' greentint -9.324 1.757 -4.669 {"}'M' greentint -9.552 1.645 -4.674 {"}'M' greentint -9.797 1.582 -4.676 {"}'M' greentint -10.05 1.569 -4.677 {"}'M' greentint -9.007 1.886 -4.422 {"}'M' greentint -9.199 1.718 -4.429 {"}'M' greentint -9.42 1.588 -4.435 {"}'M' greentint -9.662 1.503 -4.439 {"}'M' greentint -9.915 1.465 -4.44 {"}'M' greentint -9.147 1.686 -4.177 {"}'M' greentint -9.366 1.551 -4.182 {"}'M' greentint -9.606 1.458 -4.187 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ile A 133 1sx5A_169F_135}P -8.038 5.707 -11.744 {"}-8.038 5.707 -11.744 { ca ile A 133 1sx5A_169F_135}-9.146 5.782 -10.788 { c ile A 133 1sx5A_169F_135}-8.679 5.059 -9.51 { o ile A 133 1sx5A_169F_135}-8.207 3.912 -9.598 { c ile A 133 1sx5A_169F_135}P -8.679 5.059 -9.51 { n ile A 134 1sx5A_169F_135}-8.792 5.735 -8.379 { ca ile A 134 1sx5A_169F_135}-8.546 5.124 -7.088 { c ile A 134 1sx5A_169F_135}-10 4.867 -6.68 { o ile A 134 1sx5A_169F_135}-10.773 5.823 -6.473 { c ile A 134 1sx5A_169F_135}P -10 4.867 -6.68 { n gly A 135 1sx5A_169F_135}-10.368 3.598 -6.621 { ca gly A 135 1sx5A_169F_135}-11.73 3.206 -6.242 { c gly A 135 1sx5A_169F_135}-11.79 2.67 -4.824 { o gly A 135 1sx5A_169F_135}-10.954 1.826 -4.423 { c gly A 135 1sx5A_169F_135}P -11.79 2.67 -4.824 { n tyr A 136 1sx5A_169F_135}-12.753 3.18 -4.044 { ca tyr A 136 1sx5A_169F_135}-12.956 2.752 -2.668 { c tyr A 136 1sx5A_169F_135}-14.302 2.046 -2.589 { o tyr A 136 1sx5A_169F_135}-15.264 2.543 -3.152 { c tyr A 136 1sx5A_169F_135}P -14.302 2.046 -2.589 { n val A 137 1sx5A_169F_135}-14.341 0.897 -1.932 { ca val A 137 1sx5A_169F_135}-15.628 0.206 -1.706 { c val A 137 1sx5A_169F_135}-15.728 -0.067 -0.212 { o val A 137 1sx5A_169F_135}-14.756 -0.339 0.415 { n lys A 167 1sx5A_169F_135}P -12.119 -1.475 0.973 {"}-12.119 -1.475 0.973 { ca lys A 167 1sx5A_169F_135}-11.1 -2.028 0.045 { c lys A 167 1sx5A_169F_135}-10.756 -0.891 -0.923 { o lys A 167 1sx5A_169F_135}-11.613 -0.052 -1.25 { c lys A 167 1sx5A_169F_135}P -10.756 -0.891 -0.923 { n val A 168 1sx5A_169F_135}-9.54 -0.898 -1.441 { ca val A 168 1sx5A_169F_135}-9.14 0.182 -2.352 { c val A 168 1sx5A_169F_135}-8.377 -0.408 -3.548 { o val A 168 1sx5A_169F_135}-7.693 -1.438 -3.445 { c val A 168 1sx5A_169F_135}P -8.377 -0.408 -3.548 { n phe A 169 1sx5A_169F_135}-8.582 0.192 -4.721 { ca phe A 169 1sx5A_169F_135}-7.786 -0.269 -5.886 { c phe A 169 1sx5A_169F_135}-7.346 0.97 -6.674 { o phe A 169 1sx5A_169F_135}-7.872 2.085 -6.454 { c phe A 169 1sx5A_169F_135}P -7.346 0.97 -6.674 { n leu A 170 1sx5A_169F_135}-6.396 0.744 -7.602 { ca leu A 170 1sx5A_169F_135}-5.903 1.822 -8.468 { c leu A 170 1sx5A_169F_135}-5.874 1.155 -9.817 { o leu A 170 1sx5A_169F_135}-5.144 0.17 -10.014 { c leu A 170 1sx5A_169F_135}P -5.874 1.155 -9.817 { n gln A 171 1sx5A_169F_135}-6.634 1.706 -10.751 { ca gln A 171 1sx5A_169F_135}-6.681 1.116 -12.092 { c gln A 171 1sx5A_169F_135}-6.9 2.165 -13.175 { o gln A 171 1sx5A_169F_135}-7.404 3.247 -12.879 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 133 1sx5A_169F_135}P -8.038 5.707 -11.744 { ca ile A 133 1sx5A_169F_135}P -9.146 5.782 -10.788 { n ile A 134 1sx5A_169F_135}P -8.792 5.735 -8.379 { ca ile A 134 1sx5A_169F_135}P -8.546 5.124 -7.088 { n gly A 135 1sx5A_169F_135}P -10.368 3.598 -6.621 { ca gly A 135 1sx5A_169F_135}P -11.73 3.206 -6.242 {"}P -11.73 3.206 -6.242 { n tyr A 136 1sx5A_169F_135}P -12.753 3.18 -4.044 { ca tyr A 136 1sx5A_169F_135}P -12.956 2.752 -2.668 { n val A 137 1sx5A_169F_135}P -14.341 0.897 -1.932 { ca val A 137 1sx5A_169F_135}P -15.628 0.206 -1.706 { n lys A 167 1sx5A_169F_135}P -12.119 -1.475 0.973 { ca lys A 167 1sx5A_169F_135}P -11.1 -2.028 0.045 { n val A 168 1sx5A_169F_135}P -9.54 -0.898 -1.441 { ca val A 168 1sx5A_169F_135}P -9.14 0.182 -2.352 { n phe A 169 1sx5A_169F_135}P -8.582 0.192 -4.721 { ca phe A 169 1sx5A_169F_135}P -7.786 -0.269 -5.886 { n leu A 170 1sx5A_169F_135}P -6.396 0.744 -7.602 { ca leu A 170 1sx5A_169F_135}P -5.903 1.822 -8.468 { n gln A 171 1sx5A_169F_135}P -6.634 1.706 -10.751 { ca gln A 171 1sx5A_169F_135}P -6.681 1.116 -12.092 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ile A 133 1sx5A_169F_135}P -9.146 5.782 -10.788 {"}-9.146 5.782 -10.788 { ca ile A 134 1sx5A_169F_135}-8.546 5.124 -7.088 { ca gly A 135 1sx5A_169F_135}-11.73 3.206 -6.242 { ca tyr A 136 1sx5A_169F_135}-12.956 2.752 -2.668 { ca val A 137 1sx5A_169F_135}-15.628 0.206 -1.706 { ca lys A 167 1sx5A_169F_135}P -11.1 -2.028 0.045 {"}-11.1 -2.028 0.045 { ca val A 168 1sx5A_169F_135}-9.14 0.182 -2.352 { ca phe A 169 1sx5A_169F_135}-7.786 -0.269 -5.886 { ca leu A 170 1sx5A_169F_135}-5.903 1.822 -8.468 { ca gln A 171 1sx5A_169F_135}-6.681 1.116 -12.092 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile A 133 1sx5A_169F_135}P -9.146 5.782 -10.788 { ca ile A 134 1sx5A_169F_135}P -8.546 5.124 -7.088 { ca tyr A 136 1sx5A_169F_135}P -12.956 2.752 -2.668 { ca val A 137 1sx5A_169F_135}P -15.628 0.206 -1.706 { ca lys A 167 1sx5A_169F_135}P -11.1 -2.028 0.045 { ca val A 168 1sx5A_169F_135}P -9.14 0.182 -2.352 { ca phe A 169 1sx5A_169F_135}P -7.786 -0.269 -5.886 { cb phe A 169 1sx5A_169F_135}-8.559 -1.252 -6.794 { cg phe A 169 1sx5A_169F_135}-9.792 -0.63 -7.497 { cd1 phe A 169 1sx5A_169F_135}-9.651 0.236 -8.599 { ce1 phe A 169 1sx5A_169F_135}-10.796 0.819 -9.216 { cz phe A 169 1sx5A_169F_135}-12.072 0.517 -8.734 { cg phe A 169 1sx5A_169F_135}P -9.792 -0.63 -7.497 { cd2 phe A 169 1sx5A_169F_135}-11.058 -0.937 -7.016 { ce2 phe A 169 1sx5A_169F_135}-12.227 -0.361 -7.644 { cz phe A 169 1sx5A_169F_135}ghost -12.072 0.517 -8.734 { ca leu A 170 1sx5A_169F_135}P -5.903 1.822 -8.468 { ca gln A 171 1sx5A_169F_135}P -6.681 1.116 -12.092 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 169 1sx5A_169F_135}P -8.559 -1.252 -6.794 {"}P -8.559 -1.252 -6.794 { cd1 phe A 169 1sx5A_169F_135}P -9.651 0.236 -8.599 { cd2 phe A 169 1sx5A_169F_135}P -11.058 -0.937 -7.016 { ce1 phe A 169 1sx5A_169F_135}P -10.796 0.819 -9.216 { ce2 phe A 169 1sx5A_169F_135}P -12.227 -0.361 -7.644 { cz phe A 169 1sx5A_169F_135}P -12.072 0.517 -8.734 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 169 1sx5A_169F_135}P -7.786 -0.269 -5.886 { cb phe A 169 1sx5A_169F_135}-8.559 -1.252 -6.794 { cg phe A 169 1sx5A_169F_135}-9.792 -0.63 -7.497 { cd1 phe A 169 1sx5A_169F_135}-9.651 0.236 -8.599 { ce1 phe A 169 1sx5A_169F_135}-10.796 0.819 -9.216 { cz phe A 169 1sx5A_169F_135}-12.072 0.517 -8.734 { cg phe A 169 1sx5A_169F_135}P -9.792 -0.63 -7.497 { cd2 phe A 169 1sx5A_169F_135}-11.058 -0.937 -7.016 { ce2 phe A 169 1sx5A_169F_135}-12.227 -0.361 -7.644 { cz phe A 169 1sx5A_169F_135}ghost -12.072 0.517 -8.734 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 169 1sx5A_169F_135}P -8.559 -1.252 -6.794 {"}P -8.559 -1.252 -6.794 { cd1 phe A 169 1sx5A_169F_135}P -9.651 0.236 -8.599 { cd2 phe A 169 1sx5A_169F_135}P -11.058 -0.937 -7.016 { ce1 phe A 169 1sx5A_169F_135}P -10.796 0.819 -9.216 { ce2 phe A 169 1sx5A_169F_135}P -12.227 -0.361 -7.644 { cz phe A 169 1sx5A_169F_135}P -12.072 0.517 -8.734 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 169 A}'P' sky -11.478 2.133 -8.283 {"}'P' sky -11.251 2.06 -8.07 {"}'P' blue -10.989 1.937 -7.883 {"}'P' sky -11.059 1.705 -7.73 { CE2 PHE 169 A}'P' sky -11.412 1.119 -7.19 {"}'P' sky -12.738 1.156 -6.938 {"}'P' sky -11.495 1.065 -6.942 {"}'P' sky -11.662 1.006 -6.708 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 169 A}'P' sea -11.237 1.868 -7.886 { CE2 PHE 169 A}'P' sea -12.679 1.266 -7.183 {"}'P' green -12.423 1.315 -7.181 {"}'P' green -11.65 1.226 -7.185 {"}'P' green -12.49 1.217 -6.935 {"}'P' green -12.235 1.239 -6.934 {"}'P' green -11.98 1.22 -6.935 {"}'P' sea -11.731 1.161 -6.938 {"}'P' sea -12.42 1.103 -6.704 {"}'P' sea -12.163 1.114 -6.704 {"}'P' sea -11.908 1.081 -6.705 { CZ PHE 169 A}'P' green -12.583 2.034 -8.028 {"}'P' green -11.825 2.098 -8.025 {"}'P' green -11.576 2.039 -8.028 {"}'P' green -12.754 1.831 -7.801 {"}'P' green -11.507 1.884 -7.798 {"}'P' green -12.763 1.649 -7.592 {"}'P' green -12.74 1.445 -7.409 {"}'P' green -11.514 1.512 -7.407 {"}'P' green -11.586 1.311 -7.252 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 169 A}'P' P -12.162 1.325 -7.181 {"}'P' -12.162 1.311 -7.184 { CZ PHE 169 A}'P' P -12.335 2.095 -8.025 {"}'P' -12.334 2.092 -8.026 {"}'P' P -12.08 2.117 -8.024 {"}'P' -12.08 2.099 -8.032 {"}'P' P -12.516 1.927 -7.797 {"}'P' -12.505 1.891 -7.82 {"}'P' P -12.265 1.981 -7.794 {"}'P' -12.254 1.903 -7.844 {"}'P' P -12.008 1.992 -7.794 {"}'P' -12.011 1.907 -7.848 {"}'P' P -11.753 1.959 -7.795 {"}'P' -11.765 1.906 -7.83 {"}'P' P -12.527 1.758 -7.588 {"}'P' -12.51 1.71 -7.632 {"}'P' P -12.275 1.821 -7.585 {"}'P' -12.26 1.725 -7.67 {"}'P' P -12.015 1.835 -7.584 {"}'P' -12.02 1.729 -7.677 {"}'P' P -11.757 1.8 -7.586 {"}'P' -11.775 1.727 -7.651 {"}'P' P -11.511 1.716 -7.589 {"}'P' -11.517 1.704 -7.601 {"}'P' P -12.513 1.566 -7.404 {"}'P' -12.5 1.537 -7.441 {"}'P' P -12.265 1.635 -7.401 {"}'P' -12.252 1.562 -7.488 {"}'P' P -12.008 1.648 -7.401 {"}'P' -12.012 1.568 -7.496 {"}'P' P -11.754 1.607 -7.402 {"}'P' -11.768 1.558 -7.462 {"}'P' P -12.335 1.403 -7.248 {"}'P' -12.33 1.387 -7.275 {"}'P' P -12.08 1.439 -7.246 {"}'P' -12.08 1.406 -7.299 {"}'P' P -11.825 1.407 -7.248 {"}'P' -11.829 1.392 -7.273 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 135 A}'P' blue -11.218 2.221 -7.679 {"}'P' blue -11.165 1.972 -7.468 {"}'P' sky -11.55 1.406 -6.984 {"}'P' sky -12.755 1.472 -6.981 {"}'P' sky -11.596 1.404 -6.724 {"}'P' sky -12.586 1.397 -6.724 {"}'P' sky -12.225 1.371 -6.477 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 135 A}'P' green -11.539 2.01 -7.873 {"}'P' green -12.657 2.01 -7.873 {"}'P' green -12.697 1.594 -7.484 {"}'P' green -11.596 1.427 -7.244 {"}'P' green -12.586 1.42 -7.244 {"}'P' green -11.785 1.313 -6.988 {"}'P' green -12.035 1.272 -6.99 {"}'P' green -12.287 1.286 -6.989 {"}'P' green -12.531 1.353 -6.986 {"}'P' sea -11.836 1.318 -6.727 {"}'P' green -12.09 1.288 -6.729 {"}'P' sea -12.344 1.315 -6.727 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 135 A}'P' P -11.837 2.05 -8.011 {"}'P' -11.841 2.057 -7.993 {"}'P' P -12.09 1.978 -8.014 {"}'P' -12.09 2.002 -7.959 {"}'P' P -12.344 2.042 -8.011 {"}'P' -12.34 2.049 -7.993 {"}'P' P -11.733 1.848 -7.88 {"}'P' -11.754 1.881 -7.827 {"}'P' P -11.971 1.761 -7.884 {"}'P' -11.984 1.831 -7.787 {"}'P' P -12.225 1.761 -7.884 {"}'P' -12.212 1.829 -7.789 {"}'P' P -12.463 1.848 -7.88 {"}'P' -12.444 1.878 -7.832 {"}'P' P -11.493 1.786 -7.698 {"}'P' -11.496 1.789 -7.694 {"}'P' P -11.71 1.643 -7.704 {"}'P' -11.741 1.705 -7.645 {"}'P' P -11.96 1.567 -7.707 {"}'P' -11.976 1.671 -7.616 {"}'P' P -12.22 1.565 -7.707 {"}'P' -12.206 1.668 -7.617 {"}'P' P -12.47 1.636 -7.704 {"}'P' -12.442 1.697 -7.646 {"}'P' P -12.691 1.775 -7.698 {"}'P' -12.689 1.777 -7.696 {"}'P' P -11.499 1.594 -7.484 {"}'P' -11.5 1.596 -7.483 {"}'P' P -11.724 1.476 -7.489 {"}'P' -11.747 1.534 -7.456 {"}'P' P -11.971 1.416 -7.492 {"}'P' -11.983 1.509 -7.441 {"}'P' P -12.225 1.416 -7.492 {"}'P' -12.214 1.507 -7.442 {"}'P' P -12.472 1.476 -7.489 {"}'P' -12.451 1.529 -7.459 {"}'P' P -11.836 1.341 -7.248 {"}'P' -11.84 1.357 -7.243 {"}'P' P -12.09 1.311 -7.249 {"}'P' -12.09 1.343 -7.24 {"}'P' P -12.344 1.338 -7.248 {"}'P' -12.341 1.352 -7.244 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 169 A}'M' green -8.983 2.243 -7.292 {"}'M' green -8.925 2.496 -7.281 {"}'M' green -8.81 2.728 -7.27 {"}'M' green -9.212 1.966 -6.843 {"}'M' green -8.76 3.113 -6.793 {"}'M' green -9.266 2.071 -6.325 {"}'M' green -8.908 3.012 -6.284 {"}'M' green -9.164 2.447 -6.055 {"}'M' green -9.069 2.685 -6.044 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 169 A}'M' greentint -9.119 2.239 -7.072 {"}'M' greentint -9.068 2.487 -7.061 {"}'M' greentint -8.968 2.72 -7.051 {"}'M' greentint -8.823 2.928 -7.042 {"}'M' greentint -9.213 2.221 -6.832 {"}'M' greentint -9.166 2.473 -6.821 {"}'M' greentint -9.073 2.711 -6.81 {"}'M' greentint -8.935 2.927 -6.801 {"}'M' greentint -9.266 2.091 -6.583 {"}'M' greentint -9.242 2.347 -6.572 {"}'M' greentint -9.172 2.594 -6.561 {"}'M' greentint -9.057 2.824 -6.551 {"}'M' greentint -8.902 3.029 -6.542 {"}'M' greentint -9.244 2.327 -6.314 {"}'M' greentint -9.175 2.575 -6.303 {"}'M' greentint -9.062 2.806 -6.293 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 135 A}'M' green -9.217 1.991 -6.863 {"}'M' green -8.793 3.086 -6.815 {"}'M' green -9.277 1.983 -6.604 {"}'M' green -9.237 2.323 -6.14 {"}'M' green -9.053 2.799 -6.12 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 135 A}'M' greentint -8.827 2.592 -7.095 {"}'M' greentint -8.923 2.359 -7.106 {"}'M' greentint -9.077 2.159 -7.114 {"}'M' greentint -8.794 2.841 -7.085 {"}'M' greentint -8.789 2.589 -6.837 {"}'M' greentint -8.88 2.356 -6.847 {"}'M' greentint -9.026 2.152 -6.856 {"}'M' greentint -8.76 2.838 -6.826 {"}'M' greentint -8.827 2.569 -6.578 {"}'M' greentint -8.923 2.336 -6.588 {"}'M' greentint -9.077 2.136 -6.597 {"}'M' greentint -8.827 3.068 -6.557 {"}'M' greentint -8.794 2.819 -6.567 {"}'M' greentint -8.93 2.561 -6.337 {"}'M' greentint -9.04 2.328 -6.347 {"}'M' greentint -9.214 2.137 -6.356 {"}'M' greentint -8.894 2.816 -6.326 {"}'M' greentint -9.101 2.544 -6.131 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 169 A}'M' greentint -10.197 0.944 -5.154 {"}'M' greentint -10.164 1.194 -5.143 {"}'M' greentint -10.068 1.427 -5.133 {"}'M' greentint -9.914 1.627 -5.124 {"}'M' greentint -10.222 0.8 -4.901 {"}'M' greentint -10.224 1.05 -4.89 {"}'M' greentint -10.164 1.293 -4.879 {"}'M' greentint -10.045 1.514 -4.87 {"}'M' greentint -9.875 1.698 -4.862 {"}'M' greentint -9.664 1.834 -4.856 {"}'M' greentint -10.197 0.922 -4.636 {"}'M' greentint -10.164 1.171 -4.626 {"}'M' greentint -10.068 1.404 -4.615 {"}'M' greentint -9.914 1.604 -4.607 {"}'M' greentint -9.714 1.757 -4.6 {"}'M' greentint -10.086 0.774 -4.401 {"}'M' greentint -10.089 1.032 -4.39 {"}'M' greentint -10.015 1.279 -4.379 {"}'M' greentint -9.871 1.494 -4.37 {"}'M' greentint -9.671 1.656 -4.363 {"}'M' greentint -9.926 1.032 -4.183 {"}'M' greentint -9.832 1.274 -4.172 {"}'M' greentint -9.657 1.466 -4.164 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 135 A}'M' green -9.865 1.613 -5.277 {"}'M' green -9.56 1.832 -4.552 {"}'M' green -9.704 1.309 -4.062 {"}'M' green -9.821 1.082 -4.072 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 135 A}'M' greentint -9.952 1.369 -5.287 {"}'M' greentint -10.093 1.152 -5.297 {"}'M' greentint -9.726 1.601 -5.057 {"}'M' greentint -9.802 1.359 -5.068 {"}'M' greentint -9.925 1.138 -5.078 {"}'M' greentint -10.091 0.946 -5.086 {"}'M' greentint -9.63 1.596 -4.817 {"}'M' greentint -9.701 1.35 -4.827 {"}'M' greentint -9.817 1.122 -4.837 {"}'M' greentint -9.974 0.92 -4.846 {"}'M' greentint -10.166 0.752 -4.853 {"}'M' greentint -9.607 1.851 -4.805 {"}'M' greentint -9.584 1.576 -4.563 {"}'M' greentint -9.654 1.329 -4.574 {"}'M' greentint -9.769 1.098 -4.584 {"}'M' greentint -9.924 0.893 -4.593 {"}'M' greentint -10.114 0.72 -4.601 {"}'M' greentint -9.582 1.573 -4.305 {"}'M' greentint -9.651 1.325 -4.316 {"}'M' greentint -9.764 1.094 -4.326 {"}'M' greentint -9.918 0.888 -4.335 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n met A 97 1uaiA_99F_160G}P -11.935 -1.966 0.505 {"}-11.935 -1.966 0.505 { ca met A 97 1uaiA_99F_160G}-11.064 -2.32 -0.603 { c met A 97 1uaiA_99F_160G}-10.719 -1.02 -1.303 { o met A 97 1uaiA_99F_160G}-11.605 -0.265 -1.715 { c met A 97 1uaiA_99F_160G}P -10.719 -1.02 -1.303 { n val A 98 1uaiA_99F_160G}-9.425 -0.744 -1.386 { ca val A 98 1uaiA_99F_160G}-8.928 0.43 -2.084 { c val A 98 1uaiA_99F_160G}-8.147 -0.126 -3.26 { o val A 98 1uaiA_99F_160G}-7.315 -1.022 -3.095 { c val A 98 1uaiA_99F_160G}P -8.147 -0.126 -3.26 { n phe A 99 1uaiA_99F_160G}-8.419 0.389 -4.448 { ca phe A 99 1uaiA_99F_160G}-7.715 -0.084 -5.624 { c phe A 99 1uaiA_99F_160G}-7.455 1.054 -6.592 { o phe A 99 1uaiA_99F_160G}-8.153 2.068 -6.581 { c phe A 99 1uaiA_99F_160G}P -7.455 1.054 -6.592 { n arg A 100 1uaiA_99F_160G}-6.414 0.895 -7.397 { ca arg A 100 1uaiA_99F_160G}-6.085 1.874 -8.42 { c arg A 100 1uaiA_99F_160G}-6.003 1.072 -9.698 { o arg A 100 1uaiA_99F_160G}-5.247 0.105 -9.781 { c arg A 100 1uaiA_99F_160G}P -6.003 1.072 -9.698 { n glu A 101 1uaiA_99F_160G}-6.796 1.455 -10.69 { ca glu A 101 1uaiA_99F_160G}-6.793 0.726 -11.943 { c glu A 101 1uaiA_99F_160G}-7.132 1.634 -13.102 { o glu A 101 1uaiA_99F_160G}-7.521 2.792 -12.924 { n phe A 158 1uaiA_99F_160G}P -7.44 5.609 -11.962 {"}-7.44 5.609 -11.962 { ca phe A 158 1uaiA_99F_160G}-8.281 6.238 -10.954 { c phe A 158 1uaiA_99F_160G}-8.22 5.375 -9.708 { o phe A 158 1uaiA_99F_160G}-7.806 4.211 -9.764 { c phe A 158 1uaiA_99F_160G}P -8.22 5.375 -9.708 { n glu A 159 1uaiA_99F_160G}-8.607 5.957 -8.581 { ca glu A 159 1uaiA_99F_160G}-8.611 5.233 -7.326 { c glu A 159 1uaiA_99F_160G}-10.05 5.001 -6.898 { o glu A 159 1uaiA_99F_160G}-10.82 5.947 -6.728 { c glu A 159 1uaiA_99F_160G}P -10.05 5.001 -6.898 { n gly A 160 1uaiA_99F_160G}-10.415 3.734 -6.755 { ca gly A 160 1uaiA_99F_160G}-11.756 3.404 -6.322 { c gly A 160 1uaiA_99F_160G}-11.692 2.854 -4.915 { o gly A 160 1uaiA_99F_160G}-10.663 2.324 -4.489 { c gly A 160 1uaiA_99F_160G}P -11.692 2.854 -4.915 { n lys A 161 1uaiA_99F_160G}-12.783 2.999 -4.176 { ca lys A 161 1uaiA_99F_160G}-12.826 2.474 -2.823 { c lys A 161 1uaiA_99F_160G}-14.227 2.066 -2.414 { o lys A 161 1uaiA_99F_160G}-15.199 2.769 -2.695 { c lys A 161 1uaiA_99F_160G}P -14.227 2.066 -2.414 { n phe A 162 1uaiA_99F_160G}-14.315 0.906 -1.774 { ca phe A 162 1uaiA_99F_160G}-15.568 0.395 -1.234 { c phe A 162 1uaiA_99F_160G}-15.361 0.357 0.276 { o phe A 162 1uaiA_99F_160G}-14.335 -0.14 0.745 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n met A 97 1uaiA_99F_160G}P -11.935 -1.966 0.505 { ca met A 97 1uaiA_99F_160G}P -11.064 -2.32 -0.603 { n val A 98 1uaiA_99F_160G}P -9.425 -0.744 -1.386 { ca val A 98 1uaiA_99F_160G}P -8.928 0.43 -2.084 { n phe A 99 1uaiA_99F_160G}P -8.419 0.389 -4.448 { ca phe A 99 1uaiA_99F_160G}P -7.715 -0.084 -5.624 { n arg A 100 1uaiA_99F_160G}P -6.414 0.895 -7.397 { ca arg A 100 1uaiA_99F_160G}P -6.085 1.874 -8.42 { n glu A 101 1uaiA_99F_160G}P -6.796 1.455 -10.69 { ca glu A 101 1uaiA_99F_160G}P -6.793 0.726 -11.943 { n phe A 158 1uaiA_99F_160G}P -7.44 5.609 -11.962 { ca phe A 158 1uaiA_99F_160G}P -8.281 6.238 -10.954 { n glu A 159 1uaiA_99F_160G}P -8.607 5.957 -8.581 { ca glu A 159 1uaiA_99F_160G}P -8.611 5.233 -7.326 { n gly A 160 1uaiA_99F_160G}P -10.415 3.734 -6.755 { ca gly A 160 1uaiA_99F_160G}P -11.756 3.404 -6.322 {"}P -11.756 3.404 -6.322 { n lys A 161 1uaiA_99F_160G}P -12.783 2.999 -4.176 { ca lys A 161 1uaiA_99F_160G}P -12.826 2.474 -2.823 { n phe A 162 1uaiA_99F_160G}P -14.315 0.906 -1.774 { ca phe A 162 1uaiA_99F_160G}P -15.568 0.395 -1.234 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca met A 97 1uaiA_99F_160G}P -11.064 -2.32 -0.603 {"}-11.064 -2.32 -0.603 { ca val A 98 1uaiA_99F_160G}-8.928 0.43 -2.084 { ca phe A 99 1uaiA_99F_160G}-7.715 -0.084 -5.624 { ca arg A 100 1uaiA_99F_160G}-6.085 1.874 -8.42 { ca glu A 101 1uaiA_99F_160G}-6.793 0.726 -11.943 { ca phe A 158 1uaiA_99F_160G}P -8.281 6.238 -10.954 {"}-8.281 6.238 -10.954 { ca glu A 159 1uaiA_99F_160G}-8.611 5.233 -7.326 { ca gly A 160 1uaiA_99F_160G}-11.756 3.404 -6.322 { ca lys A 161 1uaiA_99F_160G}-12.826 2.474 -2.823 { ca phe A 162 1uaiA_99F_160G}-15.568 0.395 -1.234 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca met A 97 1uaiA_99F_160G}P -11.064 -2.32 -0.603 { ca val A 98 1uaiA_99F_160G}P -8.928 0.43 -2.084 { ca phe A 99 1uaiA_99F_160G}P -7.715 -0.084 -5.624 { cb phe A 99 1uaiA_99F_160G}-8.529 -1.187 -6.319 { cg phe A 99 1uaiA_99F_160G}-9.844 -0.716 -6.883 { cd1 phe A 99 1uaiA_99F_160G}-9.928 -0.235 -8.188 { ce1 phe A 99 1uaiA_99F_160G}-11.139 0.219 -8.704 { cz phe A 99 1uaiA_99F_160G}-12.283 0.197 -7.91 { cg phe A 99 1uaiA_99F_160G}P -9.844 -0.716 -6.883 { cd2 phe A 99 1uaiA_99F_160G}-10.997 -0.734 -6.102 { ce2 phe A 99 1uaiA_99F_160G}-12.21 -0.281 -6.609 { cz phe A 99 1uaiA_99F_160G}ghost -12.283 0.197 -7.91 { ca arg A 100 1uaiA_99F_160G}P -6.085 1.874 -8.42 { ca glu A 101 1uaiA_99F_160G}P -6.793 0.726 -11.943 { ca phe A 158 1uaiA_99F_160G}P -8.281 6.238 -10.954 { ca glu A 159 1uaiA_99F_160G}P -8.611 5.233 -7.326 { ca lys A 161 1uaiA_99F_160G}P -12.826 2.474 -2.823 { ca phe A 162 1uaiA_99F_160G}P -15.568 0.395 -1.234 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 99 1uaiA_99F_160G}P -8.529 -1.187 -6.319 {"}P -8.529 -1.187 -6.319 { cd1 phe A 99 1uaiA_99F_160G}P -9.928 -0.235 -8.188 { cd2 phe A 99 1uaiA_99F_160G}P -10.997 -0.734 -6.102 { ce1 phe A 99 1uaiA_99F_160G}P -11.139 0.219 -8.704 { ce2 phe A 99 1uaiA_99F_160G}P -12.21 -0.281 -6.609 { cz phe A 99 1uaiA_99F_160G}P -12.283 0.197 -7.91 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 99 1uaiA_99F_160G}P -7.715 -0.084 -5.624 { cb phe A 99 1uaiA_99F_160G}-8.529 -1.187 -6.319 { cg phe A 99 1uaiA_99F_160G}-9.844 -0.716 -6.883 { cd1 phe A 99 1uaiA_99F_160G}-9.928 -0.235 -8.188 { ce1 phe A 99 1uaiA_99F_160G}-11.139 0.219 -8.704 { cz phe A 99 1uaiA_99F_160G}-12.283 0.197 -7.91 { cg phe A 99 1uaiA_99F_160G}P -9.844 -0.716 -6.883 { cd2 phe A 99 1uaiA_99F_160G}-10.997 -0.734 -6.102 { ce2 phe A 99 1uaiA_99F_160G}-12.21 -0.281 -6.609 { cz phe A 99 1uaiA_99F_160G}ghost -12.283 0.197 -7.91 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 99 1uaiA_99F_160G}P -8.529 -1.187 -6.319 {"}P -8.529 -1.187 -6.319 { cd1 phe A 99 1uaiA_99F_160G}P -9.928 -0.235 -8.188 { cd2 phe A 99 1uaiA_99F_160G}P -10.997 -0.734 -6.102 { ce1 phe A 99 1uaiA_99F_160G}P -11.139 0.219 -8.704 { ce2 phe A 99 1uaiA_99F_160G}P -12.21 -0.281 -6.609 { cz phe A 99 1uaiA_99F_160G}P -12.283 0.197 -7.91 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 99 A}'P' blue -11.402 1.797 -7.995 {"}'P' sky -11.332 1.683 -7.764 { CE2 PHE 99 A}'P' sky -12.848 1.348 -6.669 {"}'P' sky -11.572 1.348 -6.669 {"}'P' sky -12.606 1.411 -6.404 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 99 A}'P' sea -12.598 1.424 -6.665 {"}'P' green -12.34 1.463 -6.664 {"}'P' green -12.08 1.463 -6.664 {"}'P' sea -11.822 1.424 -6.665 {"}'P' sea -12.349 1.451 -6.402 {"}'P' sea -12.088 1.452 -6.402 { CZ PHE 99 A}'P' green -12.413 1.941 -7.965 {"}'P' green -12.153 1.941 -7.965 {"}'P' green -11.895 1.902 -7.966 {"}'P' green -11.653 1.817 -7.708 {"}'P' green -12.981 1.735 -7.453 {"}'P' green -11.551 1.623 -7.208 {"}'P' green -12.727 1.607 -6.973 {"}'P' green -11.718 1.564 -6.974 {"}'P' green -12.486 1.501 -6.761 {"}'P' green -12.226 1.515 -6.76 {"}'P' green -11.968 1.48 -6.762 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 99 A}'P' P -12.679 1.889 -7.705 {"}'P' -12.677 1.88 -7.706 {"}'P' P -12.422 1.929 -7.703 {"}'P' -12.417 1.865 -7.711 {"}'P' P -12.161 1.93 -7.703 {"}'P' -12.166 1.854 -7.712 {"}'P' P -11.903 1.893 -7.705 {"}'P' -11.912 1.852 -7.71 {"}'P' P -12.735 1.824 -7.449 {"}'P' -12.725 1.787 -7.46 {"}'P' P -12.479 1.873 -7.447 {"}'P' -12.466 1.767 -7.476 {"}'P' P -12.218 1.883 -7.447 {"}'P' -12.223 1.753 -7.483 {"}'P' P -11.958 1.853 -7.448 {"}'P' -11.978 1.753 -7.476 {"}'P' P -11.706 1.784 -7.451 {"}'P' -11.717 1.755 -7.459 {"}'P' P -12.794 1.714 -7.204 {"}'P' -12.789 1.7 -7.211 {"}'P' P -12.546 1.775 -7.201 {"}'P' -12.531 1.686 -7.241 {"}'P' P -12.291 1.797 -7.2 {"}'P' -12.291 1.67 -7.256 {"}'P' P -12.036 1.778 -7.201 {"}'P' -12.054 1.666 -7.251 {"}'P' P -11.787 1.719 -7.204 {"}'P' -11.804 1.668 -7.228 {"}'P' P -12.476 1.661 -6.97 {"}'P' -12.468 1.606 -7.005 {"}'P' P -12.219 1.672 -6.97 {"}'P' -12.222 1.597 -7.018 {"}'P' P -11.964 1.639 -6.971 {"}'P' -11.974 1.59 -7.003 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 160 A}'P' sky -12.325 1.725 -6.311 {"}'P' blue -12.575 1.796 -6.308 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 160 A}'P' green -12.076 1.985 -7.945 {"}'P' green -12.33 1.985 -7.945 {"}'P' green -11.604 1.818 -7.545 {"}'P' green -12.908 1.778 -7.299 {"}'P' green -11.655 1.63 -7.045 {"}'P' green -12.86 1.696 -7.042 {"}'P' green -11.941 1.542 -6.788 {"}'P' green -12.449 1.539 -6.788 {"}'P' sea -11.829 1.656 -6.536 {"}'P' green -12.076 1.595 -6.538 {"}'P' green -12.33 1.595 -6.538 {"}'P' sea -12.577 1.656 -6.536 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 160 A}'P' P -11.815 1.867 -7.765 {"}'P' -11.817 1.87 -7.762 {"}'P' P -12.065 1.791 -7.768 {"}'P' -12.073 1.842 -7.724 {"}'P' P -12.325 1.789 -7.768 {"}'P' -12.317 1.846 -7.719 {"}'P' P -12.575 1.86 -7.765 {"}'P' -12.567 1.879 -7.747 {"}'P' P -11.829 1.7 -7.55 {"}'P' -11.851 1.758 -7.518 {"}'P' P -12.076 1.64 -7.553 {"}'P' -12.089 1.749 -7.494 {"}'P' P -12.33 1.64 -7.553 {"}'P' -12.316 1.755 -7.491 {"}'P' P -12.577 1.7 -7.55 {"}'P' -12.549 1.773 -7.509 {"}'P' P -12.802 1.818 -7.545 {"}'P' -12.8 1.822 -7.543 {"}'P' P -11.701 1.651 -7.305 {"}'P' -11.716 1.682 -7.296 {"}'P' P -11.941 1.565 -7.309 {"}'P' -11.966 1.667 -7.28 {"}'P' P -12.195 1.535 -7.31 {"}'P' -12.196 1.67 -7.273 {"}'P' P -12.449 1.562 -7.309 {"}'P' -12.423 1.679 -7.276 {"}'P' P -12.691 1.644 -7.305 {"}'P' -12.664 1.7 -7.288 {"}'P' P -11.89 1.537 -7.049 {"}'P' -11.905 1.59 -7.047 {"}'P' P -12.14 1.496 -7.051 {"}'P' -12.145 1.589 -7.047 {"}'P' P -12.392 1.51 -7.05 {"}'P' -12.378 1.597 -7.047 {"}'P' P -12.636 1.577 -7.047 {"}'P' -12.62 1.616 -7.046 {"}'P' P -12.195 1.512 -6.79 {"}'P' -12.195 1.522 -6.791 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 99 A}'M' greentint -9.206 2.479 -7.408 {"}'M' greentint -9.091 2.711 -7.397 {"}'M' greentint -9.4 2.222 -7.199 {"}'M' greentint -9.349 2.47 -7.188 {"}'M' greentint -9.249 2.703 -7.178 {"}'M' greentint -9.104 2.911 -7.169 {"}'M' greentint -8.92 3.085 -7.161 {"}'M' greentint -9.494 2.204 -6.959 {"}'M' greentint -9.447 2.456 -6.948 {"}'M' greentint -9.354 2.694 -6.937 {"}'M' greentint -9.216 2.91 -6.928 {"}'M' greentint -9.041 3.096 -6.92 {"}'M' greentint -9.547 2.074 -6.71 {"}'M' greentint -9.523 2.33 -6.699 {"}'M' greentint -9.453 2.577 -6.688 {"}'M' greentint -9.338 2.807 -6.678 {"}'M' greentint -9.183 3.012 -6.669 {"}'M' greentint -8.993 3.185 -6.662 {"}'M' greentint -9.525 2.31 -6.441 {"}'M' greentint -9.456 2.558 -6.43 {"}'M' greentint -9.343 2.789 -6.42 {"}'M' greentint -9.189 2.995 -6.411 {"}'M' greentint -9 3.169 -6.404 {"}'M' greentint -9.445 2.43 -6.182 {"}'M' greentint -9.35 2.668 -6.171 {"}'M' greentint -9.211 2.883 -6.162 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 160 A}'M' greentint -8.991 2.723 -7.437 {"}'M' greentint -9.101 2.489 -7.448 {"}'M' greentint -8.888 2.71 -7.196 {"}'M' greentint -8.984 2.477 -7.207 {"}'M' greentint -9.138 2.277 -7.215 {"}'M' greentint -9.338 2.124 -7.222 {"}'M' greentint -8.855 2.959 -7.186 {"}'M' greentint -8.85 2.707 -6.938 {"}'M' greentint -8.941 2.474 -6.948 {"}'M' greentint -9.087 2.27 -6.957 {"}'M' greentint -9.278 2.109 -6.964 {"}'M' greentint -8.854 3.204 -6.916 {"}'M' greentint -8.821 2.956 -6.927 {"}'M' greentint -8.888 2.687 -6.679 {"}'M' greentint -8.984 2.454 -6.689 {"}'M' greentint -9.138 2.254 -6.698 {"}'M' greentint -9.338 2.101 -6.705 {"}'M' greentint -8.888 3.186 -6.658 {"}'M' greentint -8.855 2.937 -6.668 {"}'M' greentint -8.991 2.679 -6.438 {"}'M' greentint -9.101 2.446 -6.448 {"}'M' greentint -9.275 2.255 -6.457 {"}'M' greentint -9.497 2.124 -6.463 {"}'M' greentint -8.955 2.934 -6.427 {"}'M' greentint -9.162 2.662 -6.232 {"}'M' greentint -9.298 2.441 -6.241 {"}'M' greentint -9.114 2.917 -6.221 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 99 A}'M' greentint -9.879 1.496 -5.1 {"}'M' greentint -9.735 1.71 -5.091 {"}'M' greentint -9.535 1.873 -5.084 {"}'M' greentint -10.028 1.367 -4.865 {"}'M' greentint -9.932 1.6 -4.855 {"}'M' greentint -9.778 1.8 -4.846 {"}'M' greentint -9.578 1.953 -4.839 {"}'M' greentint -9.345 2.049 -4.835 {"}'M' greentint -10.088 1.223 -4.612 {"}'M' greentint -10.028 1.466 -4.601 {"}'M' greentint -9.909 1.687 -4.592 {"}'M' greentint -9.739 1.871 -4.584 {"}'M' greentint -9.528 2.007 -4.578 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1.477 -7.765 {"}'P' -12.047 1.414 -7.763 {"}'P' P -11.791 1.477 -7.765 {"}'P' -11.794 1.43 -7.763 {"}'P' P -12.317 1.425 -7.505 {"}'P' -12.304 1.368 -7.512 {"}'P' P -12.06 1.465 -7.503 {"}'P' -12.052 1.37 -7.515 {"}'P' P -11.799 1.466 -7.503 {"}'P' -11.805 1.386 -7.513 {"}'P' P -11.541 1.429 -7.505 {"}'P' -11.545 1.411 -7.507 {"}'P' P -12.373 1.36 -7.249 {"}'P' -12.367 1.337 -7.256 {"}'P' P -12.117 1.409 -7.247 {"}'P' -12.109 1.34 -7.266 {"}'P' P -11.856 1.419 -7.247 {"}'P' -11.858 1.352 -7.265 {"}'P' P -11.596 1.389 -7.248 {"}'P' -11.599 1.373 -7.252 {"}'P' P -11.929 1.333 -7 {"}'P' -11.929 1.324 -7.004 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 89 A}'P' blue -12.725 1.51 -8.371 {"}'P' sky -12.485 1.417 -8.375 {"}'P' sky -12.986 1.547 -8.11 {"}'P' sky -13.042 1.492 -7.859 {"}'P' blue -13.178 1.388 -7.622 {"}'P' sky -12.912 1.227 -7.409 { HH TYR 89 A}'P' blue -13.198 1.35 -7.556 {"}'P' blue -13.244 1.326 -7.298 {"}'P' blue -13.044 1.173 -7.305 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 89 A}'P' sea -12.732 1.501 -8.112 {"}'P' sea -12.492 1.41 -8.116 {"}'P' sea -12.789 1.456 -7.86 {"}'P' green -12.547 1.372 -7.864 {"}'P' sea -12.924 1.377 -7.622 {"}'P' green -12.678 1.315 -7.625 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 102 A}'P' sky -12.639 1.764 -8.094 {"}'P' sky -12.835 1.752 -7.873 {"}'P' sky -12.933 1.722 -7.626 {"}'P' sky -12.895 1.624 -7.37 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 102 A}'P' green -11.908 1.556 -8.103 {"}'P' green -12.168 1.554 -8.103 {"}'P' sea -12.418 1.625 -8.1 {"}'P' sea -11.447 1.583 -7.88 {"}'P' green -11.672 1.465 -7.885 {"}'P' green -12.42 1.465 -7.885 {"}'P' green -12.645 1.583 -7.88 {"}'P' sea -11.328 1.553 -7.634 {"}'P' green -12.534 1.409 -7.64 {"}'P' sea -12.751 1.543 -7.634 {"}'P' sea -12.703 1.461 -7.377 {"}'P' green -11.544 1.393 -7.12 {"}'P' green -12.534 1.386 -7.12 {"}'P' green -11.919 1.36 -6.873 {"}'P' green -12.173 1.36 -6.873 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 102 A}'P' P -11.919 1.405 -7.888 {"}'P' -11.923 1.435 -7.872 {"}'P' P -12.173 1.405 -7.888 {"}'P' -12.17 1.427 -7.876 {"}'P' P -11.544 1.416 -7.64 {"}'P' -11.549 1.426 -7.637 {"}'P' P -11.784 1.33 -7.644 {"}'P' -11.801 1.398 -7.624 {"}'P' P -12.038 1.3 -7.645 {"}'P' -12.038 1.385 -7.621 {"}'P' P -12.292 1.327 -7.644 {"}'P' -12.28 1.38 -7.629 {"}'P' P -11.498 1.395 -7.38 {"}'P' -11.499 1.397 -7.38 {"}'P' P -11.733 1.302 -7.384 {"}'P' -11.751 1.368 -7.381 {"}'P' P -11.983 1.261 -7.386 {"}'P' -11.988 1.354 -7.382 {"}'P' P -12.235 1.275 -7.385 {"}'P' -12.224 1.345 -7.382 {"}'P' P -12.479 1.342 -7.382 {"}'P' -12.476 1.349 -7.382 {"}'P' P -11.784 1.307 -7.123 {"}'P' -11.791 1.338 -7.129 {"}'P' P -12.038 1.277 -7.125 {"}'P' -12.038 1.324 -7.133 {"}'P' P -12.292 1.304 -7.123 {"}'P' -12.288 1.32 -7.126 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 89 A}'M' green -8.914 2.186 -7.405 {"}'M' green -8.799 2.418 -7.394 {"}'M' green -8.628 2.792 -7.158 {"}'M' green -9.255 1.781 -6.707 {"}'M' green -8.701 2.892 -6.659 {"}'M' green -9.058 2.375 -6.168 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 89 A}'M' greentint -9.108 1.929 -7.196 {"}'M' greentint -9.057 2.177 -7.185 {"}'M' greentint -8.957 2.41 -7.175 {"}'M' greentint -8.812 2.618 -7.166 {"}'M' greentint -9.202 1.911 -6.956 {"}'M' greentint -9.155 2.163 -6.945 {"}'M' greentint -9.062 2.401 -6.934 {"}'M' greentint -8.924 2.617 -6.925 {"}'M' greentint -8.749 2.803 -6.917 {"}'M' greentint -9.231 2.037 -6.696 {"}'M' greentint -9.161 2.284 -6.685 {"}'M' greentint -9.046 2.514 -6.675 {"}'M' greentint -8.891 2.719 -6.666 {"}'M' greentint -9.233 2.017 -6.438 {"}'M' greentint -9.164 2.265 -6.427 {"}'M' greentint -9.051 2.496 -6.417 {"}'M' greentint -8.897 2.702 -6.408 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 102 A}'M' green -8.729 2.692 -7.222 {"}'M' green -8.762 2.919 -6.694 {"}'M' green -9.172 2.174 -6.277 {"}'M' green -8.988 2.65 -6.257 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 102 A}'M' greentint -8.762 2.443 -7.232 {"}'M' greentint -8.858 2.21 -7.243 {"}'M' greentint -9.012 2.01 -7.251 {"}'M' greentint -8.724 2.44 -6.974 {"}'M' greentint -8.815 2.207 -6.984 {"}'M' greentint -8.961 2.003 -6.993 {"}'M' greentint -9.152 1.842 -7 {"}'M' greentint -8.695 2.689 -6.963 {"}'M' greentint -8.762 2.42 -6.715 {"}'M' greentint -8.858 2.187 -6.725 {"}'M' greentint -9.012 1.987 -6.734 {"}'M' greentint -9.212 1.834 -6.741 {"}'M' greentint -8.729 2.67 -6.704 {"}'M' greentint -8.865 2.412 -6.474 {"}'M' greentint -8.975 2.179 -6.484 {"}'M' greentint -9.149 1.988 -6.493 {"}'M' greentint -8.829 2.667 -6.463 {"}'M' greentint -9.036 2.395 -6.268 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 89 A}'M' sea -9.675 1.312 -5.177 {"}'M' green -9.601 1.559 -5.166 {"}'M' sea -9.457 1.773 -5.157 {"}'M' green -9.783 1.18 -4.942 {"}'M' green -9.5 1.863 -4.912 {"}'M' sea -9.3 2.016 -4.905 {"}'M' green -9.808 1.036 -4.689 {"}'M' sea -9.25 2.07 -4.644 {"}'M' green -9.783 1.158 -4.424 {"}'M' green -9.3 1.993 -4.388 {"}'M' green -9.675 1.268 -4.178 {"}'M' green -9.601 1.515 -4.167 {"}'M' green -9.457 1.73 -4.158 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 89 A}'M' greentint -9.75 1.43 -4.931 {"}'M' greentint -9.654 1.663 -4.921 {"}'M' greentint -9.81 1.286 -4.678 {"}'M' greentint -9.75 1.529 -4.667 {"}'M' greentint -9.631 1.75 -4.658 {"}'M' greentint -9.461 1.934 -4.65 {"}'M' greentint -9.75 1.407 -4.414 {"}'M' greentint -9.654 1.64 -4.403 {"}'M' greentint -9.5 1.84 -4.395 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 102 A}'M' sea -9.59 1.97 -5.146 {"}'M' green -9.666 1.728 -5.157 {"}'M' green -9.789 1.507 -5.167 {"}'M' green -9.494 1.965 -4.906 {"}'M' green -9.838 1.289 -4.935 {"}'M' green -9.448 1.945 -4.652 {"}'M' sea -9.978 1.089 -4.69 {"}'M' sea -9.424 2.201 -4.641 {"}'M' green -9.446 1.942 -4.394 {"}'M' green -9.782 1.257 -4.424 {"}'M' sea -9.971 1.083 -4.431 {"}'M' sea -9.424 2.198 -4.383 {"}'M' sea -9.496 1.924 -4.14 {"}'M' green -9.568 1.678 -4.151 {"}'M' green -9.685 1.451 -4.161 {"}'M' sea -9.843 1.25 -4.17 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 102 A}'M' greentint -9.565 1.719 -4.916 {"}'M' greentint -9.681 1.491 -4.926 {"}'M' greentint -9.518 1.698 -4.663 {"}'M' greentint -9.633 1.467 -4.673 {"}'M' greentint -9.788 1.262 -4.682 {"}'M' greentint -9.515 1.694 -4.405 {"}'M' greentint -9.628 1.463 -4.415 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 20 1v0aA_22Y_55G}P -11.904 -1.795 1.094 {"}-11.904 -1.795 1.094 { ca gly A 20 1v0aA_22Y_55G}-10.693 -2.04 0.33 { c gly A 20 1v0aA_22Y_55G}-10.517 -0.981 -0.743 { o gly A 20 1v0aA_22Y_55G}-11.472 -0.292 -1.104 { c gly A 20 1v0aA_22Y_55G}P -10.517 -0.981 -0.743 { n ser A 21 1v0aA_22Y_55G}-9.292 -0.847 -1.239 { ca ser A 21 1v0aA_22Y_55G}-8.967 0.148 -2.256 { c ser A 21 1v0aA_22Y_55G}-8.527 -0.525 -3.553 { o ser A 21 1v0aA_22Y_55G}-7.949 -1.617 -3.534 { c ser A 21 1v0aA_22Y_55G}P -8.527 -0.525 -3.553 { n tyr A 22 1v0aA_22Y_55G}-8.811 0.131 -4.675 { ca tyr A 22 1v0aA_22Y_55G}-8.385 -0.353 -5.986 { c tyr A 22 1v0aA_22Y_55G}-8.089 0.805 -6.931 { o tyr A 22 1v0aA_22Y_55G}-8.719 1.864 -6.85 { c tyr A 22 1v0aA_22Y_55G}P -8.089 0.805 -6.931 { n ser A 23 1v0aA_22Y_55G}-7.126 0.593 -7.823 { ca ser A 23 1v0aA_22Y_55G}-6.789 1.577 -8.846 { c ser A 23 1v0aA_22Y_55G}-6.108 0.925 -10.047 { o ser A 23 1v0aA_22Y_55G}-5.705 -0.241 -9.992 { c ser A 23 1v0aA_22Y_55G}P -6.108 0.925 -10.047 { n gly A 24 1v0aA_22Y_55G}-5.998 1.681 -11.134 { ca gly A 24 1v0aA_22Y_55G}-5.327 1.205 -12.327 { c gly A 24 1v0aA_22Y_55G}-5.118 2.298 -13.347 { o gly A 24 1v0aA_22Y_55G}-5.671 3.395 -13.222 { n tyr A 53 1v0aA_22Y_55G}P -8.379 4.782 -13.25 {"}-8.379 4.782 -13.25 { ca tyr A 53 1v0aA_22Y_55G}-9.542 4.571 -12.397 { c tyr A 53 1v0aA_22Y_55G}-9.103 4.34 -10.956 { o tyr A 53 1v0aA_22Y_55G}-8.027 3.794 -10.712 { c tyr A 53 1v0aA_22Y_55G}P -9.103 4.34 -10.956 { n trp A 54 1v0aA_22Y_55G}-9.936 4.768 -10.014 { ca trp A 54 1v0aA_22Y_55G}-9.706 4.503 -8.594 { c trp A 54 1v0aA_22Y_55G}-11.037 4.336 -7.871 { o trp A 54 1v0aA_22Y_55G}-12.073 4.828 -8.329 { c trp A 54 1v0aA_22Y_55G}P -11.037 4.336 -7.871 { n gly A 55 1v0aA_22Y_55G}-11 3.645 -6.738 { ca gly A 55 1v0aA_22Y_55G}-12.178 3.494 -5.91 { c gly A 55 1v0aA_22Y_55G}-11.89 2.838 -4.579 { o gly A 55 1v0aA_22Y_55G}-10.848 2.205 -4.392 { c gly A 55 1v0aA_22Y_55G}P -11.89 2.838 -4.579 { n thr A 56 1v0aA_22Y_55G}-12.818 3.014 -3.646 { ca thr A 56 1v0aA_22Y_55G}-12.81 2.261 -2.4 { c thr A 56 1v0aA_22Y_55G}-14.13 1.5 -2.291 { o thr A 56 1v0aA_22Y_55G}-15.195 2.045 -2.603 { c thr A 56 1v0aA_22Y_55G}P -14.13 1.5 -2.291 { n val A 57 1v0aA_22Y_55G}-14.049 0.239 -1.875 { ca val A 57 1v0aA_22Y_55G}-15.178 -0.683 -1.981 { c val A 57 1v0aA_22Y_55G}-15.488 -1.434 -0.685 { o val A 57 1v0aA_22Y_55G}-14.584 -1.885 0.019 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 20 1v0aA_22Y_55G}P -11.904 -1.795 1.094 { ca gly A 20 1v0aA_22Y_55G}P -10.693 -2.04 0.33 {"}P -10.693 -2.04 0.33 { n ser A 21 1v0aA_22Y_55G}P -9.292 -0.847 -1.239 { ca ser A 21 1v0aA_22Y_55G}P -8.967 0.148 -2.256 { n tyr A 22 1v0aA_22Y_55G}P -8.811 0.131 -4.675 { ca tyr A 22 1v0aA_22Y_55G}P -8.385 -0.353 -5.986 { n ser A 23 1v0aA_22Y_55G}P -7.126 0.593 -7.823 { ca ser A 23 1v0aA_22Y_55G}P -6.789 1.577 -8.846 { n gly A 24 1v0aA_22Y_55G}P -5.998 1.681 -11.134 { ca gly A 24 1v0aA_22Y_55G}P -5.327 1.205 -12.327 {"}P -5.327 1.205 -12.327 { n tyr A 53 1v0aA_22Y_55G}P -8.379 4.782 -13.25 { ca tyr A 53 1v0aA_22Y_55G}P -9.542 4.571 -12.397 { n trp A 54 1v0aA_22Y_55G}P -9.936 4.768 -10.014 { ca trp A 54 1v0aA_22Y_55G}P -9.706 4.503 -8.594 { n gly A 55 1v0aA_22Y_55G}P -11 3.645 -6.738 { ca gly A 55 1v0aA_22Y_55G}P -12.178 3.494 -5.91 {"}P -12.178 3.494 -5.91 { n thr A 56 1v0aA_22Y_55G}P -12.818 3.014 -3.646 { ca thr A 56 1v0aA_22Y_55G}P -12.81 2.261 -2.4 { n val A 57 1v0aA_22Y_55G}P -14.049 0.239 -1.875 { ca val A 57 1v0aA_22Y_55G}P -15.178 -0.683 -1.981 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 20 1v0aA_22Y_55G}P -10.693 -2.04 0.33 {"}-10.693 -2.04 0.33 { ca ser A 21 1v0aA_22Y_55G}-8.967 0.148 -2.256 { ca tyr A 22 1v0aA_22Y_55G}-8.385 -0.353 -5.986 { ca ser A 23 1v0aA_22Y_55G}-6.789 1.577 -8.846 { ca gly A 24 1v0aA_22Y_55G}-5.327 1.205 -12.327 { ca tyr A 53 1v0aA_22Y_55G}P -9.542 4.571 -12.397 {"}-9.542 4.571 -12.397 { ca trp A 54 1v0aA_22Y_55G}-9.706 4.503 -8.594 { ca gly A 55 1v0aA_22Y_55G}-12.178 3.494 -5.91 { ca thr A 56 1v0aA_22Y_55G}-12.81 2.261 -2.4 { ca val A 57 1v0aA_22Y_55G}-15.178 -0.683 -1.981 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ser A 21 1v0aA_22Y_55G}P -8.967 0.148 -2.256 { ca tyr A 22 1v0aA_22Y_55G}P -8.385 -0.353 -5.986 { cb tyr A 22 1v0aA_22Y_55G}-9.432 -1.292 -6.599 { cg tyr A 22 1v0aA_22Y_55G}-10.774 -0.646 -6.88 { cd1 tyr A 22 1v0aA_22Y_55G}-11.8 -0.688 -5.937 { ce1 tyr A 22 1v0aA_22Y_55G}-13.035 -0.093 -6.192 { cz tyr A 22 1v0aA_22Y_55G}-13.247 0.545 -7.404 { oh tyr A 22 1v0aA_22Y_55G}-14.458 1.14 -7.668 { cg tyr A 22 1v0aA_22Y_55G}P -10.774 -0.646 -6.88 { cd2 tyr A 22 1v0aA_22Y_55G}-11.018 0.001 -8.092 { ce2 tyr A 22 1v0aA_22Y_55G}-12.244 0.599 -8.355 { cz tyr A 22 1v0aA_22Y_55G}ghost -13.247 0.545 -7.404 { ca ser A 23 1v0aA_22Y_55G}P -6.789 1.577 -8.846 { ca tyr A 53 1v0aA_22Y_55G}P -9.542 4.571 -12.397 { ca trp A 54 1v0aA_22Y_55G}P -9.706 4.503 -8.594 { ca thr A 56 1v0aA_22Y_55G}P -12.81 2.261 -2.4 { ca val A 57 1v0aA_22Y_55G}P -15.178 -0.683 -1.981 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 22 1v0aA_22Y_55G}P -9.432 -1.292 -6.599 {"}P -9.432 -1.292 -6.599 { cd1 tyr A 22 1v0aA_22Y_55G}P -11.8 -0.688 -5.937 { cd2 tyr A 22 1v0aA_22Y_55G}P -11.018 0.001 -8.092 { ce1 tyr A 22 1v0aA_22Y_55G}P -13.035 -0.093 -6.192 { ce2 tyr A 22 1v0aA_22Y_55G}P -12.244 0.599 -8.355 { oh tyr A 22 1v0aA_22Y_55G}P -14.458 1.14 -7.668 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 22 1v0aA_22Y_55G}P -8.385 -0.353 -5.986 { cb tyr A 22 1v0aA_22Y_55G}-9.432 -1.292 -6.599 { cg tyr A 22 1v0aA_22Y_55G}-10.774 -0.646 -6.88 { cd1 tyr A 22 1v0aA_22Y_55G}-11.8 -0.688 -5.937 { ce1 tyr A 22 1v0aA_22Y_55G}-13.035 -0.093 -6.192 { cz tyr A 22 1v0aA_22Y_55G}-13.247 0.545 -7.404 { oh tyr A 22 1v0aA_22Y_55G}-14.458 1.14 -7.668 { cg tyr A 22 1v0aA_22Y_55G}P -10.774 -0.646 -6.88 { cd2 tyr A 22 1v0aA_22Y_55G}-11.018 0.001 -8.092 { ce2 tyr A 22 1v0aA_22Y_55G}-12.244 0.599 -8.355 { cz tyr A 22 1v0aA_22Y_55G}ghost -13.247 0.545 -7.404 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 22 1v0aA_22Y_55G}P -9.432 -1.292 -6.599 {"}P -9.432 -1.292 -6.599 { cd1 tyr A 22 1v0aA_22Y_55G}P -11.8 -0.688 -5.937 { cd2 tyr A 22 1v0aA_22Y_55G}P -11.018 0.001 -8.092 { ce1 tyr A 22 1v0aA_22Y_55G}P -13.035 -0.093 -6.192 { ce2 tyr A 22 1v0aA_22Y_55G}P -12.244 0.599 -8.355 { oh tyr A 22 1v0aA_22Y_55G}P -14.458 1.14 -7.668 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 22 A}'P' sky -13.431 1.599 -5.987 {"}'P' blue -13.231 1.583 -5.729 { CE2 TYR 22 A}'P' sky -12.507 2.177 -7.646 {"}'P' blue -12.252 2.199 -7.645 {"}'P' sky -12.18 2.074 -7.415 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 22 A}'P' sea -13.174 1.639 -5.985 {"}'P' sea -12.913 1.64 -5.985 { CZ TYR 22 A}'P' green -13.117 2.289 -7.459 {"}'P' green -12.859 2.25 -7.46 {"}'P' green -13.643 2.237 -7.199 {"}'P' green -13.758 2.062 -6.698 {"}'P' green -13.691 1.955 -6.467 {"}'P' green -12.452 1.796 -6.474 {"}'P' green -13.45 1.849 -6.255 {"}'P' green -12.686 1.744 -6.259 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 22 A}'P' P -13.386 2.277 -7.197 {"}'P' -13.382 2.228 -7.203 {"}'P' P -13.125 2.278 -7.197 {"}'P' -13.131 2.188 -7.208 {"}'P' P -12.867 2.241 -7.199 {"}'P' -12.886 2.156 -7.209 {"}'P' P -12.617 2.165 -7.202 {"}'P' -12.632 2.128 -7.207 {"}'P' P -13.699 2.172 -6.943 {"}'P' -13.699 2.17 -6.944 {"}'P' P -13.443 2.221 -6.941 {"}'P' -13.432 2.13 -6.966 {"}'P' P -13.182 2.231 -6.941 {"}'P' -13.187 2.083 -6.981 {"}'P' P -12.922 2.201 -6.942 {"}'P' -12.952 2.049 -6.984 {"}'P' P -12.67 2.132 -6.945 {"}'P' -12.708 2.029 -6.975 {"}'P' P -12.432 2.025 -6.95 {"}'P' -12.444 2.003 -6.957 {"}'P' P -13.51 2.123 -6.695 {"}'P' -13.497 2.046 -6.73 {"}'P' P -13.255 2.145 -6.694 {"}'P' -13.254 2 -6.758 {"}'P' P -13 2.126 -6.695 {"}'P' -13.026 1.963 -6.768 {"}'P' P -12.751 2.067 -6.698 {"}'P' -12.792 1.941 -6.756 {"}'P' P -12.515 1.971 -6.702 {"}'P' -12.542 1.918 -6.728 {"}'P' P -13.44 2.009 -6.464 {"}'P' -13.432 1.948 -6.503 {"}'P' P -13.183 2.02 -6.464 {"}'P' -13.187 1.911 -6.533 {"}'P' P -12.928 1.987 -6.465 {"}'P' -12.952 1.879 -6.535 {"}'P' P -12.682 1.912 -6.468 {"}'P' -12.707 1.85 -6.51 {"}'P' P -13.19 1.863 -6.254 {"}'P' -13.192 1.831 -6.283 {"}'P' P -12.932 1.828 -6.256 {"}'P' -12.94 1.797 -6.284 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 22 A}'P' sky -13.844 2.385 -7.484 {"}'P' sky -14.141 2.431 -7.228 {"}'P' blue -14.264 2.202 -6.777 {"}'P' sky -14.031 1.935 -6.598 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 22 A}'P' sea -13.899 2.347 -7.232 {"}'P' sea -14.03 2.29 -6.993 {"}'P' green -13.802 2.18 -6.998 {"}'P' sea -14.015 2.128 -6.78 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 55 A}'P' blue -12.664 2.506 -7.525 {"}'P' blue -12.366 2.466 -7.387 {"}'P' sky -13.8 2.661 -7.193 {"}'P' blue -13.949 2.665 -6.971 {"}'P' sky -13.949 2.405 -6.735 {"}'P' sky -13.928 2.292 -6.479 {"}'P' sky -13.047 1.957 -5.764 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 55 A}'P' green -13.29 2.304 -7.394 {"}'P' sea -13.69 2.426 -7.204 {"}'P' sea -13.858 2.428 -6.982 {"}'P' green -13.413 1.853 -6.238 {"}'P' sea -12.798 1.827 -5.991 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 55 A}'P' P -12.798 2.217 -7.398 {"}'P' -12.799 2.223 -7.391 {"}'P' P -13.052 2.217 -7.398 {"}'P' -13.048 2.236 -7.371 {"}'P' P -12.537 2.099 -7.218 {"}'P' -12.543 2.11 -7.208 {"}'P' P -12.787 2.023 -7.221 {"}'P' -12.798 2.095 -7.159 {"}'P' P -13.047 2.021 -7.221 {"}'P' -13.034 2.114 -7.139 {"}'P' P -13.297 2.092 -7.218 {"}'P' -13.267 2.158 -7.156 {"}'P' P -13.518 2.231 -7.212 {"}'P' -13.51 2.24 -7.202 {"}'P' P -12.551 1.932 -7.003 {"}'P' -12.575 1.993 -6.969 {"}'P' P -12.798 1.872 -7.006 {"}'P' -12.814 2 -6.936 {"}'P' P -13.052 1.872 -7.006 {"}'P' -13.033 2.025 -6.923 {"}'P' P -13.299 1.932 -7.003 {"}'P' -13.25 2.058 -6.931 {"}'P' P -13.524 2.05 -6.998 {"}'P' -13.481 2.11 -6.959 {"}'P' P -12.423 1.883 -6.758 {"}'P' -12.434 1.905 -6.751 {"}'P' P -12.663 1.797 -6.762 {"}'P' -12.689 1.903 -6.732 {"}'P' P -12.917 1.767 -6.763 {"}'P' -12.918 1.927 -6.719 {"}'P' P -13.171 1.794 -6.762 {"}'P' -13.135 1.955 -6.716 {"}'P' P -13.413 1.876 -6.758 {"}'P' -13.358 1.99 -6.724 {"}'P' P -13.63 2.01 -6.752 {"}'P' -13.599 2.049 -6.739 {"}'P' P -12.612 1.769 -6.502 {"}'P' -12.626 1.818 -6.5 {"}'P' P -12.862 1.728 -6.504 {"}'P' -12.867 1.835 -6.499 {"}'P' P -13.114 1.742 -6.503 {"}'P' -13.094 1.863 -6.498 {"}'P' P -13.358 1.809 -6.5 {"}'P' -13.322 1.898 -6.497 {"}'P' P -13.582 1.928 -6.495 {"}'P' -13.564 1.953 -6.494 {"}'P' P -12.917 1.744 -6.243 {"}'P' -12.917 1.768 -6.247 {"}'P' P -13.171 1.771 -6.241 {"}'P' -13.165 1.799 -6.247 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 22 A}'M' green -9.782 2.706 -7.197 {"}'M' green -9.607 2.892 -7.189 {"}'M' green -10.019 2.373 -6.957 {"}'M' green -9.34 3.116 -6.925 {"}'M' green -9.159 3.119 -6.412 {"}'M' green -9.917 2.204 -6.211 {"}'M' green -9.652 2.441 -5.98 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 22 A}'M' greentint -9.904 2.603 -6.947 {"}'M' greentint -9.749 2.808 -6.938 {"}'M' greentint -9.559 2.981 -6.931 {"}'M' greentint -10.022 2.354 -6.699 {"}'M' greentint -9.909 2.585 -6.689 {"}'M' greentint -9.755 2.791 -6.68 {"}'M' greentint -9.566 2.965 -6.673 {"}'M' greentint -9.348 3.101 -6.667 {"}'M' greentint -10.011 2.226 -6.451 {"}'M' greentint -9.916 2.464 -6.44 {"}'M' greentint -9.777 2.679 -6.431 {"}'M' greentint -9.601 2.864 -6.423 {"}'M' greentint -9.392 3.012 -6.416 {"}'M' greentint -9.819 2.437 -6.2 {"}'M' greentint -9.675 2.646 -6.191 {"}'M' greentint -9.492 2.822 -6.184 {"}'M' greentint -9.278 2.957 -6.178 {"}'M' greentint -9.486 2.639 -5.972 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 55 A}'M' greentint -9.523 2.968 -7.102 {"}'M' greentint -9.659 2.747 -7.111 {"}'M' greentint -9.867 2.59 -7.118 {"}'M' greentint -9.352 2.967 -6.894 {"}'M' greentint -9.462 2.733 -6.905 {"}'M' greentint -9.636 2.543 -6.913 {"}'M' greentint -9.858 2.411 -6.919 {"}'M' greentint -9.249 2.954 -6.653 {"}'M' greentint -9.345 2.721 -6.664 {"}'M' greentint -9.499 2.521 -6.672 {"}'M' greentint -9.699 2.368 -6.679 {"}'M' greentint -9.932 2.271 -6.683 {"}'M' greentint -9.211 2.951 -6.395 {"}'M' greentint -9.302 2.718 -6.405 {"}'M' greentint -9.448 2.514 -6.414 {"}'M' greentint -9.639 2.353 -6.421 {"}'M' greentint -9.865 2.244 -6.425 {"}'M' greentint -9.249 2.931 -6.136 {"}'M' greentint -9.345 2.698 -6.146 {"}'M' greentint -9.499 2.498 -6.155 {"}'M' greentint -9.699 2.345 -6.162 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 22 A}'M' greentint -10.111 1.376 -5.186 {"}'M' greentint -9.967 1.59 -5.177 {"}'M' greentint -10.26 1.247 -4.951 {"}'M' greentint -10.164 1.48 -4.941 {"}'M' greentint -10.01 1.68 -4.932 {"}'M' greentint -9.81 1.833 -4.925 {"}'M' greentint -10.32 1.103 -4.698 {"}'M' greentint -10.26 1.346 -4.687 {"}'M' greentint -10.141 1.567 -4.678 {"}'M' greentint -9.971 1.751 -4.67 {"}'M' greentint -9.76 1.887 -4.664 {"}'M' greentint -9.522 1.966 -4.66 {"}'M' greentint -10.293 0.975 -4.444 {"}'M' greentint -10.26 1.224 -4.434 {"}'M' greentint -10.164 1.457 -4.423 {"}'M' greentint -10.01 1.657 -4.415 {"}'M' greentint -9.81 1.81 -4.408 {"}'M' greentint -9.577 1.907 -4.404 {"}'M' greentint -10.185 1.085 -4.198 {"}'M' greentint -10.111 1.332 -4.187 {"}'M' greentint -9.967 1.547 -4.178 {"}'M' greentint -9.767 1.709 -4.171 {"}'M' greentint -9.528 1.806 -4.167 {"}'M' greentint -9.928 1.327 -3.98 {"}'M' greentint -9.753 1.519 -3.972 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 55 A}'M' green -9.524 1.975 -4.786 {"}'M' green -9.598 1.688 -4.031 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 55 A}'M' greentint -9.696 1.738 -5.037 {"}'M' greentint -9.819 1.517 -5.047 {"}'M' greentint -9.985 1.325 -5.055 {"}'M' greentint -10.185 1.17 -5.062 {"}'M' greentint -9.595 1.729 -4.796 {"}'M' greentint -9.711 1.501 -4.806 {"}'M' greentint -9.868 1.299 -4.815 {"}'M' greentint -10.06 1.131 -4.822 {"}'M' greentint -10.281 1.001 -4.828 {"}'M' greentint -9.478 1.955 -4.532 {"}'M' greentint -9.548 1.708 -4.543 {"}'M' greentint -9.663 1.477 -4.553 {"}'M' greentint -9.818 1.272 -4.562 {"}'M' greentint -10.008 1.099 -4.57 {"}'M' greentint -10.227 0.964 -4.575 {"}'M' greentint -9.545 1.704 -4.285 {"}'M' greentint -9.658 1.473 -4.295 {"}'M' greentint -9.812 1.267 -4.304 {"}'M' greentint -10.001 1.093 -4.311 {"}'M' greentint -10.219 0.956 -4.317 {"}'M' greentint -9.715 1.461 -4.041 {"}'M' greentint -9.873 1.26 -4.05 {"}'M' greentint -10.067 1.092 -4.057 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu A 183 1vgyA_256F_185}P -7.206 5.766 -12.172 {"}-7.206 5.766 -12.172 { ca leu A 183 1vgyA_256F_185}-8.596 5.733 -11.696 { c leu A 183 1vgyA_256F_185}-8.632 4.874 -10.436 { o leu A 183 1vgyA_256F_185}-8.127 3.74 -10.441 { c leu A 183 1vgyA_256F_185}P -8.632 4.874 -10.436 { n ser A 184 1vgyA_256F_185}-9.054 5.468 -9.335 { ca ser A 184 1vgyA_256F_185}-9.044 4.811 -8.053 { c ser A 184 1vgyA_256F_185}-10.437 4.574 -7.487 { o ser A 184 1vgyA_256F_185}-11.335 5.424 -7.624 { c ser A 184 1vgyA_256F_185}P -10.437 4.574 -7.487 { n gly A 185 1vgyA_256F_185}-10.581 3.498 -6.734 { ca gly A 185 1vgyA_256F_185}-11.871 3.182 -6.141 { c gly A 185 1vgyA_256F_185}-11.703 2.877 -4.668 { o gly A 185 1vgyA_256F_185}-10.699 2.324 -4.251 { c gly A 185 1vgyA_256F_185}P -11.703 2.877 -4.668 { n asn A 186 1vgyA_256F_185}-12.652 3.355 -3.883 { ca asn A 186 1vgyA_256F_185}-12.716 3.138 -2.43 { c asn A 186 1vgyA_256F_185}-14.037 2.405 -2.215 { o asn A 186 1vgyA_256F_185}-15.13 2.985 -2.248 { c asn A 186 1vgyA_256F_185}P -14.037 2.405 -2.215 { n leu A 187 1vgyA_256F_185}-13.948 1.09 -2.069 { ca leu A 187 1vgyA_256F_185}-15.062 0.188 -1.97 { c leu A 187 1vgyA_256F_185}-15.414 -0.217 -0.545 { o leu A 187 1vgyA_256F_185}-14.502 -0.616 0.183 { n val A 254 1vgyA_256F_185}P -12.039 -1.758 0.766 {"}-12.039 -1.758 0.766 { ca val A 254 1vgyA_256F_185}-11.027 -2.133 -0.235 { c val A 254 1vgyA_256F_185}-10.632 -0.915 -1.076 { o val A 254 1vgyA_256F_185}-11.536 -0.244 -1.613 { c val A 254 1vgyA_256F_185}P -10.632 -0.915 -1.076 { n lys A 255 1vgyA_256F_185}-9.344 -0.627 -1.178 { ca lys A 255 1vgyA_256F_185}-8.926 0.489 -2.029 { c lys A 255 1vgyA_256F_185}-8.184 -0.131 -3.233 { o lys A 255 1vgyA_256F_185}-7.323 -0.998 -2.969 { c lys A 255 1vgyA_256F_185}P -8.184 -0.131 -3.233 { n phe A 256 1vgyA_256F_185}-8.581 0.266 -4.426 { ca phe A 256 1vgyA_256F_185}-7.897 -0.265 -5.612 { c phe A 256 1vgyA_256F_185}-7.624 0.836 -6.615 { o phe A 256 1vgyA_256F_185}-8.231 1.935 -6.565 { c phe A 256 1vgyA_256F_185}P -7.624 0.836 -6.615 { n asn A 257 1vgyA_256F_185}-6.8 0.494 -7.605 { ca asn A 257 1vgyA_256F_185}-6.432 1.489 -8.626 { c asn A 257 1vgyA_256F_185}-6.162 0.853 -9.968 { o asn A 257 1vgyA_256F_185}-5.683 -0.296 -10.097 { c asn A 257 1vgyA_256F_185}P -6.162 0.853 -9.968 { n phe A 258 1vgyA_256F_185}-6.467 1.611 -10.993 { ca phe A 258 1vgyA_256F_185}-6.186 1.268 -12.354 { c phe A 258 1vgyA_256F_185}-5.169 2.27 -12.948 { o phe A 258 1vgyA_256F_185}-5.402 3.487 -12.807 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 183 1vgyA_256F_185}P -7.206 5.766 -12.172 { ca leu A 183 1vgyA_256F_185}P -8.596 5.733 -11.696 { n ser A 184 1vgyA_256F_185}P -9.054 5.468 -9.335 { ca ser A 184 1vgyA_256F_185}P -9.044 4.811 -8.053 { n gly A 185 1vgyA_256F_185}P -10.581 3.498 -6.734 { ca gly A 185 1vgyA_256F_185}P -11.871 3.182 -6.141 {"}P -11.871 3.182 -6.141 { n asn A 186 1vgyA_256F_185}P -12.652 3.355 -3.883 { ca asn A 186 1vgyA_256F_185}P -12.716 3.138 -2.43 { n leu A 187 1vgyA_256F_185}P -13.948 1.09 -2.069 { ca leu A 187 1vgyA_256F_185}P -15.062 0.188 -1.97 { n val A 254 1vgyA_256F_185}P -12.039 -1.758 0.766 { ca val A 254 1vgyA_256F_185}P -11.027 -2.133 -0.235 { n lys A 255 1vgyA_256F_185}P -9.344 -0.627 -1.178 { ca lys A 255 1vgyA_256F_185}P -8.926 0.489 -2.029 { n phe A 256 1vgyA_256F_185}P -8.581 0.266 -4.426 { ca phe A 256 1vgyA_256F_185}P -7.897 -0.265 -5.612 { n asn A 257 1vgyA_256F_185}P -6.8 0.494 -7.605 { ca asn A 257 1vgyA_256F_185}P -6.432 1.489 -8.626 { n phe A 258 1vgyA_256F_185}P -6.467 1.611 -10.993 { ca phe A 258 1vgyA_256F_185}P -6.186 1.268 -12.354 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca leu A 183 1vgyA_256F_185}P -8.596 5.733 -11.696 {"}-8.596 5.733 -11.696 { ca ser A 184 1vgyA_256F_185}-9.044 4.811 -8.053 { ca gly A 185 1vgyA_256F_185}-11.871 3.182 -6.141 { ca asn A 186 1vgyA_256F_185}-12.716 3.138 -2.43 { ca leu A 187 1vgyA_256F_185}-15.062 0.188 -1.97 { ca val A 254 1vgyA_256F_185}-11.027 -2.133 -0.235 { ca lys A 255 1vgyA_256F_185}-8.926 0.489 -2.029 { ca phe A 256 1vgyA_256F_185}-7.897 -0.265 -5.612 { ca asn A 257 1vgyA_256F_185}-6.432 1.489 -8.626 { ca phe A 258 1vgyA_256F_185}-6.186 1.268 -12.354 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca leu A 183 1vgyA_256F_185}P -8.596 5.733 -11.696 { ca ser A 184 1vgyA_256F_185}P -9.044 4.811 -8.053 { ca asn A 186 1vgyA_256F_185}P -12.716 3.138 -2.43 { ca leu A 187 1vgyA_256F_185}P -15.062 0.188 -1.97 { ca val A 254 1vgyA_256F_185}P -11.027 -2.133 -0.235 { ca lys A 255 1vgyA_256F_185}P -8.926 0.489 -2.029 { ca phe A 256 1vgyA_256F_185}P -7.897 -0.265 -5.612 { cb phe A 256 1vgyA_256F_185}-8.719 -1.42 -6.211 { cg phe A 256 1vgyA_256F_185}-10.093 -0.981 -6.7 { cd1 phe A 256 1vgyA_256F_185}-10.245 -0.37 -7.92 { ce1 phe A 256 1vgyA_256F_185}-11.469 0.028 -8.407 { cz phe A 256 1vgyA_256F_185}-12.598 -0.139 -7.59 { cg phe A 256 1vgyA_256F_185}P -10.093 -0.981 -6.7 { cd2 phe A 256 1vgyA_256F_185}-11.203 -1.093 -5.877 { ce2 phe A 256 1vgyA_256F_185}-12.455 -0.674 -6.326 { cz phe A 256 1vgyA_256F_185}ghost -12.598 -0.139 -7.59 { ca asn A 257 1vgyA_256F_185}P -6.432 1.489 -8.626 { ca phe A 258 1vgyA_256F_185}P -6.186 1.268 -12.354 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 256 1vgyA_256F_185}P -8.719 -1.42 -6.211 {"}P -8.719 -1.42 -6.211 { cd1 phe A 256 1vgyA_256F_185}P -10.245 -0.37 -7.92 { cd2 phe A 256 1vgyA_256F_185}P -11.203 -1.093 -5.877 { ce1 phe A 256 1vgyA_256F_185}P -11.469 0.028 -8.407 { ce2 phe A 256 1vgyA_256F_185}P -12.455 -0.674 -6.326 { cz phe A 256 1vgyA_256F_185}P -12.598 -0.139 -7.59 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 256 1vgyA_256F_185}P -7.897 -0.265 -5.612 { cb phe A 256 1vgyA_256F_185}-8.719 -1.42 -6.211 { cg phe A 256 1vgyA_256F_185}-10.093 -0.981 -6.7 { cd1 phe A 256 1vgyA_256F_185}-10.245 -0.37 -7.92 { ce1 phe A 256 1vgyA_256F_185}-11.469 0.028 -8.407 { cz phe A 256 1vgyA_256F_185}-12.598 -0.139 -7.59 { cg phe A 256 1vgyA_256F_185}P -10.093 -0.981 -6.7 { cd2 phe A 256 1vgyA_256F_185}-11.203 -1.093 -5.877 { ce2 phe A 256 1vgyA_256F_185}-12.455 -0.674 -6.326 { cz phe A 256 1vgyA_256F_185}ghost -12.598 -0.139 -7.59 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 256 1vgyA_256F_185}P -8.719 -1.42 -6.211 {"}P -8.719 -1.42 -6.211 { cd1 phe A 256 1vgyA_256F_185}P -10.245 -0.37 -7.92 { cd2 phe A 256 1vgyA_256F_185}P -11.203 -1.093 -5.877 { ce1 phe A 256 1vgyA_256F_185}P -11.469 0.028 -8.407 { ce2 phe A 256 1vgyA_256F_185}P -12.455 -0.674 -6.326 { cz phe A 256 1vgyA_256F_185}P -12.598 -0.139 -7.59 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 256 A}'P' sky -12.167 1.566 -7.95 {"}'P' sky -11.921 1.655 -7.946 {"}'P' sky -11.477 1.628 -7.697 {"}'P' sky -11.405 1.503 -7.467 {"}'P' sky -11.412 1.346 -7.257 {"}'P' blue -11.405 1.159 -7.074 { CE2 PHE 256 A}'P' sky -11.817 0.955 -6.386 {"}'P' sky -12.851 1.018 -6.121 {"}'P' sky -12.075 1.022 -6.121 {"}'P' blue -11.825 0.946 -6.124 {"}'P' blue -12.39 1.012 -5.863 {"}'P' blue -12.13 0.982 -5.864 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 256 A}'P' sea -11.98 1.545 -7.701 {"}'P' sea -11.732 1.606 -7.698 {"}'P' sea -11.662 1.492 -7.467 {"}'P' sea -11.672 1.332 -7.258 { CE2 PHE 256 A}'P' sea -12.067 1.031 -6.382 {"}'P' sea -12.594 1.058 -6.119 {"}'P' sea -12.333 1.059 -6.119 { CZ PHE 256 A}'P' green -12.728 1.605 -7.645 {"}'P' green -12.468 1.605 -7.645 {"}'P' green -12.21 1.566 -7.646 {"}'P' green -12.994 1.553 -7.385 {"}'P' green -13.05 1.488 -7.129 {"}'P' green -11.783 1.341 -7.136 {"}'P' green -13.109 1.378 -6.884 {"}'P' green -13.042 1.271 -6.653 {"}'P' green -11.803 1.112 -6.66 {"}'P' green -12.801 1.165 -6.441 {"}'P' green -12.541 1.179 -6.44 {"}'P' green -12.283 1.144 -6.442 {"}'P' green -12.037 1.06 -6.445 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 256 A}'P' P -12.737 1.593 -7.383 {"}'P' -12.734 1.563 -7.387 {"}'P' P -12.476 1.594 -7.383 {"}'P' -12.48 1.53 -7.391 {"}'P' P -12.218 1.557 -7.385 {"}'P' -12.23 1.504 -7.391 {"}'P' P -11.968 1.481 -7.388 {"}'P' -11.969 1.48 -7.388 {"}'P' P -12.794 1.537 -7.127 {"}'P' -12.786 1.47 -7.146 {"}'P' P -12.533 1.547 -7.127 {"}'P' -12.537 1.431 -7.158 {"}'P' P -12.273 1.517 -7.128 {"}'P' -12.295 1.405 -7.159 {"}'P' P -12.021 1.448 -7.131 {"}'P' -12.043 1.388 -7.148 {"}'P' P -12.861 1.439 -6.881 {"}'P' -12.852 1.388 -6.904 {"}'P' P -12.606 1.461 -6.88 {"}'P' -12.606 1.352 -6.928 {"}'P' P -12.351 1.442 -6.881 {"}'P' -12.37 1.323 -6.934 {"}'P' P -12.102 1.383 -6.884 {"}'P' -12.128 1.304 -6.92 {"}'P' P -11.866 1.287 -6.888 {"}'P' -11.87 1.279 -6.892 {"}'P' P -12.791 1.325 -6.65 {"}'P' -12.787 1.295 -6.669 {"}'P' P -12.534 1.336 -6.65 {"}'P' -12.537 1.267 -6.694 {"}'P' P -12.279 1.303 -6.651 {"}'P' -12.293 1.24 -6.692 {"}'P' P -12.033 1.228 -6.654 {"}'P' -12.04 1.211 -6.666 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 185 A}'P' blue -12.059 1.93 -7.727 {"}'P' sky -11.761 1.89 -7.589 {"}'P' sky -11.546 1.864 -7.405 {"}'P' sky -11.531 1.643 -7.193 {"}'P' sky -11.946 1.312 -6.191 {"}'P' sky -12.694 1.312 -6.191 {"}'P' blue -12.182 1.384 -5.966 {"}'P' sky -12.442 1.381 -5.966 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 185 A}'P' sea -11.955 1.728 -7.596 {"}'P' green -12.193 1.641 -7.6 {"}'P' green -12.447 1.641 -7.6 {"}'P' sea -11.715 1.666 -7.414 {"}'P' green -11.932 1.523 -7.42 {"}'P' green -12.913 1.655 -7.414 {"}'P' green -11.818 1.307 -6.96 {"}'P' green -12.977 1.352 -6.697 {"}'P' green -12.058 1.198 -6.443 {"}'P' green -12.312 1.168 -6.445 {"}'P' green -12.566 1.195 -6.443 {"}'P' green -12.808 1.277 -6.44 {"}'P' sea -12.193 1.251 -6.193 {"}'P' sea -12.447 1.251 -6.193 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 185 A}'P' P -12.182 1.447 -7.423 {"}'P' -12.188 1.485 -7.39 {"}'P' P -12.442 1.445 -7.423 {"}'P' -12.434 1.501 -7.374 {"}'P' P -12.692 1.516 -7.42 {"}'P' -12.679 1.545 -7.393 {"}'P' P -11.946 1.356 -7.205 {"}'P' -11.958 1.387 -7.188 {"}'P' P -12.193 1.296 -7.208 {"}'P' -12.204 1.388 -7.158 {"}'P' P -12.447 1.296 -7.208 {"}'P' -12.433 1.408 -7.147 {"}'P' P -12.694 1.356 -7.205 {"}'P' -12.661 1.44 -7.157 {"}'P' P -12.919 1.474 -7.2 {"}'P' -12.904 1.496 -7.186 {"}'P' P -12.058 1.221 -6.964 {"}'P' -12.076 1.295 -6.943 {"}'P' P -12.312 1.191 -6.965 {"}'P' -12.313 1.313 -6.931 {"}'P' P -12.566 1.218 -6.964 {"}'P' -12.539 1.338 -6.93 {"}'P' P -12.808 1.3 -6.96 {"}'P' -12.773 1.372 -6.939 {"}'P' P -13.025 1.434 -6.954 {"}'P' -13.025 1.434 -6.954 {"}'P' P -12.007 1.193 -6.704 {"}'P' -12.013 1.214 -6.703 {"}'P' P -12.257 1.152 -6.706 {"}'P' -12.261 1.226 -6.703 {"}'P' P -12.509 1.166 -6.705 {"}'P' -12.495 1.25 -6.702 {"}'P' P -12.753 1.233 -6.702 {"}'P' -12.733 1.283 -6.7 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 256 A}'M' greentint -9.427 2.337 -7.172 {"}'M' greentint -9.327 2.57 -7.162 {"}'M' greentint -9.182 2.778 -7.153 {"}'M' greentint -9.572 2.071 -6.943 {"}'M' greentint -9.525 2.323 -6.932 {"}'M' greentint -9.432 2.561 -6.921 {"}'M' greentint -9.294 2.777 -6.912 {"}'M' greentint -9.119 2.963 -6.904 {"}'M' greentint -9.625 1.941 -6.694 {"}'M' greentint -9.601 2.197 -6.683 {"}'M' greentint -9.531 2.444 -6.672 {"}'M' greentint -9.416 2.674 -6.662 {"}'M' greentint -9.261 2.879 -6.653 {"}'M' greentint -9.071 3.052 -6.646 {"}'M' greentint -9.625 1.921 -6.436 {"}'M' greentint -9.603 2.177 -6.425 {"}'M' greentint -9.534 2.425 -6.414 {"}'M' greentint -9.421 2.656 -6.404 {"}'M' greentint -9.267 2.862 -6.395 {"}'M' greentint -9.078 3.036 -6.388 {"}'M' greentint -9.571 2.046 -6.177 {"}'M' greentint -9.523 2.297 -6.166 {"}'M' greentint -9.428 2.535 -6.155 {"}'M' greentint -9.289 2.75 -6.146 {"}'M' greentint -9.113 2.935 -6.138 {"}'M' greentint -9.429 2.275 -5.926 {"}'M' greentint -9.331 2.508 -5.915 {"}'M' greentint -9.187 2.717 -5.906 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 185 A}'M' greentint -9.191 2.625 -7.243 {"}'M' greentint -9.327 2.404 -7.252 {"}'M' greentint -9.02 2.624 -7.035 {"}'M' greentint -9.13 2.39 -7.046 {"}'M' greentint -9.304 2.2 -7.054 {"}'M' greentint -9.526 2.068 -7.06 {"}'M' greentint -8.984 2.879 -7.024 {"}'M' greentint -8.917 2.611 -6.794 {"}'M' greentint -9.013 2.378 -6.805 {"}'M' greentint -9.167 2.178 -6.813 {"}'M' greentint -9.367 2.025 -6.82 {"}'M' greentint -9.6 1.928 -6.824 {"}'M' greentint -8.917 3.11 -6.773 {"}'M' greentint -8.884 2.86 -6.784 {"}'M' greentint -8.879 2.608 -6.536 {"}'M' greentint -8.97 2.375 -6.546 {"}'M' greentint -9.116 2.171 -6.555 {"}'M' greentint -9.307 2.01 -6.562 {"}'M' greentint -9.533 1.901 -6.566 {"}'M' greentint -8.883 3.105 -6.514 {"}'M' greentint -8.85 2.857 -6.525 {"}'M' greentint -8.917 2.588 -6.277 {"}'M' greentint -9.013 2.355 -6.287 {"}'M' greentint -9.167 2.155 -6.296 {"}'M' greentint -9.367 2.002 -6.303 {"}'M' greentint -9.6 1.906 -6.307 {"}'M' greentint -8.917 3.087 -6.256 {"}'M' greentint -8.884 2.838 -6.266 {"}'M' greentint -9.02 2.58 -6.036 {"}'M' greentint -9.13 2.347 -6.046 {"}'M' greentint -9.304 2.156 -6.055 {"}'M' greentint -9.526 2.025 -6.061 {"}'M' greentint -8.984 2.835 -6.025 {"}'M' greentint -9.191 2.563 -5.83 {"}'M' greentint -9.327 2.342 -5.839 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 256 A}'M' greentint -9.964 1.515 -5.079 {"}'M' greentint -10.257 1.172 -4.853 {"}'M' greentint -10.161 1.405 -4.843 {"}'M' greentint -10.007 1.605 -4.834 {"}'M' greentint -9.807 1.758 -4.827 {"}'M' greentint -9.574 1.854 -4.823 {"}'M' greentint -10.317 1.028 -4.6 {"}'M' greentint -10.257 1.271 -4.589 {"}'M' greentint -10.138 1.492 -4.58 {"}'M' greentint -9.968 1.676 -4.572 {"}'M' greentint -9.757 1.812 -4.566 {"}'M' greentint -9.519 1.891 -4.562 {"}'M' greentint -10.257 1.149 -4.336 {"}'M' greentint -10.161 1.382 -4.325 {"}'M' greentint -10.007 1.582 -4.317 {"}'M' greentint -9.807 1.735 -4.31 {"}'M' greentint -9.574 1.832 -4.306 {"}'M' greentint -10.108 1.257 -4.089 {"}'M' greentint -9.964 1.472 -4.08 {"}'M' greentint -9.764 1.634 -4.073 {"}'M' greentint -9.525 1.731 -4.069 {"}'M' greentint -9.925 1.252 -3.882 {"}'M' greentint -9.75 1.444 -3.874 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 185 A}'M' green -9.547 1.857 -4.896 {"}'M' green -10.264 1.177 -4.926 {"}'M' green -10.318 0.99 -4.439 {"}'M' green -9.396 1.823 -4.144 {"}'M' green -9.566 1.58 -3.9 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 185 A}'M' greentint -9.67 1.636 -4.906 {"}'M' greentint -9.836 1.444 -4.914 {"}'M' greentint -10.036 1.289 -4.921 {"}'M' greentint -9.446 1.848 -4.655 {"}'M' greentint -9.562 1.62 -4.665 {"}'M' greentint -9.719 1.418 -4.674 {"}'M' greentint -9.911 1.25 -4.681 {"}'M' greentint -10.132 1.12 -4.687 {"}'M' greentint -9.399 1.827 -4.402 {"}'M' greentint -9.514 1.596 -4.412 {"}'M' greentint -9.669 1.391 -4.421 {"}'M' greentint -9.859 1.218 -4.429 {"}'M' greentint -10.078 1.083 -4.434 {"}'M' greentint -9.509 1.592 -4.154 {"}'M' greentint -9.663 1.386 -4.163 {"}'M' greentint -9.852 1.212 -4.17 {"}'M' greentint -10.07 1.075 -4.176 {"}'M' greentint -9.724 1.379 -3.909 {"}'M' greentint -9.918 1.211 -3.916 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ser A 156 1vzyA_175F_158}P -7.992 5.463 -12.401 {"}-7.992 5.463 -12.401 { ca ser A 156 1vzyA_175F_158}-9.16 5.368 -11.593 { c ser A 156 1vzyA_175F_158}-8.768 4.812 -10.229 { o ser A 156 1vzyA_175F_158}-8.155 3.743 -10.143 { c ser A 156 1vzyA_175F_158}P -8.768 4.812 -10.229 { n val A 157 1vzyA_175F_158}-9.155 5.53 -9.167 { ca val A 157 1vzyA_175F_158}-8.945 5.135 -7.777 { c val A 157 1vzyA_175F_158}-10.312 4.812 -7.198 { o val A 157 1vzyA_175F_158}-11.18 5.654 -7.263 { c val A 157 1vzyA_175F_158}P -10.312 4.812 -7.198 { n gly A 158 1vzyA_175F_158}-10.549 3.586 -6.708 { ca gly A 158 1vzyA_175F_158}-11.759 3.368 -5.953 { c gly A 158 1vzyA_175F_158}-11.371 3.024 -4.524 { o gly A 158 1vzyA_175F_158}-10.479 2.153 -4.286 { c gly A 158 1vzyA_175F_158}P -11.371 3.024 -4.524 { n val A 159 1vzyA_175F_158}-12.086 3.577 -3.583 { ca val A 159 1vzyA_175F_158}-11.846 3.282 -2.179 { c val A 159 1vzyA_175F_158}-13.229 3.265 -1.456 { o val A 159 1vzyA_175F_158}-14.045 4.163 -1.641 { c val A 159 1vzyA_175F_158}P -13.229 3.265 -1.456 { n gly A 160 1vzyA_175F_158}-13.397 2.309 -0.567 { ca gly A 160 1vzyA_175F_158}-14.6 2.222 0.238 { c gly A 160 1vzyA_175F_158}-14.395 1.758 1.627 { o gly A 160 1vzyA_175F_158}-13.464 0.999 1.937 { n gly A 173 1vzyA_175F_158}P -11.562 -1.395 1.573 {"}-11.562 -1.395 1.573 { ca gly A 173 1vzyA_175F_158}-10.659 -1.799 0.527 { c gly A 173 1vzyA_175F_158}-10.577 -0.783 -0.562 { o gly A 173 1vzyA_175F_158}-11.243 0.268 -0.518 { c gly A 173 1vzyA_175F_158}P -10.577 -0.783 -0.562 { n gly A 174 1vzyA_175F_158}-9.785 -1.096 -1.565 { ca gly A 174 1vzyA_175F_158}-9.643 -0.213 -2.699 { c gly A 174 1vzyA_175F_158}-8.879 -0.772 -3.873 { o gly A 174 1vzyA_175F_158}-8.301 -1.905 -3.849 { c gly A 174 1vzyA_175F_158}P -8.879 -0.772 -3.873 { n phe A 175 1vzyA_175F_158}-8.869 0.006 -4.925 { ca phe A 175 1vzyA_175F_158}-8.056 -0.293 -6.071 { c phe A 175 1vzyA_175F_158}-7.596 0.979 -6.742 { o phe A 175 1vzyA_175F_158}-8.153 2.069 -6.521 { c phe A 175 1vzyA_175F_158}P -7.596 0.979 -6.742 { n ile A 176 1vzyA_175F_158}-6.526 0.813 -7.541 { ca ile A 176 1vzyA_175F_158}-6.085 1.78 -8.535 { c ile A 176 1vzyA_175F_158}-5.797 1.088 -9.832 { o ile A 176 1vzyA_175F_158}-5.065 0.075 -9.888 { c ile A 176 1vzyA_175F_158}P -5.797 1.088 -9.832 { n ile A 177 1vzyA_175F_158}-6.39 1.624 -10.883 { ca ile A 177 1vzyA_175F_158}-6.138 1.187 -12.264 { c ile A 177 1vzyA_175F_158}-5.594 2.346 -13.124 { o ile A 177 1vzyA_175F_158}-6.13 3.449 -13.093 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 156 1vzyA_175F_158}P -7.992 5.463 -12.401 { ca ser A 156 1vzyA_175F_158}P -9.16 5.368 -11.593 { n val A 157 1vzyA_175F_158}P -9.155 5.53 -9.167 { ca val A 157 1vzyA_175F_158}P -8.945 5.135 -7.777 { n gly A 158 1vzyA_175F_158}P -10.549 3.586 -6.708 { ca gly A 158 1vzyA_175F_158}P -11.759 3.368 -5.953 {"}P -11.759 3.368 -5.953 { n val A 159 1vzyA_175F_158}P -12.086 3.577 -3.583 { ca val A 159 1vzyA_175F_158}P -11.846 3.282 -2.179 { n gly A 160 1vzyA_175F_158}P -13.397 2.309 -0.567 { ca gly A 160 1vzyA_175F_158}P -14.6 2.222 0.238 {"}P -14.6 2.222 0.238 { n gly A 173 1vzyA_175F_158}P -11.562 -1.395 1.573 { ca gly A 173 1vzyA_175F_158}P -10.659 -1.799 0.527 {"}P -10.659 -1.799 0.527 { n gly A 174 1vzyA_175F_158}P -9.785 -1.096 -1.565 { ca gly A 174 1vzyA_175F_158}P -9.643 -0.213 -2.699 {"}P -9.643 -0.213 -2.699 { n phe A 175 1vzyA_175F_158}P -8.869 0.006 -4.925 { ca phe A 175 1vzyA_175F_158}P -8.056 -0.293 -6.071 { n ile A 176 1vzyA_175F_158}P -6.526 0.813 -7.541 { ca ile A 176 1vzyA_175F_158}P -6.085 1.78 -8.535 { n ile A 177 1vzyA_175F_158}P -6.39 1.624 -10.883 { ca ile A 177 1vzyA_175F_158}P -6.138 1.187 -12.264 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ser A 156 1vzyA_175F_158}P -9.16 5.368 -11.593 {"}-9.16 5.368 -11.593 { ca val A 157 1vzyA_175F_158}-8.945 5.135 -7.777 { ca gly A 158 1vzyA_175F_158}-11.759 3.368 -5.953 { ca val A 159 1vzyA_175F_158}-11.846 3.282 -2.179 { ca gly A 160 1vzyA_175F_158}-14.6 2.222 0.238 { ca gly A 173 1vzyA_175F_158}P -10.659 -1.799 0.527 {"}-10.659 -1.799 0.527 { ca gly A 174 1vzyA_175F_158}-9.643 -0.213 -2.699 { ca phe A 175 1vzyA_175F_158}-8.056 -0.293 -6.071 { ca ile A 176 1vzyA_175F_158}-6.085 1.78 -8.535 { ca ile A 177 1vzyA_175F_158}-6.138 1.187 -12.264 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ser A 156 1vzyA_175F_158}P -9.16 5.368 -11.593 { ca val A 157 1vzyA_175F_158}P -8.945 5.135 -7.777 { ca val A 159 1vzyA_175F_158}P -11.846 3.282 -2.179 { ca phe A 175 1vzyA_175F_158}P -8.056 -0.293 -6.071 { cb phe A 175 1vzyA_175F_158}-8.798 -1.179 -7.085 { cg phe A 175 1vzyA_175F_158}-9.993 -0.512 -7.715 { cd1 phe A 175 1vzyA_175F_158}-9.831 0.36 -8.789 { ce1 phe A 175 1vzyA_175F_158}-11.016 1.042 -9.389 { cz phe A 175 1vzyA_175F_158}-12.283 0.804 -8.839 { cg phe A 175 1vzyA_175F_158}P -9.993 -0.512 -7.715 { cd2 phe A 175 1vzyA_175F_158}-11.272 -0.739 -7.23 { ce2 phe A 175 1vzyA_175F_158}-12.419 -0.064 -7.798 { cz phe A 175 1vzyA_175F_158}ghost -12.283 0.804 -8.839 { ca ile A 176 1vzyA_175F_158}P -6.085 1.78 -8.535 { ca ile A 177 1vzyA_175F_158}P -6.138 1.187 -12.264 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 175 1vzyA_175F_158}P -8.798 -1.179 -7.085 {"}P -8.798 -1.179 -7.085 { cd1 phe A 175 1vzyA_175F_158}P -9.831 0.36 -8.789 { cd2 phe A 175 1vzyA_175F_158}P -11.272 -0.739 -7.23 { ce1 phe A 175 1vzyA_175F_158}P -11.016 1.042 -9.389 { ce2 phe A 175 1vzyA_175F_158}P -12.419 -0.064 -7.798 { cz phe A 175 1vzyA_175F_158}P -12.283 0.804 -8.839 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 175 1vzyA_175F_158}P -8.056 -0.293 -6.071 { cb phe A 175 1vzyA_175F_158}-8.798 -1.179 -7.085 { cg phe A 175 1vzyA_175F_158}-9.993 -0.512 -7.715 { cd1 phe A 175 1vzyA_175F_158}-9.831 0.36 -8.789 { ce1 phe A 175 1vzyA_175F_158}-11.016 1.042 -9.389 { cz phe A 175 1vzyA_175F_158}-12.283 0.804 -8.839 { cg phe A 175 1vzyA_175F_158}P -9.993 -0.512 -7.715 { cd2 phe A 175 1vzyA_175F_158}-11.272 -0.739 -7.23 { ce2 phe A 175 1vzyA_175F_158}-12.419 -0.064 -7.798 { cz phe A 175 1vzyA_175F_158}ghost -12.283 0.804 -8.839 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 175 1vzyA_175F_158}P -8.798 -1.179 -7.085 {"}P -8.798 -1.179 -7.085 { cd1 phe A 175 1vzyA_175F_158}P -9.831 0.36 -8.789 { cd2 phe A 175 1vzyA_175F_158}P -11.272 -0.739 -7.23 { ce1 phe A 175 1vzyA_175F_158}P -11.016 1.042 -9.389 { ce2 phe A 175 1vzyA_175F_158}P -12.419 -0.064 -7.798 { cz phe A 175 1vzyA_175F_158}P -12.283 0.804 -8.839 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 175 A}'P' sky -12.871 1.563 -7.337 {"}'P' sky -12.93 1.453 -7.092 {"}'P' blue -11.687 1.362 -7.096 {"}'P' sky -12.874 1.177 -6.652 {"}'P' sky -11.858 1.135 -6.653 {"}'P' blue -12.612 1.054 -6.465 {"}'P' sky -12.355 1.067 -6.465 {"}'P' blue -12.101 1.026 -6.466 { CZ PHE 175 A}'P' blue -12.476 2.268 -7.899 {"}'P' blue -12.219 2.279 -7.899 {"}'P' sky -12.738 2.045 -7.693 {"}'P' sky -11.968 2.087 -7.691 {"}'P' blue -11.722 2.003 -7.694 {"}'P' sky -12.951 1.732 -7.514 {"}'P' sky -11.725 1.799 -7.512 {"}'P' sky -11.797 1.598 -7.357 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 175 A}'P' green -12.682 1.514 -7.089 {"}'P' green -12.427 1.536 -7.088 {"}'P' green -12.172 1.517 -7.089 {"}'P' sea -11.923 1.458 -7.092 {"}'P' sea -12.863 1.346 -6.861 {"}'P' green -12.612 1.4 -6.858 {"}'P' green -12.355 1.411 -6.858 {"}'P' green -12.1 1.378 -6.859 {"}'P' sea -11.854 1.303 -6.862 {"}'P' sea -12.622 1.24 -6.649 {"}'P' sea -12.362 1.254 -6.648 {"}'P' sea -12.104 1.219 -6.65 { CZ PHE 175 A}'P' sea -12.486 2.108 -7.69 {"}'P' sea -12.226 2.122 -7.689 {"}'P' sea -12.724 1.853 -7.509 {"}'P' green -12.476 1.922 -7.506 {"}'P' green -12.219 1.935 -7.506 {"}'P' sea -11.965 1.894 -7.507 {"}'P' green -12.546 1.69 -7.353 {"}'P' green -12.291 1.726 -7.351 {"}'P' green -12.036 1.694 -7.353 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 158 A}'P' sky -12.217 2.376 -7.548 {"}'P' sky -12.477 2.376 -7.548 {"}'P' blue -11.903 2.351 -7.463 {"}'P' blue -12.782 2.336 -7.464 {"}'P' sky -11.788 2.122 -7.333 {"}'P' sky -12.906 2.122 -7.333 {"}'P' sky -11.742 1.898 -7.158 {"}'P' blue -12.94 1.887 -7.158 {"}'P' sky -11.748 1.706 -6.944 {"}'P' sky -12.946 1.706 -6.944 {"}'P' sky -11.845 1.539 -6.704 {"}'P' sky -12.034 1.425 -6.448 {"}'P' sky -12.78 1.465 -6.446 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 158 A}'P' sea -12.086 2.162 -7.471 {"}'P' green -12.339 2.09 -7.474 {"}'P' sea -12.593 2.154 -7.471 {"}'P' sea -11.982 1.96 -7.34 {"}'P' green -12.22 1.873 -7.344 {"}'P' green -12.474 1.873 -7.344 {"}'P' sea -12.712 1.96 -7.34 {"}'P' sea -11.959 1.755 -7.164 {"}'P' green -12.209 1.679 -7.167 {"}'P' green -12.469 1.677 -7.167 {"}'P' sea -12.719 1.748 -7.164 {"}'P' sea -11.973 1.588 -6.949 {"}'P' green -12.22 1.528 -6.952 {"}'P' green -12.474 1.528 -6.952 {"}'P' green -12.721 1.588 -6.949 {"}'P' green -12.085 1.453 -6.708 {"}'P' green -12.339 1.423 -6.709 {"}'P' green -12.593 1.45 -6.708 {"}'P' sea -12.835 1.532 -6.704 {"}'P' sea -12.284 1.384 -6.45 {"}'P' sea -12.536 1.398 -6.449 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 175 A}'M' greentint -9.206 2.48 -7.348 {"}'M' greentint -9.4 2.223 -7.139 {"}'M' greentint -9.349 2.471 -7.128 {"}'M' greentint -9.249 2.704 -7.118 {"}'M' greentint -9.104 2.912 -7.109 {"}'M' greentint -9.493 1.95 -6.91 {"}'M' greentint -9.494 2.205 -6.899 {"}'M' greentint -9.447 2.457 -6.888 {"}'M' greentint -9.354 2.695 -6.877 {"}'M' greentint -9.216 2.911 -6.868 {"}'M' greentint -9.041 3.097 -6.86 {"}'M' greentint -9.547 2.075 -6.65 {"}'M' greentint -9.523 2.331 -6.639 {"}'M' greentint -9.453 2.578 -6.628 {"}'M' greentint -9.338 2.808 -6.618 {"}'M' greentint -9.183 3.013 -6.609 {"}'M' greentint -9.547 2.055 -6.392 {"}'M' greentint -9.525 2.311 -6.381 {"}'M' greentint -9.456 2.559 -6.37 {"}'M' greentint -9.343 2.79 -6.36 {"}'M' greentint -9.189 2.996 -6.351 {"}'M' greentint -9.445 2.431 -6.122 {"}'M' greentint -9.35 2.669 -6.111 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 158 A}'M' greentint -9.124 2.566 -7.329 {"}'M' greentint -9.234 2.332 -7.34 {"}'M' greentint -9.021 2.553 -7.088 {"}'M' greentint -9.117 2.32 -7.099 {"}'M' greentint -9.271 2.12 -7.107 {"}'M' greentint -8.988 2.802 -7.078 {"}'M' greentint -8.983 2.55 -6.83 {"}'M' greentint -9.074 2.317 -6.84 {"}'M' greentint -9.22 2.113 -6.849 {"}'M' greentint -9.411 1.952 -6.856 {"}'M' greentint -8.987 3.047 -6.808 {"}'M' greentint -8.954 2.799 -6.819 {"}'M' greentint -9.021 2.53 -6.571 {"}'M' greentint -9.117 2.297 -6.581 {"}'M' greentint -9.271 2.097 -6.59 {"}'M' greentint -9.471 1.944 -6.597 {"}'M' greentint -9.021 3.029 -6.55 {"}'M' greentint -8.988 2.78 -6.56 {"}'M' greentint -9.124 2.522 -6.33 {"}'M' greentint -9.234 2.289 -6.34 {"}'M' greentint -9.408 2.098 -6.349 {"}'M' greentint -9.129 3.032 -6.308 {"}'M' greentint -9.088 2.777 -6.319 {"}'M' greentint -9.295 2.505 -6.124 {"}'M' greentint -9.431 2.284 -6.133 {"}'M' greentint -9.247 2.76 -6.113 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 175 A}'M' greentint -10.249 1.336 -5.245 {"}'M' greentint -10.095 1.536 -5.236 {"}'M' greentint -9.895 1.689 -5.229 {"}'M' greentint -9.662 1.785 -5.225 {"}'M' greentint -10.405 0.959 -5.002 {"}'M' greentint -10.345 1.202 -4.991 {"}'M' greentint -10.226 1.423 -4.982 {"}'M' greentint -10.056 1.607 -4.974 {"}'M' greentint -9.845 1.743 -4.968 {"}'M' greentint -9.607 1.822 -4.964 {"}'M' greentint -9.357 1.84 -4.963 {"}'M' greentint -10.345 1.08 -4.738 {"}'M' greentint -10.249 1.313 -4.727 {"}'M' greentint -10.095 1.513 -4.719 {"}'M' greentint -9.895 1.666 -4.712 {"}'M' greentint -9.662 1.763 -4.708 {"}'M' greentint -9.412 1.796 -4.706 {"}'M' greentint -10.27 0.941 -4.502 {"}'M' greentint -10.196 1.188 -4.491 {"}'M' greentint -10.052 1.403 -4.482 {"}'M' greentint -9.852 1.565 -4.475 {"}'M' greentint -9.613 1.662 -4.471 {"}'M' greentint -9.356 1.684 -4.47 {"}'M' greentint -10.107 0.941 -4.295 {"}'M' greentint -10.013 1.183 -4.284 {"}'M' greentint -9.838 1.375 -4.276 {"}'M' greentint -9.606 1.491 -4.271 {"}'M' greentint -9.347 1.515 -4.27 {"}'M' greentint -9.849 1.047 -4.131 {"}'M' greentint -9.669 1.233 -4.123 {"}'M' greentint -9.42 1.304 -4.12 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 158 A}'M' greentint -9.673 1.709 -5.341 {"}'M' greentint -9.835 1.509 -5.35 {"}'M' greentint -10.045 1.361 -5.356 {"}'M' greentint -9.477 1.696 -5.15 {"}'M' greentint -9.618 1.479 -5.16 {"}'M' greentint -9.805 1.299 -5.168 {"}'M' greentint -10.029 1.168 -5.173 {"}'M' greentint -10.277 1.092 -5.177 {"}'M' greentint -9.327 1.686 -4.931 {"}'M' greentint -9.45 1.465 -4.941 {"}'M' greentint -9.616 1.273 -4.949 {"}'M' greentint -9.816 1.118 -4.956 {"}'M' greentint -10.044 1.006 -4.961 {"}'M' greentint -10.289 0.943 -4.963 {"}'M' greentint -9.226 1.677 -4.69 {"}'M' greentint -9.342 1.449 -4.7 {"}'M' greentint -9.499 1.247 -4.709 {"}'M' greentint -9.691 1.079 -4.716 {"}'M' greentint -9.912 0.949 -4.722 {"}'M' greentint -10.154 0.864 -4.726 {"}'M' greentint -9.294 1.425 -4.447 {"}'M' greentint -9.449 1.22 -4.456 {"}'M' greentint -9.639 1.047 -4.464 {"}'M' greentint -9.858 0.912 -4.469 {"}'M' greentint -10.098 0.819 -4.474 {"}'M' greentint -9.443 1.215 -4.198 {"}'M' greentint -9.632 1.041 -4.205 {"}'M' greentint -9.85 0.904 -4.211 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n met A 30 1w2tA_32Y_47G}P -12.01 -1.652 0.771 {"}-12.01 -1.652 0.771 { ca met A 30 1w2tA_32Y_47G}-10.947 -1.987 -0.164 { c met A 30 1w2tA_32Y_47G}-10.913 -0.966 -1.292 { o met A 30 1w2tA_32Y_47G}-11.883 -0.808 -2.038 { c met A 30 1w2tA_32Y_47G}P -10.913 -0.966 -1.292 { n phe A 31 1w2tA_32Y_47G}-9.786 -0.278 -1.408 { ca phe A 31 1w2tA_32Y_47G}-9.51 0.581 -2.549 { c phe A 31 1w2tA_32Y_47G}-8.602 -0.172 -3.518 { o phe A 31 1w2tA_32Y_47G}-8.131 -1.264 -3.203 { c phe A 31 1w2tA_32Y_47G}P -8.602 -0.172 -3.518 { n tyr A 32 1w2tA_32Y_47G}-8.36 0.4 -4.695 { ca tyr A 32 1w2tA_32Y_47G}-7.522 -0.271 -5.691 { c tyr A 32 1w2tA_32Y_47G}-7.015 0.646 -6.796 { o tyr A 32 1w2tA_32Y_47G}-7.687 1.589 -7.191 { c tyr A 32 1w2tA_32Y_47G}P -7.015 0.646 -6.796 { n gln A 33 1w2tA_32Y_47G}-5.823 0.339 -7.297 { ca gln A 33 1w2tA_32Y_47G}-5.261 1.027 -8.454 { c gln A 33 1w2tA_32Y_47G}-6.208 0.83 -9.639 { o gln A 33 1w2tA_32Y_47G}-6.524 -0.3 -9.988 { c gln A 33 1w2tA_32Y_47G}P -6.208 0.83 -9.639 { n tyr A 34 1w2tA_32Y_47G}-6.66 1.922 -10.249 { ca tyr A 34 1w2tA_32Y_47G}-7.778 1.862 -11.189 { c tyr A 34 1w2tA_32Y_47G}-7.629 2.821 -12.37 { o tyr A 34 1w2tA_32Y_47G}-7.348 3.999 -12.183 { n cys A 45 1w2tA_32Y_47G}P -6.195 6.122 -10.688 {"}-6.195 6.122 -10.688 { ca cys A 45 1w2tA_32Y_47G}-7.018 6.579 -9.568 { c cys A 45 1w2tA_32Y_47G}-7.133 5.466 -8.522 { o cys A 45 1w2tA_32Y_47G}-6.711 4.337 -8.759 { c cys A 45 1w2tA_32Y_47G}P -7.133 5.466 -8.522 { n trp A 46 1w2tA_32Y_47G}-7.712 5.792 -7.369 { ca trp A 46 1w2tA_32Y_47G}-8.128 4.788 -6.393 { c trp A 46 1w2tA_32Y_47G}-9.626 4.513 -6.535 { o trp A 46 1w2tA_32Y_47G}-10.45 5.367 -6.213 { c trp A 46 1w2tA_32Y_47G}P -9.626 4.513 -6.535 { n gly A 47 1w2tA_32Y_47G}-9.968 3.33 -7.034 { ca gly A 47 1w2tA_32Y_47G}-11.322 2.818 -6.949 { c gly A 47 1w2tA_32Y_47G}-11.656 2.43 -5.516 { o gly A 47 1w2tA_32Y_47G}-10.778 2.393 -4.655 { c gly A 47 1w2tA_32Y_47G}P -11.656 2.43 -5.516 { n his A 48 1w2tA_32Y_47G}-12.923 2.12 -5.264 { ca his A 48 1w2tA_32Y_47G}-13.419 1.91 -3.905 { c his A 48 1w2tA_32Y_47G}-14.565 0.896 -3.872 { o his A 48 1w2tA_32Y_47G}-15.489 0.972 -4.671 { c his A 48 1w2tA_32Y_47G}P -14.565 0.896 -3.872 { n ala A 49 1w2tA_32Y_47G}-14.475 -0.058 -2.953 { ca ala A 49 1w2tA_32Y_47G}-15.555 -1.004 -2.672 { c ala A 49 1w2tA_32Y_47G}-15.645 -1.267 -1.169 { o ala A 49 1w2tA_32Y_47G}-14.737 -0.939 -0.409 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n met A 30 1w2tA_32Y_47G}P -12.01 -1.652 0.771 { ca met A 30 1w2tA_32Y_47G}P -10.947 -1.987 -0.164 { n phe A 31 1w2tA_32Y_47G}P -9.786 -0.278 -1.408 { ca phe A 31 1w2tA_32Y_47G}P -9.51 0.581 -2.549 { n tyr A 32 1w2tA_32Y_47G}P -8.36 0.4 -4.695 { ca tyr A 32 1w2tA_32Y_47G}P -7.522 -0.271 -5.691 { n gln A 33 1w2tA_32Y_47G}P -5.823 0.339 -7.297 { ca gln A 33 1w2tA_32Y_47G}P -5.261 1.027 -8.454 { n tyr A 34 1w2tA_32Y_47G}P -6.66 1.922 -10.249 { ca tyr A 34 1w2tA_32Y_47G}P -7.778 1.862 -11.189 { n cys A 45 1w2tA_32Y_47G}P -6.195 6.122 -10.688 { ca cys A 45 1w2tA_32Y_47G}P -7.018 6.579 -9.568 { n trp A 46 1w2tA_32Y_47G}P -7.712 5.792 -7.369 { ca trp A 46 1w2tA_32Y_47G}P -8.128 4.788 -6.393 { n gly A 47 1w2tA_32Y_47G}P -9.968 3.33 -7.034 { ca gly A 47 1w2tA_32Y_47G}P -11.322 2.818 -6.949 {"}P -11.322 2.818 -6.949 { n his A 48 1w2tA_32Y_47G}P -12.923 2.12 -5.264 { ca his A 48 1w2tA_32Y_47G}P -13.419 1.91 -3.905 { n ala A 49 1w2tA_32Y_47G}P -14.475 -0.058 -2.953 { ca ala A 49 1w2tA_32Y_47G}P -15.555 -1.004 -2.672 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca met A 30 1w2tA_32Y_47G}P -10.947 -1.987 -0.164 {"}-10.947 -1.987 -0.164 { ca phe A 31 1w2tA_32Y_47G}-9.51 0.581 -2.549 { ca tyr A 32 1w2tA_32Y_47G}-7.522 -0.271 -5.691 { ca gln A 33 1w2tA_32Y_47G}-5.261 1.027 -8.454 { ca tyr A 34 1w2tA_32Y_47G}-7.778 1.862 -11.189 { ca cys A 45 1w2tA_32Y_47G}P -7.018 6.579 -9.568 {"}-7.018 6.579 -9.568 { ca trp A 46 1w2tA_32Y_47G}-8.128 4.788 -6.393 { ca gly A 47 1w2tA_32Y_47G}-11.322 2.818 -6.949 { ca his A 48 1w2tA_32Y_47G}-13.419 1.91 -3.905 { ca ala A 49 1w2tA_32Y_47G}-15.555 -1.004 -2.672 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca met A 30 1w2tA_32Y_47G}P -10.947 -1.987 -0.164 { ca phe A 31 1w2tA_32Y_47G}P -9.51 0.581 -2.549 { ca tyr A 32 1w2tA_32Y_47G}P -7.522 -0.271 -5.691 { cb tyr A 32 1w2tA_32Y_47G}-8.263 -1.456 -6.326 { cg tyr A 32 1w2tA_32Y_47G}-9.61 -1.127 -6.932 { cd1 tyr A 32 1w2tA_32Y_47G}-9.743 -0.869 -8.291 { ce1 tyr A 32 1w2tA_32Y_47G}-10.987 -0.586 -8.852 { cz tyr A 32 1w2tA_32Y_47G}-12.109 -0.561 -8.054 { oh tyr A 32 1w2tA_32Y_47G}-13.345 -0.278 -8.605 { cg tyr A 32 1w2tA_32Y_47G}P -9.61 -1.127 -6.932 { cd2 tyr A 32 1w2tA_32Y_47G}-10.761 -1.104 -6.149 { ce2 tyr A 32 1w2tA_32Y_47G}-12.001 -0.818 -6.697 { cz tyr A 32 1w2tA_32Y_47G}ghost -12.109 -0.561 -8.054 { ca gln A 33 1w2tA_32Y_47G}P -5.261 1.027 -8.454 { ca tyr A 34 1w2tA_32Y_47G}P -7.778 1.862 -11.189 { ca cys A 45 1w2tA_32Y_47G}P -7.018 6.579 -9.568 { ca trp A 46 1w2tA_32Y_47G}P -8.128 4.788 -6.393 { ca his A 48 1w2tA_32Y_47G}P -13.419 1.91 -3.905 { ca ala A 49 1w2tA_32Y_47G}P -15.555 -1.004 -2.672 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 32 1w2tA_32Y_47G}P -8.263 -1.456 -6.326 {"}P -8.263 -1.456 -6.326 { cd1 tyr A 32 1w2tA_32Y_47G}P -9.743 -0.869 -8.291 { cd2 tyr A 32 1w2tA_32Y_47G}P -10.761 -1.104 -6.149 { ce1 tyr A 32 1w2tA_32Y_47G}P -10.987 -0.586 -8.852 { ce2 tyr A 32 1w2tA_32Y_47G}P -12.001 -0.818 -6.697 { oh tyr A 32 1w2tA_32Y_47G}P -13.345 -0.278 -8.605 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 32 1w2tA_32Y_47G}P -7.522 -0.271 -5.691 { cb tyr A 32 1w2tA_32Y_47G}-8.263 -1.456 -6.326 { cg tyr A 32 1w2tA_32Y_47G}-9.61 -1.127 -6.932 { cd1 tyr A 32 1w2tA_32Y_47G}-9.743 -0.869 -8.291 { ce1 tyr A 32 1w2tA_32Y_47G}-10.987 -0.586 -8.852 { cz tyr A 32 1w2tA_32Y_47G}-12.109 -0.561 -8.054 { oh tyr A 32 1w2tA_32Y_47G}-13.345 -0.278 -8.605 { cg tyr A 32 1w2tA_32Y_47G}P -9.61 -1.127 -6.932 { cd2 tyr A 32 1w2tA_32Y_47G}-10.761 -1.104 -6.149 { ce2 tyr A 32 1w2tA_32Y_47G}-12.001 -0.818 -6.697 { cz tyr A 32 1w2tA_32Y_47G}ghost -12.109 -0.561 -8.054 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 32 1w2tA_32Y_47G}P -8.263 -1.456 -6.326 {"}P -8.263 -1.456 -6.326 { cd1 tyr A 32 1w2tA_32Y_47G}P -9.743 -0.869 -8.291 { cd2 tyr A 32 1w2tA_32Y_47G}P -10.761 -1.104 -6.149 { ce1 tyr A 32 1w2tA_32Y_47G}P -10.987 -0.586 -8.852 { ce2 tyr A 32 1w2tA_32Y_47G}P -12.001 -0.818 -6.697 { oh tyr A 32 1w2tA_32Y_47G}P -13.345 -0.278 -8.605 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 32 A}'P' sky -10.865 1.147 -8.645 {"}'P' sky -10.491 0.936 -8.146 {"}'P' sky -10.672 0.697 -7.704 { CE2 TYR 32 A}'P' sky -12.205 0.891 -7.012 {"}'P' blue -11.128 0.698 -6.762 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 32 A}'P' sea -11.632 1.028 -8.651 {"}'P' sea -11.383 1.106 -8.647 {"}'P' sea -11.126 1.146 -8.645 {"}'P' green -11.439 1.041 -8.391 {"}'P' green -11.183 1.09 -8.389 {"}'P' green -10.922 1.1 -8.389 {"}'P' sea -10.662 1.07 -8.39 {"}'P' green -10.74 0.995 -8.143 {"}'P' green -10.923 0.889 -7.912 {"}'P' sea -10.668 0.856 -7.913 {"}'P' green -10.93 0.732 -7.702 { CE2 TYR 32 A}'P' green -11.944 0.903 -7.012 {"}'P' green -11.684 0.874 -7.013 {"}'P' green -11.432 0.806 -7.016 {"}'P' sea -11.193 0.7 -7.02 {"}'P' sea -11.613 0.887 -6.753 {"}'P' sea -11.363 0.811 -6.757 { CZ TYR 32 A}'P' green -12.052 1.16 -8.369 {"}'P' green -11.792 1.131 -8.37 {"}'P' green -11.54 1.063 -8.373 {"}'P' green -12.239 1.183 -8.109 {"}'P' green -12.305 1.115 -7.591 {"}'P' green -11.075 0.778 -7.606 {"}'P' green -11.158 0.733 -7.358 {"}'P' green -12.045 0.914 -7.114 {"}'P' green -11.79 0.881 -7.115 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 32 A}'P' P -11.25 0.992 -8.143 {"}'P' -11.245 0.964 -8.156 {"}'P' P -10.995 1.014 -8.142 {"}'P' -10.995 1.008 -8.144 { CZ TYR 32 A}'P' P -11.979 1.183 -8.109 {"}'P' -11.983 1.13 -8.107 {"}'P' P -11.721 1.144 -8.11 {"}'P' -11.741 1.056 -8.108 {"}'P' P -11.471 1.068 -8.114 {"}'P' -11.5 0.995 -8.111 {"}'P' P -12.248 1.171 -7.847 {"}'P' -12.247 1.161 -7.849 {"}'P' P -11.987 1.172 -7.847 {"}'P' -11.993 1.079 -7.859 {"}'P' P -11.729 1.135 -7.849 {"}'P' -11.759 1.002 -7.865 {"}'P' P -11.479 1.059 -7.852 {"}'P' -11.524 0.943 -7.867 {"}'P' P -11.244 0.947 -7.857 {"}'P' -11.275 0.893 -7.864 {"}'P' P -12.044 1.125 -7.591 {"}'P' -12.046 1.054 -7.61 {"}'P' P -11.784 1.095 -7.592 {"}'P' -11.807 0.977 -7.625 {"}'P' P -11.532 1.026 -7.595 {"}'P' -11.573 0.914 -7.627 {"}'P' P -11.294 0.919 -7.6 {"}'P' -11.326 0.862 -7.617 {"}'P' P -12.117 1.039 -7.344 {"}'P' -12.117 1.036 -7.345 {"}'P' P -11.862 1.02 -7.345 {"}'P' -11.87 0.967 -7.369 {"}'P' P -11.613 0.961 -7.348 {"}'P' -11.633 0.902 -7.375 {"}'P' P -11.377 0.865 -7.352 {"}'P' -11.389 0.841 -7.364 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 47 A}'P' sky -10.643 1.268 -8.145 {"}'P' sky -10.675 1.053 -7.646 {"}'P' sky -11.058 0.937 -7.143 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 47 A}'P' sea -11.067 1.353 -8.548 {"}'P' sea -11.305 1.266 -8.552 {"}'P' sea -11.559 1.266 -8.552 {"}'P' sea -10.827 1.291 -8.366 {"}'P' green -11.044 1.148 -8.372 {"}'P' green -11.294 1.072 -8.375 {"}'P' green -11.554 1.07 -8.375 {"}'P' green -11.804 1.141 -8.372 {"}'P' green -10.833 1.099 -8.152 {"}'P' green -12.221 1.268 -8.145 {"}'P' sea -10.714 1.069 -7.906 {"}'P' green -10.93 0.932 -7.912 {"}'P' green -12.319 1.238 -7.898 {"}'P' sea -10.884 0.911 -7.652 {"}'P' green -12.281 1.14 -7.642 {"}'P' green -11.17 0.823 -7.395 {"}'P' green -11.559 0.876 -7.145 {"}'P' green -11.806 0.937 -7.143 {"}'P' sea -11.294 1.009 -6.918 {"}'P' green -11.554 1.006 -6.918 {"}'P' sea -11.804 1.077 -6.915 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 47 A}'P' P -11.058 0.981 -8.157 {"}'P' -11.064 0.995 -8.149 {"}'P' P -11.305 0.921 -8.16 {"}'P' -11.308 0.948 -8.145 {"}'P' P -11.559 0.921 -8.16 {"}'P' -11.55 0.993 -8.121 {"}'P' P -11.806 0.981 -8.157 {"}'P' -11.778 1.053 -8.116 {"}'P' P -12.031 1.099 -8.152 {"}'P' -12.009 1.13 -8.132 {"}'P' P -11.17 0.846 -7.916 {"}'P' -11.176 0.871 -7.909 {"}'P' P -11.424 0.816 -7.917 {"}'P' -11.425 0.915 -7.89 {"}'P' P -11.678 0.843 -7.916 {"}'P' -11.649 0.972 -7.879 {"}'P' P -11.92 0.925 -7.912 {"}'P' -11.868 1.032 -7.88 {"}'P' P -12.137 1.059 -7.906 {"}'P' -12.1 1.106 -7.891 {"}'P' P -11.119 0.818 -7.656 {"}'P' -11.12 0.821 -7.656 {"}'P' P -11.369 0.777 -7.658 {"}'P' -11.373 0.862 -7.654 {"}'P' P -11.621 0.791 -7.657 {"}'P' -11.6 0.918 -7.652 {"}'P' P -11.865 0.858 -7.654 {"}'P' -11.818 0.977 -7.649 {"}'P' P -12.089 0.977 -7.649 {"}'P' -12.044 1.043 -7.646 {"}'P' P -11.424 0.793 -7.397 {"}'P' -11.424 0.84 -7.405 {"}'P' P -11.678 0.82 -7.395 {"}'P' -11.661 0.897 -7.41 {"}'P' P -11.92 0.902 -7.392 {"}'P' -11.892 0.961 -7.404 {"}'P' P -12.137 1.037 -7.386 {"}'P' -12.131 1.044 -7.388 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 32 A}'M' green -8.46 2.432 -7.999 {"}'M' green -9.028 1.725 -7.569 {"}'M' green -9.059 1.831 -7.051 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 32 A}'M' greentint -8.625 2.232 -8.007 {"}'M' greentint -8.883 1.991 -7.798 {"}'M' greentint -8.783 2.224 -7.788 {"}'M' greentint -8.638 2.432 -7.779 {"}'M' greentint -8.454 2.606 -7.771 {"}'M' greentint -8.981 1.977 -7.558 {"}'M' greentint -8.888 2.215 -7.547 {"}'M' greentint -8.75 2.431 -7.538 {"}'M' greentint -8.575 2.617 -7.53 {"}'M' greentint -8.367 2.767 -7.523 {"}'M' greentint -9.057 1.851 -7.309 {"}'M' greentint -8.987 2.098 -7.298 {"}'M' greentint -8.872 2.328 -7.288 {"}'M' greentint -8.717 2.533 -7.279 {"}'M' greentint -8.527 2.706 -7.272 {"}'M' greentint -8.99 2.079 -7.04 {"}'M' greentint -8.877 2.31 -7.03 {"}'M' greentint -8.723 2.516 -7.021 {"}'M' greentint -8.534 2.69 -7.014 {"}'M' greentint -8.884 2.189 -6.781 {"}'M' greentint -8.745 2.404 -6.772 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 47 A}'M' greentint -8.394 2.479 -7.765 {"}'M' greentint -8.49 2.246 -7.776 {"}'M' greentint -8.644 2.046 -7.784 {"}'M' greentint -8.844 1.893 -7.791 {"}'M' greentint -8.356 2.476 -7.507 {"}'M' greentint -8.447 2.243 -7.517 {"}'M' greentint -8.593 2.039 -7.526 {"}'M' greentint -8.784 1.878 -7.533 {"}'M' greentint -9.01 1.769 -7.537 {"}'M' greentint -8.327 2.725 -7.496 {"}'M' greentint -8.394 2.456 -7.248 {"}'M' greentint -8.49 2.223 -7.258 {"}'M' greentint -8.644 2.023 -7.267 {"}'M' greentint -8.844 1.87 -7.274 {"}'M' greentint -8.361 2.706 -7.237 {"}'M' greentint -8.497 2.448 -7.007 {"}'M' greentint -8.607 2.215 -7.017 {"}'M' greentint -8.781 2.024 -7.026 {"}'M' greentint -9.003 1.893 -7.032 {"}'M' greentint -8.461 2.703 -6.996 {"}'M' greentint -8.668 2.431 -6.801 {"}'M' greentint -8.804 2.21 -6.81 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 32 A}'M' -9.499 1.681 -5.458 {"}'M' -9.355 1.895 -5.449 {"}'M' -9.681 1.302 -5.234 {"}'M' -9.198 2.138 -5.197 {"}'M' -9.706 1.158 -4.981 {"}'M' -9.148 2.192 -4.936 {"}'M' -9.155 2.014 -4.443 {"}'M' -9.316 1.632 -4.252 @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 32 A}'M' green -9.648 1.552 -5.223 {"}'M' green -9.552 1.785 -5.213 {"}'M' green -9.398 1.985 -5.204 {"}'M' green -9.708 1.408 -4.97 {"}'M' green -9.359 2.056 -4.942 {"}'M' sea -9.681 1.28 -4.716 {"}'M' green -9.648 1.529 -4.706 {"}'M' green -9.398 1.962 -4.687 {"}'M' sea -9.198 2.115 -4.68 {"}'M' sea -9.573 1.39 -4.47 {"}'M' green -9.499 1.637 -4.459 {"}'M' green -9.355 1.852 -4.45 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 32 A}'M' greentint -9.648 1.651 -4.959 {"}'M' greentint -9.529 1.872 -4.95 {"}'M' greentint -9.552 1.762 -4.695 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 47 A}'M' sky -9.55 2.168 -5.289 {"}'M' sky -9.915 1.513 -5.318 {"}'M' sky -9.99 1.319 -5.085 {"}'M' sky -9.384 2.399 -4.784 {"}'M' sky -9.456 2.122 -4.283 @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 47 A}'M' sea -9.626 1.926 -5.3 {"}'M' sea -9.749 1.705 -5.31 {"}'M' green -9.454 2.163 -5.049 {"}'M' green -9.525 1.917 -5.059 {"}'M' green -9.641 1.689 -5.069 {"}'M' green -9.798 1.487 -5.078 {"}'M' green -9.408 2.143 -4.795 {"}'M' green -9.748 1.46 -4.825 {"}'M' sea -9.938 1.287 -4.833 {"}'M' sea -9.406 2.14 -4.537 {"}'M' green -9.475 1.892 -4.548 {"}'M' green -9.588 1.661 -4.558 {"}'M' green -9.742 1.455 -4.567 {"}'M' sea -9.528 1.876 -4.294 {"}'M' sea -9.645 1.649 -4.304 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 47 A}'M' greentint -9.478 1.896 -4.806 {"}'M' greentint -9.593 1.665 -4.816 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n asp A 229 1w7cA_251F_231}P -6.976 6.056 -11.939 {"}-6.976 6.056 -11.939 { ca asp A 229 1w7cA_251F_231}-8.094 6.366 -11.061 { c asp A 229 1w7cA_251F_231}-8.088 5.367 -9.904 { o asp A 229 1w7cA_251F_231}-7.688 4.213 -10.076 { c asp A 229 1w7cA_251F_231}P -8.088 5.367 -9.904 { n tyr A 230 1w7cA_251F_231}-8.485 5.836 -8.741 { ca tyr A 230 1w7cA_251F_231}-8.624 4.997 -7.573 { c tyr A 230 1w7cA_251F_231}-10.105 4.655 -7.392 { o tyr A 230 1w7cA_251F_231}-10.979 5.235 -8.022 { c tyr A 230 1w7cA_251F_231}P -10.105 4.655 -7.392 { n gly A 231 1w7cA_251F_231}-10.367 3.697 -6.525 { ca gly A 231 1w7cA_251F_231}-11.721 3.279 -6.233 { c gly A 231 1w7cA_251F_231}-11.843 2.523 -4.933 { o gly A 231 1w7cA_251F_231}-10.831 2.209 -4.281 { c gly A 231 1w7cA_251F_231}P -11.843 2.523 -4.933 { n thr A 232 1w7cA_251F_231}-13.095 2.295 -4.534 { ca thr A 232 1w7cA_251F_231}-13.367 1.522 -3.338 { c thr A 232 1w7cA_251F_231}-14.658 0.762 -3.48 { o thr A 232 1w7cA_251F_231}-15.322 0.847 -4.52 { c thr A 232 1w7cA_251F_231}P -14.658 0.762 -3.48 { n cys A 233 1w7cA_251F_231}-15.012 0.021 -2.434 { ca cys A 233 1w7cA_251F_231}-16.27 -0.7 -2.385 { c cys A 233 1w7cA_251F_231}-17.048 -0.323 -1.124 { o cys A 233 1w7cA_251F_231}-16.464 -0.075 -0.065 { n phe A 249 1w7cA_251F_231}P -11.664 -1.393 1.396 {"}-11.664 -1.393 1.396 { ca phe A 249 1w7cA_251F_231}-10.98 -2.067 0.29 { c phe A 249 1w7cA_251F_231}-10.82 -1.088 -0.862 { o phe A 249 1w7cA_251F_231}-11.801 -0.527 -1.329 { c phe A 249 1w7cA_251F_231}P -10.82 -1.088 -0.862 { n phe A 250 1w7cA_251F_231}-9.594 -0.875 -1.31 { ca phe A 250 1w7cA_251F_231}-9.286 0.113 -2.342 { c phe A 250 1w7cA_251F_231}-8.552 -0.525 -3.523 { o phe A 250 1w7cA_251F_231}-7.97 -1.602 -3.419 { c phe A 250 1w7cA_251F_231}P -8.552 -0.525 -3.523 { n phe A 251 1w7cA_251F_231}-8.55 0.188 -4.633 { ca phe A 251 1w7cA_251F_231}-7.859 -0.234 -5.817 { c phe A 251 1w7cA_251F_231}-7.496 0.959 -6.691 { o phe A 251 1w7cA_251F_231}-7.981 2.069 -6.492 { c phe A 251 1w7cA_251F_231}P -7.496 0.959 -6.691 { n lys A 252 1w7cA_251F_231}-6.63 0.691 -7.655 { ca lys A 252 1w7cA_251F_231}-6.106 1.691 -8.571 { c lys A 252 1w7cA_251F_231}-5.983 1.053 -9.929 { o lys A 252 1w7cA_251F_231}-5.468 -0.055 -10.047 { c lys A 252 1w7cA_251F_231}P -5.983 1.053 -9.929 { n phe A 253 1w7cA_251F_231}-6.444 1.754 -10.957 { ca phe A 253 1w7cA_251F_231}-6.388 1.247 -12.323 { c phe A 253 1w7cA_251F_231}-5.93 2.302 -13.314 { o phe A 253 1w7cA_251F_231}-6.013 3.491 -13.064 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n asp A 229 1w7cA_251F_231}P -6.976 6.056 -11.939 { ca asp A 229 1w7cA_251F_231}P -8.094 6.366 -11.061 { n tyr A 230 1w7cA_251F_231}P -8.485 5.836 -8.741 { ca tyr A 230 1w7cA_251F_231}P -8.624 4.997 -7.573 { n gly A 231 1w7cA_251F_231}P -10.367 3.697 -6.525 { ca gly A 231 1w7cA_251F_231}P -11.721 3.279 -6.233 {"}P -11.721 3.279 -6.233 { n thr A 232 1w7cA_251F_231}P -13.095 2.295 -4.534 { ca thr A 232 1w7cA_251F_231}P -13.367 1.522 -3.338 { n cys A 233 1w7cA_251F_231}P -15.012 0.021 -2.434 { ca cys A 233 1w7cA_251F_231}P -16.27 -0.7 -2.385 { n phe A 249 1w7cA_251F_231}P -11.664 -1.393 1.396 { ca phe A 249 1w7cA_251F_231}P -10.98 -2.067 0.29 { n phe A 250 1w7cA_251F_231}P -9.594 -0.875 -1.31 { ca phe A 250 1w7cA_251F_231}P -9.286 0.113 -2.342 { n phe A 251 1w7cA_251F_231}P -8.55 0.188 -4.633 { ca phe A 251 1w7cA_251F_231}P -7.859 -0.234 -5.817 { n lys A 252 1w7cA_251F_231}P -6.63 0.691 -7.655 { ca lys A 252 1w7cA_251F_231}P -6.106 1.691 -8.571 { n phe A 253 1w7cA_251F_231}P -6.444 1.754 -10.957 { ca phe A 253 1w7cA_251F_231}P -6.388 1.247 -12.323 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca asp A 229 1w7cA_251F_231}P -8.094 6.366 -11.061 {"}-8.094 6.366 -11.061 { ca tyr A 230 1w7cA_251F_231}-8.624 4.997 -7.573 { ca gly A 231 1w7cA_251F_231}-11.721 3.279 -6.233 { ca thr A 232 1w7cA_251F_231}-13.367 1.522 -3.338 { ca cys A 233 1w7cA_251F_231}-16.27 -0.7 -2.385 { ca phe A 249 1w7cA_251F_231}P -10.98 -2.067 0.29 {"}-10.98 -2.067 0.29 { ca phe A 250 1w7cA_251F_231}-9.286 0.113 -2.342 { ca phe A 251 1w7cA_251F_231}-7.859 -0.234 -5.817 { ca lys A 252 1w7cA_251F_231}-6.106 1.691 -8.571 { ca phe A 253 1w7cA_251F_231}-6.388 1.247 -12.323 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca asp A 229 1w7cA_251F_231}P -8.094 6.366 -11.061 { ca tyr A 230 1w7cA_251F_231}P -8.624 4.997 -7.573 { ca thr A 232 1w7cA_251F_231}P -13.367 1.522 -3.338 { ca cys A 233 1w7cA_251F_231}P -16.27 -0.7 -2.385 { ca phe A 249 1w7cA_251F_231}P -10.98 -2.067 0.29 { ca phe A 250 1w7cA_251F_231}P -9.286 0.113 -2.342 { ca phe A 251 1w7cA_251F_231}P -7.859 -0.234 -5.817 { cb phe A 251 1w7cA_251F_231}-8.688 -1.269 -6.609 { cg phe A 251 1w7cA_251F_231}-10.106 -0.863 -6.83 { cd1 phe A 251 1w7cA_251F_231}-10.466 -0.099 -7.932 { ce1 phe A 251 1w7cA_251F_231}-11.792 0.301 -8.119 { cz phe A 251 1w7cA_251F_231}-12.767 -0.108 -7.222 { cg phe A 251 1w7cA_251F_231}P -10.106 -0.863 -6.83 { cd2 phe A 251 1w7cA_251F_231}-11.1 -1.265 -5.949 { ce2 phe A 251 1w7cA_251F_231}-12.408 -0.875 -6.126 { cz phe A 251 1w7cA_251F_231}ghost -12.767 -0.108 -7.222 { ca lys A 252 1w7cA_251F_231}P -6.106 1.691 -8.571 { ca phe A 253 1w7cA_251F_231}P -6.388 1.247 -12.323 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 251 1w7cA_251F_231}P -8.688 -1.269 -6.609 {"}P -8.688 -1.269 -6.609 { cd1 phe A 251 1w7cA_251F_231}P -10.466 -0.099 -7.932 { cd2 phe A 251 1w7cA_251F_231}P -11.1 -1.265 -5.949 { ce1 phe A 251 1w7cA_251F_231}P -11.792 0.301 -8.119 { ce2 phe A 251 1w7cA_251F_231}P -12.408 -0.875 -6.126 { cz phe A 251 1w7cA_251F_231}P -12.767 -0.108 -7.222 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 251 1w7cA_251F_231}P -7.859 -0.234 -5.817 { cb phe A 251 1w7cA_251F_231}-8.688 -1.269 -6.609 { cg phe A 251 1w7cA_251F_231}-10.106 -0.863 -6.83 { cd1 phe A 251 1w7cA_251F_231}-10.466 -0.099 -7.932 { ce1 phe A 251 1w7cA_251F_231}-11.792 0.301 -8.119 { cz phe A 251 1w7cA_251F_231}-12.767 -0.108 -7.222 { cg phe A 251 1w7cA_251F_231}P -10.106 -0.863 -6.83 { cd2 phe A 251 1w7cA_251F_231}-11.1 -1.265 -5.949 { ce2 phe A 251 1w7cA_251F_231}-12.408 -0.875 -6.126 { cz phe A 251 1w7cA_251F_231}ghost -12.767 -0.108 -7.222 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 251 1w7cA_251F_231}P -8.688 -1.269 -6.609 {"}P -8.688 -1.269 -6.609 { cd1 phe A 251 1w7cA_251F_231}P -10.466 -0.099 -7.932 { cd2 phe A 251 1w7cA_251F_231}P -11.1 -1.265 -5.949 { ce1 phe A 251 1w7cA_251F_231}P -11.792 0.301 -8.119 { ce2 phe A 251 1w7cA_251F_231}P -12.408 -0.875 -6.126 { cz phe A 251 1w7cA_251F_231}P -12.767 -0.108 -7.222 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 251 A}'P' sky -12.971 1.601 -7.537 {"}'P' sky -12.775 1.492 -6.512 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 251 A}'P' green -12.437 1.915 -7.918 {"}'P' green -11.412 1.997 -7.914 {"}'P' green -11.296 1.823 -7.413 {"}'P' green -11.477 1.584 -6.971 {"}'P' green -11.985 1.419 -6.786 { CZ PHE 251 A}'P' green -12.897 1.636 -7.277 {"}'P' green -12.637 1.636 -7.277 {"}'P' green -12.906 1.624 -7.015 {"}'P' sea -12.963 1.568 -6.759 {"}'P' green -12.702 1.578 -6.759 {"}'P' green -12.442 1.548 -6.76 {"}'P' green -12.19 1.479 -6.763 {"}'P' sea -12.52 1.473 -6.513 {"}'P' sea -12.271 1.414 -6.516 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 251 A}'P' P -12.188 1.993 -7.914 {"}'P' -12.179 1.952 -7.919 {"}'P' P -11.931 2.033 -7.912 {"}'P' -11.927 1.982 -7.919 {"}'P' P -11.67 2.034 -7.912 {"}'P' -11.671 2.016 -7.915 {"}'P' P -12.49 1.839 -7.662 {"}'P' -12.473 1.803 -7.673 {"}'P' P -12.244 1.928 -7.658 {"}'P' -12.216 1.826 -7.687 {"}'P' P -11.988 1.977 -7.656 {"}'P' -11.973 1.85 -7.691 {"}'P' P -11.727 1.987 -7.656 {"}'P' -11.731 1.887 -7.683 {"}'P' P -11.467 1.957 -7.657 {"}'P' -11.473 1.926 -7.666 {"}'P' P -12.539 1.719 -7.417 {"}'P' -12.522 1.688 -7.433 {"}'P' P -12.303 1.818 -7.413 {"}'P' -12.268 1.713 -7.462 {"}'P' P -12.055 1.879 -7.41 {"}'P' -12.03 1.733 -7.476 {"}'P' P -11.8 1.901 -7.409 {"}'P' -11.799 1.765 -7.469 {"}'P' P -11.545 1.882 -7.41 {"}'P' -11.557 1.806 -7.444 {"}'P' P -12.236 1.711 -7.182 {"}'P' -12.208 1.624 -7.239 {"}'P' P -11.985 1.765 -7.179 {"}'P' -11.969 1.65 -7.253 {"}'P' P -11.728 1.776 -7.179 {"}'P' -11.732 1.682 -7.238 {"}'P' P -11.473 1.743 -7.18 {"}'P' -11.479 1.714 -7.199 {"}'P' P -11.995 1.605 -6.97 {"}'P' -11.988 1.559 -7.01 {"}'P' P -11.735 1.619 -6.969 {"}'P' -11.737 1.588 -6.996 { CZ PHE 251 A}'P' P -12.645 1.625 -7.015 {"}'P' -12.645 1.622 -7.016 {"}'P' P -12.387 1.588 -7.017 {"}'P' -12.394 1.554 -7.021 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 231 A}'P' green -11.722 2.054 -7.995 {"}'P' green -12.792 1.76 -7.353 {"}'P' green -12.744 1.678 -7.096 {"}'P' sea -12.936 1.841 -7.089 {"}'P' green -11.825 1.524 -6.842 {"}'P' green -12.079 1.494 -6.844 {"}'P' green -12.575 1.603 -6.839 {"}'P' green -12.792 1.738 -6.833 {"}'P' sea -11.96 1.577 -6.592 {"}'P' green -12.214 1.577 -6.592 {"}'P' green -12.461 1.638 -6.59 {"}'P' sea -12.686 1.756 -6.585 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 231 A}'P' P -11.96 1.967 -7.999 {"}'P' -11.964 1.988 -7.971 {"}'P' P -12.214 1.967 -7.999 {"}'P' -12.212 1.975 -7.988 {"}'P' P -11.482 1.992 -7.813 {"}'P' -11.483 1.993 -7.811 {"}'P' P -11.699 1.849 -7.819 {"}'P' -11.728 1.907 -7.763 {"}'P' P -11.949 1.773 -7.822 {"}'P' -11.963 1.863 -7.744 {"}'P' P -12.209 1.771 -7.822 {"}'P' -12.199 1.843 -7.759 {"}'P' P -12.459 1.842 -7.819 {"}'P' -12.452 1.857 -7.805 {"}'P' P -11.488 1.8 -7.599 {"}'P' -11.523 1.849 -7.568 {"}'P' P -11.713 1.682 -7.604 {"}'P' -11.757 1.795 -7.54 {"}'P' P -11.96 1.622 -7.607 {"}'P' -11.978 1.763 -7.53 {"}'P' P -12.214 1.622 -7.607 {"}'P' -12.199 1.741 -7.543 {"}'P' P -12.461 1.682 -7.604 {"}'P' -12.44 1.736 -7.573 {"}'P' P -11.369 1.77 -7.353 {"}'P' -11.382 1.785 -7.348 {"}'P' P -11.585 1.633 -7.359 {"}'P' -11.628 1.721 -7.332 {"}'P' P -11.825 1.547 -7.363 {"}'P' -11.858 1.684 -7.324 {"}'P' P -12.079 1.517 -7.364 {"}'P' -12.08 1.657 -7.325 {"}'P' P -12.333 1.544 -7.363 {"}'P' -12.312 1.637 -7.337 {"}'P' P -12.575 1.626 -7.359 {"}'P' -12.568 1.641 -7.355 {"}'P' P -11.539 1.612 -7.099 {"}'P' -11.555 1.643 -7.098 {"}'P' P -11.774 1.519 -7.103 {"}'P' -11.796 1.598 -7.1 {"}'P' P -12.024 1.478 -7.105 {"}'P' -12.029 1.567 -7.101 {"}'P' P -12.276 1.492 -7.104 {"}'P' -12.267 1.547 -7.102 {"}'P' P -12.52 1.559 -7.101 {"}'P' -12.509 1.587 -7.1 {"}'P' P -12.333 1.521 -6.842 {"}'P' -12.331 1.531 -6.844 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 251 A}'M' green -8.821 3.186 -6.573 {"}'M' green -9.321 2.18 -6.104 {"}'M' green -8.654 3.217 -6.058 {"}'M' green -9.031 2.414 -5.632 {"}'M' green -8.914 2.646 -5.622 {"}'M' green -8.748 2.844 -5.614 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 251 A}'M' greentint -9.281 2.578 -6.599 {"}'M' greentint -9.166 2.808 -6.589 {"}'M' greentint -9.011 3.013 -6.58 {"}'M' greentint -9.353 2.311 -6.352 {"}'M' greentint -9.284 2.559 -6.341 {"}'M' greentint -9.171 2.79 -6.331 {"}'M' greentint -9.017 2.996 -6.322 {"}'M' greentint -8.828 3.17 -6.315 {"}'M' greentint -9.273 2.431 -6.093 {"}'M' greentint -9.178 2.669 -6.082 {"}'M' greentint -9.039 2.884 -6.073 {"}'M' greentint -8.863 3.069 -6.065 {"}'M' greentint -9.179 2.409 -5.853 {"}'M' greentint -9.081 2.642 -5.842 {"}'M' greentint -8.937 2.851 -5.833 {"}'M' greentint -8.754 3.027 -5.826 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 231 A}'M' green -9.34 2.418 -6.552 {"}'M' green -8.798 3.229 -6.516 {"}'M' green -9.414 2.278 -6.316 {"}'M' green -9.347 2.251 -6.058 {"}'M' green -8.664 3.207 -6.017 {"}'M' green -9.181 2.352 -5.795 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 231 A}'M' greentint -9.005 2.975 -6.735 {"}'M' greentint -9.141 2.754 -6.744 {"}'M' greentint -8.834 2.974 -6.527 {"}'M' greentint -8.944 2.74 -6.538 {"}'M' greentint -9.118 2.55 -6.546 {"}'M' greentint -8.731 2.961 -6.286 {"}'M' greentint -8.827 2.728 -6.297 {"}'M' greentint -8.981 2.528 -6.305 {"}'M' greentint -9.181 2.375 -6.312 {"}'M' greentint -8.698 3.21 -6.276 {"}'M' greentint -8.693 2.958 -6.028 {"}'M' greentint -8.784 2.725 -6.038 {"}'M' greentint -8.93 2.521 -6.047 {"}'M' greentint -9.121 2.36 -6.054 {"}'M' greentint -8.731 2.938 -5.769 {"}'M' greentint -8.827 2.705 -5.779 {"}'M' greentint -8.981 2.505 -5.788 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 251 A}'M' green -9.958 1.323 -4.976 {"}'M' green -9.508 1.909 -4.95 {"}'M' green -9.458 1.963 -4.689 {"}'M' green -9.991 1.051 -4.469 {"}'M' green -9.883 1.161 -4.223 {"}'M' green -9.465 1.785 -4.196 {"}'M' sea -9.72 1.161 -4.016 {"}'M' green -9.626 1.403 -4.005 {"}'M' green -9.451 1.595 -3.997 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 251 A}'M' greentint -9.862 1.556 -4.966 {"}'M' greentint -9.708 1.756 -4.957 {"}'M' greentint -10.018 1.179 -4.723 {"}'M' greentint -9.958 1.422 -4.712 {"}'M' greentint -9.839 1.643 -4.703 {"}'M' greentint -9.669 1.827 -4.695 {"}'M' greentint -9.958 1.3 -4.459 {"}'M' greentint -9.862 1.533 -4.448 {"}'M' greentint -9.708 1.733 -4.44 {"}'M' greentint -9.508 1.886 -4.433 {"}'M' greentint -9.809 1.408 -4.212 {"}'M' greentint -9.665 1.623 -4.203 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 231 A}'M' green -9.829 1.752 -5.145 {"}'M' green -9.97 1.535 -5.155 {"}'M' green -9.603 1.984 -4.915 {"}'M' green -9.968 1.329 -4.944 {"}'M' sea -10.168 1.174 -4.951 {"}'M' green -9.507 1.979 -4.675 {"}'M' green -10.043 1.135 -4.711 {"}'M' green -9.461 1.959 -4.421 {"}'M' green -9.991 1.103 -4.459 {"}'M' green -9.459 1.956 -4.163 {"}'M' green -9.984 1.097 -4.2 {"}'M' sea -9.581 1.692 -3.92 {"}'M' green -9.698 1.465 -3.93 {"}'M' sea -9.856 1.264 -3.939 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 231 A}'M' greentint -9.679 1.742 -4.926 {"}'M' greentint -9.802 1.521 -4.936 {"}'M' greentint -9.578 1.733 -4.685 {"}'M' greentint -9.694 1.505 -4.695 {"}'M' greentint -9.851 1.303 -4.704 {"}'M' greentint -9.531 1.712 -4.432 {"}'M' greentint -9.646 1.481 -4.442 {"}'M' greentint -9.801 1.276 -4.451 {"}'M' greentint -9.528 1.708 -4.174 {"}'M' greentint -9.641 1.477 -4.184 {"}'M' greentint -9.795 1.271 -4.193 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n arg A 423 1wkyA_425Y_467}P -12.165 -2.604 0.07 {"}-12.165 -2.604 0.07 { ca arg A 423 1wkyA_425Y_467}-10.767 -2.46 -0.288 { c arg A 423 1wkyA_425Y_467}-10.601 -1.333 -1.293 { o arg A 423 1wkyA_425Y_467}-11.477 -1.082 -2.124 { c arg A 423 1wkyA_425Y_467}P -10.601 -1.333 -1.293 { n leu A 424 1wkyA_425Y_467}-9.47 -0.648 -1.186 { ca leu A 424 1wkyA_425Y_467}-9.129 0.465 -2.06 { c leu A 424 1wkyA_425Y_467}-8.398 -0.113 -3.264 { o leu A 424 1wkyA_425Y_467}-7.608 -1.043 -3.121 { c leu A 424 1wkyA_425Y_467}P -8.398 -0.113 -3.264 { n tyr A 425 1wkyA_425Y_467}-8.663 0.426 -4.45 { ca tyr A 425 1wkyA_425Y_467}-8 -0.071 -5.65 { c tyr A 425 1wkyA_425Y_467}-7.674 1.046 -6.628 { o tyr A 425 1wkyA_425Y_467}-8.222 2.148 -6.543 { c tyr A 425 1wkyA_425Y_467}P -7.674 1.046 -6.628 { n val A 426 1wkyA_425Y_467}-6.767 0.748 -7.551 { ca val A 426 1wkyA_425Y_467}-6.391 1.677 -8.607 { c val A 426 1wkyA_425Y_467}-6.2 0.833 -9.861 { o val A 426 1wkyA_425Y_467}-5.983 -0.376 -9.771 { c val A 426 1wkyA_425Y_467}P -6.2 0.833 -9.861 { n lys A 427 1wkyA_425Y_467}-6.311 1.468 -11.022 { ca lys A 427 1wkyA_425Y_467}-6.105 0.792 -12.3 { c lys A 427 1wkyA_425Y_467}-5.091 1.636 -13.056 { o lys A 427 1wkyA_425Y_467}-5.208 2.86 -13.086 { n glu A 465 1wkyA_425Y_467}P -8.031 5.049 -12.876 {"}-8.031 5.049 -12.876 { ca glu A 465 1wkyA_425Y_467}-9.168 5.023 -11.964 { c glu A 465 1wkyA_425Y_467}-8.725 4.76 -10.528 { o glu A 465 1wkyA_425Y_467}-7.758 4.041 -10.292 { c glu A 465 1wkyA_425Y_467}P -8.725 4.76 -10.528 { n ile A 466 1wkyA_425Y_467}-9.438 5.358 -9.58 { ca ile A 466 1wkyA_425Y_467}-9.179 5.16 -8.156 { c ile A 466 1wkyA_425Y_467}-10.543 4.908 -7.528 { o ile A 466 1wkyA_425Y_467}-11.491 5.647 -7.789 { c ile A 466 1wkyA_425Y_467}P -10.543 4.908 -7.528 { n gly A 467 1wkyA_425Y_467}-10.659 3.874 -6.707 { ca gly A 467 1wkyA_425Y_467}-11.948 3.627 -6.091 { c gly A 467 1wkyA_425Y_467}-11.933 2.681 -4.912 { o gly A 467 1wkyA_425Y_467}-10.884 2.222 -4.468 { c gly A 467 1wkyA_425Y_467}P -11.933 2.681 -4.912 { n val A 468 1wkyA_425Y_467}-13.12 2.406 -4.393 { ca val A 468 1wkyA_425Y_467}-13.273 1.485 -3.284 { c val A 468 1wkyA_425Y_467}-14.329 0.471 -3.682 { o val A 468 1wkyA_425Y_467}-15.397 0.835 -4.188 { c val A 468 1wkyA_425Y_467}P -14.329 0.471 -3.682 { n gln A 469 1wkyA_425Y_467}-14.016 -0.801 -3.471 { ca gln A 469 1wkyA_425Y_467}-14.941 -1.88 -3.78 { c gln A 469 1wkyA_425Y_467}-15.524 -2.352 -2.452 { o gln A 469 1wkyA_425Y_467}-14.788 -2.815 -1.576 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 423 1wkyA_425Y_467}P -12.165 -2.604 0.07 { ca arg A 423 1wkyA_425Y_467}P -10.767 -2.46 -0.288 { n leu A 424 1wkyA_425Y_467}P -9.47 -0.648 -1.186 { ca leu A 424 1wkyA_425Y_467}P -9.129 0.465 -2.06 { n tyr A 425 1wkyA_425Y_467}P -8.663 0.426 -4.45 { ca tyr A 425 1wkyA_425Y_467}P -8 -0.071 -5.65 { n val A 426 1wkyA_425Y_467}P -6.767 0.748 -7.551 { ca val A 426 1wkyA_425Y_467}P -6.391 1.677 -8.607 { n lys A 427 1wkyA_425Y_467}P -6.311 1.468 -11.022 { ca lys A 427 1wkyA_425Y_467}P -6.105 0.792 -12.3 { n glu A 465 1wkyA_425Y_467}P -8.031 5.049 -12.876 { ca glu A 465 1wkyA_425Y_467}P -9.168 5.023 -11.964 { n ile A 466 1wkyA_425Y_467}P -9.438 5.358 -9.58 { ca ile A 466 1wkyA_425Y_467}P -9.179 5.16 -8.156 { n gly A 467 1wkyA_425Y_467}P -10.659 3.874 -6.707 { ca gly A 467 1wkyA_425Y_467}P -11.948 3.627 -6.091 {"}P -11.948 3.627 -6.091 { n val A 468 1wkyA_425Y_467}P -13.12 2.406 -4.393 { ca val A 468 1wkyA_425Y_467}P -13.273 1.485 -3.284 { n gln A 469 1wkyA_425Y_467}P -14.016 -0.801 -3.471 { ca gln A 469 1wkyA_425Y_467}P -14.941 -1.88 -3.78 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca arg A 423 1wkyA_425Y_467}P -10.767 -2.46 -0.288 {"}-10.767 -2.46 -0.288 { ca leu A 424 1wkyA_425Y_467}-9.129 0.465 -2.06 { ca tyr A 425 1wkyA_425Y_467}-8 -0.071 -5.65 { ca val A 426 1wkyA_425Y_467}-6.391 1.677 -8.607 { ca lys A 427 1wkyA_425Y_467}-6.105 0.792 -12.3 { ca glu A 465 1wkyA_425Y_467}P -9.168 5.023 -11.964 {"}-9.168 5.023 -11.964 { ca ile A 466 1wkyA_425Y_467}-9.179 5.16 -8.156 { ca gly A 467 1wkyA_425Y_467}-11.948 3.627 -6.091 { ca val A 468 1wkyA_425Y_467}-13.273 1.485 -3.284 { ca gln A 469 1wkyA_425Y_467}-14.941 -1.88 -3.78 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca arg A 423 1wkyA_425Y_467}P -10.767 -2.46 -0.288 { ca leu A 424 1wkyA_425Y_467}P -9.129 0.465 -2.06 { ca tyr A 425 1wkyA_425Y_467}P -8 -0.071 -5.65 { cb tyr A 425 1wkyA_425Y_467}-8.889 -1.107 -6.354 { cg tyr A 425 1wkyA_425Y_467}-10.09 -0.51 -7.07 { cd1 tyr A 425 1wkyA_425Y_467}-9.962 0.041 -8.347 { ce1 tyr A 425 1wkyA_425Y_467}-11.051 0.628 -8.993 { cz tyr A 425 1wkyA_425Y_467}-12.282 0.667 -8.359 { oh tyr A 425 1wkyA_425Y_467}-13.354 1.255 -8.993 { cg tyr A 425 1wkyA_425Y_467}P -10.09 -0.51 -7.07 { cd2 tyr A 425 1wkyA_425Y_467}-11.339 -0.464 -6.455 { ce2 tyr A 425 1wkyA_425Y_467}-12.437 0.124 -7.091 { cz tyr A 425 1wkyA_425Y_467}ghost -12.282 0.667 -8.359 { ca val A 426 1wkyA_425Y_467}P -6.391 1.677 -8.607 { ca lys A 427 1wkyA_425Y_467}P -6.105 0.792 -12.3 { ca glu A 465 1wkyA_425Y_467}P -9.168 5.023 -11.964 { ca ile A 466 1wkyA_425Y_467}P -9.179 5.16 -8.156 { ca val A 468 1wkyA_425Y_467}P -13.273 1.485 -3.284 { ca gln A 469 1wkyA_425Y_467}P -14.941 -1.88 -3.78 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 425 1wkyA_425Y_467}P -8.889 -1.107 -6.354 {"}P -8.889 -1.107 -6.354 { cd1 tyr A 425 1wkyA_425Y_467}P -9.962 0.041 -8.347 { cd2 tyr A 425 1wkyA_425Y_467}P -11.339 -0.464 -6.455 { ce1 tyr A 425 1wkyA_425Y_467}P -11.051 0.628 -8.993 { ce2 tyr A 425 1wkyA_425Y_467}P -12.437 0.124 -7.091 { oh tyr A 425 1wkyA_425Y_467}P -13.354 1.255 -8.993 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 425 1wkyA_425Y_467}P -8 -0.071 -5.65 { cb tyr A 425 1wkyA_425Y_467}-8.889 -1.107 -6.354 { cg tyr A 425 1wkyA_425Y_467}-10.09 -0.51 -7.07 { cd1 tyr A 425 1wkyA_425Y_467}-9.962 0.041 -8.347 { ce1 tyr A 425 1wkyA_425Y_467}-11.051 0.628 -8.993 { cz tyr A 425 1wkyA_425Y_467}-12.282 0.667 -8.359 { oh tyr A 425 1wkyA_425Y_467}-13.354 1.255 -8.993 { cg tyr A 425 1wkyA_425Y_467}P -10.09 -0.51 -7.07 { cd2 tyr A 425 1wkyA_425Y_467}-11.339 -0.464 -6.455 { ce2 tyr A 425 1wkyA_425Y_467}-12.437 0.124 -7.091 { cz tyr A 425 1wkyA_425Y_467}ghost -12.282 0.667 -8.359 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 425 1wkyA_425Y_467}P -8.889 -1.107 -6.354 {"}P -8.889 -1.107 -6.354 { cd1 tyr A 425 1wkyA_425Y_467}P -9.962 0.041 -8.347 { cd2 tyr A 425 1wkyA_425Y_467}P -11.339 -0.464 -6.455 { ce1 tyr A 425 1wkyA_425Y_467}P -11.051 0.628 -8.993 { ce2 tyr A 425 1wkyA_425Y_467}P -12.437 0.124 -7.091 { oh tyr A 425 1wkyA_425Y_467}P -13.354 1.255 -8.993 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 425 A}'P' blue -13.075 1.753 -7.151 {"}'P' sky -12.825 1.829 -7.147 {"}'P' blue -13.082 1.738 -6.89 {"}'P' sky -12.833 1.816 -6.886 {"}'P' sky -12.889 1.751 -6.63 {"}'P' sky -12.633 1.8 -6.628 { CZ TYR 425 A}'P' blue -12.678 2.359 -8.154 {"}'P' blue -12.421 2.399 -8.152 {"}'P' sky -12.98 2.205 -7.902 {"}'P' blue -11.957 2.323 -7.897 {"}'P' sky -13.029 2.085 -7.657 {"}'P' sky -12.973 1.799 -7.217 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 425 A}'P' sea -12.576 1.856 -6.884 { CZ TYR 425 A}'P' sea -12.734 2.294 -7.898 {"}'P' sea -12.478 2.343 -7.896 {"}'P' sea -12.217 2.353 -7.896 {"}'P' green -12.793 2.184 -7.653 {"}'P' green -12.545 2.245 -7.65 {"}'P' green -12.29 2.267 -7.649 {"}'P' sea -12.035 2.248 -7.65 {"}'P' sea -12.964 1.981 -7.426 {"}'P' green -12.726 2.077 -7.422 {"}'P' green -12.475 2.131 -7.419 {"}'P' green -12.218 2.142 -7.419 {"}'P' sea -11.963 2.109 -7.42 {"}'P' sea -12.737 1.908 -7.213 {"}'P' green -12.485 1.971 -7.21 {"}'P' sea -12.225 1.985 -7.209 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 425 A}'P' blue -13.16 2.317 -8.102 {"}'P' blue -13.17 2.134 -7.919 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 467 A}'P' sky -12.264 2.631 -7.795 {"}'P' sky -12.756 2.544 -7.799 {"}'P' blue -12.994 2.631 -7.795 {"}'P' sky -12.024 2.569 -7.613 {"}'P' sky -13.001 2.419 -7.619 {"}'P' blue -13.117 2.203 -7.159 {"}'P' blue -13.062 2.136 -6.901 {"}'P' sky -12.621 2.071 -6.644 {"}'P' sky -12.875 2.098 -6.642 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 467 A}'P' sea -12.502 2.544 -7.799 {"}'P' sea -12.241 2.426 -7.619 {"}'P' green -12.491 2.35 -7.622 {"}'P' green -12.751 2.348 -7.622 {"}'P' sea -12.03 2.377 -7.399 {"}'P' green -12.255 2.259 -7.404 {"}'P' green -12.502 2.199 -7.407 {"}'P' green -12.756 2.199 -7.407 {"}'P' sea -13.003 2.259 -7.404 {"}'P' sea -12.127 2.21 -7.159 {"}'P' green -12.367 2.124 -7.163 {"}'P' green -12.621 2.094 -7.164 {"}'P' sea -12.875 2.121 -7.163 {"}'P' sea -12.316 2.096 -6.903 {"}'P' sea -12.566 2.055 -6.905 {"}'P' sea -12.818 2.069 -6.904 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 425 A}'M' green -9.318 2.783 -7.14 {"}'M' green -9.173 2.991 -7.131 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 425 A}'M' greentint -9.516 2.536 -6.91 {"}'M' greentint -9.423 2.774 -6.899 {"}'M' greentint -9.285 2.99 -6.89 {"}'M' greentint -9.11 3.176 -6.882 {"}'M' greentint -9.592 2.41 -6.661 {"}'M' greentint -9.522 2.657 -6.65 {"}'M' greentint -9.407 2.887 -6.64 {"}'M' greentint -9.252 3.092 -6.631 {"}'M' greentint -9.062 3.265 -6.624 {"}'M' greentint -9.594 2.39 -6.403 {"}'M' greentint -9.525 2.638 -6.392 {"}'M' greentint -9.412 2.869 -6.382 {"}'M' greentint -9.258 3.075 -6.373 {"}'M' greentint -9.069 3.249 -6.366 {"}'M' greentint -9.514 2.51 -6.144 {"}'M' greentint -9.419 2.748 -6.133 {"}'M' greentint -9.28 2.963 -6.124 {"}'M' greentint -9.104 3.148 -6.116 {"}'M' greentint -9.322 2.721 -5.893 {"}'M' greentint -9.178 2.93 -5.884 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 467 A}'M' greentint -9.098 3.01 -6.976 {"}'M' greentint -9.208 2.776 -6.987 {"}'M' greentint -9.382 2.586 -6.995 {"}'M' greentint -8.995 2.997 -6.735 {"}'M' greentint -9.091 2.764 -6.746 {"}'M' greentint -9.245 2.564 -6.754 {"}'M' greentint -9.445 2.411 -6.761 {"}'M' greentint -8.962 3.246 -6.725 {"}'M' greentint -8.957 2.994 -6.477 {"}'M' greentint -9.048 2.761 -6.487 {"}'M' greentint -9.194 2.557 -6.496 {"}'M' greentint -9.385 2.396 -6.503 {"}'M' greentint -9.611 2.287 -6.507 {"}'M' greentint -8.928 3.243 -6.466 {"}'M' greentint -8.995 2.974 -6.218 {"}'M' greentint -9.091 2.741 -6.228 {"}'M' greentint -9.245 2.541 -6.237 {"}'M' greentint -9.445 2.388 -6.244 {"}'M' greentint -8.962 3.224 -6.207 {"}'M' greentint -9.098 2.966 -5.977 {"}'M' greentint -9.208 2.733 -5.987 {"}'M' greentint -9.382 2.542 -5.996 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 425 A}'M' greentint -10.163 1.319 -5.095 {"}'M' greentint -10.089 1.566 -5.084 {"}'M' greentint -9.945 1.78 -5.075 {"}'M' greentint -9.745 1.943 -5.068 {"}'M' greentint -10.271 1.187 -4.86 {"}'M' greentint -10.238 1.437 -4.849 {"}'M' greentint -10.142 1.67 -4.839 {"}'M' greentint -9.988 1.87 -4.83 {"}'M' greentint -9.788 2.023 -4.823 {"}'M' greentint -9.555 2.119 -4.819 {"}'M' greentint -10.296 1.043 -4.607 {"}'M' greentint -10.298 1.293 -4.596 {"}'M' greentint -10.238 1.536 -4.585 {"}'M' greentint -10.119 1.757 -4.576 {"}'M' greentint -9.949 1.941 -4.568 {"}'M' greentint -9.738 2.077 -4.562 {"}'M' greentint -9.5 2.156 -4.558 {"}'M' greentint -10.271 1.165 -4.342 {"}'M' greentint -10.238 1.414 -4.332 {"}'M' greentint -10.142 1.647 -4.321 {"}'M' greentint -9.988 1.847 -4.313 {"}'M' greentint -9.788 2 -4.306 {"}'M' greentint -9.555 2.097 -4.302 {"}'M' greentint -10.163 1.275 -4.096 {"}'M' greentint -10.089 1.522 -4.085 {"}'M' greentint -9.945 1.737 -4.076 {"}'M' greentint -9.745 1.899 -4.069 {"}'M' greentint -9.906 1.517 -3.878 {"}'M' greentint -9.731 1.709 -3.87 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 467 A}'M' greentint -9.732 1.755 -5.113 {"}'M' greentint -9.855 1.534 -5.123 {"}'M' greentint -10.021 1.342 -5.131 {"}'M' greentint -9.56 1.992 -4.862 {"}'M' greentint -9.631 1.746 -4.872 {"}'M' greentint -9.747 1.518 -4.882 {"}'M' greentint -9.904 1.316 -4.891 {"}'M' greentint -10.096 1.148 -4.898 {"}'M' greentint -9.514 1.972 -4.608 {"}'M' greentint -9.584 1.725 -4.619 {"}'M' greentint -9.699 1.494 -4.629 {"}'M' greentint -9.854 1.289 -4.638 {"}'M' greentint -10.044 1.116 -4.646 {"}'M' greentint -10.263 0.981 -4.651 {"}'M' greentint -9.512 1.969 -4.35 {"}'M' greentint -9.581 1.721 -4.361 {"}'M' greentint -9.694 1.49 -4.371 {"}'M' greentint -9.848 1.284 -4.38 {"}'M' greentint -10.037 1.11 -4.387 {"}'M' greentint -10.255 0.973 -4.393 {"}'M' greentint -9.562 1.951 -4.096 {"}'M' greentint -9.634 1.705 -4.107 {"}'M' greentint -9.751 1.478 -4.117 {"}'M' greentint -9.909 1.277 -4.126 {"}'M' greentint -10.103 1.109 -4.133 {"}'M' greentint -9.851 1.486 -3.875 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu A 97 1wl7A_99Y_112G}P -12.116 -1.636 0.734 {"}-12.116 -1.636 0.734 { ca leu A 97 1wl7A_99Y_112G}-11.033 -2.085 -0.128 { c leu A 97 1wl7A_99Y_112G}-10.766 -1.062 -1.223 { o leu A 97 1wl7A_99Y_112G}-11.614 -0.819 -2.084 { c leu A 97 1wl7A_99Y_112G}P -10.766 -1.062 -1.223 { n tyr A 98 1wl7A_99Y_112G}-9.59 -0.453 -1.184 { ca tyr A 98 1wl7A_99Y_112G}-9.215 0.523 -2.196 { c tyr A 98 1wl7A_99Y_112G}-8.349 -0.187 -3.226 { o tyr A 98 1wl7A_99Y_112G}-7.626 -1.125 -2.891 { c tyr A 98 1wl7A_99Y_112G}P -8.349 -0.187 -3.226 { n tyr A 99 1wl7A_99Y_112G}-8.429 0.255 -4.478 { ca tyr A 99 1wl7A_99Y_112G}-7.649 -0.353 -5.551 { c tyr A 99 1wl7A_99Y_112G}-7.297 0.677 -6.623 { o tyr A 99 1wl7A_99Y_112G}-7.945 1.72 -6.729 { c tyr A 99 1wl7A_99Y_112G}P -7.297 0.677 -6.623 { n ser A 100 1wl7A_99Y_112G}-6.279 0.368 -7.423 { ca ser A 100 1wl7A_99Y_112G}-5.811 1.28 -8.463 { c ser A 100 1wl7A_99Y_112G}-6.169 0.863 -9.886 { o ser A 100 1wl7A_99Y_112G}-6.025 -0.305 -10.259 { c ser A 100 1wl7A_99Y_112G}P -6.169 0.863 -9.886 { n val A 101 1wl7A_99Y_112G}-6.635 1.83 -10.669 { ca val A 101 1wl7A_99Y_112G}-6.973 1.608 -12.071 { c val A 101 1wl7A_99Y_112G}-6.015 2.522 -12.829 { o val A 101 1wl7A_99Y_112G}-6.068 3.744 -12.683 { n val A 110 1wl7A_99Y_112G}P -7.018 6.257 -11.494 {"}-7.018 6.257 -11.494 { ca val A 110 1wl7A_99Y_112G}-8.055 6.535 -10.518 { c val A 110 1wl7A_99Y_112G}-8.074 5.431 -9.467 { o val A 110 1wl7A_99Y_112G}-7.863 4.257 -9.781 { c val A 110 1wl7A_99Y_112G}P -8.074 5.431 -9.467 { n ile A 111 1wl7A_99Y_112G}-8.29 5.821 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-1.11 -6.745 { cd1 tyr A 99 1wl7A_99Y_112G}-10.906 -1.071 -5.941 { ce1 tyr A 99 1wl7A_99Y_112G}-12.142 -0.697 -6.462 { cz tyr A 99 1wl7A_99Y_112G}-12.242 -0.355 -7.803 { oh tyr A 99 1wl7A_99Y_112G}-13.451 0.026 -8.322 { cg tyr A 99 1wl7A_99Y_112G}P -9.766 -1.11 -6.745 { cd2 tyr A 99 1wl7A_99Y_112G}-9.895 -0.762 -8.09 { ce2 tyr A 99 1wl7A_99Y_112G}-11.128 -0.384 -8.62 { cz tyr A 99 1wl7A_99Y_112G}ghost -12.242 -0.355 -7.803 { ca ser A 100 1wl7A_99Y_112G}P -5.811 1.28 -8.463 { ca val A 101 1wl7A_99Y_112G}P -6.973 1.608 -12.071 { ca val A 110 1wl7A_99Y_112G}P -8.055 6.535 -10.518 { ca ile A 111 1wl7A_99Y_112G}P -8.372 4.865 -7.118 { ca leu A 113 1wl7A_99Y_112G}P -13.443 1.77 -3.504 { ca ala A 114 1wl7A_99Y_112G}P -15.383 -1.429 -2.837 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 99 1wl7A_99Y_112G}P -8.426 -1.512 -6.177 {"}P -8.426 -1.512 -6.177 { cd1 tyr A 99 1wl7A_99Y_112G}P -10.906 -1.071 -5.941 { cd2 tyr A 99 1wl7A_99Y_112G}P -9.895 -0.762 -8.09 { ce1 tyr A 99 1wl7A_99Y_112G}P -12.142 -0.697 -6.462 { ce2 tyr A 99 1wl7A_99Y_112G}P -11.128 -0.384 -8.62 { oh tyr A 99 1wl7A_99Y_112G}P -13.451 0.026 -8.322 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 99 1wl7A_99Y_112G}P -7.649 -0.353 -5.551 { cb tyr A 99 1wl7A_99Y_112G}-8.426 -1.512 -6.177 { cg tyr A 99 1wl7A_99Y_112G}-9.766 -1.11 -6.745 { cd1 tyr A 99 1wl7A_99Y_112G}-10.906 -1.071 -5.941 { ce1 tyr A 99 1wl7A_99Y_112G}-12.142 -0.697 -6.462 { cz tyr A 99 1wl7A_99Y_112G}-12.242 -0.355 -7.803 { oh tyr A 99 1wl7A_99Y_112G}-13.451 0.026 -8.322 { cg tyr A 99 1wl7A_99Y_112G}P -9.766 -1.11 -6.745 { cd2 tyr A 99 1wl7A_99Y_112G}-9.895 -0.762 -8.09 { ce2 tyr A 99 1wl7A_99Y_112G}-11.128 -0.384 -8.62 { cz tyr A 99 1wl7A_99Y_112G}ghost -12.242 -0.355 -7.803 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 99 1wl7A_99Y_112G}P -8.426 -1.512 -6.177 {"}P -8.426 -1.512 -6.177 { cd1 tyr A 99 1wl7A_99Y_112G}P -10.906 -1.071 -5.941 { cd2 tyr A 99 1wl7A_99Y_112G}P -9.895 -0.762 -8.09 { ce1 tyr A 99 1wl7A_99Y_112G}P -12.142 -0.697 -6.462 { ce2 tyr A 99 1wl7A_99Y_112G}P -11.128 -0.384 -8.62 { oh tyr A 99 1wl7A_99Y_112G}P -13.451 0.026 -8.322 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 99 A}'P' blue -11.773 1.23 -8.419 {"}'P' blue -11.524 1.308 -8.415 {"}'P' sky -11.58 1.243 -8.159 {"}'P' sky -11.324 1.292 -8.157 {"}'P' sky -11.391 1.194 -7.911 {"}'P' blue -11.136 1.216 -7.91 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ TYR 99 A}'P' sea -12.446 1.354 -8.118 {"}'P' green -12.185 1.366 -8.118 {"}'P' green -11.925 1.337 -8.119 {"}'P' sea -11.673 1.269 -8.122 {"}'P' green -12.63 1.35 -7.859 {"}'P' green -11.604 1.274 -7.863 {"}'P' green -12.638 1.337 -7.598 {"}'P' green -11.612 1.265 -7.601 {"}'P' sea -11.377 1.153 -7.606 {"}'P' green -12.694 1.272 -7.342 {"}'P' green -11.665 1.232 -7.344 {"}'P' sea -11.427 1.125 -7.349 {"}'P' green -12.505 1.223 -7.094 {"}'P' green -11.746 1.167 -7.097 {"}'P' sea -11.51 1.071 -7.101 {"}'P' sea -12.435 1.109 -6.863 {"}'P' sea -12.178 1.12 -6.863 {"}'P' sea -11.923 1.087 -6.864 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 99 A}'P' P -12.372 1.389 -7.858 {"}'P' -12.372 1.378 -7.857 {"}'P' P -12.112 1.389 -7.858 {"}'P' -12.114 1.352 -7.857 {"}'P' P -11.854 1.35 -7.859 {"}'P' -11.857 1.334 -7.859 {"}'P' P -12.381 1.377 -7.596 {"}'P' -12.377 1.33 -7.602 {"}'P' P -12.12 1.378 -7.596 {"}'P' -12.125 1.301 -7.606 {"}'P' P -11.862 1.341 -7.598 {"}'P' -11.874 1.286 -7.605 {"}'P' P -12.438 1.321 -7.34 {"}'P' -12.435 1.297 -7.347 {"}'P' P -12.177 1.331 -7.34 {"}'P' -12.179 1.268 -7.357 {"}'P' P -11.917 1.301 -7.341 {"}'P' -11.927 1.25 -7.355 {"}'P' P -12.25 1.245 -7.093 {"}'P' -12.25 1.244 -7.094 {"}'P' P -11.995 1.226 -7.094 {"}'P' -11.996 1.222 -7.096 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 99 A}'P' blue -12.837 1.271 -8.138 {"}'P' blue -13.134 1.317 -7.882 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 112 A}'P' blue -11.409 1.705 -8.116 {"}'P' blue -12.803 1.682 -7.895 {"}'P' blue -12.901 1.652 -7.648 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 112 A}'P' sea -11.876 1.486 -8.125 {"}'P' green -12.136 1.484 -8.125 {"}'P' sea -12.386 1.555 -8.122 {"}'P' green -11.64 1.395 -7.907 {"}'P' green -12.388 1.395 -7.907 {"}'P' sea -12.613 1.513 -7.902 {"}'P' green -11.512 1.346 -7.662 {"}'P' green -12.719 1.473 -7.656 {"}'P' green -11.466 1.325 -7.402 {"}'P' green -12.671 1.391 -7.399 {"}'P' sea -11.512 1.323 -7.142 {"}'P' green -11.752 1.237 -7.145 {"}'P' green -12.502 1.316 -7.142 {"}'P' sea -11.887 1.29 -6.895 {"}'P' green -12.141 1.29 -6.895 {"}'P' sea -12.388 1.351 -6.893 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 112 A}'P' P -11.887 1.335 -7.91 {"}'P' -11.888 1.343 -7.905 {"}'P' P -12.141 1.335 -7.91 {"}'P' -12.138 1.358 -7.897 {"}'P' P -11.752 1.26 -7.666 {"}'P' -11.759 1.287 -7.658 {"}'P' P -12.006 1.23 -7.667 {"}'P' -12.006 1.298 -7.648 {"}'P' P -12.26 1.257 -7.666 {"}'P' -12.246 1.319 -7.648 {"}'P' P -12.502 1.339 -7.662 {"}'P' -12.495 1.352 -7.658 {"}'P' P -11.701 1.232 -7.406 {"}'P' -11.705 1.245 -7.406 {"}'P' P -11.951 1.191 -7.408 {"}'P' -11.954 1.255 -7.405 {"}'P' P -12.203 1.205 -7.407 {"}'P' -12.192 1.274 -7.404 {"}'P' P -12.447 1.272 -7.404 {"}'P' -12.436 1.301 -7.403 {"}'P' P -12.006 1.207 -7.147 {"}'P' -12.006 1.226 -7.15 {"}'P' P -12.26 1.234 -7.145 {"}'P' -12.257 1.248 -7.148 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 99 A}'M' greentint -9.192 1.874 -7.347 {"}'M' greentint -9.141 2.122 -7.336 {"}'M' greentint -9.041 2.355 -7.326 {"}'M' greentint -8.896 2.563 -7.317 {"}'M' greentint -9.286 1.856 -7.107 {"}'M' greentint -9.239 2.108 -7.096 {"}'M' greentint -9.146 2.346 -7.085 {"}'M' greentint -9.008 2.562 -7.076 {"}'M' greentint -8.833 2.748 -7.068 {"}'M' greentint -9.339 1.726 -6.858 {"}'M' greentint -9.315 1.982 -6.847 {"}'M' greentint -9.245 2.229 -6.836 {"}'M' greentint -9.13 2.459 -6.826 {"}'M' greentint -8.975 2.664 -6.817 {"}'M' greentint -8.785 2.837 -6.81 {"}'M' greentint -9.339 1.706 -6.6 {"}'M' greentint -9.317 1.962 -6.589 {"}'M' greentint -9.248 2.21 -6.578 {"}'M' greentint -9.135 2.441 -6.568 {"}'M' greentint -8.981 2.647 -6.559 {"}'M' greentint -8.792 2.821 -6.552 {"}'M' greentint -9.237 2.082 -6.33 {"}'M' greentint -9.142 2.32 -6.319 {"}'M' greentint -9.003 2.535 -6.31 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 112 A}'M' greentint -8.834 2.361 -7.449 {"}'M' greentint -8.944 2.127 -7.46 {"}'M' greentint -8.731 2.348 -7.208 {"}'M' greentint -8.827 2.115 -7.219 {"}'M' greentint -8.981 1.915 -7.227 {"}'M' greentint -9.181 1.762 -7.234 {"}'M' greentint -8.698 2.597 -7.198 {"}'M' greentint -8.693 2.345 -6.95 {"}'M' greentint -8.784 2.112 -6.96 {"}'M' greentint -8.93 1.908 -6.969 {"}'M' greentint -9.121 1.747 -6.976 {"}'M' greentint -8.697 2.842 -6.928 {"}'M' greentint -8.664 2.594 -6.939 {"}'M' greentint -8.731 2.325 -6.691 {"}'M' greentint -8.827 2.092 -6.701 {"}'M' greentint -8.981 1.892 -6.71 {"}'M' greentint -9.181 1.739 -6.717 {"}'M' greentint -8.731 2.824 -6.67 {"}'M' greentint -8.698 2.575 -6.68 {"}'M' greentint -8.834 2.317 -6.45 {"}'M' greentint -8.944 2.084 -6.46 {"}'M' greentint -9.118 1.893 -6.469 {"}'M' greentint -8.798 2.572 -6.439 {"}'M' greentint -9.005 2.3 -6.244 {"}'M' greentint -9.141 2.079 -6.253 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 99 A}'M' green -9.795 1.405 -5.251 {"}'M' green -9.651 1.619 -5.242 {"}'M' green -9.977 1.026 -5.027 {"}'M' green -9.494 1.862 -4.99 {"}'M' green -10.002 0.882 -4.774 {"}'M' green -9.444 1.916 -4.729 {"}'M' green -9.977 1.004 -4.509 {"}'M' green -9.494 1.839 -4.473 {"}'M' green -9.869 1.114 -4.263 {"}'M' green -9.451 1.738 -4.236 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 99 A}'M' greentint -9.944 1.276 -5.016 {"}'M' greentint -9.848 1.509 -5.006 {"}'M' greentint -9.694 1.709 -4.997 {"}'M' greentint -10.004 1.132 -4.763 {"}'M' greentint -9.944 1.375 -4.752 {"}'M' greentint -9.825 1.596 -4.743 {"}'M' greentint -9.655 1.78 -4.735 {"}'M' greentint -9.944 1.253 -4.499 {"}'M' greentint -9.848 1.486 -4.488 {"}'M' greentint -9.694 1.686 -4.48 {"}'M' greentint -9.795 1.361 -4.252 {"}'M' greentint -9.651 1.576 -4.243 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 112 A}'M' green -9.66 1.855 -5.177 {"}'M' green -9.736 1.613 -5.188 {"}'M' green -9.859 1.392 -5.198 {"}'M' green -10.025 1.2 -5.206 {"}'M' green -9.564 1.85 -4.937 {"}'M' green -10.1 1.006 -4.973 {"}'M' green -10.048 0.974 -4.721 {"}'M' green -9.516 1.827 -4.425 {"}'M' green -10.041 0.968 -4.462 {"}'M' green -9.566 1.809 -4.171 {"}'M' green -9.638 1.563 -4.182 {"}'M' green -9.913 1.135 -4.201 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 112 A}'M' greentint -9.635 1.604 -4.947 {"}'M' greentint -9.751 1.376 -4.957 {"}'M' greentint -9.908 1.174 -4.966 {"}'M' greentint -9.518 1.83 -4.683 {"}'M' greentint -9.588 1.583 -4.694 {"}'M' greentint -9.703 1.352 -4.704 {"}'M' greentint -9.858 1.147 -4.713 {"}'M' greentint -9.585 1.579 -4.436 {"}'M' greentint -9.698 1.348 -4.446 {"}'M' greentint -9.852 1.142 -4.455 {"}'M' greentint -9.755 1.336 -4.192 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n cys A 38 1wpuA_104F_40G}P -7.456 5.379 -12.63 {"}-7.456 5.379 -12.63 { ca cys A 38 1wpuA_104F_40G}-8.741 5.218 -11.968 { c cys A 38 1wpuA_104F_40G}-8.489 4.796 -10.524 { o cys A 38 1wpuA_104F_40G}-7.655 3.932 -10.264 { c cys A 38 1wpuA_104F_40G}P -8.489 4.796 -10.524 { n leu A 39 1wpuA_104F_40G}-9.193 5.428 -9.594 { ca leu A 39 1wpuA_104F_40G}-9.073 5.11 -8.177 { c leu A 39 1wpuA_104F_40G}-10.469 4.889 -7.624 { o leu A 39 1wpuA_104F_40G}-11.412 5.587 -8 { c leu A 39 1wpuA_104F_40G}P -10.469 4.889 -7.624 { n gly A 40 1wpuA_104F_40G}-10.604 3.912 -6.736 { ca gly A 40 1wpuA_104F_40G}-11.902 3.639 -6.156 { c gly A 40 1wpuA_104F_40G}-11.822 2.847 -4.869 { o gly A 40 1wpuA_104F_40G}-10.738 2.56 -4.364 { c gly A 40 1wpuA_104F_40G}P -11.822 2.847 -4.869 { n lys A 41 1wpuA_104F_40G}-12.984 2.507 -4.333 { ca lys A 41 1wpuA_104F_40G}-13.065 1.74 -3.105 { c lys A 41 1wpuA_104F_40G}-14.287 0.848 -3.183 { o lys A 41 1wpuA_104F_40G}-15.277 1.189 -3.823 { c lys A 41 1wpuA_104F_40G}P -14.287 0.848 -3.183 { n val A 42 1wpuA_104F_40G}-14.205 -0.308 -2.543 { ca val A 42 1wpuA_104F_40G}-15.308 -1.242 -2.532 { c val A 42 1wpuA_104F_40G}-15.086 -2.244 -1.413 { o val A 42 1wpuA_104F_40G}-13.956 -2.652 -1.145 { n leu A 102 1wpuA_104F_40G}P -11.717 -2.851 0.511 {"}-11.717 -2.851 0.511 { ca leu A 102 1wpuA_104F_40G}-10.599 -2.489 -0.347 { c leu A 102 1wpuA_104F_40G}-10.615 -1.123 -1.002 { o leu A 102 1wpuA_104F_40G}-11.659 -0.493 -1.167 { c leu A 102 1wpuA_104F_40G}P -10.615 -1.123 -1.002 { n arg A 103 1wpuA_104F_40G}-9.416 -0.69 -1.363 { ca arg A 103 1wpuA_104F_40G}-9.207 0.528 -2.116 { c arg A 103 1wpuA_104F_40G}-8.525 -0.075 -3.339 { o arg A 103 1wpuA_104F_40G}-7.793 -1.067 -3.222 { c arg A 103 1wpuA_104F_40G}P -8.525 -0.075 -3.339 { n phe A 104 1wpuA_104F_40G}-8.783 0.478 -4.513 { ca phe A 104 1wpuA_104F_40G}-8.173 -0.049 -5.716 { c phe A 104 1wpuA_104F_40G}-7.72 1.044 -6.651 { o phe A 104 1wpuA_104F_40G}-8.198 2.182 -6.596 { c phe A 104 1wpuA_104F_40G}P -7.72 1.044 -6.651 { n ala A 105 1wpuA_104F_40G}-6.771 0.689 -7.502 { ca ala A 105 1wpuA_104F_40G}-6.247 1.61 -8.486 { c ala A 105 1wpuA_104F_40G}-6.047 0.817 -9.761 { o ala A 105 1wpuA_104F_40G}-5.622 -0.34 -9.724 { c ala A 105 1wpuA_104F_40G}P -6.047 0.817 -9.761 { n val A 106 1wpuA_104F_40G}-6.394 1.424 -10.886 { ca val A 106 1wpuA_104F_40G}-6.211 0.791 -12.174 { c val A 106 1wpuA_104F_40G}-5.423 1.787 -13.007 { o val A 106 1wpuA_104F_40G}-5.818 2.941 -13.155 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n cys A 38 1wpuA_104F_40G}P -7.456 5.379 -12.63 { ca cys A 38 1wpuA_104F_40G}P -8.741 5.218 -11.968 { n leu A 39 1wpuA_104F_40G}P -9.193 5.428 -9.594 { ca leu A 39 1wpuA_104F_40G}P -9.073 5.11 -8.177 { n gly A 40 1wpuA_104F_40G}P -10.604 3.912 -6.736 { ca gly A 40 1wpuA_104F_40G}P -11.902 3.639 -6.156 {"}P -11.902 3.639 -6.156 { n lys A 41 1wpuA_104F_40G}P -12.984 2.507 -4.333 { ca lys A 41 1wpuA_104F_40G}P -13.065 1.74 -3.105 { n val A 42 1wpuA_104F_40G}P -14.205 -0.308 -2.543 { ca val A 42 1wpuA_104F_40G}P -15.308 -1.242 -2.532 { n leu A 102 1wpuA_104F_40G}P -11.717 -2.851 0.511 { ca leu A 102 1wpuA_104F_40G}P -10.599 -2.489 -0.347 { n arg A 103 1wpuA_104F_40G}P -9.416 -0.69 -1.363 { ca arg A 103 1wpuA_104F_40G}P -9.207 0.528 -2.116 { n phe A 104 1wpuA_104F_40G}P -8.783 0.478 -4.513 { ca phe A 104 1wpuA_104F_40G}P -8.173 -0.049 -5.716 { n ala A 105 1wpuA_104F_40G}P -6.771 0.689 -7.502 { ca ala A 105 1wpuA_104F_40G}P -6.247 1.61 -8.486 { n val A 106 1wpuA_104F_40G}P -6.394 1.424 -10.886 { ca val A 106 1wpuA_104F_40G}P -6.211 0.791 -12.174 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca cys A 38 1wpuA_104F_40G}P -8.741 5.218 -11.968 {"}-8.741 5.218 -11.968 { ca leu A 39 1wpuA_104F_40G}-9.073 5.11 -8.177 { ca gly A 40 1wpuA_104F_40G}-11.902 3.639 -6.156 { ca lys A 41 1wpuA_104F_40G}-13.065 1.74 -3.105 { ca val A 42 1wpuA_104F_40G}-15.308 -1.242 -2.532 { ca leu A 102 1wpuA_104F_40G}P -10.599 -2.489 -0.347 {"}-10.599 -2.489 -0.347 { ca arg A 103 1wpuA_104F_40G}-9.207 0.528 -2.116 { ca phe A 104 1wpuA_104F_40G}-8.173 -0.049 -5.716 { ca ala A 105 1wpuA_104F_40G}-6.247 1.61 -8.486 { ca val A 106 1wpuA_104F_40G}-6.211 0.791 -12.174 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca cys A 38 1wpuA_104F_40G}P -8.741 5.218 -11.968 { ca leu A 39 1wpuA_104F_40G}P -9.073 5.11 -8.177 { ca lys A 41 1wpuA_104F_40G}P -13.065 1.74 -3.105 { ca val A 42 1wpuA_104F_40G}P -15.308 -1.242 -2.532 { ca leu A 102 1wpuA_104F_40G}P -10.599 -2.489 -0.347 { ca arg A 103 1wpuA_104F_40G}P -9.207 0.528 -2.116 { ca phe A 104 1wpuA_104F_40G}P -8.173 -0.049 -5.716 { cb phe A 104 1wpuA_104F_40G}-9.143 -1.002 -6.436 { cg phe A 104 1wpuA_104F_40G}-10.402 -0.346 -6.948 { cd1 phe A 104 1wpuA_104F_40G}-10.399 0.364 -8.145 { ce1 phe A 104 1wpuA_104F_40G}-11.578 0.93 -8.645 { cz phe A 104 1wpuA_104F_40G}-12.767 0.783 -7.938 { cg phe A 104 1wpuA_104F_40G}P -10.402 -0.346 -6.948 { cd2 phe A 104 1wpuA_104F_40G}-11.599 -0.48 -6.25 { ce2 phe A 104 1wpuA_104F_40G}-12.779 0.08 -6.741 { cz phe A 104 1wpuA_104F_40G}ghost -12.767 0.783 -7.938 { ca ala A 105 1wpuA_104F_40G}P -6.247 1.61 -8.486 { ca val A 106 1wpuA_104F_40G}P -6.211 0.791 -12.174 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 104 1wpuA_104F_40G}P -9.143 -1.002 -6.436 {"}P -9.143 -1.002 -6.436 { cd1 phe A 104 1wpuA_104F_40G}P -10.399 0.364 -8.145 { cd2 phe A 104 1wpuA_104F_40G}P -11.599 -0.48 -6.25 { ce1 phe A 104 1wpuA_104F_40G}P -11.578 0.93 -8.645 { ce2 phe A 104 1wpuA_104F_40G}P -12.779 0.08 -6.741 { cz phe A 104 1wpuA_104F_40G}P -12.767 0.783 -7.938 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 104 1wpuA_104F_40G}P -8.173 -0.049 -5.716 { cb phe A 104 1wpuA_104F_40G}-9.143 -1.002 -6.436 { cg phe A 104 1wpuA_104F_40G}-10.402 -0.346 -6.948 { cd1 phe A 104 1wpuA_104F_40G}-10.399 0.364 -8.145 { ce1 phe A 104 1wpuA_104F_40G}-11.578 0.93 -8.645 { cz phe A 104 1wpuA_104F_40G}-12.767 0.783 -7.938 { cg phe A 104 1wpuA_104F_40G}P -10.402 -0.346 -6.948 { cd2 phe A 104 1wpuA_104F_40G}-11.599 -0.48 -6.25 { ce2 phe A 104 1wpuA_104F_40G}-12.779 0.08 -6.741 { cz phe A 104 1wpuA_104F_40G}ghost -12.767 0.783 -7.938 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 104 1wpuA_104F_40G}P -9.143 -1.002 -6.436 {"}P -9.143 -1.002 -6.436 { cd1 phe A 104 1wpuA_104F_40G}P -10.399 0.364 -8.145 { cd2 phe A 104 1wpuA_104F_40G}P -11.599 -0.48 -6.25 { ce1 phe A 104 1wpuA_104F_40G}P -11.578 0.93 -8.645 { ce2 phe A 104 1wpuA_104F_40G}P -12.779 0.08 -6.741 { cz phe A 104 1wpuA_104F_40G}P -12.767 0.783 -7.938 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 104 A}'P' sky -12.276 2.468 -8.188 {"}'P' sky -12.03 2.557 -8.184 {"}'P' sky -11.586 2.53 -7.935 { CE2 PHE 104 A}'P' sky -13.175 1.772 -6.536 {"}'P' blue -12.975 1.756 -6.278 {"}'P' sky -12.714 1.766 -6.278 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 104 A}'P' green -12.089 2.447 -7.939 {"}'P' sea -11.841 2.508 -7.936 {"}'P' green -11.771 2.394 -7.705 {"}'P' green -11.781 2.234 -7.496 { CE2 PHE 104 A}'P' sea -12.399 1.776 -6.536 { CZ PHE 104 A}'P' green -13.163 2.475 -7.733 {"}'P' green -11.972 2.034 -7.008 {"}'P' green -12.703 1.914 -6.605 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 104 A}'P' P -12.906 2.515 -7.731 {"}'P' -12.903 2.477 -7.736 {"}'P' P -12.645 2.516 -7.731 {"}'P' -12.65 2.446 -7.74 {"}'P' P -12.387 2.479 -7.733 {"}'P' -12.4 2.421 -7.74 {"}'P' P -12.137 2.403 -7.736 {"}'P' -12.14 2.395 -7.737 {"}'P' P -13.219 2.41 -7.477 {"}'P' -13.215 2.397 -7.481 {"}'P' P -12.963 2.459 -7.475 {"}'P' -12.951 2.363 -7.502 {"}'P' P -12.702 2.469 -7.475 {"}'P' -12.707 2.326 -7.514 {"}'P' P -12.442 2.439 -7.476 {"}'P' -12.469 2.301 -7.515 {"}'P' P -12.19 2.37 -7.479 {"}'P' -12.221 2.285 -7.503 {"}'P' P -11.952 2.263 -7.484 {"}'P' -11.954 2.259 -7.485 {"}'P' P -13.278 2.3 -7.232 {"}'P' -13.275 2.291 -7.236 {"}'P' P -13.03 2.361 -7.229 {"}'P' -13.014 2.263 -7.273 {"}'P' P -12.775 2.383 -7.228 {"}'P' -12.774 2.224 -7.299 {"}'P' P -12.52 2.364 -7.229 {"}'P' -12.546 2.196 -7.304 {"}'P' P -12.271 2.305 -7.232 {"}'P' -12.312 2.182 -7.289 {"}'P' P -12.035 2.209 -7.236 {"}'P' -12.058 2.163 -7.259 {"}'P' P -13.211 2.193 -7.001 {"}'P' -13.207 2.179 -7.009 {"}'P' P -12.96 2.247 -6.998 {"}'P' -12.948 2.157 -7.056 {"}'P' P -12.703 2.258 -6.998 {"}'P' -12.708 2.125 -7.083 {"}'P' P -12.448 2.225 -6.999 {"}'P' -12.475 2.101 -7.08 {"}'P' P -12.202 2.15 -7.002 {"}'P' -12.231 2.08 -7.05 {"}'P' P -12.97 2.087 -6.789 {"}'P' -12.966 2.061 -6.812 {"}'P' P -12.71 2.101 -6.788 {"}'P' -12.713 2.039 -6.842 {"}'P' P -12.452 2.066 -6.79 {"}'P' -12.466 2.012 -6.838 {"}'P' P -12.206 1.982 -6.793 {"}'P' -12.21 1.974 -6.801 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 40 A}'P' sea -11.954 2.654 -7.818 {"}'P' sea -11.739 2.628 -7.634 {"}'P' green -11.908 2.43 -7.643 {"}'P' sea -11.724 2.407 -7.422 {"}'P' green -11.914 2.238 -7.429 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 40 A}'P' P -12.386 2.405 -7.829 {"}'P' -12.391 2.428 -7.797 {"}'P' P -12.64 2.405 -7.829 {"}'P' -12.633 2.44 -7.781 {"}'P' P -12.878 2.492 -7.825 {"}'P' -12.872 2.5 -7.812 {"}'P' P -12.125 2.287 -7.649 {"}'P' -12.14 2.317 -7.62 {"}'P' P -12.375 2.211 -7.652 {"}'P' -12.389 2.301 -7.573 {"}'P' P -12.635 2.209 -7.652 {"}'P' -12.62 2.317 -7.557 {"}'P' P -12.885 2.28 -7.649 {"}'P' -12.85 2.356 -7.577 {"}'P' P -13.106 2.419 -7.643 {"}'P' -13.092 2.434 -7.626 {"}'P' P -12.139 2.12 -7.434 {"}'P' -12.169 2.198 -7.39 {"}'P' P -12.386 2.06 -7.437 {"}'P' -12.404 2.202 -7.36 {"}'P' P -12.64 2.06 -7.437 {"}'P' -12.62 2.223 -7.349 {"}'P' P -12.887 2.12 -7.434 {"}'P' -12.836 2.25 -7.36 {"}'P' P -13.112 2.238 -7.429 {"}'P' -13.068 2.3 -7.389 {"}'P' P -12.011 2.071 -7.189 {"}'P' -12.028 2.105 -7.179 {"}'P' P -12.251 1.985 -7.193 {"}'P' -12.279 2.1 -7.16 {"}'P' P -12.505 1.955 -7.194 {"}'P' -12.506 2.117 -7.149 {"}'P' P -12.759 1.982 -7.193 {"}'P' -12.723 2.141 -7.148 {"}'P' P -13.001 2.064 -7.189 {"}'P' -12.949 2.172 -7.157 {"}'P' P -13.218 2.198 -7.183 {"}'P' -13.193 2.23 -7.173 {"}'P' P -12.2 1.957 -6.933 {"}'P' -12.214 2.007 -6.931 {"}'P' P -12.45 1.916 -6.935 {"}'P' -12.455 2.018 -6.931 {"}'P' P -12.702 1.93 -6.934 {"}'P' -12.684 2.04 -6.93 {"}'P' P -12.946 1.997 -6.931 {"}'P' -12.916 2.073 -6.928 {"}'P' P -13.17 2.116 -6.926 {"}'P' -13.161 2.128 -6.926 {"}'P' P -12.505 1.932 -6.674 {"}'P' -12.505 1.943 -6.676 {"}'P' P -12.759 1.959 -6.672 {"}'P' -12.757 1.97 -6.675 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 104 A}'M' green -9.492 2.57 -6.963 {"}'M' green -8.827 3.419 -6.413 {"}'M' green -8.871 3.33 -6.162 {"}'M' green -9.396 2.522 -5.957 {"}'M' green -8.971 3.14 -5.93 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 104 A}'M' greentint -9.399 2.808 -6.952 {"}'M' greentint -9.261 3.024 -6.943 {"}'M' greentint -9.086 3.21 -6.935 {"}'M' greentint -9.568 2.444 -6.714 {"}'M' greentint -9.498 2.691 -6.703 {"}'M' greentint -9.383 2.921 -6.693 {"}'M' greentint -9.228 3.126 -6.684 {"}'M' greentint -9.038 3.299 -6.677 {"}'M' greentint -9.57 2.424 -6.456 {"}'M' greentint -9.501 2.672 -6.445 {"}'M' greentint -9.388 2.903 -6.435 {"}'M' greentint -9.234 3.109 -6.426 {"}'M' greentint -9.045 3.283 -6.419 {"}'M' greentint -9.49 2.544 -6.197 {"}'M' greentint -9.395 2.782 -6.186 {"}'M' greentint -9.256 2.997 -6.177 {"}'M' greentint -9.08 3.182 -6.169 {"}'M' greentint -9.298 2.755 -5.946 {"}'M' greentint -9.154 2.964 -5.937 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 40 A}'M' greentint -9.031 3.097 -6.926 {"}'M' greentint -9.141 2.863 -6.937 {"}'M' greentint -9.315 2.673 -6.945 {"}'M' greentint -8.928 3.084 -6.685 {"}'M' greentint -9.024 2.851 -6.696 {"}'M' greentint -9.178 2.651 -6.704 {"}'M' greentint -9.378 2.498 -6.711 {"}'M' greentint -8.895 3.333 -6.675 {"}'M' greentint -8.89 3.081 -6.427 {"}'M' greentint -8.981 2.848 -6.437 {"}'M' greentint -9.127 2.644 -6.446 {"}'M' greentint -9.318 2.483 -6.453 {"}'M' greentint -9.544 2.374 -6.457 {"}'M' greentint -8.861 3.33 -6.416 {"}'M' greentint -8.928 3.061 -6.168 {"}'M' greentint -9.024 2.828 -6.178 {"}'M' greentint -9.178 2.628 -6.187 {"}'M' greentint -9.378 2.475 -6.194 {"}'M' greentint -8.895 3.311 -6.157 {"}'M' greentint -9.031 3.053 -5.927 {"}'M' greentint -9.141 2.82 -5.937 {"}'M' greentint -9.315 2.629 -5.946 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 104 A}'M' greentint -10.172 1.653 -5.135 {"}'M' greentint -10.028 1.867 -5.126 {"}'M' greentint -9.828 2.03 -5.119 {"}'M' greentint -10.321 1.524 -4.9 {"}'M' greentint -10.225 1.757 -4.89 {"}'M' greentint -10.071 1.957 -4.881 {"}'M' greentint -9.871 2.11 -4.874 {"}'M' greentint -9.638 2.206 -4.87 {"}'M' greentint -10.381 1.38 -4.647 {"}'M' greentint -10.321 1.623 -4.636 {"}'M' greentint -10.202 1.844 -4.627 {"}'M' greentint -10.032 2.028 -4.619 {"}'M' greentint -9.821 2.164 -4.613 {"}'M' greentint -9.583 2.243 -4.609 {"}'M' greentint -10.354 1.252 -4.393 {"}'M' greentint -10.321 1.501 -4.383 {"}'M' greentint -10.225 1.734 -4.372 {"}'M' greentint -10.071 1.934 -4.364 {"}'M' greentint -9.871 2.087 -4.357 {"}'M' greentint -9.638 2.184 -4.353 {"}'M' greentint -9.388 2.217 -4.351 {"}'M' greentint -10.246 1.362 -4.147 {"}'M' greentint -10.172 1.609 -4.136 {"}'M' greentint -10.028 1.824 -4.127 {"}'M' greentint -9.828 1.986 -4.12 {"}'M' greentint -9.589 2.083 -4.116 {"}'M' greentint -9.989 1.604 -3.929 {"}'M' greentint -9.814 1.796 -3.921 {"}'M' greentint -9.582 1.912 -3.916 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 40 A}'M' greentint -9.877 1.886 -5.238 {"}'M' greentint -9.586 2.093 -5.009 {"}'M' greentint -9.709 1.872 -5.019 {"}'M' greentint -9.875 1.68 -5.027 {"}'M' greentint -10.075 1.525 -5.034 {"}'M' greentint -9.485 2.084 -4.768 {"}'M' greentint -9.601 1.856 -4.778 {"}'M' greentint -9.758 1.654 -4.787 {"}'M' greentint -9.95 1.486 -4.794 {"}'M' greentint -10.171 1.356 -4.8 {"}'M' greentint -9.438 2.063 -4.515 {"}'M' greentint -9.553 1.832 -4.525 {"}'M' greentint -9.708 1.627 -4.534 {"}'M' greentint -9.898 1.454 -4.542 {"}'M' greentint -10.117 1.319 -4.547 {"}'M' greentint -10.357 1.226 -4.552 {"}'M' greentint -9.435 2.059 -4.257 {"}'M' greentint -9.548 1.828 -4.267 {"}'M' greentint -9.702 1.622 -4.276 {"}'M' greentint -9.891 1.448 -4.283 {"}'M' greentint -10.109 1.311 -4.289 {"}'M' greentint -9.605 1.816 -4.013 {"}'M' greentint -9.763 1.615 -4.022 {"}'M' greentint -9.957 1.447 -4.029 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n val A 30 1wtoA_32F_43G}P -12.005 -1.829 0.505 {"}-12.005 -1.829 0.505 { ca val A 30 1wtoA_32F_43G}-10.985 -2.421 -0.299 { c val A 30 1wtoA_32F_43G}-10.679 -1.246 -1.296 { o val A 30 1wtoA_32F_43G}-11.564 -0.828 -2.062 { c val A 30 1wtoA_32F_43G}P -10.679 -1.246 -1.296 { n ser A 31 1wtoA_32F_43G}-9.496 -0.636 -1.177 { ca ser A 31 1wtoA_32F_43G}-9.036 0.404 -2.084 { c ser A 31 1wtoA_32F_43G}-8.326 -0.252 -3.286 { o ser A 31 1wtoA_32F_43G}-7.686 -1.284 -3.191 { c ser A 31 1wtoA_32F_43G}P -8.326 -0.252 -3.286 { n phe A 32 1wtoA_32F_43G}-8.453 0.389 -4.441 { ca phe A 32 1wtoA_32F_43G}-7.741 -0.095 -5.614 { c phe A 32 1wtoA_32F_43G}-7.42 1.031 -6.584 { o phe A 32 1wtoA_32F_43G}-8.035 2.084 -6.546 { c phe A 32 1wtoA_32F_43G}P -7.42 1.031 -6.584 { n thr A 33 1wtoA_32F_43G}-6.376 0.808 -7.36 { ca thr A 33 1wtoA_32F_43G}-6.048 1.717 -8.437 { c thr A 33 1wtoA_32F_43G}-6.255 0.893 -9.697 { o thr A 33 1wtoA_32F_43G}-6.257 -0.357 -9.647 { c thr A 33 1wtoA_32F_43G}P -6.255 0.893 -9.697 { n tyr A 34 1wtoA_32F_43G}-6.493 1.594 -10.813 { ca tyr A 34 1wtoA_32F_43G}-6.734 0.902 -12.062 { c tyr A 34 1wtoA_32F_43G}-6.297 1.74 -13.254 { o tyr A 34 1wtoA_32F_43G}-6.092 2.942 -13.114 { n gly A 41 1wtoA_32F_43G}P -6.626 5.57 -12.157 {"}-6.626 5.57 -12.157 { ca gly A 41 1wtoA_32F_43G}-7.933 5.782 -11.578 { c gly A 41 1wtoA_32F_43G}-7.909 5.192 -10.157 { o gly A 41 1wtoA_32F_43G}-7.199 4.216 -9.926 { c gly A 41 1wtoA_32F_43G}P -7.909 5.192 -10.157 { n arg A 42 1wtoA_32F_43G}-8.651 5.789 -9.239 { ca arg A 42 1wtoA_32F_43G}-8.761 5.281 -7.86 { c arg A 42 1wtoA_32F_43G}-10.215 4.985 -7.584 { o arg A 42 1wtoA_32F_43G}-11.111 5.736 -7.988 { c arg A 42 1wtoA_32F_43G}P -10.215 4.985 -7.584 { n gly A 43 1wtoA_32F_43G}-10.463 3.884 -6.918 { ca gly A 43 1wtoA_32F_43G}-11.797 3.523 -6.501 { c gly A 43 1wtoA_32F_43G}-11.735 2.78 -5.169 { o gly A 43 1wtoA_32F_43G}-10.677 2.348 -4.709 { c gly A 43 1wtoA_32F_43G}P -11.735 2.78 -5.169 { n ala A 44 1wtoA_32F_43G}-12.896 2.647 -4.552 { ca ala A 44 1wtoA_32F_43G}-12.99 1.883 -3.317 { c ala A 44 1wtoA_32F_43G}-14.356 1.244 -3.216 { o ala A 44 1wtoA_32F_43G}-15.359 1.817 -3.668 { c ala A 44 1wtoA_32F_43G}P -14.356 1.244 -3.216 { n val A 45 1wtoA_32F_43G}-14.407 0.072 -2.613 { ca val A 45 1wtoA_32F_43G}-15.693 -0.578 -2.385 { c val A 45 1wtoA_32F_43G}-15.638 -1.082 -0.948 { o val A 45 1wtoA_32F_43G}-14.601 -1.522 -0.495 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 30 1wtoA_32F_43G}P -12.005 -1.829 0.505 { ca val A 30 1wtoA_32F_43G}P -10.985 -2.421 -0.299 { n ser A 31 1wtoA_32F_43G}P -9.496 -0.636 -1.177 { ca ser A 31 1wtoA_32F_43G}P -9.036 0.404 -2.084 { n phe A 32 1wtoA_32F_43G}P -8.453 0.389 -4.441 { ca phe A 32 1wtoA_32F_43G}P -7.741 -0.095 -5.614 { n thr A 33 1wtoA_32F_43G}P -6.376 0.808 -7.36 { ca thr A 33 1wtoA_32F_43G}P -6.048 1.717 -8.437 { n tyr A 34 1wtoA_32F_43G}P -6.493 1.594 -10.813 { ca tyr A 34 1wtoA_32F_43G}P -6.734 0.902 -12.062 { n gly A 41 1wtoA_32F_43G}P -6.626 5.57 -12.157 { ca gly A 41 1wtoA_32F_43G}P -7.933 5.782 -11.578 {"}P -7.933 5.782 -11.578 { n arg A 42 1wtoA_32F_43G}P -8.651 5.789 -9.239 { ca arg A 42 1wtoA_32F_43G}P -8.761 5.281 -7.86 { n gly A 43 1wtoA_32F_43G}P -10.463 3.884 -6.918 { ca gly A 43 1wtoA_32F_43G}P -11.797 3.523 -6.501 {"}P -11.797 3.523 -6.501 { n ala A 44 1wtoA_32F_43G}P -12.896 2.647 -4.552 { ca ala A 44 1wtoA_32F_43G}P -12.99 1.883 -3.317 { n val A 45 1wtoA_32F_43G}P -14.407 0.072 -2.613 { ca val A 45 1wtoA_32F_43G}P -15.693 -0.578 -2.385 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca val A 30 1wtoA_32F_43G}P -10.985 -2.421 -0.299 {"}-10.985 -2.421 -0.299 { ca ser A 31 1wtoA_32F_43G}-9.036 0.404 -2.084 { ca phe A 32 1wtoA_32F_43G}-7.741 -0.095 -5.614 { ca thr A 33 1wtoA_32F_43G}-6.048 1.717 -8.437 { ca tyr A 34 1wtoA_32F_43G}-6.734 0.902 -12.062 { ca gly A 41 1wtoA_32F_43G}P -7.933 5.782 -11.578 {"}-7.933 5.782 -11.578 { ca arg A 42 1wtoA_32F_43G}-8.761 5.281 -7.86 { ca gly A 43 1wtoA_32F_43G}-11.797 3.523 -6.501 { ca ala A 44 1wtoA_32F_43G}-12.99 1.883 -3.317 { ca val A 45 1wtoA_32F_43G}-15.693 -0.578 -2.385 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca val A 30 1wtoA_32F_43G}P -10.985 -2.421 -0.299 { ca ser A 31 1wtoA_32F_43G}P -9.036 0.404 -2.084 { ca phe A 32 1wtoA_32F_43G}P -7.741 -0.095 -5.614 { cb phe A 32 1wtoA_32F_43G}-8.491 -1.221 -6.357 { cg phe A 32 1wtoA_32F_43G}-9.88 -0.861 -6.768 { cd1 phe A 32 1wtoA_32F_43G}-10.125 -0.244 -7.974 { ce1 phe A 32 1wtoA_32F_43G}-11.421 0.202 -8.29 { cz phe A 32 1wtoA_32F_43G}-12.448 0.013 -7.413 { cg phe A 32 1wtoA_32F_43G}P -9.88 -0.861 -6.768 { cd2 phe A 32 1wtoA_32F_43G}-10.958 -1.05 -5.892 { ce2 phe A 32 1wtoA_32F_43G}-12.225 -0.609 -6.226 { cz phe A 32 1wtoA_32F_43G}ghost -12.448 0.013 -7.413 { ca thr A 33 1wtoA_32F_43G}P -6.048 1.717 -8.437 { ca tyr A 34 1wtoA_32F_43G}P -6.734 0.902 -12.062 { ca arg A 42 1wtoA_32F_43G}P -8.761 5.281 -7.86 { ca ala A 44 1wtoA_32F_43G}P -12.99 1.883 -3.317 { ca val A 45 1wtoA_32F_43G}P -15.693 -0.578 -2.385 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 32 1wtoA_32F_43G}P -8.491 -1.221 -6.357 {"}P -8.491 -1.221 -6.357 { cd1 phe A 32 1wtoA_32F_43G}P -10.125 -0.244 -7.974 { cd2 phe A 32 1wtoA_32F_43G}P -10.958 -1.05 -5.892 { ce1 phe A 32 1wtoA_32F_43G}P -11.421 0.202 -8.29 { ce2 phe A 32 1wtoA_32F_43G}P -12.225 -0.609 -6.226 { cz phe A 32 1wtoA_32F_43G}P -12.448 0.013 -7.413 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 32 1wtoA_32F_43G}P -7.741 -0.095 -5.614 { cb phe A 32 1wtoA_32F_43G}-8.491 -1.221 -6.357 { cg phe A 32 1wtoA_32F_43G}-9.88 -0.861 -6.768 { cd1 phe A 32 1wtoA_32F_43G}-10.125 -0.244 -7.974 { ce1 phe A 32 1wtoA_32F_43G}-11.421 0.202 -8.29 { cz phe A 32 1wtoA_32F_43G}-12.448 0.013 -7.413 { cg phe A 32 1wtoA_32F_43G}P -9.88 -0.861 -6.768 { cd2 phe A 32 1wtoA_32F_43G}-10.958 -1.05 -5.892 { ce2 phe A 32 1wtoA_32F_43G}-12.225 -0.609 -6.226 { cz phe A 32 1wtoA_32F_43G}ghost -12.448 0.013 -7.413 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 32 1wtoA_32F_43G}P -8.491 -1.221 -6.357 {"}P -8.491 -1.221 -6.357 { cd1 phe A 32 1wtoA_32F_43G}P -10.125 -0.244 -7.974 { cd2 phe A 32 1wtoA_32F_43G}P -10.958 -1.05 -5.892 { ce1 phe A 32 1wtoA_32F_43G}P -11.421 0.202 -8.29 { ce2 phe A 32 1wtoA_32F_43G}P -12.225 -0.609 -6.226 { cz phe A 32 1wtoA_32F_43G}P -12.448 0.013 -7.413 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 32 A}'P' blue -12.059 1.831 -8.35 {"}'P' blue -11.809 1.907 -8.346 {"}'P' sky -12.301 1.702 -8.094 {"}'P' sky -11.56 1.934 -8.083 {"}'P' sky -11.356 1.888 -7.827 { CZ PHE 32 A}'P' sky -12.703 1.648 -7.982 {"}'P' sky -12.448 1.668 -7.981 {"}'P' sky -12.908 1.671 -7.73 {"}'P' sky -13.086 1.642 -7.473 {"}'P' sky -13.093 1.627 -7.212 {"}'P' sky -12.9 1.64 -6.952 {"}'P' sky -12.711 1.591 -6.704 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 32 A}'P' sea -12.066 1.816 -8.089 {"}'P' sea -11.817 1.894 -8.085 {"}'P' green -12.119 1.74 -7.833 {"}'P' green -11.873 1.829 -7.829 {"}'P' sea -11.617 1.878 -7.827 {"}'P' green -11.932 1.719 -7.584 {"}'P' green -11.684 1.78 -7.581 {"}'P' sea -11.429 1.802 -7.58 {"}'P' sea -11.614 1.666 -7.35 { CZ PHE 32 A}'P' green -12.652 1.722 -7.728 {"}'P' green -12.391 1.734 -7.728 {"}'P' green -12.131 1.705 -7.729 {"}'P' green -12.836 1.718 -7.469 {"}'P' green -12.578 1.757 -7.468 {"}'P' green -12.06 1.718 -7.469 {"}'P' green -12.844 1.705 -7.208 {"}'P' green -12.587 1.745 -7.206 {"}'P' green -12.068 1.709 -7.208 {"}'P' sea -11.818 1.633 -7.211 {"}'P' green -12.644 1.689 -6.95 {"}'P' green -12.383 1.699 -6.95 {"}'P' green -12.123 1.669 -6.951 {"}'P' sea -11.871 1.6 -6.954 {"}'P' sea -12.456 1.613 -6.703 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 32 A}'P' P -12.318 1.757 -7.468 {"}'P' -12.318 1.748 -7.467 {"}'P' P -12.326 1.746 -7.206 {"}'P' -12.327 1.734 -7.208 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 43 A}'P' blue -12.144 2.211 -8.209 {"}'P' sky -11.666 2.236 -8.023 {"}'P' sky -12.393 2.015 -8.032 {"}'P' sky -11.482 2.213 -7.802 {"}'P' sky -12.976 2.004 -7.563 {"}'P' sky -12.976 1.982 -7.043 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 43 A}'P' sea -11.883 2.093 -8.029 {"}'P' sea -12.133 2.017 -8.032 {"}'P' sea -11.672 2.044 -7.809 {"}'P' green -11.897 1.926 -7.814 {"}'P' green -12.144 1.866 -7.817 {"}'P' green -12.398 1.866 -7.817 {"}'P' sea -12.645 1.926 -7.814 {"}'P' sea -11.553 2.014 -7.563 {"}'P' green -11.769 1.877 -7.569 {"}'P' green -12.009 1.791 -7.573 {"}'P' green -12.263 1.761 -7.574 {"}'P' green -12.517 1.788 -7.573 {"}'P' green -12.759 1.87 -7.569 {"}'P' sea -11.723 1.856 -7.309 {"}'P' green -11.958 1.763 -7.313 {"}'P' green -12.704 1.803 -7.311 {"}'P' sea -12.928 1.922 -7.306 {"}'P' sea -11.769 1.854 -7.049 {"}'P' green -12.009 1.768 -7.052 {"}'P' green -12.263 1.738 -7.054 {"}'P' green -12.517 1.765 -7.052 {"}'P' green -12.759 1.847 -7.049 {"}'P' sea -12.144 1.821 -6.802 {"}'P' sea -12.398 1.821 -6.802 {"}'P' sea -12.645 1.882 -6.8 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 43 A}'P' P -12.208 1.722 -7.315 {"}'P' -12.208 1.733 -7.314 {"}'P' P -12.46 1.736 -7.314 {"}'P' -12.458 1.748 -7.314 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 32 A}'M' green -9.231 2.486 -7.153 {"}'M' green -8.802 3.101 -7.126 {"}'M' green -8.715 3.262 -6.878 {"}'M' green -9.327 2.446 -6.147 {"}'M' green -8.917 3.084 -6.119 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 32 A}'M' greentint -9.131 2.719 -7.143 {"}'M' greentint -8.986 2.927 -7.134 {"}'M' greentint -9.329 2.472 -6.913 {"}'M' greentint -9.236 2.71 -6.902 {"}'M' greentint -9.098 2.926 -6.893 {"}'M' greentint -8.923 3.112 -6.885 {"}'M' greentint -9.405 2.346 -6.664 {"}'M' greentint -9.335 2.593 -6.653 {"}'M' greentint -9.22 2.823 -6.643 {"}'M' greentint -9.065 3.028 -6.634 {"}'M' greentint -8.875 3.201 -6.627 {"}'M' greentint -9.407 2.326 -6.406 {"}'M' greentint -9.338 2.574 -6.395 {"}'M' greentint -9.225 2.805 -6.385 {"}'M' greentint -9.071 3.011 -6.376 {"}'M' greentint -8.882 3.185 -6.369 {"}'M' greentint -9.232 2.684 -6.136 {"}'M' greentint -9.093 2.899 -6.127 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 43 A}'M' green -8.928 3 -7.164 {"}'M' green -9.212 2.576 -7.183 {"}'M' green -8.792 3.236 -6.913 {"}'M' green -9.441 2.277 -6.695 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 43 A}'M' greentint -9.038 2.766 -7.175 {"}'M' greentint -8.825 2.987 -6.923 {"}'M' greentint -8.921 2.754 -6.934 {"}'M' greentint -9.075 2.554 -6.942 {"}'M' greentint -9.275 2.401 -6.949 {"}'M' greentint -8.787 2.984 -6.665 {"}'M' greentint -8.878 2.751 -6.675 {"}'M' greentint -9.024 2.547 -6.684 {"}'M' greentint -9.215 2.386 -6.691 {"}'M' greentint -8.758 3.233 -6.654 {"}'M' greentint -8.825 2.964 -6.406 {"}'M' greentint -8.921 2.731 -6.416 {"}'M' greentint -9.075 2.531 -6.425 {"}'M' greentint -9.275 2.378 -6.432 {"}'M' greentint -8.792 3.214 -6.395 {"}'M' greentint -8.928 2.956 -6.165 {"}'M' greentint -9.038 2.723 -6.175 {"}'M' greentint -9.212 2.532 -6.184 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 32 A}'M' green -9.98 1.193 -4.327 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 32 A}'M' greentint -9.872 1.347 -5.08 {"}'M' greentint -9.798 1.594 -5.069 {"}'M' greentint -9.654 1.808 -5.06 {"}'M' greentint -9.454 1.971 -5.053 {"}'M' greentint -9.98 1.215 -4.845 {"}'M' greentint -9.947 1.465 -4.834 {"}'M' greentint -9.851 1.698 -4.824 {"}'M' greentint -9.697 1.898 -4.815 {"}'M' greentint -9.497 2.051 -4.808 {"}'M' greentint -10.007 1.321 -4.581 {"}'M' greentint -9.947 1.564 -4.57 {"}'M' greentint -9.828 1.785 -4.561 {"}'M' greentint -9.658 1.969 -4.553 {"}'M' greentint -9.447 2.105 -4.547 {"}'M' greentint -9.947 1.442 -4.317 {"}'M' greentint -9.851 1.675 -4.306 {"}'M' greentint -9.697 1.875 -4.298 {"}'M' greentint -9.497 2.028 -4.291 {"}'M' greentint -9.798 1.55 -4.07 {"}'M' greentint -9.654 1.765 -4.061 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 43 A}'M' green -9.889 1.274 -5.139 {"}'M' green -10.048 1.099 -4.634 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 43 A}'M' greentint -9.424 1.872 -5.113 {"}'M' greentint -9.54 1.644 -5.123 {"}'M' greentint -9.697 1.442 -5.132 {"}'M' greentint -9.307 2.098 -4.849 {"}'M' greentint -9.377 1.851 -4.86 {"}'M' greentint -9.492 1.62 -4.87 {"}'M' greentint -9.647 1.415 -4.879 {"}'M' greentint -9.837 1.242 -4.887 {"}'M' greentint -9.305 2.095 -4.591 {"}'M' greentint -9.374 1.847 -4.602 {"}'M' greentint -9.487 1.616 -4.612 {"}'M' greentint -9.641 1.41 -4.621 {"}'M' greentint -9.83 1.236 -4.628 {"}'M' greentint -9.355 2.077 -4.337 {"}'M' greentint -9.427 1.831 -4.348 {"}'M' greentint -9.544 1.604 -4.358 {"}'M' greentint -9.702 1.403 -4.367 {"}'M' greentint -9.896 1.235 -4.374 {"}'M' greentint -9.522 1.834 -4.107 {"}'M' greentint -9.644 1.612 -4.116 {"}'M' greentint -9.808 1.419 -4.125 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ile A 46 1wzoA_71F_48G}P -5.943 7.394 -10.059 {"}-5.943 7.394 -10.059 { ca ile A 46 1wzoA_71F_48G}-7.317 6.962 -9.907 { c ile A 46 1wzoA_71F_48G}-7.433 5.809 -8.925 { o ile A 46 1wzoA_71F_48G}-6.814 4.764 -9.122 { c ile A 46 1wzoA_71F_48G}P -7.433 5.809 -8.925 { n leu A 47 1wzoA_71F_48G}-8.214 6.004 -7.867 { ca leu A 47 1wzoA_71F_48G}-8.431 4.944 -6.89 { c leu A 47 1wzoA_71F_48G}-9.894 4.547 -6.902 { o leu A 47 1wzoA_71F_48G}-10.778 5.39 -7.071 { c leu A 47 1wzoA_71F_48G}P -9.894 4.547 -6.902 { n gly A 48 1wzoA_71F_48G}-10.151 3.261 -6.711 { ca gly A 48 1wzoA_71F_48G}-11.524 2.803 -6.669 { c gly A 48 1wzoA_71F_48G}-11.746 2.115 -5.342 { o gly A 48 1wzoA_71F_48G}-10.794 1.866 -4.59 { c gly A 48 1wzoA_71F_48G}P -11.746 2.115 -5.342 { n val A 49 1wzoA_71F_48G}-13.003 1.823 -5.03 { ca val A 49 1wzoA_71F_48G}-13.315 1.128 -3.796 { c val A 49 1wzoA_71F_48G}-14.231 -0.046 -4.125 { o val A 49 1wzoA_71F_48G}-15.244 0.104 -4.812 { c val A 49 1wzoA_71F_48G}P -14.231 -0.046 -4.125 { n ala A 50 1wzoA_71F_48G}-13.85 -1.229 -3.669 { ca ala A 50 1wzoA_71F_48G}-14.652 -2.42 -3.908 { c ala A 50 1wzoA_71F_48G}-15.634 -2.629 -2.754 { o ala A 50 1wzoA_71F_48G}-15.485 -2.043 -1.681 { n ala A 69 1wzoA_71F_48G}P -12 -0.955 0.782 {"}-12 -0.955 0.782 { ca ala A 69 1wzoA_71F_48G}-11.145 -1.872 0.026 { c ala A 69 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lys A 73 1wzoA_71F_48G}-5.726 3.918 -12.537 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 46 1wzoA_71F_48G}P -5.943 7.394 -10.059 { ca ile A 46 1wzoA_71F_48G}P -7.317 6.962 -9.907 { n leu A 47 1wzoA_71F_48G}P -8.214 6.004 -7.867 { ca leu A 47 1wzoA_71F_48G}P -8.431 4.944 -6.89 { n gly A 48 1wzoA_71F_48G}P -10.151 3.261 -6.711 { ca gly A 48 1wzoA_71F_48G}P -11.524 2.803 -6.669 {"}P -11.524 2.803 -6.669 { n val A 49 1wzoA_71F_48G}P -13.003 1.823 -5.03 { ca val A 49 1wzoA_71F_48G}P -13.315 1.128 -3.796 { n ala A 50 1wzoA_71F_48G}P -13.85 -1.229 -3.669 { ca ala A 50 1wzoA_71F_48G}P -14.652 -2.42 -3.908 { n ala A 69 1wzoA_71F_48G}P -12 -0.955 0.782 { ca ala A 69 1wzoA_71F_48G}P -11.145 -1.872 0.026 { n leu A 70 1wzoA_71F_48G}P -9.65 -0.341 -1.101 { ca leu A 70 1wzoA_71F_48G}P -9.115 0.457 -2.195 { n phe A 71 1wzoA_71F_48G}P -8.423 0.109 -4.493 { ca phe A 71 1wzoA_71F_48G}P -7.672 -0.499 -5.586 { n trp A 72 1wzoA_71F_48G}P -6.412 0.29 -7.489 { ca trp A 72 1wzoA_71F_48G}P -5.944 1.248 -8.478 { n lys A 73 1wzoA_71F_48G}P -6.608 2.008 -10.674 { ca lys A 73 1wzoA_71F_48G}P -6.94 1.893 -12.095 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ile A 46 1wzoA_71F_48G}P -7.317 6.962 -9.907 {"}-7.317 6.962 -9.907 { ca leu A 47 1wzoA_71F_48G}-8.431 4.944 -6.89 { ca gly A 48 1wzoA_71F_48G}-11.524 2.803 -6.669 { ca val A 49 1wzoA_71F_48G}-13.315 1.128 -3.796 { ca ala A 50 1wzoA_71F_48G}-14.652 -2.42 -3.908 { ca ala A 69 1wzoA_71F_48G}P -11.145 -1.872 0.026 {"}-11.145 -1.872 0.026 { ca leu A 70 1wzoA_71F_48G}-9.115 0.457 -2.195 { ca phe A 71 1wzoA_71F_48G}-7.672 -0.499 -5.586 { ca trp A 72 1wzoA_71F_48G}-5.944 1.248 -8.478 { ca lys A 73 1wzoA_71F_48G}-6.94 1.893 -12.095 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ile A 46 1wzoA_71F_48G}P -7.317 6.962 -9.907 { ca leu A 47 1wzoA_71F_48G}P -8.431 4.944 -6.89 { ca val A 49 1wzoA_71F_48G}P -13.315 1.128 -3.796 { ca ala A 50 1wzoA_71F_48G}P -14.652 -2.42 -3.908 { ca ala A 69 1wzoA_71F_48G}P -11.145 -1.872 0.026 { ca leu A 70 1wzoA_71F_48G}P -9.115 0.457 -2.195 { ca phe A 71 1wzoA_71F_48G}P -7.672 -0.499 -5.586 { cb phe A 71 1wzoA_71F_48G}-8.413 -1.674 -6.249 { cg phe A 71 1wzoA_71F_48G}-9.686 -1.291 -6.944 { cd1 phe A 71 1wzoA_71F_48G}-10.899 -1.306 -6.259 { ce1 phe A 71 1wzoA_71F_48G}-12.086 -0.953 -6.901 { cz phe A 71 1wzoA_71F_48G}-12.066 -0.58 -8.244 { cg phe A 71 1wzoA_71F_48G}P -9.686 -1.291 -6.944 { cd2 phe A 71 1wzoA_71F_48G}-9.675 -0.917 -8.286 { ce2 phe A 71 1wzoA_71F_48G}-10.861 -0.562 -8.939 { cz phe A 71 1wzoA_71F_48G}ghost -12.066 -0.58 -8.244 { ca trp A 72 1wzoA_71F_48G}P -5.944 1.248 -8.478 { ca lys A 73 1wzoA_71F_48G}P -6.94 1.893 -12.095 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 71 1wzoA_71F_48G}P -8.413 -1.674 -6.249 {"}P -8.413 -1.674 -6.249 { cd1 phe A 71 1wzoA_71F_48G}P -10.899 -1.306 -6.259 { cd2 phe A 71 1wzoA_71F_48G}P -9.675 -0.917 -8.286 { ce1 phe A 71 1wzoA_71F_48G}P -12.086 -0.953 -6.901 { ce2 phe A 71 1wzoA_71F_48G}P -10.861 -0.562 -8.939 { cz phe A 71 1wzoA_71F_48G}P -12.066 -0.58 -8.244 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 71 1wzoA_71F_48G}P -7.672 -0.499 -5.586 { cb phe A 71 1wzoA_71F_48G}-8.413 -1.674 -6.249 { cg phe A 71 1wzoA_71F_48G}-9.686 -1.291 -6.944 { cd1 phe A 71 1wzoA_71F_48G}-10.899 -1.306 -6.259 { ce1 phe A 71 1wzoA_71F_48G}-12.086 -0.953 -6.901 { cz phe A 71 1wzoA_71F_48G}-12.066 -0.58 -8.244 { cg phe A 71 1wzoA_71F_48G}P -9.686 -1.291 -6.944 { cd2 phe A 71 1wzoA_71F_48G}-9.675 -0.917 -8.286 { ce2 phe A 71 1wzoA_71F_48G}-10.861 -0.562 -8.939 { cz phe A 71 1wzoA_71F_48G}ghost -12.066 -0.58 -8.244 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 71 1wzoA_71F_48G}P -8.413 -1.674 -6.249 {"}P -8.413 -1.674 -6.249 { cd1 phe A 71 1wzoA_71F_48G}P -10.899 -1.306 -6.259 { cd2 phe A 71 1wzoA_71F_48G}P -9.675 -0.917 -8.286 { ce1 phe A 71 1wzoA_71F_48G}P -12.086 -0.953 -6.901 { ce2 phe A 71 1wzoA_71F_48G}P -10.861 -0.562 -8.939 { cz phe A 71 1wzoA_71F_48G}P -12.066 -0.58 -8.244 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 71 A}'P' sky -12.216 0.791 -6.956 {"}'P' sky -11.956 0.791 -6.956 {"}'P' sky -11.698 0.752 -6.957 {"}'P' blue -11.448 0.676 -6.961 { CE2 PHE 71 A}'P' sky -11.313 1.065 -8.478 {"}'P' blue -11.057 1.114 -8.476 {"}'P' sky -11.124 1.016 -8.23 {"}'P' blue -10.869 1.038 -8.229 {"}'P' sky -11.054 0.902 -7.999 {"}'P' blue -10.797 0.913 -7.999 { CZ PHE 71 A}'P' sky -12.577 0.937 -7.538 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 71 A}'P' sea -12.196 1.164 -8.299 {"}'P' green -11.936 1.164 -8.299 {"}'P' green -11.678 1.125 -8.3 {"}'P' sea -11.428 1.049 -8.304 {"}'P' sea -12.462 1.112 -8.039 {"}'P' green -12.205 1.152 -8.037 {"}'P' green -11.436 1.04 -8.042 {"}'P' sea -11.201 0.928 -8.047 {"}'P' sea -12.518 1.047 -7.783 {"}'P' green -12.262 1.096 -7.781 {"}'P' sea -11.251 0.9 -7.79 {"}'P' green -12.329 0.998 -7.535 {"}'P' green -11.57 0.942 -7.538 {"}'P' sea -11.334 0.846 -7.542 {"}'P' sea -12.259 0.884 -7.304 {"}'P' green -12.002 0.895 -7.304 {"}'P' green -11.747 0.862 -7.305 {"}'P' sea -11.501 0.787 -7.308 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 71 A}'P' P -11.944 1.153 -8.037 {"}'P' -11.946 1.128 -8.04 {"}'P' P -11.686 1.116 -8.039 {"}'P' -11.69 1.097 -8.041 {"}'P' P -12.001 1.106 -7.781 {"}'P' -12.002 1.062 -7.793 {"}'P' P -11.741 1.076 -7.782 {"}'P' -11.75 1.03 -7.795 {"}'P' P -11.489 1.007 -7.785 {"}'P' -11.49 1.004 -7.786 {"}'P' P -12.074 1.02 -7.534 {"}'P' -12.074 1.008 -7.539 {"}'P' P -11.819 1.001 -7.535 {"}'P' -11.823 0.975 -7.546 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 48 A}'P' blue -11.12 1.457 -8.259 {"}'P' sky -11.126 1.265 -8.045 {"}'P' blue -11.007 1.235 -7.799 {"}'P' sky -11.177 1.077 -7.545 {"}'P' sky -11.598 1.042 -7.038 {"}'P' sky -11.852 1.042 -7.038 {"}'P' sky -12.099 1.103 -7.036 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 48 A}'P' green -11.587 1.238 -8.268 {"}'P' green -11.847 1.236 -8.268 {"}'P' green -12.097 1.307 -8.265 {"}'P' green -11.351 1.147 -8.05 {"}'P' green -12.324 1.265 -8.045 {"}'P' sea -11.223 1.098 -7.805 {"}'P' green -11.463 1.012 -7.809 {"}'P' green -12.43 1.225 -7.799 {"}'P' green -11.412 0.984 -7.549 {"}'P' green -12.158 1.024 -7.547 {"}'P' green -12.382 1.143 -7.542 {"}'P' sea -11.463 0.989 -7.288 {"}'P' green -11.717 0.959 -7.29 {"}'P' green -11.971 0.986 -7.288 {"}'P' sea -12.213 1.068 -7.285 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 48 A}'P' P -11.598 1.087 -8.053 {"}'P' -11.598 1.09 -8.051 {"}'P' P -11.852 1.087 -8.053 {"}'P' -11.849 1.112 -8.039 {"}'P' P -12.099 1.147 -8.05 {"}'P' -12.097 1.152 -8.047 {"}'P' P -11.717 0.982 -7.81 {"}'P' -11.717 1.026 -7.798 {"}'P' P -11.971 1.009 -7.809 {"}'P' -11.96 1.056 -7.795 {"}'P' P -12.213 1.091 -7.805 {"}'P' -12.209 1.098 -7.803 {"}'P' P -11.662 0.943 -7.551 {"}'P' -11.662 0.957 -7.55 {"}'P' P -11.914 0.957 -7.55 {"}'P' -11.91 0.985 -7.549 @subgroup {1->2} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { O PHE 71 A}'M' P -9.127 2.408 -6.687 {"}'M' -9.116 2.401 -6.686 {"}'M' P -9.132 2.39 -6.429 {"}'M' -9.131 2.389 -6.429 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 71 A}'M' greentint -9.189 1.823 -7.208 {"}'M' greentint -9.138 2.071 -7.197 {"}'M' greentint -9.038 2.304 -7.187 {"}'M' greentint -8.893 2.512 -7.178 {"}'M' greentint -8.709 2.686 -7.17 {"}'M' greentint -9.283 1.805 -6.968 {"}'M' greentint -9.236 2.057 -6.957 {"}'M' greentint -9.143 2.295 -6.946 {"}'M' greentint -9.005 2.511 -6.937 {"}'M' greentint -8.83 2.697 -6.929 {"}'M' greentint -8.622 2.847 -6.922 {"}'M' greentint -9.336 1.675 -6.719 {"}'M' greentint -9.312 1.931 -6.708 {"}'M' greentint -9.242 2.178 -6.697 {"}'M' greentint -8.972 2.613 -6.678 {"}'M' greentint -8.782 2.786 -6.671 {"}'M' greentint -8.563 2.921 -6.665 {"}'M' greentint -9.336 1.655 -6.461 {"}'M' greentint -9.314 1.911 -6.45 {"}'M' greentint -9.245 2.159 -6.439 {"}'M' greentint -8.978 2.596 -6.42 {"}'M' greentint -8.789 2.77 -6.413 {"}'M' greentint -8.571 2.906 -6.407 {"}'M' greentint -9.282 1.78 -6.202 {"}'M' greentint -9.234 2.031 -6.191 {"}'M' greentint -9.139 2.269 -6.18 {"}'M' greentint -9 2.484 -6.171 {"}'M' greentint -8.824 2.669 -6.163 {"}'M' greentint -8.615 2.817 -6.156 {"}'M' greentint -9.14 2.009 -5.951 {"}'M' greentint -9.042 2.242 -5.94 {"}'M' greentint -8.898 2.451 -5.931 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H GLY 48 A}'M' P -8.579 2.076 -6.61 {"}'M' -8.598 2.086 -6.609 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 48 A}'M' greentint -8.8 2.326 -7.307 {"}'M' greentint -8.936 2.105 -7.316 {"}'M' greentint -8.629 2.325 -7.099 {"}'M' greentint -8.739 2.091 -7.11 {"}'M' greentint -8.913 1.901 -7.118 {"}'M' greentint -9.135 1.769 -7.124 {"}'M' greentint -8.593 2.58 -7.088 {"}'M' greentint -8.526 2.312 -6.858 {"}'M' greentint -8.622 2.079 -6.869 {"}'M' greentint -8.776 1.879 -6.877 {"}'M' greentint -8.976 1.726 -6.884 {"}'M' greentint -9.209 1.629 -6.888 {"}'M' greentint -8.526 2.811 -6.837 {"}'M' greentint -8.493 2.561 -6.848 {"}'M' greentint -8.488 2.309 -6.6 {"}'M' greentint -8.725 1.872 -6.619 {"}'M' greentint -8.916 1.711 -6.626 {"}'M' greentint -9.142 1.602 -6.63 {"}'M' greentint -8.492 2.806 -6.578 {"}'M' greentint -8.459 2.558 -6.589 {"}'M' greentint -8.526 2.289 -6.341 {"}'M' greentint -8.622 2.056 -6.351 {"}'M' greentint -8.776 1.856 -6.36 {"}'M' greentint -8.976 1.703 -6.367 {"}'M' greentint -9.209 1.607 -6.371 {"}'M' greentint -8.526 2.788 -6.32 {"}'M' greentint -8.493 2.539 -6.33 {"}'M' greentint -8.629 2.281 -6.1 {"}'M' greentint -8.739 2.048 -6.11 {"}'M' greentint -8.913 1.857 -6.119 {"}'M' greentint -9.135 1.726 -6.125 {"}'M' greentint -8.593 2.536 -6.089 {"}'M' greentint -8.8 2.264 -5.894 {"}'M' greentint -8.936 2.043 -5.903 {"}'M' greentint -9.144 1.887 -5.91 {"}'M' greentint -8.752 2.519 -5.883 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 71 A}'M' green -9.867 1.014 -5.266 {"}'M' green -9.449 1.594 -4.24 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 71 A}'M' greentint -9.793 1.261 -5.255 {"}'M' greentint -9.649 1.475 -5.246 {"}'M' greentint -9.975 0.882 -5.031 {"}'M' greentint -9.942 1.132 -5.02 {"}'M' greentint -9.846 1.365 -5.01 {"}'M' greentint -9.692 1.565 -5.001 {"}'M' greentint -9.492 1.718 -4.994 {"}'M' greentint -10 0.738 -4.778 {"}'M' greentint -10.002 0.988 -4.767 {"}'M' greentint -9.942 1.231 -4.756 {"}'M' greentint -9.823 1.452 -4.747 {"}'M' greentint -9.653 1.636 -4.739 {"}'M' greentint -9.442 1.772 -4.733 {"}'M' greentint -9.975 0.86 -4.513 {"}'M' greentint -9.942 1.109 -4.503 {"}'M' greentint -9.846 1.342 -4.492 {"}'M' greentint -9.692 1.542 -4.484 {"}'M' greentint -9.492 1.695 -4.477 {"}'M' greentint -9.867 0.97 -4.267 {"}'M' greentint -9.793 1.217 -4.256 {"}'M' greentint -9.649 1.432 -4.247 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 48 A}'M' green -9.566 1.641 -5.224 {"}'M' green -9.931 0.986 -5.253 {"}'M' green -10.006 0.792 -5.02 {"}'M' green -9.472 1.595 -4.218 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 48 A}'M' greentint -9.642 1.399 -5.235 {"}'M' greentint -9.765 1.178 -5.245 {"}'M' greentint -9.47 1.636 -4.984 {"}'M' greentint -9.541 1.39 -4.994 {"}'M' greentint -9.657 1.162 -5.004 {"}'M' greentint -9.814 0.96 -5.013 {"}'M' greentint -9.424 1.616 -4.73 {"}'M' greentint -9.494 1.369 -4.741 {"}'M' greentint -9.609 1.138 -4.751 {"}'M' greentint -9.764 0.933 -4.76 {"}'M' greentint -9.954 0.76 -4.768 {"}'M' greentint -9.422 1.613 -4.472 {"}'M' greentint -9.491 1.365 -4.483 {"}'M' greentint -9.604 1.134 -4.493 {"}'M' greentint -9.758 0.928 -4.502 {"}'M' greentint -9.947 0.754 -4.509 {"}'M' greentint -9.544 1.349 -4.229 {"}'M' greentint -9.661 1.122 -4.239 {"}'M' greentint -9.819 0.921 -4.248 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ala A 520 1x1iA_640Y_522}P -8.686 5.118 -12.855 {"}-8.686 5.118 -12.855 { ca ala A 520 1x1iA_640Y_522}-9.844 4.755 -12.053 { c ala A 520 1x1iA_640Y_522}-9.386 4.433 -10.637 { o ala A 520 1x1iA_640Y_522}-8.503 3.6 -10.44 { c ala A 520 1x1iA_640Y_522}P -9.386 4.433 -10.637 { n leu A 521 1x1iA_640Y_522}-9.98 5.108 -9.656 { ca leu A 521 1x1iA_640Y_522}-9.633 4.886 -8.258 { c leu A 521 1x1iA_640Y_522}-10.86 4.507 -7.448 { o leu A 521 1x1iA_640Y_522}-11.956 5.026 -7.666 { c leu A 521 1x1iA_640Y_522}P -10.86 4.507 -7.448 { n gly A 522 1x1iA_640Y_522}-10.662 3.606 -6.498 { ca gly A 522 1x1iA_640Y_522}-11.755 3.186 -5.647 { c gly A 522 1x1iA_640Y_522}-11.245 3.142 -4.225 { o gly A 522 1x1iA_640Y_522}-10.129 2.685 -3.985 { c gly A 522 1x1iA_640Y_522}P -11.245 3.142 -4.225 { n ser A 523 1x1iA_640Y_522}-12.045 3.633 -3.283 { ca ser A 523 1x1iA_640Y_522}-11.641 3.63 -1.882 { c ser A 523 1x1iA_640Y_522}-12.841 3.408 -0.973 { o ser A 523 1x1iA_640Y_522}-13.984 3.453 -1.419 { c ser A 523 1x1iA_640Y_522}P -12.841 3.408 -0.973 { n gly A 524 1x1iA_640Y_522}-12.568 3.165 0.305 { ca gly A 524 1x1iA_640Y_522}-13.631 2.952 1.27 { c gly A 524 1x1iA_640Y_522}-14.612 1.866 0.879 { o gly A 524 1x1iA_640Y_522}-15.794 1.953 1.2 { n ala A 638 1x1iA_640Y_522}P -11.582 -1.356 1.564 {"}-11.582 -1.356 1.564 { ca ala A 638 1x1iA_640Y_522}-10.773 -1.868 0.464 { c ala A 638 1x1iA_640Y_522}-10.626 -0.771 -0.593 { o ala A 638 1x1iA_640Y_522}-11.334 0.24 -0.559 { c ala A 638 1x1iA_640Y_522}P -10.626 -0.771 -0.593 { n ser A 639 1x1iA_640Y_522}-9.708 -0.97 -1.531 { ca ser A 639 1x1iA_640Y_522}-9.469 0.028 -2.564 { c ser A 639 1x1iA_640Y_522}-8.874 -0.606 -3.808 { o ser A 639 1x1iA_640Y_522}-8.51 -1.781 -3.805 { c ser A 639 1x1iA_640Y_522}P -8.874 -0.606 -3.808 { n tyr A 640 1x1iA_640Y_522}-8.796 0.182 -4.875 { ca tyr A 640 1x1iA_640Y_522}-8.21 -0.259 -6.135 { c tyr A 640 1x1iA_640Y_522}-7.728 0.958 -6.906 { o tyr A 640 1x1iA_640Y_522}-8.121 2.094 -6.621 { c tyr A 640 1x1iA_640Y_522}P -7.728 0.958 -6.906 { n gly A 641 1x1iA_640Y_522}-6.877 0.706 -7.888 { ca gly A 641 1x1iA_640Y_522}-6.362 1.776 -8.713 { c gly A 641 1x1iA_640Y_522}-5.777 1.205 -9.985 { o gly A 641 1x1iA_640Y_522}-4.887 0.352 -9.938 { c gly A 641 1x1iA_640Y_522}P -5.777 1.205 -9.985 { n tyr A 642 1x1iA_640Y_522}-6.297 1.638 -11.127 { ca tyr A 642 1x1iA_640Y_522}-5.771 1.166 -12.401 { c tyr A 642 1x1iA_640Y_522}-5.839 2.26 -13.444 { o tyr A 642 1x1iA_640Y_522}-6.602 3.218 -13.312 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 520 1x1iA_640Y_522}P -8.686 5.118 -12.855 { ca ala A 520 1x1iA_640Y_522}P -9.844 4.755 -12.053 { n leu A 521 1x1iA_640Y_522}P -9.98 5.108 -9.656 { ca leu A 521 1x1iA_640Y_522}P -9.633 4.886 -8.258 { n gly A 522 1x1iA_640Y_522}P -10.662 3.606 -6.498 { ca gly A 522 1x1iA_640Y_522}P -11.755 3.186 -5.647 {"}P -11.755 3.186 -5.647 { n ser A 523 1x1iA_640Y_522}P -12.045 3.633 -3.283 { ca ser A 523 1x1iA_640Y_522}P -11.641 3.63 -1.882 { n gly A 524 1x1iA_640Y_522}P -12.568 3.165 0.305 { ca gly A 524 1x1iA_640Y_522}P -13.631 2.952 1.27 {"}P -13.631 2.952 1.27 { n ala A 638 1x1iA_640Y_522}P -11.582 -1.356 1.564 { ca ala A 638 1x1iA_640Y_522}P -10.773 -1.868 0.464 { n ser A 639 1x1iA_640Y_522}P -9.708 -0.97 -1.531 { ca ser A 639 1x1iA_640Y_522}P -9.469 0.028 -2.564 { n tyr A 640 1x1iA_640Y_522}P -8.796 0.182 -4.875 { ca tyr A 640 1x1iA_640Y_522}P -8.21 -0.259 -6.135 { n gly A 641 1x1iA_640Y_522}P -6.877 0.706 -7.888 { ca gly A 641 1x1iA_640Y_522}P -6.362 1.776 -8.713 {"}P -6.362 1.776 -8.713 { n tyr A 642 1x1iA_640Y_522}P -6.297 1.638 -11.127 { ca tyr A 642 1x1iA_640Y_522}P -5.771 1.166 -12.401 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ala A 520 1x1iA_640Y_522}P -9.844 4.755 -12.053 {"}-9.844 4.755 -12.053 { ca leu A 521 1x1iA_640Y_522}-9.633 4.886 -8.258 { ca gly A 522 1x1iA_640Y_522}-11.755 3.186 -5.647 { ca ser A 523 1x1iA_640Y_522}-11.641 3.63 -1.882 { ca gly A 524 1x1iA_640Y_522}-13.631 2.952 1.27 { ca ala A 638 1x1iA_640Y_522}P -10.773 -1.868 0.464 {"}-10.773 -1.868 0.464 { ca ser A 639 1x1iA_640Y_522}-9.469 0.028 -2.564 { ca tyr A 640 1x1iA_640Y_522}-8.21 -0.259 -6.135 { ca gly A 641 1x1iA_640Y_522}-6.362 1.776 -8.713 { ca tyr A 642 1x1iA_640Y_522}-5.771 1.166 -12.401 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ala A 520 1x1iA_640Y_522}P -9.844 4.755 -12.053 { ca leu A 521 1x1iA_640Y_522}P -9.633 4.886 -8.258 { ca ser A 523 1x1iA_640Y_522}P -11.641 3.63 -1.882 { ca ala A 638 1x1iA_640Y_522}P -10.773 -1.868 0.464 { ca ser A 639 1x1iA_640Y_522}P -9.469 0.028 -2.564 { ca tyr A 640 1x1iA_640Y_522}P -8.21 -0.259 -6.135 { cb tyr A 640 1x1iA_640Y_522}-9.222 -1.034 -6.991 { cg tyr A 640 1x1iA_640Y_522}-10.381 -0.211 -7.506 { cd1 tyr A 640 1x1iA_640Y_522}-10.216 0.697 -8.56 { ce1 tyr A 640 1x1iA_640Y_522}-11.284 1.487 -9.008 { cz tyr A 640 1x1iA_640Y_522}-12.527 1.363 -8.398 { oh tyr A 640 1x1iA_640Y_522}-13.577 2.157 -8.788 { cg tyr A 640 1x1iA_640Y_522}P -10.381 -0.211 -7.506 { cd2 tyr A 640 1x1iA_640Y_522}-11.639 -0.315 -6.921 { ce2 tyr A 640 1x1iA_640Y_522}-12.712 0.464 -7.361 { cz tyr A 640 1x1iA_640Y_522}ghost -12.527 1.363 -8.398 { ca tyr A 642 1x1iA_640Y_522}P -5.771 1.166 -12.401 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 640 1x1iA_640Y_522}P -9.222 -1.034 -6.991 {"}P -9.222 -1.034 -6.991 { cd1 tyr A 640 1x1iA_640Y_522}P -10.216 0.697 -8.56 { cd2 tyr A 640 1x1iA_640Y_522}P -11.639 -0.315 -6.921 { ce1 tyr A 640 1x1iA_640Y_522}P -11.284 1.487 -9.008 { ce2 tyr A 640 1x1iA_640Y_522}P -12.712 0.464 -7.361 { oh tyr A 640 1x1iA_640Y_522}P -13.577 2.157 -8.788 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 640 1x1iA_640Y_522}P -8.21 -0.259 -6.135 { cb tyr A 640 1x1iA_640Y_522}-9.222 -1.034 -6.991 { cg tyr A 640 1x1iA_640Y_522}-10.381 -0.211 -7.506 { cd1 tyr A 640 1x1iA_640Y_522}-10.216 0.697 -8.56 { ce1 tyr A 640 1x1iA_640Y_522}-11.284 1.487 -9.008 { cz tyr A 640 1x1iA_640Y_522}-12.527 1.363 -8.398 { oh tyr A 640 1x1iA_640Y_522}-13.577 2.157 -8.788 { cg tyr A 640 1x1iA_640Y_522}P -10.381 -0.211 -7.506 { cd2 tyr A 640 1x1iA_640Y_522}-11.639 -0.315 -6.921 { ce2 tyr A 640 1x1iA_640Y_522}-12.712 0.464 -7.361 { cz tyr A 640 1x1iA_640Y_522}ghost -12.527 1.363 -8.398 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 640 1x1iA_640Y_522}P -9.222 -1.034 -6.991 {"}P -9.222 -1.034 -6.991 { cd1 tyr A 640 1x1iA_640Y_522}P -10.216 0.697 -8.56 { cd2 tyr A 640 1x1iA_640Y_522}P -11.639 -0.315 -6.921 { ce1 tyr A 640 1x1iA_640Y_522}P -11.284 1.487 -9.008 { ce2 tyr A 640 1x1iA_640Y_522}P -12.712 0.464 -7.361 { oh tyr A 640 1x1iA_640Y_522}P -13.577 2.157 -8.788 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 640 A}'P' green -11.314 1.341 -6.459 {"}'P' green -11.392 1.266 -6.212 {"}'P' green -11.575 1.16 -5.981 {"}'P' sea -11.32 1.127 -5.982 {"}'P' green -12.094 0.926 -5.775 {"}'P' green -11.842 0.989 -5.772 {"}'P' sea -11.582 1.003 -5.771 { CZ TYR 640 A}'P' green -11.579 2.027 -7.085 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CD2 TYR 640 A}'P' P -11.647 1.285 -6.211 {"}'P' -11.647 1.235 -6.233 {"}'P' P -11.832 1.149 -5.981 {"}'P' -11.827 1.115 -6.003 { CE2 TYR 640 A}'P' P -11.678 1.803 -6.913 {"}'P' -11.69 1.787 -6.918 {"}'P' P -12.975 2.042 -6.652 {"}'P' -12.97 2.015 -6.664 {"}'P' P -12.72 2.064 -6.651 {"}'P' -12.72 1.952 -6.701 {"}'P' P -12.465 2.045 -6.652 {"}'P' -12.492 1.873 -6.729 {"}'P' P -11.98 1.89 -6.659 {"}'P' -12.061 1.732 -6.737 {"}'P' P -11.761 1.758 -6.665 {"}'P' -11.832 1.662 -6.716 {"}'P' P -11.566 1.593 -6.672 {"}'P' -11.592 1.567 -6.687 {"}'P' P -12.905 1.928 -6.421 {"}'P' -12.892 1.835 -6.481 {"}'P' P -11.711 1.562 -6.437 {"}'P' -11.788 1.477 -6.509 {"}'P' P -11.533 1.377 -6.445 {"}'P' -11.548 1.365 -6.457 {"}'P' P -12.915 1.768 -6.212 {"}'P' -12.901 1.681 -6.289 {"}'P' P -11.728 1.366 -6.229 {"}'P' -11.786 1.312 -6.297 {"}'P' P -12.905 1.582 -6.028 {"}'P' -12.895 1.526 -6.094 {"}'P' P -12.648 1.595 -6.028 {"}'P' -12.654 1.476 -6.168 {"}'P' P -11.941 1.314 -6.04 {"}'P' -12 1.25 -6.14 {"}'P' P -12.72 1.386 -5.873 {"}'P' -12.72 1.343 -5.942 {"}'P' P -12.465 1.354 -5.875 {"}'P' -12.483 1.289 -5.984 {"}'P' P -12.226 1.258 -5.879 {"}'P' -12.257 1.207 -5.973 {"}'P' P -12.021 1.103 -5.886 {"}'P' -12.034 1.091 -5.915 {"}'P' P -12.58 1.142 -5.753 {"}'P' -12.58 1.142 -5.755 { CZ TYR 640 A}'P' P -12.79 2.249 -6.912 {"}'P' -12.79 2.248 -6.913 {"}'P' P -12.535 2.285 -6.91 {"}'P' -12.535 2.251 -6.964 {"}'P' P -12.28 2.253 -6.912 {"}'P' -12.294 2.203 -6.996 {"}'P' P -12.041 2.157 -6.916 {"}'P' -12.07 2.111 -7.003 {"}'P' P -11.836 2.002 -6.923 {"}'P' -11.864 1.976 -6.982 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 TYR 640 A}'P' P -12.216 1.986 -6.655 {"}'P' -12.278 1.798 -6.742 {"}'P' P -12.648 1.939 -6.421 {"}'P' -12.655 1.76 -6.535 {"}'P' P -12.393 1.906 -6.422 {"}'P' -12.444 1.676 -6.572 {"}'P' P -12.147 1.831 -6.425 {"}'P' -12.239 1.607 -6.579 {"}'P' P -11.917 1.715 -6.431 {"}'P' -12.022 1.55 -6.553 {"}'P' P -12.655 1.782 -6.211 {"}'P' -12.662 1.613 -6.359 {"}'P' P -12.397 1.747 -6.213 {"}'P' -12.45 1.533 -6.404 {"}'P' P -12.151 1.663 -6.216 {"}'P' -12.243 1.466 -6.405 {"}'P' P -11.925 1.535 -6.222 {"}'P' -12.021 1.404 -6.361 {"}'P' P -12.394 1.554 -6.029 {"}'P' -12.436 1.408 -6.208 {"}'P' P -12.154 1.459 -6.034 {"}'P' -12.222 1.337 -6.195 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 522 A}'P' green -12.854 2.237 -6.869 {"}'P' sea -11.336 1.521 -6.493 {"}'P' green -11.407 1.322 -6.254 {"}'P' green -11.368 1.306 -5.994 {"}'P' green -11.623 1.162 -5.74 {"}'P' green -11.863 1.076 -5.743 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 522 A}'P' P -12.125 2.248 -7.124 {"}'P' -12.125 2.245 -7.05 {"}'P' P -11.995 2.022 -7.104 {"}'P' -12.006 2.037 -7.004 {"}'P' P -12.255 2.022 -7.104 {"}'P' -12.24 2.042 -6.97 {"}'P' P -12.385 2.247 -7.095 {"}'P' -12.367 2.243 -7.012 {"}'P' P -11.681 1.997 -7.019 {"}'P' -11.684 1.998 -7.013 {"}'P' P -11.864 1.808 -7.027 {"}'P' -11.882 1.835 -6.952 {"}'P' P -12.117 1.736 -7.03 {"}'P' -12.118 1.796 -6.889 {"}'P' P -12.371 1.8 -7.027 {"}'P' -12.337 1.856 -6.875 {"}'P' P -12.56 1.982 -7.02 {"}'P' -12.516 2.004 -6.911 {"}'P' P -12.633 2.235 -7.008 {"}'P' -12.609 2.233 -6.961 {"}'P' P -11.76 1.606 -6.896 {"}'P' -11.79 1.654 -6.819 {"}'P' P -11.998 1.519 -6.9 {"}'P' -12.02 1.634 -6.741 {"}'P' P -12.684 1.768 -6.889 {"}'P' -12.597 1.835 -6.745 {"}'P' P -12.81 1.988 -6.88 {"}'P' -12.767 2.001 -6.821 {"}'P' P -11.52 1.544 -6.714 {"}'P' -11.524 1.548 -6.708 {"}'P' P -11.737 1.401 -6.72 {"}'P' -11.779 1.487 -6.637 {"}'P' P -12.89 1.728 -6.706 {"}'P' -12.787 1.791 -6.605 {"}'P' P -13 1.963 -6.695 {"}'P' -12.969 1.972 -6.669 {"}'P' P -11.526 1.352 -6.5 {"}'P' -11.535 1.366 -6.492 {"}'P' P -11.751 1.234 -6.505 {"}'P' -11.791 1.337 -6.446 {"}'P' P -12.914 1.521 -6.493 {"}'P' -12.79 1.627 -6.408 {"}'P' P -13.058 1.73 -6.484 {"}'P' -12.99 1.764 -6.445 {"}'P' P -11.623 1.185 -6.26 {"}'P' -11.646 1.233 -6.245 {"}'P' P -11.863 1.099 -6.264 {"}'P' -11.888 1.204 -6.234 {"}'P' P -12.117 1.069 -6.265 {"}'P' -12.118 1.244 -6.217 {"}'P' P -12.83 1.312 -6.254 {"}'P' -12.724 1.445 -6.209 {"}'P' P -13.012 1.491 -6.246 {"}'P' -12.934 1.553 -6.221 {"}'P' P -13.149 1.707 -6.237 {"}'P' -13.141 1.71 -6.235 {"}'P' P -11.577 1.164 -6 {"}'P' -11.578 1.167 -6 {"}'P' P -11.812 1.071 -6.004 {"}'P' -11.823 1.109 -6.003 {"}'P' P -12.062 1.03 -6.006 {"}'P' -12.066 1.102 -6.003 {"}'P' P -12.314 1.044 -6.005 {"}'P' -12.296 1.153 -6.001 {"}'P' P -12.558 1.111 -6.002 {"}'P' -12.514 1.221 -5.998 {"}'P' P -12.782 1.23 -5.997 {"}'P' -12.73 1.306 -5.994 {"}'P' P -12.974 1.393 -5.99 {"}'P' -12.948 1.418 -5.989 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 522 A}'P' P -12.252 1.519 -6.9 {"}'P' -12.224 1.667 -6.694 {"}'P' P -12.49 1.606 -6.896 {"}'P' -12.412 1.731 -6.696 {"}'P' P -11.987 1.325 -6.723 {"}'P' -12.014 1.495 -6.574 {"}'P' P -12.247 1.323 -6.723 {"}'P' -12.217 1.541 -6.532 {"}'P' P -12.497 1.394 -6.72 {"}'P' -12.402 1.6 -6.524 {"}'P' P -12.718 1.533 -6.714 {"}'P' -12.591 1.675 -6.552 {"}'P' P -11.998 1.174 -6.508 {"}'P' -12.021 1.362 -6.406 {"}'P' P -12.252 1.174 -6.508 {"}'P' -12.222 1.414 -6.378 {"}'P' P -12.499 1.234 -6.505 {"}'P' -12.406 1.473 -6.369 {"}'P' P -12.724 1.352 -6.5 {"}'P' -12.593 1.538 -6.381 {"}'P' P -12.371 1.096 -6.264 {"}'P' -12.325 1.302 -6.206 {"}'P' P -12.613 1.178 -6.26 {"}'P' -12.522 1.367 -6.204 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 640 A}'M' green -9.415 2.482 -6.988 {"}'M' green -9.009 3.122 -6.96 {"}'M' green -9.461 2.205 -6.233 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 640 A}'M' greentint -9.322 2.72 -6.977 {"}'M' greentint -9.184 2.936 -6.968 {"}'M' greentint -9.491 2.356 -6.739 {"}'M' greentint -9.421 2.603 -6.728 {"}'M' greentint -9.306 2.833 -6.718 {"}'M' greentint -9.151 3.038 -6.709 {"}'M' greentint -8.961 3.211 -6.702 {"}'M' greentint -9.493 2.336 -6.481 {"}'M' greentint -9.424 2.584 -6.47 {"}'M' greentint -9.311 2.815 -6.46 {"}'M' greentint -9.157 3.021 -6.451 {"}'M' greentint -8.968 3.195 -6.444 {"}'M' greentint -9.413 2.456 -6.222 {"}'M' greentint -9.318 2.694 -6.211 {"}'M' greentint -9.179 2.909 -6.202 {"}'M' greentint -9.003 3.094 -6.194 {"}'M' greentint -8.794 3.242 -6.187 {"}'M' greentint -9.319 2.434 -5.982 {"}'M' greentint -9.221 2.667 -5.971 {"}'M' greentint -9.077 2.876 -5.962 {"}'M' greentint -8.894 3.052 -5.955 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 522 A}'M' greentint -9.125 2.943 -7.024 {"}'M' greentint -9.261 2.722 -7.033 {"}'M' greentint -8.954 2.942 -6.816 {"}'M' greentint -9.064 2.708 -6.827 {"}'M' greentint -9.238 2.518 -6.835 {"}'M' greentint -9.46 2.386 -6.841 {"}'M' greentint -8.918 3.197 -6.805 {"}'M' greentint -8.851 2.929 -6.575 {"}'M' greentint -8.947 2.696 -6.586 {"}'M' greentint -9.101 2.496 -6.594 {"}'M' greentint -9.301 2.343 -6.601 {"}'M' greentint -8.818 3.178 -6.565 {"}'M' greentint -8.813 2.926 -6.317 {"}'M' greentint -8.904 2.693 -6.327 {"}'M' greentint -9.05 2.489 -6.336 {"}'M' greentint -9.241 2.328 -6.343 {"}'M' greentint -9.467 2.219 -6.347 {"}'M' greentint -8.784 3.175 -6.306 {"}'M' greentint -8.851 2.906 -6.058 {"}'M' greentint -8.947 2.673 -6.068 {"}'M' greentint -9.101 2.473 -6.077 {"}'M' greentint -9.301 2.32 -6.084 {"}'M' greentint -8.818 3.156 -6.047 {"}'M' greentint -9.064 2.665 -5.827 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 640 A}'M' green -9.613 1.972 -5.114 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 640 A}'M' greentint -9.944 1.706 -4.867 {"}'M' greentint -9.774 1.89 -4.859 {"}'M' greentint -9.563 2.026 -4.853 {"}'M' greentint -9.325 2.105 -4.849 {"}'M' greentint -9.967 1.596 -4.612 {"}'M' greentint -9.813 1.796 -4.604 {"}'M' greentint -9.613 1.949 -4.597 {"}'M' greentint -9.38 2.046 -4.593 {"}'M' greentint -9.13 2.079 -4.591 {"}'M' greentint -9.914 1.471 -4.376 {"}'M' greentint -9.77 1.686 -4.367 {"}'M' greentint -9.57 1.848 -4.36 {"}'M' greentint -9.331 1.945 -4.356 {"}'M' greentint -9.074 1.967 -4.355 {"}'M' greentint -9.731 1.466 -4.169 {"}'M' greentint -9.556 1.658 -4.161 {"}'M' greentint -9.324 1.774 -4.156 {"}'M' greentint -9.065 1.798 -4.155 {"}'M' greentint -9.387 1.516 -4.008 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 522 A}'M' green -9.937 1.808 -5.059 {"}'M' green -10.057 1.358 -4.426 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 522 A}'M' greentint -9.485 2.041 -5.049 {"}'M' greentint -9.695 1.893 -5.055 {"}'M' greentint -9.268 2.011 -4.859 {"}'M' greentint -9.455 1.831 -4.867 {"}'M' greentint -9.679 1.7 -4.872 {"}'M' greentint -9.927 1.624 -4.876 {"}'M' greentint -9.1 1.997 -4.64 {"}'M' greentint -9.266 1.805 -4.648 {"}'M' greentint -9.466 1.65 -4.655 {"}'M' greentint -9.694 1.538 -4.66 {"}'M' greentint -9.939 1.475 -4.662 {"}'M' greentint -8.992 1.981 -4.399 {"}'M' greentint -9.149 1.779 -4.408 {"}'M' greentint -9.341 1.611 -4.415 {"}'M' greentint -9.562 1.481 -4.421 {"}'M' greentint -9.804 1.396 -4.425 {"}'M' greentint -9.099 1.752 -4.155 {"}'M' greentint -9.289 1.579 -4.163 {"}'M' greentint -9.508 1.444 -4.168 {"}'M' greentint -9.748 1.351 -4.173 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n val A 29 1xsoA_95F_31G}P -8.881 4.427 -13.024 {"}-8.881 4.427 -13.024 { ca val A 29 1xsoA_95F_31G}-9.936 4.041 -12.128 { c val A 29 1xsoA_95F_31G}-9.387 3.948 -10.692 { o val A 29 1xsoA_95F_31G}-8.461 3.23 -10.434 { c val A 29 1xsoA_95F_31G}P -9.387 3.948 -10.692 { n glu A 30 1xsoA_95F_31G}-10.004 4.773 -9.82 { ca glu A 30 1xsoA_95F_31G}-9.598 4.786 -8.427 { c glu A 30 1xsoA_95F_31G}-10.868 4.681 -7.56 { o glu A 30 1xsoA_95F_31G}-11.79 5.472 -7.694 { c glu A 30 1xsoA_95F_31G}P -10.868 4.681 -7.56 { n gly A 31 1xsoA_95F_31G}-10.849 3.744 -6.632 { ca gly A 31 1xsoA_95F_31G}-11.995 3.56 -5.814 { c gly A 31 1xsoA_95F_31G}-11.711 3.087 -4.404 { o gly A 31 1xsoA_95F_31G}-10.617 2.585 -4.143 { c gly A 31 1xsoA_95F_31G}P -11.711 3.087 -4.404 { n lys A 32 1xsoA_95F_31G}-12.748 3.167 -3.575 { ca lys A 32 1xsoA_95F_31G}-12.765 2.686 -2.194 { c lys A 32 1xsoA_95F_31G}-14.164 2.12 -1.933 { o lys A 32 1xsoA_95F_31G}-15.165 2.771 -2.201 { c lys A 32 1xsoA_95F_31G}P -14.164 2.12 -1.933 { n ile A 33 1xsoA_95F_31G}-14.178 0.881 -1.498 { ca ile A 33 1xsoA_95F_31G}-15.416 0.165 -1.2 { c ile A 33 1xsoA_95F_31G}-15.276 -0.45 0.21 { o ile A 33 1xsoA_95F_31G}-14.292 -1.04 0.516 { n ala A 93 1xsoA_95F_31G}P -11.799 -2.396 0.386 {"}-11.799 -2.396 0.386 { ca ala A 93 1xsoA_95F_31G}-11.033 -2.49 -0.808 { c ala A 93 1xsoA_95F_31G}-10.68 -1.1 -1.353 { o ala A 93 1xsoA_95F_31G}-11.597 -0.321 -1.684 { c ala A 93 1xsoA_95F_31G}P -10.68 -1.1 -1.353 { n gln A 94 1xsoA_95F_31G}-9.422 -0.774 -1.446 { ca gln A 94 1xsoA_95F_31G}-8.944 0.521 -2.043 { c gln A 94 1xsoA_95F_31G}-8.037 0.1 -3.213 { o gln A 94 1xsoA_95F_31G}-7.105 -0.67 -3.09 { c gln A 94 1xsoA_95F_31G}P -8.037 0.1 -3.213 { n phe A 95 1xsoA_95F_31G}-8.36 0.593 -4.41 { ca phe A 95 1xsoA_95F_31G}-7.756 0.169 -5.617 { c phe A 95 1xsoA_95F_31G}-7.559 1.285 -6.641 { o phe A 95 1xsoA_95F_31G}-8.265 2.28 -6.646 { c phe A 95 1xsoA_95F_31G}P -7.559 1.285 -6.641 { n lys A 96 1xsoA_95F_31G}-6.547 1.081 -7.475 { ca lys A 96 1xsoA_95F_31G}-6.21 1.916 -8.616 { c lys A 96 1xsoA_95F_31G}-5.903 0.99 -9.814 { o lys A 96 1xsoA_95F_31G}-4.989 0.169 -9.682 { c lys A 96 1xsoA_95F_31G}P -5.903 0.99 -9.814 { n ile A 97 1xsoA_95F_31G}-6.613 1.162 -10.887 { ca ile A 97 1xsoA_95F_31G}-6.403 0.354 -12.098 { c ile A 97 1xsoA_95F_31G}-6.326 1.342 -13.277 { o ile A 97 1xsoA_95F_31G}-6.884 2.431 -13.233 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 29 1xsoA_95F_31G}P -8.881 4.427 -13.024 { ca val A 29 1xsoA_95F_31G}P -9.936 4.041 -12.128 { n glu A 30 1xsoA_95F_31G}P -10.004 4.773 -9.82 { ca glu A 30 1xsoA_95F_31G}P -9.598 4.786 -8.427 { n gly A 31 1xsoA_95F_31G}P -10.849 3.744 -6.632 { ca gly A 31 1xsoA_95F_31G}P -11.995 3.56 -5.814 {"}P -11.995 3.56 -5.814 { n lys A 32 1xsoA_95F_31G}P -12.748 3.167 -3.575 { ca lys A 32 1xsoA_95F_31G}P -12.765 2.686 -2.194 { n ile A 33 1xsoA_95F_31G}P -14.178 0.881 -1.498 { ca ile A 33 1xsoA_95F_31G}P -15.416 0.165 -1.2 { n ala A 93 1xsoA_95F_31G}P -11.799 -2.396 0.386 { ca ala A 93 1xsoA_95F_31G}P -11.033 -2.49 -0.808 { n gln A 94 1xsoA_95F_31G}P -9.422 -0.774 -1.446 { ca gln A 94 1xsoA_95F_31G}P -8.944 0.521 -2.043 { n phe A 95 1xsoA_95F_31G}P -8.36 0.593 -4.41 { ca phe A 95 1xsoA_95F_31G}P -7.756 0.169 -5.617 { n lys A 96 1xsoA_95F_31G}P -6.547 1.081 -7.475 { ca lys A 96 1xsoA_95F_31G}P -6.21 1.916 -8.616 { n ile A 97 1xsoA_95F_31G}P -6.613 1.162 -10.887 { ca ile A 97 1xsoA_95F_31G}P -6.403 0.354 -12.098 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca val A 29 1xsoA_95F_31G}P -9.936 4.041 -12.128 {"}-9.936 4.041 -12.128 { ca glu A 30 1xsoA_95F_31G}-9.598 4.786 -8.427 { ca gly A 31 1xsoA_95F_31G}-11.995 3.56 -5.814 { ca lys A 32 1xsoA_95F_31G}-12.765 2.686 -2.194 { ca ile A 33 1xsoA_95F_31G}-15.416 0.165 -1.2 { ca ala A 93 1xsoA_95F_31G}P -11.033 -2.49 -0.808 {"}-11.033 -2.49 -0.808 { ca gln A 94 1xsoA_95F_31G}-8.944 0.521 -2.043 { ca phe A 95 1xsoA_95F_31G}-7.756 0.169 -5.617 { ca lys A 96 1xsoA_95F_31G}-6.21 1.916 -8.616 { ca ile A 97 1xsoA_95F_31G}-6.403 0.354 -12.098 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca val A 29 1xsoA_95F_31G}P -9.936 4.041 -12.128 { ca glu A 30 1xsoA_95F_31G}P -9.598 4.786 -8.427 { ca lys A 32 1xsoA_95F_31G}P -12.765 2.686 -2.194 { ca ile A 33 1xsoA_95F_31G}P -15.416 0.165 -1.2 { ca ala A 93 1xsoA_95F_31G}P -11.033 -2.49 -0.808 { ca gln A 94 1xsoA_95F_31G}P -8.944 0.521 -2.043 { ca phe A 95 1xsoA_95F_31G}P -7.756 0.169 -5.617 { cb phe A 95 1xsoA_95F_31G}-8.545 -0.991 -6.245 { cg phe A 95 1xsoA_95F_31G}-9.989 -0.616 -6.592 { cd1 phe A 95 1xsoA_95F_31G}-10.974 -0.739 -5.65 { ce1 phe A 95 1xsoA_95F_31G}-12.288 -0.409 -5.946 { cz phe A 95 1xsoA_95F_31G}-12.631 0.069 -7.192 { cg phe A 95 1xsoA_95F_31G}P -9.989 -0.616 -6.592 { cd2 phe A 95 1xsoA_95F_31G}-10.34 -0.175 -7.844 { ce2 phe A 95 1xsoA_95F_31G}-11.657 0.134 -8.16 { cz phe A 95 1xsoA_95F_31G}ghost -12.631 0.069 -7.192 { ca lys A 96 1xsoA_95F_31G}P -6.21 1.916 -8.616 { ca ile A 97 1xsoA_95F_31G}P -6.403 0.354 -12.098 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 95 1xsoA_95F_31G}P -8.545 -0.991 -6.245 {"}P -8.545 -0.991 -6.245 { cd1 phe A 95 1xsoA_95F_31G}P -10.974 -0.739 -5.65 { cd2 phe A 95 1xsoA_95F_31G}P -10.34 -0.175 -7.844 { ce1 phe A 95 1xsoA_95F_31G}P -12.288 -0.409 -5.946 { ce2 phe A 95 1xsoA_95F_31G}P -11.657 0.134 -8.16 { cz phe A 95 1xsoA_95F_31G}P -12.631 0.069 -7.192 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 95 1xsoA_95F_31G}P -7.756 0.169 -5.617 { cb phe A 95 1xsoA_95F_31G}-8.545 -0.991 -6.245 { cg phe A 95 1xsoA_95F_31G}-9.989 -0.616 -6.592 { cd1 phe A 95 1xsoA_95F_31G}-10.974 -0.739 -5.65 { ce1 phe A 95 1xsoA_95F_31G}-12.288 -0.409 -5.946 { cz phe A 95 1xsoA_95F_31G}-12.631 0.069 -7.192 { cg phe A 95 1xsoA_95F_31G}P -9.989 -0.616 -6.592 { cd2 phe A 95 1xsoA_95F_31G}-10.34 -0.175 -7.844 { ce2 phe A 95 1xsoA_95F_31G}-11.657 0.134 -8.16 { cz phe A 95 1xsoA_95F_31G}ghost -12.631 0.069 -7.192 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 95 1xsoA_95F_31G}P -8.545 -0.991 -6.245 {"}P -8.545 -0.991 -6.245 { cd1 phe A 95 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{"}'P' green -12.827 1.745 -6.729 {"}'P' green -12.306 1.725 -6.73 {"}'P' sea -12.054 1.656 -6.733 {"}'P' sea -13.142 1.586 -6.486 {"}'P' green -12.894 1.647 -6.483 {"}'P' green -12.639 1.669 -6.482 {"}'P' green -12.384 1.65 -6.483 {"}'P' sea -12.135 1.591 -6.486 {"}'P' sea -13.075 1.479 -6.255 {"}'P' green -12.824 1.533 -6.252 {"}'P' green -12.567 1.544 -6.252 {"}'P' sea -12.312 1.511 -6.253 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 95 A}'P' P -12.566 1.755 -6.729 {"}'P' -12.566 1.752 -6.729 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 31 A}'P' sky -12.533 2.155 -7.246 {"}'P' sky -12.787 2.155 -7.246 {"}'P' sky -12.272 2.037 -7.066 {"}'P' sky -13.032 2.03 -7.066 {"}'P' sky -12.061 1.988 -6.846 {"}'P' sky -13.259 1.988 -6.846 {"}'P' sky -11.942 1.958 -6.6 {"}'P' blue -13.365 1.948 -6.6 {"}'P' blue -13.317 1.866 -6.343 {"}'P' blue -12.158 1.798 -6.086 {"}'P' blue -12.533 1.765 -5.839 @dotlist {x} 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2.371 -6.017 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 95 A}'M' greentint -9.559 2.668 -7.013 {"}'M' greentint -9.466 2.906 -7.002 {"}'M' greentint -9.328 3.122 -6.993 {"}'M' greentint -9.635 2.542 -6.764 {"}'M' greentint -9.565 2.789 -6.753 {"}'M' greentint -9.45 3.019 -6.743 {"}'M' greentint -9.295 3.224 -6.734 {"}'M' greentint -9.659 2.266 -6.517 {"}'M' greentint -9.637 2.522 -6.506 {"}'M' greentint -9.568 2.77 -6.495 {"}'M' greentint -9.455 3.001 -6.485 {"}'M' greentint -9.301 3.207 -6.476 {"}'M' greentint -9.605 2.391 -6.258 {"}'M' greentint -9.557 2.642 -6.247 {"}'M' greentint -9.462 2.88 -6.236 {"}'M' greentint -9.323 3.095 -6.227 {"}'M' greentint -9.147 3.28 -6.219 {"}'M' greentint -9.463 2.62 -6.007 {"}'M' greentint -9.365 2.853 -5.996 {"}'M' greentint -9.221 3.062 -5.987 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 31 A}'M' greentint -9.251 2.908 -6.954 {"}'M' greentint -9.361 2.674 -6.965 {"}'M' greentint -9.535 2.484 -6.973 {"}'M' greentint -9.215 3.163 -6.943 {"}'M' greentint -9.148 2.895 -6.713 {"}'M' greentint -9.244 2.662 -6.724 {"}'M' greentint -9.398 2.462 -6.732 {"}'M' greentint -9.598 2.309 -6.739 {"}'M' greentint -9.115 3.144 -6.703 {"}'M' greentint -9.11 2.892 -6.455 {"}'M' greentint -9.201 2.659 -6.465 {"}'M' greentint -9.347 2.455 -6.474 {"}'M' greentint -9.538 2.294 -6.481 {"}'M' greentint -9.081 3.141 -6.444 {"}'M' greentint -9.148 2.872 -6.196 {"}'M' greentint -9.244 2.639 -6.206 {"}'M' greentint -9.398 2.439 -6.215 {"}'M' greentint -9.598 2.286 -6.222 {"}'M' greentint -9.115 3.122 -6.185 {"}'M' greentint -9.251 2.864 -5.955 {"}'M' greentint -9.361 2.631 -5.965 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 95 A}'M' green -9.696 1.905 -5.012 {"}'M' green -9.251 2.281 -4.495 {"}'M' green -10.022 1.29 -4.279 {"}'M' green -9.482 1.834 -3.807 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 95 A}'M' greentint -9.989 1.562 -4.786 {"}'M' 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-13.231 { ca phe A 235 1xu1A_157Y_237}-9.73 4.833 -12.219 { c phe A 235 1xu1A_157Y_237}-9.254 4.451 -10.827 { o phe A 235 1xu1A_157Y_237}-8.233 3.789 -10.658 { c phe A 235 1xu1A_157Y_237}P -9.254 4.451 -10.827 { n leu A 236 1xu1A_157Y_237}-10.015 4.877 -9.825 { ca leu A 236 1xu1A_157Y_237}-9.651 4.698 -8.43 { c leu A 236 1xu1A_157Y_237}-10.94 4.496 -7.658 { o leu A 236 1xu1A_157Y_237}-11.902 5.204 -7.887 { c leu A 236 1xu1A_157Y_237}P -10.94 4.496 -7.658 { n gly A 237 1xu1A_157Y_237}-10.973 3.532 -6.749 { ca gly A 237 1xu1A_157Y_237}-12.168 3.323 -5.955 { c gly A 237 1xu1A_157Y_237}-11.932 2.738 -4.58 { o gly A 237 1xu1A_157Y_237}-10.848 2.219 -4.249 { c gly A 237 1xu1A_157Y_237}P -11.932 2.738 -4.58 { n phe A 238 1xu1A_157Y_237}-12.999 2.795 -3.792 { ca phe A 238 1xu1A_157Y_237}-12.968 2.488 -2.369 { c phe A 238 1xu1A_157Y_237}-14.279 1.809 -2.006 { o phe A 238 1xu1A_157Y_237}-15.347 2.234 -2.455 { c phe A 238 1xu1A_157Y_237}P -14.279 1.809 -2.006 { n val A 239 1xu1A_157Y_237}-14.201 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-6.749 { ca gly A 237 1xu1A_157Y_237}P -12.168 3.323 -5.955 {"}P -12.168 3.323 -5.955 { n phe A 238 1xu1A_157Y_237}P -12.999 2.795 -3.792 { ca phe A 238 1xu1A_157Y_237}P -12.968 2.488 -2.369 { n val A 239 1xu1A_157Y_237}P -14.201 0.779 -1.173 { ca val A 239 1xu1A_157Y_237}P -15.38 0.181 -0.554 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca leu A 155 1xu1A_157Y_237}P -10.864 -2.025 0.027 {"}-10.864 -2.025 0.027 { ca leu A 156 1xu1A_157Y_237}-8.83 0.332 -2.212 { ca tyr A 157 1xu1A_157Y_237}-8.283 -0.384 -5.945 { ca ser A 158 1xu1A_157Y_237}-6.394 1.589 -8.579 { ca gln A 159 1xu1A_157Y_237}-5.802 1.194 -12.333 { ca phe A 235 1xu1A_157Y_237}P -9.73 4.833 -12.219 {"}-9.73 4.833 -12.219 { ca leu A 236 1xu1A_157Y_237}-9.651 4.698 -8.43 { ca gly A 237 1xu1A_157Y_237}-12.168 3.323 -5.955 { ca phe A 238 1xu1A_157Y_237}-12.968 2.488 -2.369 { ca val A 239 1xu1A_157Y_237}-15.38 0.181 -0.554 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { 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1y4wA_56F_71G}-11.237 -0.609 -8.233 { cz phe A 56 1y4wA_56F_71G}-12.254 -0.761 -7.297 { cg phe A 56 1y4wA_56F_71G}P -9.591 -1.218 -6.56 { cd2 phe A 56 1y4wA_56F_71G}-10.621 -1.378 -5.639 { ce2 phe A 56 1y4wA_56F_71G}-11.947 -1.155 -6.005 { cz phe A 56 1y4wA_56F_71G}ghost -12.254 -0.761 -7.297 { ca gln A 57 1y4wA_56F_71G}P -5.321 1.092 -8.417 { ca tyr A 58 1y4wA_56F_71G}P -7.885 1.722 -11.133 { ca ser A 69 1y4wA_56F_71G}P -7.013 6.463 -9.66 { ca trp A 70 1y4wA_56F_71G}P -8.11 4.882 -6.373 { ca his A 72 1y4wA_56F_71G}P -13.33 1.823 -3.957 { ca ala A 73 1y4wA_56F_71G}P -15.441 -1.122 -2.811 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 56 1y4wA_56F_71G}P -8.155 -1.462 -6.16 {"}P -8.155 -1.462 -6.16 { cd1 phe A 56 1y4wA_56F_71G}P -9.908 -0.835 -7.859 { cd2 phe A 56 1y4wA_56F_71G}P -10.621 -1.378 -5.639 { ce1 phe A 56 1y4wA_56F_71G}P -11.237 -0.609 -8.233 { ce2 phe A 56 1y4wA_56F_71G}P -11.947 -1.155 -6.005 { cz phe A 56 1y4wA_56F_71G}P -12.254 -0.761 -7.297 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 56 1y4wA_56F_71G}P -7.441 -0.22 -5.59 { cb phe A 56 1y4wA_56F_71G}-8.155 -1.462 -6.16 { cg phe A 56 1y4wA_56F_71G}-9.591 -1.218 -6.56 { cd1 phe A 56 1y4wA_56F_71G}-9.908 -0.835 -7.859 { ce1 phe A 56 1y4wA_56F_71G}-11.237 -0.609 -8.233 { cz phe A 56 1y4wA_56F_71G}-12.254 -0.761 -7.297 { cg phe A 56 1y4wA_56F_71G}P -9.591 -1.218 -6.56 { cd2 phe A 56 1y4wA_56F_71G}-10.621 -1.378 -5.639 { ce2 phe A 56 1y4wA_56F_71G}-11.947 -1.155 -6.005 { cz phe A 56 1y4wA_56F_71G}ghost -12.254 -0.761 -7.297 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 56 1y4wA_56F_71G}P -8.155 -1.462 -6.16 {"}P -8.155 -1.462 -6.16 { cd1 phe A 56 1y4wA_56F_71G}P -9.908 -0.835 -7.859 { cd2 phe A 56 1y4wA_56F_71G}P -10.621 -1.378 -5.639 { ce1 phe A 56 1y4wA_56F_71G}P -11.237 -0.609 -8.233 { ce2 phe A 56 1y4wA_56F_71G}P -11.947 -1.155 -6.005 { cz phe A 56 1y4wA_56F_71G}P -12.254 -0.761 -7.297 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 56 A}'P' blue -10.296 0.87 -7.915 {"}'P' blue -10.304 0.857 -7.654 {"}'P' blue -10.36 0.792 -7.398 { CZ PHE 56 A}'P' sky -12.254 0.894 -7.865 {"}'P' sky -12.458 0.948 -7.612 {"}'P' sky -12.384 0.983 -7.352 {"}'P' sky -11.929 0.895 -6.835 {"}'P' sky -11.677 0.826 -6.838 {"}'P' sky -11.439 0.719 -6.843 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 56 A}'P' green -11.441 1.1 -8.548 {"}'P' green -11.18 1.112 -8.548 {"}'P' green -11.875 1.02 -8.293 {"}'P' green -10.849 1.096 -8.289 {"}'P' green -10.607 1.011 -8.031 {"}'P' green -11.935 0.929 -7.776 {"}'P' green -10.66 0.978 -7.774 {"}'P' green -10.741 0.913 -7.527 {"}'P' green -11.43 0.855 -7.293 {"}'P' green -11.173 0.866 -7.293 {"}'P' green -10.918 0.833 -7.294 { CZ PHE 56 A}'P' green -12.197 0.96 -7.612 {"}'P' green -11.937 0.931 -7.613 {"}'P' green -12.124 0.983 -7.352 {"}'P' green -11.866 0.944 -7.353 {"}'P' green -11.616 0.868 -7.357 {"}'P' sea -12.132 0.972 -7.09 {"}'P' green -11.874 0.935 -7.092 {"}'P' green -11.624 0.859 -7.095 {"}'P' sea -11.389 0.747 -7.1 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 56 A}'P' P -11.625 1.096 -8.289 {"}'P' -11.62 1.073 -8.289 {"}'P' P -11.367 1.135 -8.288 {"}'P' -11.363 1.079 -8.286 {"}'P' P -11.107 1.135 -8.288 {"}'P' -11.11 1.093 -8.286 {"}'P' P -11.882 1.005 -8.032 {"}'P' -11.882 1.005 -8.032 {"}'P' P -11.633 1.083 -8.028 {"}'P' -11.615 1.005 -8.038 {"}'P' P -11.376 1.123 -8.026 {"}'P' -11.366 1.005 -8.041 {"}'P' P -11.115 1.124 -8.026 {"}'P' -11.122 1.021 -8.039 {"}'P' P -10.857 1.087 -8.028 {"}'P' -10.866 1.046 -8.033 {"}'P' P -11.689 1.018 -7.772 {"}'P' -11.67 0.948 -7.792 {"}'P' P -11.433 1.067 -7.77 {"}'P' -11.419 0.946 -7.803 {"}'P' P -11.172 1.077 -7.77 {"}'P' -11.176 0.958 -7.802 {"}'P' P -10.912 1.047 -7.771 {"}'P' -10.925 0.983 -7.789 {"}'P' P -11.748 0.908 -7.527 {"}'P' -11.744 0.896 -7.533 {"}'P' P -11.5 0.969 -7.524 {"}'P' -11.489 0.902 -7.554 {"}'P' P -11.245 0.991 -7.523 {"}'P' -11.245 0.911 -7.559 {"}'P' P -10.99 0.972 -7.524 {"}'P' -10.997 0.928 -7.544 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 71 A}'P' blue -10.423 1.266 -7.675 {"}'P' sky -12.241 1.245 -7.415 {"}'P' sky -12.143 1.253 -7.167 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 71 A}'P' green -10.966 1.177 -8.409 {"}'P' green -11.726 1.17 -8.409 {"}'P' green -10.755 1.128 -8.189 {"}'P' green -10.636 1.098 -7.943 {"}'P' green -12.011 1.006 -7.686 {"}'P' sea -12.203 1.169 -7.679 {"}'P' green -10.852 0.938 -7.429 {"}'P' green -12.059 1.066 -7.423 {"}'P' green -11.227 0.905 -7.182 {"}'P' green -11.481 0.905 -7.182 {"}'P' green -11.728 0.966 -7.18 {"}'P' green -11.953 1.084 -7.175 {"}'P' sea -11.476 1.035 -6.955 {"}'P' sea -11.726 1.106 -6.952 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 71 A}'P' P -11.216 1.101 -8.412 {"}'P' -11.217 1.113 -8.402 {"}'P' P -11.476 1.099 -8.412 {"}'P' -11.475 1.105 -8.407 {"}'P' P -10.98 1.01 -8.194 {"}'P' -10.998 1.056 -8.168 {"}'P' P -11.227 0.95 -8.197 {"}'P' -11.237 1.033 -8.152 {"}'P' P -11.481 0.95 -8.197 {"}'P' -11.472 1.025 -8.156 {"}'P' P -11.728 1.01 -8.194 {"}'P' -11.719 1.034 -8.181 {"}'P' P -10.852 0.961 -7.949 {"}'P' -10.875 1.008 -7.935 {"}'P' P -11.092 0.875 -7.953 {"}'P' -11.118 0.984 -7.922 {"}'P' P -11.346 0.845 -7.954 {"}'P' -11.347 0.973 -7.919 {"}'P' P -11.6 0.872 -7.953 {"}'P' -11.579 0.966 -7.926 {"}'P' P -11.842 0.954 -7.949 {"}'P' -11.831 0.976 -7.943 {"}'P' P -10.806 0.94 -7.689 {"}'P' -10.818 0.963 -7.688 {"}'P' P -11.041 0.847 -7.693 {"}'P' -11.066 0.936 -7.689 {"}'P' P -11.291 0.806 -7.695 {"}'P' -11.297 0.923 -7.69 {"}'P' P -11.543 0.82 -7.694 {"}'P' -11.528 0.915 -7.69 {"}'P' P -11.787 0.887 -7.691 {"}'P' -11.775 0.918 -7.69 {"}'P' P -11.092 0.852 -7.432 {"}'P' -11.101 0.889 -7.439 {"}'P' P -11.346 0.822 -7.434 {"}'P' -11.346 0.875 -7.443 {"}'P' P -11.6 0.849 -7.432 {"}'P' -11.595 0.872 -7.437 {"}'P' P -11.842 0.931 -7.429 {"}'P' -11.841 0.933 -7.429 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 56 A}'M' greentint -8.655 2.232 -7.942 {"}'M' greentint -8.49 2.432 -7.934 {"}'M' greentint -8.913 1.991 -7.733 {"}'M' greentint -8.813 2.224 -7.723 {"}'M' greentint -8.668 2.432 -7.714 {"}'M' greentint -8.484 2.606 -7.706 {"}'M' greentint -9.011 1.977 -7.493 {"}'M' greentint -8.918 2.215 -7.482 {"}'M' greentint -8.78 2.431 -7.473 {"}'M' greentint -8.605 2.617 -7.465 {"}'M' greentint -8.397 2.767 -7.458 {"}'M' greentint -9.087 1.851 -7.244 {"}'M' greentint -9.017 2.098 -7.233 {"}'M' greentint -8.902 2.328 -7.223 {"}'M' greentint -8.747 2.533 -7.214 {"}'M' greentint -8.557 2.706 -7.207 {"}'M' greentint -8.338 2.841 -7.201 {"}'M' greentint -9.02 2.079 -6.975 {"}'M' greentint -8.907 2.31 -6.965 {"}'M' greentint -8.753 2.516 -6.956 {"}'M' greentint -8.564 2.69 -6.949 {"}'M' greentint -8.914 2.189 -6.716 {"}'M' greentint -8.775 2.404 -6.707 {"}'M' greentint -8.599 2.589 -6.699 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 71 A}'M' greentint -8.518 2.289 -7.967 {"}'M' greentint -8.692 2.099 -7.975 {"}'M' greentint -8.305 2.51 -7.715 {"}'M' greentint -8.401 2.277 -7.726 {"}'M' greentint -8.555 2.077 -7.734 {"}'M' greentint -8.755 1.924 -7.741 {"}'M' greentint -8.267 2.507 -7.457 {"}'M' greentint -8.358 2.274 -7.467 {"}'M' greentint -8.504 2.07 -7.476 {"}'M' greentint -8.695 1.909 -7.483 {"}'M' greentint -8.921 1.8 -7.487 {"}'M' greentint -8.238 2.756 -7.446 {"}'M' greentint -8.305 2.487 -7.198 {"}'M' greentint -8.401 2.254 -7.208 {"}'M' greentint -8.555 2.054 -7.217 {"}'M' greentint -8.755 1.901 -7.224 {"}'M' greentint -8.988 1.805 -7.228 {"}'M' greentint -8.272 2.737 -7.187 {"}'M' greentint -8.408 2.479 -6.957 {"}'M' greentint -8.518 2.246 -6.967 {"}'M' greentint -8.692 2.055 -6.976 {"}'M' greentint -8.914 1.924 -6.982 {"}'M' greentint -8.372 2.734 -6.946 {"}'M' greentint -8.579 2.462 -6.751 {"}'M' greentint -8.715 2.241 -6.76 {"}'M' greentint -8.923 2.085 -6.767 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 56 A}'M' -9.518 1.485 -5.419 {"}'M' -9.3 1.946 -5.399 {"}'M' -9.143 2.189 -5.147 {"}'M' -9.093 2.243 -4.886 {"}'M' -9.1 2.065 -4.393 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 56 A}'M' sea -9.444 1.732 -5.408 {"}'M' sea -9.626 1.353 -5.184 {"}'M' green -9.593 1.603 -5.173 {"}'M' green -9.497 1.836 -5.163 {"}'M' green -9.343 2.036 -5.154 {"}'M' sea -9.651 1.209 -4.931 {"}'M' green -9.653 1.459 -4.92 {"}'M' green -9.304 2.107 -4.892 {"}'M' green -9.626 1.331 -4.666 {"}'M' green -9.343 2.013 -4.637 {"}'M' sea -9.143 2.166 -4.63 {"}'M' sea -9.518 1.441 -4.42 {"}'M' green -9.444 1.688 -4.409 {"}'M' green -9.3 1.903 -4.4 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 56 A}'M' greentint -9.593 1.702 -4.909 {"}'M' greentint -9.474 1.923 -4.9 {"}'M' greentint -9.593 1.58 -4.656 {"}'M' greentint -9.497 1.813 -4.645 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 71 A}'M' sky -9.876 1.495 -5.331 {"}'M' sky -9.951 1.301 -5.098 {"}'M' sky -9.392 2.4 -5.05 {"}'M' sky -9.345 2.381 -4.797 {"}'M' sky -9.345 2.378 -4.539 @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 71 A}'M' sea -9.511 2.15 -5.302 {"}'M' sea -9.587 1.908 -5.313 {"}'M' sea -9.71 1.687 -5.323 {"}'M' green -9.415 2.145 -5.062 {"}'M' green -9.486 1.899 -5.072 {"}'M' green -9.602 1.671 -5.082 {"}'M' green -9.759 1.469 -5.091 {"}'M' green -9.369 2.125 -4.808 {"}'M' green -9.709 1.442 -4.838 {"}'M' sea -9.899 1.269 -4.846 {"}'M' green -9.367 2.122 -4.55 {"}'M' green -9.436 1.874 -4.561 {"}'M' green -9.549 1.643 -4.571 {"}'M' green -9.703 1.437 -4.58 {"}'M' sea -9.417 2.104 -4.296 {"}'M' sea -9.489 1.858 -4.307 {"}'M' sea -9.606 1.631 -4.317 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 71 A}'M' greentint -9.439 1.878 -4.819 {"}'M' greentint -9.554 1.647 -4.829 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 32 2a13A_46Y_34G}P -6.566 6.099 -12.336 {"}-6.566 6.099 -12.336 { ca gly A 32 2a13A_46Y_34G}-7.032 6.661 -11.079 { c gly A 32 2a13A_46Y_34G}-7.188 5.595 -10.026 { o gly A 32 2a13A_46Y_34G}-6.395 4.656 -9.944 { c gly A 32 2a13A_46Y_34G}P -7.188 5.595 -10.026 { n gln A 33 2a13A_46Y_34G}-8.204 5.751 -9.187 { ca gln A 33 2a13A_46Y_34G}-8.416 4.807 -8.096 { c gln A 33 2a13A_46Y_34G}-9.881 4.658 -7.742 { o gln A 33 2a13A_46Y_34G}-10.713 5.509 -8.102 { c gln A 33 2a13A_46Y_34G}P -9.881 4.658 -7.742 { n gly A 34 2a13A_46Y_34G}-10.176 3.566 -7.042 { ca gly A 34 2a13A_46Y_34G}-11.54 3.235 -6.683 { c gly A 34 2a13A_46Y_34G}-11.654 2.556 -5.337 { o gly A 34 2a13A_46Y_34G}-10.648 2.325 -4.653 { c gly A 34 2a13A_46Y_34G}P -11.654 2.556 -5.337 { n glu A 35 2a13A_46Y_34G}-12.895 2.237 -4.985 { ca glu A 35 2a13A_46Y_34G}-13.241 1.597 -3.714 { c glu A 35 2a13A_46Y_34G}-14.292 0.534 -3.995 { o glu A 35 2a13A_46Y_34G}-15.209 0.759 -4.789 { c glu A 35 2a13A_46Y_34G}P -14.292 0.534 -3.995 { n gly A 36 2a13A_46Y_34G}-14.181 -0.599 -3.301 { ca gly A 36 2a13A_46Y_34G}-15.145 -1.691 -3.402 { c gly A 36 2a13A_46Y_34G}-15.7 -2.064 -2.033 { o gly A 36 2a13A_46Y_34G}-15.018 -1.917 -0.999 { n phe A 44 2a13A_46Y_34G}P -12.475 -2.228 0.463 {"}-12.475 -2.228 0.463 { ca phe A 44 2a13A_46Y_34G}-11.097 -2.2 -0.022 { c phe A 44 2a13A_46Y_34G}-10.902 -1.087 -1.04 { o phe A 44 2a13A_46Y_34G}-11.875 -0.581 -1.591 { c phe A 44 2a13A_46Y_34G}P -10.902 -1.087 -1.04 { n arg A 45 2a13A_46Y_34G}-9.645 -0.705 -1.257 { ca arg A 45 2a13A_46Y_34G}-9.284 0.297 -2.264 { c arg A 45 2a13A_46Y_34G}-8.354 -0.305 -3.31 { o arg A 45 2a13A_46Y_34G}-7.675 -1.302 -3.056 { c arg A 45 2a13A_46Y_34G}P -8.354 -0.305 -3.31 { n tyr A 46 2a13A_46Y_34G}-8.334 0.305 -4.496 { ca tyr A 46 2a13A_46Y_34G}-7.537 -0.194 -5.611 { c tyr A 46 2a13A_46Y_34G}-7.151 0.932 -6.565 { o tyr A 46 2a13A_46Y_34G}-7.853 1.955 -6.647 { c tyr A 46 2a13A_46Y_34G}P -7.151 0.932 -6.565 { n gly A 47 2a13A_46Y_34G}-6.043 0.738 -7.287 { ca gly A 47 2a13A_46Y_34G}-5.73 1.596 -8.44 { c gly A 47 2a13A_46Y_34G}-6.296 0.961 -9.705 { o gly A 47 2a13A_46Y_34G}-6.516 -0.263 -9.76 { c gly A 47 2a13A_46Y_34G}P -6.296 0.961 -9.705 { n glu A 48 2a13A_46Y_34G}-6.55 1.777 -10.727 { ca glu A 48 2a13A_46Y_34G}-7.152 1.297 -11.975 { c glu A 48 2a13A_46Y_34G}-6.619 2.071 -13.173 { o glu A 48 2a13A_46Y_34G}-6.414 3.285 -13.095 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 32 2a13A_46Y_34G}P -6.566 6.099 -12.336 { ca gly A 32 2a13A_46Y_34G}P -7.032 6.661 -11.079 {"}P -7.032 6.661 -11.079 { n gln A 33 2a13A_46Y_34G}P -8.204 5.751 -9.187 { ca gln A 33 2a13A_46Y_34G}P -8.416 4.807 -8.096 { n gly A 34 2a13A_46Y_34G}P -10.176 3.566 -7.042 { ca gly A 34 2a13A_46Y_34G}P -11.54 3.235 -6.683 {"}P -11.54 3.235 -6.683 { n glu A 35 2a13A_46Y_34G}P -12.895 2.237 -4.985 { ca glu A 35 2a13A_46Y_34G}P -13.241 1.597 -3.714 { n gly A 36 2a13A_46Y_34G}P -14.181 -0.599 -3.301 { ca gly A 36 2a13A_46Y_34G}P -15.145 -1.691 -3.402 {"}P -15.145 -1.691 -3.402 { n phe A 44 2a13A_46Y_34G}P -12.475 -2.228 0.463 { ca phe A 44 2a13A_46Y_34G}P -11.097 -2.2 -0.022 { n arg A 45 2a13A_46Y_34G}P -9.645 -0.705 -1.257 { ca arg A 45 2a13A_46Y_34G}P -9.284 0.297 -2.264 { n tyr A 46 2a13A_46Y_34G}P -8.334 0.305 -4.496 { ca tyr A 46 2a13A_46Y_34G}P -7.537 -0.194 -5.611 { n gly A 47 2a13A_46Y_34G}P -6.043 0.738 -7.287 { ca gly A 47 2a13A_46Y_34G}P -5.73 1.596 -8.44 {"}P -5.73 1.596 -8.44 { n glu A 48 2a13A_46Y_34G}P -6.55 1.777 -10.727 { ca glu A 48 2a13A_46Y_34G}P -7.152 1.297 -11.975 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 32 2a13A_46Y_34G}P -7.032 6.661 -11.079 {"}-7.032 6.661 -11.079 { ca gln A 33 2a13A_46Y_34G}-8.416 4.807 -8.096 { ca gly A 34 2a13A_46Y_34G}-11.54 3.235 -6.683 { ca glu A 35 2a13A_46Y_34G}-13.241 1.597 -3.714 { ca gly A 36 2a13A_46Y_34G}-15.145 -1.691 -3.402 { ca phe A 44 2a13A_46Y_34G}P -11.097 -2.2 -0.022 {"}-11.097 -2.2 -0.022 { ca arg A 45 2a13A_46Y_34G}-9.284 0.297 -2.264 { ca tyr A 46 2a13A_46Y_34G}-7.537 -0.194 -5.611 { ca gly A 47 2a13A_46Y_34G}-5.73 1.596 -8.44 { ca glu A 48 2a13A_46Y_34G}-7.152 1.297 -11.975 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca gln A 33 2a13A_46Y_34G}P -8.416 4.807 -8.096 { ca glu A 35 2a13A_46Y_34G}P -13.241 1.597 -3.714 { ca phe A 44 2a13A_46Y_34G}P -11.097 -2.2 -0.022 { ca arg A 45 2a13A_46Y_34G}P -9.284 0.297 -2.264 { ca tyr A 46 2a13A_46Y_34G}P -7.537 -0.194 -5.611 { cb tyr A 46 2a13A_46Y_34G}-8.296 -1.304 -6.364 { cg tyr A 46 2a13A_46Y_34G}-9.651 -0.917 -6.922 { cd1 tyr A 46 2a13A_46Y_34G}-10.817 -1.058 -6.161 { ce1 tyr A 46 2a13A_46Y_34G}-12.066 -0.713 -6.684 { cz tyr A 46 2a13A_46Y_34G}-12.157 -0.216 -7.977 { oh tyr A 46 2a13A_46Y_34G}-13.391 0.112 -8.501 { cg tyr A 46 2a13A_46Y_34G}P -9.651 -0.917 -6.922 { cd2 tyr A 46 2a13A_46Y_34G}-9.771 -0.432 -8.227 { ce2 tyr A 46 2a13A_46Y_34G}-11.016 -0.091 -8.758 { cz tyr A 46 2a13A_46Y_34G}ghost -12.157 -0.216 -7.977 { ca glu A 48 2a13A_46Y_34G}P -7.152 1.297 -11.975 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 46 2a13A_46Y_34G}P -8.296 -1.304 -6.364 {"}P -8.296 -1.304 -6.364 { cd1 tyr A 46 2a13A_46Y_34G}P -10.817 -1.058 -6.161 { cd2 tyr A 46 2a13A_46Y_34G}P -9.771 -0.432 -8.227 { ce1 tyr A 46 2a13A_46Y_34G}P -12.066 -0.713 -6.684 { ce2 tyr A 46 2a13A_46Y_34G}P -11.016 -0.091 -8.758 { oh tyr A 46 2a13A_46Y_34G}P -13.391 0.112 -8.501 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 46 2a13A_46Y_34G}P -7.537 -0.194 -5.611 { cb tyr A 46 2a13A_46Y_34G}-8.296 -1.304 -6.364 { cg tyr A 46 2a13A_46Y_34G}-9.651 -0.917 -6.922 { cd1 tyr A 46 2a13A_46Y_34G}-10.817 -1.058 -6.161 { ce1 tyr A 46 2a13A_46Y_34G}-12.066 -0.713 -6.684 { cz tyr A 46 2a13A_46Y_34G}-12.157 -0.216 -7.977 { oh tyr A 46 2a13A_46Y_34G}-13.391 0.112 -8.501 { cg tyr A 46 2a13A_46Y_34G}P -9.651 -0.917 -6.922 { cd2 tyr A 46 2a13A_46Y_34G}-9.771 -0.432 -8.227 { ce2 tyr A 46 2a13A_46Y_34G}-11.016 -0.091 -8.758 { cz tyr A 46 2a13A_46Y_34G}ghost -12.157 -0.216 -7.977 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 46 2a13A_46Y_34G}P -8.296 -1.304 -6.364 {"}P -8.296 -1.304 -6.364 { cd1 tyr A 46 2a13A_46Y_34G}P -10.817 -1.058 -6.161 { cd2 tyr A 46 2a13A_46Y_34G}P -9.771 -0.432 -8.227 { ce1 tyr A 46 2a13A_46Y_34G}P -12.066 -0.713 -6.684 { ce2 tyr A 46 2a13A_46Y_34G}P -11.016 -0.091 -8.758 { oh tyr A 46 2a13A_46Y_34G}P -13.391 0.112 -8.501 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 46 A}'P' blue -11.661 1.523 -8.557 {"}'P' blue -11.412 1.601 -8.553 {"}'P' sky -11.714 1.447 -8.301 {"}'P' sky -11.468 1.536 -8.297 {"}'P' sky -11.212 1.585 -8.295 {"}'P' blue -11.024 1.509 -8.048 {"}'P' sky -11.209 1.373 -7.818 { CZ TYR 46 A}'P' sky -12.361 1.493 -8.292 {"}'P' sky -12.802 1.398 -7.776 {"}'P' sky -11.342 1.264 -7.523 {"}'P' sky -12.668 1.301 -7.271 {"}'P' sky -11.425 1.21 -7.275 {"}'P' sky -12.35 1.248 -7.037 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 46 A}'P' sea -11.527 1.426 -8.052 {"}'P' sea -11.279 1.487 -8.049 { CZ TYR 46 A}'P' sea -12.1 1.505 -8.292 {"}'P' sea -11.84 1.476 -8.293 {"}'P' sea -12.545 1.489 -8.033 {"}'P' green -12.287 1.528 -8.032 {"}'P' green -12.027 1.528 -8.032 {"}'P' green -11.769 1.489 -8.033 {"}'P' green -12.553 1.476 -7.772 {"}'P' green -11.527 1.404 -7.775 {"}'P' sea -12.609 1.411 -7.516 {"}'P' green -12.353 1.46 -7.514 {"}'P' green -11.58 1.371 -7.518 {"}'P' green -12.42 1.362 -7.268 {"}'P' green -12.165 1.384 -7.267 {"}'P' green -11.91 1.365 -7.268 {"}'P' green -11.661 1.306 -7.271 {"}'P' sea -12.093 1.259 -7.037 {"}'P' sea -11.838 1.226 -7.038 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 46 A}'P' P -12.296 1.516 -7.77 {"}'P' -12.295 1.509 -7.771 {"}'P' P -12.035 1.517 -7.77 {"}'P' -12.037 1.486 -7.774 {"}'P' P -11.777 1.48 -7.772 {"}'P' -11.778 1.474 -7.773 {"}'P' P -12.092 1.47 -7.514 {"}'P' -12.093 1.444 -7.521 {"}'P' P -11.832 1.44 -7.515 {"}'P' -11.834 1.429 -7.518 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 34 A}'P' blue -11.361 1.924 -8.215 {"}'P' sky -11.578 1.781 -8.221 {"}'P' sky -12.338 1.774 -8.221 {"}'P' blue -11.177 1.901 -7.994 {"}'P' sky -11.367 1.732 -8.001 {"}'P' sky -11.248 1.702 -7.755 {"}'P' sky -11.464 1.542 -7.241 {"}'P' sky -11.839 1.509 -6.994 {"}'P' sky -12.34 1.57 -6.992 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 34 A}'P' sea -11.828 1.705 -8.224 {"}'P' sea -12.088 1.703 -8.224 {"}'P' sea -11.592 1.614 -8.006 {"}'P' green -11.839 1.554 -8.009 {"}'P' green -12.093 1.554 -8.009 {"}'P' green -12.34 1.614 -8.006 {"}'P' sea -12.565 1.732 -8.001 {"}'P' sea -11.464 1.565 -7.761 {"}'P' green -11.704 1.479 -7.765 {"}'P' green -12.454 1.558 -7.761 {"}'P' sea -12.671 1.692 -7.755 {"}'P' sea -11.418 1.544 -7.501 {"}'P' green -11.653 1.451 -7.505 {"}'P' green -12.399 1.491 -7.503 {"}'P' sea -12.623 1.61 -7.498 {"}'P' green -11.704 1.456 -7.244 {"}'P' green -11.958 1.426 -7.246 {"}'P' green -12.212 1.453 -7.244 {"}'P' sea -12.454 1.535 -7.241 {"}'P' sea -12.093 1.509 -6.994 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 34 A}'P' P -11.958 1.449 -7.766 {"}'P' -11.958 1.478 -7.758 {"}'P' P -12.212 1.476 -7.765 {"}'P' -12.207 1.496 -7.759 {"}'P' P -11.903 1.41 -7.507 {"}'P' -11.904 1.429 -7.506 {"}'P' P -12.155 1.424 -7.506 {"}'P' -12.152 1.445 -7.505 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 46 A}'M' greentint -9.049 2.357 -7.254 {"}'M' greentint -8.949 2.59 -7.244 {"}'M' greentint -8.804 2.798 -7.235 {"}'M' greentint -9.194 2.091 -7.025 {"}'M' greentint -9.147 2.343 -7.014 {"}'M' greentint -9.054 2.581 -7.003 {"}'M' greentint -8.916 2.797 -6.994 {"}'M' greentint -8.741 2.983 -6.986 {"}'M' greentint -9.247 1.961 -6.776 {"}'M' greentint -9.223 2.217 -6.765 {"}'M' greentint -9.153 2.464 -6.754 {"}'M' greentint -9.038 2.694 -6.744 {"}'M' greentint -8.883 2.899 -6.735 {"}'M' greentint -8.693 3.072 -6.728 {"}'M' greentint -9.225 2.197 -6.507 {"}'M' greentint -9.156 2.445 -6.496 {"}'M' greentint -9.043 2.676 -6.486 {"}'M' greentint -8.889 2.882 -6.477 {"}'M' greentint -8.7 3.056 -6.47 {"}'M' greentint -9.145 2.317 -6.248 {"}'M' greentint -9.05 2.555 -6.237 {"}'M' greentint -8.911 2.77 -6.228 {"}'M' greentint -8.735 2.955 -6.22 {"}'M' greentint -8.953 2.528 -5.997 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 34 A}'M' greentint -8.664 2.685 -7.23 {"}'M' greentint -8.774 2.451 -7.241 {"}'M' greentint -8.948 2.261 -7.249 {"}'M' greentint -8.628 2.94 -7.219 {"}'M' greentint -8.561 2.672 -6.989 {"}'M' greentint -8.657 2.439 -7 {"}'M' greentint -8.811 2.239 -7.008 {"}'M' greentint -9.011 2.086 -7.015 {"}'M' greentint -8.528 2.921 -6.979 {"}'M' greentint -8.523 2.669 -6.731 {"}'M' greentint -8.614 2.436 -6.741 {"}'M' greentint -8.76 2.232 -6.75 {"}'M' greentint -8.951 2.071 -6.757 {"}'M' greentint -9.177 1.962 -6.761 {"}'M' greentint -8.527 3.166 -6.709 {"}'M' greentint -8.494 2.918 -6.72 {"}'M' greentint -8.561 2.649 -6.472 {"}'M' greentint -8.657 2.416 -6.482 {"}'M' greentint -8.811 2.216 -6.491 {"}'M' greentint -9.011 2.063 -6.498 {"}'M' greentint -9.244 1.967 -6.502 {"}'M' greentint -8.528 2.899 -6.461 {"}'M' greentint -8.664 2.641 -6.231 {"}'M' greentint -8.774 2.408 -6.241 {"}'M' greentint -8.948 2.217 -6.25 {"}'M' greentint -9.17 2.086 -6.256 {"}'M' greentint -8.628 2.896 -6.22 {"}'M' greentint -8.835 2.624 -6.025 {"}'M' greentint -8.971 2.403 -6.034 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 46 A}'M' green -9.711 1.278 -5.196 {"}'M' green -9.293 1.902 -5.169 {"}'M' green -9.819 1.146 -4.961 {"}'M' green -9.819 1.124 -4.443 {"}'M' green -9.711 1.234 -4.197 {"}'M' green -9.293 1.858 -4.17 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 46 A}'M' greentint -9.637 1.525 -5.185 {"}'M' greentint -9.493 1.739 -5.176 {"}'M' greentint -9.786 1.396 -4.95 {"}'M' greentint -9.69 1.629 -4.94 {"}'M' greentint -9.536 1.829 -4.931 {"}'M' greentint -9.336 1.982 -4.924 {"}'M' greentint -9.846 1.252 -4.697 {"}'M' greentint -9.786 1.495 -4.686 {"}'M' greentint -9.667 1.716 -4.677 {"}'M' greentint -9.497 1.9 -4.669 {"}'M' greentint -9.286 2.036 -4.663 {"}'M' greentint -9.786 1.373 -4.433 {"}'M' greentint -9.69 1.606 -4.422 {"}'M' greentint -9.536 1.806 -4.414 {"}'M' greentint -9.336 1.959 -4.407 {"}'M' greentint -9.637 1.481 -4.186 {"}'M' greentint -9.493 1.696 -4.177 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 34 A}'M' green -9.496 1.858 -5.298 {"}'M' green -9.619 1.637 -5.308 {"}'M' green -9.324 2.095 -5.047 {"}'M' green -9.86 1.251 -5.083 {"}'M' green -9.278 2.075 -4.793 {"}'M' green -9.276 2.072 -4.535 {"}'M' green -9.326 2.054 -4.281 {"}'M' green -9.867 1.212 -4.318 {"}'M' green -9.493 1.811 -4.051 {"}'M' green -9.615 1.589 -4.06 {"}'M' sea -9.779 1.396 -4.069 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 34 A}'M' greentint -9.395 1.849 -5.057 {"}'M' greentint -9.511 1.621 -5.067 {"}'M' greentint -9.668 1.419 -5.076 {"}'M' greentint -9.348 1.828 -4.804 {"}'M' greentint -9.463 1.597 -4.814 {"}'M' greentint -9.618 1.392 -4.823 {"}'M' greentint -9.808 1.219 -4.831 {"}'M' greentint -9.345 1.824 -4.546 {"}'M' greentint -9.458 1.593 -4.556 {"}'M' greentint -9.612 1.387 -4.565 {"}'M' greentint -9.801 1.213 -4.572 {"}'M' greentint -9.398 1.808 -4.292 {"}'M' greentint -9.515 1.581 -4.302 {"}'M' greentint -9.673 1.38 -4.311 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n met A 9 2a50A_11F_30G}P -12.054 -2.139 0.707 {"}-12.054 -2.139 0.707 { ca met A 9 2a50A_11F_30G}-10.727 -2.318 0.121 { c met A 9 2a50A_11F_30G}-10.606 -1.32 -1.031 { o met A 9 2a50A_11F_30G}-11.523 -1.228 -1.856 { c met A 9 2a50A_11F_30G}P -10.606 -1.32 -1.031 { n pro A 10 2a50A_11F_30G}-9.487 -0.587 -1.098 { ca pro A 10 2a50A_11F_30G}-9.287 0.341 -2.22 { c pro A 10 2a50A_11F_30G}-8.682 -0.355 -3.436 { o pro A 10 2a50A_11F_30G}-8.124 -1.446 -3.308 { c pro A 10 2a50A_11F_30G}P -8.682 -0.355 -3.436 { n phe A 11 2a50A_11F_30G}-8.778 0.292 -4.603 { ca phe A 11 2a50A_11F_30G}-8.11 -0.196 -5.796 { c phe A 11 2a50A_11F_30G}-7.656 0.942 -6.699 { o phe A 11 2a50A_11F_30G}-8.15 2.057 -6.586 { c phe A 11 2a50A_11F_30G}P -7.656 0.942 -6.699 { n lys A 12 2a50A_11F_30G}-6.698 0.64 -7.566 { ca lys A 12 2a50A_11F_30G}-6.16 1.6 -8.53 { c lys A 12 2a50A_11F_30G}-6.063 0.895 -9.855 { o lys A 12 2a50A_11F_30G}-5.838 -0.308 -9.879 { c lys A 12 2a50A_11F_30G}P -6.063 0.895 -9.855 {"}P -6.063 0.895 -9.855 { n gly A 28 2a50A_11F_30G}P -7.247 5.339 -12.752 {"}-7.247 5.339 -12.752 { ca gly A 28 2a50A_11F_30G}-8.465 5.322 -11.96 { c gly A 28 2a50A_11F_30G}-8.178 4.935 -10.528 { o gly A 28 2a50A_11F_30G}-7.183 4.287 -10.25 { n gly A 28 2a50A_11F_30G}P -7.247 5.339 -12.752 {"}-7.247 5.339 -12.752 { c gly A 28 2a50A_11F_30G}P -8.178 4.935 -10.528 { n lys A 29 2a50A_11F_30G}-9.1 5.31 -9.65 { ca lys A 29 2a50A_11F_30G}-8.994 5.011 -8.224 { c lys A 29 2a50A_11F_30G}-10.384 4.799 -7.673 { o lys A 29 2a50A_11F_30G}-11.321 5.546 -8 { c lys A 29 2a50A_11F_30G}P -10.384 4.799 -7.673 { n gly A 30 2a50A_11F_30G}-10.521 3.786 -6.828 { ca gly A 30 2a50A_11F_30G}-11.822 3.495 -6.264 { c gly A 30 2a50A_11F_30G}-11.743 2.746 -4.952 { o gly A 30 2a50A_11F_30G}-10.663 2.523 -4.405 { c gly A 30 2a50A_11F_30G}P -11.743 2.746 -4.952 { n glu A 31 2a50A_11F_30G}-12.913 2.365 -4.464 { ca glu A 31 2a50A_11F_30G}-13.044 1.579 -3.249 { c glu A 31 2a50A_11F_30G}-14.305 0.778 -3.323 { o glu A 31 2a50A_11F_30G}-15.283 1.201 -3.949 { c glu A 31 2a50A_11F_30G}P -14.305 0.778 -3.323 { n gly A 32 2a50A_11F_30G}-14.292 -0.37 -2.67 { ca gly A 32 2a50A_11F_30G}-15.496 -1.169 -2.592 { c gly A 32 2a50A_11F_30G}-15.58 -1.959 -1.312 { o gly A 32 2a50A_11F_30G}-14.662 -1.947 -0.481 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n met A 9 2a50A_11F_30G}P -12.054 -2.139 0.707 { ca met A 9 2a50A_11F_30G}P -10.727 -2.318 0.121 { ca pro A 10 2a50A_11F_30G}P -9.287 0.341 -2.22 { n phe A 11 2a50A_11F_30G}P -8.778 0.292 -4.603 { ca phe A 11 2a50A_11F_30G}P -8.11 -0.196 -5.796 { n lys A 12 2a50A_11F_30G}P -6.698 0.64 -7.566 { ca lys A 12 2a50A_11F_30G}P -6.16 1.6 -8.53 { n gly A 28 2a50A_11F_30G}P -7.247 5.339 -12.752 { ca gly A 28 2a50A_11F_30G}P -8.465 5.322 -11.96 {"}P -8.465 5.322 -11.96 { n lys A 29 2a50A_11F_30G}P -9.1 5.31 -9.65 { ca lys A 29 2a50A_11F_30G}P -8.994 5.011 -8.224 { n gly A 30 2a50A_11F_30G}P -10.521 3.786 -6.828 { ca gly A 30 2a50A_11F_30G}P -11.822 3.495 -6.264 {"}P -11.822 3.495 -6.264 { n glu A 31 2a50A_11F_30G}P -12.913 2.365 -4.464 { ca glu A 31 2a50A_11F_30G}P -13.044 1.579 -3.249 { n gly A 32 2a50A_11F_30G}P -14.292 -0.37 -2.67 { ca gly A 32 2a50A_11F_30G}P -15.496 -1.169 -2.592 {"}P -15.496 -1.169 -2.592 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca met A 9 2a50A_11F_30G}P -10.727 -2.318 0.121 {"}-10.727 -2.318 0.121 { ca pro A 10 2a50A_11F_30G}-9.287 0.341 -2.22 { ca phe A 11 2a50A_11F_30G}-8.11 -0.196 -5.796 { ca lys A 12 2a50A_11F_30G}-6.16 1.6 -8.53 {"}P -6.16 1.6 -8.53 { ca gly A 28 2a50A_11F_30G}P -8.465 5.322 -11.96 {"}P -8.465 5.322 -11.96 { ca lys A 29 2a50A_11F_30G}-8.994 5.011 -8.224 { ca gly A 30 2a50A_11F_30G}-11.822 3.495 -6.264 { ca glu A 31 2a50A_11F_30G}-13.044 1.579 -3.249 { ca gly A 32 2a50A_11F_30G}-15.496 -1.169 -2.592 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca met A 9 2a50A_11F_30G}P -10.727 -2.318 0.121 { ca pro A 10 2a50A_11F_30G}P -9.287 0.341 -2.22 { n pro A 10 2a50A_11F_30G}P -9.487 -0.587 -1.098 { ca phe A 11 2a50A_11F_30G}P -8.11 -0.196 -5.796 { cb phe A 11 2a50A_11F_30G}-8.993 -1.179 -6.581 { cg phe A 11 2a50A_11F_30G}-10.372 -0.662 -6.967 { cd1 phe A 11 2a50A_11F_30G}-10.599 -0.106 -8.224 { ce1 phe A 11 2a50A_11F_30G}-11.902 0.276 -8.625 { cz phe A 11 2a50A_11F_30G}-12.985 0.119 -7.744 { cg phe A 11 2a50A_11F_30G}P -10.372 -0.662 -6.967 { cd2 phe A 11 2a50A_11F_30G}-11.475 -0.857 -6.126 { ce2 phe A 11 2a50A_11F_30G}-12.776 -0.445 -6.502 { cz phe A 11 2a50A_11F_30G}ghost -12.985 0.119 -7.744 { ca lys A 12 2a50A_11F_30G}P -6.16 1.6 -8.53 { ca lys A 29 2a50A_11F_30G}P -8.994 5.011 -8.224 { ca glu A 31 2a50A_11F_30G}P -13.044 1.579 -3.249 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 11 2a50A_11F_30G}P -8.993 -1.179 -6.581 {"}P -8.993 -1.179 -6.581 { cd1 phe A 11 2a50A_11F_30G}P -10.599 -0.106 -8.224 { cd2 phe A 11 2a50A_11F_30G}P -11.475 -0.857 -6.126 { ce1 phe A 11 2a50A_11F_30G}P -11.902 0.276 -8.625 { ce2 phe A 11 2a50A_11F_30G}P -12.776 -0.445 -6.502 { cz phe A 11 2a50A_11F_30G}P -12.985 0.119 -7.744 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 11 2a50A_11F_30G}P -8.11 -0.196 -5.796 { cb phe A 11 2a50A_11F_30G}-8.993 -1.179 -6.581 { cg phe A 11 2a50A_11F_30G}-10.372 -0.662 -6.967 { cd1 phe A 11 2a50A_11F_30G}-10.599 -0.106 -8.224 { ce1 phe A 11 2a50A_11F_30G}-11.902 0.276 -8.625 { cz phe A 11 2a50A_11F_30G}-12.985 0.119 -7.744 { cg phe A 11 2a50A_11F_30G}P -10.372 -0.662 -6.967 { cd2 phe A 11 2a50A_11F_30G}-11.475 -0.857 -6.126 { ce2 phe A 11 2a50A_11F_30G}-12.776 -0.445 -6.502 { cz phe A 11 2a50A_11F_30G}ghost -12.985 0.119 -7.744 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 11 2a50A_11F_30G}P -8.993 -1.179 -6.581 {"}P -8.993 -1.179 -6.581 { cd1 phe A 11 2a50A_11F_30G}P -10.599 -0.106 -8.224 { cd2 phe A 11 2a50A_11F_30G}P -11.475 -0.857 -6.126 { ce1 phe A 11 2a50A_11F_30G}P -11.902 0.276 -8.625 { ce2 phe A 11 2a50A_11F_30G}P -12.776 -0.445 -6.502 { cz phe A 11 2a50A_11F_30G}P -12.985 0.119 -7.744 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 11 A}'P' blue -12.354 1.903 -8.164 {"}'P' blue -12.098 1.952 -8.162 {"}'P' sky -12.413 1.793 -7.919 {"}'P' sky -12.165 1.854 -7.916 {"}'P' sky -11.91 1.876 -7.915 {"}'P' blue -11.655 1.857 -7.916 {"}'P' sky -11.838 1.751 -7.685 {"}'P' sky -11.845 1.594 -7.475 { CZ PHE 11 A}'P' sky -13.115 1.863 -7.799 {"}'P' blue -11.951 1.458 -7.296 {"}'P' sky -13.248 1.697 -7.035 {"}'P' blue -12.034 1.413 -7.048 {"}'P' blue -13.178 1.583 -6.804 {"}'P' sky -12.42 1.486 -6.808 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 11 A}'P' sea -12.095 1.74 -7.685 { CZ PHE 11 A}'P' sea -12.855 1.863 -7.799 {"}'P' sea -12.597 1.824 -7.8 {"}'P' sea -13.124 1.851 -7.537 {"}'P' green -12.863 1.852 -7.537 {"}'P' green -12.605 1.815 -7.539 {"}'P' green -12.355 1.739 -7.542 {"}'P' sea -13.181 1.795 -7.281 {"}'P' green -12.92 1.805 -7.281 {"}'P' green -12.66 1.775 -7.282 {"}'P' green -12.408 1.706 -7.285 {"}'P' sea -12.17 1.599 -7.29 {"}'P' sea -12.993 1.719 -7.034 {"}'P' green -12.738 1.7 -7.035 {"}'P' green -12.489 1.641 -7.038 {"}'P' sea -12.253 1.545 -7.042 {"}'P' sea -12.921 1.594 -6.804 {"}'P' sea -12.666 1.561 -6.805 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 30 A}'P' blue -12.037 2.309 -7.926 {"}'P' sky -12.275 2.222 -7.93 {"}'P' blue -12.529 2.222 -7.93 {"}'P' blue -11.797 2.247 -7.744 {"}'P' sky -12.014 2.104 -7.75 {"}'P' blue -12.995 2.236 -7.744 {"}'P' sky -11.803 2.055 -7.53 {"}'P' blue -13.191 2.224 -7.523 {"}'P' sky -11.9 1.888 -7.29 {"}'P' sky -12.089 1.774 -7.034 {"}'P' blue -13.251 2.096 -7.02 {"}'P' blue -12.14 1.779 -6.773 {"}'P' blue -13.107 1.993 -6.764 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 30 A}'P' sea -12.264 2.028 -7.753 {"}'P' sea -12.524 2.026 -7.753 {"}'P' sea -12.774 2.097 -7.75 {"}'P' sea -12.028 1.937 -7.535 {"}'P' sea -12.275 1.877 -7.538 {"}'P' green -12.529 1.877 -7.538 {"}'P' green -12.776 1.937 -7.535 {"}'P' sea -13.001 2.055 -7.53 {"}'P' sea -12.14 1.802 -7.294 {"}'P' green -12.394 1.772 -7.295 {"}'P' green -12.648 1.799 -7.294 {"}'P' green -12.89 1.881 -7.29 {"}'P' sea -13.107 2.015 -7.284 {"}'P' green -12.339 1.733 -7.036 {"}'P' green -12.591 1.747 -7.035 {"}'P' green -12.835 1.814 -7.032 {"}'P' sea -13.059 1.933 -7.027 {"}'P' sea -12.394 1.749 -6.775 {"}'P' sea -12.648 1.776 -6.773 {"}'P' sea -12.89 1.858 -6.77 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 11 A}'M' green -8.779 3.294 -6.403 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 11 A}'M' greentint -9.246 2.692 -7.183 {"}'M' greentint -9.101 2.9 -7.174 {"}'M' greentint -9.444 2.445 -6.953 {"}'M' greentint -9.351 2.683 -6.942 {"}'M' greentint -9.213 2.899 -6.933 {"}'M' greentint -9.038 3.085 -6.925 {"}'M' greentint -9.52 2.319 -6.704 {"}'M' greentint -9.45 2.566 -6.693 {"}'M' greentint -9.335 2.796 -6.683 {"}'M' greentint -9.18 3.001 -6.674 {"}'M' greentint -8.99 3.174 -6.667 {"}'M' greentint -9.522 2.299 -6.446 {"}'M' greentint -9.453 2.547 -6.435 {"}'M' greentint -9.34 2.778 -6.425 {"}'M' greentint -9.186 2.984 -6.416 {"}'M' greentint -8.997 3.158 -6.409 {"}'M' greentint -9.442 2.419 -6.187 {"}'M' greentint -9.347 2.657 -6.176 {"}'M' greentint -9.208 2.872 -6.167 {"}'M' greentint -9.032 3.057 -6.159 {"}'M' greentint -9.25 2.63 -5.936 {"}'M' greentint -9.106 2.839 -5.927 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 30 A}'M' greentint -8.951 2.957 -7.042 {"}'M' greentint -9.061 2.723 -7.053 {"}'M' greentint -9.235 2.533 -7.061 {"}'M' greentint -8.848 2.944 -6.801 {"}'M' greentint -8.944 2.711 -6.812 {"}'M' greentint -9.098 2.511 -6.82 {"}'M' greentint -9.298 2.358 -6.827 {"}'M' greentint -8.815 3.193 -6.791 {"}'M' greentint -8.81 2.941 -6.543 {"}'M' greentint -8.901 2.708 -6.553 {"}'M' greentint -9.047 2.504 -6.562 {"}'M' greentint -9.238 2.343 -6.569 {"}'M' greentint -9.464 2.234 -6.573 {"}'M' greentint -8.781 3.19 -6.532 {"}'M' greentint -8.848 2.921 -6.284 {"}'M' greentint -8.944 2.688 -6.294 {"}'M' greentint -9.098 2.488 -6.303 {"}'M' greentint -9.298 2.335 -6.31 {"}'M' greentint -8.815 3.171 -6.273 {"}'M' greentint -8.951 2.913 -6.043 {"}'M' greentint -9.061 2.68 -6.053 {"}'M' greentint -9.235 2.489 -6.062 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 11 A}'M' greentint -9.942 1.738 -5.21 {"}'M' greentint -9.742 1.901 -5.203 {"}'M' greentint -10.235 1.395 -4.984 {"}'M' greentint -10.139 1.628 -4.974 {"}'M' greentint -9.985 1.828 -4.965 {"}'M' greentint -9.785 1.981 -4.958 {"}'M' greentint -9.552 2.077 -4.954 {"}'M' greentint -10.295 1.251 -4.731 {"}'M' greentint -10.235 1.494 -4.72 {"}'M' greentint -10.116 1.715 -4.711 {"}'M' greentint -9.946 1.899 -4.703 {"}'M' greentint -9.735 2.035 -4.697 {"}'M' greentint -9.497 2.114 -4.693 {"}'M' greentint -10.235 1.372 -4.467 {"}'M' greentint -10.139 1.605 -4.456 {"}'M' greentint -9.985 1.805 -4.448 {"}'M' greentint -9.785 1.958 -4.441 {"}'M' greentint -9.552 2.055 -4.437 {"}'M' greentint -10.16 1.233 -4.231 {"}'M' greentint -10.086 1.48 -4.22 {"}'M' greentint -9.942 1.695 -4.211 {"}'M' greentint -9.742 1.857 -4.204 {"}'M' greentint -9.503 1.954 -4.2 {"}'M' greentint -9.903 1.475 -4.013 {"}'M' greentint -9.728 1.667 -4.005 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 30 A}'M' greentint -9.511 2.056 -5.05 {"}'M' greentint -9.634 1.835 -5.06 {"}'M' greentint -9.8 1.643 -5.068 {"}'M' greentint -10 1.488 -5.075 {"}'M' greentint -9.41 2.047 -4.809 {"}'M' greentint -9.526 1.819 -4.819 {"}'M' greentint -9.683 1.617 -4.828 {"}'M' greentint -9.875 1.449 -4.835 {"}'M' greentint -10.096 1.319 -4.841 {"}'M' greentint -9.363 2.026 -4.556 {"}'M' greentint -9.478 1.795 -4.566 {"}'M' greentint -9.633 1.59 -4.575 {"}'M' greentint -9.823 1.417 -4.583 {"}'M' greentint -10.042 1.282 -4.588 {"}'M' greentint -10.282 1.189 -4.593 {"}'M' greentint -9.36 2.022 -4.298 {"}'M' greentint -9.473 1.791 -4.308 {"}'M' greentint -9.627 1.585 -4.317 {"}'M' greentint -9.816 1.411 -4.324 {"}'M' greentint -10.034 1.274 -4.33 {"}'M' greentint -9.53 1.779 -4.054 {"}'M' greentint -9.688 1.578 -4.063 {"}'M' greentint -9.882 1.41 -4.07 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ala A 22 2axwA_93F_24G}P -7.173 6.15 -12.194 {"}-7.173 6.15 -12.194 { ca ala A 22 2axwA_93F_24G}-8.35 6.252 -11.339 { c ala A 22 2axwA_93F_24G}-8.075 5.508 -10.06 { o ala A 22 2axwA_93F_24G}-7.297 4.56 -10.035 { c ala A 22 2axwA_93F_24G}P -8.075 5.508 -10.06 { n thr A 23 2axwA_93F_24G}-8.702 5.937 -8.975 { ca thr A 23 2axwA_93F_24G}-8.641 5.232 -7.715 { c thr A 23 2axwA_93F_24G}-10.038 4.889 -7.279 { o thr A 23 2axwA_93F_24G}-10.961 5.696 -7.372 { c thr A 23 2axwA_93F_24G}P -10.038 4.889 -7.279 { n gly A 24 2axwA_93F_24G}-10.198 3.669 -6.834 { ca gly A 24 2axwA_93F_24G}-11.485 3.102 -6.535 { c gly A 24 2axwA_93F_24G}-11.558 2.469 -5.175 { o gly A 24 2axwA_93F_24G}-10.566 2.224 -4.47 { c gly A 24 2axwA_93F_24G}P -11.558 2.469 -5.175 { n arg A 25 2axwA_93F_24G}-12.785 2.114 -4.851 { ca arg A 25 2axwA_93F_24G}-13.051 1.296 -3.7 { c arg A 25 2axwA_93F_24G}-14.242 0.415 -3.998 { o arg A 25 2axwA_93F_24G}-15.09 0.751 -4.823 { c arg A 25 2axwA_93F_24G}P -14.242 0.415 -3.998 { n ile A 26 2axwA_93F_24G}-14.286 -0.707 -3.302 { ca ile A 26 2axwA_93F_24G}-15.401 -1.609 -3.319 { c ile A 26 2axwA_93F_24G}-15.85 -1.806 -1.874 { o ile A 26 2axwA_93F_24G}-15.036 -2.018 -0.974 { n val A 91 2axwA_93F_24G}P -12.367 -2.029 0.669 {"}-12.367 -2.029 0.669 { ca val A 91 2axwA_93F_24G}-10.962 -2.011 0.263 { c val A 91 2axwA_93F_24G}-10.817 -1.117 -0.959 { o val A 91 2axwA_93F_24G}-11.784 -0.892 -1.702 { c val A 91 2axwA_93F_24G}P -10.817 -1.117 -0.959 { n phe A 92 2axwA_93F_24G}-9.604 -0.647 -1.175 { ca phe A 92 2axwA_93F_24G}-9.258 0.271 -2.231 { c phe A 92 2axwA_93F_24G}-8.451 -0.436 -3.309 { o phe A 92 2axwA_93F_24G}-7.691 -1.355 -3.02 { c phe A 92 2axwA_93F_24G}P -8.451 -0.436 -3.309 { n phe A 93 2axwA_93F_24G}-8.606 0.025 -4.536 { ca phe A 93 2axwA_93F_24G}-7.834 -0.455 -5.675 { c phe A 93 2axwA_93F_24G}-7.584 0.705 -6.61 { o phe A 93 2axwA_93F_24G}-8.25 1.732 -6.541 { c phe A 93 2axwA_93F_24G}P -7.584 0.705 -6.61 { n asp A 94 2axwA_93F_24G}-6.63 0.531 -7.516 { ca asp A 94 2axwA_93F_24G}-6.315 1.543 -8.514 { c asp A 94 2axwA_93F_24G}-6.37 0.966 -9.904 { o asp A 94 2axwA_93F_24G}-6.153 -0.241 -10.117 { c asp A 94 2axwA_93F_24G}P -6.37 0.966 -9.904 { n val A 95 2axwA_93F_24G}-6.67 1.837 -10.861 { ca val A 95 2axwA_93F_24G}-6.486 1.579 -12.304 { c val A 95 2axwA_93F_24G}-5.256 2.386 -12.68 { o val A 95 2axwA_93F_24G}-5.224 3.61 -12.5 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 22 2axwA_93F_24G}P -7.173 6.15 -12.194 { ca ala A 22 2axwA_93F_24G}P -8.35 6.252 -11.339 { n thr A 23 2axwA_93F_24G}P -8.702 5.937 -8.975 { ca thr A 23 2axwA_93F_24G}P -8.641 5.232 -7.715 { n gly A 24 2axwA_93F_24G}P -10.198 3.669 -6.834 { ca gly A 24 2axwA_93F_24G}P -11.485 3.102 -6.535 {"}P -11.485 3.102 -6.535 { n arg A 25 2axwA_93F_24G}P -12.785 2.114 -4.851 { ca arg A 25 2axwA_93F_24G}P -13.051 1.296 -3.7 { n ile A 26 2axwA_93F_24G}P -14.286 -0.707 -3.302 { ca ile A 26 2axwA_93F_24G}P -15.401 -1.609 -3.319 { n val A 91 2axwA_93F_24G}P -12.367 -2.029 0.669 { ca val A 91 2axwA_93F_24G}P -10.962 -2.011 0.263 { n phe A 92 2axwA_93F_24G}P -9.604 -0.647 -1.175 { ca phe A 92 2axwA_93F_24G}P -9.258 0.271 -2.231 { n phe A 93 2axwA_93F_24G}P -8.606 0.025 -4.536 { ca phe A 93 2axwA_93F_24G}P -7.834 -0.455 -5.675 { n asp A 94 2axwA_93F_24G}P -6.63 0.531 -7.516 { ca asp A 94 2axwA_93F_24G}P -6.315 1.543 -8.514 { n val A 95 2axwA_93F_24G}P -6.67 1.837 -10.861 { ca val A 95 2axwA_93F_24G}P -6.486 1.579 -12.304 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ala A 22 2axwA_93F_24G}P -8.35 6.252 -11.339 {"}-8.35 6.252 -11.339 { ca thr A 23 2axwA_93F_24G}-8.641 5.232 -7.715 { ca gly A 24 2axwA_93F_24G}-11.485 3.102 -6.535 { ca arg A 25 2axwA_93F_24G}-13.051 1.296 -3.7 { ca ile A 26 2axwA_93F_24G}-15.401 -1.609 -3.319 { ca val A 91 2axwA_93F_24G}P -10.962 -2.011 0.263 {"}-10.962 -2.011 0.263 { ca phe A 92 2axwA_93F_24G}-9.258 0.271 -2.231 { ca phe A 93 2axwA_93F_24G}-7.834 -0.455 -5.675 { ca asp A 94 2axwA_93F_24G}-6.315 1.543 -8.514 { ca val A 95 2axwA_93F_24G}-6.486 1.579 -12.304 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ala A 22 2axwA_93F_24G}P -8.35 6.252 -11.339 { ca thr A 23 2axwA_93F_24G}P -8.641 5.232 -7.715 { ca arg A 25 2axwA_93F_24G}P -13.051 1.296 -3.7 { ca ile A 26 2axwA_93F_24G}P -15.401 -1.609 -3.319 { ca val A 91 2axwA_93F_24G}P -10.962 -2.011 0.263 { ca phe A 92 2axwA_93F_24G}P -9.258 0.271 -2.231 { ca phe A 93 2axwA_93F_24G}P -7.834 -0.455 -5.675 { cb phe A 93 2axwA_93F_24G}-8.588 -1.58 -6.435 { cg phe A 93 2axwA_93F_24G}-9.877 -1.122 -7.063 { cd1 phe A 93 2axwA_93F_24G}-11.035 -1.136 -6.353 { ce1 phe A 93 2axwA_93F_24G}-12.214 -0.692 -6.911 { cz phe A 93 2axwA_93F_24G}-12.248 -0.196 -8.204 { cg phe A 93 2axwA_93F_24G}P -9.877 -1.122 -7.063 { cd2 phe A 93 2axwA_93F_24G}-9.906 -0.616 -8.351 { ce2 phe A 93 2axwA_93F_24G}-11.079 -0.173 -8.927 { cz phe A 93 2axwA_93F_24G}ghost -12.248 -0.196 -8.204 { ca asp A 94 2axwA_93F_24G}P -6.315 1.543 -8.514 { ca val A 95 2axwA_93F_24G}P -6.486 1.579 -12.304 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 93 2axwA_93F_24G}P -8.588 -1.58 -6.435 {"}P -8.588 -1.58 -6.435 { cd1 phe A 93 2axwA_93F_24G}P -11.035 -1.136 -6.353 { cd2 phe A 93 2axwA_93F_24G}P -9.906 -0.616 -8.351 { ce1 phe A 93 2axwA_93F_24G}P -12.214 -0.692 -6.911 { ce2 phe A 93 2axwA_93F_24G}P -11.079 -0.173 -8.927 { cz phe A 93 2axwA_93F_24G}P -12.248 -0.196 -8.204 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 93 2axwA_93F_24G}P -7.834 -0.455 -5.675 { cb phe A 93 2axwA_93F_24G}-8.588 -1.58 -6.435 { cg phe A 93 2axwA_93F_24G}-9.877 -1.122 -7.063 { cd1 phe A 93 2axwA_93F_24G}-11.035 -1.136 -6.353 { ce1 phe A 93 2axwA_93F_24G}-12.214 -0.692 -6.911 { cz phe A 93 2axwA_93F_24G}-12.248 -0.196 -8.204 { cg phe A 93 2axwA_93F_24G}P -9.877 -1.122 -7.063 { cd2 phe A 93 2axwA_93F_24G}-9.906 -0.616 -8.351 { ce2 phe A 93 2axwA_93F_24G}-11.079 -0.173 -8.927 { cz phe A 93 2axwA_93F_24G}ghost -12.248 -0.196 -8.204 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 93 2axwA_93F_24G}P -8.588 -1.58 -6.435 {"}P -8.588 -1.58 -6.435 { cd1 phe A 93 2axwA_93F_24G}P -11.035 -1.136 -6.353 { cd2 phe A 93 2axwA_93F_24G}P -9.906 -0.616 -8.351 { ce1 phe A 93 2axwA_93F_24G}P -12.214 -0.692 -6.911 { ce2 phe A 93 2axwA_93F_24G}P -11.079 -0.173 -8.927 { cz phe A 93 2axwA_93F_24G}P -12.248 -0.196 -8.204 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 93 A}'P' sky -12.344 1.052 -6.966 {"}'P' sky -11.576 0.937 -6.971 {"}'P' blue -12.353 1.04 -6.704 {"}'P' sky -12.092 1.041 -6.704 {"}'P' sky -11.834 1.004 -6.706 {"}'P' blue -11.584 0.928 -6.709 { CE2 PHE 93 A}'P' sky -11.531 1.454 -8.466 {"}'P' sky -11.275 1.503 -8.464 {"}'P' sky -11.087 1.427 -8.217 {"}'P' sky -11.015 1.302 -7.987 {"}'P' sky -11.022 1.145 -7.777 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 93 A}'P' sea -12.084 1.052 -6.966 {"}'P' sea -11.826 1.013 -6.967 { CE2 PHE 93 A}'P' sea -11.342 1.405 -8.218 {"}'P' sea -11.272 1.291 -7.987 { CZ PHE 93 A}'P' green -12.118 1.548 -8.259 {"}'P' green -11.86 1.509 -8.26 {"}'P' sea -11.61 1.433 -8.264 {"}'P' green -12.387 1.536 -7.997 {"}'P' green -11.383 1.312 -8.007 {"}'P' green -12.444 1.48 -7.741 {"}'P' green -11.433 1.284 -7.75 {"}'P' sea -11.214 1.143 -7.756 {"}'P' green -12.511 1.382 -7.495 {"}'P' sea -11.297 1.098 -7.508 {"}'P' green -12.441 1.268 -7.264 {"}'P' green -11.683 1.171 -7.268 {"}'P' sea -11.453 1.055 -7.274 {"}'P' sea -12.191 1.122 -7.054 {"}'P' green -11.933 1.087 -7.056 {"}'P' sea -11.687 1.003 -7.059 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 93 A}'P' P -12.126 1.537 -7.997 {"}'P' -12.127 1.524 -7.999 {"}'P' P -11.868 1.5 -7.999 {"}'P' -11.874 1.471 -8.003 {"}'P' P -11.618 1.424 -8.002 {"}'P' -11.619 1.423 -8.003 {"}'P' P -12.183 1.49 -7.741 {"}'P' -12.185 1.44 -7.754 {"}'P' P -11.923 1.46 -7.742 {"}'P' -11.938 1.385 -7.763 {"}'P' P -11.671 1.391 -7.745 {"}'P' -11.69 1.34 -7.76 {"}'P' P -12.256 1.404 -7.494 {"}'P' -12.256 1.371 -7.509 {"}'P' P -12.001 1.385 -7.495 {"}'P' -12.012 1.317 -7.526 {"}'P' P -11.752 1.326 -7.498 {"}'P' -11.771 1.27 -7.524 {"}'P' P -11.516 1.23 -7.502 {"}'P' -11.519 1.224 -7.505 {"}'P' P -12.184 1.279 -7.264 {"}'P' -12.184 1.275 -7.266 {"}'P' P -11.929 1.246 -7.265 {"}'P' -11.933 1.225 -7.279 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 24 A}'P' sky -11.365 1.756 -8.237 {"}'P' sky -11.125 1.694 -8.055 {"}'P' blue -10.941 1.671 -7.834 {"}'P' blue -11.012 1.472 -7.595 {"}'P' sky -11.603 1.279 -6.834 {"}'P' sky -11.857 1.279 -6.834 {"}'P' sky -12.104 1.34 -6.832 {"}'P' blue -12.329 1.458 -6.827 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 24 A}'P' sea -11.857 1.669 -8.241 {"}'P' sea -12.095 1.756 -8.237 {"}'P' sea -11.342 1.551 -8.061 {"}'P' green -11.592 1.475 -8.064 {"}'P' green -12.102 1.544 -8.061 {"}'P' green -12.323 1.683 -8.055 {"}'P' sea -11.131 1.502 -7.841 {"}'P' green -11.356 1.384 -7.846 {"}'P' sea -12.519 1.671 -7.834 {"}'P' sea -11.228 1.335 -7.601 {"}'P' green -12.435 1.462 -7.595 {"}'P' green -11.417 1.221 -7.345 {"}'P' green -12.387 1.38 -7.338 {"}'P' green -11.722 1.196 -7.086 {"}'P' green -11.976 1.223 -7.084 {"}'P' green -12.218 1.305 -7.081 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 24 A}'P' P -11.852 1.473 -8.064 {"}'P' -11.85 1.484 -8.055 {"}'P' P -11.603 1.324 -7.849 {"}'P' -11.606 1.35 -7.834 {"}'P' P -11.857 1.324 -7.849 {"}'P' -11.849 1.385 -7.815 {"}'P' P -12.104 1.384 -7.846 {"}'P' -12.084 1.435 -7.817 {"}'P' P -12.329 1.502 -7.841 {"}'P' -12.326 1.507 -7.838 {"}'P' P -11.468 1.249 -7.605 {"}'P' -11.468 1.25 -7.604 {"}'P' P -11.722 1.219 -7.606 {"}'P' -11.722 1.28 -7.589 {"}'P' P -11.976 1.246 -7.605 {"}'P' -11.959 1.323 -7.583 {"}'P' P -12.218 1.328 -7.601 {"}'P' -12.195 1.376 -7.587 {"}'P' P -11.667 1.18 -7.347 {"}'P' -11.667 1.194 -7.346 {"}'P' P -11.919 1.194 -7.346 {"}'P' -11.912 1.235 -7.345 {"}'P' P -12.163 1.261 -7.343 {"}'P' -12.153 1.287 -7.342 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 93 A}'M' greentint -9.188 2.375 -7.357 {"}'M' greentint -9.023 2.575 -7.349 {"}'M' greentint -8.816 2.731 -7.342 {"}'M' greentint -9.346 2.367 -7.138 {"}'M' greentint -9.201 2.575 -7.129 {"}'M' greentint -9.017 2.749 -7.121 {"}'M' greentint -8.802 2.883 -7.115 {"}'M' greentint -8.564 2.971 -7.112 {"}'M' greentint -9.544 2.12 -6.908 {"}'M' greentint -9.451 2.358 -6.897 {"}'M' greentint -9.313 2.574 -6.888 {"}'M' greentint -9.138 2.76 -6.88 {"}'M' greentint -8.93 2.91 -6.873 {"}'M' greentint -8.698 3.017 -6.868 {"}'M' greentint -9.55 2.241 -6.648 {"}'M' greentint -9.435 2.471 -6.638 {"}'M' greentint -9.28 2.676 -6.629 {"}'M' greentint -9.09 2.849 -6.622 {"}'M' greentint -8.871 2.984 -6.616 {"}'M' greentint -8.631 3.077 -6.612 {"}'M' greentint -9.553 2.222 -6.39 {"}'M' greentint -9.44 2.453 -6.38 {"}'M' greentint -9.286 2.659 -6.371 {"}'M' greentint -9.097 2.833 -6.364 {"}'M' greentint -8.879 2.969 -6.358 {"}'M' greentint -8.639 3.064 -6.354 {"}'M' greentint -9.447 2.332 -6.131 {"}'M' greentint -9.308 2.547 -6.122 {"}'M' greentint -9.132 2.732 -6.114 {"}'M' greentint -8.923 2.88 -6.107 {"}'M' greentint -8.69 2.987 -6.103 {"}'M' greentint -9.206 2.514 -5.882 {"}'M' greentint -9.023 2.69 -5.875 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H GLY 24 A}'M' P -8.703 2.366 -6.7 {"}'M' -8.704 2.368 -6.7 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 24 A}'M' greentint -8.914 2.599 -7.397 {"}'M' greentint -8.607 2.819 -7.18 {"}'M' greentint -8.717 2.585 -7.191 {"}'M' greentint -8.891 2.395 -7.199 {"}'M' greentint -9.113 2.263 -7.205 {"}'M' greentint -9.364 2.204 -7.207 {"}'M' greentint -8.504 2.806 -6.939 {"}'M' greentint -8.6 2.573 -6.95 {"}'M' greentint -8.754 2.373 -6.958 {"}'M' greentint -8.954 2.22 -6.965 {"}'M' greentint -9.187 2.123 -6.969 {"}'M' greentint -9.437 2.09 -6.971 {"}'M' greentint -8.471 3.055 -6.929 {"}'M' greentint -8.466 2.803 -6.681 {"}'M' greentint -8.557 2.57 -6.691 {"}'M' greentint -8.894 2.205 -6.707 {"}'M' greentint -9.12 2.096 -6.711 {"}'M' greentint -9.366 2.047 -6.714 {"}'M' greentint -8.437 3.052 -6.67 {"}'M' greentint -8.504 2.783 -6.422 {"}'M' greentint -8.6 2.55 -6.432 {"}'M' greentint -8.754 2.35 -6.441 {"}'M' greentint -8.954 2.197 -6.448 {"}'M' greentint -9.187 2.101 -6.452 {"}'M' greentint -9.437 2.068 -6.454 {"}'M' greentint -8.471 3.033 -6.411 {"}'M' greentint -8.607 2.775 -6.181 {"}'M' greentint -8.717 2.542 -6.191 {"}'M' greentint -8.891 2.351 -6.2 {"}'M' greentint -9.113 2.22 -6.206 {"}'M' greentint -9.364 2.16 -6.208 {"}'M' greentint -8.571 3.03 -6.17 {"}'M' greentint -8.778 2.758 -5.975 {"}'M' greentint -8.914 2.537 -5.984 {"}'M' greentint -9.122 2.381 -5.991 {"}'M' greentint -9.372 2.31 -5.994 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 93 A}'M' greentint -9.907 1.343 -5.246 {"}'M' greentint -9.707 1.506 -5.239 {"}'M' greentint -10.2 1 -5.02 {"}'M' greentint -10.104 1.233 -5.01 {"}'M' greentint -9.95 1.433 -5.001 {"}'M' greentint -9.75 1.586 -4.994 {"}'M' greentint -9.517 1.682 -4.99 {"}'M' greentint -10.2 1.099 -4.756 {"}'M' greentint -10.081 1.32 -4.747 {"}'M' greentint -9.911 1.504 -4.739 {"}'M' greentint -9.7 1.64 -4.733 {"}'M' greentint -9.462 1.719 -4.729 {"}'M' greentint -10.2 0.977 -4.503 {"}'M' greentint -10.104 1.21 -4.492 {"}'M' greentint -9.95 1.41 -4.484 {"}'M' greentint -9.75 1.563 -4.477 {"}'M' greentint -9.517 1.66 -4.473 {"}'M' greentint -10.051 1.085 -4.256 {"}'M' greentint -9.907 1.3 -4.247 {"}'M' greentint -9.707 1.462 -4.24 {"}'M' greentint -9.468 1.559 -4.236 {"}'M' greentint -9.693 1.272 -4.041 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 24 A}'M' green -9.313 1.748 -4.874 {"}'M' green -10.241 0.935 -4.91 {"}'M' green -9.433 1.48 -4.119 {"}'M' green -10.007 0.984 -4.141 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 24 A}'M' greentint -9.537 1.536 -5.125 {"}'M' greentint -9.703 1.344 -5.133 {"}'M' greentint -9.903 1.189 -5.14 {"}'M' greentint -10.131 1.077 -5.145 {"}'M' greentint -9.429 1.52 -4.884 {"}'M' greentint -9.586 1.318 -4.893 {"}'M' greentint -9.778 1.15 -4.9 {"}'M' greentint -9.999 1.02 -4.906 {"}'M' greentint -9.266 1.727 -4.621 {"}'M' greentint -9.381 1.496 -4.631 {"}'M' greentint -9.536 1.291 -4.64 {"}'M' greentint -9.726 1.118 -4.648 {"}'M' greentint -9.945 0.983 -4.653 {"}'M' greentint -10.185 0.89 -4.658 {"}'M' greentint -9.376 1.492 -4.373 {"}'M' greentint -9.53 1.286 -4.382 {"}'M' greentint -9.719 1.112 -4.389 {"}'M' greentint -9.937 0.975 -4.395 {"}'M' greentint -10.177 0.881 -4.399 {"}'M' greentint -9.591 1.279 -4.128 {"}'M' greentint -9.785 1.111 -4.135 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu H 138 2bbkH_140F_150}P -12.073 -1.282 0.866 {"}-12.073 -1.282 0.866 { ca leu H 138 2bbkH_140F_150}-11.038 -1.828 0.031 { c leu H 138 2bbkH_140F_150}-10.786 -0.797 -1.044 { o leu H 138 2bbkH_140F_150}-11.747 -0.28 -1.609 { c leu H 138 2bbkH_140F_150}P -10.786 -0.797 -1.044 { n leu H 139 2bbkH_140F_150}-9.521 -0.468 -1.276 { ca leu H 139 2bbkH_140F_150}-9.148 0.491 -2.305 { c leu H 139 2bbkH_140F_150}-8.336 -0.216 -3.389 { o leu H 139 2bbkH_140F_150}-7.483 -1.044 -3.063 { c leu H 139 2bbkH_140F_150}P -8.336 -0.216 -3.389 { n phe H 140 2bbkH_140F_150}-8.516 0.116 -4.658 { ca phe H 140 2bbkH_140F_150}-7.75 -0.538 -5.707 { c phe H 140 2bbkH_140F_150}-7.374 0.46 -6.767 { o phe H 140 2bbkH_140F_150}-8.045 1.466 -6.944 { c phe H 140 2bbkH_140F_150}P -7.374 0.46 -6.767 { n tyr H 141 2bbkH_140F_150}-6.263 0.192 -7.436 { ca tyr H 141 2bbkH_140F_150}-5.759 1.125 -8.425 { c tyr H 141 2bbkH_140F_150}-6.26 0.855 -9.824 { o tyr H 141 2bbkH_140F_150}-6.312 -0.315 -10.211 { c tyr H 141 2bbkH_140F_150}P -6.26 0.855 -9.824 { n gln H 142 2bbkH_140F_150}-6.593 1.947 -10.534 { ca gln H 142 2bbkH_140F_150}-6.971 1.945 -11.95 { c gln H 142 2bbkH_140F_150}-5.875 2.667 -12.696 { o gln H 142 2bbkH_140F_150}-5.484 3.726 -12.267 { n ala H 148 2bbkH_140F_150}P -6.604 6.386 -11.101 {"}-6.604 6.386 -11.101 { ca ala H 148 2bbkH_140F_150}-7.637 6.606 -10.115 { c ala H 148 2bbkH_140F_150}-7.601 5.474 -9.125 { o ala H 148 2bbkH_140F_150}-6.986 4.426 -9.376 { c ala H 148 2bbkH_140F_150}P -7.601 5.474 -9.125 { n val H 149 2bbkH_140F_150}-8.31 5.682 -8.037 { ca val H 149 2bbkH_140F_150}-8.385 4.677 -7.003 { c val H 149 2bbkH_140F_150}-9.855 4.406 -6.723 { o val H 149 2bbkH_140F_150}-10.659 5.307 -6.49 { c val H 149 2bbkH_140F_150}P -9.855 4.406 -6.723 { n gly H 150 2bbkH_140F_150}-10.257 3.156 -6.852 { ca gly H 150 2bbkH_140F_150}-11.673 2.836 -6.641 { c gly H 150 2bbkH_140F_150}-11.933 2.574 -5.165 { o gly H 150 2bbkH_140F_150}-11.08 2.023 -4.476 { c gly H 150 2bbkH_140F_150}P -11.933 2.574 -5.165 { n val H 151 2bbkH_140F_150}-13.096 2.954 -4.675 { ca val H 151 2bbkH_140F_150}-13.463 2.751 -3.282 { c val H 151 2bbkH_140F_150}-14.544 1.689 -3.138 { o val H 151 2bbkH_140F_150}-15.633 1.835 -3.665 { c val H 151 2bbkH_140F_150}P -14.544 1.689 -3.138 { n val H 152 2bbkH_140F_150}-14.253 0.591 -2.433 { ca val H 152 2bbkH_140F_150}-15.253 -0.452 -2.275 { c val H 152 2bbkH_140F_150}-15.663 -0.504 -0.806 { o val H 152 2bbkH_140F_150}-14.819 -0.623 0.076 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu H 138 2bbkH_140F_150}P -12.073 -1.282 0.866 { ca leu H 138 2bbkH_140F_150}P -11.038 -1.828 0.031 { n leu H 139 2bbkH_140F_150}P -9.521 -0.468 -1.276 { ca leu H 139 2bbkH_140F_150}P -9.148 0.491 -2.305 { n phe H 140 2bbkH_140F_150}P -8.516 0.116 -4.658 { ca phe H 140 2bbkH_140F_150}P -7.75 -0.538 -5.707 { n tyr H 141 2bbkH_140F_150}P -6.263 0.192 -7.436 { ca tyr H 141 2bbkH_140F_150}P -5.759 1.125 -8.425 { n gln H 142 2bbkH_140F_150}P -6.593 1.947 -10.534 { ca gln H 142 2bbkH_140F_150}P -6.971 1.945 -11.95 { n ala H 148 2bbkH_140F_150}P -6.604 6.386 -11.101 { ca ala H 148 2bbkH_140F_150}P -7.637 6.606 -10.115 { n val H 149 2bbkH_140F_150}P -8.31 5.682 -8.037 { ca val H 149 2bbkH_140F_150}P -8.385 4.677 -7.003 { n gly H 150 2bbkH_140F_150}P -10.257 3.156 -6.852 { ca gly H 150 2bbkH_140F_150}P -11.673 2.836 -6.641 {"}P -11.673 2.836 -6.641 { n val H 151 2bbkH_140F_150}P -13.096 2.954 -4.675 { ca val H 151 2bbkH_140F_150}P -13.463 2.751 -3.282 { n val H 152 2bbkH_140F_150}P -14.253 0.591 -2.433 { ca val H 152 2bbkH_140F_150}P -15.253 -0.452 -2.275 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca leu H 138 2bbkH_140F_150}P -11.038 -1.828 0.031 {"}-11.038 -1.828 0.031 { ca leu H 139 2bbkH_140F_150}-9.148 0.491 -2.305 { ca phe H 140 2bbkH_140F_150}-7.75 -0.538 -5.707 { ca tyr H 141 2bbkH_140F_150}-5.759 1.125 -8.425 { ca gln H 142 2bbkH_140F_150}-6.971 1.945 -11.95 { ca ala H 148 2bbkH_140F_150}P -7.637 6.606 -10.115 {"}-7.637 6.606 -10.115 { ca val H 149 2bbkH_140F_150}-8.385 4.677 -7.003 { ca gly H 150 2bbkH_140F_150}-11.673 2.836 -6.641 { ca val H 151 2bbkH_140F_150}-13.463 2.751 -3.282 { ca val H 152 2bbkH_140F_150}-15.253 -0.452 -2.275 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca leu H 138 2bbkH_140F_150}P -11.038 -1.828 0.031 { ca leu H 139 2bbkH_140F_150}P -9.148 0.491 -2.305 { ca phe H 140 2bbkH_140F_150}P -7.75 -0.538 -5.707 { cb phe H 140 2bbkH_140F_150}-8.513 -1.704 -6.371 { cg phe H 140 2bbkH_140F_150}-9.767 -1.279 -7.105 { cd1 phe H 140 2bbkH_140F_150}-10.962 -1.14 -6.4 { ce1 phe H 140 2bbkH_140F_150}-12.141 -0.766 -7.046 { cz phe H 140 2bbkH_140F_150}-12.126 -0.505 -8.415 { cg phe H 140 2bbkH_140F_150}P -9.767 -1.279 -7.105 { cd2 phe H 140 2bbkH_140F_150}-9.772 -1.01 -8.474 { ce2 phe H 140 2bbkH_140F_150}-10.933 -0.594 -9.131 { cz phe H 140 2bbkH_140F_150}ghost -12.126 -0.505 -8.415 { ca tyr H 141 2bbkH_140F_150}P -5.759 1.125 -8.425 { ca gln H 142 2bbkH_140F_150}P -6.971 1.945 -11.95 { ca ala H 148 2bbkH_140F_150}P -7.637 6.606 -10.115 { ca val H 149 2bbkH_140F_150}P -8.385 4.677 -7.003 { ca val H 151 2bbkH_140F_150}P -13.463 2.751 -3.282 { ca val H 152 2bbkH_140F_150}P -15.253 -0.452 -2.275 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe H 140 2bbkH_140F_150}P -8.513 -1.704 -6.371 {"}P -8.513 -1.704 -6.371 { cd1 phe H 140 2bbkH_140F_150}P -10.962 -1.14 -6.4 { cd2 phe H 140 2bbkH_140F_150}P -9.772 -1.01 -8.474 { ce1 phe H 140 2bbkH_140F_150}P -12.141 -0.766 -7.046 { ce2 phe H 140 2bbkH_140F_150}P -10.933 -0.594 -9.131 { cz phe H 140 2bbkH_140F_150}P -12.126 -0.505 -8.415 @subgroup {sidechain} off @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe H 140 2bbkH_140F_150}P -7.75 -0.538 -5.707 { cb phe H 140 2bbkH_140F_150}-8.513 -1.704 -6.371 { cg phe H 140 2bbkH_140F_150}-9.767 -1.279 -7.105 { cd1 phe H 140 2bbkH_140F_150}-10.962 -1.14 -6.4 { ce1 phe H 140 2bbkH_140F_150}-12.141 -0.766 -7.046 { cz phe H 140 2bbkH_140F_150}-12.126 -0.505 -8.415 { cg phe H 140 2bbkH_140F_150}P -9.767 -1.279 -7.105 { cd2 phe H 140 2bbkH_140F_150}-9.772 -1.01 -8.474 { ce2 phe H 140 2bbkH_140F_150}-10.933 -0.594 -9.131 { cz phe H 140 2bbkH_140F_150}ghost -12.126 -0.505 -8.415 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe H 140 2bbkH_140F_150}P -8.513 -1.704 -6.371 {"}P -8.513 -1.704 -6.371 { cd1 phe H 140 2bbkH_140F_150}P -10.962 -1.14 -6.4 { cd2 phe H 140 2bbkH_140F_150}P -9.772 -1.01 -8.474 { ce1 phe H 140 2bbkH_140F_150}P -12.141 -0.766 -7.046 { ce2 phe H 140 2bbkH_140F_150}P -10.933 -0.594 -9.131 { cz phe H 140 2bbkH_140F_150}P -12.126 -0.505 -8.415 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 140 H}'P' green -12.601 0.892 -7.363 {"}'P' sea -11.333 0.752 -7.369 {"}'P' sea -12.779 0.863 -7.106 {"}'P' green -12.529 0.939 -7.102 {"}'P' green -11.503 0.863 -7.106 {"}'P' green -12.537 0.926 -6.841 {"}'P' green -11.511 0.854 -6.844 {"}'P' green -12.337 0.91 -6.583 {"}'P' green -12.076 0.92 -6.583 {"}'P' green -11.816 0.89 -6.584 {"}'P' sea -11.564 0.821 -6.587 { CZ PHE 140 H}'P' sea -12.522 1.187 -8.21 {"}'P' green -12.265 1.227 -8.208 {"}'P' green -12.004 1.228 -8.208 {"}'P' green -11.746 1.191 -8.21 {"}'P' sea -11.496 1.115 -8.213 {"}'P' green -12.578 1.122 -7.954 {"}'P' green -11.549 1.082 -7.956 {"}'P' sea -11.311 0.975 -7.961 {"}'P' green -12.637 1.012 -7.709 {"}'P' green -11.394 0.921 -7.713 {"}'P' green -12.57 0.905 -7.478 {"}'P' green -11.561 0.862 -7.479 {"}'P' sea -11.331 0.746 -7.485 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 140 H}'P' P -12.345 0.943 -7.361 {"}'P' -12.34 0.904 -7.354 {"}'P' P -12.084 0.955 -7.361 {"}'P' -12.087 0.878 -7.347 {"}'P' P -11.824 0.926 -7.362 {"}'P' -11.836 0.864 -7.35 {"}'P' P -11.572 0.858 -7.365 {"}'P' -11.573 0.856 -7.364 {"}'P' P -12.271 0.978 -7.101 {"}'P' -12.266 0.91 -7.099 {"}'P' P -12.011 0.978 -7.101 {"}'P' -12.018 0.886 -7.098 {"}'P' P -11.753 0.939 -7.102 {"}'P' -11.767 0.876 -7.1 {"}'P' P -12.28 0.966 -6.839 {"}'P' -12.277 0.937 -6.843 {"}'P' P -12.019 0.967 -6.839 {"}'P' -12.023 0.914 -6.846 {"}'P' P -11.761 0.93 -6.841 {"}'P' -11.767 0.901 -6.845 { CZ PHE 140 H}'P' P -12.322 1.171 -7.952 {"}'P' -12.319 1.149 -7.958 {"}'P' P -12.061 1.181 -7.952 {"}'P' -12.063 1.128 -7.966 {"}'P' P -11.801 1.151 -7.953 {"}'P' -11.809 1.112 -7.964 {"}'P' P -12.389 1.073 -7.706 {"}'P' -12.383 1.037 -7.722 {"}'P' P -12.134 1.095 -7.705 {"}'P' -12.134 1.015 -7.741 {"}'P' P -11.879 1.076 -7.706 {"}'P' -11.891 0.998 -7.741 {"}'P' P -11.63 1.017 -7.709 {"}'P' -11.641 0.985 -7.723 {"}'P' P -12.319 0.959 -7.475 {"}'P' -12.314 0.924 -7.498 {"}'P' P -12.062 0.97 -7.475 {"}'P' -12.064 0.905 -7.516 {"}'P' P -11.807 0.937 -7.476 {"}'P' -11.817 0.889 -7.507 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 150 H}'P' green -11.824 1.274 -8.178 {"}'P' green -12.078 1.274 -8.178 {"}'P' green -12.316 1.361 -8.174 {"}'P' green -11.563 1.156 -7.998 {"}'P' green -12.544 1.288 -7.992 {"}'P' green -11.352 1.107 -7.778 {"}'P' green -12.55 1.107 -7.778 {"}'P' green -11.449 0.94 -7.538 {"}'P' green -12.656 1.067 -7.532 {"}'P' green -11.403 0.919 -7.278 {"}'P' green -12.608 0.985 -7.275 {"}'P' green -11.449 0.917 -7.018 {"}'P' green -12.656 1.045 -7.012 {"}'P' green -11.577 0.945 -6.769 {"}'P' green -12.55 1.063 -6.764 {"}'P' green -11.813 1.017 -6.544 {"}'P' green -12.073 1.014 -6.544 {"}'P' sea -12.323 1.085 -6.541 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 150 H}'P' P -11.813 1.08 -8.001 {"}'P' -11.817 1.111 -7.974 {"}'P' P -12.073 1.078 -8.001 {"}'P' -12.067 1.12 -7.964 {"}'P' P -12.323 1.149 -7.998 {"}'P' -12.318 1.16 -7.988 {"}'P' P -11.577 0.989 -7.783 {"}'P' -11.583 1.005 -7.774 {"}'P' P -11.824 0.929 -7.786 {"}'P' -11.832 0.997 -7.749 {"}'P' P -12.078 0.929 -7.786 {"}'P' -12.068 1.009 -7.742 {"}'P' P -12.325 0.989 -7.783 {"}'P' -12.306 1.037 -7.756 {"}'P' P -11.689 0.854 -7.542 {"}'P' -11.698 0.89 -7.531 {"}'P' P -11.943 0.824 -7.543 {"}'P' -11.943 0.896 -7.523 {"}'P' P -12.197 0.851 -7.542 {"}'P' -12.183 0.915 -7.524 {"}'P' P -12.439 0.933 -7.538 {"}'P' -12.431 0.949 -7.533 {"}'P' P -11.638 0.826 -7.282 {"}'P' -11.647 0.857 -7.281 {"}'P' P -11.888 0.785 -7.284 {"}'P' -11.892 0.865 -7.28 {"}'P' P -12.14 0.799 -7.283 {"}'P' -12.127 0.881 -7.28 {"}'P' P -12.384 0.866 -7.28 {"}'P' -12.369 0.905 -7.279 {"}'P' P -11.689 0.831 -7.021 {"}'P' -11.699 0.874 -7.029 {"}'P' P -11.943 0.801 -7.023 {"}'P' -11.943 0.885 -7.038 {"}'P' P -12.197 0.828 -7.021 {"}'P' -12.181 0.902 -7.035 {"}'P' P -12.439 0.91 -7.018 {"}'P' -12.429 0.931 -7.022 {"}'P' P -11.824 0.884 -6.771 {"}'P' -11.826 0.906 -6.781 {"}'P' P -12.078 0.884 -6.771 {"}'P' -12.074 0.919 -6.786 {"}'P' P -12.325 0.945 -6.769 {"}'P' -12.324 0.948 -6.77 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 140 H}'M' greentint -8.983 2.109 -7.76 {"}'M' greentint -9.292 1.62 -7.562 {"}'M' greentint -9.241 1.868 -7.551 {"}'M' greentint -9.141 2.101 -7.541 {"}'M' greentint -8.996 2.309 -7.532 {"}'M' greentint -8.812 2.483 -7.524 {"}'M' greentint -9.386 1.602 -7.322 {"}'M' greentint -9.339 1.854 -7.311 {"}'M' greentint -9.246 2.092 -7.3 {"}'M' greentint -9.108 2.308 -7.291 {"}'M' greentint -8.933 2.494 -7.283 {"}'M' greentint -8.725 2.644 -7.276 {"}'M' greentint -9.439 1.472 -7.073 {"}'M' greentint -9.415 1.728 -7.062 {"}'M' greentint -9.345 1.975 -7.051 {"}'M' greentint -9.23 2.205 -7.041 {"}'M' greentint -9.075 2.41 -7.032 {"}'M' greentint -8.885 2.583 -7.025 {"}'M' greentint -9.439 1.452 -6.815 {"}'M' greentint -9.417 1.708 -6.804 {"}'M' greentint -9.348 1.956 -6.793 {"}'M' greentint -9.235 2.187 -6.783 {"}'M' greentint -9.081 2.393 -6.774 {"}'M' greentint -8.892 2.567 -6.767 {"}'M' greentint -9.337 1.828 -6.545 {"}'M' greentint -9.242 2.066 -6.534 {"}'M' greentint -9.103 2.281 -6.525 {"}'M' greentint -8.927 2.466 -6.517 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 150 H}'M' greentint -8.839 2.158 -7.598 {"}'M' greentint -8.949 1.924 -7.609 {"}'M' greentint -9.123 1.734 -7.617 {"}'M' greentint -8.803 2.413 -7.587 {"}'M' greentint -8.736 2.145 -7.357 {"}'M' greentint -8.832 1.912 -7.368 {"}'M' greentint -8.986 1.712 -7.376 {"}'M' greentint -9.186 1.559 -7.383 {"}'M' greentint -8.703 2.394 -7.347 {"}'M' greentint -8.698 2.142 -7.099 {"}'M' greentint -8.789 1.909 -7.109 {"}'M' greentint -8.935 1.705 -7.118 {"}'M' greentint -9.126 1.544 -7.125 {"}'M' greentint -9.352 1.435 -7.129 {"}'M' greentint -8.702 2.639 -7.077 {"}'M' greentint -8.669 2.391 -7.088 {"}'M' greentint -8.736 2.122 -6.84 {"}'M' greentint -8.832 1.889 -6.85 {"}'M' greentint -8.986 1.689 -6.859 {"}'M' greentint -9.186 1.536 -6.866 {"}'M' greentint -9.419 1.44 -6.87 {"}'M' greentint -8.736 2.621 -6.819 {"}'M' greentint -8.703 2.372 -6.829 {"}'M' greentint -8.839 2.114 -6.599 {"}'M' greentint -8.949 1.881 -6.609 {"}'M' greentint -9.123 1.69 -6.618 {"}'M' greentint -9.345 1.559 -6.624 {"}'M' greentint -8.803 2.369 -6.588 {"}'M' greentint -9.01 2.097 -6.393 {"}'M' greentint -9.146 1.876 -6.402 {"}'M' greentint -8.962 2.352 -6.382 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 140 H}'M' -9.857 0.909 -4.265 {"}'M' -9.588 1.343 -4.246 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 140 H}'M' sea -10.095 1.071 -5.225 {"}'M' green -9.999 1.304 -5.215 {"}'M' green -9.845 1.504 -5.206 {"}'M' sea -9.645 1.657 -5.199 {"}'M' green -10.155 0.927 -4.972 {"}'M' green -9.806 1.575 -4.944 {"}'M' sea -9.595 1.711 -4.938 {"}'M' sea -10.128 0.799 -4.718 {"}'M' green -10.095 1.048 -4.708 {"}'M' green -9.645 1.634 -4.682 {"}'M' green -10.02 0.909 -4.472 {"}'M' green -9.946 1.156 -4.461 {"}'M' green -9.802 1.371 -4.452 {"}'M' sea -9.602 1.533 -4.445 {"}'M' sea -9.763 1.151 -4.254 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 140 H}'M' greentint -10.095 1.17 -4.961 {"}'M' greentint -9.976 1.391 -4.952 {"}'M' greentint -9.999 1.281 -4.697 {"}'M' greentint -9.845 1.481 -4.689 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 150 H}'M' sky -10.417 0.988 -5.146 {"}'M' sky -9.708 1.77 -4.358 {"}'M' sky -9.83 1.506 -4.115 @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 150 H}'M' sea -10.078 1.566 -5.34 {"}'M' sea -10.219 1.349 -5.35 {"}'M' sea -9.852 1.798 -5.11 {"}'M' green -9.928 1.556 -5.121 {"}'M' green -10.051 1.335 -5.131 {"}'M' green -10.217 1.143 -5.139 {"}'M' sea -9.756 1.793 -4.87 {"}'M' green -10.292 0.949 -4.906 {"}'M' sea -9.71 1.773 -4.616 {"}'M' green -9.78 1.526 -4.627 {"}'M' green -10.24 0.917 -4.654 {"}'M' green -9.777 1.522 -4.369 {"}'M' green -9.89 1.291 -4.379 {"}'M' green -10.044 1.085 -4.388 {"}'M' sea -10.233 0.911 -4.395 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 150 H}'M' greentint -9.827 1.547 -4.88 {"}'M' greentint -9.943 1.319 -4.89 {"}'M' greentint -10.1 1.117 -4.899 {"}'M' greentint -9.895 1.295 -4.637 {"}'M' greentint -10.05 1.09 -4.646 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n val A 115 2bhgA_129F_117}P -6.303 6.239 -11.232 {"}-6.303 6.239 -11.232 { ca val A 115 2bhgA_129F_117}-7.691 6.206 -10.807 { c val A 115 2bhgA_129F_117}-7.765 5.314 -9.565 { o val A 115 2bhgA_129F_117}-7.14 4.253 -9.522 { c val A 115 2bhgA_129F_117}P -7.765 5.314 -9.565 { n val A 116 2bhgA_129F_117}-8.515 5.749 -8.557 { ca val A 116 2bhgA_129F_117}-8.655 4.977 -7.327 { c val A 116 2bhgA_129F_117}-10.109 4.748 -6.937 { o val A 116 2bhgA_129F_117}-10.889 5.689 -6.862 { c val A 116 2bhgA_129F_117}P -10.109 4.748 -6.937 { n gly A 117 2bhgA_129F_117}-10.463 3.49 -6.692 { ca gly A 117 2bhgA_129F_117}-11.817 3.16 -6.284 { c gly A 117 2bhgA_129F_117}-11.853 2.858 -4.799 { o gly A 117 2bhgA_129F_117}-10.977 2.163 -4.279 { c gly A 117 2bhgA_129F_117}P -11.853 2.858 -4.799 { n val A 118 2bhgA_129F_117}-12.869 3.366 -4.11 { ca val A 118 2bhgA_129F_117}-13.002 3.17 -2.671 { c val A 118 2bhgA_129F_117}-14.159 2.221 -2.386 { o val A 118 2bhgA_129F_117}-15.314 2.532 -2.659 { c val A 118 2bhgA_129F_117}P -14.159 2.221 -2.386 { n val A 119 2bhgA_129F_117}-13.834 1.066 -1.822 { ca val A 119 2bhgA_129F_117}-14.83 0.041 -1.555 { c val A 119 2bhgA_129F_117}-14.969 -0.361 -0.094 { o val A 119 2bhgA_129F_117}-13.984 -0.41 0.642 { n leu A 127 2bhgA_129F_117}P -11.577 -1.798 1.152 {"}-11.577 -1.798 1.152 { ca leu A 127 2bhgA_129F_117}-10.473 -1.918 0.22 { c leu A 127 2bhgA_129F_117}-10.473 -0.841 -0.855 { o leu A 127 2bhgA_129F_117}-11.513 -0.273 -1.179 { c leu A 127 2bhgA_129F_117}P -10.473 -0.841 -0.855 { n ile A 128 2bhgA_129F_117}-9.291 -0.57 -1.402 { ca ile A 128 2bhgA_129F_117}-9.122 0.429 -2.457 { c ile A 128 2bhgA_129F_117}-8.642 -0.289 -3.716 { o ile A 128 2bhgA_129F_117}-7.808 -1.175 -3.623 { c ile A 128 2bhgA_129F_117}P -8.642 -0.289 -3.716 { n phe A 129 2bhgA_129F_117}-9.179 0.043 -4.885 { ca phe A 129 2bhgA_129F_117}-8.649 -0.579 -6.092 { c phe A 129 2bhgA_129F_117}-8.03 0.544 -6.905 { o phe A 129 2bhgA_129F_117}-8.558 1.643 -6.924 { c phe A 129 2bhgA_129F_117}P -8.03 0.544 -6.905 { n ser A 130 2bhgA_129F_117}-6.88 0.301 -7.527 { ca ser A 130 2bhgA_129F_117}-6.267 1.357 -8.311 { c ser A 130 2bhgA_129F_117}-6.065 0.909 -9.748 { o ser A 130 2bhgA_129F_117}-5.83 -0.27 -10.02 { c ser A 130 2bhgA_129F_117}P -6.065 0.909 -9.748 { n gly A 131 2bhgA_129F_117}-6.185 1.864 -10.661 { ca gly A 131 2bhgA_129F_117}-6.012 1.581 -12.072 { c gly A 131 2bhgA_129F_117}-5.659 2.857 -12.798 { o gly A 131 2bhgA_129F_117}-5.019 3.74 -12.235 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 115 2bhgA_129F_117}P -6.303 6.239 -11.232 { ca val A 115 2bhgA_129F_117}P -7.691 6.206 -10.807 { n val A 116 2bhgA_129F_117}P -8.515 5.749 -8.557 { ca val A 116 2bhgA_129F_117}P -8.655 4.977 -7.327 { n gly A 117 2bhgA_129F_117}P -10.463 3.49 -6.692 { ca gly A 117 2bhgA_129F_117}P -11.817 3.16 -6.284 {"}P -11.817 3.16 -6.284 { n val A 118 2bhgA_129F_117}P -12.869 3.366 -4.11 { ca val A 118 2bhgA_129F_117}P -13.002 3.17 -2.671 { n val A 119 2bhgA_129F_117}P -13.834 1.066 -1.822 { ca val A 119 2bhgA_129F_117}P -14.83 0.041 -1.555 { n leu A 127 2bhgA_129F_117}P -11.577 -1.798 1.152 { ca leu A 127 2bhgA_129F_117}P -10.473 -1.918 0.22 { n ile A 128 2bhgA_129F_117}P -9.291 -0.57 -1.402 { ca ile A 128 2bhgA_129F_117}P -9.122 0.429 -2.457 { n phe A 129 2bhgA_129F_117}P -9.179 0.043 -4.885 { ca phe A 129 2bhgA_129F_117}P -8.649 -0.579 -6.092 { n ser A 130 2bhgA_129F_117}P -6.88 0.301 -7.527 { ca ser A 130 2bhgA_129F_117}P -6.267 1.357 -8.311 { n gly A 131 2bhgA_129F_117}P -6.185 1.864 -10.661 { ca gly A 131 2bhgA_129F_117}P -6.012 1.581 -12.072 {"}P -6.012 1.581 -12.072 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca val A 115 2bhgA_129F_117}P -7.691 6.206 -10.807 {"}-7.691 6.206 -10.807 { ca val A 116 2bhgA_129F_117}-8.655 4.977 -7.327 { ca gly A 117 2bhgA_129F_117}-11.817 3.16 -6.284 { ca val A 118 2bhgA_129F_117}-13.002 3.17 -2.671 { ca val A 119 2bhgA_129F_117}-14.83 0.041 -1.555 { ca leu A 127 2bhgA_129F_117}P -10.473 -1.918 0.22 {"}-10.473 -1.918 0.22 { ca ile A 128 2bhgA_129F_117}-9.122 0.429 -2.457 { ca phe A 129 2bhgA_129F_117}-8.649 -0.579 -6.092 { ca ser A 130 2bhgA_129F_117}-6.267 1.357 -8.311 { ca gly A 131 2bhgA_129F_117}-6.012 1.581 -12.072 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca val A 115 2bhgA_129F_117}P -7.691 6.206 -10.807 { ca val A 116 2bhgA_129F_117}P -8.655 4.977 -7.327 { ca val A 118 2bhgA_129F_117}P -13.002 3.17 -2.671 { ca val A 119 2bhgA_129F_117}P -14.83 0.041 -1.555 { ca leu A 127 2bhgA_129F_117}P -10.473 -1.918 0.22 { ca ile A 128 2bhgA_129F_117}P -9.122 0.429 -2.457 { ca phe A 129 2bhgA_129F_117}P -8.649 -0.579 -6.092 { cb phe A 129 2bhgA_129F_117}-9.724 -1.354 -6.884 { cg phe A 129 2bhgA_129F_117}-10.838 -0.51 -7.467 { cd1 phe A 129 2bhgA_129F_117}-10.657 0.205 -8.656 { ce1 phe A 129 2bhgA_129F_117}-11.721 0.909 -9.25 { cz phe A 129 2bhgA_129F_117}-12.972 0.901 -8.645 { cg phe A 129 2bhgA_129F_117}P -10.838 -0.51 -7.467 { cd2 phe A 129 2bhgA_129F_117}-12.092 -0.502 -6.873 { ce2 phe A 129 2bhgA_129F_117}-13.159 0.196 -7.453 { cz phe A 129 2bhgA_129F_117}ghost -12.972 0.901 -8.645 { ca ser A 130 2bhgA_129F_117}P -6.267 1.357 -8.311 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 129 2bhgA_129F_117}P -9.724 -1.354 -6.884 {"}P -9.724 -1.354 -6.884 { cd1 phe A 129 2bhgA_129F_117}P -10.657 0.205 -8.656 { cd2 phe A 129 2bhgA_129F_117}P -12.092 -0.502 -6.873 { ce1 phe A 129 2bhgA_129F_117}P -11.721 0.909 -9.25 { ce2 phe A 129 2bhgA_129F_117}P -13.159 0.196 -7.453 { cz phe A 129 2bhgA_129F_117}P -12.972 0.901 -8.645 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 129 2bhgA_129F_117}P -8.649 -0.579 -6.092 { cb phe A 129 2bhgA_129F_117}-9.724 -1.354 -6.884 { cg phe A 129 2bhgA_129F_117}-10.838 -0.51 -7.467 { cd1 phe A 129 2bhgA_129F_117}-10.657 0.205 -8.656 { ce1 phe A 129 2bhgA_129F_117}-11.721 0.909 -9.25 { cz phe A 129 2bhgA_129F_117}-12.972 0.901 -8.645 { cg phe A 129 2bhgA_129F_117}P -10.838 -0.51 -7.467 { cd2 phe A 129 2bhgA_129F_117}-12.092 -0.502 -6.873 { ce2 phe A 129 2bhgA_129F_117}-13.159 0.196 -7.453 { cz phe A 129 2bhgA_129F_117}ghost -12.972 0.901 -8.645 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 129 2bhgA_129F_117}P -9.724 -1.354 -6.884 {"}P -9.724 -1.354 -6.884 { cd1 phe A 129 2bhgA_129F_117}P -10.657 0.205 -8.656 { cd2 phe A 129 2bhgA_129F_117}P -12.092 -0.502 -6.873 { ce1 phe A 129 2bhgA_129F_117}P -11.721 0.909 -9.25 { ce2 phe A 129 2bhgA_129F_117}P -13.159 0.196 -7.453 { cz phe A 129 2bhgA_129F_117}P -12.972 0.901 -8.645 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 129 A}'P' sky -11.483 1.104 -7.266 {"}'P' sky -11.234 1.182 -7.262 {"}'P' sky -11.29 1.117 -7.006 { CD1 PHE 129 A}'P' blue -11.101 1.615 -7.719 {"}'P' sky -11.559 1.185 -7.521 {"}'P' sky -11.348 1.337 -7.514 {"}'P' sky -11.112 1.446 -7.51 {"}'P' blue -11.098 1.254 -7.326 { CD2 PHE 129 A}'P' sky -11.845 1.079 -6.164 { CE1 PHE 129 A}'P' sky -11.235 1.703 -7.768 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 129 A}'P' sea -11.523 1.122 -7.192 {"}'P' green -11.704 1.203 -6.929 {"}'P' sea -11.454 1.127 -6.933 {"}'P' green -11.712 1.194 -6.668 {"}'P' sea -11.462 1.118 -6.671 {"}'P' green -12.027 1.184 -6.41 {"}'P' green -11.767 1.154 -6.411 {"}'P' sea -12.355 1.076 -6.164 {"}'P' sea -12.1 1.098 -6.163 { CE1 PHE 129 A}'P' green -11.924 2.213 -8.101 {"}'P' sea -11.664 2.227 -8.1 {"}'P' green -11.657 2.04 -7.917 {"}'P' sea -11.403 1.999 -7.918 {"}'P' green -11.474 1.799 -7.764 {"}'P' green -11.589 1.587 -7.642 {"}'P' sea -11.341 1.497 -7.646 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CD2 PHE 129 A}'P' P -11.97 1.231 -6.666 {"}'P' -11.972 1.194 -6.671 { CE1 PHE 129 A}'P' P -11.729 1.831 -7.762 {"}'P' -11.729 1.816 -7.787 { CE2 PHE 129 A}'P' P -12.077 1.559 -7.263 {"}'P' -12.178 1.432 -7.28 {"}'P' P -11.885 1.382 -7.27 {"}'P' -11.932 1.339 -7.277 {"}'P' P -13.094 1.882 -6.99 {"}'P' -13.097 1.806 -7.011 {"}'P' P -12.834 1.852 -6.991 {"}'P' -12.868 1.678 -7.04 {"}'P' P -12.125 1.535 -7.005 {"}'P' -12.242 1.383 -7.056 {"}'P' P -11.93 1.361 -7.012 {"}'P' -11.998 1.296 -7.037 {"}'P' P -13.167 1.796 -6.743 {"}'P' -13.167 1.769 -6.755 {"}'P' P -12.912 1.777 -6.744 {"}'P' -12.931 1.656 -6.798 {"}'P' P -12.208 1.49 -6.757 {"}'P' -12.307 1.355 -6.829 {"}'P' P -12.013 1.325 -6.764 {"}'P' -12.074 1.264 -6.801 {"}'P' P -13.095 1.671 -6.513 {"}'P' -13.095 1.665 -6.516 {"}'P' P -12.84 1.638 -6.514 {"}'P' -12.856 1.563 -6.563 {"}'P' P -12.594 1.563 -6.517 {"}'P' -12.637 1.458 -6.589 {"}'P' P -12.364 1.447 -6.523 {"}'P' -12.42 1.359 -6.588 {"}'P' P -12.158 1.294 -6.529 {"}'P' -12.193 1.256 -6.562 {"}'P' P -12.598 1.395 -6.308 {"}'P' -12.605 1.381 -6.322 { CZ PHE 129 A}'P' P -12.476 2.423 -7.939 {"}'P' -12.481 2.408 -7.946 {"}'P' P -12.24 2.327 -7.943 {"}'P' -12.256 2.295 -7.958 {"}'P' P -12.021 2.195 -7.949 {"}'P' -12.037 2.173 -7.96 {"}'P' P -12.908 2.376 -7.705 {"}'P' -12.909 2.357 -7.717 {"}'P' P -12.653 2.343 -7.706 {"}'P' -12.67 2.264 -7.758 {"}'P' P -12.407 2.268 -7.709 {"}'P' -12.453 2.157 -7.785 {"}'P' P -12.177 2.152 -7.715 {"}'P' -12.245 2.046 -7.794 {"}'P' P -11.971 1.999 -7.721 {"}'P' -12.037 1.927 -7.782 {"}'P' P -11.793 1.814 -7.729 {"}'P' -11.827 1.788 -7.756 {"}'P' P -12.915 2.219 -7.495 {"}'P' -12.918 2.148 -7.558 {"}'P' P -12.657 2.184 -7.497 {"}'P' -12.69 2.052 -7.615 {"}'P' P -11.988 1.803 -7.513 {"}'P' -12.08 1.718 -7.619 {"}'P' P -11.825 1.599 -7.522 {"}'P' -11.873 1.57 -7.569 {"}'P' P -13.165 2.019 -7.312 {"}'P' -13.162 2.003 -7.331 {"}'P' P -12.908 2.032 -7.312 {"}'P' -12.913 1.945 -7.415 {"}'P' P -12.024 1.565 -7.332 {"}'P' -12.102 1.51 -7.44 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 PHE 129 A}'P' P -12.582 1.783 -6.994 {"}'P' -12.666 1.553 -7.06 {"}'P' P -12.344 1.676 -6.999 {"}'P' -12.465 1.457 -7.066 {"}'P' P -12.663 1.718 -6.747 {"}'P' -12.722 1.539 -6.83 {"}'P' P -12.427 1.622 -6.751 {"}'P' -12.521 1.439 -6.841 { CZ PHE 129 A}'P' P -12.411 2.1 -7.5 {"}'P' -12.484 1.944 -7.65 {"}'P' P -12.185 1.972 -7.506 {"}'P' -12.285 1.836 -7.65 {"}'P' P -12.654 1.991 -7.313 {"}'P' -12.694 1.853 -7.482 {"}'P' P -12.414 1.896 -7.318 {"}'P' -12.497 1.749 -7.513 {"}'P' P -12.201 1.751 -7.324 {"}'P' -12.301 1.641 -7.495 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 117 A}'P' blue -11.245 1.823 -7.382 {"}'P' blue -11.281 1.597 -7.144 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 117 A}'P' green -11.734 2.09 -7.917 {"}'P' sea -11.67 2.344 -7.906 {"}'P' green -11.493 2.081 -7.778 {"}'P' sea -11.404 1.835 -7.603 {"}'P' green -11.573 1.637 -7.612 {"}'P' sea -11.579 1.445 -7.398 {"}'P' green -11.676 1.278 -7.158 {"}'P' green -11.63 1.257 -6.898 {"}'P' green -11.676 1.255 -6.638 {"}'P' green -11.804 1.283 -6.389 {"}'P' green -12.051 1.222 -6.391 {"}'P' sea -12.04 1.355 -6.164 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 117 A}'P' P -12.048 2.115 -8.002 {"}'P' -12.053 2.122 -7.956 {"}'P' P -12.308 2.115 -8.002 {"}'P' -12.296 2.131 -7.892 {"}'P' P -12.438 2.34 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-6.747 {"}'M' greentint -9.187 2.88 -6.741 {"}'M' greentint -8.947 2.975 -6.737 {"}'M' greentint -9.898 1.754 -6.536 {"}'M' greentint -9.85 2.005 -6.525 {"}'M' greentint -9.755 2.243 -6.514 {"}'M' greentint -9.616 2.458 -6.505 {"}'M' greentint -9.44 2.643 -6.497 {"}'M' greentint -9.231 2.791 -6.49 {"}'M' greentint -8.998 2.898 -6.486 {"}'M' greentint -9.756 1.983 -6.285 {"}'M' greentint -9.658 2.216 -6.274 {"}'M' greentint -9.514 2.425 -6.265 {"}'M' greentint -9.331 2.601 -6.258 {"}'M' greentint -9.117 2.736 -6.252 {"}'M' greentint -9.491 2.22 -6.054 {"}'M' greentint -9.325 2.418 -6.046 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H GLY 117 A}'M' P -9.009 2.235 -7.047 {"}'M' -9.029 2.246 -7.04 {"}'M' P -9.163 2.035 -7.055 {"}'M' -9.186 2.058 -7.046 {"}'M' P -8.966 2.232 -6.788 {"}'M' -8.997 2.249 -6.787 {"}'M' P -9.112 2.028 -6.797 {"}'M' -9.153 2.067 -6.795 {"}'M' P -9.303 1.867 -6.804 {"}'M' -9.307 1.872 -6.803 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 117 A}'M' greentint -9.187 2.482 -7.485 {"}'M' greentint -9.323 2.261 -7.494 {"}'M' greentint -9.531 2.104 -7.501 {"}'M' greentint -9.139 2.737 -7.473 {"}'M' greentint -9.016 2.481 -7.277 {"}'M' greentint -9.126 2.247 -7.288 {"}'M' greentint -9.3 2.057 -7.296 {"}'M' greentint -9.522 1.925 -7.302 {"}'M' greentint -9.773 1.866 -7.304 {"}'M' greentint -8.98 2.736 -7.266 {"}'M' greentint -8.913 2.468 -7.036 {"}'M' greentint -9.363 1.882 -7.062 {"}'M' greentint -9.596 1.785 -7.066 {"}'M' greentint -9.846 1.752 -7.068 {"}'M' greentint -8.913 2.967 -7.015 {"}'M' greentint -8.88 2.717 -7.026 {"}'M' greentint -8.875 2.465 -6.778 {"}'M' greentint -9.529 1.758 -6.808 {"}'M' greentint -9.775 1.709 -6.811 {"}'M' greentint -8.879 2.962 -6.756 {"}'M' greentint -8.846 2.714 -6.767 {"}'M' greentint -8.913 2.445 -6.519 {"}'M' greentint -9.009 2.212 -6.529 {"}'M' greentint -9.163 2.012 -6.538 {"}'M' greentint -9.363 1.859 -6.545 {"}'M' greentint -9.596 1.763 -6.549 {"}'M' greentint -9.846 1.73 -6.551 {"}'M' greentint -8.88 2.695 -6.508 {"}'M' greentint -9.016 2.437 -6.278 {"}'M' greentint -9.126 2.204 -6.288 {"}'M' greentint -9.3 2.013 -6.297 {"}'M' greentint -9.522 1.882 -6.303 {"}'M' greentint -9.773 1.822 -6.305 {"}'M' greentint -8.98 2.692 -6.267 {"}'M' greentint -9.187 2.42 -6.072 {"}'M' greentint -9.323 2.199 -6.081 {"}'M' greentint -9.531 2.043 -6.088 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 129 A}'M' greentint -10.764 1.186 -5.257 {"}'M' greentint -10.61 1.386 -5.248 {"}'M' greentint -10.41 1.539 -5.241 {"}'M' greentint -10.177 1.635 -5.237 {"}'M' greentint -10.86 1.052 -5.003 {"}'M' greentint -10.741 1.273 -4.994 {"}'M' greentint -10.571 1.457 -4.986 {"}'M' greentint -10.36 1.593 -4.98 {"}'M' greentint -10.122 1.672 -4.976 {"}'M' greentint -9.872 1.69 -4.975 {"}'M' greentint -10.86 0.93 -4.75 {"}'M' greentint -10.764 1.163 -4.739 {"}'M' greentint -10.61 1.363 -4.731 {"}'M' greentint -10.41 1.516 -4.724 {"}'M' greentint -10.177 1.613 -4.72 {"}'M' greentint -9.927 1.646 -4.718 {"}'M' greentint -10.711 1.038 -4.503 {"}'M' greentint -10.567 1.253 -4.494 {"}'M' greentint -10.367 1.415 -4.487 {"}'M' greentint -10.128 1.512 -4.483 {"}'M' greentint -9.871 1.534 -4.482 {"}'M' greentint -10.528 1.033 -4.296 {"}'M' greentint -10.353 1.225 -4.288 {"}'M' greentint -10.121 1.341 -4.283 {"}'M' greentint -9.862 1.365 -4.282 {"}'M' greentint -10.184 1.083 -4.135 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 117 A}'M' greentint -10.333 1.519 -5.343 {"}'M' greentint -10.543 1.371 -5.349 {"}'M' greentint -10.116 1.489 -5.153 {"}'M' greentint -10.303 1.309 -5.161 {"}'M' greentint -10.527 1.178 -5.166 {"}'M' greentint -10.775 1.102 -5.17 {"}'M' greentint -9.948 1.475 -4.934 {"}'M' greentint -10.114 1.283 -4.942 {"}'M' greentint -10.314 1.128 -4.949 {"}'M' greentint -10.542 1.016 -4.954 {"}'M' greentint -10.787 0.953 -4.956 {"}'M' greentint -9.84 1.459 -4.693 {"}'M' greentint -9.997 1.257 -4.702 {"}'M' greentint -10.189 1.089 -4.709 {"}'M' greentint -10.41 0.959 -4.715 {"}'M' greentint -10.652 0.874 -4.719 {"}'M' greentint -9.792 1.435 -4.44 {"}'M' greentint -9.947 1.23 -4.449 {"}'M' greentint -10.137 1.057 -4.457 {"}'M' greentint -10.356 0.922 -4.462 {"}'M' greentint -10.596 0.829 -4.467 {"}'M' greentint -9.941 1.225 -4.191 {"}'M' greentint -10.13 1.051 -4.198 {"}'M' greentint -10.348 0.914 -4.204 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n trp A 294 2ckfA_304F_296}P -8.208 4.794 -12.674 {"}-8.208 4.794 -12.674 { ca trp A 294 2ckfA_304F_296}-9.175 4.97 -11.589 { c trp A 294 2ckfA_304F_296}-8.502 4.914 -10.24 { o trp A 294 2ckfA_304F_296}-7.517 4.176 -10.063 { c trp A 294 2ckfA_304F_296}P -8.502 4.914 -10.24 { n asn A 295 2ckfA_304F_296}-9.026 5.694 -9.299 { ca asn A 295 2ckfA_304F_296}-8.795 5.492 -7.879 { c asn A 295 2ckfA_304F_296}-10.194 5.143 -7.328 { o asn A 295 2ckfA_304F_296}-11.145 5.911 -7.515 { c asn A 295 2ckfA_304F_296}P -10.194 5.143 -7.328 { n gly A 296 2ckfA_304F_296}-10.333 3.968 -6.731 { ca gly A 296 2ckfA_304F_296}-11.67 3.558 -6.254 { c gly A 296 2ckfA_304F_296}-11.65 2.791 -4.956 { o gly A 296 2ckfA_304F_296}-10.563 2.39 -4.452 { c gly A 296 2ckfA_304F_296}P -11.65 2.791 -4.956 { n ala A 297 2ckfA_304F_296}-12.847 2.601 -4.401 { ca ala A 297 2ckfA_304F_296}-12.963 1.68 -3.267 { c ala A 297 2ckfA_304F_296}-14.262 0.91 -3.389 { o ala A 297 2ckfA_304F_296}-15.281 1.402 -3.966 { c ala A 297 2ckfA_304F_296}P -14.262 0.91 -3.389 { n ile A 298 2ckfA_304F_296}-14.202 -0.308 -2.847 { ca ile A 298 2ckfA_304F_296}-15.387 -1.163 -2.669 { c ile A 298 2ckfA_304F_296}-15.666 -1.105 -1.19 { o ile A 298 2ckfA_304F_296}-14.81 -1.436 -0.338 { n cys A 302 2ckfA_304F_296}P -11.957 -1.927 0.868 {"}-11.957 -1.927 0.868 { ca cys A 302 2ckfA_304F_296}-11.055 -2.39 -0.185 { c cys A 302 2ckfA_304F_296}-10.835 -1.195 -1.131 { o cys A 302 2ckfA_304F_296}-11.826 -0.541 -1.531 { c cys A 302 2ckfA_304F_296}P -10.835 -1.195 -1.131 { n ser A 303 2ckfA_304F_296}-9.574 -0.892 -1.431 { ca ser A 303 2ckfA_304F_296}-9.316 0.207 -2.38 { c ser A 303 2ckfA_304F_296}-8.394 -0.302 -3.51 { o ser A 303 2ckfA_304F_296}-7.704 -1.354 -3.395 { c ser A 303 2ckfA_304F_296}P -8.394 -0.302 -3.51 { n phe A 304 2ckfA_304F_296}-8.344 0.445 -4.618 { ca phe A 304 2ckfA_304F_296}-7.526 0.02 -5.719 { c phe A 304 2ckfA_304F_296}-7.196 1.213 -6.626 { o phe A 304 2ckfA_304F_296}-7.908 2.209 -6.63 { c phe A 304 2ckfA_304F_296}P -7.196 1.213 -6.626 { n leu A 305 2ckfA_304F_296}-6.107 1.098 -7.374 { ca leu A 305 2ckfA_304F_296}-5.897 2.009 -8.525 { c leu A 305 2ckfA_304F_296}-5.958 1.119 -9.743 { o leu A 305 2ckfA_304F_296}-5.152 0.227 -9.851 { c leu A 305 2ckfA_304F_296}P -5.958 1.119 -9.743 { n tyr A 306 2ckfA_304F_296}-6.91 1.346 -10.651 { ca tyr A 306 2ckfA_304F_296}-6.876 0.625 -11.933 { c tyr A 306 2ckfA_304F_296}-6.015 1.475 -12.886 { o tyr A 306 2ckfA_304F_296}-6.226 2.675 -12.992 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n trp A 294 2ckfA_304F_296}P -8.208 4.794 -12.674 { ca trp A 294 2ckfA_304F_296}P -9.175 4.97 -11.589 { n asn A 295 2ckfA_304F_296}P -9.026 5.694 -9.299 { ca asn A 295 2ckfA_304F_296}P -8.795 5.492 -7.879 { n gly A 296 2ckfA_304F_296}P -10.333 3.968 -6.731 { ca gly A 296 2ckfA_304F_296}P -11.67 3.558 -6.254 {"}P -11.67 3.558 -6.254 { n ala A 297 2ckfA_304F_296}P -12.847 2.601 -4.401 { ca ala A 297 2ckfA_304F_296}P -12.963 1.68 -3.267 { n ile A 298 2ckfA_304F_296}P -14.202 -0.308 -2.847 { ca ile A 298 2ckfA_304F_296}P -15.387 -1.163 -2.669 { n cys A 302 2ckfA_304F_296}P -11.957 -1.927 0.868 { ca cys A 302 2ckfA_304F_296}P -11.055 -2.39 -0.185 { n ser A 303 2ckfA_304F_296}P -9.574 -0.892 -1.431 { ca ser A 303 2ckfA_304F_296}P -9.316 0.207 -2.38 { n phe A 304 2ckfA_304F_296}P -8.344 0.445 -4.618 { ca phe A 304 2ckfA_304F_296}P -7.526 0.02 -5.719 { n leu A 305 2ckfA_304F_296}P -6.107 1.098 -7.374 { ca leu A 305 2ckfA_304F_296}P -5.897 2.009 -8.525 { n tyr A 306 2ckfA_304F_296}P -6.91 1.346 -10.651 { ca tyr A 306 2ckfA_304F_296}P -6.876 0.625 -11.933 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca trp A 294 2ckfA_304F_296}P -9.175 4.97 -11.589 {"}-9.175 4.97 -11.589 { ca asn A 295 2ckfA_304F_296}-8.795 5.492 -7.879 { ca gly A 296 2ckfA_304F_296}-11.67 3.558 -6.254 { ca ala A 297 2ckfA_304F_296}-12.963 1.68 -3.267 { ca ile A 298 2ckfA_304F_296}-15.387 -1.163 -2.669 { ca cys A 302 2ckfA_304F_296}P -11.055 -2.39 -0.185 {"}-11.055 -2.39 -0.185 { ca ser A 303 2ckfA_304F_296}-9.316 0.207 -2.38 { ca phe A 304 2ckfA_304F_296}-7.526 0.02 -5.719 { ca leu A 305 2ckfA_304F_296}-5.897 2.009 -8.525 { ca tyr A 306 2ckfA_304F_296}-6.876 0.625 -11.933 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca trp A 294 2ckfA_304F_296}P -9.175 4.97 -11.589 { ca asn A 295 2ckfA_304F_296}P -8.795 5.492 -7.879 { ca ala A 297 2ckfA_304F_296}P -12.963 1.68 -3.267 { ca ile A 298 2ckfA_304F_296}P -15.387 -1.163 -2.669 { ca cys A 302 2ckfA_304F_296}P -11.055 -2.39 -0.185 { ca ser A 303 2ckfA_304F_296}P -9.316 0.207 -2.38 { ca phe A 304 2ckfA_304F_296}P -7.526 0.02 -5.719 { cb phe A 304 2ckfA_304F_296}-8.179 -1.122 -6.51 { cg phe A 304 2ckfA_304F_296}-9.471 -0.753 -7.139 { cd1 phe A 304 2ckfA_304F_296}-10.65 -0.883 -6.425 { ce1 phe A 304 2ckfA_304F_296}-11.863 -0.46 -6.982 { cz phe A 304 2ckfA_304F_296}-11.897 0.072 -8.251 { cg phe A 304 2ckfA_304F_296}P -9.471 -0.753 -7.139 { cd2 phe A 304 2ckfA_304F_296}-9.498 -0.162 -8.438 { ce2 phe A 304 2ckfA_304F_296}-10.711 0.23 -9.006 { cz phe A 304 2ckfA_304F_296}ghost -11.897 0.072 -8.251 { ca leu A 305 2ckfA_304F_296}P -5.897 2.009 -8.525 { ca tyr A 306 2ckfA_304F_296}P -6.876 0.625 -11.933 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 304 2ckfA_304F_296}P -8.179 -1.122 -6.51 {"}P -8.179 -1.122 -6.51 { cd1 phe A 304 2ckfA_304F_296}P -10.65 -0.883 -6.425 { cd2 phe A 304 2ckfA_304F_296}P -9.498 -0.162 -8.438 { ce1 phe A 304 2ckfA_304F_296}P -11.863 -0.46 -6.982 { ce2 phe A 304 2ckfA_304F_296}P -10.711 0.23 -9.006 { cz phe A 304 2ckfA_304F_296}P -11.897 0.072 -8.251 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 304 2ckfA_304F_296}P -7.526 0.02 -5.719 { cb phe A 304 2ckfA_304F_296}-8.179 -1.122 -6.51 { cg phe A 304 2ckfA_304F_296}-9.471 -0.753 -7.139 { cd1 phe A 304 2ckfA_304F_296}-10.65 -0.883 -6.425 { ce1 phe A 304 2ckfA_304F_296}-11.863 -0.46 -6.982 { cz phe A 304 2ckfA_304F_296}-11.897 0.072 -8.251 { cg phe A 304 2ckfA_304F_296}P -9.471 -0.753 -7.139 { cd2 phe A 304 2ckfA_304F_296}-9.498 -0.162 -8.438 { ce2 phe A 304 2ckfA_304F_296}-10.711 0.23 -9.006 { cz phe A 304 2ckfA_304F_296}ghost -11.897 0.072 -8.251 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 304 2ckfA_304F_296}P -8.179 -1.122 -6.51 {"}P -8.179 -1.122 -6.51 { cd1 phe A 304 2ckfA_304F_296}P -10.65 -0.883 -6.425 { cd2 phe A 304 2ckfA_304F_296}P -9.498 -0.162 -8.438 { ce1 phe A 304 2ckfA_304F_296}P -11.863 -0.46 -6.982 { ce2 phe A 304 2ckfA_304F_296}P -10.711 0.23 -9.006 { cz phe A 304 2ckfA_304F_296}P -11.897 0.072 -8.251 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 304 A}'P' blue -12.293 1.764 -8.046 {"}'P' blue -12.036 1.804 -8.044 {"}'P' blue -11.775 1.805 -8.044 {"}'P' sky -12.349 1.699 -7.79 {"}'P' sky -11.832 1.758 -7.788 {"}'P' blue -11.572 1.728 -7.789 {"}'P' sky -12.408 1.589 -7.545 {"}'P' sky -11.65 1.653 -7.542 {"}'P' sky -12.341 1.482 -7.314 {"}'P' sky -12.09 1.536 -7.311 {"}'P' sky -11.833 1.547 -7.311 {"}'P' blue -11.578 1.514 -7.312 {"}'P' blue -12.1 1.376 -7.102 {"}'P' blue -11.84 1.39 -7.101 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 304 A}'P' sea -12.093 1.748 -7.788 {"}'P' sea -12.16 1.65 -7.542 {"}'P' sea -11.905 1.672 -7.541 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 296 A}'P' blue -11.762 2.144 -7.791 {"}'P' sky -12.012 2.068 -7.794 {"}'P' sky -12.272 2.066 -7.794 {"}'P' blue -11.551 2.095 -7.571 {"}'P' sky -11.776 1.977 -7.576 {"}'P' blue -12.524 1.977 -7.576 {"}'P' sky -11.648 1.928 -7.331 {"}'P' sky -12.396 1.839 -7.335 {"}'P' blue -11.837 1.814 -7.075 {"}'P' sky -12.087 1.773 -7.077 {"}'P' blue -12.339 1.787 -7.076 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 296 A}'P' sea -12.023 1.917 -7.579 {"}'P' sea -12.277 1.917 -7.579 {"}'P' sea -11.888 1.842 -7.335 {"}'P' sea -12.142 1.812 -7.336 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 304 A}'M' green -9.004 2.844 -7.227 {"}'M' green -8.859 3.052 -7.218 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 304 A}'M' greentint -9.202 2.597 -6.997 {"}'M' greentint -9.109 2.835 -6.986 {"}'M' greentint -8.971 3.051 -6.977 {"}'M' greentint -8.796 3.237 -6.969 {"}'M' greentint -9.278 2.471 -6.748 {"}'M' greentint -9.208 2.718 -6.737 {"}'M' greentint -9.093 2.948 -6.727 {"}'M' greentint -8.938 3.153 -6.718 {"}'M' greentint -8.748 3.326 -6.711 {"}'M' greentint -9.28 2.451 -6.49 {"}'M' greentint -9.211 2.699 -6.479 {"}'M' greentint -9.098 2.93 -6.469 {"}'M' greentint -8.944 3.136 -6.46 {"}'M' greentint -8.755 3.31 -6.453 {"}'M' greentint -9.2 2.571 -6.231 {"}'M' greentint -9.105 2.809 -6.22 {"}'M' greentint -8.966 3.024 -6.211 {"}'M' greentint -8.79 3.209 -6.203 {"}'M' greentint -9.008 2.782 -5.98 {"}'M' greentint -8.864 2.991 -5.971 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 296 A}'M' greentint -8.765 3.087 -7.079 {"}'M' greentint -8.875 2.853 -7.09 {"}'M' greentint -9.049 2.663 -7.098 {"}'M' greentint -8.662 3.074 -6.838 {"}'M' greentint -8.758 2.841 -6.849 {"}'M' greentint -8.912 2.641 -6.857 {"}'M' greentint -9.112 2.488 -6.864 {"}'M' greentint -8.629 3.323 -6.828 {"}'M' greentint -8.624 3.071 -6.58 {"}'M' greentint -8.715 2.838 -6.59 {"}'M' greentint -8.861 2.634 -6.599 {"}'M' greentint -9.052 2.473 -6.606 {"}'M' greentint -9.278 2.364 -6.61 {"}'M' greentint -8.595 3.32 -6.569 {"}'M' greentint -8.662 3.051 -6.321 {"}'M' greentint -8.758 2.818 -6.331 {"}'M' greentint -8.912 2.618 -6.34 {"}'M' greentint -9.112 2.465 -6.347 {"}'M' greentint -8.629 3.301 -6.31 {"}'M' greentint -8.765 3.043 -6.08 {"}'M' greentint -8.875 2.81 -6.09 {"}'M' greentint -9.049 2.619 -6.099 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 304 A}'M' green -9.623 1.692 -5.24 {"}'M' green -9.479 1.906 -5.231 {"}'M' green -9.805 1.313 -5.016 {"}'M' green -9.44 1.643 -4.034 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 304 A}'M' greentint -9.772 1.563 -5.005 {"}'M' greentint -9.676 1.796 -4.995 {"}'M' greentint -9.522 1.996 -4.986 {"}'M' greentint -9.322 2.149 -4.979 {"}'M' greentint -9.832 1.419 -4.752 {"}'M' greentint -9.772 1.662 -4.741 {"}'M' greentint -9.653 1.883 -4.732 {"}'M' greentint -9.483 2.067 -4.724 {"}'M' greentint -9.272 2.203 -4.718 {"}'M' greentint -9.805 1.291 -4.498 {"}'M' greentint -9.772 1.54 -4.488 {"}'M' greentint -9.676 1.773 -4.477 {"}'M' greentint -9.522 1.973 -4.469 {"}'M' greentint -9.322 2.126 -4.462 {"}'M' greentint -9.697 1.401 -4.252 {"}'M' greentint -9.623 1.648 -4.241 {"}'M' greentint -9.479 1.863 -4.232 {"}'M' greentint -9.279 2.025 -4.225 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 296 A}'M' green -9.335 2.165 -5.086 {"}'M' green -9.588 1.445 -4.11 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 296 A}'M' greentint -9.411 1.923 -5.097 {"}'M' greentint -9.534 1.702 -5.107 {"}'M' greentint -9.7 1.51 -5.115 {"}'M' greentint -9.239 2.16 -4.846 {"}'M' greentint -9.31 1.914 -4.856 {"}'M' greentint -9.426 1.686 -4.866 {"}'M' greentint -9.583 1.484 -4.875 {"}'M' greentint -9.775 1.316 -4.882 {"}'M' greentint -9.193 2.14 -4.592 {"}'M' greentint -9.263 1.893 -4.603 {"}'M' greentint -9.378 1.662 -4.613 {"}'M' greentint -9.533 1.457 -4.622 {"}'M' greentint -9.723 1.284 -4.63 {"}'M' greentint -9.191 2.137 -4.334 {"}'M' greentint -9.26 1.889 -4.345 {"}'M' greentint -9.373 1.658 -4.355 {"}'M' greentint -9.527 1.452 -4.364 {"}'M' greentint -9.716 1.278 -4.371 {"}'M' greentint -9.313 1.873 -4.091 {"}'M' greentint -9.43 1.646 -4.101 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ser X 126 2f68X_128F_324}P -11.097 -1.118 1.811 {"}-11.097 -1.118 1.811 { ca ser X 126 2f68X_128F_324}-10.631 -1.83 0.622 { c ser X 126 2f68X_128F_324}-10.718 -0.922 -0.603 { o ser X 126 2f68X_128F_324}-11.639 -0.111 -0.711 { c ser X 126 2f68X_128F_324}P -10.718 -0.922 -0.603 { n gly X 127 2f68X_128F_324}-9.764 -1.062 -1.521 { ca gly X 127 2f68X_128F_324}-9.736 -0.227 -2.721 { c gly X 127 2f68X_128F_324}-8.853 -0.732 -3.846 { o gly X 127 2f68X_128F_324}-8.232 -1.792 -3.735 { c gly X 127 2f68X_128F_324}P -8.853 -0.732 -3.846 { n phe X 128 2f68X_128F_324}-8.802 0.038 -4.933 { ca phe X 128 2f68X_128F_324}-7.997 -0.312 -6.106 { c phe X 128 2f68X_128F_324}-7.426 0.91 -6.831 { o phe X 128 2f68X_128F_324}-7.87 2.04 -6.612 { c phe X 128 2f68X_128F_324}P -7.426 0.91 -6.831 { n ala X 129 2f68X_128F_324}-6.442 0.662 -7.694 { ca ala X 129 2f68X_128F_324}-5.828 1.701 -8.517 { c ala X 129 2f68X_128F_324}-5.564 1.176 -9.926 { o ala X 129 2f68X_128F_324}-4.673 0.348 -10.135 { c ala X 129 2f68X_128F_324}P -5.564 1.176 -9.926 { n glu X 130 2f68X_128F_324}-6.349 1.661 -10.884 { ca glu X 130 2f68X_128F_324}-6.245 1.228 -12.274 { c glu X 130 2f68X_128F_324}-5.702 2.355 -13.151 { o glu X 130 2f68X_128F_324}-6.265 3.452 -13.182 { n asn X 322 2f68X_128F_324}P -8.395 5.218 -13.252 {"}-8.395 5.218 -13.252 { ca asn X 322 2f68X_128F_324}-9.459 5.2 -12.249 { c asn X 322 2f68X_128F_324}-8.995 4.632 -10.91 { o asn X 322 2f68X_128F_324}-8.131 3.753 -10.865 { c asn X 322 2f68X_128F_324}P -8.995 4.632 -10.91 { n ala X 323 2f68X_128F_324}-9.578 5.138 -9.826 { ca ala X 323 2f68X_128F_324}-9.265 4.668 -8.478 { c ala X 323 2f68X_128F_324}-10.496 4.706 -7.577 { o ala X 323 2f68X_128F_324}-11.19 5.724 -7.499 { c ala X 323 2f68X_128F_324}P -10.496 4.706 -7.577 { n gly X 324 2f68X_128F_324}-10.76 3.588 -6.904 { ca gly X 324 2f68X_128F_324}-11.902 3.471 -6 { c gly X 324 2f68X_128F_324}-11.505 3 -4.614 { o gly X 324 2f68X_128F_324}-10.457 2.375 -4.44 { c gly X 324 2f68X_128F_324}P -11.505 3 -4.614 { n ile X 325 2f68X_128F_324}-12.35 3.305 -3.631 { ca ile X 325 2f68X_128F_324}-12.096 2.951 -2.23 { c ile X 325 2f68X_128F_324}-13.402 2.828 -1.434 { o ile X 325 2f68X_128F_324}-14.293 3.676 -1.543 { c ile X 325 2f68X_128F_324}P -13.402 2.828 -1.434 { n glu X 326 2f68X_128F_324}-13.507 1.756 -0.653 { ca glu X 326 2f68X_128F_324}-14.675 1.501 0.192 { c glu X 326 2f68X_128F_324}-14.289 1.509 1.669 { o glu X 326 2f68X_128F_324}-13.161 1.16 2.023 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser X 126 2f68X_128F_324}P -11.097 -1.118 1.811 { ca ser X 126 2f68X_128F_324}P -10.631 -1.83 0.622 { n gly X 127 2f68X_128F_324}P -9.764 -1.062 -1.521 { ca gly X 127 2f68X_128F_324}P -9.736 -0.227 -2.721 {"}P -9.736 -0.227 -2.721 { n phe X 128 2f68X_128F_324}P -8.802 0.038 -4.933 { ca phe X 128 2f68X_128F_324}P -7.997 -0.312 -6.106 { n ala X 129 2f68X_128F_324}P -6.442 0.662 -7.694 { ca ala X 129 2f68X_128F_324}P -5.828 1.701 -8.517 { n glu X 130 2f68X_128F_324}P -6.349 1.661 -10.884 { ca glu X 130 2f68X_128F_324}P -6.245 1.228 -12.274 { n asn X 322 2f68X_128F_324}P -8.395 5.218 -13.252 { ca asn X 322 2f68X_128F_324}P -9.459 5.2 -12.249 { n ala X 323 2f68X_128F_324}P -9.578 5.138 -9.826 { ca ala X 323 2f68X_128F_324}P -9.265 4.668 -8.478 { n gly X 324 2f68X_128F_324}P -10.76 3.588 -6.904 { ca gly X 324 2f68X_128F_324}P -11.902 3.471 -6 {"}P -11.902 3.471 -6 { n ile X 325 2f68X_128F_324}P -12.35 3.305 -3.631 { ca ile X 325 2f68X_128F_324}P -12.096 2.951 -2.23 { n glu X 326 2f68X_128F_324}P -13.507 1.756 -0.653 { ca glu X 326 2f68X_128F_324}P -14.675 1.501 0.192 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ser X 126 2f68X_128F_324}P -10.631 -1.83 0.622 {"}-10.631 -1.83 0.622 { ca gly X 127 2f68X_128F_324}-9.736 -0.227 -2.721 { ca phe X 128 2f68X_128F_324}-7.997 -0.312 -6.106 { ca ala X 129 2f68X_128F_324}-5.828 1.701 -8.517 { ca glu X 130 2f68X_128F_324}-6.245 1.228 -12.274 { ca asn X 322 2f68X_128F_324}P -9.459 5.2 -12.249 {"}-9.459 5.2 -12.249 { ca ala X 323 2f68X_128F_324}-9.265 4.668 -8.478 { ca gly X 324 2f68X_128F_324}-11.902 3.471 -6 { ca ile X 325 2f68X_128F_324}-12.096 2.951 -2.23 { ca glu X 326 2f68X_128F_324}-14.675 1.501 0.192 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ser X 126 2f68X_128F_324}P -10.631 -1.83 0.622 { ca phe X 128 2f68X_128F_324}P -7.997 -0.312 -6.106 { cb phe X 128 2f68X_128F_324}-8.801 -1.196 -7.077 { cg phe X 128 2f68X_128F_324}-9.896 -0.466 -7.815 { cd1 phe X 128 2f68X_128F_324}-9.669 0.056 -9.086 { ce1 phe X 128 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{"}'P' -11.969 1.445 -7.356 {"}'P' P -12.298 1.411 -7.102 {"}'P' -12.298 1.409 -7.103 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 177 A}'P' sky -11.722 1.766 -7.908 {"}'P' sky -11.736 1.555 -6.679 {"}'P' blue -12.709 1.673 -6.674 {"}'P' sky -11.972 1.627 -6.454 {"}'P' sky -12.482 1.695 -6.451 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 177 A}'P' sea -11.972 1.69 -7.911 {"}'P' green -12.232 1.688 -7.911 {"}'P' sea -12.482 1.759 -7.908 {"}'P' green -11.736 1.599 -7.693 {"}'P' green -11.983 1.539 -7.696 {"}'P' green -12.484 1.599 -7.693 {"}'P' sea -12.709 1.717 -7.688 {"}'P' sea -11.608 1.55 -7.448 {"}'P' green -12.598 1.543 -7.448 {"}'P' sea -12.815 1.677 -7.442 {"}'P' sea -11.562 1.529 -7.188 {"}'P' green -11.797 1.436 -7.192 {"}'P' green -12.543 1.476 -7.19 {"}'P' sea -12.767 1.595 -7.185 {"}'P' sea -11.848 1.441 -6.931 {"}'P' green -12.102 1.411 -6.933 {"}'P' green -12.356 1.438 -6.931 {"}'P' sea -12.598 1.52 -6.928 {"}'P' green -11.983 1.494 -6.681 {"}'P' green -12.237 1.494 -6.681 {"}'P' sea -12.484 1.555 -6.679 {"}'P' sea -12.232 1.624 -6.454 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 177 A}'P' P -12.237 1.539 -7.696 {"}'P' -12.236 1.546 -7.692 {"}'P' P -11.848 1.464 -7.452 {"}'P' -11.848 1.465 -7.451 {"}'P' P -12.102 1.434 -7.453 {"}'P' -12.102 1.471 -7.443 {"}'P' P -12.356 1.461 -7.452 {"}'P' -12.35 1.489 -7.444 {"}'P' P -12.047 1.395 -7.194 {"}'P' -12.048 1.411 -7.193 {"}'P' P -12.299 1.409 -7.193 {"}'P' -12.296 1.427 -7.193 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 164 A}'M' greentint -9.264 2.468 -7.166 {"}'M' greentint -9.164 2.701 -7.156 {"}'M' greentint -9.019 2.909 -7.147 {"}'M' greentint -8.835 3.083 -7.139 {"}'M' greentint -9.362 2.454 -6.926 {"}'M' greentint -9.269 2.692 -6.915 {"}'M' greentint -9.131 2.908 -6.906 {"}'M' greentint -8.956 3.094 -6.898 {"}'M' greentint -8.748 3.244 -6.891 {"}'M' greentint -9.438 2.328 -6.677 {"}'M' greentint -9.368 2.575 -6.666 {"}'M' greentint -9.253 2.805 -6.656 {"}'M' greentint -9.098 3.01 -6.647 {"}'M' greentint -8.908 3.183 -6.64 {"}'M' greentint -8.689 3.318 -6.634 {"}'M' greentint -9.44 2.308 -6.419 {"}'M' greentint -9.371 2.556 -6.408 {"}'M' greentint -9.258 2.787 -6.398 {"}'M' greentint -9.104 2.993 -6.389 {"}'M' greentint -8.915 3.167 -6.382 {"}'M' greentint -9.36 2.428 -6.16 {"}'M' greentint -9.265 2.666 -6.149 {"}'M' greentint -9.126 2.881 -6.14 {"}'M' greentint -8.95 3.066 -6.132 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 177 A}'M' greentint -8.823 2.926 -7.157 {"}'M' greentint -8.933 2.692 -7.168 {"}'M' greentint -9.107 2.502 -7.176 {"}'M' greentint -8.72 2.913 -6.916 {"}'M' greentint -8.816 2.68 -6.927 {"}'M' greentint -8.97 2.48 -6.935 {"}'M' greentint -9.17 2.327 -6.942 {"}'M' greentint -9.403 2.23 -6.946 {"}'M' greentint -8.687 3.162 -6.906 {"}'M' greentint -8.682 2.91 -6.658 {"}'M' greentint -8.773 2.677 -6.668 {"}'M' greentint -8.919 2.473 -6.677 {"}'M' greentint -9.11 2.312 -6.684 {"}'M' greentint -9.336 2.203 -6.688 {"}'M' greentint -8.653 3.159 -6.647 {"}'M' greentint -8.72 2.89 -6.399 {"}'M' greentint -8.816 2.657 -6.409 {"}'M' greentint -8.97 2.457 -6.418 {"}'M' greentint -9.17 2.304 -6.425 {"}'M' greentint -9.403 2.208 -6.429 {"}'M' greentint -8.687 3.14 -6.388 {"}'M' greentint -8.823 2.882 -6.158 {"}'M' greentint -8.933 2.649 -6.168 {"}'M' greentint -9.107 2.458 -6.177 {"}'M' greentint -9.329 2.327 -6.183 {"}'M' greentint -8.787 3.137 -6.147 {"}'M' greentint -8.994 2.865 -5.952 {"}'M' greentint -9.13 2.644 -5.961 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 164 A}'M' greentint -9.736 1.668 -5.099 {"}'M' greentint -9.561 1.86 -5.091 {"}'M' greentint -9.993 1.408 -4.903 {"}'M' greentint -9.919 1.655 -4.892 {"}'M' greentint -9.775 1.869 -4.883 {"}'M' greentint -9.575 2.032 -4.876 {"}'M' greentint -9.336 2.128 -4.872 {"}'M' greentint -10.101 1.276 -4.668 {"}'M' greentint -10.068 1.526 -4.657 {"}'M' greentint -9.972 1.759 -4.647 {"}'M' greentint -9.818 1.959 -4.638 {"}'M' greentint -9.618 2.112 -4.631 {"}'M' greentint -9.385 2.208 -4.627 {"}'M' greentint -10.128 1.382 -4.404 {"}'M' greentint -10.068 1.625 -4.393 {"}'M' greentint -9.949 1.846 -4.384 {"}'M' greentint -9.779 2.03 -4.376 {"}'M' greentint -9.568 2.166 -4.37 {"}'M' greentint -9.33 2.245 -4.366 {"}'M' greentint -10.068 1.503 -4.14 {"}'M' greentint -9.972 1.736 -4.129 {"}'M' greentint -9.818 1.936 -4.121 {"}'M' greentint -9.618 2.089 -4.114 {"}'M' greentint -9.385 2.186 -4.11 {"}'M' greentint -9.919 1.611 -3.893 {"}'M' greentint -9.775 1.826 -3.884 {"}'M' greentint -9.575 1.988 -3.877 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 177 A}'M' greentint -9.312 2.071 -4.951 {"}'M' greentint -9.428 1.843 -4.961 {"}'M' greentint -9.585 1.641 -4.97 {"}'M' greentint -9.777 1.473 -4.977 {"}'M' greentint -9.265 2.05 -4.698 {"}'M' greentint -9.38 1.819 -4.708 {"}'M' greentint -9.535 1.614 -4.717 {"}'M' greentint -9.725 1.441 -4.725 {"}'M' greentint -9.944 1.306 -4.73 {"}'M' greentint -9.262 2.046 -4.44 {"}'M' greentint -9.375 1.815 -4.45 {"}'M' greentint -9.529 1.609 -4.459 {"}'M' greentint -9.718 1.435 -4.466 {"}'M' greentint -9.936 1.298 -4.472 {"}'M' greentint -9.315 2.03 -4.186 {"}'M' greentint -9.432 1.803 -4.196 {"}'M' greentint -9.59 1.602 -4.205 {"}'M' greentint -9.784 1.434 -4.212 {"}'M' greentint -10.006 1.307 -4.218 {"}'M' greentint -9.41 2.033 -3.945 {"}'M' greentint -9.532 1.811 -3.954 {"}'M' greentint -9.696 1.618 -3.963 {"}'M' greentint -9.895 1.462 -3.97 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n asn X 149 2fgqX_175Y_151}P -7.308 5.808 -12.553 {"}-7.308 5.808 -12.553 { ca asn X 149 2fgqX_175Y_151}-8.564 5.897 -11.811 { c asn X 149 2fgqX_175Y_151}-8.46 5.014 -10.577 { o asn X 149 2fgqX_175Y_151}-7.704 4.067 -10.552 { c asn X 149 2fgqX_175Y_151}P -8.46 5.014 -10.577 { n ala X 150 2fgqX_175Y_151}-9.238 5.344 -9.555 { ca ala X 150 2fgqX_175Y_151}-9.181 4.594 -8.298 { c ala X 150 2fgqX_175Y_151}-10.531 4.578 -7.616 { o ala X 150 2fgqX_175Y_151}-11.401 5.392 -7.894 { c ala X 150 2fgqX_175Y_151}P -10.531 4.578 -7.616 { n gly X 151 2fgqX_175Y_151}-10.679 3.63 -6.708 { ca gly X 151 2fgqX_175Y_151}-11.902 3.493 -5.929 { c gly X 151 2fgqX_175Y_151}-11.576 2.988 -4.533 { o gly X 151 2fgqX_175Y_151}-10.597 2.246 -4.342 { c gly X 151 2fgqX_175Y_151}P -11.576 2.988 -4.533 { n phe X 152 2fgqX_175Y_151}-12.36 3.447 -3.55 { ca phe X 152 2fgqX_175Y_151}-12.107 3.174 -2.155 { c phe X 152 2fgqX_175Y_151}-13.435 2.979 -1.429 { o phe X 152 2fgqX_175Y_151}-14.396 3.659 -1.711 { c phe X 152 2fgqX_175Y_151}P -13.435 2.979 -1.429 { n gly X 153 2fgqX_175Y_151}-13.455 2.037 -0.499 { ca gly X 153 2fgqX_175Y_151}-14.669 1.766 0.254 { c gly X 153 2fgqX_175Y_151}-14.386 1.409 1.69 { o gly X 153 2fgqX_175Y_151}-13.342 0.841 2.016 { n gly X 173 2fgqX_175Y_151}P -11.105 -1.326 1.707 {"}-11.105 -1.326 1.707 { ca gly X 173 2fgqX_175Y_151}-10.468 -1.802 0.499 { c gly X 173 2fgqX_175Y_151}-10.55 -0.798 -0.611 { o gly X 173 2fgqX_175Y_151}-11.211 0.217 -0.517 { c gly X 173 2fgqX_175Y_151}P -10.55 -0.798 -0.611 { n gly X 174 2fgqX_175Y_151}-9.825 -1.08 -1.678 { ca gly X 174 2fgqX_175Y_151}-9.821 -0.193 -2.802 { c gly X 174 2fgqX_175Y_151}-8.952 -0.72 -3.913 { o gly X 174 2fgqX_175Y_151}-8.351 -1.787 -3.8 { c gly X 174 2fgqX_175Y_151}P -8.952 -0.72 -3.913 { n tyr X 175 2fgqX_175Y_151}-8.893 0.06 -4.98 { ca tyr X 175 2fgqX_175Y_151}-8.082 -0.294 -6.126 { c tyr X 175 2fgqX_175Y_151}-7.49 0.945 -6.768 { o tyr X 175 2fgqX_175Y_151}-7.982 2.048 -6.628 { c tyr X 175 2fgqX_175Y_151}P -7.49 0.945 -6.768 { n val X 176 2fgqX_175Y_151}-6.393 0.707 -7.466 { ca val X 176 2fgqX_175Y_151}-5.855 1.633 -8.448 { c val X 176 2fgqX_175Y_151}-5.857 0.94 -9.812 { o val X 176 2fgqX_175Y_151}-5.695 -0.278 -9.917 { c val X 176 2fgqX_175Y_151}P -5.857 0.94 -9.812 { n ala X 177 2fgqX_175Y_151}-6.065 1.723 -10.858 { ca ala X 177 2fgqX_175Y_151}-6.212 1.192 -12.19 { c ala X 177 2fgqX_175Y_151}-5.799 2.184 -13.264 { o ala X 177 2fgqX_175Y_151}-5.661 3.396 -13.01 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n asn X 149 2fgqX_175Y_151}P -7.308 5.808 -12.553 { ca asn X 149 2fgqX_175Y_151}P -8.564 5.897 -11.811 { n ala X 150 2fgqX_175Y_151}P -9.238 5.344 -9.555 { ca ala X 150 2fgqX_175Y_151}P -9.181 4.594 -8.298 { n gly X 151 2fgqX_175Y_151}P -10.679 3.63 -6.708 { ca gly X 151 2fgqX_175Y_151}P -11.902 3.493 -5.929 {"}P -11.902 3.493 -5.929 { n phe X 152 2fgqX_175Y_151}P -12.36 3.447 -3.55 { ca phe X 152 2fgqX_175Y_151}P -12.107 3.174 -2.155 { n gly X 153 2fgqX_175Y_151}P -13.455 2.037 -0.499 { ca gly X 153 2fgqX_175Y_151}P -14.669 1.766 0.254 {"}P -14.669 1.766 0.254 { n gly X 173 2fgqX_175Y_151}P -11.105 -1.326 1.707 { ca gly X 173 2fgqX_175Y_151}P -10.468 -1.802 0.499 {"}P -10.468 -1.802 0.499 { n gly X 174 2fgqX_175Y_151}P -9.825 -1.08 -1.678 { ca gly X 174 2fgqX_175Y_151}P -9.821 -0.193 -2.802 {"}P -9.821 -0.193 -2.802 { n tyr X 175 2fgqX_175Y_151}P -8.893 0.06 -4.98 { ca tyr X 175 2fgqX_175Y_151}P -8.082 -0.294 -6.126 { n val X 176 2fgqX_175Y_151}P -6.393 0.707 -7.466 { ca val X 176 2fgqX_175Y_151}P -5.855 1.633 -8.448 { n ala X 177 2fgqX_175Y_151}P -6.065 1.723 -10.858 { ca ala X 177 2fgqX_175Y_151}P -6.212 1.192 -12.19 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca asn X 149 2fgqX_175Y_151}P -8.564 5.897 -11.811 {"}-8.564 5.897 -11.811 { ca ala X 150 2fgqX_175Y_151}-9.181 4.594 -8.298 { ca gly X 151 2fgqX_175Y_151}-11.902 3.493 -5.929 { ca phe X 152 2fgqX_175Y_151}-12.107 3.174 -2.155 { ca gly X 153 2fgqX_175Y_151}-14.669 1.766 0.254 { ca gly X 173 2fgqX_175Y_151}P -10.468 -1.802 0.499 {"}-10.468 -1.802 0.499 { ca gly X 174 2fgqX_175Y_151}-9.821 -0.193 -2.802 { ca tyr X 175 2fgqX_175Y_151}-8.082 -0.294 -6.126 { ca val X 176 2fgqX_175Y_151}-5.855 1.633 -8.448 { ca ala X 177 2fgqX_175Y_151}-6.212 1.192 -12.19 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca asn X 149 2fgqX_175Y_151}P -8.564 5.897 -11.811 { ca ala X 150 2fgqX_175Y_151}P -9.181 4.594 -8.298 { ca phe X 152 2fgqX_175Y_151}P -12.107 3.174 -2.155 { ca tyr X 175 2fgqX_175Y_151}P -8.082 -0.294 -6.126 { cb tyr X 175 2fgqX_175Y_151}-8.891 -1.056 -7.186 { cg tyr X 175 2fgqX_175Y_151}-9.964 -0.254 -7.856 { cd1 tyr X 175 2fgqX_175Y_151}-9.697 0.58 -8.961 { ce1 tyr X 175 2fgqX_175Y_151}-10.726 1.326 -9.554 { cz tyr X 175 2fgqX_175Y_151}-12.02 1.213 -9.014 { oh tyr X 175 2fgqX_175Y_151}-13.102 1.852 -9.571 { cg tyr X 175 2fgqX_175Y_151}P -9.964 -0.254 -7.856 { cd2 tyr X 175 2fgqX_175Y_151}-11.267 -0.34 -7.394 { ce2 tyr X 175 2fgqX_175Y_151}-12.267 0.362 -7.964 { cz tyr X 175 2fgqX_175Y_151}ghost -12.02 1.213 -9.014 { ca val X 176 2fgqX_175Y_151}P -5.855 1.633 -8.448 { ca ala X 177 2fgqX_175Y_151}P -6.212 1.192 -12.19 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr X 175 2fgqX_175Y_151}P -8.891 -1.056 -7.186 {"}P -8.891 -1.056 -7.186 { cd1 tyr X 175 2fgqX_175Y_151}P -9.697 0.58 -8.961 { cd2 tyr X 175 2fgqX_175Y_151}P -11.267 -0.34 -7.394 { ce1 tyr X 175 2fgqX_175Y_151}P -10.726 1.326 -9.554 { ce2 tyr X 175 2fgqX_175Y_151}P -12.267 0.362 -7.964 { oh tyr X 175 2fgqX_175Y_151}P -13.102 1.852 -9.571 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr X 175 2fgqX_175Y_151}P -8.082 -0.294 -6.126 { cb tyr X 175 2fgqX_175Y_151}-8.891 -1.056 -7.186 { cg tyr X 175 2fgqX_175Y_151}-9.964 -0.254 -7.856 { cd1 tyr X 175 2fgqX_175Y_151}-9.697 0.58 -8.961 { ce1 tyr X 175 2fgqX_175Y_151}-10.726 1.326 -9.554 { cz tyr X 175 2fgqX_175Y_151}-12.02 1.213 -9.014 { oh tyr X 175 2fgqX_175Y_151}-13.102 1.852 -9.571 { cg tyr X 175 2fgqX_175Y_151}P -9.964 -0.254 -7.856 { cd2 tyr X 175 2fgqX_175Y_151}-11.267 -0.34 -7.394 { ce2 tyr X 175 2fgqX_175Y_151}-12.267 0.362 -7.964 { cz tyr X 175 2fgqX_175Y_151}ghost -12.02 1.213 -9.014 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr X 175 2fgqX_175Y_151}P -8.891 -1.056 -7.186 {"}P -8.891 -1.056 -7.186 { cd1 tyr X 175 2fgqX_175Y_151}P -9.697 0.58 -8.961 { cd2 tyr X 175 2fgqX_175Y_151}P -11.267 -0.34 -7.394 { ce1 tyr X 175 2fgqX_175Y_151}P -10.726 1.326 -9.554 { ce2 tyr X 175 2fgqX_175Y_151}P -12.267 0.362 -7.964 { oh tyr X 175 2fgqX_175Y_151}P -13.102 1.852 -9.571 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 175 X}'P' sky -12.965 1.9 -7.507 {"}'P' sky -11.771 1.884 -7.258 {"}'P' sky -13.168 1.541 -7.037 {"}'P' sky -11.949 1.452 -6.632 { CZ TYR 175 X}'P' sky -12.711 2.345 -7.872 {"}'P' sky -12.475 2.454 -7.868 {"}'P' sky -12.223 2.517 -7.865 {"}'P' sky -12.688 2.141 -7.689 {"}'P' sky -11.956 2.344 -7.681 {"}'P' blue -11.773 2.103 -7.528 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 175 X}'P' sea -12.719 1.989 -7.503 {"}'P' green -12.463 2.038 -7.501 {"}'P' sea -13.014 1.78 -7.262 {"}'P' green -12.778 1.879 -7.258 {"}'P' green -12.53 1.94 -7.255 {"}'P' green -12.275 1.962 -7.254 {"}'P' green -12.02 1.943 -7.255 {"}'P' sea -12.949 1.676 -7.031 {"}'P' green -12.711 1.772 -7.027 {"}'P' green -12.203 1.837 -7.024 {"}'P' sea -11.948 1.804 -7.025 {"}'P' sea -12.958 1.494 -6.822 {"}'P' green -12.722 1.603 -6.818 {"}'P' green -12.47 1.666 -6.815 {"}'P' green -12.21 1.68 -6.814 {"}'P' sea -11.952 1.645 -6.816 {"}'P' sea -12.708 1.411 -6.634 {"}'P' sea -12.46 1.48 -6.631 {"}'P' sea -12.203 1.493 -6.631 { CZ TYR 175 X}'P' sea -12.461 2.262 -7.684 {"}'P' sea -12.213 2.331 -7.681 {"}'P' sea -12.283 2.099 -7.528 {"}'P' sea -12.028 2.135 -7.526 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 175 X}'P' P -12.46 1.826 -7.024 {"}'P' -12.458 1.815 -7.031 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 151 X}'P' sky -12.459 2.62 -7.579 {"}'P' blue -12.719 2.62 -7.579 {"}'P' sky -12.145 2.595 -7.494 {"}'P' sky -12.835 2.398 -7.502 {"}'P' sky -12.03 2.366 -7.364 {"}'P' sky -12.954 2.204 -7.371 {"}'P' sky -13.188 1.95 -6.975 {"}'P' sky -11.871 1.92 -6.729 {"}'P' sky -13.077 1.776 -6.735 {"}'P' sky -12.041 1.762 -6.475 {"}'P' sky -12.778 1.642 -6.48 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 151 X}'P' sea -12.328 2.406 -7.502 {"}'P' sea -12.581 2.334 -7.505 {"}'P' sea -12.224 2.204 -7.371 {"}'P' green -12.462 2.117 -7.375 {"}'P' sea -12.716 2.117 -7.375 {"}'P' sea -11.984 2.142 -7.189 {"}'P' green -12.201 1.999 -7.195 {"}'P' green -12.711 1.921 -7.198 {"}'P' sea -12.961 1.992 -7.195 {"}'P' green -11.99 1.95 -6.975 {"}'P' green -12.215 1.832 -6.98 {"}'P' green -12.716 1.772 -6.983 {"}'P' sea -12.963 1.832 -6.98 {"}'P' green -12.087 1.783 -6.735 {"}'P' green -12.327 1.697 -6.739 {"}'P' green -12.581 1.667 -6.74 {"}'P' green -12.835 1.694 -6.739 {"}'P' sea -12.276 1.669 -6.479 {"}'P' sea -12.526 1.628 -6.481 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 151 X}'P' P -12.451 1.923 -7.198 {"}'P' -12.451 1.924 -7.198 {"}'P' P -12.462 1.772 -6.983 {"}'P' -12.463 1.781 -6.978 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 175 X}'M' green -9.323 2.184 -7.006 {"}'M' green -9.276 2.436 -6.995 {"}'M' green -9.045 2.89 -6.975 {"}'M' green -9.376 2.054 -6.757 {"}'M' green -9.376 2.034 -6.499 {"}'M' sea -8.829 3.149 -6.451 {"}'M' green -9.322 2.159 -6.24 {"}'M' sea -8.864 3.048 -6.201 {"}'M' green -9.18 2.388 -5.989 {"}'M' green -9.082 2.621 -5.978 {"}'M' sea -8.938 2.83 -5.969 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 175 X}'M' greentint -9.183 2.674 -6.984 {"}'M' greentint -9.352 2.31 -6.746 {"}'M' greentint -9.282 2.557 -6.735 {"}'M' greentint -9.167 2.787 -6.725 {"}'M' greentint -9.012 2.992 -6.716 {"}'M' greentint -9.354 2.29 -6.488 {"}'M' greentint -9.285 2.538 -6.477 {"}'M' greentint -9.172 2.769 -6.467 {"}'M' greentint -9.018 2.975 -6.458 {"}'M' greentint -9.274 2.41 -6.229 {"}'M' greentint -9.179 2.648 -6.218 {"}'M' greentint -9.04 2.863 -6.209 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 151 X}'M' green -9.257 2.492 -7.014 {"}'M' green -9.431 2.302 -7.022 {"}'M' green -9.111 2.981 -6.992 {"}'M' green -9.494 2.127 -6.788 {"}'M' green -9.434 2.112 -6.53 {"}'M' sea -9.01 3.207 -6.482 {"}'M' sea -9.494 2.104 -6.271 {"}'M' green -9.011 2.94 -6.234 {"}'M' green -9.147 2.682 -6.004 {"}'M' green -9.257 2.449 -6.014 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 151 X}'M' greentint -9.147 2.726 -7.003 {"}'M' greentint -9.044 2.713 -6.762 {"}'M' greentint -9.14 2.48 -6.773 {"}'M' greentint -9.294 2.28 -6.781 {"}'M' greentint -9.011 2.962 -6.752 {"}'M' greentint -9.006 2.71 -6.504 {"}'M' greentint -9.097 2.477 -6.514 {"}'M' greentint -9.243 2.273 -6.523 {"}'M' greentint -8.977 2.959 -6.493 {"}'M' greentint -9.044 2.69 -6.245 {"}'M' greentint -9.14 2.457 -6.255 {"}'M' greentint -9.294 2.257 -6.264 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 175 X}'M' greentint -10.224 1.418 -5.309 {"}'M' greentint -10.07 1.618 -5.3 {"}'M' greentint -9.87 1.771 -5.293 {"}'M' greentint -10.32 1.284 -5.055 {"}'M' greentint -10.201 1.505 -5.046 {"}'M' greentint -10.031 1.689 -5.038 {"}'M' greentint -9.82 1.825 -5.032 {"}'M' greentint -9.582 1.904 -5.028 {"}'M' greentint -10.32 1.162 -4.802 {"}'M' greentint -10.224 1.395 -4.791 {"}'M' greentint -10.07 1.595 -4.783 {"}'M' greentint -9.87 1.748 -4.776 {"}'M' greentint -9.637 1.845 -4.772 {"}'M' greentint -9.387 1.878 -4.77 {"}'M' greentint -10.245 1.023 -4.566 {"}'M' greentint -10.171 1.27 -4.555 {"}'M' greentint -10.027 1.485 -4.546 {"}'M' greentint -9.827 1.647 -4.539 {"}'M' greentint -9.588 1.744 -4.535 {"}'M' greentint -9.331 1.766 -4.534 {"}'M' greentint -10.082 1.023 -4.359 {"}'M' greentint -9.988 1.265 -4.348 {"}'M' greentint -9.813 1.457 -4.34 {"}'M' greentint -9.581 1.573 -4.335 {"}'M' greentint -9.824 1.129 -4.195 {"}'M' greentint -9.644 1.315 -4.187 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 151 X}'M' greentint -9.953 1.602 -5.406 {"}'M' greentint -9.595 1.789 -5.206 {"}'M' greentint -9.736 1.572 -5.216 {"}'M' greentint -9.923 1.392 -5.224 {"}'M' greentint -10.147 1.261 -5.229 {"}'M' greentint -9.445 1.779 -4.987 {"}'M' greentint -9.568 1.558 -4.997 {"}'M' greentint -9.734 1.366 -5.005 {"}'M' greentint -9.934 1.211 -5.012 {"}'M' greentint -10.162 1.099 -5.017 {"}'M' greentint -9.344 1.77 -4.746 {"}'M' greentint -9.46 1.542 -4.756 {"}'M' greentint -9.617 1.34 -4.765 {"}'M' greentint -9.809 1.172 -4.772 {"}'M' greentint -10.03 1.042 -4.778 {"}'M' greentint -10.272 0.957 -4.782 {"}'M' greentint -9.412 1.518 -4.503 {"}'M' greentint -9.567 1.313 -4.512 {"}'M' greentint -9.757 1.14 -4.52 {"}'M' greentint -9.976 1.005 -4.525 {"}'M' greentint -10.216 0.912 -4.53 {"}'M' greentint -9.561 1.308 -4.254 {"}'M' greentint -9.75 1.134 -4.261 {"}'M' greentint -9.968 0.997 -4.267 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu X 41 2fgqX_55F_43G}P -8.592 4.795 -13.048 {"}-8.592 4.795 -13.048 { ca leu X 41 2fgqX_55F_43G}-9.79 4.578 -12.281 { c leu X 41 2fgqX_55F_43G}-9.347 4.152 -10.904 { o leu X 41 2fgqX_55F_43G}-8.474 3.317 -10.792 { c leu X 41 2fgqX_55F_43G}P -9.347 4.152 -10.904 { n arg X 42 2fgqX_55F_43G}-9.985 4.678 -9.878 { ca arg X 42 2fgqX_55F_43G}-9.689 4.265 -8.513 { c arg X 42 2fgqX_55F_43G}-10.925 4.251 -7.685 { o arg X 42 2fgqX_55F_43G}-11.91 4.923 -7.966 { c arg X 42 2fgqX_55F_43G}P -10.925 4.251 -7.685 { n gly X 43 2fgqX_55F_43G}-10.925 3.426 -6.658 { ca gly X 43 2fgqX_55F_43G}-12.072 3.402 -5.794 { c gly X 43 2fgqX_55F_43G}-11.708 2.967 -4.408 { o gly X 43 2fgqX_55F_43G}-10.68 2.354 -4.194 { c gly X 43 2fgqX_55F_43G}P -11.708 2.967 -4.408 { n thr X 44 2fgqX_55F_43G}-12.596 3.293 -3.484 { ca thr X 44 2fgqX_55F_43G}-12.428 2.928 -2.104 { c thr X 44 2fgqX_55F_43G}-13.788 2.445 -1.605 { o thr X 44 2fgqX_55F_43G}-14.823 3.009 -1.959 { c thr X 44 2fgqX_55F_43G}P -13.788 2.445 -1.605 { n glu X 45 2fgqX_55F_43G}-13.79 1.403 -0.795 { ca glu X 45 2fgqX_55F_43G}-14.998 0.879 -0.196 { c glu X 45 2fgqX_55F_43G}-14.792 0.788 1.319 { o glu X 45 2fgqX_55F_43G}-13.849 0.185 1.772 { n ala X 53 2fgqX_55F_43G}P -11.268 -1.163 1.572 {"}-11.268 -1.163 1.572 { ca ala X 53 2fgqX_55F_43G}-10.672 -1.811 0.426 { c ala X 53 2fgqX_55F_43G}-10.538 -0.791 -0.676 { o ala X 53 2fgqX_55F_43G}-11.37 0.089 -0.823 { c ala X 53 2fgqX_55F_43G}P -10.538 -0.791 -0.676 { n gly X 54 2fgqX_55F_43G}-9.512 -0.942 -1.488 { ca gly X 54 2fgqX_55F_43G}-9.306 -0.011 -2.598 { c gly X 54 2fgqX_55F_43G}-8.803 -0.727 -3.816 { o gly X 54 2fgqX_55F_43G}-8.285 -1.819 -3.751 { c gly X 54 2fgqX_55F_43G}P -8.803 -0.727 -3.816 { n phe X 55 2fgqX_55F_43G}-8.929 -0.052 -4.959 { ca phe X 55 2fgqX_55F_43G}-8.23 -0.47 -6.147 { c phe X 55 2fgqX_55F_43G}-7.808 0.777 -6.919 { o phe X 55 2fgqX_55F_43G}-8.362 1.845 -6.71 { c phe X 55 2fgqX_55F_43G}P -7.808 0.777 -6.919 { n trp X 56 2fgqX_55F_43G}-6.834 0.612 -7.802 { ca trp X 56 2fgqX_55F_43G}-6.318 1.728 -8.578 { c trp X 56 2fgqX_55F_43G}-5.704 1.184 -9.849 { o trp X 56 2fgqX_55F_43G}-4.8 0.33 -9.801 { c trp X 56 2fgqX_55F_43G}P -5.704 1.184 -9.849 { n leu X 57 2fgqX_55F_43G}-6.22 1.626 -10.991 { ca leu X 57 2fgqX_55F_43G}-5.743 1.192 -12.305 { c leu X 57 2fgqX_55F_43G}-5.351 2.467 -13.043 { o leu X 57 2fgqX_55F_43G}-6.181 3.355 -13.214 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu X 41 2fgqX_55F_43G}P -8.592 4.795 -13.048 { ca leu X 41 2fgqX_55F_43G}P -9.79 4.578 -12.281 { n arg X 42 2fgqX_55F_43G}P -9.985 4.678 -9.878 { ca arg X 42 2fgqX_55F_43G}P -9.689 4.265 -8.513 { n gly X 43 2fgqX_55F_43G}P -10.925 3.426 -6.658 { ca gly X 43 2fgqX_55F_43G}P -12.072 3.402 -5.794 {"}P -12.072 3.402 -5.794 { n thr X 44 2fgqX_55F_43G}P -12.596 3.293 -3.484 { ca 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0.879 -0.196 { ca ala X 53 2fgqX_55F_43G}P -10.672 -1.811 0.426 {"}-10.672 -1.811 0.426 { ca gly X 54 2fgqX_55F_43G}-9.306 -0.011 -2.598 { ca phe X 55 2fgqX_55F_43G}-8.23 -0.47 -6.147 { ca trp X 56 2fgqX_55F_43G}-6.318 1.728 -8.578 { ca leu X 57 2fgqX_55F_43G}-5.743 1.192 -12.305 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca leu X 41 2fgqX_55F_43G}P -9.79 4.578 -12.281 { ca arg X 42 2fgqX_55F_43G}P -9.689 4.265 -8.513 { ca thr X 44 2fgqX_55F_43G}P -12.428 2.928 -2.104 { ca glu X 45 2fgqX_55F_43G}P -14.998 0.879 -0.196 { ca ala X 53 2fgqX_55F_43G}P -10.672 -1.811 0.426 { ca phe X 55 2fgqX_55F_43G}P -8.23 -0.47 -6.147 { cb phe X 55 2fgqX_55F_43G}-9.105 -1.391 -7.012 { cg phe X 55 2fgqX_55F_43G}-10.109 -0.665 -7.821 { cd1 phe X 55 2fgqX_55F_43G}-9.825 -0.275 -9.124 { ce1 phe X 55 2fgqX_55F_43G}-10.719 0.475 -9.85 { cz phe X 55 2fgqX_55F_43G}-11.908 0.86 -9.312 { cg phe X 55 2fgqX_55F_43G}P -10.109 -0.665 -7.821 { cd2 phe X 55 2fgqX_55F_43G}-11.303 -0.241 -7.252 { ce2 phe X 55 2fgqX_55F_43G}-12.229 0.512 -8.021 { cz phe X 55 2fgqX_55F_43G}ghost -11.908 0.86 -9.312 { ca trp X 56 2fgqX_55F_43G}P -6.318 1.728 -8.578 { ca leu X 57 2fgqX_55F_43G}P -5.743 1.192 -12.305 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe X 55 2fgqX_55F_43G}P -9.105 -1.391 -7.012 {"}P -9.105 -1.391 -7.012 { cd1 phe X 55 2fgqX_55F_43G}P -9.825 -0.275 -9.124 { cd2 phe X 55 2fgqX_55F_43G}P -11.303 -0.241 -7.252 { ce1 phe X 55 2fgqX_55F_43G}P -10.719 0.475 -9.85 { ce2 phe X 55 2fgqX_55F_43G}P -12.229 0.512 -8.021 { cz phe X 55 2fgqX_55F_43G}P -11.908 0.86 -9.312 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe X 55 2fgqX_55F_43G}P -8.23 -0.47 -6.147 { cb phe X 55 2fgqX_55F_43G}-9.105 -1.391 -7.012 { cg phe X 55 2fgqX_55F_43G}-10.109 -0.665 -7.821 { cd1 phe X 55 2fgqX_55F_43G}-9.825 -0.275 -9.124 { ce1 phe X 55 2fgqX_55F_43G}-10.719 0.475 -9.85 { cz phe X 55 2fgqX_55F_43G}-11.908 0.86 -9.312 { cg phe X 55 2fgqX_55F_43G}P -10.109 -0.665 -7.821 { cd2 phe X 55 2fgqX_55F_43G}-11.303 -0.241 -7.252 { ce2 phe X 55 2fgqX_55F_43G}-12.229 0.512 -8.021 { cz phe X 55 2fgqX_55F_43G}ghost -11.908 0.86 -9.312 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe X 55 2fgqX_55F_43G}P -9.105 -1.391 -7.012 {"}P -9.105 -1.391 -7.012 { cd1 phe X 55 2fgqX_55F_43G}P -9.825 -0.275 -9.124 { cd2 phe X 55 2fgqX_55F_43G}P -11.303 -0.241 -7.252 { ce1 phe X 55 2fgqX_55F_43G}P -10.719 0.475 -9.85 { ce2 phe X 55 2fgqX_55F_43G}P -12.229 0.512 -8.021 { cz phe X 55 2fgqX_55F_43G}P -11.908 0.86 -9.312 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 55 X}'P' sky -12.927 2.05 -7.564 {"}'P' sky -12.681 2.139 -7.56 {"}'P' sky -12.425 2.188 -7.558 {"}'P' sky -13.193 1.796 -7.325 {"}'P' sky -12.729 1.298 -6.539 {"}'P' sky -12.237 1.434 -6.533 { HE2 PHE 55 X}'P' sky -13.395 1.634 -7.052 {"}'P' sky -13.388 1.463 -6.852 {"}'P' sky -13.129 1.487 -6.851 {"}'P' blue -13.202 1.276 -6.701 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 55 X}'P' sea -12.976 1.93 -7.319 {"}'P' green -12.74 2.029 -7.315 {"}'P' green -12.492 2.09 -7.312 {"}'P' sea -12.237 2.112 -7.311 {"}'P' sea -13.13 1.691 -7.094 {"}'P' green -12.911 1.826 -7.088 {"}'P' green -12.673 1.922 -7.084 {"}'P' green -12.422 1.976 -7.081 {"}'P' sea -12.165 1.987 -7.081 {"}'P' green -12.92 1.644 -6.879 {"}'P' green -12.684 1.753 -6.875 {"}'P' green -12.432 1.816 -6.872 {"}'P' green -12.172 1.83 -6.871 {"}'P' sea -12.897 1.44 -6.696 {"}'P' green -12.67 1.561 -6.691 {"}'P' green -12.422 1.63 -6.688 {"}'P' sea -12.165 1.643 -6.688 {"}'P' sea -12.492 1.398 -6.535 { HE2 PHE 55 X}'P' sea -13.138 1.656 -7.051 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 43 X}'P' sky -13.195 2.129 -7.148 {"}'P' sky -13.202 1.917 -6.972 {"}'P' blue -13.423 2.056 -6.966 {"}'P' sky -13.204 1.757 -6.757 {"}'P' blue -13.429 1.875 -6.752 {"}'P' sky -13.076 1.619 -6.516 {"}'P' blue -13.318 1.701 -6.512 {"}'P' sky -12.517 1.594 -6.256 {"}'P' blue -12.767 1.553 -6.258 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 43 X}'P' sea -12.569 2.331 -7.279 {"}'P' sea -12.822 2.259 -7.282 {"}'P' sea -12.271 2.291 -7.141 {"}'P' green -12.465 2.129 -7.148 {"}'P' green -12.703 2.042 -7.152 {"}'P' sea -12.957 2.042 -7.152 {"}'P' green -12.225 2.067 -6.966 {"}'P' green -12.442 1.924 -6.972 {"}'P' green -12.692 1.848 -6.975 {"}'P' green -12.952 1.846 -6.975 {"}'P' green -12.231 1.875 -6.752 {"}'P' green -12.456 1.757 -6.757 {"}'P' green -12.703 1.697 -6.76 {"}'P' green -12.957 1.697 -6.76 {"}'P' sea -12.328 1.708 -6.512 {"}'P' sea -12.568 1.622 -6.516 {"}'P' sea -12.822 1.592 -6.517 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 55 X}'M' green -9.656 2.233 -7.077 {"}'M' green -9.202 2.962 -6.791 {"}'M' green -9.756 1.831 -6.581 {"}'M' green -9.61 1.936 -6.081 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 55 X}'M' greentint -9.563 2.471 -7.066 {"}'M' greentint -9.425 2.687 -7.057 {"}'M' greentint -9.732 2.107 -6.828 {"}'M' greentint -9.662 2.354 -6.817 {"}'M' greentint -9.547 2.584 -6.807 {"}'M' greentint -9.392 2.789 -6.798 {"}'M' greentint -9.734 2.087 -6.57 {"}'M' greentint -9.665 2.335 -6.559 {"}'M' greentint -9.552 2.566 -6.549 {"}'M' greentint -9.398 2.772 -6.54 {"}'M' greentint -9.209 2.946 -6.533 {"}'M' greentint -9.702 1.956 -6.322 {"}'M' greentint -9.654 2.207 -6.311 {"}'M' greentint -9.559 2.445 -6.3 {"}'M' greentint -9.42 2.66 -6.291 {"}'M' greentint -9.244 2.845 -6.283 {"}'M' greentint -9.56 2.185 -6.071 {"}'M' greentint -9.462 2.418 -6.06 {"}'M' greentint -9.318 2.627 -6.051 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 43 X}'M' green -9.526 2.574 -7.135 {"}'M' green -9.702 1.951 -6.195 {"}'M' green -9.355 2.529 -5.928 {"}'M' green -9.465 2.296 -5.938 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 43 X}'M' greentint -9.355 2.573 -6.927 {"}'M' greentint -9.465 2.339 -6.938 {"}'M' greentint -9.639 2.149 -6.946 {"}'M' greentint -9.319 2.828 -6.916 {"}'M' greentint -9.252 2.56 -6.686 {"}'M' greentint -9.348 2.327 -6.697 {"}'M' greentint -9.502 2.127 -6.705 {"}'M' greentint -9.702 1.974 -6.712 {"}'M' greentint -9.219 2.809 -6.676 {"}'M' greentint -9.214 2.557 -6.428 {"}'M' greentint -9.305 2.324 -6.438 {"}'M' greentint -9.451 2.12 -6.447 {"}'M' greentint -9.642 1.959 -6.454 {"}'M' greentint -9.185 2.806 -6.417 {"}'M' greentint -9.252 2.537 -6.169 {"}'M' greentint -9.348 2.304 -6.179 {"}'M' greentint -9.502 2.104 -6.188 {"}'M' greentint -9.219 2.787 -6.158 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 55 X}'M' green -10.18 1.457 -5.302 {"}'M' green -9.98 1.61 -5.295 {"}'M' green -10.43 1.123 -5.057 {"}'M' green -9.692 1.743 -5.03 {"}'M' green -10.43 1.001 -4.804 {"}'M' green -9.497 1.717 -4.772 {"}'M' green -9.441 1.605 -4.536 {"}'M' green -9.754 1.154 -4.189 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 55 X}'M' greentint -10.311 1.344 -5.048 {"}'M' greentint -10.141 1.528 -5.04 {"}'M' greentint -9.93 1.664 -5.034 {"}'M' greentint -10.334 1.234 -4.793 {"}'M' greentint -10.18 1.434 -4.785 {"}'M' greentint -9.98 1.587 -4.778 {"}'M' greentint -9.747 1.684 -4.774 {"}'M' greentint -10.281 1.109 -4.557 {"}'M' greentint -10.137 1.324 -4.548 {"}'M' greentint -9.937 1.486 -4.541 {"}'M' greentint -9.698 1.583 -4.537 {"}'M' greentint -10.098 1.104 -4.35 {"}'M' greentint -9.923 1.296 -4.342 {"}'M' greentint -9.691 1.412 -4.337 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 43 X}'M' green -10.036 1.71 -5.258 {"}'M' green -10.246 1.562 -5.264 {"}'M' green -9.678 1.897 -5.058 {"}'M' green -10.478 1.293 -5.085 {"}'M' green -9.528 1.887 -4.839 {"}'M' green -10.49 1.144 -4.871 {"}'M' green -9.543 1.65 -4.608 {"}'M' green -10.355 1.065 -4.634 {"}'M' green -9.495 1.626 -4.355 {"}'M' green -10.299 1.02 -4.382 {"}'M' green -9.833 1.242 -4.113 {"}'M' sea -10.051 1.105 -4.119 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 43 X}'M' greentint -9.819 1.68 -5.068 {"}'M' greentint -10.006 1.5 -5.076 {"}'M' greentint -10.23 1.369 -5.081 {"}'M' greentint -9.651 1.666 -4.849 {"}'M' greentint -9.817 1.474 -4.857 {"}'M' greentint -10.017 1.319 -4.864 {"}'M' greentint -10.245 1.207 -4.869 {"}'M' greentint -9.7 1.448 -4.617 {"}'M' greentint -9.892 1.28 -4.624 {"}'M' greentint -10.113 1.15 -4.63 {"}'M' greentint -9.65 1.421 -4.364 {"}'M' greentint -9.84 1.248 -4.372 {"}'M' greentint -10.059 1.113 -4.377 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n thr X 5 2fgqX_7F_40G}P -11.82 -2.083 0.622 {"}-11.82 -2.083 0.622 { ca thr X 5 2fgqX_7F_40G}-10.706 -2.244 -0.28 { c thr X 5 2fgqX_7F_40G}-10.503 -0.987 -1.096 { o thr X 5 2fgqX_7F_40G}-11.424 -0.506 -1.733 { c thr X 5 2fgqX_7F_40G}P -10.503 -0.987 -1.096 { n leu X 6 2fgqX_7F_40G}-9.279 -0.474 -1.085 { ca leu X 6 2fgqX_7F_40G}-8.861 0.592 -1.964 { c leu X 6 2fgqX_7F_40G}-8.261 -0.092 -3.178 { o leu X 6 2fgqX_7F_40G}-7.448 -0.994 -3.035 { c leu X 6 2fgqX_7F_40G}P -8.261 -0.092 -3.178 { n phe X 7 2fgqX_7F_40G}-8.638 0.345 -4.365 { ca phe X 7 2fgqX_7F_40G}-8.123 -0.267 -5.583 { c phe X 7 2fgqX_7F_40G}-7.964 0.78 -6.678 { o phe X 7 2fgqX_7F_40G}-8.5 1.878 -6.602 { c phe X 7 2fgqX_7F_40G}P -7.964 0.78 -6.678 { n gly X 8 2fgqX_7F_40G}-7.301 0.391 -7.764 { ca gly X 8 2fgqX_7F_40G}-7.184 1.279 -8.885 { c gly X 8 2fgqX_7F_40G}-6.345 0.719 -9.989 { o gly X 8 2fgqX_7F_40G}-5.822 -0.401 -9.923 { c gly X 8 2fgqX_7F_40G}P -6.345 0.719 -9.989 { n ile X 9 2fgqX_7F_40G}-6.272 1.528 -11.036 { ca ile X 9 2fgqX_7F_40G}-5.46 1.261 -12.216 { c ile X 9 2fgqX_7F_40G}-4.915 2.577 -12.72 { o ile X 9 2fgqX_7F_40G}-5.654 3.52 -12.916 { n arg X 38 2fgqX_7F_40G}P -8.419 4.2 -13.113 {"}-8.419 4.2 -13.113 { ca arg X 38 2fgqX_7F_40G}-9.437 4.43 -12.093 { c arg X 38 2fgqX_7F_40G}-8.869 4.41 -10.703 { o arg X 38 2fgqX_7F_40G}-7.776 3.891 -10.46 { c arg X 38 2fgqX_7F_40G}P -8.869 4.41 -10.703 { n leu X 39 2fgqX_7F_40G}-9.67 4.935 -9.779 { ca leu X 39 2fgqX_7F_40G}-9.37 4.921 -8.342 { c leu X 39 2fgqX_7F_40G}-10.709 4.695 -7.643 { o leu X 39 2fgqX_7F_40G}-11.658 5.356 -7.962 { c leu X 39 2fgqX_7F_40G}P -10.709 4.695 -7.643 { n gly X 40 2fgqX_7F_40G}-10.764 3.734 -6.734 { ca gly X 40 2fgqX_7F_40G}-12.006 3.41 -6.069 { c gly X 40 2fgqX_7F_40G}-11.845 2.814 -4.702 { o gly X 40 2fgqX_7F_40G}-10.769 2.378 -4.277 { c gly X 40 2fgqX_7F_40G}P -11.845 2.814 -4.702 { n leu X 41 2fgqX_7F_40G}-12.985 2.788 -4.011 { ca leu X 41 2fgqX_7F_40G}-13.117 2.165 -2.721 { c leu X 41 2fgqX_7F_40G}-14.361 1.314 -2.781 { o leu X 41 2fgqX_7F_40G}-15.373 1.775 -3.266 { c leu X 41 2fgqX_7F_40G}P -14.361 1.314 -2.781 { n arg X 42 2fgqX_7F_40G}-14.296 0.114 -2.24 { ca arg X 42 2fgqX_7F_40G}-15.468 -0.747 -2.171 { c arg X 42 2fgqX_7F_40G}-15.469 -1.539 -0.912 { o arg X 42 2fgqX_7F_40G}-14.442 -1.78 -0.288 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr X 5 2fgqX_7F_40G}P -11.82 -2.083 0.622 { ca thr X 5 2fgqX_7F_40G}P -10.706 -2.244 -0.28 { n leu X 6 2fgqX_7F_40G}P -9.279 -0.474 -1.085 { ca leu X 6 2fgqX_7F_40G}P -8.861 0.592 -1.964 { n phe X 7 2fgqX_7F_40G}P -8.638 0.345 -4.365 { ca phe X 7 2fgqX_7F_40G}P -8.123 -0.267 -5.583 { n gly X 8 2fgqX_7F_40G}P -7.301 0.391 -7.764 { ca gly X 8 2fgqX_7F_40G}P -7.184 1.279 -8.885 {"}P -7.184 1.279 -8.885 { n ile X 9 2fgqX_7F_40G}P -6.272 1.528 -11.036 { ca ile X 9 2fgqX_7F_40G}P -5.46 1.261 -12.216 { n arg X 38 2fgqX_7F_40G}P -8.419 4.2 -13.113 { ca arg X 38 2fgqX_7F_40G}P -9.437 4.43 -12.093 { n leu X 39 2fgqX_7F_40G}P -9.67 4.935 -9.779 { ca leu X 39 2fgqX_7F_40G}P -9.37 4.921 -8.342 { n gly X 40 2fgqX_7F_40G}P -10.764 3.734 -6.734 { ca gly X 40 2fgqX_7F_40G}P -12.006 3.41 -6.069 {"}P -12.006 3.41 -6.069 { n leu X 41 2fgqX_7F_40G}P -12.985 2.788 -4.011 { ca leu X 41 2fgqX_7F_40G}P -13.117 2.165 -2.721 { n arg X 42 2fgqX_7F_40G}P -14.296 0.114 -2.24 { ca arg X 42 2fgqX_7F_40G}P -15.468 -0.747 -2.171 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca thr X 5 2fgqX_7F_40G}P -10.706 -2.244 -0.28 {"}-10.706 -2.244 -0.28 { ca leu X 6 2fgqX_7F_40G}-8.861 0.592 -1.964 { ca phe X 7 2fgqX_7F_40G}-8.123 -0.267 -5.583 { ca gly X 8 2fgqX_7F_40G}-7.184 1.279 -8.885 { ca ile X 9 2fgqX_7F_40G}-5.46 1.261 -12.216 { ca arg X 38 2fgqX_7F_40G}P -9.437 4.43 -12.093 {"}-9.437 4.43 -12.093 { ca leu X 39 2fgqX_7F_40G}-9.37 4.921 -8.342 { ca gly X 40 2fgqX_7F_40G}-12.006 3.41 -6.069 { ca leu X 41 2fgqX_7F_40G}-13.117 2.165 -2.721 { ca arg X 42 2fgqX_7F_40G}-15.468 -0.747 -2.171 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca thr X 5 2fgqX_7F_40G}P -10.706 -2.244 -0.28 { ca leu X 6 2fgqX_7F_40G}P -8.861 0.592 -1.964 { ca phe X 7 2fgqX_7F_40G}P -8.123 -0.267 -5.583 { cb phe X 7 2fgqX_7F_40G}-9.05 -1.391 -6.068 { cg phe X 7 2fgqX_7F_40G}-10.401 -0.9 -6.495 { cd1 phe X 7 2fgqX_7F_40G}-11.421 -0.725 -5.564 { ce1 phe X 7 2fgqX_7F_40G}-12.656 -0.258 -5.962 { cz phe X 7 2fgqX_7F_40G}-12.901 0.014 -7.309 { cg phe X 7 2fgqX_7F_40G}P -10.401 -0.9 -6.495 { cd2 phe X 7 2fgqX_7F_40G}-10.657 -0.614 -7.845 { ce2 phe X 7 2fgqX_7F_40G}-11.906 -0.163 -8.249 { cz phe X 7 2fgqX_7F_40G}ghost -12.901 0.014 -7.309 { ca ile X 9 2fgqX_7F_40G}P -5.46 1.261 -12.216 { ca arg X 38 2fgqX_7F_40G}P -9.437 4.43 -12.093 { ca leu X 39 2fgqX_7F_40G}P -9.37 4.921 -8.342 { ca leu X 41 2fgqX_7F_40G}P -13.117 2.165 -2.721 { ca arg X 42 2fgqX_7F_40G}P -15.468 -0.747 -2.171 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe X 7 2fgqX_7F_40G}P -9.05 -1.391 -6.068 {"}P -9.05 -1.391 -6.068 { cd1 phe X 7 2fgqX_7F_40G}P -11.421 -0.725 -5.564 { cd2 phe X 7 2fgqX_7F_40G}P -10.657 -0.614 -7.845 { ce1 phe X 7 2fgqX_7F_40G}P -12.656 -0.258 -5.962 { ce2 phe X 7 2fgqX_7F_40G}P -11.906 -0.163 -8.249 { cz phe X 7 2fgqX_7F_40G}P -12.901 0.014 -7.309 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe X 7 2fgqX_7F_40G}P -8.123 -0.267 -5.583 { cb phe X 7 2fgqX_7F_40G}-9.05 -1.391 -6.068 { cg phe X 7 2fgqX_7F_40G}-10.401 -0.9 -6.495 { cd1 phe X 7 2fgqX_7F_40G}-11.421 -0.725 -5.564 { ce1 phe X 7 2fgqX_7F_40G}-12.656 -0.258 -5.962 { cz phe X 7 2fgqX_7F_40G}-12.901 0.014 -7.309 { cg phe X 7 2fgqX_7F_40G}P -10.401 -0.9 -6.495 { cd2 phe X 7 2fgqX_7F_40G}-10.657 -0.614 -7.845 { ce2 phe X 7 2fgqX_7F_40G}-11.906 -0.163 -8.249 { cz phe X 7 2fgqX_7F_40G}ghost -12.901 0.014 -7.309 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe X 7 2fgqX_7F_40G}P -9.05 -1.391 -6.068 {"}P -9.05 -1.391 -6.068 { cd1 phe X 7 2fgqX_7F_40G}P -11.421 -0.725 -5.564 { cd2 phe X 7 2fgqX_7F_40G}P -10.657 -0.614 -7.845 { ce1 phe X 7 2fgqX_7F_40G}P -12.656 -0.258 -5.962 { ce2 phe X 7 2fgqX_7F_40G}P -11.906 -0.163 -8.249 { cz phe X 7 2fgqX_7F_40G}P -12.901 0.014 -7.309 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 7 X}'P' sky -13.044 1.447 -6.018 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 7 X}'P' sea -12.86 1.451 -6.277 {"}'P' green -12.599 1.463 -6.277 {"}'P' sea -12.339 1.434 -6.278 {"}'P' sea -12.786 1.486 -6.017 {"}'P' sea -12.526 1.486 -6.017 { CZ PHE 7 X}'P' sea -12.844 1.735 -7.624 {"}'P' sea -12.584 1.706 -7.625 {"}'P' sea -13.289 1.719 -7.365 {"}'P' green -13.031 1.758 -7.364 {"}'P' green -12.771 1.758 -7.364 {"}'P' green -12.513 1.719 -7.365 {"}'P' green -12.263 1.643 -7.369 {"}'P' green -13.297 1.706 -7.104 {"}'P' green -12.271 1.634 -7.107 {"}'P' sea -12.036 1.522 -7.112 {"}'P' sea -13.353 1.641 -6.848 {"}'P' green -12.086 1.494 -6.855 {"}'P' green -13.164 1.592 -6.6 {"}'P' green -12.405 1.536 -6.603 {"}'P' sea -12.169 1.44 -6.607 {"}'P' sea -13.094 1.478 -6.369 {"}'P' green -12.837 1.489 -6.369 {"}'P' green -12.582 1.456 -6.37 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 7 X}'P' P -13.04 1.746 -7.102 {"}'P' -13.039 1.732 -7.104 {"}'P' P -12.779 1.747 -7.102 {"}'P' -12.783 1.693 -7.109 {"}'P' P -12.521 1.71 -7.104 {"}'P' -12.531 1.664 -7.11 {"}'P' P -13.097 1.69 -6.846 {"}'P' -13.096 1.682 -6.848 {"}'P' P -12.836 1.7 -6.846 {"}'P' -12.838 1.642 -6.862 {"}'P' P -12.576 1.67 -6.847 {"}'P' -12.588 1.611 -6.863 {"}'P' P -12.324 1.601 -6.85 {"}'P' -12.329 1.588 -6.854 {"}'P' P -12.909 1.614 -6.599 {"}'P' -12.909 1.603 -6.604 {"}'P' P -12.654 1.595 -6.6 {"}'P' -12.658 1.571 -6.611 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 40 X}'P' blue -13.17 1.816 -6.228 {"}'P' sky -12.693 1.767 -6.008 {"}'P' blue -12.943 1.838 -6.005 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 40 X}'P' green -12.433 1.833 -7.465 {"}'P' green -12.693 1.831 -7.465 {"}'P' green -12.943 1.902 -7.462 {"}'P' green -12.197 1.742 -7.247 {"}'P' green -13.17 1.86 -7.242 {"}'P' green -12.069 1.693 -7.002 {"}'P' green -13.276 1.82 -6.996 {"}'P' sea -12.023 1.672 -6.742 {"}'P' green -12.258 1.579 -6.746 {"}'P' green -13.228 1.738 -6.739 {"}'P' green -12.309 1.584 -6.485 {"}'P' green -12.563 1.554 -6.487 {"}'P' green -12.817 1.581 -6.485 {"}'P' green -13.059 1.663 -6.482 {"}'P' sea -12.444 1.637 -6.235 {"}'P' sea -12.698 1.637 -6.235 {"}'P' sea -12.945 1.698 -6.233 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 40 X}'P' P -12.444 1.682 -7.25 {"}'P' -12.445 1.69 -7.245 {"}'P' P -12.698 1.682 -7.25 {"}'P' -12.694 1.712 -7.234 {"}'P' P -12.945 1.742 -7.247 {"}'P' -12.942 1.751 -7.242 {"}'P' P -12.309 1.607 -7.006 {"}'P' -12.312 1.618 -7.002 {"}'P' P -12.563 1.577 -7.007 {"}'P' -12.563 1.636 -6.991 {"}'P' P -12.817 1.604 -7.006 {"}'P' -12.803 1.665 -6.989 {"}'P' P -13.059 1.686 -7.002 {"}'P' -13.05 1.705 -6.997 {"}'P' P -12.508 1.538 -6.748 {"}'P' -12.51 1.577 -6.746 {"}'P' P -12.76 1.552 -6.747 {"}'P' -12.752 1.604 -6.745 {"}'P' P -13.004 1.619 -6.744 {"}'P' -12.996 1.64 -6.743 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 7 X}'M' greentint -9.701 2.504 -6.958 {"}'M' greentint -9.563 2.72 -6.949 {"}'M' greentint -9.388 2.906 -6.941 {"}'M' greentint -9.18 3.056 -6.934 {"}'M' greentint -9.8 2.387 -6.709 {"}'M' greentint -9.685 2.617 -6.699 {"}'M' greentint -9.53 2.822 -6.69 {"}'M' greentint -9.34 2.995 -6.683 {"}'M' greentint -9.121 3.13 -6.677 {"}'M' greentint -9.803 2.368 -6.451 {"}'M' greentint -9.69 2.599 -6.441 {"}'M' greentint -9.536 2.805 -6.432 {"}'M' greentint -9.347 2.979 -6.425 {"}'M' greentint -9.129 3.115 -6.419 {"}'M' greentint -9.792 2.24 -6.203 {"}'M' greentint -9.697 2.478 -6.192 {"}'M' greentint -9.558 2.693 -6.183 {"}'M' greentint -9.382 2.878 -6.175 {"}'M' greentint -9.173 3.026 -6.168 {"}'M' greentint -9.6 2.451 -5.952 {"}'M' greentint -9.456 2.66 -5.943 {"}'M' greentint -9.273 2.836 -5.936 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 40 X}'M' greentint -9.151 2.955 -6.961 {"}'M' greentint -9.261 2.721 -6.972 {"}'M' greentint -9.435 2.531 -6.98 {"}'M' greentint -9.657 2.399 -6.986 {"}'M' greentint -9.048 2.942 -6.72 {"}'M' greentint -9.144 2.709 -6.731 {"}'M' greentint -9.298 2.509 -6.739 {"}'M' greentint -9.498 2.356 -6.746 {"}'M' greentint -9.731 2.259 -6.75 {"}'M' greentint -9.01 2.939 -6.462 {"}'M' greentint -9.101 2.706 -6.472 {"}'M' greentint -9.247 2.502 -6.481 {"}'M' greentint -9.438 2.341 -6.488 {"}'M' greentint -9.664 2.232 -6.492 {"}'M' greentint -9.048 2.919 -6.203 {"}'M' greentint -9.144 2.686 -6.213 {"}'M' greentint -9.298 2.486 -6.222 {"}'M' greentint -9.498 2.333 -6.229 {"}'M' greentint -9.731 2.237 -6.233 {"}'M' greentint -9.151 2.911 -5.962 {"}'M' greentint -9.261 2.678 -5.972 {"}'M' greentint -9.435 2.487 -5.981 {"}'M' greentint -9.657 2.356 -5.987 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 7 X}'M' greentint -10.062 1.49 -4.995 {"}'M' greentint -9.918 1.704 -4.986 {"}'M' greentint -9.718 1.867 -4.979 {"}'M' greentint -10.211 1.361 -4.76 {"}'M' greentint -10.115 1.594 -4.75 {"}'M' greentint -9.961 1.794 -4.741 {"}'M' greentint -9.761 1.947 -4.734 {"}'M' greentint -9.528 2.043 -4.73 {"}'M' greentint -10.271 1.217 -4.507 {"}'M' greentint -10.211 1.46 -4.496 {"}'M' greentint -10.092 1.681 -4.487 {"}'M' greentint -9.922 1.865 -4.479 {"}'M' greentint -9.711 2.001 -4.473 {"}'M' greentint -9.473 2.08 -4.469 {"}'M' greentint -10.244 1.089 -4.253 {"}'M' greentint -10.211 1.338 -4.243 {"}'M' greentint -10.115 1.571 -4.232 {"}'M' greentint -9.961 1.771 -4.224 {"}'M' greentint -9.761 1.924 -4.217 {"}'M' greentint -9.528 2.021 -4.213 {"}'M' greentint -10.136 1.199 -4.007 {"}'M' greentint -10.062 1.446 -3.996 {"}'M' greentint -9.918 1.661 -3.987 {"}'M' greentint -9.718 1.823 -3.98 {"}'M' greentint -9.879 1.441 -3.789 {"}'M' greentint -9.704 1.633 -3.781 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 40 X}'M' greentint -9.617 1.911 -4.922 {"}'M' greentint -9.74 1.69 -4.932 {"}'M' greentint -9.906 1.498 -4.94 {"}'M' greentint -10.106 1.343 -4.947 {"}'M' greentint -9.516 1.902 -4.681 {"}'M' greentint -9.632 1.674 -4.691 {"}'M' greentint -9.789 1.472 -4.7 {"}'M' greentint -9.981 1.304 -4.707 {"}'M' greentint -10.202 1.174 -4.713 {"}'M' greentint -9.469 1.881 -4.428 {"}'M' greentint -9.584 1.65 -4.438 {"}'M' greentint -9.739 1.445 -4.447 {"}'M' greentint -9.929 1.272 -4.455 {"}'M' greentint -10.148 1.137 -4.46 {"}'M' greentint -9.466 1.877 -4.17 {"}'M' greentint -9.579 1.646 -4.18 {"}'M' greentint -9.733 1.44 -4.189 {"}'M' greentint -9.922 1.266 -4.196 {"}'M' greentint -10.14 1.129 -4.202 {"}'M' greentint -9.519 1.861 -3.916 {"}'M' greentint -9.636 1.634 -3.926 {"}'M' greentint -9.794 1.433 -3.935 {"}'M' greentint -9.988 1.265 -3.942 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 21 2fr2A_35Y_23G}P -6.708 5.782 -12.503 {"}-6.708 5.782 -12.503 { ca gly A 21 2fr2A_35Y_23G}-7.196 6.42 -11.304 { c gly A 21 2fr2A_35Y_23G}-7.312 5.433 -10.163 { o gly A 21 2fr2A_35Y_23G}-6.472 4.544 -10.021 { c gly A 21 2fr2A_35Y_23G}P -7.312 5.433 -10.163 { n arg A 22 2fr2A_35Y_23G}-8.36 5.605 -9.358 { ca arg A 22 2fr2A_35Y_23G}-8.444 4.921 -8.062 { c arg A 22 2fr2A_35Y_23G}-9.889 4.755 -7.735 { o arg A 22 2fr2A_35Y_23G}-10.702 5.598 -8.104 { c arg A 22 2fr2A_35Y_23G}P -9.889 4.755 -7.735 { n gly A 23 2fr2A_35Y_23G}-10.199 3.639 -7.071 { ca gly A 23 2fr2A_35Y_23G}-11.574 3.411 -6.643 { c gly A 23 2fr2A_35Y_23G}-11.624 2.613 -5.355 { o gly A 23 2fr2A_35Y_23G}-10.62 2.446 -4.652 { c gly A 23 2fr2A_35Y_23G}P -11.624 2.613 -5.355 { n ala A 24 2fr2A_35Y_23G}-12.818 2.129 -5.064 { ca ala A 24 2fr2A_35Y_23G}-13.07 1.38 -3.835 { c ala A 24 2fr2A_35Y_23G}-14.151 0.352 -4.058 { o ala A 24 2fr2A_35Y_23G}-14.997 0.495 -4.945 { c ala A 24 2fr2A_35Y_23G}P -14.151 0.352 -4.058 { n gly A 25 2fr2A_35Y_23G}-14.087 -0.716 -3.267 { ca gly A 25 2fr2A_35Y_23G}-15.032 -1.818 -3.361 { c gly A 25 2fr2A_35Y_23G}-15.562 -2.221 -1.99 { o gly A 25 2fr2A_35Y_23G}-14.924 -2.001 -0.938 { n phe A 33 2fr2A_35Y_23G}P -12.283 -2.423 0.455 {"}-12.283 -2.423 0.455 { ca phe A 33 2fr2A_35Y_23G}-10.938 -2.298 -0.041 { c phe A 33 2fr2A_35Y_23G}-10.851 -1.142 -1.026 { o phe A 33 2fr2A_35Y_23G}-11.875 -0.604 -1.455 { c phe A 33 2fr2A_35Y_23G}P -10.851 -1.142 -1.026 { n glu A 34 2fr2A_35Y_23G}-9.635 -0.743 -1.348 { ca glu A 34 2fr2A_35Y_23G}-9.416 0.275 -2.365 { c glu A 34 2fr2A_35Y_23G}-8.436 -0.26 -3.381 { o glu A 34 2fr2A_35Y_23G}-7.684 -1.191 -3.108 { c glu A 34 2fr2A_35Y_23G}P -8.436 -0.26 -3.381 { n tyr A 35 2fr2A_35Y_23G}-8.43 0.363 -4.555 { ca tyr A 35 2fr2A_35Y_23G}-7.587 -0.111 -5.644 { c tyr A 35 2fr2A_35Y_23G}-7.216 0.994 -6.596 { o tyr A 35 2fr2A_35Y_23G}-7.922 2.004 -6.692 { c tyr A 35 2fr2A_35Y_23G}P -7.216 0.994 -6.596 { n leu A 36 2fr2A_35Y_23G}-6.082 0.788 -7.273 { ca leu A 36 2fr2A_35Y_23G}-5.695 1.623 -8.412 { c leu A 36 2fr2A_35Y_23G}-6.197 0.912 -9.66 { o leu A 36 2fr2A_35Y_23G}-6.299 -0.325 -9.677 { c leu A 36 2fr2A_35Y_23G}P -6.197 0.912 -9.66 { n glu A 37 2fr2A_35Y_23G}-6.521 1.682 -10.69 { ca glu A 37 2fr2A_35Y_23G}-7.13 1.129 -11.892 { c glu A 37 2fr2A_35Y_23G}-6.544 1.793 -13.132 { o glu A 37 2fr2A_35Y_23G}-6.362 3.015 -13.149 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 21 2fr2A_35Y_23G}P -6.708 5.782 -12.503 { ca gly A 21 2fr2A_35Y_23G}P -7.196 6.42 -11.304 {"}P -7.196 6.42 -11.304 { n arg A 22 2fr2A_35Y_23G}P -8.36 5.605 -9.358 { ca arg A 22 2fr2A_35Y_23G}P -8.444 4.921 -8.062 { n gly A 23 2fr2A_35Y_23G}P -10.199 3.639 -7.071 { ca gly A 23 2fr2A_35Y_23G}P -11.574 3.411 -6.643 {"}P -11.574 3.411 -6.643 { n ala A 24 2fr2A_35Y_23G}P -12.818 2.129 -5.064 { ca ala A 24 2fr2A_35Y_23G}P -13.07 1.38 -3.835 { n gly A 25 2fr2A_35Y_23G}P -14.087 -0.716 -3.267 { ca gly A 25 2fr2A_35Y_23G}P -15.032 -1.818 -3.361 {"}P -15.032 -1.818 -3.361 { n phe A 33 2fr2A_35Y_23G}P -12.283 -2.423 0.455 { ca phe A 33 2fr2A_35Y_23G}P -10.938 -2.298 -0.041 { n glu A 34 2fr2A_35Y_23G}P -9.635 -0.743 -1.348 { ca glu A 34 2fr2A_35Y_23G}P -9.416 0.275 -2.365 { n tyr A 35 2fr2A_35Y_23G}P -8.43 0.363 -4.555 { ca tyr A 35 2fr2A_35Y_23G}P -7.587 -0.111 -5.644 { n leu A 36 2fr2A_35Y_23G}P -6.082 0.788 -7.273 { ca leu A 36 2fr2A_35Y_23G}P -5.695 1.623 -8.412 { n glu A 37 2fr2A_35Y_23G}P -6.521 1.682 -10.69 { ca glu A 37 2fr2A_35Y_23G}P -7.13 1.129 -11.892 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 21 2fr2A_35Y_23G}P -7.196 6.42 -11.304 {"}-7.196 6.42 -11.304 { ca arg A 22 2fr2A_35Y_23G}-8.444 4.921 -8.062 { ca gly A 23 2fr2A_35Y_23G}-11.574 3.411 -6.643 { ca ala A 24 2fr2A_35Y_23G}-13.07 1.38 -3.835 { ca gly A 25 2fr2A_35Y_23G}-15.032 -1.818 -3.361 { ca phe A 33 2fr2A_35Y_23G}P -10.938 -2.298 -0.041 {"}-10.938 -2.298 -0.041 { ca glu A 34 2fr2A_35Y_23G}-9.416 0.275 -2.365 { ca tyr A 35 2fr2A_35Y_23G}-7.587 -0.111 -5.644 { ca leu A 36 2fr2A_35Y_23G}-5.695 1.623 -8.412 { ca glu A 37 2fr2A_35Y_23G}-7.13 1.129 -11.892 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca arg A 22 2fr2A_35Y_23G}P -8.444 4.921 -8.062 { ca ala A 24 2fr2A_35Y_23G}P -13.07 1.38 -3.835 { ca phe A 33 2fr2A_35Y_23G}P -10.938 -2.298 -0.041 { ca glu A 34 2fr2A_35Y_23G}P -9.416 0.275 -2.365 { ca tyr A 35 2fr2A_35Y_23G}P -7.587 -0.111 -5.644 { cb tyr A 35 2fr2A_35Y_23G}-8.317 -1.239 -6.4 { cg tyr A 35 2fr2A_35Y_23G}-9.683 -0.821 -6.978 { cd1 tyr A 35 2fr2A_35Y_23G}-9.788 -0.295 -8.282 { ce1 tyr A 35 2fr2A_35Y_23G}-11.044 0.048 -8.839 { cz tyr A 35 2fr2A_35Y_23G}-12.205 -0.137 -8.069 { oh tyr A 35 2fr2A_35Y_23G}-13.479 0.154 -8.581 { cg tyr A 35 2fr2A_35Y_23G}P -9.683 -0.821 -6.978 { cd2 tyr A 35 2fr2A_35Y_23G}-10.858 -1.03 -6.262 { ce2 tyr A 35 2fr2A_35Y_23G}-12.093 -0.674 -6.778 { cz tyr A 35 2fr2A_35Y_23G}ghost -12.205 -0.137 -8.069 { ca leu A 36 2fr2A_35Y_23G}P -5.695 1.623 -8.412 { ca glu A 37 2fr2A_35Y_23G}P -7.13 1.129 -11.892 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 35 2fr2A_35Y_23G}P -8.317 -1.239 -6.4 {"}P -8.317 -1.239 -6.4 { cd1 tyr A 35 2fr2A_35Y_23G}P -9.788 -0.295 -8.282 { cd2 tyr A 35 2fr2A_35Y_23G}P -10.858 -1.03 -6.262 { ce1 tyr A 35 2fr2A_35Y_23G}P -11.044 0.048 -8.839 { ce2 tyr A 35 2fr2A_35Y_23G}P -12.093 -0.674 -6.778 { oh tyr A 35 2fr2A_35Y_23G}P -13.479 0.154 -8.581 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 35 2fr2A_35Y_23G}P -7.587 -0.111 -5.644 { cb tyr A 35 2fr2A_35Y_23G}-8.317 -1.239 -6.4 { cg tyr A 35 2fr2A_35Y_23G}-9.683 -0.821 -6.978 { cd1 tyr A 35 2fr2A_35Y_23G}-9.788 -0.295 -8.282 { ce1 tyr A 35 2fr2A_35Y_23G}-11.044 0.048 -8.839 { cz tyr A 35 2fr2A_35Y_23G}-12.205 -0.137 -8.069 { oh tyr A 35 2fr2A_35Y_23G}-13.479 0.154 -8.581 { cg tyr A 35 2fr2A_35Y_23G}P -9.683 -0.821 -6.978 { cd2 tyr A 35 2fr2A_35Y_23G}-10.858 -1.03 -6.262 { ce2 tyr A 35 2fr2A_35Y_23G}-12.093 -0.674 -6.778 { cz tyr A 35 2fr2A_35Y_23G}ghost -12.205 -0.137 -8.069 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 35 2fr2A_35Y_23G}P -8.317 -1.239 -6.4 {"}P -8.317 -1.239 -6.4 { cd1 tyr A 35 2fr2A_35Y_23G}P -9.788 -0.295 -8.282 { cd2 tyr A 35 2fr2A_35Y_23G}P -10.858 -1.03 -6.262 { ce1 tyr A 35 2fr2A_35Y_23G}P -11.044 0.048 -8.839 { ce2 tyr A 35 2fr2A_35Y_23G}P -12.093 -0.674 -6.778 { oh tyr A 35 2fr2A_35Y_23G}P -13.479 0.154 -8.581 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 35 A}'P' blue -11.742 1.586 -8.382 {"}'P' blue -11.555 1.565 -8.133 {"}'P' blue -11.307 1.626 -8.13 {"}'P' blue -11.488 1.458 -7.902 { CZ TYR 35 A}'P' blue -12.593 1.568 -8.125 {"}'P' sky -12.335 1.607 -8.124 {"}'P' sky -12.075 1.607 -8.124 {"}'P' sky -11.817 1.568 -8.125 {"}'P' sky -12.601 1.555 -7.864 {"}'P' blue -11.575 1.483 -7.867 {"}'P' sky -12.657 1.49 -7.608 {"}'P' sky -11.628 1.45 -7.61 {"}'P' sky -12.468 1.441 -7.36 {"}'P' sky -11.958 1.444 -7.36 {"}'P' blue -11.709 1.385 -7.363 {"}'P' blue -12.141 1.338 -7.129 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ TYR 35 A}'P' sea -12.344 1.595 -7.862 {"}'P' sea -12.083 1.596 -7.862 {"}'P' sea -11.825 1.559 -7.864 {"}'P' sea -12.401 1.539 -7.606 {"}'P' sea -12.14 1.549 -7.606 {"}'P' sea -11.88 1.519 -7.607 {"}'P' sea -12.213 1.463 -7.359 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 23 A}'P' blue -11.984 2.003 -8.199 {"}'P' blue -12.244 2.001 -8.199 {"}'P' blue -11.523 2.03 -7.976 {"}'P' blue -11.748 1.912 -7.981 {"}'P' sky -11.995 1.852 -7.984 {"}'P' sky -12.496 1.912 -7.981 {"}'P' blue -11.62 1.863 -7.736 {"}'P' sky -12.61 1.856 -7.736 {"}'P' blue -11.574 1.842 -7.476 {"}'P' sky -11.809 1.749 -7.48 {"}'P' sky -12.555 1.789 -7.478 {"}'P' blue -11.86 1.754 -7.219 {"}'P' sky -12.114 1.724 -7.221 {"}'P' sky -12.368 1.751 -7.219 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 23 A}'P' sea -12.249 1.852 -7.984 {"}'P' sea -11.86 1.777 -7.74 {"}'P' sea -12.114 1.747 -7.741 {"}'P' sea -12.368 1.774 -7.74 {"}'P' sea -12.059 1.708 -7.482 {"}'P' sea -12.311 1.722 -7.481 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 35 A}'M' greentint -9.169 2.158 -7.31 {"}'M' greentint -9.118 2.406 -7.299 {"}'M' greentint -9.018 2.639 -7.289 {"}'M' greentint -8.873 2.847 -7.28 {"}'M' greentint -8.689 3.021 -7.272 {"}'M' greentint -9.263 2.14 -7.07 {"}'M' greentint -9.216 2.392 -7.059 {"}'M' greentint -9.123 2.63 -7.048 {"}'M' greentint -8.985 2.846 -7.039 {"}'M' greentint -8.81 3.032 -7.031 {"}'M' greentint -9.316 2.01 -6.821 {"}'M' greentint -9.292 2.266 -6.81 {"}'M' greentint -9.222 2.513 -6.799 {"}'M' greentint -9.107 2.743 -6.789 {"}'M' greentint -8.952 2.948 -6.78 {"}'M' greentint -8.762 3.121 -6.773 {"}'M' greentint -9.316 1.99 -6.563 {"}'M' greentint -9.294 2.246 -6.552 {"}'M' greentint -9.225 2.494 -6.541 {"}'M' greentint -9.112 2.725 -6.531 {"}'M' greentint -8.958 2.931 -6.522 {"}'M' greentint -8.769 3.105 -6.515 {"}'M' greentint -9.214 2.366 -6.293 {"}'M' greentint -9.119 2.604 -6.282 {"}'M' greentint -8.98 2.819 -6.273 {"}'M' greentint -8.804 3.004 -6.265 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 23 A}'M' greentint -8.721 2.691 -7.341 {"}'M' greentint -8.831 2.457 -7.352 {"}'M' greentint -9.005 2.267 -7.36 {"}'M' greentint -8.685 2.946 -7.33 {"}'M' greentint -8.618 2.678 -7.1 {"}'M' greentint -8.714 2.445 -7.111 {"}'M' greentint -8.868 2.245 -7.119 {"}'M' greentint -9.068 2.092 -7.126 {"}'M' greentint -8.585 2.927 -7.09 {"}'M' greentint -8.58 2.675 -6.842 {"}'M' greentint -8.671 2.442 -6.852 {"}'M' greentint -8.817 2.238 -6.861 {"}'M' greentint -9.008 2.077 -6.868 {"}'M' greentint -9.234 1.968 -6.872 {"}'M' greentint -8.584 3.172 -6.82 {"}'M' greentint -8.551 2.924 -6.831 {"}'M' greentint -8.618 2.655 -6.583 {"}'M' greentint -8.714 2.422 -6.593 {"}'M' greentint -8.868 2.222 -6.602 {"}'M' greentint -9.068 2.069 -6.609 {"}'M' greentint -9.301 1.973 -6.613 {"}'M' greentint -8.618 3.154 -6.562 {"}'M' greentint -8.585 2.905 -6.572 {"}'M' greentint -8.721 2.647 -6.342 {"}'M' greentint -8.831 2.414 -6.352 {"}'M' greentint -9.005 2.223 -6.361 {"}'M' greentint -9.227 2.092 -6.367 {"}'M' greentint -8.685 2.902 -6.331 {"}'M' greentint -8.892 2.63 -6.136 {"}'M' greentint -9.028 2.409 -6.145 {"}'M' greentint -8.844 2.885 -6.125 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 35 A}'M' green -9.419 1.937 -5.237 {"}'M' green -9.945 1.159 -4.511 {"}'M' green -9.229 2.091 -4.471 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 35 A}'M' greentint -9.763 1.56 -5.253 {"}'M' greentint -9.619 1.774 -5.244 {"}'M' greentint -9.912 1.431 -5.018 {"}'M' greentint -9.816 1.664 -5.008 {"}'M' greentint -9.662 1.864 -4.999 {"}'M' greentint -9.462 2.017 -4.992 {"}'M' greentint -9.972 1.287 -4.765 {"}'M' greentint -9.912 1.53 -4.754 {"}'M' greentint -9.793 1.751 -4.745 {"}'M' greentint -9.623 1.935 -4.737 {"}'M' greentint -9.412 2.071 -4.731 {"}'M' greentint -9.912 1.408 -4.501 {"}'M' greentint -9.816 1.641 -4.49 {"}'M' greentint -9.662 1.841 -4.482 {"}'M' greentint -9.462 1.994 -4.475 {"}'M' greentint -9.763 1.516 -4.254 {"}'M' greentint -9.619 1.731 -4.245 {"}'M' greentint -9.419 1.893 -4.238 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 23 A}'M' green -9.468 1.979 -5.297 {"}'M' green -9.591 1.758 -5.307 {"}'M' green -9.757 1.566 -5.315 {"}'M' green -9.25 2.196 -4.792 {"}'M' green -9.999 1.205 -4.835 {"}'M' green -9.248 2.193 -4.534 {"}'M' green -9.991 1.197 -4.577 {"}'M' green -9.587 1.71 -4.059 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 23 A}'M' greentint -9.367 1.97 -5.056 {"}'M' greentint -9.483 1.742 -5.066 {"}'M' greentint -9.64 1.54 -5.075 {"}'M' greentint -9.832 1.372 -5.082 {"}'M' greentint -9.32 1.949 -4.803 {"}'M' greentint -9.435 1.718 -4.813 {"}'M' greentint -9.59 1.513 -4.822 {"}'M' greentint -9.78 1.34 -4.83 {"}'M' greentint -9.317 1.945 -4.545 {"}'M' greentint -9.43 1.714 -4.555 {"}'M' greentint -9.584 1.508 -4.564 {"}'M' greentint -9.773 1.334 -4.571 {"}'M' greentint -9.37 1.929 -4.291 {"}'M' greentint -9.487 1.702 -4.301 {"}'M' greentint -9.645 1.501 -4.31 {"}'M' greentint -9.839 1.333 -4.317 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 77 2fwvA_90F_79G}P -6.729 6.32 -11.923 {"}-6.729 6.32 -11.923 { ca gly A 77 2fwvA_90F_79G}-7.203 6.788 -10.627 { c gly A 77 2fwvA_90F_79G}-7.35 5.663 -9.668 { o gly A 77 2fwvA_90F_79G}-6.685 4.647 -9.81 { c gly A 77 2fwvA_90F_79G}P -7.35 5.663 -9.668 { n glu A 78 2fwvA_90F_79G}-8.185 5.885 -8.662 { ca glu A 78 2fwvA_90F_79G}-8.417 4.927 -7.587 { c glu A 78 2fwvA_90F_79G}-9.905 4.662 -7.464 { o glu A 78 2fwvA_90F_79G}-10.766 5.477 -7.884 { c glu A 78 2fwvA_90F_79G}P -9.905 4.662 -7.464 { n gly A 79 2fwvA_90F_79G}-10.229 3.534 -6.856 { ca gly A 79 2fwvA_90F_79G}-11.61 3.182 -6.644 { c gly A 79 2fwvA_90F_79G}-11.764 2.474 -5.321 { o gly A 79 2fwvA_90F_79G}-10.77 2.3 -4.578 { c gly A 79 2fwvA_90F_79G}P -11.764 2.474 -5.321 { n glu A 80 2fwvA_90F_79G}-13.005 2.079 -5.054 { ca glu A 80 2fwvA_90F_79G}-13.389 1.413 -3.808 { c glu A 80 2fwvA_90F_79G}-14.218 0.208 -4.178 { o glu A 80 2fwvA_90F_79G}-15.038 0.279 -5.091 { c glu A 80 2fwvA_90F_79G}P -14.218 0.208 -4.178 { n gly A 81 2fwvA_90F_79G}-13.996 -0.899 -3.481 { ca gly A 81 2fwvA_90F_79G}-14.778 -2.096 -3.668 { c gly A 81 2fwvA_90F_79G}-15.333 -2.61 -2.353 { o gly A 81 2fwvA_90F_79G}-14.838 -2.263 -1.259 { n tyr A 88 2fwvA_90F_79G}P -12.486 -2.113 0.359 {"}-12.486 -2.113 0.359 { ca tyr A 88 2fwvA_90F_79G}-11.08 -2.103 0.034 { c tyr A 88 2fwvA_90F_79G}-10.798 -1.056 -1.071 { o tyr A 88 2fwvA_90F_79G}-11.721 -0.561 -1.741 { c tyr A 88 2fwvA_90F_79G}P -10.798 -1.056 -1.071 { n arg A 89 2fwvA_90F_79G}-9.53 -0.704 -1.205 { ca arg A 89 2fwvA_90F_79G}-9.098 0.274 -2.212 { c arg A 89 2fwvA_90F_79G}-8.42 -0.437 -3.368 { o arg A 89 2fwvA_90F_79G}-7.794 -1.501 -3.2 { c arg A 89 2fwvA_90F_79G}P -8.42 -0.437 -3.368 { n phe A 90 2fwvA_90F_79G}-8.513 0.18 -4.544 { ca phe A 90 2fwvA_90F_79G}-7.743 -0.302 -5.687 { c phe A 90 2fwvA_90F_79G}-7.326 0.858 -6.581 { o phe A 90 2fwvA_90F_79G}-7.938 1.93 -6.542 { c phe A 90 2fwvA_90F_79G}P -7.326 0.858 -6.581 { n gly A 91 2fwvA_90F_79G}-6.268 0.658 -7.366 { ca gly A 91 2fwvA_90F_79G}-5.933 1.605 -8.412 { c gly A 91 2fwvA_90F_79G}-6.302 0.999 -9.766 { o gly A 91 2fwvA_90F_79G}-6.511 -0.201 -9.887 { c gly A 91 2fwvA_90F_79G}P -6.302 0.999 -9.766 { n gln A 92 2fwvA_90F_79G}-6.414 1.852 -10.767 { ca gln A 92 2fwvA_90F_79G}-6.877 1.374 -12.075 { c gln A 92 2fwvA_90F_79G}-6.416 2.281 -13.205 { o gln A 92 2fwvA_90F_79G}-6.327 3.524 -13.038 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 77 2fwvA_90F_79G}P -6.729 6.32 -11.923 { ca gly A 77 2fwvA_90F_79G}P -7.203 6.788 -10.627 {"}P -7.203 6.788 -10.627 { n glu A 78 2fwvA_90F_79G}P -8.185 5.885 -8.662 { ca glu A 78 2fwvA_90F_79G}P -8.417 4.927 -7.587 { n gly A 79 2fwvA_90F_79G}P -10.229 3.534 -6.856 { ca gly A 79 2fwvA_90F_79G}P -11.61 3.182 -6.644 {"}P -11.61 3.182 -6.644 { n glu A 80 2fwvA_90F_79G}P -13.005 2.079 -5.054 { ca glu A 80 2fwvA_90F_79G}P -13.389 1.413 -3.808 { n gly A 81 2fwvA_90F_79G}P -13.996 -0.899 -3.481 { ca gly A 81 2fwvA_90F_79G}P -14.778 -2.096 -3.668 {"}P -14.778 -2.096 -3.668 { n tyr A 88 2fwvA_90F_79G}P -12.486 -2.113 0.359 { ca tyr A 88 2fwvA_90F_79G}P -11.08 -2.103 0.034 { n arg A 89 2fwvA_90F_79G}P -9.53 -0.704 -1.205 { ca arg A 89 2fwvA_90F_79G}P -9.098 0.274 -2.212 { n phe A 90 2fwvA_90F_79G}P -8.513 0.18 -4.544 { ca phe A 90 2fwvA_90F_79G}P -7.743 -0.302 -5.687 { n gly A 91 2fwvA_90F_79G}P -6.268 0.658 -7.366 { ca gly A 91 2fwvA_90F_79G}P -5.933 1.605 -8.412 {"}P -5.933 1.605 -8.412 { n gln A 92 2fwvA_90F_79G}P -6.414 1.852 -10.767 { ca gln A 92 2fwvA_90F_79G}P -6.877 1.374 -12.075 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 77 2fwvA_90F_79G}P -7.203 6.788 -10.627 {"}-7.203 6.788 -10.627 { ca glu A 78 2fwvA_90F_79G}-8.417 4.927 -7.587 { ca gly A 79 2fwvA_90F_79G}-11.61 3.182 -6.644 { ca glu A 80 2fwvA_90F_79G}-13.389 1.413 -3.808 { ca gly A 81 2fwvA_90F_79G}-14.778 -2.096 -3.668 { ca tyr A 88 2fwvA_90F_79G}P -11.08 -2.103 0.034 {"}-11.08 -2.103 0.034 { ca arg A 89 2fwvA_90F_79G}-9.098 0.274 -2.212 { ca phe A 90 2fwvA_90F_79G}-7.743 -0.302 -5.687 { ca gly A 91 2fwvA_90F_79G}-5.933 1.605 -8.412 { ca gln A 92 2fwvA_90F_79G}-6.877 1.374 -12.075 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca glu A 78 2fwvA_90F_79G}P -8.417 4.927 -7.587 { ca glu A 80 2fwvA_90F_79G}P -13.389 1.413 -3.808 { ca tyr A 88 2fwvA_90F_79G}P -11.08 -2.103 0.034 { ca arg A 89 2fwvA_90F_79G}P -9.098 0.274 -2.212 { ca phe A 90 2fwvA_90F_79G}P -7.743 -0.302 -5.687 { cb phe A 90 2fwvA_90F_79G}-8.537 -1.366 -6.476 { cg phe A 90 2fwvA_90F_79G}-9.808 -0.868 -7.082 { cd1 phe A 90 2fwvA_90F_79G}-9.806 -0.3 -8.366 { ce1 phe A 90 2fwvA_90F_79G}-11.032 0.154 -8.959 { cz phe A 90 2fwvA_90F_79G}-12.251 0.01 -8.256 { cg phe A 90 2fwvA_90F_79G}P -9.808 -0.868 -7.082 { cd2 phe A 90 2fwvA_90F_79G}-11.02 -1.028 -6.413 { ce2 phe A 90 2fwvA_90F_79G}-12.242 -0.606 -6.984 { cz phe A 90 2fwvA_90F_79G}ghost -12.251 0.01 -8.256 { ca gln A 92 2fwvA_90F_79G}P -6.877 1.374 -12.075 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 90 2fwvA_90F_79G}P -8.537 -1.366 -6.476 {"}P -8.537 -1.366 -6.476 { cd1 phe A 90 2fwvA_90F_79G}P -9.806 -0.3 -8.366 { cd2 phe A 90 2fwvA_90F_79G}P -11.02 -1.028 -6.413 { ce1 phe A 90 2fwvA_90F_79G}P -11.032 0.154 -8.959 { ce2 phe A 90 2fwvA_90F_79G}P -12.242 -0.606 -6.984 { cz phe A 90 2fwvA_90F_79G}P -12.251 0.01 -8.256 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 90 2fwvA_90F_79G}P -7.743 -0.302 -5.687 { cb phe A 90 2fwvA_90F_79G}-8.537 -1.366 -6.476 { cg phe A 90 2fwvA_90F_79G}-9.808 -0.868 -7.082 { cd1 phe A 90 2fwvA_90F_79G}-9.806 -0.3 -8.366 { ce1 phe A 90 2fwvA_90F_79G}-11.032 0.154 -8.959 { cz phe A 90 2fwvA_90F_79G}-12.251 0.01 -8.256 { cg phe A 90 2fwvA_90F_79G}P -9.808 -0.868 -7.082 { cd2 phe A 90 2fwvA_90F_79G}-11.02 -1.028 -6.413 { ce2 phe A 90 2fwvA_90F_79G}-12.242 -0.606 -6.984 { cz phe A 90 2fwvA_90F_79G}ghost -12.251 0.01 -8.256 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 90 2fwvA_90F_79G}P -8.537 -1.366 -6.476 {"}P -8.537 -1.366 -6.476 { cd1 phe A 90 2fwvA_90F_79G}P -9.806 -0.3 -8.366 { cd2 phe A 90 2fwvA_90F_79G}P -11.02 -1.028 -6.413 { ce1 phe A 90 2fwvA_90F_79G}P -11.032 0.154 -8.959 { ce2 phe A 90 2fwvA_90F_79G}P -12.242 -0.606 -6.984 { cz phe A 90 2fwvA_90F_79G}P -12.251 0.01 -8.256 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 90 A}'P' blue -11.677 1.768 -8.758 {"}'P' sky -11.228 1.83 -8.496 {"}'P' sky -11.04 1.754 -8.249 {"}'P' sky -10.968 1.629 -8.019 {"}'P' sky -10.975 1.472 -7.809 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 90 A}'P' sea -11.73 1.692 -8.502 {"}'P' sea -11.484 1.781 -8.498 {"}'P' green -11.543 1.671 -8.253 {"}'P' green -11.295 1.732 -8.25 {"}'P' green -11.476 1.564 -8.022 {"}'P' green -11.225 1.618 -8.019 {"}'P' sea -11.235 1.458 -7.81 { CZ PHE 90 A}'P' green -12.381 1.754 -8.311 {"}'P' green -11.863 1.715 -8.312 {"}'P' green -12.647 1.702 -8.051 {"}'P' green -12.703 1.637 -7.795 {"}'P' green -11.436 1.49 -7.802 {"}'P' green -12.762 1.527 -7.55 {"}'P' green -11.519 1.436 -7.554 {"}'P' green -12.444 1.474 -7.316 {"}'P' green -11.686 1.377 -7.32 {"}'P' green -12.194 1.328 -7.106 {"}'P' green -11.936 1.293 -7.108 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 90 A}'P' P -12.121 1.754 -8.311 {"}'P' -12.121 1.751 -8.311 {"}'P' P -12.39 1.742 -8.049 {"}'P' -12.386 1.695 -8.055 {"}'P' P -12.129 1.743 -8.049 {"}'P' -12.135 1.659 -8.06 {"}'P' P -11.871 1.706 -8.051 {"}'P' -11.887 1.633 -8.06 {"}'P' P -11.621 1.63 -8.054 {"}'P' -11.628 1.613 -8.057 {"}'P' P -12.447 1.686 -7.793 {"}'P' -12.439 1.619 -7.811 {"}'P' P -12.186 1.696 -7.793 {"}'P' -12.19 1.579 -7.825 {"}'P' P -11.926 1.666 -7.794 {"}'P' -11.949 1.552 -7.826 {"}'P' P -11.674 1.597 -7.797 {"}'P' -11.697 1.536 -7.815 {"}'P' P -12.514 1.588 -7.547 {"}'P' -12.508 1.556 -7.562 {"}'P' P -12.259 1.61 -7.546 {"}'P' -12.259 1.52 -7.586 {"}'P' P -12.004 1.591 -7.547 {"}'P' -12.02 1.49 -7.592 {"}'P' P -11.755 1.532 -7.55 {"}'P' -11.776 1.47 -7.579 {"}'P' P -12.187 1.485 -7.316 {"}'P' -12.188 1.448 -7.339 {"}'P' P -11.932 1.452 -7.317 {"}'P' -11.939 1.419 -7.338 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 79 A}'P' sky -11.403 2.104 -8.395 {"}'P' sky -11.188 2.078 -8.211 {"}'P' sky -11.065 1.84 -7.752 {"}'P' sky -11.205 1.642 -7.5 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 79 A}'P' sea -11.597 1.942 -8.402 {"}'P' green -12.089 1.855 -8.406 {"}'P' sea -11.357 1.88 -8.22 {"}'P' green -11.574 1.737 -8.226 {"}'P' sea -11.173 1.857 -7.999 {"}'P' green -11.363 1.688 -8.006 {"}'P' sea -11.244 1.658 -7.76 {"}'P' green -11.46 1.521 -7.766 {"}'P' green -12.667 1.648 -7.76 {"}'P' green -11.414 1.5 -7.506 {"}'P' green -12.619 1.566 -7.503 {"}'P' green -11.7 1.412 -7.249 {"}'P' green -12.45 1.491 -7.246 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 79 A}'P' P -11.824 1.661 -8.229 {"}'P' -11.826 1.678 -8.215 {"}'P' P -12.084 1.659 -8.229 {"}'P' -12.079 1.694 -8.199 {"}'P' P -12.334 1.73 -8.226 {"}'P' -12.33 1.74 -8.217 {"}'P' P -11.588 1.57 -8.011 {"}'P' -11.594 1.586 -8.002 {"}'P' P -11.835 1.51 -8.014 {"}'P' -11.844 1.586 -7.972 {"}'P' P -12.089 1.51 -8.014 {"}'P' -12.077 1.607 -7.961 {"}'P' P -12.336 1.57 -8.011 {"}'P' -12.309 1.64 -7.972 {"}'P' P -12.561 1.688 -8.006 {"}'P' -12.554 1.697 -8 {"}'P' P -11.7 1.435 -7.77 {"}'P' -11.717 1.504 -7.75 {"}'P' P -11.954 1.405 -7.771 {"}'P' -11.955 1.522 -7.739 {"}'P' P -12.208 1.432 -7.77 {"}'P' -12.182 1.548 -7.737 {"}'P' P -12.45 1.514 -7.766 {"}'P' -12.417 1.582 -7.746 {"}'P' P -11.649 1.407 -7.51 {"}'P' -11.656 1.434 -7.509 {"}'P' P -11.899 1.366 -7.512 {"}'P' -11.903 1.448 -7.508 {"}'P' P -12.151 1.38 -7.511 {"}'P' -12.136 1.472 -7.507 {"}'P' P -12.395 1.447 -7.508 {"}'P' -12.372 1.505 -7.506 {"}'P' P -11.954 1.382 -7.251 {"}'P' -11.954 1.394 -7.253 {"}'P' P -12.208 1.409 -7.249 {"}'P' -12.205 1.421 -7.252 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 90 A}'M' greentint -9.134 2.332 -7.149 {"}'M' greentint -9.034 2.565 -7.139 {"}'M' greentint -8.889 2.773 -7.13 {"}'M' greentint -9.279 2.066 -6.92 {"}'M' greentint -9.232 2.318 -6.909 {"}'M' greentint -9.139 2.556 -6.898 {"}'M' greentint -9.001 2.772 -6.889 {"}'M' greentint -8.826 2.958 -6.881 {"}'M' greentint -9.332 1.936 -6.671 {"}'M' greentint -9.308 2.192 -6.66 {"}'M' greentint -9.238 2.439 -6.649 {"}'M' greentint -9.123 2.669 -6.639 {"}'M' greentint -8.968 2.874 -6.63 {"}'M' greentint -8.778 3.047 -6.623 {"}'M' greentint -9.332 1.916 -6.413 {"}'M' greentint -9.31 2.172 -6.402 {"}'M' greentint -9.241 2.42 -6.391 {"}'M' greentint -9.128 2.651 -6.381 {"}'M' greentint -8.974 2.857 -6.372 {"}'M' greentint -8.785 3.031 -6.365 {"}'M' greentint -9.278 2.041 -6.154 {"}'M' greentint -9.23 2.292 -6.143 {"}'M' greentint -9.135 2.53 -6.132 {"}'M' greentint -8.996 2.745 -6.123 {"}'M' greentint -8.82 2.93 -6.115 {"}'M' greentint -9.136 2.27 -5.903 {"}'M' greentint -9.038 2.503 -5.892 {"}'M' greentint -8.894 2.712 -5.883 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 79 A}'M' greentint -8.91 2.643 -7.23 {"}'M' greentint -9.046 2.422 -7.239 {"}'M' greentint -8.739 2.642 -7.022 {"}'M' greentint -8.849 2.408 -7.033 {"}'M' greentint -9.023 2.218 -7.041 {"}'M' greentint -8.703 2.897 -7.011 {"}'M' greentint -8.636 2.629 -6.781 {"}'M' greentint -8.732 2.396 -6.792 {"}'M' greentint -8.886 2.196 -6.8 {"}'M' greentint -9.086 2.043 -6.807 {"}'M' greentint -8.603 2.878 -6.771 {"}'M' greentint -8.598 2.626 -6.523 {"}'M' greentint -8.689 2.393 -6.533 {"}'M' greentint -8.835 2.189 -6.542 {"}'M' greentint -9.026 2.028 -6.549 {"}'M' greentint -9.252 1.919 -6.553 {"}'M' greentint -8.602 3.123 -6.501 {"}'M' greentint -8.569 2.875 -6.512 {"}'M' greentint -8.636 2.606 -6.264 {"}'M' greentint -8.732 2.373 -6.274 {"}'M' greentint -8.886 2.173 -6.283 {"}'M' greentint -9.086 2.02 -6.29 {"}'M' greentint -8.636 3.105 -6.243 {"}'M' greentint -8.603 2.856 -6.253 {"}'M' greentint -8.739 2.598 -6.023 {"}'M' greentint -8.849 2.365 -6.033 {"}'M' greentint -9.023 2.174 -6.042 {"}'M' greentint -8.703 2.853 -6.012 {"}'M' greentint -8.91 2.581 -5.817 {"}'M' greentint -9.046 2.36 -5.826 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 90 A}'M' green -9.871 1.369 -5.208 {"}'M' green -9.727 1.583 -5.199 {"}'M' green -9.527 1.746 -5.192 {"}'M' green -10.053 0.968 -4.466 {"}'M' green -9.337 1.9 -4.426 {"}'M' green -9.945 1.078 -4.22 {"}'M' green -9.527 1.702 -4.193 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 90 A}'M' greentint -10.02 1.24 -4.973 {"}'M' greentint -9.924 1.473 -4.963 {"}'M' greentint -9.77 1.673 -4.954 {"}'M' greentint -9.57 1.826 -4.947 {"}'M' greentint -10.08 1.096 -4.72 {"}'M' greentint -10.02 1.339 -4.709 {"}'M' greentint -9.901 1.56 -4.7 {"}'M' greentint -9.731 1.744 -4.692 {"}'M' greentint -9.52 1.88 -4.686 {"}'M' greentint -10.02 1.217 -4.456 {"}'M' greentint -9.924 1.45 -4.445 {"}'M' greentint -9.77 1.65 -4.437 {"}'M' greentint -9.57 1.803 -4.43 {"}'M' greentint -9.871 1.325 -4.209 {"}'M' greentint -9.727 1.54 -4.2 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 79 A}'M' green -9.618 1.833 -5.223 {"}'M' green -9.741 1.612 -5.233 {"}'M' green -9.907 1.42 -5.241 {"}'M' green -9.4 2.05 -4.718 {"}'M' green -10.149 1.059 -4.761 {"}'M' green -9.398 2.047 -4.46 {"}'M' green -10.141 1.051 -4.503 {"}'M' green -9.52 1.783 -4.217 {"}'M' green -9.989 1.187 -4.243 {"}'M' green -9.737 1.564 -3.985 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 79 A}'M' greentint -9.517 1.824 -4.982 {"}'M' greentint -9.633 1.596 -4.992 {"}'M' greentint -9.79 1.394 -5.001 {"}'M' greentint -9.982 1.226 -5.008 {"}'M' greentint -9.47 1.803 -4.729 {"}'M' greentint -9.585 1.572 -4.739 {"}'M' greentint -9.74 1.367 -4.748 {"}'M' greentint -9.93 1.194 -4.756 {"}'M' greentint -9.467 1.799 -4.471 {"}'M' greentint -9.58 1.568 -4.481 {"}'M' greentint -9.734 1.362 -4.49 {"}'M' greentint -9.923 1.188 -4.497 {"}'M' greentint -9.637 1.556 -4.227 {"}'M' greentint -9.795 1.355 -4.236 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n arg A 235 2g5fA_237F_248}P -11.209 -2.064 1.445 {"}-11.209 -2.064 1.445 { ca arg A 235 2g5fA_237F_248}-10.709 -2.389 0.115 { c arg A 235 2g5fA_237F_248}-10.608 -1.109 -0.704 { o arg A 235 2g5fA_237F_248}-11.419 -0.196 -0.549 { c arg A 235 2g5fA_237F_248}P -10.608 -1.109 -0.704 { n ser A 236 2g5fA_237F_248}-9.603 -1.04 -1.566 { ca ser A 236 2g5fA_237F_248}-9.436 0.114 -2.44 { c ser A 236 2g5fA_237F_248}-8.683 -0.342 -3.677 { o ser A 236 2g5fA_237F_248}-8.102 -1.433 -3.693 { c ser A 236 2g5fA_237F_248}P -8.683 -0.342 -3.677 { n phe A 237 2g5fA_237F_248}-8.707 0.469 -4.727 { ca phe A 237 2g5fA_237F_248}-8.041 0.075 -5.953 { c phe A 237 2g5fA_237F_248}-7.645 1.252 -6.825 { o phe A 237 2g5fA_237F_248}-8.143 2.362 -6.666 { c phe A 237 2g5fA_237F_248}P -7.645 1.252 -6.825 { n leu A 238 2g5fA_237F_248}-6.737 0.969 -7.75 { ca leu A 238 2g5fA_237F_248}-6.214 1.932 -8.71 { c leu A 238 2g5fA_237F_248}-5.826 1.055 -9.879 { o leu A 238 2g5fA_237F_248}-5.087 0.08 -9.709 { c leu A 238 2g5fA_237F_248}P -5.826 1.055 -9.879 { n leu A 239 2g5fA_237F_248}-6.318 1.382 -11.065 { ca leu A 239 2g5fA_237F_248}-5.995 0.557 -12.212 { c leu A 239 2g5fA_237F_248}-5.944 1.283 -13.543 { o leu A 239 2g5fA_237F_248}-6.492 2.375 -13.711 { n ala A 246 2g5fA_237F_248}P -9.11 3.857 -13.485 {"}-9.11 3.857 -13.485 { ca ala A 246 2g5fA_237F_248}-10.114 3.93 -12.431 { c ala A 246 2g5fA_237F_248}-9.473 3.788 -11.067 { o ala A 246 2g5fA_237F_248}-8.432 3.145 -10.916 { c ala A 246 2g5fA_237F_248}P -9.473 3.788 -11.067 { n leu A 247 2g5fA_237F_248}-10.1 4.411 -10.08 { ca leu A 247 2g5fA_237F_248}-9.633 4.328 -8.708 { c leu A 247 2g5fA_237F_248}-10.876 4.346 -7.841 { o leu A 247 2g5fA_237F_248}-11.916 4.887 -8.242 { c leu A 247 2g5fA_237F_248}P -10.876 4.346 -7.841 { n gly A 248 2g5fA_237F_248}-10.786 3.751 -6.657 { ca gly A 248 2g5fA_237F_248}-11.945 3.741 -5.795 { c gly A 248 2g5fA_237F_248}-11.665 3.263 -4.391 { o gly A 248 2g5fA_237F_248}-10.652 2.608 -4.116 { c gly A 248 2g5fA_237F_248}P -11.665 3.263 -4.391 { n tyr A 249 2g5fA_237F_248}-12.591 3.605 -3.505 { ca tyr A 249 2g5fA_237F_248}-12.524 3.241 -2.095 { c tyr A 249 2g5fA_237F_248}-13.812 2.468 -1.845 { o tyr A 249 2g5fA_237F_248}-14.909 3.024 -1.937 { c tyr A 249 2g5fA_237F_248}P -13.812 2.468 -1.845 { n ser A 250 2g5fA_237F_248}-13.666 1.183 -1.536 { ca ser A 250 2g5fA_237F_248}-14.801 0.297 -1.354 { c ser A 250 2g5fA_237F_248}-14.921 -0.351 0.022 { o ser A 250 2g5fA_237F_248}-14.186 -1.284 0.354 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 235 2g5fA_237F_248}P -11.209 -2.064 1.445 { ca arg A 235 2g5fA_237F_248}P -10.709 -2.389 0.115 { n ser A 236 2g5fA_237F_248}P -9.603 -1.04 -1.566 { ca ser A 236 2g5fA_237F_248}P -9.436 0.114 -2.44 { n phe A 237 2g5fA_237F_248}P -8.707 0.469 -4.727 { ca phe A 237 2g5fA_237F_248}P -8.041 0.075 -5.953 { n leu A 238 2g5fA_237F_248}P -6.737 0.969 -7.75 { ca leu A 238 2g5fA_237F_248}P -6.214 1.932 -8.71 { n leu A 239 2g5fA_237F_248}P -6.318 1.382 -11.065 { ca leu A 239 2g5fA_237F_248}P -5.995 0.557 -12.212 { n ala A 246 2g5fA_237F_248}P -9.11 3.857 -13.485 { ca ala A 246 2g5fA_237F_248}P -10.114 3.93 -12.431 { n leu A 247 2g5fA_237F_248}P -10.1 4.411 -10.08 { ca leu A 247 2g5fA_237F_248}P -9.633 4.328 -8.708 { n gly A 248 2g5fA_237F_248}P -10.786 3.751 -6.657 { ca gly A 248 2g5fA_237F_248}P -11.945 3.741 -5.795 {"}P -11.945 3.741 -5.795 { n tyr A 249 2g5fA_237F_248}P -12.591 3.605 -3.505 { ca tyr A 249 2g5fA_237F_248}P -12.524 3.241 -2.095 { n ser A 250 2g5fA_237F_248}P -13.666 1.183 -1.536 { ca ser A 250 2g5fA_237F_248}P -14.801 0.297 -1.354 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca arg A 235 2g5fA_237F_248}P -10.709 -2.389 0.115 {"}-10.709 -2.389 0.115 { ca ser A 236 2g5fA_237F_248}-9.436 0.114 -2.44 { ca phe A 237 2g5fA_237F_248}-8.041 0.075 -5.953 { ca leu A 238 2g5fA_237F_248}-6.214 1.932 -8.71 { ca leu A 239 2g5fA_237F_248}-5.995 0.557 -12.212 { ca ala A 246 2g5fA_237F_248}P -10.114 3.93 -12.431 {"}-10.114 3.93 -12.431 { ca leu A 247 2g5fA_237F_248}-9.633 4.328 -8.708 { ca gly A 248 2g5fA_237F_248}-11.945 3.741 -5.795 { ca tyr A 249 2g5fA_237F_248}-12.524 3.241 -2.095 { ca ser A 250 2g5fA_237F_248}-14.801 0.297 -1.354 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca arg A 235 2g5fA_237F_248}P -10.709 -2.389 0.115 { ca ser A 236 2g5fA_237F_248}P -9.436 0.114 -2.44 { ca phe A 237 2g5fA_237F_248}P -8.041 0.075 -5.953 { cb phe A 237 2g5fA_237F_248}-8.953 -0.869 -6.749 { cg phe A 237 2g5fA_237F_248}-10.148 -0.182 -7.365 { cd1 phe A 237 2g5fA_237F_248}-10.075 0.353 -8.648 { ce1 phe A 237 2g5fA_237F_248}-11.163 1.024 -9.21 { cz phe A 237 2g5fA_237F_248}-12.341 1.16 -8.478 { cg phe A 237 2g5fA_237F_248}P -10.148 -0.182 -7.365 { cd2 phe A 237 2g5fA_237F_248}-11.329 -0.038 -6.645 { ce2 phe A 237 2g5fA_237F_248}-12.425 0.628 -7.193 { cz phe A 237 2g5fA_237F_248}ghost -12.341 1.16 -8.478 { ca leu A 238 2g5fA_237F_248}P -6.214 1.932 -8.71 { ca leu A 239 2g5fA_237F_248}P -5.995 0.557 -12.212 { ca ala A 246 2g5fA_237F_248}P -10.114 3.93 -12.431 { ca leu A 247 2g5fA_237F_248}P -9.633 4.328 -8.708 { ca tyr A 249 2g5fA_237F_248}P -12.524 3.241 -2.095 { ca ser A 250 2g5fA_237F_248}P -14.801 0.297 -1.354 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 237 2g5fA_237F_248}P -8.953 -0.869 -6.749 {"}P -8.953 -0.869 -6.749 { cd1 phe A 237 2g5fA_237F_248}P -10.075 0.353 -8.648 { cd2 phe A 237 2g5fA_237F_248}P -11.329 -0.038 -6.645 { ce1 phe A 237 2g5fA_237F_248}P -11.163 1.024 -9.21 { ce2 phe A 237 2g5fA_237F_248}P -12.425 0.628 -7.193 { cz phe A 237 2g5fA_237F_248}P -12.341 1.16 -8.478 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 237 2g5fA_237F_248}P -8.041 0.075 -5.953 { cb phe A 237 2g5fA_237F_248}-8.953 -0.869 -6.749 { cg phe A 237 2g5fA_237F_248}-10.148 -0.182 -7.365 { cd1 phe A 237 2g5fA_237F_248}-10.075 0.353 -8.648 { ce1 phe A 237 2g5fA_237F_248}-11.163 1.024 -9.21 { cz phe A 237 2g5fA_237F_248}-12.341 1.16 -8.478 { cg phe A 237 2g5fA_237F_248}P -10.148 -0.182 -7.365 { cd2 phe A 237 2g5fA_237F_248}-11.329 -0.038 -6.645 { ce2 phe A 237 2g5fA_237F_248}-12.425 0.628 -7.193 { cz phe A 237 2g5fA_237F_248}ghost -12.341 1.16 -8.478 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 237 2g5fA_237F_248}P -8.953 -0.869 -6.749 {"}P -8.953 -0.869 -6.749 { cd1 phe A 237 2g5fA_237F_248}P -10.075 0.353 -8.648 { cd2 phe A 237 2g5fA_237F_248}P -11.329 -0.038 -6.645 { ce1 phe A 237 2g5fA_237F_248}P -11.163 1.024 -9.21 { ce2 phe A 237 2g5fA_237F_248}P -12.425 0.628 -7.193 { cz phe A 237 2g5fA_237F_248}P -12.341 1.16 -8.478 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 237 A}'P' sky -13.023 2.474 -7.545 {"}'P' sky -12.277 2.635 -7.538 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 237 A}'P' green -12.813 2.333 -7.249 {"}'P' green -13.07 2.242 -6.992 {"}'P' green -12.045 2.324 -6.988 {"}'P' green -13.172 2.046 -6.491 {"}'P' green -13.107 1.942 -6.26 {"}'P' green -12.88 1.869 -6.047 {"}'P' green -12.628 1.932 -6.044 {"}'P' green -12.368 1.946 -6.043 { CZ PHE 237 A}'P' sea -12.785 2.57 -7.541 {"}'P' sea -12.534 2.624 -7.538 {"}'P' sea -13.032 2.292 -7.336 {"}'P' green -12.796 2.401 -7.332 {"}'P' green -12.544 2.464 -7.329 {"}'P' sea -12.284 2.478 -7.328 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 237 A}'P' P -12.821 2.32 -6.988 {"}'P' -12.811 2.277 -6.993 {"}'P' P -12.564 2.36 -6.986 {"}'P' -12.559 2.304 -6.993 {"}'P' P -12.303 2.361 -6.986 {"}'P' -12.305 2.338 -6.989 {"}'P' P -13.123 2.166 -6.736 {"}'P' -13.115 2.148 -6.742 {"}'P' P -12.877 2.255 -6.732 {"}'P' -12.853 2.169 -6.756 {"}'P' P -12.621 2.304 -6.73 {"}'P' -12.607 2.191 -6.761 {"}'P' P -12.36 2.314 -6.73 {"}'P' -12.363 2.226 -6.754 {"}'P' P -12.1 2.284 -6.731 {"}'P' -12.104 2.265 -6.736 {"}'P' P -12.936 2.145 -6.487 {"}'P' -12.912 2.074 -6.52 {"}'P' P -12.688 2.206 -6.484 {"}'P' -12.669 2.094 -6.534 {"}'P' P -12.433 2.228 -6.483 {"}'P' -12.433 2.124 -6.529 {"}'P' P -12.178 2.209 -6.484 {"}'P' -12.186 2.161 -6.505 {"}'P' P -12.869 2.038 -6.256 {"}'P' -12.856 1.997 -6.283 {"}'P' P -12.618 2.092 -6.253 {"}'P' -12.609 2.024 -6.296 {"}'P' P -12.361 2.103 -6.253 {"}'P' -12.363 2.054 -6.284 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 248 A}'P' sky -12.586 2.921 -7.393 {"}'P' blue -12.846 2.921 -7.393 {"}'P' sky -12.272 2.896 -7.308 {"}'P' sky -12.962 2.699 -7.316 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 248 A}'P' sea -12.455 2.707 -7.316 {"}'P' sea -12.708 2.635 -7.319 {"}'P' sea -12.157 2.667 -7.178 {"}'P' green -12.351 2.505 -7.185 {"}'P' green -12.589 2.418 -7.189 {"}'P' green -12.843 2.418 -7.189 {"}'P' green -12.111 2.443 -7.003 {"}'P' green -13.088 2.293 -7.009 {"}'P' green -13.204 2.077 -6.549 {"}'P' green -13.149 2.01 -6.291 {"}'P' green -12.454 1.975 -6.032 {"}'P' green -12.708 1.945 -6.034 {"}'P' green -12.962 1.972 -6.032 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 248 A}'P' P -12.328 2.3 -7.009 {"}'P' -12.339 2.322 -6.988 {"}'P' P -12.578 2.224 -7.012 {"}'P' -12.586 2.275 -6.968 {"}'P' P -12.838 2.222 -7.012 {"}'P' -12.833 2.257 -6.982 {"}'P' P -12.117 2.251 -6.789 {"}'P' -12.13 2.269 -6.778 {"}'P' P -12.342 2.133 -6.794 {"}'P' -12.373 2.212 -6.749 {"}'P' P -12.589 2.073 -6.797 {"}'P' -12.602 2.179 -6.739 {"}'P' P -12.843 2.073 -6.797 {"}'P' -12.832 2.158 -6.751 {"}'P' P -13.09 2.133 -6.794 {"}'P' -13.081 2.157 -6.781 {"}'P' P -12.214 2.084 -6.549 {"}'P' -12.245 2.146 -6.53 {"}'P' P -12.454 1.998 -6.553 {"}'P' -12.481 2.109 -6.521 {"}'P' P -12.708 1.968 -6.554 {"}'P' -12.709 2.083 -6.522 {"}'P' P -12.962 1.995 -6.553 {"}'P' -12.946 2.064 -6.533 {"}'P' P -12.168 2.063 -6.289 {"}'P' -12.176 2.078 -6.288 {"}'P' P -12.403 1.97 -6.293 {"}'P' -12.421 2.034 -6.29 {"}'P' P -12.653 1.929 -6.295 {"}'P' -12.657 2.005 -6.292 {"}'P' P -12.905 1.943 -6.294 {"}'P' -12.898 1.985 -6.292 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 237 A}'M' green -9.437 2.75 -7.033 {"}'M' green -9.344 2.988 -7.022 {"}'M' green -9.206 3.204 -7.013 {"}'M' green -9.537 2.348 -6.537 {"}'M' green -8.99 3.463 -6.489 {"}'M' green -9.391 2.453 -6.037 {"}'M' green -8.916 3.32 -6 {"}'M' green -9.193 2.707 -5.806 {"}'M' green -9.076 2.939 -5.796 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 237 A}'M' greentint -9.513 2.624 -6.784 {"}'M' greentint -9.443 2.871 -6.773 {"}'M' greentint -9.328 3.101 -6.763 {"}'M' greentint -9.173 3.306 -6.754 {"}'M' greentint -9.515 2.604 -6.526 {"}'M' greentint -9.446 2.852 -6.515 {"}'M' greentint -9.333 3.083 -6.505 {"}'M' greentint -9.179 3.289 -6.496 {"}'M' greentint -9.483 2.473 -6.278 {"}'M' greentint -9.435 2.724 -6.267 {"}'M' greentint -9.34 2.962 -6.256 {"}'M' greentint -9.201 3.177 -6.247 {"}'M' greentint -9.025 3.362 -6.239 {"}'M' greentint -9.341 2.702 -6.027 {"}'M' greentint -9.243 2.935 -6.016 {"}'M' greentint -9.099 3.144 -6.007 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 248 A}'M' green -9.311 3.074 -7.015 {"}'M' green -9.447 2.853 -7.024 {"}'M' green -9.004 3.287 -6.038 {"}'M' green -9.25 2.796 -5.818 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 248 A}'M' greentint -9.14 3.073 -6.807 {"}'M' greentint -9.25 2.839 -6.818 {"}'M' greentint -9.424 2.649 -6.826 {"}'M' greentint -9.104 3.328 -6.796 {"}'M' greentint -9.037 3.06 -6.566 {"}'M' greentint -9.133 2.827 -6.577 {"}'M' greentint -9.287 2.627 -6.585 {"}'M' greentint -9.487 2.474 -6.592 {"}'M' greentint -9.004 3.309 -6.556 {"}'M' greentint -8.999 3.057 -6.308 {"}'M' greentint -9.09 2.824 -6.318 {"}'M' greentint -9.236 2.62 -6.327 {"}'M' greentint -9.427 2.459 -6.334 {"}'M' greentint -8.97 3.306 -6.297 {"}'M' greentint -9.037 3.037 -6.049 {"}'M' greentint -9.133 2.804 -6.059 {"}'M' greentint -9.287 2.604 -6.068 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 237 A}'M' green -10.126 1.349 -4.494 {"}'M' green -9.855 1.459 -4.041 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 237 A}'M' greentint -9.997 1.854 -4.991 {"}'M' greentint -9.843 2.054 -4.982 {"}'M' greentint -9.643 2.207 -4.975 {"}'M' greentint -10.153 1.477 -4.748 {"}'M' greentint -10.093 1.72 -4.737 {"}'M' greentint -9.974 1.941 -4.728 {"}'M' greentint -9.804 2.125 -4.72 {"}'M' greentint -9.593 2.261 -4.714 {"}'M' greentint -10.093 1.598 -4.484 {"}'M' greentint -9.997 1.831 -4.473 {"}'M' greentint -9.843 2.031 -4.465 {"}'M' greentint -9.643 2.184 -4.458 {"}'M' greentint -9.41 2.281 -4.454 {"}'M' greentint -10.018 1.459 -4.248 {"}'M' greentint -9.944 1.706 -4.237 {"}'M' greentint -9.8 1.921 -4.228 {"}'M' greentint -9.6 2.083 -4.221 {"}'M' greentint -9.361 2.18 -4.217 {"}'M' greentint -9.761 1.701 -4.03 {"}'M' greentint -9.586 1.893 -4.022 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 248 A}'M' green -9.424 2.383 -4.75 {"}'M' green -10.217 1.461 -4.791 {"}'M' green -9.328 2.378 -4.51 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 248 A}'M' greentint -9.65 2.151 -4.98 {"}'M' greentint -9.791 1.934 -4.99 {"}'M' greentint -9.978 1.754 -4.998 {"}'M' greentint -9.5 2.141 -4.761 {"}'M' greentint -9.623 1.92 -4.771 {"}'M' greentint -9.789 1.728 -4.779 {"}'M' greentint -9.989 1.573 -4.786 {"}'M' greentint -9.399 2.132 -4.52 {"}'M' greentint -9.515 1.904 -4.53 {"}'M' greentint -9.672 1.702 -4.539 {"}'M' greentint -9.864 1.534 -4.546 {"}'M' greentint -10.085 1.404 -4.552 {"}'M' greentint -9.352 2.111 -4.267 {"}'M' greentint -9.467 1.88 -4.277 {"}'M' greentint -9.622 1.675 -4.286 {"}'M' greentint -9.812 1.502 -4.294 {"}'M' greentint -10.031 1.367 -4.299 {"}'M' greentint -9.462 1.876 -4.019 {"}'M' greentint -9.616 1.67 -4.028 {"}'M' greentint -9.805 1.496 -4.035 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n thr A 381 2gaiA_383F_396}P -11.807 -2.26 0.444 {"}-11.807 -2.26 0.444 { ca thr A 381 2gaiA_383F_396}-10.824 -2.482 -0.611 { c thr A 381 2gaiA_383F_396}-10.627 -1.145 -1.358 { o thr A 381 2gaiA_383F_396}-11.55 -0.584 -1.924 { c thr A 381 2gaiA_383F_396}P -10.627 -1.145 -1.358 { n arg A 382 2gaiA_383F_396}-9.42 -0.612 -1.297 { ca arg A 382 2gaiA_383F_396}-9.035 0.579 -2.026 { c arg A 382 2gaiA_383F_396}-8.185 0.084 -3.185 { o arg A 382 2gaiA_383F_396}-7.21 -0.683 -3.009 { c arg A 382 2gaiA_383F_396}P -8.185 0.084 -3.185 { n phe A 383 2gaiA_383F_396}-8.543 0.506 -4.388 { ca phe A 383 2gaiA_383F_396}-7.903 -0.023 -5.585 { c phe A 383 2gaiA_383F_396}-7.552 1.1 -6.55 { o phe A 383 2gaiA_383F_396}-8.202 2.171 -6.519 { c phe A 383 2gaiA_383F_396}P -7.552 1.1 -6.55 { n val A 384 2gaiA_383F_396}-6.558 0.769 -7.367 { ca val A 384 2gaiA_383F_396}-6.088 1.633 -8.434 { c val A 384 2gaiA_383F_396}-6.021 0.811 -9.694 { o val A 384 2gaiA_383F_396}-5.43 -0.277 -9.729 { c val A 384 2gaiA_383F_396}P -6.021 0.811 -9.694 { n leu A 385 2gaiA_383F_396}-6.572 1.369 -10.77 { ca leu A 385 2gaiA_383F_396}-6.565 0.752 -12.077 { c leu A 385 2gaiA_383F_396}-5.766 1.649 -12.993 { o leu A 385 2gaiA_383F_396}-5.777 2.85 -12.775 { n phe A 394 2gaiA_383F_396}P -7.059 5.345 -12.328 {"}-7.059 5.345 -12.328 { ca phe A 394 2gaiA_383F_396}-8.4 5.538 -11.798 { c phe A 394 2gaiA_383F_396}-8.413 4.894 -10.426 { o phe A 394 2gaiA_383F_396}-7.84 3.812 -10.285 { c phe A 394 2gaiA_383F_396}P -8.413 4.894 -10.426 { n lys A 395 2gaiA_383F_396}-9.01 5.563 -9.449 { ca lys A 395 2gaiA_383F_396}-8.983 5.11 -8.045 { c lys A 395 2gaiA_383F_396}-10.407 4.939 -7.564 { o lys A 395 2gaiA_383F_396}-11.311 5.712 -7.912 { c lys A 395 2gaiA_383F_396}P -10.407 4.939 -7.564 { n gly A 396 2gaiA_383F_396}-10.61 3.914 -6.735 { ca gly A 396 2gaiA_383F_396}-11.925 3.571 -6.263 { c gly A 396 2gaiA_383F_396}-11.78 2.855 -4.938 { o gly A 396 2gaiA_383F_396}-10.688 2.418 -4.544 { c gly A 396 2gaiA_383F_396}P -11.78 2.855 -4.938 { n thr A 397 2gaiA_383F_396}-12.914 2.78 -4.25 { ca thr A 397 2gaiA_383F_396}-13.009 2.005 -3.019 { c thr A 397 2gaiA_383F_396}-14.339 1.225 -3.028 { o thr A 397 2gaiA_383F_396}-15.34 1.669 -3.627 { c thr A 397 2gaiA_383F_396}P -14.339 1.225 -3.028 { n val A 398 2gaiA_383F_396}-14.351 0.069 -2.37 { ca val A 398 2gaiA_383F_396}-15.589 -0.66 -2.167 { c val A 398 2gaiA_383F_396}-15.564 -1.293 -0.792 { o val A 398 2gaiA_383F_396}-14.488 -1.653 -0.304 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 381 2gaiA_383F_396}P -11.807 -2.26 0.444 { ca thr A 381 2gaiA_383F_396}P -10.824 -2.482 -0.611 { n arg A 382 2gaiA_383F_396}P -9.42 -0.612 -1.297 { ca arg A 382 2gaiA_383F_396}P -9.035 0.579 -2.026 { n phe A 383 2gaiA_383F_396}P -8.543 0.506 -4.388 { ca phe A 383 2gaiA_383F_396}P -7.903 -0.023 -5.585 { n val A 384 2gaiA_383F_396}P -6.558 0.769 -7.367 { ca val A 384 2gaiA_383F_396}P -6.088 1.633 -8.434 { n leu A 385 2gaiA_383F_396}P -6.572 1.369 -10.77 { ca leu A 385 2gaiA_383F_396}P -6.565 0.752 -12.077 { n phe A 394 2gaiA_383F_396}P -7.059 5.345 -12.328 { ca phe A 394 2gaiA_383F_396}P -8.4 5.538 -11.798 { n lys A 395 2gaiA_383F_396}P -9.01 5.563 -9.449 { ca lys A 395 2gaiA_383F_396}P -8.983 5.11 -8.045 { n gly A 396 2gaiA_383F_396}P -10.61 3.914 -6.735 { ca gly A 396 2gaiA_383F_396}P -11.925 3.571 -6.263 {"}P -11.925 3.571 -6.263 { n thr A 397 2gaiA_383F_396}P -12.914 2.78 -4.25 { ca thr A 397 2gaiA_383F_396}P -13.009 2.005 -3.019 { n val A 398 2gaiA_383F_396}P -14.351 0.069 -2.37 { ca val A 398 2gaiA_383F_396}P -15.589 -0.66 -2.167 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca thr A 381 2gaiA_383F_396}P -10.824 -2.482 -0.611 {"}-10.824 -2.482 -0.611 { ca arg A 382 2gaiA_383F_396}-9.035 0.579 -2.026 { ca phe A 383 2gaiA_383F_396}-7.903 -0.023 -5.585 { ca val A 384 2gaiA_383F_396}-6.088 1.633 -8.434 { ca leu A 385 2gaiA_383F_396}-6.565 0.752 -12.077 { ca phe A 394 2gaiA_383F_396}P -8.4 5.538 -11.798 {"}-8.4 5.538 -11.798 { ca lys A 395 2gaiA_383F_396}-8.983 5.11 -8.045 { ca gly A 396 2gaiA_383F_396}-11.925 3.571 -6.263 { ca thr A 397 2gaiA_383F_396}-13.009 2.005 -3.019 { ca val A 398 2gaiA_383F_396}-15.589 -0.66 -2.167 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca thr A 381 2gaiA_383F_396}P -10.824 -2.482 -0.611 { ca arg A 382 2gaiA_383F_396}P -9.035 0.579 -2.026 { ca phe A 383 2gaiA_383F_396}P -7.903 -0.023 -5.585 { cb phe A 383 2gaiA_383F_396}-8.765 -1.08 -6.314 { cg phe A 383 2gaiA_383F_396}-10.157 -0.606 -6.674 { cd1 phe A 383 2gaiA_383F_396}-10.4 0.016 -7.89 { ce1 phe A 383 2gaiA_383F_396}-11.704 0.446 -8.184 { cz phe A 383 2gaiA_383F_396}-12.734 0.256 -7.289 { cg phe A 383 2gaiA_383F_396}P -10.157 -0.606 -6.674 { cd2 phe A 383 2gaiA_383F_396}-11.221 -0.785 -5.777 { ce2 phe A 383 2gaiA_383F_396}-12.509 -0.356 -6.068 { cz phe A 383 2gaiA_383F_396}ghost -12.734 0.256 -7.289 { ca val A 384 2gaiA_383F_396}P -6.088 1.633 -8.434 { ca leu A 385 2gaiA_383F_396}P -6.565 0.752 -12.077 { ca phe A 394 2gaiA_383F_396}P -8.4 5.538 -11.798 { ca lys A 395 2gaiA_383F_396}P -8.983 5.11 -8.045 { ca thr A 397 2gaiA_383F_396}P -13.009 2.005 -3.019 {"}P -13.009 2.005 -3.019 { ca val A 398 2gaiA_383F_396}P -15.589 -0.66 -2.167 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 383 2gaiA_383F_396}P -8.765 -1.08 -6.314 {"}P -8.765 -1.08 -6.314 { cd1 phe A 383 2gaiA_383F_396}P -10.4 0.016 -7.89 { cd2 phe A 383 2gaiA_383F_396}P -11.221 -0.785 -5.777 { ce1 phe A 383 2gaiA_383F_396}P -11.704 0.446 -8.184 { ce2 phe A 383 2gaiA_383F_396}P -12.509 -0.356 -6.068 { cz phe A 383 2gaiA_383F_396}P -12.734 0.256 -7.289 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 383 2gaiA_383F_396}P -7.903 -0.023 -5.585 { cb phe A 383 2gaiA_383F_396}-8.765 -1.08 -6.314 { cg phe A 383 2gaiA_383F_396}-10.157 -0.606 -6.674 { cd1 phe A 383 2gaiA_383F_396}-10.4 0.016 -7.89 { ce1 phe A 383 2gaiA_383F_396}-11.704 0.446 -8.184 { cz phe A 383 2gaiA_383F_396}-12.734 0.256 -7.289 { cg phe A 383 2gaiA_383F_396}P -10.157 -0.606 -6.674 { cd2 phe A 383 2gaiA_383F_396}-11.221 -0.785 -5.777 { ce2 phe A 383 2gaiA_383F_396}-12.509 -0.356 -6.068 { cz phe A 383 2gaiA_383F_396}ghost -12.734 0.256 -7.289 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 383 2gaiA_383F_396}P -8.765 -1.08 -6.314 {"}P -8.765 -1.08 -6.314 { cd1 phe A 383 2gaiA_383F_396}P -10.4 0.016 -7.89 { cd2 phe A 383 2gaiA_383F_396}P -11.221 -0.785 -5.777 { ce1 phe A 383 2gaiA_383F_396}P -11.704 0.446 -8.184 { ce2 phe A 383 2gaiA_383F_396}P -12.509 -0.356 -6.068 { cz phe A 383 2gaiA_383F_396}P -12.734 0.256 -7.289 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 383 A}'P' sea -12.584 1.946 -7.988 {"}'P' green -12.349 2.06 -7.983 {"}'P' green -12.1 2.138 -7.979 {"}'P' sea -11.843 2.178 -7.977 {"}'P' green -12.402 1.984 -7.727 {"}'P' green -11.9 2.122 -7.721 {"}'P' sea -11.639 2.132 -7.721 {"}'P' green -11.712 2.046 -7.474 {"}'P' sea -11.457 2.027 -7.475 {"}'P' green -11.897 1.91 -7.244 {"}'P' green -11.64 1.921 -7.244 { CZ PHE 383 A}'P' green -12.938 1.965 -7.604 {"}'P' green -13.122 1.961 -7.345 {"}'P' green -13.13 1.948 -7.084 {"}'P' green -13.186 1.883 -6.828 {"}'P' green -11.919 1.736 -6.835 {"}'P' green -12.997 1.834 -6.58 {"}'P' green -12.742 1.856 -6.579 {"}'P' green -12.238 1.778 -6.583 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 383 A}'P' P -12.156 2.073 -7.723 {"}'P' -12.155 2.067 -7.725 {"}'P' P -12.215 1.963 -7.478 {"}'P' -12.205 1.934 -7.492 {"}'P' P -11.967 2.024 -7.475 {"}'P' -11.964 2.005 -7.484 { CZ PHE 383 A}'P' P -12.677 1.977 -7.604 {"}'P' -12.677 1.969 -7.602 {"}'P' P -12.417 1.948 -7.605 {"}'P' -12.419 1.941 -7.604 {"}'P' P -12.864 2 -7.344 {"}'P' -12.861 1.955 -7.342 {"}'P' P -12.604 2 -7.344 {"}'P' -12.61 1.918 -7.341 {"}'P' P -12.346 1.961 -7.345 {"}'P' -12.361 1.894 -7.343 {"}'P' P -12.873 1.988 -7.082 {"}'P' -12.867 1.923 -7.09 {"}'P' P -12.612 1.989 -7.082 {"}'P' -12.619 1.884 -7.095 {"}'P' P -12.354 1.952 -7.084 {"}'P' -12.374 1.861 -7.095 {"}'P' P -12.104 1.876 -7.087 {"}'P' -12.116 1.847 -7.091 {"}'P' P -12.93 1.932 -6.826 {"}'P' -12.927 1.909 -6.832 {"}'P' P -12.669 1.942 -6.826 {"}'P' -12.671 1.872 -6.845 {"}'P' P -12.409 1.912 -6.827 {"}'P' -12.422 1.845 -6.846 {"}'P' P -12.157 1.843 -6.83 {"}'P' -12.164 1.826 -6.835 {"}'P' P -12.487 1.837 -6.58 {"}'P' -12.487 1.835 -6.581 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 396 A}'P' sky -12.565 2.249 -7.938 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 396 A}'P' sea -12.073 2.336 -7.934 {"}'P' sea -12.311 2.249 -7.938 {"}'P' green -11.833 2.274 -7.752 {"}'P' green -12.05 2.131 -7.758 {"}'P' green -12.3 2.055 -7.761 {"}'P' green -12.56 2.053 -7.761 {"}'P' sea -11.649 2.251 -7.531 {"}'P' green -11.839 2.082 -7.538 {"}'P' green -13.037 2.082 -7.538 {"}'P' green -11.72 2.052 -7.292 {"}'P' green -13.143 2.042 -7.292 {"}'P' green -11.89 1.894 -7.038 {"}'P' green -13.095 1.96 -7.035 {"}'P' green -11.936 1.892 -6.778 {"}'P' green -13.143 2.02 -6.772 {"}'P' green -12.311 1.859 -6.531 {"}'P' green -12.565 1.859 -6.531 {"}'P' green -12.812 1.92 -6.529 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 396 A}'P' P -12.064 1.964 -7.543 {"}'P' -12.074 1.99 -7.528 {"}'P' P -12.311 1.904 -7.546 {"}'P' -12.313 1.924 -7.535 {"}'P' P -12.565 1.904 -7.546 {"}'P' -12.561 1.936 -7.528 {"}'P' P -12.812 1.964 -7.543 {"}'P' -12.808 1.973 -7.538 {"}'P' P -11.936 1.915 -7.298 {"}'P' -11.94 1.923 -7.295 {"}'P' P -12.176 1.829 -7.302 {"}'P' -12.185 1.867 -7.291 {"}'P' P -12.43 1.799 -7.303 {"}'P' -12.43 1.884 -7.279 {"}'P' P -12.684 1.826 -7.302 {"}'P' -12.665 1.91 -7.278 {"}'P' P -12.926 1.908 -7.298 {"}'P' -12.907 1.946 -7.287 {"}'P' P -12.125 1.801 -7.042 {"}'P' -12.135 1.835 -7.041 {"}'P' P -12.375 1.76 -7.044 {"}'P' -12.38 1.852 -7.04 {"}'P' P -12.627 1.774 -7.043 {"}'P' -12.61 1.877 -7.039 {"}'P' P -12.871 1.841 -7.04 {"}'P' -12.845 1.906 -7.038 {"}'P' P -12.176 1.806 -6.781 {"}'P' -12.179 1.819 -6.784 {"}'P' P -12.43 1.776 -6.783 {"}'P' -12.43 1.835 -6.793 {"}'P' P -12.684 1.803 -6.781 {"}'P' -12.671 1.861 -6.792 {"}'P' P -12.926 1.885 -6.778 {"}'P' -12.919 1.899 -6.781 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 383 A}'M' green -8.831 3.408 -6.336 {"}'M' green -8.875 3.319 -6.085 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 383 A}'M' greentint -9.496 2.559 -6.886 {"}'M' greentint -9.403 2.797 -6.875 {"}'M' greentint -9.265 3.013 -6.866 {"}'M' greentint -9.09 3.199 -6.858 {"}'M' greentint -9.572 2.433 -6.637 {"}'M' greentint -9.502 2.68 -6.626 {"}'M' greentint -9.387 2.91 -6.616 {"}'M' greentint -9.232 3.115 -6.607 {"}'M' greentint -9.042 3.288 -6.6 {"}'M' greentint -9.574 2.413 -6.379 {"}'M' greentint -9.505 2.661 -6.368 {"}'M' greentint -9.392 2.892 -6.358 {"}'M' greentint -9.238 3.098 -6.349 {"}'M' greentint -9.049 3.272 -6.342 {"}'M' greentint -9.494 2.533 -6.12 {"}'M' greentint -9.399 2.771 -6.109 {"}'M' greentint -9.26 2.986 -6.1 {"}'M' greentint -9.084 3.171 -6.092 {"}'M' greentint -9.302 2.744 -5.869 {"}'M' greentint -9.158 2.953 -5.86 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 396 A}'M' green -8.915 3.312 -6.13 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 396 A}'M' greentint -9.051 3.098 -6.899 {"}'M' greentint -9.161 2.864 -6.91 {"}'M' greentint -9.335 2.674 -6.918 {"}'M' greentint -8.948 3.085 -6.658 {"}'M' greentint -9.044 2.852 -6.669 {"}'M' greentint -9.198 2.652 -6.677 {"}'M' greentint -9.398 2.499 -6.684 {"}'M' greentint -8.915 3.334 -6.648 {"}'M' greentint -8.91 3.082 -6.4 {"}'M' greentint -9.001 2.849 -6.41 {"}'M' greentint -9.147 2.645 -6.419 {"}'M' greentint -9.338 2.484 -6.426 {"}'M' greentint -9.564 2.375 -6.43 {"}'M' greentint -8.881 3.331 -6.389 {"}'M' greentint -8.948 3.062 -6.141 {"}'M' greentint -9.044 2.829 -6.151 {"}'M' greentint -9.198 2.629 -6.16 {"}'M' greentint -9.398 2.476 -6.167 {"}'M' greentint -9.051 3.054 -5.9 {"}'M' greentint -9.161 2.821 -5.91 {"}'M' greentint -9.335 2.63 -5.919 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 383 A}'M' greentint -9.852 1.595 -5.249 {"}'M' greentint -9.677 1.787 -5.241 {"}'M' greentint -10.109 1.335 -5.053 {"}'M' greentint -10.035 1.582 -5.042 {"}'M' greentint -9.891 1.796 -5.033 {"}'M' greentint -9.691 1.959 -5.026 {"}'M' greentint -9.452 2.055 -5.022 {"}'M' greentint -10.217 1.203 -4.818 {"}'M' greentint -10.184 1.453 -4.807 {"}'M' greentint -10.088 1.686 -4.797 {"}'M' greentint -9.934 1.886 -4.788 {"}'M' greentint -9.734 2.039 -4.781 {"}'M' greentint -9.501 2.135 -4.777 {"}'M' greentint -10.244 1.309 -4.554 {"}'M' greentint -10.184 1.552 -4.543 {"}'M' greentint -10.065 1.773 -4.534 {"}'M' greentint -9.895 1.957 -4.526 {"}'M' greentint -9.684 2.093 -4.52 {"}'M' greentint -9.446 2.172 -4.516 {"}'M' greentint -10.217 1.181 -4.3 {"}'M' greentint -10.184 1.43 -4.29 {"}'M' greentint -10.088 1.663 -4.279 {"}'M' greentint -9.934 1.863 -4.271 {"}'M' greentint -9.734 2.016 -4.264 {"}'M' greentint -9.501 2.113 -4.26 {"}'M' greentint -10.109 1.291 -4.054 {"}'M' greentint -10.035 1.538 -4.043 {"}'M' greentint -9.891 1.753 -4.034 {"}'M' greentint -9.691 1.915 -4.027 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 396 A}'M' greentint -9.659 1.73 -5.199 {"}'M' greentint -9.825 1.538 -5.207 {"}'M' greentint -9.435 1.942 -4.948 {"}'M' greentint -9.551 1.714 -4.958 {"}'M' greentint -9.708 1.512 -4.967 {"}'M' greentint -9.9 1.344 -4.974 {"}'M' greentint -10.121 1.214 -4.98 {"}'M' greentint -9.318 2.168 -4.684 {"}'M' greentint -9.388 1.921 -4.695 {"}'M' greentint -9.503 1.69 -4.705 {"}'M' greentint -9.658 1.485 -4.714 {"}'M' greentint -9.848 1.312 -4.722 {"}'M' greentint -10.067 1.177 -4.727 {"}'M' greentint -9.316 2.165 -4.426 {"}'M' greentint -9.385 1.917 -4.437 {"}'M' greentint -9.498 1.686 -4.447 {"}'M' greentint -9.652 1.48 -4.456 {"}'M' greentint -9.841 1.306 -4.463 {"}'M' greentint -10.059 1.169 -4.469 {"}'M' greentint -9.438 1.901 -4.183 {"}'M' greentint -9.555 1.674 -4.193 {"}'M' greentint -9.713 1.473 -4.202 {"}'M' greentint -9.907 1.305 -4.209 {"}'M' greentint -10.129 1.178 -4.215 {"}'M' greentint -9.533 1.904 -3.942 {"}'M' greentint -9.655 1.682 -3.951 {"}'M' greentint -9.819 1.489 -3.96 {"}'M' greentint -10.018 1.333 -3.967 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ser A 215 2gufA_217F_253}P -11.771 -1.877 1.206 {"}-11.771 -1.877 1.206 { ca ser A 215 2gufA_217F_253}-10.843 -2.165 0.128 { c ser A 215 2gufA_217F_253}-10.674 -0.959 -0.781 { o ser A 215 2gufA_217F_253}-11.513 -0.037 -0.795 { c ser A 215 2gufA_217F_253}P -10.674 -0.959 -0.781 { n gly A 216 2gufA_217F_253}-9.579 -0.952 -1.536 { ca gly A 216 2gufA_217F_253}-9.346 0.138 -2.489 { c gly A 216 2gufA_217F_253}-8.695 -0.433 -3.717 { o gly A 216 2gufA_217F_253}-8.136 -1.539 -3.68 { c gly A 216 2gufA_217F_253}P -8.695 -0.433 -3.717 { n phe A 217 2gufA_217F_253}-8.734 0.319 -4.811 { ca phe A 217 2gufA_217F_253}-8.018 -0.094 -6.011 { c phe A 217 2gufA_217F_253}-7.608 1.113 -6.8 { o phe A 217 2gufA_217F_253}-8.25 2.17 -6.708 { c phe A 217 2gufA_217F_253}P -7.608 1.113 -6.8 { n val A 218 2gufA_217F_253}-6.517 0.95 -7.544 { ca val A 218 2gufA_217F_253}-6.086 1.896 -8.578 { c val A 218 2gufA_217F_253}-5.802 1.079 -9.816 { o val A 218 2gufA_217F_253}-5.156 0.043 -9.727 { c val A 218 2gufA_217F_253}P -5.802 1.079 -9.816 { n arg A 219 2gufA_217F_253}-6.316 1.532 -10.958 { ca arg A 219 2gufA_217F_253}-6.199 0.806 -12.199 { c arg A 219 2gufA_217F_253}-5.879 1.842 -13.227 { o arg A 219 2gufA_217F_253}-6.48 2.927 -13.251 { n asp A 251 2gufA_217F_253}P -8.471 4.804 -12.912 {"}-8.471 4.804 -12.912 { ca asp A 251 2gufA_217F_253}-9.64 4.682 -12.034 { c asp A 251 2gufA_217F_253}-9.068 4.417 -10.672 { o asp A 251 2gufA_217F_253}-8.003 3.77 -10.552 { c asp A 251 2gufA_217F_253}P -9.068 4.417 -10.672 { n ala A 252 2gufA_217F_253}-9.735 4.933 -9.646 { ca ala A 252 2gufA_217F_253}-9.318 4.71 -8.261 { c ala A 252 2gufA_217F_253}-10.583 4.552 -7.506 { o ala A 252 2gufA_217F_253}-11.591 5.212 -7.811 { c ala A 252 2gufA_217F_253}P -10.583 4.552 -7.506 { n gly A 253 2gufA_217F_253}-10.584 3.697 -6.509 { ca gly A 253 2gufA_217F_253}-11.849 3.448 -5.847 { c gly A 253 2gufA_217F_253}-11.69 2.973 -4.432 { o gly A 253 2gufA_217F_253}-10.654 2.425 -4.072 { c gly A 253 2gufA_217F_253}P -11.69 2.973 -4.432 { n leu A 254 2gufA_217F_253}-12.723 3.192 -3.631 { ca leu A 254 2gufA_217F_253}-12.748 2.702 -2.252 { c leu A 254 2gufA_217F_253}-14.01 1.953 -2.094 { o leu A 254 2gufA_217F_253}-15.047 2.364 -2.627 { c leu A 254 2gufA_217F_253}P -14.01 1.953 -2.094 { n arg A 255 2gufA_217F_253}-13.97 0.85 -1.37 { ca arg A 255 2gufA_217F_253}-15.178 0.062 -1.223 { c arg A 255 2gufA_217F_253}-15.278 -0.41 0.188 { o arg A 255 2gufA_217F_253}-14.274 -0.788 0.815 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 215 2gufA_217F_253}P -11.771 -1.877 1.206 { ca ser A 215 2gufA_217F_253}P -10.843 -2.165 0.128 { n gly A 216 2gufA_217F_253}P -9.579 -0.952 -1.536 { ca gly A 216 2gufA_217F_253}P -9.346 0.138 -2.489 {"}P -9.346 0.138 -2.489 { n phe A 217 2gufA_217F_253}P -8.734 0.319 -4.811 { ca phe A 217 2gufA_217F_253}P -8.018 -0.094 -6.011 { n val A 218 2gufA_217F_253}P -6.517 0.95 -7.544 { ca val A 218 2gufA_217F_253}P -6.086 1.896 -8.578 { n arg A 219 2gufA_217F_253}P -6.316 1.532 -10.958 { ca arg A 219 2gufA_217F_253}P -6.199 0.806 -12.199 { n asp A 251 2gufA_217F_253}P -8.471 4.804 -12.912 { ca asp A 251 2gufA_217F_253}P -9.64 4.682 -12.034 { n ala A 252 2gufA_217F_253}P -9.735 4.933 -9.646 { ca ala A 252 2gufA_217F_253}P -9.318 4.71 -8.261 { n gly A 253 2gufA_217F_253}P -10.584 3.697 -6.509 { ca gly A 253 2gufA_217F_253}P -11.849 3.448 -5.847 {"}P -11.849 3.448 -5.847 { n leu A 254 2gufA_217F_253}P -12.723 3.192 -3.631 { ca leu A 254 2gufA_217F_253}P -12.748 2.702 -2.252 { n arg A 255 2gufA_217F_253}P -13.97 0.85 -1.37 { ca arg A 255 2gufA_217F_253}P -15.178 0.062 -1.223 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ser A 215 2gufA_217F_253}P -10.843 -2.165 0.128 {"}-10.843 -2.165 0.128 { ca gly A 216 2gufA_217F_253}-9.346 0.138 -2.489 { ca phe A 217 2gufA_217F_253}-8.018 -0.094 -6.011 { ca val A 218 2gufA_217F_253}-6.086 1.896 -8.578 { ca arg A 219 2gufA_217F_253}-6.199 0.806 -12.199 { ca asp A 251 2gufA_217F_253}P -9.64 4.682 -12.034 {"}-9.64 4.682 -12.034 { ca ala A 252 2gufA_217F_253}-9.318 4.71 -8.261 { ca gly A 253 2gufA_217F_253}-11.849 3.448 -5.847 { ca leu A 254 2gufA_217F_253}-12.748 2.702 -2.252 { ca arg A 255 2gufA_217F_253}-15.178 0.062 -1.223 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ser A 215 2gufA_217F_253}P -10.843 -2.165 0.128 { ca phe A 217 2gufA_217F_253}P -8.018 -0.094 -6.011 { cb phe A 217 2gufA_217F_253}-8.903 -1.01 -6.86 { cg phe A 217 2gufA_217F_253}-10.034 -0.301 -7.489 { cd1 phe A 217 2gufA_217F_253}-9.817 0.503 -8.605 { ce1 phe A 217 2gufA_217F_253}-10.836 1.223 -9.187 { cz phe A 217 2gufA_217F_253}-12.092 1.132 -8.66 { cg phe A 217 2gufA_217F_253}P -10.034 -0.301 -7.489 { cd2 phe A 217 2gufA_217F_253}-11.294 -0.376 -6.95 { ce2 phe A 217 2gufA_217F_253}-12.325 0.33 -7.537 { cz phe A 217 2gufA_217F_253}ghost -12.092 1.132 -8.66 { ca val A 218 2gufA_217F_253}P -6.086 1.896 -8.578 { ca arg A 219 2gufA_217F_253}P -6.199 0.806 -12.199 {"}P -6.199 0.806 -12.199 { ca asp A 251 2gufA_217F_253}P -9.64 4.682 -12.034 { ca ala A 252 2gufA_217F_253}P -9.318 4.71 -8.261 { ca leu A 254 2gufA_217F_253}P -12.748 2.702 -2.252 { ca arg A 255 2gufA_217F_253}P -15.178 0.062 -1.223 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 217 2gufA_217F_253}P -8.903 -1.01 -6.86 {"}P -8.903 -1.01 -6.86 { cd1 phe A 217 2gufA_217F_253}P -9.817 0.503 -8.605 { cd2 phe A 217 2gufA_217F_253}P -11.294 -0.376 -6.95 { ce1 phe A 217 2gufA_217F_253}P -10.836 1.223 -9.187 { ce2 phe A 217 2gufA_217F_253}P -12.325 0.33 -7.537 { cz phe A 217 2gufA_217F_253}P -12.092 1.132 -8.66 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 217 2gufA_217F_253}P -8.018 -0.094 -6.011 { cb phe A 217 2gufA_217F_253}-8.903 -1.01 -6.86 { cg phe A 217 2gufA_217F_253}-10.034 -0.301 -7.489 { cd1 phe A 217 2gufA_217F_253}-9.817 0.503 -8.605 { ce1 phe A 217 2gufA_217F_253}-10.836 1.223 -9.187 { cz phe A 217 2gufA_217F_253}-12.092 1.132 -8.66 { cg phe A 217 2gufA_217F_253}P -10.034 -0.301 -7.489 { cd2 phe A 217 2gufA_217F_253}-11.294 -0.376 -6.95 { ce2 phe A 217 2gufA_217F_253}-12.325 0.33 -7.537 { cz phe A 217 2gufA_217F_253}ghost -12.092 1.132 -8.66 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 217 2gufA_217F_253}P -8.903 -1.01 -6.86 {"}P -8.903 -1.01 -6.86 { cd1 phe A 217 2gufA_217F_253}P -9.817 0.503 -8.605 { cd2 phe A 217 2gufA_217F_253}P -11.294 -0.376 -6.95 { ce1 phe A 217 2gufA_217F_253}P -10.836 1.223 -9.187 { ce2 phe A 217 2gufA_217F_253}P -12.325 0.33 -7.537 { cz phe A 217 2gufA_217F_253}P -12.092 1.132 -8.66 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 217 A}'P' green -13.023 1.868 -7.08 {"}'P' green -11.748 1.917 -7.078 {"}'P' green -13.072 1.748 -6.835 {"}'P' green -13.007 1.644 -6.604 {"}'P' green -11.76 1.697 -6.601 {"}'P' green -12.78 1.571 -6.391 {"}'P' green -12.518 1.448 -6.204 {"}'P' green -12.261 1.461 -6.204 { CZ PHE 217 A}'P' sea -12.774 2.446 -7.727 {"}'P' green -12.536 2.542 -7.723 {"}'P' green -12.285 2.596 -7.72 {"}'P' sea -12.028 2.607 -7.72 {"}'P' sea -12.994 2.112 -7.525 {"}'P' green -12.783 2.264 -7.518 {"}'P' green -12.035 2.45 -7.51 {"}'P' green -11.777 2.415 -7.512 {"}'P' green -11.774 2.222 -7.328 {"}'P' sea -11.534 2.127 -7.333 {"}'P' sea -11.606 1.926 -7.178 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 217 A}'P' P -12.777 1.957 -7.076 {"}'P' -12.762 1.903 -7.091 {"}'P' P -12.521 2.006 -7.074 {"}'P' -12.509 1.905 -7.102 {"}'P' P -12.26 2.016 -7.074 {"}'P' -12.264 1.914 -7.102 {"}'P' P -12 1.986 -7.075 {"}'P' -12.011 1.931 -7.09 {"}'P' P -12.836 1.847 -6.831 {"}'P' -12.816 1.789 -6.858 {"}'P' P -12.588 1.908 -6.828 {"}'P' -12.568 1.789 -6.882 {"}'P' P -12.333 1.93 -6.827 {"}'P' -12.332 1.794 -6.887 {"}'P' P -12.078 1.911 -6.828 {"}'P' -12.094 1.811 -6.873 {"}'P' P -11.829 1.852 -6.831 {"}'P' -11.838 1.825 -6.843 {"}'P' P -12.769 1.74 -6.6 {"}'P' -12.752 1.686 -6.635 {"}'P' P -12.518 1.794 -6.597 {"}'P' -12.504 1.692 -6.663 {"}'P' P -12.261 1.805 -6.597 {"}'P' -12.265 1.701 -6.663 {"}'P' P -12.006 1.772 -6.598 {"}'P' -12.019 1.713 -6.637 {"}'P' P -12.528 1.634 -6.388 {"}'P' -12.522 1.597 -6.421 {"}'P' P -12.268 1.648 -6.387 {"}'P' -12.27 1.606 -6.424 {"}'P' P -12.01 1.613 -6.389 {"}'P' -12.012 1.608 -6.393 { CZ PHE 217 A}'P' P -12.547 2.373 -7.514 {"}'P' -12.545 2.366 -7.52 {"}'P' P -12.295 2.436 -7.511 {"}'P' -12.293 2.421 -7.524 {"}'P' P -12.76 2.06 -7.335 {"}'P' -12.76 2.06 -7.336 {"}'P' P -12.533 2.181 -7.33 {"}'P' -12.518 2.146 -7.374 {"}'P' P -12.285 2.25 -7.327 {"}'P' -12.276 2.202 -7.384 {"}'P' P -12.028 2.263 -7.327 {"}'P' -12.029 2.234 -7.361 {"}'P' P -12.1 2.054 -7.172 {"}'P' -12.1 2.02 -7.228 {"}'P' P -11.845 2.022 -7.174 {"}'P' -11.845 2.02 -7.177 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 253 A}'P' green -12.284 2.522 -7.567 {"}'P' green -12.544 2.522 -7.567 {"}'P' sea -12.154 2.747 -7.558 {"}'P' green -11.97 2.497 -7.482 {"}'P' sea -12.849 2.482 -7.483 {"}'P' sea -11.729 2.488 -7.343 {"}'P' green -12.779 2.106 -7.359 {"}'P' sea -12.973 2.268 -7.352 {"}'P' sea -11.64 2.242 -7.168 {"}'P' green -11.809 2.044 -7.177 {"}'P' green -13.013 1.852 -6.963 {"}'P' green -11.696 1.822 -6.717 {"}'P' green -11.866 1.664 -6.463 {"}'P' green -12.152 1.576 -6.206 {"}'P' green -12.406 1.546 -6.208 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 253 A}'P' P -12.153 2.308 -7.49 {"}'P' -12.163 2.323 -7.449 {"}'P' P -12.406 2.236 -7.493 {"}'P' -12.406 2.258 -7.441 {"}'P' P -12.66 2.3 -7.49 {"}'P' -12.66 2.3 -7.489 {"}'P' P -11.855 2.268 -7.352 {"}'P' -11.856 2.269 -7.352 {"}'P' P -12.049 2.106 -7.359 {"}'P' -12.069 2.137 -7.309 {"}'P' P -12.287 2.019 -7.363 {"}'P' -12.296 2.067 -7.296 {"}'P' P -12.541 2.019 -7.363 {"}'P' -12.534 2.053 -7.316 {"}'P' P -12.026 1.901 -7.183 {"}'P' -12.045 1.939 -7.146 {"}'P' P -12.276 1.825 -7.186 {"}'P' -12.288 1.905 -7.116 {"}'P' P -12.536 1.823 -7.186 {"}'P' -12.525 1.898 -7.12 {"}'P' P -12.786 1.894 -7.183 {"}'P' -12.773 1.922 -7.157 {"}'P' P -11.815 1.852 -6.963 {"}'P' -11.827 1.869 -6.953 {"}'P' P -12.04 1.734 -6.968 {"}'P' -12.073 1.82 -6.919 {"}'P' P -12.287 1.674 -6.971 {"}'P' -12.303 1.801 -6.902 {"}'P' P -12.541 1.674 -6.971 {"}'P' -12.526 1.794 -6.906 {"}'P' P -12.788 1.734 -6.968 {"}'P' -12.761 1.803 -6.929 {"}'P' P -11.912 1.685 -6.723 {"}'P' -11.937 1.735 -6.708 {"}'P' P -12.152 1.599 -6.727 {"}'P' -12.178 1.709 -6.696 {"}'P' P -12.406 1.569 -6.728 {"}'P' -12.407 1.698 -6.692 {"}'P' P -12.66 1.596 -6.727 {"}'P' -12.638 1.695 -6.699 {"}'P' P -12.902 1.678 -6.723 {"}'P' -12.886 1.71 -6.714 {"}'P' P -12.101 1.571 -6.467 {"}'P' -12.114 1.617 -6.465 {"}'P' P -12.351 1.53 -6.469 {"}'P' -12.355 1.601 -6.466 {"}'P' P -12.603 1.544 -6.468 {"}'P' -12.594 1.597 -6.466 {"}'P' P -12.847 1.611 -6.465 {"}'P' -12.847 1.611 -6.465 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 217 A}'M' greentint -9.55 2.679 -6.815 {"}'M' greentint -9.435 2.909 -6.805 {"}'M' greentint -9.28 3.114 -6.796 {"}'M' greentint -9.09 3.287 -6.789 {"}'M' greentint -9.622 2.412 -6.568 {"}'M' greentint -9.553 2.66 -6.557 {"}'M' greentint -9.44 2.891 -6.547 {"}'M' greentint -9.286 3.097 -6.538 {"}'M' greentint -9.097 3.271 -6.531 {"}'M' greentint -9.59 2.281 -6.32 {"}'M' greentint -9.542 2.532 -6.309 {"}'M' greentint -9.447 2.77 -6.298 {"}'M' greentint -9.308 2.985 -6.289 {"}'M' greentint -9.132 3.17 -6.281 {"}'M' greentint -8.923 3.318 -6.274 {"}'M' greentint -9.498 2.261 -6.079 {"}'M' greentint -9.448 2.51 -6.069 {"}'M' greentint -9.35 2.743 -6.058 {"}'M' greentint -9.206 2.952 -6.049 {"}'M' greentint -9.023 3.128 -6.042 {"}'M' greentint -8.809 3.263 -6.036 {"}'M' greentint -9.3 2.515 -5.848 {"}'M' greentint -9.183 2.747 -5.838 {"}'M' greentint -9.017 2.945 -5.83 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 253 A}'M' greentint -9.133 2.973 -6.877 {"}'M' greentint -9.269 2.752 -6.886 {"}'M' greentint -9.477 2.595 -6.893 {"}'M' greentint -9.085 3.228 -6.865 {"}'M' greentint -8.962 2.972 -6.669 {"}'M' greentint -9.072 2.738 -6.68 {"}'M' greentint -9.246 2.548 -6.688 {"}'M' greentint -9.468 2.416 -6.694 {"}'M' greentint -8.926 3.227 -6.658 {"}'M' greentint -8.859 2.959 -6.428 {"}'M' greentint -8.955 2.726 -6.439 {"}'M' greentint -9.109 2.526 -6.447 {"}'M' greentint -9.309 2.373 -6.454 {"}'M' greentint -9.542 2.276 -6.458 {"}'M' greentint -8.826 3.208 -6.418 {"}'M' greentint -8.821 2.956 -6.17 {"}'M' greentint -8.912 2.723 -6.18 {"}'M' greentint -9.058 2.519 -6.189 {"}'M' greentint -9.249 2.358 -6.196 {"}'M' greentint -9.475 2.249 -6.2 {"}'M' greentint -8.792 3.205 -6.159 {"}'M' greentint -8.859 2.936 -5.911 {"}'M' greentint -8.955 2.703 -5.921 {"}'M' greentint -9.109 2.503 -5.93 {"}'M' greentint -9.309 2.35 -5.937 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 217 A}'M' green -10.069 1.677 -5.128 {"}'M' green -9.669 1.388 -4.014 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 217 A}'M' greentint -9.915 1.877 -5.119 {"}'M' greentint -10.165 1.543 -4.874 {"}'M' greentint -10.046 1.764 -4.865 {"}'M' greentint -9.876 1.948 -4.857 {"}'M' greentint -9.665 2.084 -4.851 {"}'M' greentint -10.165 1.421 -4.621 {"}'M' greentint -10.069 1.654 -4.61 {"}'M' greentint -9.915 1.854 -4.602 {"}'M' greentint -9.715 2.007 -4.595 {"}'M' greentint -9.482 2.104 -4.591 {"}'M' greentint -10.09 1.282 -4.385 {"}'M' greentint -10.016 1.529 -4.374 {"}'M' greentint -9.872 1.744 -4.365 {"}'M' greentint -9.672 1.906 -4.358 {"}'M' greentint -9.433 2.003 -4.354 {"}'M' greentint -9.927 1.282 -4.178 {"}'M' greentint -9.833 1.524 -4.167 {"}'M' greentint -9.658 1.716 -4.159 {"}'M' greentint -9.426 1.832 -4.154 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 253 A}'M' green -9.848 1.981 -5.127 {"}'M' green -10.01 1.781 -5.136 {"}'M' green -10.204 1.44 -4.959 {"}'M' green -9.426 2.2 -4.706 {"}'M' green -10.219 1.278 -4.747 {"}'M' green -9.354 1.928 -4.223 {"}'M' green -10.033 1.184 -4.255 {"}'M' green -9.464 1.693 -3.975 {"}'M' green -9.618 1.487 -3.984 {"}'M' green -9.807 1.313 -3.991 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 253 A}'M' greentint -9.652 1.968 -4.936 {"}'M' greentint -9.793 1.751 -4.946 {"}'M' greentint -9.98 1.571 -4.954 {"}'M' greentint -9.502 1.958 -4.717 {"}'M' greentint -9.625 1.737 -4.727 {"}'M' greentint -9.791 1.545 -4.735 {"}'M' greentint -9.991 1.39 -4.742 {"}'M' greentint -9.401 1.949 -4.476 {"}'M' greentint -9.517 1.721 -4.486 {"}'M' greentint -9.674 1.519 -4.495 {"}'M' greentint -9.866 1.351 -4.502 {"}'M' greentint -10.087 1.221 -4.508 {"}'M' greentint -9.469 1.697 -4.233 {"}'M' greentint -9.624 1.492 -4.242 {"}'M' greentint -9.814 1.319 -4.25 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 312 2gufA_341Y_314}P -7.641 5.192 -12.757 {"}-7.641 5.192 -12.757 { ca gly A 312 2gufA_341Y_314}-8.851 5.137 -11.983 { c gly A 312 2gufA_341Y_314}-8.53 4.692 -10.573 { o gly A 312 2gufA_341Y_314}-7.486 4.117 -10.329 { c gly A 312 2gufA_341Y_314}P -8.53 4.692 -10.573 { n ala A 313 2gufA_341Y_314}-9.402 5.003 -9.636 { ca ala A 313 2gufA_341Y_314}-9.237 4.456 -8.29 { c ala A 313 2gufA_341Y_314}-10.573 4.39 -7.649 { o ala A 313 2gufA_341Y_314}-11.507 5.058 -8.08 { c ala A 313 2gufA_341Y_314}P -10.573 4.39 -7.649 { n gly A 314 2gufA_341Y_314}-10.692 3.618 -6.58 { ca gly A 314 2gufA_341Y_314}-12.042 3.446 -6.016 { c gly A 314 2gufA_341Y_314}-11.851 2.891 -4.622 { o gly A 314 2gufA_341Y_314}-10.745 2.4 -4.282 { c gly A 314 2gufA_341Y_314}P -11.851 2.891 -4.622 { n val A 315 2gufA_341Y_314}-12.876 3.053 -3.799 { ca val A 315 2gufA_341Y_314}-12.846 2.459 -2.466 { c val A 315 2gufA_341Y_314}-14.232 1.884 -2.299 { o val A 315 2gufA_341Y_314}-15.146 2.422 -2.885 { c val A 315 2gufA_341Y_314}P -14.232 1.884 -2.299 { n asp A 316 2gufA_341Y_314}-14.377 0.763 -1.599 { ca asp A 316 2gufA_341Y_314}-15.696 0.24 -1.342 { c asp A 316 2gufA_341Y_314}-15.676 -0.445 -0.003 { o asp A 316 2gufA_341Y_314}-14.617 -0.811 0.525 { n gly A 339 2gufA_341Y_314}P -12.084 -2.14 0.719 {"}-12.084 -2.14 0.719 { ca gly A 339 2gufA_341Y_314}-10.932 -2.237 -0.183 { c gly A 339 2gufA_341Y_314}-10.711 -0.939 -0.907 { o gly A 339 2gufA_341Y_314}-11.612 -0.081 -0.986 { c gly A 339 2gufA_341Y_314}P -10.711 -0.939 -0.907 { n ile A 340 2gufA_341Y_314}-9.538 -0.819 -1.445 { ca ile A 340 2gufA_341Y_314}-9.145 0.345 -2.212 { c ile A 340 2gufA_341Y_314}-8.333 -0.149 -3.388 { o ile A 340 2gufA_341Y_314}-7.562 -1.054 -3.226 { c ile A 340 2gufA_341Y_314}P -8.333 -0.149 -3.388 { n tyr A 341 2gufA_341Y_314}-8.479 0.464 -4.57 { ca tyr A 341 2gufA_341Y_314}-7.871 -0.093 -5.753 { c tyr A 341 2gufA_341Y_314}-7.472 1.046 -6.684 { o tyr A 341 2gufA_341Y_314}-8.034 2.127 -6.625 { c tyr A 341 2gufA_341Y_314}P -7.472 1.046 -6.684 { n leu A 342 2gufA_341Y_314}-6.507 0.733 -7.539 { ca leu A 342 2gufA_341Y_314}-5.975 1.617 -8.522 { c leu A 342 2gufA_341Y_314}-6.046 0.876 -9.894 { o leu A 342 2gufA_341Y_314}-5.882 -0.354 -9.953 { c leu A 342 2gufA_341Y_314}P -6.046 0.876 -9.894 { n thr A 343 2gufA_341Y_314}-6.37 1.58 -10.974 { ca thr A 343 2gufA_341Y_314}-6.374 0.953 -12.311 { c thr A 343 2gufA_341Y_314}-5.647 1.922 -13.272 { o thr A 343 2gufA_341Y_314}-5.636 3.159 -13.071 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 312 2gufA_341Y_314}P -7.641 5.192 -12.757 { ca gly A 312 2gufA_341Y_314}P -8.851 5.137 -11.983 {"}P -8.851 5.137 -11.983 { n ala A 313 2gufA_341Y_314}P -9.402 5.003 -9.636 { ca ala A 313 2gufA_341Y_314}P -9.237 4.456 -8.29 { n gly A 314 2gufA_341Y_314}P -10.692 3.618 -6.58 { ca gly A 314 2gufA_341Y_314}P -12.042 3.446 -6.016 {"}P -12.042 3.446 -6.016 { n val A 315 2gufA_341Y_314}P -12.876 3.053 -3.799 { ca val A 315 2gufA_341Y_314}P -12.846 2.459 -2.466 { n asp A 316 2gufA_341Y_314}P -14.377 0.763 -1.599 { ca asp A 316 2gufA_341Y_314}P -15.696 0.24 -1.342 { n gly A 339 2gufA_341Y_314}P -12.084 -2.14 0.719 { ca gly A 339 2gufA_341Y_314}P -10.932 -2.237 -0.183 {"}P -10.932 -2.237 -0.183 { n ile A 340 2gufA_341Y_314}P -9.538 -0.819 -1.445 { ca ile A 340 2gufA_341Y_314}P -9.145 0.345 -2.212 { n tyr A 341 2gufA_341Y_314}P -8.479 0.464 -4.57 { ca tyr A 341 2gufA_341Y_314}P -7.871 -0.093 -5.753 { n leu A 342 2gufA_341Y_314}P -6.507 0.733 -7.539 { ca leu A 342 2gufA_341Y_314}P -5.975 1.617 -8.522 { n thr A 343 2gufA_341Y_314}P -6.37 1.58 -10.974 { ca thr A 343 2gufA_341Y_314}P -6.374 0.953 -12.311 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 312 2gufA_341Y_314}P -8.851 5.137 -11.983 {"}-8.851 5.137 -11.983 { ca ala A 313 2gufA_341Y_314}-9.237 4.456 -8.29 { ca gly A 314 2gufA_341Y_314}-12.042 3.446 -6.016 { ca val A 315 2gufA_341Y_314}-12.846 2.459 -2.466 { ca asp A 316 2gufA_341Y_314}-15.696 0.24 -1.342 { ca gly A 339 2gufA_341Y_314}P -10.932 -2.237 -0.183 {"}-10.932 -2.237 -0.183 { ca ile A 340 2gufA_341Y_314}-9.145 0.345 -2.212 { ca tyr A 341 2gufA_341Y_314}-7.871 -0.093 -5.753 { ca leu A 342 2gufA_341Y_314}-5.975 1.617 -8.522 { ca thr A 343 2gufA_341Y_314}-6.374 0.953 -12.311 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ala A 313 2gufA_341Y_314}P -9.237 4.456 -8.29 { ca val A 315 2gufA_341Y_314}P -12.846 2.459 -2.466 { ca asp A 316 2gufA_341Y_314}P -15.696 0.24 -1.342 { ca ile A 340 2gufA_341Y_314}P -9.145 0.345 -2.212 { ca tyr A 341 2gufA_341Y_314}P -7.871 -0.093 -5.753 { cb tyr A 341 2gufA_341Y_314}-8.734 -1.167 -6.458 { cg tyr A 341 2gufA_341Y_314}-9.934 -0.561 -7.084 { cd1 tyr A 341 2gufA_341Y_314}-9.868 -0.073 -8.376 { ce1 tyr A 341 2gufA_341Y_314}-10.894 0.57 -8.952 { cz tyr A 341 2gufA_341Y_314}-12.05 0.733 -8.214 { oh tyr A 341 2gufA_341Y_314}-13.05 1.426 -8.818 { cg tyr A 341 2gufA_341Y_314}P -9.934 -0.561 -7.084 { cd2 tyr A 341 2gufA_341Y_314}-11.086 -0.365 -6.352 { ce2 tyr A 341 2gufA_341Y_314}-12.162 0.307 -6.919 { cz tyr A 341 2gufA_341Y_314}ghost -12.05 0.733 -8.214 { ca leu A 342 2gufA_341Y_314}P -5.975 1.617 -8.522 { ca thr A 343 2gufA_341Y_314}P -6.374 0.953 -12.311 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 341 2gufA_341Y_314}P -8.734 -1.167 -6.458 {"}P -8.734 -1.167 -6.458 { cd1 tyr A 341 2gufA_341Y_314}P -9.868 -0.073 -8.376 { cd2 tyr A 341 2gufA_341Y_314}P -11.086 -0.365 -6.352 { ce1 tyr A 341 2gufA_341Y_314}P -10.894 0.57 -8.952 { ce2 tyr A 341 2gufA_341Y_314}P -12.162 0.307 -6.919 { oh tyr A 341 2gufA_341Y_314}P -13.05 1.426 -8.818 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 341 2gufA_341Y_314}P -7.871 -0.093 -5.753 { cb tyr A 341 2gufA_341Y_314}-8.734 -1.167 -6.458 { cg tyr A 341 2gufA_341Y_314}-9.934 -0.561 -7.084 { cd1 tyr A 341 2gufA_341Y_314}-9.868 -0.073 -8.376 { ce1 tyr A 341 2gufA_341Y_314}-10.894 0.57 -8.952 { cz tyr A 341 2gufA_341Y_314}-12.05 0.733 -8.214 { oh tyr A 341 2gufA_341Y_314}-13.05 1.426 -8.818 { cg tyr A 341 2gufA_341Y_314}P -9.934 -0.561 -7.084 { cd2 tyr A 341 2gufA_341Y_314}-11.086 -0.365 -6.352 { ce2 tyr A 341 2gufA_341Y_314}-12.162 0.307 -6.919 { cz tyr A 341 2gufA_341Y_314}ghost -12.05 0.733 -8.214 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 341 2gufA_341Y_314}P -8.734 -1.167 -6.458 {"}P -8.734 -1.167 -6.458 { cd1 tyr A 341 2gufA_341Y_314}P -9.868 -0.073 -8.376 { cd2 tyr A 341 2gufA_341Y_314}P -11.086 -0.365 -6.352 { ce1 tyr A 341 2gufA_341Y_314}P -10.894 0.57 -8.952 { ce2 tyr A 341 2gufA_341Y_314}P -12.162 0.307 -6.919 { oh tyr A 341 2gufA_341Y_314}P -13.05 1.426 -8.818 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ TYR 341 A}'P' green -12.502 2.36 -7.753 {"}'P' green -12.246 2.409 -7.751 {"}'P' green -13.014 2.017 -7.518 {"}'P' green -11.803 2.314 -7.505 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 341 A}'P' P -13.035 1.823 -6.984 {"}'P' -13.011 1.781 -6.982 {"}'P' P -12.8 1.936 -6.979 {"}'P' -12.752 1.813 -6.974 {"}'P' P -12.55 2.012 -6.975 {"}'P' -12.512 1.845 -6.97 {"}'P' P -12.292 2.051 -6.974 {"}'P' -12.281 1.896 -6.969 {"}'P' P -12.032 2.051 -6.974 {"}'P' -12.038 1.963 -6.971 {"}'P' P -13.042 1.807 -6.723 {"}'P' -13.008 1.75 -6.73 {"}'P' P -12.807 1.921 -6.718 {"}'P' -12.75 1.778 -6.736 {"}'P' P -12.301 2.039 -6.712 {"}'P' -12.286 1.856 -6.734 {"}'P' P -12.04 2.04 -6.712 {"}'P' -12.048 1.926 -6.726 {"}'P' P -13.089 1.721 -6.467 {"}'P' -13.082 1.71 -6.471 {"}'P' P -12.86 1.845 -6.462 {"}'P' -12.817 1.751 -6.49 {"}'P' P -12.614 1.934 -6.458 {"}'P' -12.572 1.782 -6.501 {"}'P' P -12.358 1.983 -6.456 {"}'P' -12.339 1.827 -6.499 {"}'P' P -12.909 1.725 -6.217 {"}'P' -12.904 1.716 -6.222 {"}'P' P -12.673 1.824 -6.213 {"}'P' -12.652 1.762 -6.242 {"}'P' P -12.425 1.885 -6.21 {"}'P' -12.412 1.806 -6.246 { CZ TYR 341 A}'P' P -12.797 2.151 -7.512 {"}'P' -12.778 2.115 -7.53 {"}'P' P -12.561 2.25 -7.508 {"}'P' -12.538 2.183 -7.539 {"}'P' P -12.313 2.311 -7.505 {"}'P' -12.303 2.25 -7.533 {"}'P' P -12.058 2.333 -7.504 {"}'P' -12.058 2.315 -7.512 {"}'P' P -12.951 1.912 -7.287 {"}'P' -12.937 1.893 -7.301 {"}'P' P -12.732 2.047 -7.281 {"}'P' -12.693 1.971 -7.335 {"}'P' P -12.494 2.143 -7.277 {"}'P' -12.46 2.035 -7.348 {"}'P' P -12.243 2.197 -7.274 {"}'P' -12.23 2.101 -7.336 {"}'P' P -11.986 2.208 -7.274 {"}'P' -11.988 2.165 -7.301 {"}'P' P -11.993 2.051 -7.064 {"}'P' -11.995 2.006 -7.103 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 TYR 341 A}'P' P -12.558 1.999 -6.714 {"}'P' -12.513 1.805 -6.738 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 341 A}'P' blue -12.868 2.638 -8.14 {"}'P' blue -12.622 2.576 -8.143 {"}'P' sky -13.37 2.458 -7.928 {"}'P' sky -13.374 2.266 -7.746 {"}'P' sky -13.419 2.012 -7.601 {"}'P' sky -13.31 1.802 -7.495 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 341 A}'P' sea -13.115 2.503 -7.926 {"}'P' sea -12.856 2.488 -7.927 {"}'P' sea -12.607 2.414 -7.93 {"}'P' green -13.123 2.32 -7.743 {"}'P' green -12.866 2.305 -7.744 {"}'P' green -13.178 2.099 -7.597 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 314 A}'P' blue -12.64 2.81 -7.802 {"}'P' sky -12.9 2.809 -7.773 {"}'P' sky -13.325 2.55 -7.558 {"}'P' sky -13.405 2.29 -7.384 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 314 A}'P' sea -12.77 2.584 -7.782 {"}'P' green -12.886 2.362 -7.705 {"}'P' sea -13.075 2.544 -7.698 {"}'P' green -13.005 2.168 -7.574 {"}'P' sea -13.199 2.33 -7.567 {"}'P' green -11.866 2.304 -7.383 {"}'P' green -13.012 1.956 -7.398 {"}'P' sea -13.233 2.095 -7.392 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 314 A}'P' P -12.379 2.37 -7.705 {"}'P' -12.379 2.371 -7.703 {"}'P' P -12.632 2.298 -7.708 {"}'P' -12.632 2.299 -7.706 {"}'P' P -12.081 2.33 -7.567 {"}'P' -12.087 2.335 -7.557 {"}'P' P -12.275 2.168 -7.574 {"}'P' -12.301 2.209 -7.509 {"}'P' P -12.513 2.081 -7.578 {"}'P' -12.524 2.136 -7.502 {"}'P' P -12.767 2.081 -7.578 {"}'P' -12.761 2.109 -7.539 {"}'P' P -12.035 2.106 -7.392 {"}'P' -12.073 2.147 -7.343 {"}'P' P -12.252 1.963 -7.398 {"}'P' -12.296 2.051 -7.313 {"}'P' P -12.502 1.887 -7.401 {"}'P' -12.517 1.987 -7.313 {"}'P' P -12.762 1.885 -7.401 {"}'P' -12.753 1.949 -7.345 {"}'P' P -11.851 2.083 -7.171 {"}'P' -11.862 2.092 -7.163 {"}'P' P -12.041 1.914 -7.178 {"}'P' -12.087 1.979 -7.136 {"}'P' P -12.266 1.796 -7.183 {"}'P' -12.307 1.901 -7.124 {"}'P' P -12.513 1.736 -7.186 {"}'P' -12.527 1.847 -7.126 {"}'P' P -12.767 1.736 -7.186 {"}'P' -12.758 1.813 -7.144 {"}'P' P -13.014 1.796 -7.183 {"}'P' -13.012 1.802 -7.18 {"}'P' P -11.922 1.884 -6.932 {"}'P' -11.97 1.942 -6.912 {"}'P' P -12.138 1.747 -6.938 {"}'P' -12.204 1.881 -6.897 {"}'P' P -12.378 1.661 -6.942 {"}'P' -12.421 1.839 -6.892 {"}'P' P -12.632 1.631 -6.943 {"}'P' -12.633 1.797 -6.897 {"}'P' P -12.886 1.658 -6.942 {"}'P' -12.863 1.76 -6.913 {"}'P' P -13.128 1.74 -6.938 {"}'P' -13.123 1.75 -6.935 {"}'P' P -12.092 1.726 -6.678 {"}'P' -12.164 1.863 -6.672 {"}'P' P -12.327 1.633 -6.682 {"}'P' -12.38 1.822 -6.674 {"}'P' P -12.577 1.592 -6.684 {"}'P' -12.587 1.781 -6.676 {"}'P' P -12.829 1.606 -6.683 {"}'P' -12.807 1.739 -6.678 {"}'P' P -13.073 1.673 -6.68 {"}'P' -13.056 1.715 -6.679 {"}'P' P -12.138 1.724 -6.418 {"}'P' -12.191 1.833 -6.44 {"}'P' P -12.378 1.638 -6.421 {"}'P' -12.413 1.788 -6.45 {"}'P' P -12.632 1.608 -6.423 {"}'P' -12.633 1.746 -6.448 {"}'P' P -12.886 1.635 -6.421 {"}'P' -12.869 1.711 -6.436 {"}'P' P -12.513 1.691 -6.171 {"}'P' -12.52 1.754 -6.199 {"}'P' P -12.767 1.691 -6.171 {"}'P' -12.764 1.721 -6.184 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 341 A}'M' sea -9.235 2.753 -6.981 {"}'M' green -9.404 2.389 -6.743 {"}'M' green -9.334 2.636 -6.732 {"}'M' green -9.064 3.071 -6.713 {"}'M' green -9.406 2.369 -6.485 {"}'M' green -8.881 3.228 -6.448 {"}'M' green -9.374 2.238 -6.237 {"}'M' green -8.916 3.127 -6.198 {"}'M' green -9.282 2.218 -5.996 {"}'M' sea -8.807 3.085 -5.959 {"}'M' green -9.084 2.472 -5.765 {"}'M' green -8.967 2.704 -5.755 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 341 A}'M' greentint -9.219 2.866 -6.722 {"}'M' greentint -9.337 2.617 -6.474 {"}'M' greentint -9.224 2.848 -6.464 {"}'M' greentint -9.07 3.054 -6.455 {"}'M' greentint -9.326 2.489 -6.226 {"}'M' greentint -9.231 2.727 -6.215 {"}'M' greentint -9.092 2.942 -6.206 {"}'M' greentint -9.232 2.467 -5.986 {"}'M' greentint -9.134 2.7 -5.975 {"}'M' greentint -8.99 2.909 -5.966 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 314 A}'M' green -9.29 2.914 -6.832 {"}'M' green -9.426 2.693 -6.841 {"}'M' green -9.403 2.489 -6.643 {"}'M' green -9.083 3.168 -6.613 {"}'M' green -9.466 2.314 -6.409 {"}'M' green -8.983 3.149 -6.373 {"}'M' green -9.406 2.299 -6.151 {"}'M' green -8.949 3.146 -6.114 {"}'M' green -9.016 2.877 -5.866 {"}'M' green -9.112 2.644 -5.876 {"}'M' green -9.266 2.444 -5.885 {"}'M' sea -8.983 3.127 -5.855 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 314 A}'M' greentint -9.119 2.913 -6.624 {"}'M' greentint -9.229 2.679 -6.635 {"}'M' greentint -9.016 2.9 -6.383 {"}'M' greentint -9.112 2.667 -6.394 {"}'M' greentint -9.266 2.467 -6.402 {"}'M' greentint -8.978 2.897 -6.125 {"}'M' greentint -9.069 2.664 -6.135 {"}'M' greentint -9.215 2.46 -6.144 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 341 A}'M' green -9.477 2.156 -4.936 {"}'M' green -9.689 1.408 -4.002 {"}'M' green -9.595 1.65 -3.991 {"}'M' green -9.42 1.842 -3.983 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 341 A}'M' greentint -9.927 1.57 -4.962 {"}'M' greentint -9.831 1.803 -4.952 {"}'M' greentint -9.677 2.003 -4.943 {"}'M' greentint -9.987 1.426 -4.709 {"}'M' greentint -9.927 1.669 -4.698 {"}'M' greentint -9.808 1.89 -4.689 {"}'M' greentint -9.638 2.074 -4.681 {"}'M' greentint -9.427 2.21 -4.675 {"}'M' greentint -9.96 1.298 -4.455 {"}'M' greentint -9.927 1.547 -4.445 {"}'M' greentint -9.831 1.78 -4.434 {"}'M' greentint -9.677 1.98 -4.426 {"}'M' greentint -9.477 2.133 -4.419 {"}'M' greentint -9.852 1.408 -4.209 {"}'M' greentint -9.778 1.655 -4.198 {"}'M' greentint -9.634 1.87 -4.189 {"}'M' greentint -9.434 2.032 -4.182 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 314 A}'M' green -9.743 1.943 -5.146 {"}'M' green -9.884 1.726 -5.156 {"}'M' green -9.517 2.175 -4.916 {"}'M' green -10.082 1.365 -4.952 {"}'M' green -9.373 2.147 -4.164 {"}'M' green -9.898 1.288 -4.201 {"}'M' green -9.495 1.883 -3.921 {"}'M' green -9.612 1.656 -3.931 {"}'M' green -9.77 1.455 -3.94 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 314 A}'M' greentint -9.593 1.933 -4.927 {"}'M' greentint -9.716 1.712 -4.937 {"}'M' greentint -9.882 1.52 -4.945 {"}'M' greentint -9.421 2.17 -4.676 {"}'M' greentint -9.492 1.924 -4.686 {"}'M' greentint -9.608 1.696 -4.696 {"}'M' greentint -9.765 1.494 -4.705 {"}'M' greentint -9.957 1.326 -4.712 {"}'M' greentint -9.375 2.15 -4.422 {"}'M' greentint -9.445 1.903 -4.433 {"}'M' greentint -9.56 1.672 -4.443 {"}'M' greentint -9.715 1.467 -4.452 {"}'M' greentint -9.905 1.294 -4.46 {"}'M' greentint -9.442 1.899 -4.175 {"}'M' greentint -9.555 1.668 -4.185 {"}'M' greentint -9.709 1.462 -4.194 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ser A 434 2gufA_436Y_463}P -12.123 -2.318 0.376 {"}-12.123 -2.318 0.376 { ca ser A 434 2gufA_436Y_463}-10.865 -2.314 -0.337 { c ser A 434 2gufA_436Y_463}-10.62 -0.984 -1.048 { o ser A 434 2gufA_436Y_463}-11.568 -0.245 -1.297 { c ser A 434 2gufA_436Y_463}P -10.62 -0.984 -1.048 { n gly A 435 2gufA_436Y_463}-9.354 -0.675 -1.35 { ca gly A 435 2gufA_436Y_463}-9.047 0.456 -2.2 { c gly A 435 2gufA_436Y_463}-8.412 -0.131 -3.395 { o gly A 435 2gufA_436Y_463}-7.661 -1.096 -3.249 { c gly A 435 2gufA_436Y_463}P -8.412 -0.131 -3.395 { n tyr A 436 2gufA_436Y_463}-8.734 0.377 -4.601 { ca tyr A 436 2gufA_436Y_463}-8.001 -0.075 -5.788 { c tyr A 436 2gufA_436Y_463}-7.521 1.087 -6.619 { o tyr A 436 2gufA_436Y_463}-8.048 2.233 -6.557 { c tyr A 436 2gufA_436Y_463}P -7.521 1.087 -6.619 { n arg A 437 2gufA_436Y_463}-6.541 0.779 -7.437 { ca arg A 437 2gufA_436Y_463}-6.185 1.689 -8.464 { c arg A 437 2gufA_436Y_463}-5.972 0.929 -9.749 { o arg A 437 2gufA_436Y_463}-5.321 -0.114 -9.753 { c arg A 437 2gufA_436Y_463}P -5.972 0.929 -9.749 { n asn A 438 2gufA_436Y_463}-6.487 1.482 -10.831 { ca asn A 438 2gufA_436Y_463}-6.361 0.85 -12.115 { c asn A 438 2gufA_436Y_463}-5.788 1.882 -13.047 { o asn A 438 2gufA_436Y_463}-6.426 2.898 -13.273 { n ile A 461 2gufA_436Y_463}P -8.1 5.095 -12.523 {"}-8.1 5.095 -12.523 { ca ile A 461 2gufA_436Y_463}-9.298 4.943 -11.731 { c ile A 461 2gufA_436Y_463}-8.837 4.62 -10.305 { o ile A 461 2gufA_436Y_463}-8.068 3.67 -10.096 { c ile A 461 2gufA_436Y_463}P -8.837 4.62 -10.305 { n lys A 462 2gufA_436Y_463}-9.29 5.413 -9.337 { ca lys A 462 2gufA_436Y_463}-9.037 5.113 -7.912 { c lys A 462 2gufA_436Y_463}-10.4 4.881 -7.329 { o lys A 462 2gufA_436Y_463}-11.348 5.557 -7.725 { c lys A 462 2gufA_436Y_463}P -10.4 4.881 -7.329 { n gly A 463 2gufA_436Y_463}-10.544 3.893 -6.459 { ca gly A 463 2gufA_436Y_463}-11.881 3.425 -6.092 { c gly A 463 2gufA_436Y_463}-11.823 2.871 -4.686 { o gly A 463 2gufA_436Y_463}-10.761 2.428 -4.213 { c gly A 463 2gufA_436Y_463}P -11.823 2.871 -4.686 { n val A 464 2gufA_436Y_463}-12.968 2.89 -4.024 { ca val A 464 2gufA_436Y_463}-13.12 2.192 -2.764 { c val A 464 2gufA_436Y_463}-14.352 1.378 -2.924 { o val A 464 2gufA_436Y_463}-15.358 1.855 -3.459 { c val A 464 2gufA_436Y_463}P -14.352 1.378 -2.924 { n glu A 465 2gufA_436Y_463}-14.277 0.143 -2.464 { ca glu A 465 2gufA_436Y_463}-15.44 -0.697 -2.394 { c glu A 465 2gufA_436Y_463}-15.662 -1.124 -0.943 { o glu A 465 2gufA_436Y_463}-14.826 -1.77 -0.345 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 434 2gufA_436Y_463}P -12.123 -2.318 0.376 { ca ser A 434 2gufA_436Y_463}P -10.865 -2.314 -0.337 { n gly A 435 2gufA_436Y_463}P -9.354 -0.675 -1.35 { ca gly A 435 2gufA_436Y_463}P -9.047 0.456 -2.2 {"}P -9.047 0.456 -2.2 { n tyr A 436 2gufA_436Y_463}P -8.734 0.377 -4.601 { ca tyr A 436 2gufA_436Y_463}P -8.001 -0.075 -5.788 { n arg A 437 2gufA_436Y_463}P -6.541 0.779 -7.437 { ca arg A 437 2gufA_436Y_463}P -6.185 1.689 -8.464 { n asn A 438 2gufA_436Y_463}P -6.487 1.482 -10.831 { ca asn A 438 2gufA_436Y_463}P -6.361 0.85 -12.115 { n ile A 461 2gufA_436Y_463}P -8.1 5.095 -12.523 { ca ile A 461 2gufA_436Y_463}P -9.298 4.943 -11.731 { n lys A 462 2gufA_436Y_463}P -9.29 5.413 -9.337 { ca lys A 462 2gufA_436Y_463}P -9.037 5.113 -7.912 { n gly A 463 2gufA_436Y_463}P -10.544 3.893 -6.459 { ca gly A 463 2gufA_436Y_463}P -11.881 3.425 -6.092 {"}P -11.881 3.425 -6.092 { n val A 464 2gufA_436Y_463}P -12.968 2.89 -4.024 { ca val A 464 2gufA_436Y_463}P -13.12 2.192 -2.764 { n glu A 465 2gufA_436Y_463}P -14.277 0.143 -2.464 { ca glu A 465 2gufA_436Y_463}P -15.44 -0.697 -2.394 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ser A 434 2gufA_436Y_463}P -10.865 -2.314 -0.337 {"}-10.865 -2.314 -0.337 { ca gly A 435 2gufA_436Y_463}-9.047 0.456 -2.2 { ca tyr A 436 2gufA_436Y_463}-8.001 -0.075 -5.788 { ca arg A 437 2gufA_436Y_463}-6.185 1.689 -8.464 { ca asn A 438 2gufA_436Y_463}-6.361 0.85 -12.115 { ca ile A 461 2gufA_436Y_463}P -9.298 4.943 -11.731 {"}-9.298 4.943 -11.731 { ca lys A 462 2gufA_436Y_463}-9.037 5.113 -7.912 { ca gly A 463 2gufA_436Y_463}-11.881 3.425 -6.092 { ca val A 464 2gufA_436Y_463}-13.12 2.192 -2.764 { ca glu A 465 2gufA_436Y_463}-15.44 -0.697 -2.394 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ser A 434 2gufA_436Y_463}P -10.865 -2.314 -0.337 { ca tyr A 436 2gufA_436Y_463}P -8.001 -0.075 -5.788 { cb tyr A 436 2gufA_436Y_463}-8.824 -0.988 -6.659 { cg tyr A 436 2gufA_436Y_463}-10.117 -0.399 -7.137 { cd1 tyr A 436 2gufA_436Y_463}-11.298 -0.563 -6.401 { ce1 tyr A 436 2gufA_436Y_463}-12.524 -0.056 -6.856 { cz tyr A 436 2gufA_436Y_463}-12.561 0.638 -8.024 { oh tyr A 436 2gufA_436Y_463}-13.761 1.197 -8.459 { cg tyr A 436 2gufA_436Y_463}P -10.117 -0.399 -7.137 { cd2 tyr A 436 2gufA_436Y_463}-10.187 0.294 -8.327 { ce2 tyr A 436 2gufA_436Y_463}-11.414 0.819 -8.777 { cz tyr A 436 2gufA_436Y_463}ghost -12.561 0.638 -8.024 { ca arg A 437 2gufA_436Y_463}P -6.185 1.689 -8.464 { ca asn A 438 2gufA_436Y_463}P -6.361 0.85 -12.115 { ca ile A 461 2gufA_436Y_463}P -9.298 4.943 -11.731 { ca lys A 462 2gufA_436Y_463}P -9.037 5.113 -7.912 { ca val A 464 2gufA_436Y_463}P -13.12 2.192 -2.764 { ca glu A 465 2gufA_436Y_463}P -15.44 -0.697 -2.394 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 436 2gufA_436Y_463}P -8.824 -0.988 -6.659 {"}P -8.824 -0.988 -6.659 { cd1 tyr A 436 2gufA_436Y_463}P -11.298 -0.563 -6.401 { cd2 tyr A 436 2gufA_436Y_463}P -10.187 0.294 -8.327 { ce1 tyr A 436 2gufA_436Y_463}P -12.524 -0.056 -6.856 { ce2 tyr A 436 2gufA_436Y_463}P -11.414 0.819 -8.777 { oh tyr A 436 2gufA_436Y_463}P -13.761 1.197 -8.459 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 436 2gufA_436Y_463}P -8.001 -0.075 -5.788 { cb tyr A 436 2gufA_436Y_463}-8.824 -0.988 -6.659 { cg tyr A 436 2gufA_436Y_463}-10.117 -0.399 -7.137 { cd1 tyr A 436 2gufA_436Y_463}-11.298 -0.563 -6.401 { ce1 tyr A 436 2gufA_436Y_463}-12.524 -0.056 -6.856 { cz tyr A 436 2gufA_436Y_463}-12.561 0.638 -8.024 { oh tyr A 436 2gufA_436Y_463}-13.761 1.197 -8.459 { cg tyr A 436 2gufA_436Y_463}P -10.117 -0.399 -7.137 { cd2 tyr A 436 2gufA_436Y_463}-10.187 0.294 -8.327 { ce2 tyr A 436 2gufA_436Y_463}-11.414 0.819 -8.777 { cz tyr A 436 2gufA_436Y_463}ghost -12.561 0.638 -8.024 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 436 2gufA_436Y_463}P -8.824 -0.988 -6.659 {"}P -8.824 -0.988 -6.659 { cd1 tyr A 436 2gufA_436Y_463}P -11.298 -0.563 -6.401 { cd2 tyr A 436 2gufA_436Y_463}P -10.187 0.294 -8.327 { ce1 tyr A 436 2gufA_436Y_463}P -12.524 -0.056 -6.856 { ce2 tyr A 436 2gufA_436Y_463}P -11.414 0.819 -8.777 { oh tyr A 436 2gufA_436Y_463}P -13.761 1.197 -8.459 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 436 A}'P' sea -11.659 1.452 -6.659 {"}'P' sea -12.976 1.571 -6.395 {"}'P' green -12.72 1.62 -6.393 {"}'P' green -11.947 1.531 -6.397 {"}'P' sea -12.532 1.544 -6.146 {"}'P' green -12.277 1.525 -6.147 {"}'P' sea -12.028 1.466 -6.15 { CE2 TYR 436 A}'P' sea -11.925 2.336 -8.071 {"}'P' sea -11.677 2.397 -8.068 {"}'P' green -11.607 2.283 -7.837 {"}'P' sea -11.35 2.294 -7.837 {"}'P' green -11.357 2.137 -7.627 {"}'P' green -11.35 1.95 -7.444 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 436 A}'P' P -12.144 1.64 -6.651 {"}'P' -12.16 1.569 -6.66 {"}'P' P -11.894 1.564 -6.654 {"}'P' -11.899 1.552 -6.656 {"}'P' P -12.459 1.63 -6.393 {"}'P' -12.46 1.607 -6.399 {"}'P' P -12.199 1.6 -6.394 {"}'P' -12.203 1.579 -6.4 { CE2 TYR 436 A}'P' P -11.617 2.123 -7.628 {"}'P' -11.616 2.118 -7.632 { CZ TYR 436 A}'P' P -12.7 2.37 -7.817 {"}'P' -12.699 2.367 -7.818 {"}'P' P -12.439 2.371 -7.817 {"}'P' -12.442 2.328 -7.823 {"}'P' P -12.181 2.334 -7.819 {"}'P' -12.191 2.287 -7.825 {"}'P' P -11.931 2.258 -7.822 {"}'P' -11.937 2.243 -7.824 {"}'P' P -13.013 2.265 -7.563 {"}'P' -13.013 2.264 -7.563 {"}'P' P -12.757 2.314 -7.561 {"}'P' -12.747 2.229 -7.584 {"}'P' P -12.496 2.324 -7.561 {"}'P' -12.501 2.183 -7.599 {"}'P' P -12.236 2.294 -7.562 {"}'P' -12.266 2.141 -7.605 {"}'P' P -11.984 2.225 -7.565 {"}'P' -12.027 2.108 -7.599 {"}'P' P -11.746 2.118 -7.57 {"}'P' -11.773 2.069 -7.585 {"}'P' P -13.072 2.155 -7.318 {"}'P' -13.064 2.131 -7.329 {"}'P' P -12.824 2.216 -7.315 {"}'P' -12.804 2.097 -7.368 {"}'P' P -11.829 2.064 -7.322 {"}'P' -11.889 1.946 -7.38 {"}'P' P -11.61 1.932 -7.328 {"}'P' -11.633 1.9 -7.345 {"}'P' P -13.005 2.048 -7.087 {"}'P' -12.987 1.991 -7.124 {"}'P' P -12.754 2.102 -7.084 {"}'P' -12.734 1.954 -7.179 {"}'P' P -11.766 1.889 -7.094 {"}'P' -11.819 1.806 -7.156 {"}'P' P -11.56 1.736 -7.1 {"}'P' -11.56 1.736 -7.1 {"}'P' P -13.016 1.879 -6.878 {"}'P' -13.009 1.858 -6.897 {"}'P' P -12.764 1.942 -6.875 {"}'P' -12.748 1.84 -6.965 {"}'P' P -12 1.837 -6.879 {"}'P' -12.052 1.727 -6.985 {"}'P' P -11.774 1.709 -6.885 {"}'P' -11.802 1.671 -6.925 {"}'P' P -12.754 1.756 -6.691 {"}'P' -12.747 1.716 -6.738 {"}'P' P -12.497 1.769 -6.691 {"}'P' -12.501 1.692 -6.782 {"}'P' P -12.243 1.728 -6.692 {"}'P' -12.264 1.653 -6.784 {"}'P' P -12.003 1.633 -6.697 {"}'P' -12.023 1.597 -6.743 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CZ TYR 436 A}'P' P -12.569 2.238 -7.314 {"}'P' -12.568 2.045 -7.4 {"}'P' P -12.314 2.219 -7.315 {"}'P' -12.349 1.999 -7.414 {"}'P' P -12.065 2.16 -7.318 {"}'P' -12.127 1.971 -7.406 {"}'P' P -12.497 2.113 -7.084 {"}'P' -12.506 1.902 -7.218 {"}'P' P -12.242 2.08 -7.085 {"}'P' -12.29 1.862 -7.227 {"}'P' P -11.996 2.005 -7.088 {"}'P' -12.065 1.839 -7.202 {"}'P' P -12.504 1.956 -6.874 {"}'P' -12.511 1.8 -7.011 {"}'P' P -12.246 1.921 -6.876 {"}'P' -12.286 1.761 -7.018 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 436 A}'P' sky -13.333 2.347 -7.784 {"}'P' sky -13.318 2.185 -7.571 { HH TYR 436 A}'P' blue -13.6 2.195 -7.383 {"}'P' blue -13.572 1.996 -7.15 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 463 A}'P' blue -13.246 2.421 -7.313 {"}'P' blue -13.332 2.401 -7.067 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 463 A}'P' sea -11.778 2.451 -7.859 {"}'P' sea -11.537 2.442 -7.72 {"}'P' green -11.663 2.222 -7.729 {"}'P' green -11.448 2.196 -7.545 {"}'P' sea -11.289 2.184 -7.324 {"}'P' green -11.433 1.975 -7.333 {"}'P' green -11.72 1.616 -6.58 {"}'P' sea -11.848 1.644 -6.331 {"}'P' green -12.095 1.583 -6.333 {"}'P' green -12.596 1.644 -6.331 {"}'P' sea -12.821 1.762 -6.326 {"}'P' sea -12.344 1.713 -6.106 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 463 A}'P' P -11.961 2.262 -7.867 {"}'P' -11.962 2.264 -7.862 {"}'P' P -12.214 2.19 -7.87 {"}'P' -12.214 2.22 -7.8 {"}'P' P -12.468 2.254 -7.867 {"}'P' -12.455 2.275 -7.811 {"}'P' P -11.857 2.06 -7.736 {"}'P' -11.879 2.095 -7.681 {"}'P' P -12.095 1.973 -7.74 {"}'P' -12.112 2.062 -7.616 {"}'P' P -12.349 1.973 -7.74 {"}'P' -12.329 2.08 -7.591 {"}'P' P -12.587 2.06 -7.736 {"}'P' -12.54 2.135 -7.616 {"}'P' P -12.781 2.222 -7.729 {"}'P' -12.751 2.245 -7.68 {"}'P' P -11.617 1.998 -7.554 {"}'P' -11.627 2.009 -7.541 {"}'P' P -11.834 1.855 -7.56 {"}'P' -11.877 1.943 -7.475 {"}'P' P -12.815 1.987 -7.554 {"}'P' -12.739 2.072 -7.457 {"}'P' P -12.987 2.182 -7.546 {"}'P' -12.961 2.198 -7.52 {"}'P' P -11.623 1.806 -7.34 {"}'P' -11.65 1.844 -7.316 {"}'P' P -11.848 1.688 -7.345 {"}'P' -11.898 1.816 -7.272 {"}'P' P -12.821 1.806 -7.34 {"}'P' -12.726 1.94 -7.254 {"}'P' P -13.011 1.975 -7.333 {"}'P' -12.951 2.027 -7.291 {"}'P' P -11.72 1.639 -7.1 {"}'P' -11.752 1.703 -7.08 {"}'P' P -11.96 1.553 -7.104 {"}'P' -11.996 1.703 -7.061 {"}'P' P -12.71 1.632 -7.1 {"}'P' -12.629 1.8 -7.05 {"}'P' P -12.927 1.766 -7.094 {"}'P' -12.854 1.858 -7.063 {"}'P' P -13.109 1.945 -7.086 {"}'P' -13.09 1.961 -7.08 {"}'P' P -11.909 1.525 -6.844 {"}'P' -11.927 1.59 -6.841 {"}'P' P -12.159 1.484 -6.846 {"}'P' -12.165 1.606 -6.841 {"}'P' P -12.411 1.498 -6.845 {"}'P' -12.388 1.637 -6.839 {"}'P' P -12.655 1.565 -6.842 {"}'P' -12.61 1.679 -6.837 {"}'P' P -12.879 1.684 -6.837 {"}'P' -12.84 1.74 -6.835 {"}'P' P -11.96 1.53 -6.583 {"}'P' -11.965 1.552 -6.587 {"}'P' P -12.214 1.5 -6.585 {"}'P' -12.214 1.569 -6.597 {"}'P' P -12.468 1.527 -6.583 {"}'P' -12.453 1.595 -6.596 {"}'P' P -12.71 1.609 -6.58 {"}'P' -12.699 1.632 -6.585 {"}'P' P -12.349 1.583 -6.333 {"}'P' -12.348 1.593 -6.338 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 463 A}'P' P -12.084 1.779 -7.563 {"}'P' -12.109 1.94 -7.422 {"}'P' P -12.344 1.777 -7.563 {"}'P' -12.318 1.965 -7.398 {"}'P' P -12.594 1.848 -7.56 {"}'P' -12.522 2.004 -7.412 {"}'P' P -12.095 1.628 -7.348 {"}'P' -12.12 1.831 -7.238 {"}'P' P -12.349 1.628 -7.348 {"}'P' -12.32 1.861 -7.222 {"}'P' P -12.596 1.688 -7.345 {"}'P' -12.516 1.894 -7.228 {"}'P' P -12.214 1.523 -7.105 {"}'P' -12.215 1.729 -7.048 {"}'P' P -12.468 1.55 -7.104 {"}'P' -12.42 1.762 -7.044 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 436 A}'M' green -9.348 2.742 -6.664 {"}'M' green -8.888 3.35 -6.638 {"}'M' green -9.42 2.475 -6.417 {"}'M' sea -9.388 2.344 -6.169 {"}'M' green -8.721 3.381 -6.123 {"}'M' green -9.246 2.573 -5.918 {"}'M' green -8.821 3.191 -5.891 {"}'M' green -9.098 2.578 -5.697 {"}'M' green -8.981 2.81 -5.687 {"}'M' green -8.815 3.008 -5.679 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 436 A}'M' greentint -9.233 2.972 -6.654 {"}'M' greentint -9.078 3.177 -6.645 {"}'M' greentint -9.351 2.723 -6.406 {"}'M' greentint -9.238 2.954 -6.396 {"}'M' greentint -9.084 3.16 -6.387 {"}'M' greentint -8.895 3.334 -6.38 {"}'M' greentint -9.34 2.595 -6.158 {"}'M' greentint -9.245 2.833 -6.147 {"}'M' greentint -9.106 3.048 -6.138 {"}'M' greentint -8.93 3.233 -6.13 {"}'M' greentint -9.148 2.806 -5.907 {"}'M' greentint -9.004 3.015 -5.898 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 463 A}'M' green -9.13 3.192 -6.728 {"}'M' green -9.266 2.971 -6.737 {"}'M' green -9.465 2.635 -6.545 {"}'M' green -8.923 3.446 -6.509 {"}'M' green -9.539 2.495 -6.309 {"}'M' green -8.823 3.427 -6.269 {"}'M' green -9.472 2.468 -6.051 {"}'M' green -8.789 3.424 -6.01 {"}'M' green -8.856 3.155 -5.762 {"}'M' green -9.106 2.722 -5.781 {"}'M' green -9.306 2.569 -5.788 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 463 A}'M' greentint -8.959 3.191 -6.52 {"}'M' greentint -9.069 2.957 -6.531 {"}'M' greentint -9.243 2.767 -6.539 {"}'M' greentint -8.856 3.178 -6.279 {"}'M' greentint -8.952 2.945 -6.29 {"}'M' greentint -9.106 2.745 -6.298 {"}'M' greentint -9.306 2.592 -6.305 {"}'M' greentint -8.818 3.175 -6.021 {"}'M' greentint -8.909 2.942 -6.031 {"}'M' greentint -9.055 2.738 -6.04 {"}'M' greentint -9.246 2.577 -6.047 {"}'M' greentint -8.952 2.922 -5.772 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 436 A}'M' greentint -10.286 1.55 -5.006 {"}'M' greentint -10.132 1.75 -4.997 {"}'M' greentint -9.932 1.903 -4.99 {"}'M' greentint -9.699 1.999 -4.986 {"}'M' greentint -10.382 1.416 -4.752 {"}'M' greentint -10.263 1.637 -4.743 {"}'M' greentint -10.093 1.821 -4.735 {"}'M' greentint -9.882 1.957 -4.729 {"}'M' greentint -9.644 2.036 -4.725 {"}'M' greentint -10.382 1.294 -4.499 {"}'M' greentint -10.286 1.527 -4.488 {"}'M' greentint -10.132 1.727 -4.48 {"}'M' greentint -9.932 1.88 -4.473 {"}'M' greentint -9.699 1.977 -4.469 {"}'M' greentint -10.307 1.155 -4.263 {"}'M' greentint -10.233 1.402 -4.252 {"}'M' greentint -10.089 1.617 -4.243 {"}'M' greentint -9.889 1.779 -4.236 {"}'M' greentint -9.65 1.876 -4.232 {"}'M' greentint -10.05 1.397 -4.045 {"}'M' greentint -9.875 1.589 -4.037 {"}'M' greentint -9.643 1.705 -4.032 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 463 A}'M' green -9.759 1.971 -5.077 {"}'M' green -10.311 1.443 -5.1 {"}'M' green -10.38 1.094 -4.401 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 463 A}'M' greentint -9.9 1.754 -5.087 {"}'M' greentint -10.087 1.574 -5.095 {"}'M' greentint -9.609 1.961 -4.858 {"}'M' greentint -9.732 1.74 -4.868 {"}'M' greentint -9.898 1.548 -4.876 {"}'M' greentint -10.098 1.393 -4.883 {"}'M' greentint -10.326 1.281 -4.888 {"}'M' greentint -9.508 1.952 -4.617 {"}'M' greentint -9.624 1.724 -4.627 {"}'M' greentint -9.781 1.522 -4.636 {"}'M' greentint -9.973 1.354 -4.643 {"}'M' greentint -10.194 1.224 -4.649 {"}'M' greentint -10.436 1.139 -4.653 {"}'M' greentint -9.461 1.931 -4.364 {"}'M' greentint -9.576 1.7 -4.374 {"}'M' greentint -9.731 1.495 -4.383 {"}'M' greentint -9.921 1.322 -4.391 {"}'M' greentint -10.14 1.187 -4.396 {"}'M' greentint -9.571 1.696 -4.116 {"}'M' greentint -9.725 1.49 -4.125 {"}'M' greentint -9.914 1.316 -4.132 {"}'M' greentint -10.132 1.179 -4.138 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n mse A 248 2gvkA_250F_259}P -12.051 -1.484 0.692 {"}-12.051 -1.484 0.692 { ca mse A 248 2gvkA_250F_259}-10.736 -1.858 0.184 { c mse A 248 2gvkA_250F_259}-10.398 -1.041 -1.046 { o mse A 248 2gvkA_250F_259}-11.171 -0.988 -1.995 { c mse A 248 2gvkA_250F_259}P -10.398 -1.041 -1.046 { n pro A 249 2gvkA_250F_259}-9.229 -0.415 -1.026 { ca pro A 249 2gvkA_250F_259}-8.756 0.32 -2.176 { c pro A 249 2gvkA_250F_259}-8.538 -0.569 -3.411 { o pro A 249 2gvkA_250F_259}-8.084 -1.694 -3.292 { c pro A 249 2gvkA_250F_259}P -8.538 -0.569 -3.411 { n phe A 250 2gvkA_250F_259}-8.868 -0.039 -4.581 { ca phe A 250 2gvkA_250F_259}-8.417 -0.615 -5.85 { c phe A 250 2gvkA_250F_259}-8.147 0.524 -6.824 { o phe A 250 2gvkA_250F_259}-8.704 1.63 -6.676 { c phe A 250 2gvkA_250F_259}P -8.147 0.524 -6.824 { n ala A 251 2gvkA_250F_259}-7.249 0.3 -7.773 { ca ala A 251 2gvkA_250F_259}-6.896 1.367 -8.702 { c ala A 251 2gvkA_250F_259}-6.166 0.924 -9.907 { o ala A 251 2gvkA_250F_259}-5.384 -0.041 -9.864 { c ala A 251 2gvkA_250F_259}P -6.166 0.924 -9.907 { n asn A 252 2gvkA_250F_259}-6.407 1.657 -10.994 { ca aasn A 252 2gvkA_250F_259}-5.553 1.637 -12.19 { n asn A 252 2gvkA_250F_259}P -6.407 1.657 -10.994 { ca basn A 252 2gvkA_250F_259}-5.537 1.628 -12.154 { ca aasn A 252 2gvkA_250F_259}P -5.553 1.637 -12.19 { c asn A 252 2gvkA_250F_259}-5.11 3.073 -12.426 { o asn A 252 2gvkA_250F_259}-5.776 3.819 -13.129 { ca basn A 252 2gvkA_250F_259}P -5.537 1.628 -12.154 { c asn A 252 2gvkA_250F_259}ghost -5.11 3.073 -12.426 { n glu A 257 2gvkA_250F_259}P -7.944 5.9 -12.559 {"}-7.944 5.9 -12.559 { ca aglu A 257 2gvkA_250F_259}-9.084 5.187 -11.942 { n glu A 257 2gvkA_250F_259}P -7.944 5.9 -12.559 { ca bglu A 257 2gvkA_250F_259}-9.08 5.219 -11.953 { ca aglu A 257 2gvkA_250F_259}P -9.084 5.187 -11.942 { c glu A 257 2gvkA_250F_259}-8.78 4.847 -10.505 { o glu A 257 2gvkA_250F_259}-7.861 4.077 -10.226 { ca bglu A 257 2gvkA_250F_259}P -9.08 5.219 -11.953 { c glu A 257 2gvkA_250F_259}ghost -8.78 4.847 -10.505 {"}P -8.78 4.847 -10.505 { n tyr A 258 2gvkA_250F_259}-9.57 5.413 -9.586 { ca tyr A 258 2gvkA_250F_259}-9.4 5.19 -8.155 { c tyr A 258 2gvkA_250F_259}-10.729 4.778 -7.577 { o tyr A 258 2gvkA_250F_259}-11.751 5.455 -7.81 { c tyr A 258 2gvkA_250F_259}P -10.729 4.778 -7.577 { n gly A 259 2gvkA_250F_259}-10.736 3.69 -6.823 { ca gly A 259 2gvkA_250F_259}-11.983 3.178 -6.262 { c gly A 259 2gvkA_250F_259}-11.894 2.563 -4.88 { o gly A 259 2gvkA_250F_259}-10.816 2.349 -4.332 { c gly A 259 2gvkA_250F_259}P -11.894 2.563 -4.88 { n thr A 260 2gvkA_250F_259}-13.073 2.355 -4.297 { ca thr A 260 2gvkA_250F_259}-13.237 1.663 -3.041 { c thr A 260 2gvkA_250F_259}-14.19 0.502 -3.281 { o thr A 260 2gvkA_250F_259}-15.275 0.681 -3.856 { c thr A 260 2gvkA_250F_259}P -14.19 0.502 -3.281 { n tyr A 261 2gvkA_250F_259}-13.781 -0.694 -2.882 { ca tyr A 261 2gvkA_250F_259}-14.656 -1.836 -2.926 { c tyr A 261 2gvkA_250F_259}-15.239 -2.032 -1.537 { o tyr A 261 2gvkA_250F_259}-14.539 -2.433 -0.607 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n mse A 248 2gvkA_250F_259}P -12.051 -1.484 0.692 { ca mse A 248 2gvkA_250F_259}P -10.736 -1.858 0.184 { ca pro A 249 2gvkA_250F_259}P -8.756 0.32 -2.176 { n phe A 250 2gvkA_250F_259}P -8.868 -0.039 -4.581 { ca phe A 250 2gvkA_250F_259}P -8.417 -0.615 -5.85 { n ala A 251 2gvkA_250F_259}P -7.249 0.3 -7.773 { ca ala A 251 2gvkA_250F_259}P -6.896 1.367 -8.702 { n asn A 252 2gvkA_250F_259}P -6.407 1.657 -10.994 { ca aasn A 252 2gvkA_250F_259}P -5.553 1.637 -12.19 { n glu A 257 2gvkA_250F_259}P -7.944 5.9 -12.559 { ca aglu A 257 2gvkA_250F_259}P -9.084 5.187 -11.942 { n tyr A 258 2gvkA_250F_259}P -9.57 5.413 -9.586 { ca tyr A 258 2gvkA_250F_259}P -9.4 5.19 -8.155 { n gly A 259 2gvkA_250F_259}P -10.736 3.69 -6.823 { ca gly A 259 2gvkA_250F_259}P -11.983 3.178 -6.262 {"}P -11.983 3.178 -6.262 { n thr A 260 2gvkA_250F_259}P -13.073 2.355 -4.297 { ca thr A 260 2gvkA_250F_259}P -13.237 1.663 -3.041 { n tyr A 261 2gvkA_250F_259}P -13.781 -0.694 -2.882 { ca tyr A 261 2gvkA_250F_259}P -14.656 -1.836 -2.926 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca mse A 248 2gvkA_250F_259}P -10.736 -1.858 0.184 {"}-10.736 -1.858 0.184 { ca pro A 249 2gvkA_250F_259}-8.756 0.32 -2.176 { ca phe A 250 2gvkA_250F_259}-8.417 -0.615 -5.85 { ca ala A 251 2gvkA_250F_259}-6.896 1.367 -8.702 { ca aasn A 252 2gvkA_250F_259}-5.553 1.637 -12.19 { ca ala A 251 2gvkA_250F_259}P -6.896 1.367 -8.702 { ca basn A 252 2gvkA_250F_259}-5.537 1.628 -12.154 { ca aglu A 257 2gvkA_250F_259}P -9.084 5.187 -11.942 {"}-9.084 5.187 -11.942 { ca bglu A 257 2gvkA_250F_259}P -9.08 5.219 -11.953 {"}-9.08 5.219 -11.953 { ca aglu A 257 2gvkA_250F_259}P -9.084 5.187 -11.942 { ca tyr A 258 2gvkA_250F_259}-9.4 5.19 -8.155 { ca bglu A 257 2gvkA_250F_259}P -9.08 5.219 -11.953 { ca tyr A 258 2gvkA_250F_259}-9.4 5.19 -8.155 { ca gly A 259 2gvkA_250F_259}-11.983 3.178 -6.262 { ca thr A 260 2gvkA_250F_259}-13.237 1.663 -3.041 { ca tyr A 261 2gvkA_250F_259}-14.656 -1.836 -2.926 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca mse A 248 2gvkA_250F_259}P -10.736 -1.858 0.184 { ca pro A 249 2gvkA_250F_259}P -8.756 0.32 -2.176 { n pro A 249 2gvkA_250F_259}P -9.229 -0.415 -1.026 { ca phe A 250 2gvkA_250F_259}P -8.417 -0.615 -5.85 { cb phe A 250 2gvkA_250F_259}-9.422 -1.608 -6.42 { cg phe A 250 2gvkA_250F_259}-10.715 -0.993 -6.865 { cd1 phe A 250 2gvkA_250F_259}-11.789 -0.898 -5.999 { ce1 phe A 250 2gvkA_250F_259}-13.029 -0.386 -6.442 { cz phe A 250 2gvkA_250F_259}-13.182 -0.005 -7.718 { cg phe A 250 2gvkA_250F_259}P -10.715 -0.993 -6.865 { cd2 phe A 250 2gvkA_250F_259}-10.892 -0.612 -8.17 { ce2 phe A 250 2gvkA_250F_259}-12.095 -0.091 -8.607 { cz phe A 250 2gvkA_250F_259}ghost -13.182 -0.005 -7.718 { ca ala A 251 2gvkA_250F_259}P -6.896 1.367 -8.702 { ca aasn A 252 2gvkA_250F_259}P -5.553 1.637 -12.19 { ca basn A 252 2gvkA_250F_259}P -5.537 1.628 -12.154 { ca aglu A 257 2gvkA_250F_259}P -9.084 5.187 -11.942 { ca bglu A 257 2gvkA_250F_259}P -9.08 5.219 -11.953 { ca tyr A 258 2gvkA_250F_259}P -9.4 5.19 -8.155 { ca thr A 260 2gvkA_250F_259}P -13.237 1.663 -3.041 { ca tyr A 261 2gvkA_250F_259}P -14.656 -1.836 -2.926 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 250 2gvkA_250F_259}P -9.422 -1.608 -6.42 {"}P -9.422 -1.608 -6.42 { cd1 phe A 250 2gvkA_250F_259}P -11.789 -0.898 -5.999 { cd2 phe A 250 2gvkA_250F_259}P -10.892 -0.612 -8.17 { ce1 phe A 250 2gvkA_250F_259}P -13.029 -0.386 -6.442 { ce2 phe A 250 2gvkA_250F_259}P -12.095 -0.091 -8.607 { cz phe A 250 2gvkA_250F_259}P -13.182 -0.005 -7.718 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 250 2gvkA_250F_259}P -8.417 -0.615 -5.85 { cb phe A 250 2gvkA_250F_259}-9.422 -1.608 -6.42 { cg phe A 250 2gvkA_250F_259}-10.715 -0.993 -6.865 { cd1 phe A 250 2gvkA_250F_259}-11.789 -0.898 -5.999 { ce1 phe A 250 2gvkA_250F_259}-13.029 -0.386 -6.442 { cz phe A 250 2gvkA_250F_259}-13.182 -0.005 -7.718 { cg phe A 250 2gvkA_250F_259}P -10.715 -0.993 -6.865 { cd2 phe A 250 2gvkA_250F_259}-10.892 -0.612 -8.17 { ce2 phe A 250 2gvkA_250F_259}-12.095 -0.091 -8.607 { cz phe A 250 2gvkA_250F_259}ghost -13.182 -0.005 -7.718 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 250 2gvkA_250F_259}P -9.422 -1.608 -6.42 {"}P -9.422 -1.608 -6.42 { cd1 phe A 250 2gvkA_250F_259}P -11.789 -0.898 -5.999 { cd2 phe A 250 2gvkA_250F_259}P -10.892 -0.612 -8.17 { ce1 phe A 250 2gvkA_250F_259}P -13.029 -0.386 -6.442 { ce2 phe A 250 2gvkA_250F_259}P -12.095 -0.091 -8.607 { cz phe A 250 2gvkA_250F_259}P -13.182 -0.005 -7.718 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 250 A}'P' sky -12.001 0.992 -6.772 {"}'P' sky -13.168 1.346 -6.235 { CE2 PHE 250 A}'P' sky -12.291 1.585 -8.144 {"}'P' sky -12.03 1.595 -8.144 {"}'P' sky -11.848 1.49 -7.898 {"}'P' sky -11.776 1.351 -7.668 {"}'P' sky -11.78 1.192 -7.459 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 250 A}'P' green -12.221 1.132 -6.765 {"}'P' sea -13.159 1.358 -6.497 {"}'P' green -12.899 1.358 -6.497 {"}'P' green -12.641 1.319 -6.498 {"}'P' green -12.391 1.243 -6.502 {"}'P' sea -12.156 1.13 -6.507 {"}'P' sea -12.907 1.347 -6.235 {"}'P' sea -12.649 1.31 -6.237 {"}'P' sea -12.399 1.234 -6.24 { CE2 PHE 250 A}'P' sea -12.103 1.509 -7.897 {"}'P' green -12.031 1.384 -7.667 { CZ PHE 250 A}'P' green -13.052 1.739 -7.773 {"}'P' green -12.309 1.511 -7.783 {"}'P' green -13.321 1.727 -7.511 {"}'P' green -12.1 1.358 -7.528 {"}'P' green -13.378 1.671 -7.255 {"}'P' green -13.118 1.47 -6.778 {"}'P' green -12.387 1.246 -6.788 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ PHE 250 A}'P' P -12.794 1.7 -7.774 {"}'P' -12.794 1.7 -7.774 {"}'P' P -12.544 1.624 -7.778 {"}'P' -12.546 1.619 -7.778 {"}'P' P -13.06 1.728 -7.511 {"}'P' -13.062 1.703 -7.514 {"}'P' P -12.802 1.691 -7.513 {"}'P' -12.819 1.614 -7.522 {"}'P' P -12.552 1.615 -7.516 {"}'P' -12.583 1.536 -7.526 {"}'P' P -12.317 1.503 -7.521 {"}'P' -12.338 1.466 -7.526 {"}'P' P -13.117 1.681 -7.255 {"}'P' -13.118 1.64 -7.266 {"}'P' P -12.857 1.651 -7.256 {"}'P' -12.877 1.549 -7.284 {"}'P' P -12.605 1.582 -7.259 {"}'P' -12.646 1.47 -7.292 {"}'P' P -12.367 1.475 -7.264 {"}'P' -12.407 1.403 -7.286 {"}'P' P -12.148 1.334 -7.27 {"}'P' -12.151 1.33 -7.271 {"}'P' P -13.19 1.595 -7.008 {"}'P' -13.19 1.588 -7.011 {"}'P' P -12.935 1.576 -7.009 {"}'P' -12.946 1.504 -7.041 {"}'P' P -12.686 1.517 -7.012 {"}'P' -12.717 1.424 -7.055 {"}'P' P -12.45 1.421 -7.016 {"}'P' -12.484 1.354 -7.049 {"}'P' P -12.231 1.289 -7.022 {"}'P' -12.237 1.28 -7.026 {"}'P' P -12.863 1.437 -6.779 {"}'P' -12.868 1.412 -6.796 {"}'P' P -12.617 1.362 -6.782 {"}'P' -12.628 1.334 -6.801 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 259 A}'P' sky -12.021 1.832 -7.893 {"}'P' sky -11.781 1.77 -7.711 {"}'P' sky -11.787 1.578 -7.497 {"}'P' sky -12.012 1.416 -6.488 {"}'P' sky -13.175 1.703 -6.475 {"}'P' sky -12.979 1.695 -6.254 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 259 A}'P' sea -12.259 1.745 -7.897 {"}'P' green -12.513 1.745 -7.897 {"}'P' sea -11.998 1.627 -7.717 {"}'P' green -12.248 1.551 -7.72 {"}'P' green -12.979 1.759 -7.711 {"}'P' green -13.175 1.747 -7.49 {"}'P' green -12.124 1.325 -7.261 {"}'P' green -13.273 1.717 -7.243 {"}'P' green -12.073 1.297 -7.001 {"}'P' green -13.235 1.619 -6.987 {"}'P' sea -12.124 1.302 -6.74 {"}'P' green -12.378 1.272 -6.742 {"}'P' green -13.091 1.516 -6.731 {"}'P' sea -12.259 1.355 -6.49 {"}'P' green -12.513 1.355 -6.49 {"}'P' green -12.76 1.416 -6.488 {"}'P' sea -12.985 1.534 -6.483 {"}'P' sea -12.508 1.485 -6.263 {"}'P' sea -12.758 1.556 -6.26 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 259 A}'P' P -12.508 1.549 -7.72 {"}'P' -12.505 1.57 -7.702 {"}'P' P -12.758 1.62 -7.717 {"}'P' -12.747 1.644 -7.694 {"}'P' P -12.259 1.4 -7.505 {"}'P' -12.262 1.424 -7.492 {"}'P' P -12.513 1.4 -7.505 {"}'P' -12.503 1.478 -7.462 {"}'P' P -12.76 1.46 -7.502 {"}'P' -12.726 1.547 -7.453 {"}'P' P -12.985 1.578 -7.497 {"}'P' -12.949 1.629 -7.465 {"}'P' P -12.378 1.295 -7.262 {"}'P' -12.378 1.37 -7.241 {"}'P' P -12.632 1.322 -7.261 {"}'P' -12.606 1.436 -7.229 {"}'P' P -12.874 1.404 -7.257 {"}'P' -12.824 1.507 -7.226 {"}'P' P -13.091 1.538 -7.251 {"}'P' -13.05 1.589 -7.234 {"}'P' P -12.323 1.256 -7.003 {"}'P' -12.324 1.288 -7.002 {"}'P' P -12.575 1.27 -7.002 {"}'P' -12.562 1.352 -6.999 {"}'P' P -12.819 1.337 -6.999 {"}'P' -12.785 1.423 -6.996 {"}'P' P -13.043 1.456 -6.994 {"}'P' -13.011 1.503 -6.992 {"}'P' P -12.632 1.299 -6.74 {"}'P' -12.629 1.313 -6.743 {"}'P' P -12.874 1.381 -6.737 {"}'P' -12.869 1.392 -6.739 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 250 A}'M' greentint -9.655 2.473 -7.264 {"}'M' greentint -9.471 2.647 -7.256 {"}'M' greentint -9.767 2.472 -7.023 {"}'M' greentint -9.592 2.658 -7.015 {"}'M' greentint -9.384 2.808 -7.008 {"}'M' greentint -9.152 2.915 -7.003 {"}'M' greentint -9.889 2.369 -6.773 {"}'M' greentint -9.734 2.574 -6.764 {"}'M' greentint -9.544 2.747 -6.757 {"}'M' greentint -9.325 2.882 -6.751 {"}'M' greentint -9.085 2.975 -6.747 {"}'M' greentint -9.894 2.351 -6.515 {"}'M' greentint -9.74 2.557 -6.506 {"}'M' greentint -9.551 2.731 -6.499 {"}'M' greentint -9.333 2.867 -6.493 {"}'M' greentint -9.093 2.962 -6.489 {"}'M' greentint -9.901 2.23 -6.266 {"}'M' greentint -9.762 2.445 -6.257 {"}'M' greentint -9.586 2.63 -6.249 {"}'M' greentint -9.377 2.778 -6.242 {"}'M' greentint -9.144 2.885 -6.238 {"}'M' greentint -9.66 2.412 -6.017 {"}'M' greentint -9.477 2.588 -6.01 {"}'M' greentint -9.263 2.723 -6.004 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 259 A}'M' greentint -9.201 2.701 -7.11 {"}'M' greentint -9.375 2.511 -7.118 {"}'M' greentint -9.597 2.379 -7.124 {"}'M' greentint -8.988 2.922 -6.858 {"}'M' greentint -9.084 2.689 -6.869 {"}'M' greentint -9.238 2.489 -6.877 {"}'M' greentint -9.438 2.336 -6.884 {"}'M' greentint -9.671 2.239 -6.888 {"}'M' greentint -9.921 2.206 -6.89 {"}'M' greentint -8.95 2.919 -6.6 {"}'M' greentint -9.041 2.686 -6.61 {"}'M' greentint -9.187 2.482 -6.619 {"}'M' greentint -9.378 2.321 -6.626 {"}'M' greentint -9.604 2.212 -6.63 {"}'M' greentint -9.85 2.163 -6.633 {"}'M' greentint -8.988 2.899 -6.341 {"}'M' greentint -9.084 2.666 -6.351 {"}'M' greentint -9.238 2.466 -6.36 {"}'M' greentint -9.438 2.313 -6.367 {"}'M' greentint -9.671 2.217 -6.371 {"}'M' greentint -9.921 2.184 -6.373 {"}'M' greentint -9.201 2.658 -6.11 {"}'M' greentint -9.375 2.467 -6.119 {"}'M' greentint -9.597 2.336 -6.125 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 250 A}'M' green -10.078 1.38 -5.153 {"}'M' green -9.878 1.543 -5.146 {"}'M' green -9.688 1.719 -4.897 {"}'M' green -10.371 1.014 -4.41 {"}'M' green -9.639 1.596 -4.143 {"}'M' green -9.864 1.309 -3.948 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 250 A}'M' greentint -10.275 1.27 -4.917 {"}'M' greentint -10.121 1.47 -4.908 {"}'M' greentint -9.921 1.623 -4.901 {"}'M' greentint -10.371 1.136 -4.663 {"}'M' greentint -10.252 1.357 -4.654 {"}'M' greentint -10.082 1.541 -4.646 {"}'M' greentint -9.871 1.677 -4.64 {"}'M' greentint -9.633 1.756 -4.636 {"}'M' greentint -10.275 1.247 -4.399 {"}'M' greentint -10.121 1.447 -4.391 {"}'M' greentint -9.921 1.6 -4.384 {"}'M' greentint -9.688 1.697 -4.38 {"}'M' greentint -10.222 1.122 -4.163 {"}'M' greentint -10.078 1.337 -4.154 {"}'M' greentint -9.878 1.499 -4.147 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 259 A}'M' green -10.381 1.202 -5.007 {"}'M' green -9.563 1.873 -4.736 {"}'M' green -10.491 1.06 -4.772 {"}'M' green -9.516 1.852 -4.483 {"}'M' green -10.435 1.015 -4.52 {"}'M' green -10.427 1.006 -4.261 {"}'M' green -9.683 1.605 -3.981 {"}'M' green -9.841 1.404 -3.99 {"}'M' green -10.035 1.236 -3.997 {"}'M' green -10.257 1.109 -4.003 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 259 A}'M' greentint -9.787 1.661 -4.987 {"}'M' greentint -9.953 1.469 -4.995 {"}'M' greentint -10.153 1.314 -5.002 {"}'M' greentint -9.679 1.645 -4.746 {"}'M' greentint -9.836 1.443 -4.755 {"}'M' greentint -10.028 1.275 -4.762 {"}'M' greentint -10.249 1.145 -4.768 {"}'M' greentint -9.631 1.621 -4.493 {"}'M' greentint -9.786 1.416 -4.502 {"}'M' greentint -9.976 1.243 -4.51 {"}'M' greentint -10.195 1.108 -4.515 {"}'M' greentint -9.626 1.617 -4.235 {"}'M' greentint -9.78 1.411 -4.244 {"}'M' greentint -9.969 1.237 -4.251 {"}'M' greentint -10.187 1.1 -4.257 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n met A 12 2h5oA_14F_33G}P -12.048 -2.022 0.918 {"}-12.048 -2.022 0.918 { ca met A 12 2h5oA_14F_33G}-10.857 -2.213 0.07 { c met A 12 2h5oA_14F_33G}-10.792 -1.093 -0.949 { o met A 12 2h5oA_14F_33G}-11.832 -0.673 -1.496 { c met A 12 2h5oA_14F_33G}P -10.792 -1.093 -0.949 { n arg A 13 2h5oA_14F_33G}-9.578 -0.648 -1.24 { ca arg A 13 2h5oA_14F_33G}-9.271 0.311 -2.278 { c arg A 13 2h5oA_14F_33G}-8.63 -0.384 -3.465 { o arg A 13 2h5oA_14F_33G}-8.062 -1.459 -3.36 { c arg A 13 2h5oA_14F_33G}P -8.63 -0.384 -3.465 { n phe A 14 2h5oA_14F_33G}-8.685 0.309 -4.595 { ca phe A 14 2h5oA_14F_33G}-7.993 -0.152 -5.806 { c phe A 14 2h5oA_14F_33G}-7.427 1.011 -6.573 { o phe A 14 2h5oA_14F_33G}-7.885 2.16 -6.472 { c phe A 14 2h5oA_14F_33G}P -7.427 1.011 -6.573 { n lys A 15 2h5oA_14F_33G}-6.477 0.692 -7.448 { ca lys A 15 2h5oA_14F_33G}-5.946 1.572 -8.461 { c lys A 15 2h5oA_14F_33G}-6.119 0.905 -9.831 { o lys A 15 2h5oA_14F_33G}-5.974 -0.301 -9.913 { c lys A 15 2h5oA_14F_33G}P -6.119 0.905 -9.831 { n val A 16 2h5oA_14F_33G}-6.368 1.709 -10.836 { ca val A 16 2h5oA_14F_33G}-6.547 1.195 -12.194 { c val A 16 2h5oA_14F_33G}-5.858 2.072 -13.198 { o val A 16 2h5oA_14F_33G}-5.826 3.303 -13.078 { n gly A 31 2h5oA_14F_33G}P -7.091 5.788 -12.52 {"}-7.091 5.788 -12.52 { ca gly A 31 2h5oA_14F_33G}-8.111 6.104 -11.505 { c gly A 31 2h5oA_14F_33G}-7.86 5.316 -10.231 { o gly A 31 2h5oA_14F_33G}-6.92 4.547 -10.057 { c gly A 31 2h5oA_14F_33G}P -7.86 5.316 -10.231 { n glu A 32 2h5oA_14F_33G}-8.777 5.556 -9.335 { ca glu A 32 2h5oA_14F_33G}-8.759 4.937 -8 { c glu A 32 2h5oA_14F_33G}-10.197 4.64 -7.615 { o glu A 32 2h5oA_14F_33G}-11.12 5.336 -8.047 { c glu A 32 2h5oA_14F_33G}P -10.197 4.64 -7.615 { n gly A 33 2h5oA_14F_33G}-10.4 3.677 -6.769 { ca gly A 33 2h5oA_14F_33G}-11.726 3.317 -6.327 { c gly A 33 2h5oA_14F_33G}-11.695 2.7 -4.961 { o gly A 33 2h5oA_14F_33G}-10.641 2.462 -4.353 { c gly A 33 2h5oA_14F_33G}P -11.695 2.7 -4.961 { n glu A 34 2h5oA_14F_33G}-12.884 2.461 -4.429 { ca glu A 34 2h5oA_14F_33G}-13.026 1.847 -3.101 { c glu A 34 2h5oA_14F_33G}-14.409 1.28 -3.017 { o glu A 34 2h5oA_14F_33G}-15.299 1.627 -3.742 { c glu A 34 2h5oA_14F_33G}P -14.409 1.28 -3.017 { n gly A 35 2h5oA_14F_33G}-14.604 0.429 -2.036 { ca gly A 35 2h5oA_14F_33G}-15.91 -0.177 -1.845 { c gly A 35 2h5oA_14F_33G}-15.855 -1.211 -0.761 { o gly A 35 2h5oA_14F_33G}-14.849 -1.35 -0.042 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n met A 12 2h5oA_14F_33G}P -12.048 -2.022 0.918 { ca met A 12 2h5oA_14F_33G}P -10.857 -2.213 0.07 { n arg A 13 2h5oA_14F_33G}P -9.578 -0.648 -1.24 { ca arg A 13 2h5oA_14F_33G}P -9.271 0.311 -2.278 { n phe A 14 2h5oA_14F_33G}P -8.685 0.309 -4.595 { ca phe A 14 2h5oA_14F_33G}P -7.993 -0.152 -5.806 { n lys A 15 2h5oA_14F_33G}P -6.477 0.692 -7.448 { ca lys A 15 2h5oA_14F_33G}P -5.946 1.572 -8.461 { n val A 16 2h5oA_14F_33G}P -6.368 1.709 -10.836 { ca val A 16 2h5oA_14F_33G}P -6.547 1.195 -12.194 { n gly A 31 2h5oA_14F_33G}P -7.091 5.788 -12.52 { ca gly A 31 2h5oA_14F_33G}P -8.111 6.104 -11.505 {"}P -8.111 6.104 -11.505 { n glu A 32 2h5oA_14F_33G}P -8.777 5.556 -9.335 { ca glu A 32 2h5oA_14F_33G}P -8.759 4.937 -8 { n gly A 33 2h5oA_14F_33G}P -10.4 3.677 -6.769 { ca gly A 33 2h5oA_14F_33G}P -11.726 3.317 -6.327 {"}P -11.726 3.317 -6.327 { n glu A 34 2h5oA_14F_33G}P -12.884 2.461 -4.429 { ca glu A 34 2h5oA_14F_33G}P -13.026 1.847 -3.101 { n gly A 35 2h5oA_14F_33G}P -14.604 0.429 -2.036 { ca gly A 35 2h5oA_14F_33G}P -15.91 -0.177 -1.845 {"}P -15.91 -0.177 -1.845 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca met A 12 2h5oA_14F_33G}P -10.857 -2.213 0.07 {"}-10.857 -2.213 0.07 { ca arg A 13 2h5oA_14F_33G}-9.271 0.311 -2.278 { ca phe A 14 2h5oA_14F_33G}-7.993 -0.152 -5.806 { ca lys A 15 2h5oA_14F_33G}-5.946 1.572 -8.461 { ca val A 16 2h5oA_14F_33G}-6.547 1.195 -12.194 { ca gly A 31 2h5oA_14F_33G}P -8.111 6.104 -11.505 {"}-8.111 6.104 -11.505 { ca glu A 32 2h5oA_14F_33G}-8.759 4.937 -8 { ca gly A 33 2h5oA_14F_33G}-11.726 3.317 -6.327 { ca glu A 34 2h5oA_14F_33G}-13.026 1.847 -3.101 { ca gly A 35 2h5oA_14F_33G}-15.91 -0.177 -1.845 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca met A 12 2h5oA_14F_33G}P -10.857 -2.213 0.07 { ca arg A 13 2h5oA_14F_33G}P -9.271 0.311 -2.278 { ca phe A 14 2h5oA_14F_33G}P -7.993 -0.152 -5.806 { cb phe A 14 2h5oA_14F_33G}-8.892 -1.001 -6.7 { cg phe A 14 2h5oA_14F_33G}-10.072 -0.344 -7.41 { cd1 phe A 14 2h5oA_14F_33G}-9.89 0.352 -8.601 { ce1 phe A 14 2h5oA_14F_33G}-10.944 0.864 -9.291 { cz phe A 14 2h5oA_14F_33G}-12.232 0.71 -8.84 { cg phe A 14 2h5oA_14F_33G}P -10.072 -0.344 -7.41 { cd2 phe A 14 2h5oA_14F_33G}-11.358 -0.463 -6.893 { ce2 phe A 14 2h5oA_14F_33G}-12.429 0.046 -7.62 { cz phe A 14 2h5oA_14F_33G}ghost -12.232 0.71 -8.84 { ca lys A 15 2h5oA_14F_33G}P -5.946 1.572 -8.461 { ca val A 16 2h5oA_14F_33G}P -6.547 1.195 -12.194 { ca glu A 32 2h5oA_14F_33G}P -8.759 4.937 -8 { ca glu A 34 2h5oA_14F_33G}P -13.026 1.847 -3.101 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 14 2h5oA_14F_33G}P -8.892 -1.001 -6.7 {"}P -8.892 -1.001 -6.7 { cd1 phe A 14 2h5oA_14F_33G}P -9.89 0.352 -8.601 { cd2 phe A 14 2h5oA_14F_33G}P -11.358 -0.463 -6.893 { ce1 phe A 14 2h5oA_14F_33G}P -10.944 0.864 -9.291 { ce2 phe A 14 2h5oA_14F_33G}P -12.429 0.046 -7.62 { cz phe A 14 2h5oA_14F_33G}P -12.232 0.71 -8.84 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 14 2h5oA_14F_33G}P -7.993 -0.152 -5.806 { cb phe A 14 2h5oA_14F_33G}-8.892 -1.001 -6.7 { cg phe A 14 2h5oA_14F_33G}-10.072 -0.344 -7.41 { cd1 phe A 14 2h5oA_14F_33G}-9.89 0.352 -8.601 { ce1 phe A 14 2h5oA_14F_33G}-10.944 0.864 -9.291 { cz phe A 14 2h5oA_14F_33G}-12.232 0.71 -8.84 { cg phe A 14 2h5oA_14F_33G}P -10.072 -0.344 -7.41 { cd2 phe A 14 2h5oA_14F_33G}-11.358 -0.463 -6.893 { ce2 phe A 14 2h5oA_14F_33G}-12.429 0.046 -7.62 { cz phe A 14 2h5oA_14F_33G}ghost -12.232 0.71 -8.84 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 14 2h5oA_14F_33G}P -8.892 -1.001 -6.7 {"}P -8.892 -1.001 -6.7 { cd1 phe A 14 2h5oA_14F_33G}P -9.89 0.352 -8.601 { cd2 phe A 14 2h5oA_14F_33G}P -11.358 -0.463 -6.893 { ce1 phe A 14 2h5oA_14F_33G}P -10.944 0.864 -9.291 { ce2 phe A 14 2h5oA_14F_33G}P -12.429 0.046 -7.62 { cz phe A 14 2h5oA_14F_33G}P -12.232 0.71 -8.84 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 14 A}'P' blue -11.388 2.274 -8.354 {"}'P' sky -11.399 2.105 -8.145 {"}'P' blue -11.147 2.168 -8.142 {"}'P' blue -11.137 1.982 -7.958 {"}'P' sky -11.207 1.75 -7.805 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 14 A}'P' green -11.564 1.554 -7.423 {"}'P' green -12.881 1.673 -7.159 {"}'P' green -11.614 1.526 -7.166 {"}'P' green -12.94 1.563 -6.914 {"}'P' green -11.697 1.472 -6.918 {"}'P' green -12.622 1.51 -6.68 {"}'P' green -12.11 1.488 -6.681 {"}'P' green -11.864 1.413 -6.684 { CZ PHE 14 A}'P' green -12.743 2.227 -8.134 {"}'P' green -12.495 2.288 -8.131 {"}'P' green -11.736 2.232 -8.134 {"}'P' green -12.914 2.024 -7.907 {"}'P' green -12.923 1.842 -7.698 {"}'P' green -11.445 1.781 -7.701 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 PHE 14 A}'P' P -12.825 1.738 -7.415 {"}'P' -12.823 1.729 -7.416 {"}'P' P -12.568 1.778 -7.413 {"}'P' -12.561 1.691 -7.424 {"}'P' P -12.307 1.779 -7.413 {"}'P' -12.316 1.656 -7.428 {"}'P' P -12.049 1.742 -7.415 {"}'P' -12.072 1.638 -7.428 {"}'P' P -11.799 1.666 -7.418 {"}'P' -11.814 1.627 -7.423 {"}'P' P -12.625 1.722 -7.157 {"}'P' -12.615 1.643 -7.179 {"}'P' P -12.364 1.732 -7.157 {"}'P' -12.369 1.606 -7.191 {"}'P' P -12.104 1.702 -7.158 {"}'P' -12.127 1.584 -7.191 {"}'P' P -11.852 1.633 -7.161 {"}'P' -11.874 1.573 -7.178 {"}'P' P -12.692 1.624 -6.911 {"}'P' -12.688 1.603 -6.921 {"}'P' P -12.437 1.646 -6.91 {"}'P' -12.437 1.572 -6.943 {"}'P' P -12.182 1.627 -6.911 {"}'P' -12.195 1.547 -6.947 {"}'P' P -11.933 1.568 -6.914 {"}'P' -11.946 1.529 -6.932 {"}'P' P -12.365 1.521 -6.68 {"}'P' -12.365 1.519 -6.681 { CZ PHE 14 A}'P' P -12.24 2.31 -8.13 {"}'P' -12.24 2.292 -8.138 {"}'P' P -11.985 2.291 -8.131 {"}'P' -11.986 2.283 -8.135 {"}'P' P -12.676 2.12 -7.903 {"}'P' -12.668 2.096 -7.918 {"}'P' P -12.425 2.174 -7.9 {"}'P' -12.415 2.101 -7.947 {"}'P' P -12.168 2.185 -7.9 {"}'P' -12.172 2.096 -7.956 {"}'P' P -11.913 2.152 -7.901 {"}'P' -11.927 2.086 -7.944 {"}'P' P -11.667 2.077 -7.904 {"}'P' -11.672 2.063 -7.914 {"}'P' P -12.687 1.951 -7.694 {"}'P' -12.673 1.913 -7.729 {"}'P' P -12.435 2.014 -7.691 {"}'P' -12.42 1.921 -7.773 {"}'P' P -12.175 2.028 -7.69 {"}'P' -12.18 1.916 -7.788 {"}'P' P -11.917 1.993 -7.692 {"}'P' -11.939 1.906 -7.769 {"}'P' P -11.671 1.909 -7.695 {"}'P' -11.685 1.88 -7.723 {"}'P' P -12.425 1.828 -7.507 {"}'P' -12.412 1.756 -7.592 {"}'P' P -12.168 1.841 -7.507 {"}'P' -12.173 1.754 -7.609 {"}'P' P -11.914 1.8 -7.508 {"}'P' -11.932 1.738 -7.583 {"}'P' P -11.674 1.705 -7.513 {"}'P' -11.679 1.696 -7.524 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 33 A}'P' blue -11.242 2.145 -7.57 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 33 A}'P' green -11.616 2.183 -7.975 {"}'P' green -12.734 2.183 -7.975 {"}'P' green -11.57 1.959 -7.8 {"}'P' green -11.576 1.767 -7.586 {"}'P' green -11.673 1.6 -7.346 {"}'P' green -12.88 1.727 -7.34 {"}'P' green -11.627 1.579 -7.086 {"}'P' green -12.048 1.544 -6.579 {"}'P' green -12.302 1.544 -6.579 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 33 A}'P' P -11.914 2.223 -8.113 {"}'P' -11.919 2.23 -8.094 {"}'P' P -12.167 2.151 -8.116 {"}'P' -12.167 2.178 -8.054 {"}'P' P -12.421 2.215 -8.113 {"}'P' -12.414 2.226 -8.082 {"}'P' P -11.81 2.021 -7.982 {"}'P' -11.83 2.053 -7.931 {"}'P' P -12.048 1.934 -7.986 {"}'P' -12.062 2.006 -7.887 {"}'P' P -12.302 1.934 -7.986 {"}'P' -12.288 2.008 -7.883 {"}'P' P -12.54 2.021 -7.982 {"}'P' -12.516 2.06 -7.921 {"}'P' P -11.787 1.816 -7.806 {"}'P' -11.816 1.875 -7.75 {"}'P' P -12.037 1.74 -7.809 {"}'P' -12.053 1.845 -7.717 {"}'P' P -12.297 1.738 -7.809 {"}'P' -12.282 1.847 -7.713 {"}'P' P -12.547 1.809 -7.806 {"}'P' -12.514 1.881 -7.738 {"}'P' P -12.768 1.948 -7.8 {"}'P' -12.756 1.961 -7.785 {"}'P' P -11.801 1.649 -7.591 {"}'P' -11.822 1.702 -7.561 {"}'P' P -12.048 1.589 -7.594 {"}'P' -12.06 1.682 -7.543 {"}'P' P -12.302 1.589 -7.594 {"}'P' -12.29 1.686 -7.541 {"}'P' P -12.549 1.649 -7.591 {"}'P' -12.524 1.713 -7.555 {"}'P' P -12.774 1.767 -7.586 {"}'P' -12.768 1.776 -7.581 {"}'P' P -11.913 1.514 -7.35 {"}'P' -11.932 1.594 -7.327 {"}'P' P -12.167 1.484 -7.351 {"}'P' -12.168 1.611 -7.316 {"}'P' P -12.421 1.511 -7.35 {"}'P' -12.393 1.633 -7.315 {"}'P' P -12.663 1.593 -7.346 {"}'P' -12.629 1.663 -7.325 {"}'P' P -11.862 1.486 -7.09 {"}'P' -11.877 1.541 -7.088 {"}'P' P -12.112 1.445 -7.092 {"}'P' -12.118 1.555 -7.087 {"}'P' P -12.364 1.459 -7.091 {"}'P' -12.345 1.577 -7.086 {"}'P' P -12.608 1.526 -7.088 {"}'P' -12.577 1.604 -7.085 {"}'P' P -12.832 1.645 -7.083 {"}'P' -12.827 1.651 -7.083 {"}'P' P -11.913 1.491 -6.829 {"}'P' -11.916 1.503 -6.831 {"}'P' P -12.167 1.461 -6.831 {"}'P' -12.167 1.514 -6.84 {"}'P' P -12.421 1.488 -6.829 {"}'P' -12.41 1.539 -6.839 {"}'P' P -12.663 1.57 -6.826 {"}'P' -12.659 1.577 -6.827 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 14 A}'M' green -8.981 2.795 -7.069 {"}'M' green -9.226 2.296 -6.85 {"}'M' green -8.773 3.188 -6.811 {"}'M' green -9.279 2.146 -6.343 {"}'M' green -9.225 2.271 -6.084 {"}'M' green -9.083 2.5 -5.833 {"}'M' green -8.841 2.942 -5.813 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 14 A}'M' greentint -9.179 2.548 -6.839 {"}'M' greentint -9.086 2.786 -6.828 {"}'M' greentint -8.948 3.002 -6.819 {"}'M' greentint -9.255 2.422 -6.59 {"}'M' greentint -9.185 2.669 -6.579 {"}'M' greentint -9.07 2.899 -6.569 {"}'M' greentint -8.915 3.104 -6.56 {"}'M' greentint -8.725 3.277 -6.553 {"}'M' greentint -9.257 2.402 -6.332 {"}'M' greentint -9.188 2.65 -6.321 {"}'M' greentint -9.075 2.881 -6.311 {"}'M' greentint -8.921 3.087 -6.302 {"}'M' greentint -8.732 3.261 -6.295 {"}'M' greentint -9.177 2.522 -6.073 {"}'M' greentint -9.082 2.76 -6.062 {"}'M' greentint -8.943 2.975 -6.053 {"}'M' greentint -8.767 3.16 -6.045 {"}'M' greentint -8.985 2.733 -5.822 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 33 A}'M' green -8.804 3.154 -6.867 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 33 A}'M' greentint -8.84 2.899 -6.878 {"}'M' greentint -8.95 2.665 -6.889 {"}'M' greentint -9.124 2.475 -6.897 {"}'M' greentint -8.737 2.886 -6.637 {"}'M' greentint -8.833 2.653 -6.648 {"}'M' greentint -8.987 2.453 -6.656 {"}'M' greentint -9.187 2.3 -6.663 {"}'M' greentint -8.704 3.135 -6.627 {"}'M' greentint -8.699 2.883 -6.379 {"}'M' greentint -8.79 2.65 -6.389 {"}'M' greentint -8.936 2.446 -6.398 {"}'M' greentint -9.127 2.285 -6.405 {"}'M' greentint -8.67 3.132 -6.368 {"}'M' greentint -8.737 2.863 -6.12 {"}'M' greentint -8.833 2.63 -6.13 {"}'M' greentint -8.987 2.43 -6.139 {"}'M' greentint -9.187 2.277 -6.146 {"}'M' greentint -8.704 3.113 -6.109 {"}'M' greentint -8.84 2.855 -5.879 {"}'M' greentint -8.95 2.622 -5.889 {"}'M' greentint -9.124 2.431 -5.898 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 14 A}'M' greentint -9.824 1.772 -5.177 {"}'M' greentint -10.117 1.429 -4.951 {"}'M' greentint -10.021 1.662 -4.941 {"}'M' greentint -9.867 1.862 -4.932 {"}'M' greentint -9.667 2.015 -4.925 {"}'M' greentint -9.434 2.111 -4.921 {"}'M' greentint -10.177 1.285 -4.698 {"}'M' greentint -10.117 1.528 -4.687 {"}'M' greentint -9.998 1.749 -4.678 {"}'M' greentint -9.828 1.933 -4.67 {"}'M' greentint -9.617 2.069 -4.664 {"}'M' greentint -9.379 2.148 -4.66 {"}'M' greentint -10.15 1.157 -4.444 {"}'M' greentint -10.117 1.406 -4.434 {"}'M' greentint -10.021 1.639 -4.423 {"}'M' greentint -9.867 1.839 -4.415 {"}'M' greentint -9.667 1.992 -4.408 {"}'M' greentint -9.434 2.089 -4.404 {"}'M' greentint -10.042 1.267 -4.198 {"}'M' greentint -9.968 1.514 -4.187 {"}'M' greentint -9.824 1.729 -4.178 {"}'M' greentint -9.624 1.891 -4.171 {"}'M' greentint -9.385 1.988 -4.167 {"}'M' greentint -9.785 1.509 -3.98 {"}'M' greentint -9.61 1.701 -3.972 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 33 A}'M' green -9.78 1.788 -5.227 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 33 A}'M' greentint -9.489 1.995 -4.998 {"}'M' greentint -9.612 1.774 -5.008 {"}'M' greentint -9.778 1.582 -5.016 {"}'M' greentint -9.978 1.427 -5.023 {"}'M' greentint -9.388 1.986 -4.757 {"}'M' greentint -9.504 1.758 -4.767 {"}'M' greentint -9.661 1.556 -4.776 {"}'M' greentint -9.853 1.388 -4.783 {"}'M' greentint -10.074 1.258 -4.789 {"}'M' greentint -9.341 1.965 -4.504 {"}'M' greentint -9.456 1.734 -4.514 {"}'M' greentint -9.611 1.529 -4.523 {"}'M' greentint -9.801 1.356 -4.531 {"}'M' greentint -10.02 1.221 -4.536 {"}'M' greentint -9.338 1.961 -4.246 {"}'M' greentint -9.451 1.73 -4.256 {"}'M' greentint -9.605 1.524 -4.265 {"}'M' greentint -9.794 1.35 -4.272 {"}'M' greentint -10.012 1.213 -4.278 {"}'M' greentint -9.508 1.718 -4.002 {"}'M' greentint -9.666 1.517 -4.011 {"}'M' greentint -9.86 1.349 -4.018 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n val A 91 2imjA_93Y_109G}P -12.241 -2.393 0.466 {"}-12.241 -2.393 0.466 { ca val A 91 2imjA_93Y_109G}-11.076 -2.419 -0.41 { c val A 91 2imjA_93Y_109G}-10.753 -1.102 -1.103 { o val A 91 2imjA_93Y_109G}-11.655 -0.378 -1.526 { c val A 91 2imjA_93Y_109G}P -10.753 -1.102 -1.103 { n arg A 92 2imjA_93Y_109G}-9.46 -0.802 -1.219 { ca arg A 92 2imjA_93Y_109G}-8.985 0.387 -1.923 { c arg A 92 2imjA_93Y_109G}-8.341 -0.157 -3.186 { o arg A 92 2imjA_93Y_109G}-7.791 -1.259 -3.178 { c arg A 92 2imjA_93Y_109G}P -8.341 -0.157 -3.186 { n tyr A 93 2imjA_93Y_109G}-8.407 0.592 -4.275 { ca tyr A 93 2imjA_93Y_109G}-7.791 0.119 -5.5 { c tyr A 93 2imjA_93Y_109G}-7.53 1.218 -6.501 { o tyr A 93 2imjA_93Y_109G}-7.971 2.357 -6.34 { c tyr A 93 2imjA_93Y_109G}P -7.53 1.218 -6.501 { n ala A 94 2imjA_93Y_109G}-6.78 0.861 -7.536 { ca ala A 94 2imjA_93Y_109G}-6.468 1.777 -8.612 { c ala A 94 2imjA_93Y_109G}-6.238 0.958 -9.865 { o ala A 94 2imjA_93Y_109G}-5.721 -0.16 -9.802 { c ala A 94 2imjA_93Y_109G}P -6.238 0.958 -9.865 { n tyr A 95 2imjA_93Y_109G}-6.668 1.493 -11 { ca tyr A 95 2imjA_93Y_109G}-6.445 0.824 -12.263 { c tyr A 95 2imjA_93Y_109G}-6.073 1.845 -13.321 { o tyr A 95 2imjA_93Y_109G}-6.596 2.961 -13.341 { n ser A 107 2imjA_93Y_109G}P -7.498 5.413 -12.441 {"}-7.498 5.413 -12.441 { ca ser A 107 2imjA_93Y_109G}-8.76 5.483 -11.733 { c ser A 107 2imjA_93Y_109G}-8.549 5.002 -10.308 { o ser A 107 2imjA_93Y_109G}-7.918 3.968 -10.073 { c ser A 107 2imjA_93Y_109G}P -8.549 5.002 -10.308 { n tyr A 108 2imjA_93Y_109G}-9.056 5.781 -9.36 { ca tyr A 108 2imjA_93Y_109G}-8.936 5.456 -7.949 { c tyr A 108 2imjA_93Y_109G}-10.291 5 -7.443 { o tyr A 108 2imjA_93Y_109G}-11.298 5.69 -7.63 { c tyr A 108 2imjA_93Y_109G}P -10.291 5 -7.443 { n gly A 109 2imjA_93Y_109G}-10.317 3.847 -6.791 { ca gly A 109 2imjA_93Y_109G}-11.576 3.342 -6.287 { c gly A 109 2imjA_93Y_109G}-11.576 2.852 -4.855 { o gly A 109 2imjA_93Y_109G}-10.533 2.55 -4.27 { c gly A 109 2imjA_93Y_109G}P -11.576 2.852 -4.855 { n asn A 110 2imjA_93Y_109G}-12.781 2.814 -4.295 { ca asn A 110 2imjA_93Y_109G}-13.048 2.315 -2.954 { c asn A 110 2imjA_93Y_109G}-14.261 1.424 -3.193 { o asn A 110 2imjA_93Y_109G}-15.297 1.904 -3.656 { c asn A 110 2imjA_93Y_109G}P -14.261 1.424 -3.193 { n glu A 111 2imjA_93Y_109G}-14.127 0.13 -2.921 { ca glu A 111 2imjA_93Y_109G}-15.241 -0.788 -3.103 { c glu A 111 2imjA_93Y_109G}-15.473 -1.548 -1.801 { o glu A 111 2imjA_93Y_109G}-14.526 -1.988 -1.14 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 91 2imjA_93Y_109G}P -12.241 -2.393 0.466 { ca val A 91 2imjA_93Y_109G}P -11.076 -2.419 -0.41 { n arg A 92 2imjA_93Y_109G}P -9.46 -0.802 -1.219 { ca arg A 92 2imjA_93Y_109G}P -8.985 0.387 -1.923 { n tyr A 93 2imjA_93Y_109G}P -8.407 0.592 -4.275 { ca tyr A 93 2imjA_93Y_109G}P -7.791 0.119 -5.5 { n ala A 94 2imjA_93Y_109G}P -6.78 0.861 -7.536 { ca ala A 94 2imjA_93Y_109G}P -6.468 1.777 -8.612 { n tyr A 95 2imjA_93Y_109G}P -6.668 1.493 -11 { ca tyr A 95 2imjA_93Y_109G}P -6.445 0.824 -12.263 { n ser A 107 2imjA_93Y_109G}P -7.498 5.413 -12.441 { ca ser A 107 2imjA_93Y_109G}P -8.76 5.483 -11.733 { n tyr A 108 2imjA_93Y_109G}P -9.056 5.781 -9.36 { ca tyr A 108 2imjA_93Y_109G}P -8.936 5.456 -7.949 { n gly A 109 2imjA_93Y_109G}P -10.317 3.847 -6.791 { ca gly A 109 2imjA_93Y_109G}P -11.576 3.342 -6.287 {"}P -11.576 3.342 -6.287 { n asn A 110 2imjA_93Y_109G}P -12.781 2.814 -4.295 { ca asn A 110 2imjA_93Y_109G}P -13.048 2.315 -2.954 { n glu A 111 2imjA_93Y_109G}P -14.127 0.13 -2.921 { ca glu A 111 2imjA_93Y_109G}P -15.241 -0.788 -3.103 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca val A 91 2imjA_93Y_109G}P -11.076 -2.419 -0.41 {"}-11.076 -2.419 -0.41 { ca arg A 92 2imjA_93Y_109G}-8.985 0.387 -1.923 { ca tyr A 93 2imjA_93Y_109G}-7.791 0.119 -5.5 { ca ala A 94 2imjA_93Y_109G}-6.468 1.777 -8.612 { ca tyr A 95 2imjA_93Y_109G}-6.445 0.824 -12.263 { ca ser A 107 2imjA_93Y_109G}P -8.76 5.483 -11.733 {"}-8.76 5.483 -11.733 { ca tyr A 108 2imjA_93Y_109G}-8.936 5.456 -7.949 { ca gly A 109 2imjA_93Y_109G}-11.576 3.342 -6.287 { ca asn A 110 2imjA_93Y_109G}-13.048 2.315 -2.954 { ca glu A 111 2imjA_93Y_109G}-15.241 -0.788 -3.103 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca val A 91 2imjA_93Y_109G}P -11.076 -2.419 -0.41 { ca arg A 92 2imjA_93Y_109G}P -8.985 0.387 -1.923 { ca tyr A 93 2imjA_93Y_109G}P -7.791 0.119 -5.5 { cb tyr A 93 2imjA_93Y_109G}-8.645 -0.968 -6.162 { cg tyr A 93 2imjA_93Y_109G}-10.015 -0.542 -6.667 { cd1 tyr A 93 2imjA_93Y_109G}-11.116 -0.482 -5.807 { ce1 tyr A 93 2imjA_93Y_109G}-12.406 -0.243 -6.297 { cz tyr A 93 2imjA_93Y_109G}-12.593 -0.058 -7.661 { oh tyr A 93 2imjA_93Y_109G}-13.87 0.059 -8.169 { cg tyr A 93 2imjA_93Y_109G}P -10.015 -0.542 -6.667 { cd2 tyr A 93 2imjA_93Y_109G}-10.235 -0.327 -8.028 { ce2 tyr A 93 2imjA_93Y_109G}-11.513 -0.086 -8.524 { cz tyr A 93 2imjA_93Y_109G}ghost -12.593 -0.058 -7.661 { ca ala A 94 2imjA_93Y_109G}P -6.468 1.777 -8.612 { ca tyr A 95 2imjA_93Y_109G}P -6.445 0.824 -12.263 { ca ser A 107 2imjA_93Y_109G}P -8.76 5.483 -11.733 { ca tyr A 108 2imjA_93Y_109G}P -8.936 5.456 -7.949 { ca asn A 110 2imjA_93Y_109G}P -13.048 2.315 -2.954 { ca glu A 111 2imjA_93Y_109G}P -15.241 -0.788 -3.103 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 93 2imjA_93Y_109G}P -8.645 -0.968 -6.162 {"}P -8.645 -0.968 -6.162 { cd1 tyr A 93 2imjA_93Y_109G}P -11.116 -0.482 -5.807 { cd2 tyr A 93 2imjA_93Y_109G}P -10.235 -0.327 -8.028 { ce1 tyr A 93 2imjA_93Y_109G}P -12.406 -0.243 -6.297 { ce2 tyr A 93 2imjA_93Y_109G}P -11.513 -0.086 -8.524 { oh tyr A 93 2imjA_93Y_109G}P -13.87 0.059 -8.169 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 93 2imjA_93Y_109G}P -7.791 0.119 -5.5 { cb tyr A 93 2imjA_93Y_109G}-8.645 -0.968 -6.162 { cg tyr A 93 2imjA_93Y_109G}-10.015 -0.542 -6.667 { cd1 tyr A 93 2imjA_93Y_109G}-11.116 -0.482 -5.807 { ce1 tyr A 93 2imjA_93Y_109G}-12.406 -0.243 -6.297 { cz tyr A 93 2imjA_93Y_109G}-12.593 -0.058 -7.661 { oh tyr A 93 2imjA_93Y_109G}-13.87 0.059 -8.169 { cg tyr A 93 2imjA_93Y_109G}P -10.015 -0.542 -6.667 { cd2 tyr A 93 2imjA_93Y_109G}-10.235 -0.327 -8.028 { ce2 tyr A 93 2imjA_93Y_109G}-11.513 -0.086 -8.524 { cz tyr A 93 2imjA_93Y_109G}ghost -12.593 -0.058 -7.661 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 93 2imjA_93Y_109G}P -8.645 -0.968 -6.162 {"}P -8.645 -0.968 -6.162 { cd1 tyr A 93 2imjA_93Y_109G}P -11.116 -0.482 -5.807 { cd2 tyr A 93 2imjA_93Y_109G}P -10.235 -0.327 -8.028 { ce1 tyr A 93 2imjA_93Y_109G}P -12.406 -0.243 -6.297 { ce2 tyr A 93 2imjA_93Y_109G}P -11.513 -0.086 -8.524 { oh tyr A 93 2imjA_93Y_109G}P -13.87 0.059 -8.169 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 93 A}'P' sky -11.448 1.102 -6.878 {"}'P' sky -12.866 1.415 -6.614 {"}'P' sky -11.378 1.135 -6.627 {"}'P' sky -12.794 1.462 -6.353 {"}'P' sky -12.545 1.489 -6.09 { CE2 TYR 93 A}'P' sky -11.965 1.541 -8.063 {"}'P' sky -11.709 1.59 -8.061 {"}'P' sky -11.448 1.6 -8.061 {"}'P' sky -11.266 1.495 -7.815 {"}'P' sky -11.194 1.356 -7.585 {"}'P' blue -11.198 1.197 -7.376 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 93 A}'P' green -11.666 1.235 -6.872 {"}'P' green -12.61 1.466 -6.612 {"}'P' green -12.349 1.478 -6.612 {"}'P' green -11.837 1.381 -6.616 {"}'P' green -11.598 1.275 -6.62 {"}'P' sea -12.536 1.501 -6.352 {"}'P' green -12.276 1.501 -6.352 {"}'P' green -12.018 1.462 -6.353 {"}'P' green -11.768 1.386 -6.357 {"}'P' sea -11.533 1.273 -6.362 {"}'P' sea -12.284 1.49 -6.09 {"}'P' sea -12.026 1.453 -6.092 { CE2 TYR 93 A}'P' sea -11.776 1.492 -7.815 {"}'P' sea -11.521 1.514 -7.814 {"}'P' sea -11.449 1.389 -7.584 { CZ TYR 93 A}'P' sea -12.723 1.686 -7.716 {"}'P' green -12.463 1.686 -7.716 {"}'P' green -12.205 1.647 -7.717 {"}'P' green -11.955 1.571 -7.721 {"}'P' sea -11.72 1.458 -7.726 {"}'P' green -12.732 1.674 -7.454 {"}'P' green -11.728 1.45 -7.464 {"}'P' green -12.789 1.618 -7.198 {"}'P' green -11.559 1.281 -7.213 {"}'P' sea -12.856 1.52 -6.952 {"}'P' green -12.601 1.542 -6.951 {"}'P' green -11.642 1.236 -6.965 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 TYR 93 A}'P' P -12.089 1.449 -6.613 {"}'P' -12.093 1.43 -6.609 { CZ TYR 93 A}'P' P -12.471 1.675 -7.454 {"}'P' -12.472 1.661 -7.456 {"}'P' P -12.213 1.638 -7.456 {"}'P' -12.224 1.588 -7.462 {"}'P' P -11.963 1.562 -7.459 {"}'P' -11.978 1.525 -7.464 {"}'P' P -12.528 1.628 -7.198 {"}'P' -12.529 1.603 -7.205 {"}'P' P -12.268 1.598 -7.199 {"}'P' -12.282 1.528 -7.218 {"}'P' P -12.016 1.529 -7.202 {"}'P' -12.04 1.465 -7.221 {"}'P' P -11.778 1.422 -7.207 {"}'P' -11.787 1.406 -7.211 {"}'P' P -12.346 1.523 -6.952 {"}'P' -12.352 1.486 -6.969 {"}'P' P -12.097 1.464 -6.955 {"}'P' -12.112 1.421 -6.975 {"}'P' P -11.861 1.368 -6.959 {"}'P' -11.865 1.359 -6.963 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 109 A}'P' blue -11.535 1.924 -7.877 {"}'P' sky -11.773 1.837 -7.881 {"}'P' blue -11.295 1.862 -7.695 {"}'P' sky -11.301 1.67 -7.481 {"}'P' sky -11.398 1.48 -6.721 {"}'P' sky -12.689 1.795 -6.459 {"}'P' sky -12.493 1.787 -6.238 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 109 A}'P' sea -11.512 1.719 -7.701 {"}'P' green -11.762 1.643 -7.704 {"}'P' green -12.022 1.641 -7.704 {"}'P' green -12.272 1.712 -7.701 {"}'P' sea -12.493 1.851 -7.695 {"}'P' sea -11.526 1.552 -7.486 {"}'P' green -11.773 1.492 -7.489 {"}'P' sea -12.689 1.839 -7.474 {"}'P' green -11.638 1.417 -7.245 {"}'P' sea -12.787 1.809 -7.227 {"}'P' green -11.587 1.389 -6.985 {"}'P' sea -12.749 1.711 -6.971 {"}'P' green -11.638 1.394 -6.724 {"}'P' green -12.388 1.473 -6.721 {"}'P' sea -12.605 1.608 -6.715 {"}'P' sea -11.526 1.508 -6.472 {"}'P' green -11.773 1.447 -6.474 {"}'P' green -12.274 1.508 -6.472 {"}'P' green -12.499 1.626 -6.467 {"}'P' sea -11.762 1.58 -6.247 {"}'P' green -12.022 1.577 -6.247 {"}'P' green -12.272 1.648 -6.244 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 109 A}'P' P -12.027 1.492 -7.489 {"}'P' -12.022 1.532 -7.467 {"}'P' P -12.274 1.552 -7.486 {"}'P' -12.258 1.593 -7.463 {"}'P' P -12.499 1.67 -7.481 {"}'P' -12.496 1.674 -7.479 {"}'P' P -11.892 1.387 -7.246 {"}'P' -11.892 1.431 -7.234 {"}'P' P -12.146 1.414 -7.245 {"}'P' -12.129 1.487 -7.224 {"}'P' P -12.388 1.496 -7.241 {"}'P' -12.361 1.551 -7.225 {"}'P' P -12.605 1.63 -7.235 {"}'P' -12.602 1.634 -7.234 {"}'P' P -11.837 1.348 -6.987 {"}'P' -11.837 1.356 -6.987 {"}'P' P -12.089 1.362 -6.986 {"}'P' -12.081 1.411 -6.984 {"}'P' P -12.333 1.429 -6.983 {"}'P' -12.315 1.473 -6.981 {"}'P' P -12.557 1.548 -6.978 {"}'P' -12.555 1.55 -6.978 {"}'P' P -11.892 1.364 -6.726 {"}'P' -11.892 1.369 -6.726 {"}'P' P -12.146 1.391 -6.724 {"}'P' -12.142 1.411 -6.728 {"}'P' P -12.027 1.447 -6.474 {"}'P' -12.027 1.451 -6.476 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 93 A}'M' greentint -9.024 2.768 -7.167 {"}'M' greentint -8.909 3 -7.156 {"}'M' greentint -8.744 3.2 -7.148 {"}'M' greentint -9.218 2.511 -6.958 {"}'M' greentint -9.167 2.759 -6.947 {"}'M' greentint -9.067 2.992 -6.937 {"}'M' greentint -8.922 3.2 -6.928 {"}'M' greentint -8.738 3.374 -6.92 {"}'M' greentint -9.312 2.493 -6.718 {"}'M' greentint -9.265 2.745 -6.707 {"}'M' greentint -9.172 2.983 -6.696 {"}'M' greentint -9.034 3.199 -6.687 {"}'M' greentint -8.859 3.385 -6.679 {"}'M' greentint -8.651 3.535 -6.672 {"}'M' greentint -9.365 2.363 -6.469 {"}'M' greentint -9.341 2.619 -6.458 {"}'M' greentint -9.271 2.866 -6.447 {"}'M' greentint -9.156 3.096 -6.437 {"}'M' greentint -9.001 3.301 -6.428 {"}'M' greentint -8.811 3.474 -6.421 {"}'M' greentint -9.343 2.599 -6.2 {"}'M' greentint -9.274 2.847 -6.189 {"}'M' greentint -9.161 3.078 -6.179 {"}'M' greentint -9.007 3.284 -6.17 {"}'M' greentint -8.818 3.458 -6.163 {"}'M' greentint -9.263 2.719 -5.941 {"}'M' greentint -9.168 2.957 -5.93 {"}'M' greentint -9.029 3.172 -5.921 {"}'M' greentint -8.853 3.357 -5.913 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 109 A}'M' greentint -8.69 3.048 -7.117 {"}'M' greentint -8.8 2.814 -7.128 {"}'M' greentint -8.974 2.624 -7.136 {"}'M' greentint -8.654 3.303 -7.106 {"}'M' greentint -8.587 3.035 -6.876 {"}'M' greentint -8.683 2.802 -6.887 {"}'M' greentint -8.837 2.602 -6.895 {"}'M' greentint -9.037 2.449 -6.902 {"}'M' greentint -8.554 3.284 -6.866 {"}'M' greentint -8.549 3.032 -6.618 {"}'M' greentint -8.64 2.799 -6.628 {"}'M' greentint -8.786 2.595 -6.637 {"}'M' greentint -8.977 2.434 -6.644 {"}'M' greentint -9.203 2.325 -6.648 {"}'M' greentint -8.553 3.529 -6.596 {"}'M' greentint -8.52 3.281 -6.607 {"}'M' greentint -8.587 3.012 -6.359 {"}'M' greentint -8.683 2.779 -6.369 {"}'M' greentint -8.837 2.579 -6.378 {"}'M' greentint -9.037 2.426 -6.385 {"}'M' greentint -9.27 2.33 -6.389 {"}'M' greentint -8.587 3.511 -6.338 {"}'M' greentint -8.554 3.262 -6.348 {"}'M' greentint -8.69 3.004 -6.118 {"}'M' greentint -8.8 2.771 -6.128 {"}'M' greentint -8.974 2.58 -6.137 {"}'M' greentint -9.196 2.449 -6.143 {"}'M' greentint -8.695 3.514 -6.096 {"}'M' greentint -8.654 3.259 -6.107 {"}'M' greentint -8.861 2.987 -5.912 {"}'M' greentint -8.997 2.766 -5.921 {"}'M' greentint -9.205 2.61 -5.928 {"}'M' greentint -8.813 3.242 -5.901 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 93 A}'M' greentint -9.714 1.626 -4.828 {"}'M' greentint -9.64 1.873 -4.817 {"}'M' greentint -9.496 2.087 -4.808 {"}'M' greentint -9.296 2.25 -4.801 {"}'M' greentint -9.822 1.494 -4.593 {"}'M' greentint -9.789 1.744 -4.582 {"}'M' greentint -9.693 1.977 -4.572 {"}'M' greentint -9.539 2.177 -4.563 {"}'M' greentint -9.339 2.33 -4.556 {"}'M' greentint -9.847 1.35 -4.34 {"}'M' greentint -9.849 1.6 -4.329 {"}'M' greentint -9.789 1.843 -4.318 {"}'M' greentint -9.67 2.064 -4.309 {"}'M' greentint -9.5 2.248 -4.301 {"}'M' greentint -9.289 2.384 -4.295 {"}'M' greentint -9.822 1.472 -4.075 {"}'M' greentint -9.789 1.721 -4.065 {"}'M' greentint -9.693 1.954 -4.054 {"}'M' greentint -9.539 2.154 -4.046 {"}'M' greentint -9.339 2.307 -4.039 {"}'M' greentint -9.714 1.582 -3.829 {"}'M' greentint -9.64 1.829 -3.818 {"}'M' greentint -9.496 2.044 -3.809 {"}'M' greentint -9.296 2.206 -3.802 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 109 A}'M' green -9.378 2.036 -3.668 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 109 A}'M' greentint -9.381 2.083 -4.915 {"}'M' greentint -9.504 1.862 -4.925 {"}'M' greentint -9.209 2.32 -4.664 {"}'M' greentint -9.28 2.074 -4.674 {"}'M' greentint -9.396 1.846 -4.684 {"}'M' greentint -9.553 1.644 -4.693 {"}'M' greentint -9.745 1.476 -4.7 {"}'M' greentint -9.163 2.3 -4.41 {"}'M' greentint -9.233 2.053 -4.421 {"}'M' greentint -9.348 1.822 -4.431 {"}'M' greentint -9.503 1.617 -4.44 {"}'M' greentint -9.693 1.444 -4.448 {"}'M' greentint -9.161 2.297 -4.152 {"}'M' greentint -9.23 2.049 -4.163 {"}'M' greentint -9.343 1.818 -4.173 {"}'M' greentint -9.497 1.612 -4.182 {"}'M' greentint -9.686 1.438 -4.189 {"}'M' greentint -9.211 2.279 -3.898 {"}'M' greentint -9.283 2.033 -3.909 {"}'M' greentint -9.4 1.806 -3.919 {"}'M' greentint -9.558 1.605 -3.928 {"}'M' greentint -9.752 1.437 -3.935 {"}'M' greentint -9.5 1.814 -3.677 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 65 2o1qA_67Y_93G}P -11.956 -2.006 0.773 {"}-11.956 -2.006 0.773 { ca gly A 65 2o1qA_67Y_93G}-10.927 -2.261 -0.209 { c gly A 65 2o1qA_67Y_93G}-10.714 -1.032 -1.037 { o gly A 65 2o1qA_67Y_93G}-11.621 -0.234 -1.2 { c gly A 65 2o1qA_67Y_93G}P -10.714 -1.032 -1.037 { n glu A 66 2o1qA_67Y_93G}-9.496 -0.864 -1.548 { ca glu A 66 2o1qA_67Y_93G}-9.146 0.317 -2.352 { c glu A 66 2o1qA_67Y_93G}-8.333 -0.131 -3.555 { o glu A 66 2o1qA_67Y_93G}-7.388 -0.953 -3.403 { c glu A 66 2o1qA_67Y_93G}P -8.333 -0.131 -3.555 { n tyr A 67 2o1qA_67Y_93G}-8.652 0.359 -4.735 { ca tyr A 67 2o1qA_67Y_93G}-7.961 -0.008 -5.925 { c tyr A 67 2o1qA_67Y_93G}-7.425 1.177 -6.698 { o tyr A 67 2o1qA_67Y_93G}-7.961 2.279 -6.587 { c tyr A 67 2o1qA_67Y_93G}P -7.425 1.177 -6.698 { n phe A 68 2o1qA_67Y_93G}-6.37 0.894 -7.449 { ca phe A 68 2o1qA_67Y_93G}-5.746 1.761 -8.414 { c phe A 68 2o1qA_67Y_93G}-5.695 0.996 -9.735 { o phe A 68 2o1qA_67Y_93G}-4.927 0.033 -9.91 { c phe A 68 2o1qA_67Y_93G}P -5.695 0.996 -9.735 { n leu A 69 2o1qA_67Y_93G}-6.613 1.337 -10.616 { ca leu A 69 2o1qA_67Y_93G}-6.657 0.809 -11.996 { c leu A 69 2o1qA_67Y_93G}-5.635 1.544 -12.803 { o leu A 69 2o1qA_67Y_93G}-5.795 2.754 -13.067 { n gly A 91 2o1qA_67Y_93G}P -7.556 5.279 -12.595 {"}-7.556 5.279 -12.595 { ca gly A 91 2o1qA_67Y_93G}-8.739 5.389 -11.726 { c gly A 91 2o1qA_67Y_93G}-8.485 4.845 -10.343 { o gly A 91 2o1qA_67Y_93G}-7.797 3.817 -10.198 { c gly A 91 2o1qA_67Y_93G}P -8.485 4.845 -10.343 { n tyr A 92 2o1qA_67Y_93G}-9.069 5.505 -9.338 { ca tyr A 92 2o1qA_67Y_93G}-9.01 5.085 -7.931 { c tyr A 92 2o1qA_67Y_93G}-10.438 4.774 -7.474 { o tyr A 92 2o1qA_67Y_93G}-11.362 5.5 -7.818 { c tyr A 92 2o1qA_67Y_93G}P -10.438 4.774 -7.474 { n gly A 93 2o1qA_67Y_93G}-10.629 3.718 -6.691 { ca gly A 93 2o1qA_67Y_93G}-11.904 3.411 -6.1 { c gly A 93 2o1qA_67Y_93G}-11.801 3.001 -4.658 { o gly A 93 2o1qA_67Y_93G}-10.837 2.315 -4.29 { c gly A 93 2o1qA_67Y_93G}P -11.801 3.001 -4.658 { n tyr A 94 2o1qA_67Y_93G}-12.805 3.359 -3.89 { ca tyr A 94 2o1qA_67Y_93G}-12.956 2.913 -2.505 { c tyr A 94 2o1qA_67Y_93G}-14.203 2.072 -2.505 { o tyr A 94 2o1qA_67Y_93G}-15.297 2.61 -2.793 { c tyr A 94 2o1qA_67Y_93G}P -14.203 2.072 -2.505 { n glu A 95 2o1qA_67Y_93G}-14.028 0.78 -2.228 { ca glu A 95 2o1qA_67Y_93G}-15.137 -0.171 -2.159 { c glu A 95 2o1qA_67Y_93G}-15.355 -0.465 -0.681 { o glu A 95 2o1qA_67Y_93G}-14.539 -1.105 -0.059 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 65 2o1qA_67Y_93G}P -11.956 -2.006 0.773 { ca gly A 65 2o1qA_67Y_93G}P -10.927 -2.261 -0.209 {"}P -10.927 -2.261 -0.209 { n glu A 66 2o1qA_67Y_93G}P -9.496 -0.864 -1.548 { ca glu A 66 2o1qA_67Y_93G}P -9.146 0.317 -2.352 { n tyr A 67 2o1qA_67Y_93G}P -8.652 0.359 -4.735 { ca tyr A 67 2o1qA_67Y_93G}P -7.961 -0.008 -5.925 { n phe A 68 2o1qA_67Y_93G}P -6.37 0.894 -7.449 { ca phe A 68 2o1qA_67Y_93G}P -5.746 1.761 -8.414 { n leu A 69 2o1qA_67Y_93G}P -6.613 1.337 -10.616 { ca leu A 69 2o1qA_67Y_93G}P -6.657 0.809 -11.996 { n gly A 91 2o1qA_67Y_93G}P -7.556 5.279 -12.595 { ca gly A 91 2o1qA_67Y_93G}P -8.739 5.389 -11.726 {"}P -8.739 5.389 -11.726 { n tyr A 92 2o1qA_67Y_93G}P -9.069 5.505 -9.338 { ca tyr A 92 2o1qA_67Y_93G}P -9.01 5.085 -7.931 { n gly A 93 2o1qA_67Y_93G}P -10.629 3.718 -6.691 { ca gly A 93 2o1qA_67Y_93G}P -11.904 3.411 -6.1 {"}P -11.904 3.411 -6.1 { n tyr A 94 2o1qA_67Y_93G}P -12.805 3.359 -3.89 { ca tyr A 94 2o1qA_67Y_93G}P -12.956 2.913 -2.505 { n glu A 95 2o1qA_67Y_93G}P -14.028 0.78 -2.228 { ca glu A 95 2o1qA_67Y_93G}P -15.137 -0.171 -2.159 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 65 2o1qA_67Y_93G}P -10.927 -2.261 -0.209 {"}-10.927 -2.261 -0.209 { ca glu A 66 2o1qA_67Y_93G}-9.146 0.317 -2.352 { ca tyr A 67 2o1qA_67Y_93G}-7.961 -0.008 -5.925 { ca phe A 68 2o1qA_67Y_93G}-5.746 1.761 -8.414 { ca leu A 69 2o1qA_67Y_93G}-6.657 0.809 -11.996 { ca gly A 91 2o1qA_67Y_93G}P -8.739 5.389 -11.726 {"}-8.739 5.389 -11.726 { ca tyr A 92 2o1qA_67Y_93G}-9.01 5.085 -7.931 { ca gly A 93 2o1qA_67Y_93G}-11.904 3.411 -6.1 { ca tyr A 94 2o1qA_67Y_93G}-12.956 2.913 -2.505 { ca glu A 95 2o1qA_67Y_93G}-15.137 -0.171 -2.159 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca glu A 66 2o1qA_67Y_93G}P -9.146 0.317 -2.352 { ca tyr A 67 2o1qA_67Y_93G}P -7.961 -0.008 -5.925 { cb tyr A 67 2o1qA_67Y_93G}-8.818 -0.874 -6.847 { cg tyr A 67 2o1qA_67Y_93G}-9.991 -0.169 -7.494 { cd1 tyr A 67 2o1qA_67Y_93G}-9.791 0.643 -8.599 { ce1 tyr A 67 2o1qA_67Y_93G}-10.865 1.316 -9.17 { cz tyr A 67 2o1qA_67Y_93G}-12.119 1.133 -8.726 { oh tyr A 67 2o1qA_67Y_93G}-13.188 1.831 -9.277 { cg tyr A 67 2o1qA_67Y_93G}P -9.991 -0.169 -7.494 { cd2 tyr A 67 2o1qA_67Y_93G}-11.287 -0.341 -7.013 { ce2 tyr A 67 2o1qA_67Y_93G}-12.361 0.314 -7.624 { cz tyr A 67 2o1qA_67Y_93G}ghost -12.119 1.133 -8.726 { ca phe A 68 2o1qA_67Y_93G}P -5.746 1.761 -8.414 { ca leu A 69 2o1qA_67Y_93G}P -6.657 0.809 -11.996 { ca tyr A 92 2o1qA_67Y_93G}P -9.01 5.085 -7.931 { ca tyr A 94 2o1qA_67Y_93G}P -12.956 2.913 -2.505 { ca glu A 95 2o1qA_67Y_93G}P -15.137 -0.171 -2.159 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 67 2o1qA_67Y_93G}P -8.818 -0.874 -6.847 {"}P -8.818 -0.874 -6.847 { cd1 tyr A 67 2o1qA_67Y_93G}P -9.791 0.643 -8.599 { cd2 tyr A 67 2o1qA_67Y_93G}P -11.287 -0.341 -7.013 { ce1 tyr A 67 2o1qA_67Y_93G}P -10.865 1.316 -9.17 { ce2 tyr A 67 2o1qA_67Y_93G}P -12.361 0.314 -7.624 { oh tyr A 67 2o1qA_67Y_93G}P -13.188 1.831 -9.277 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 67 2o1qA_67Y_93G}P -7.961 -0.008 -5.925 { cb tyr A 67 2o1qA_67Y_93G}-8.818 -0.874 -6.847 { cg tyr A 67 2o1qA_67Y_93G}-9.991 -0.169 -7.494 { cd1 tyr A 67 2o1qA_67Y_93G}-9.791 0.643 -8.599 { ce1 tyr A 67 2o1qA_67Y_93G}-10.865 1.316 -9.17 { cz tyr A 67 2o1qA_67Y_93G}-12.119 1.133 -8.726 { oh tyr A 67 2o1qA_67Y_93G}-13.188 1.831 -9.277 { cg tyr A 67 2o1qA_67Y_93G}P -9.991 -0.169 -7.494 { cd2 tyr A 67 2o1qA_67Y_93G}-11.287 -0.341 -7.013 { ce2 tyr A 67 2o1qA_67Y_93G}-12.361 0.314 -7.624 { cz tyr A 67 2o1qA_67Y_93G}ghost -12.119 1.133 -8.726 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 67 2o1qA_67Y_93G}P -8.818 -0.874 -6.847 {"}P -8.818 -0.874 -6.847 { cd1 tyr A 67 2o1qA_67Y_93G}P -9.791 0.643 -8.599 { cd2 tyr A 67 2o1qA_67Y_93G}P -11.287 -0.341 -7.013 { ce1 tyr A 67 2o1qA_67Y_93G}P -10.865 1.316 -9.17 { ce2 tyr A 67 2o1qA_67Y_93G}P -12.361 0.314 -7.624 { oh tyr A 67 2o1qA_67Y_93G}P -13.188 1.831 -9.277 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 67 A}'P' green -11.629 1.74 -6.922 {"}'P' green -13.043 1.628 -6.691 { CZ TYR 67 A}'P' green -12.801 2.447 -7.793 {"}'P' green -13.021 2.113 -7.591 {"}'P' green -11.561 2.128 -7.399 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 67 A}'P' P -13.059 1.852 -7.167 {"}'P' -13.05 1.833 -7.173 {"}'P' P -12.813 1.941 -7.163 {"}'P' -12.782 1.829 -7.195 {"}'P' P -12.557 1.99 -7.161 {"}'P' -12.536 1.814 -7.21 {"}'P' P -12.296 2 -7.161 {"}'P' -12.303 1.812 -7.212 {"}'P' P -12.036 1.97 -7.162 {"}'P' -12.064 1.829 -7.201 {"}'P' P -11.784 1.901 -7.165 {"}'P' -11.805 1.844 -7.181 {"}'P' P -13.108 1.732 -6.922 {"}'P' -13.106 1.728 -6.924 {"}'P' P -12.872 1.831 -6.918 {"}'P' -12.839 1.734 -6.963 {"}'P' P -12.624 1.892 -6.915 {"}'P' -12.595 1.72 -6.992 {"}'P' P -12.114 1.895 -6.915 {"}'P' -12.141 1.725 -6.991 {"}'P' P -11.865 1.836 -6.918 {"}'P' -11.896 1.743 -6.961 {"}'P' P -12.805 1.724 -6.687 {"}'P' -12.78 1.645 -6.739 {"}'P' P -12.554 1.778 -6.684 {"}'P' -12.535 1.641 -6.772 {"}'P' P -12.297 1.789 -6.684 {"}'P' -12.303 1.64 -6.778 {"}'P' P -12.042 1.756 -6.685 {"}'P' -12.065 1.65 -6.754 {"}'P' P -11.796 1.681 -6.688 {"}'P' -11.809 1.65 -6.709 {"}'P' P -12.816 1.555 -6.478 {"}'P' -12.814 1.548 -6.484 {"}'P' P -12.564 1.618 -6.475 {"}'P' -12.555 1.562 -6.524 {"}'P' P -12.304 1.632 -6.474 {"}'P' -12.307 1.565 -6.532 {"}'P' P -12.046 1.597 -6.476 {"}'P' -12.055 1.563 -6.506 { CZ TYR 67 A}'P' P -12.563 2.543 -7.789 {"}'P' -12.558 2.528 -7.799 {"}'P' P -12.312 2.597 -7.786 {"}'P' -12.309 2.574 -7.801 {"}'P' P -12.055 2.608 -7.786 {"}'P' -12.055 2.604 -7.788 {"}'P' P -12.81 2.265 -7.584 {"}'P' -12.789 2.23 -7.619 {"}'P' P -12.574 2.374 -7.58 {"}'P' -12.546 2.298 -7.65 {"}'P' P -12.322 2.437 -7.577 {"}'P' -12.308 2.345 -7.658 {"}'P' P -12.062 2.451 -7.576 {"}'P' -12.065 2.376 -7.642 {"}'P' P -11.804 2.416 -7.578 {"}'P' -11.812 2.387 -7.604 {"}'P' P -12.787 2.061 -7.401 {"}'P' -12.753 2.015 -7.468 {"}'P' P -12.56 2.182 -7.396 {"}'P' -12.52 2.088 -7.515 {"}'P' P -12.312 2.251 -7.393 {"}'P' -12.292 2.134 -7.532 {"}'P' P -12.055 2.264 -7.393 {"}'P' -12.06 2.164 -7.51 {"}'P' P -11.801 2.223 -7.394 {"}'P' -11.816 2.17 -7.458 {"}'P' P -12.127 2.055 -7.238 {"}'P' -12.126 1.965 -7.384 {"}'P' P -11.872 2.023 -7.24 {"}'P' -11.887 1.969 -7.33 {"}'P' P -11.633 1.927 -7.244 {"}'P' -11.635 1.924 -7.249 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CE2 TYR 67 A}'P' P -12.369 1.914 -6.914 {"}'P' -12.368 1.712 -7.003 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 67 A}'P' blue -13.06 2.504 -8.056 { HH TYR 67 A}'P' blue -13.127 2.542 -8.035 {"}'P' sky -13.315 2.515 -7.829 {"}'P' sky -13.179 2.294 -7.838 {"}'P' blue -13.595 2.469 -7.672 {"}'P' sky -13.409 2.289 -7.68 {"}'P' sky -13.338 2.041 -7.69 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 93 A}'P' sky -13.111 2.642 -7.586 {"}'P' sky -13.257 2.368 -7.412 {"}'P' blue -13.297 2.626 -7.401 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 93 A}'P' P -12.252 2.427 -7.821 {"}'P' -12.261 2.439 -7.74 {"}'P' P -12.512 2.427 -7.821 {"}'P' -12.505 2.436 -7.761 {"}'P' P -11.938 2.402 -7.736 {"}'P' -11.963 2.413 -7.677 {"}'P' P -12.121 2.213 -7.744 {"}'P' -12.153 2.261 -7.611 {"}'P' P -12.374 2.141 -7.747 {"}'P' -12.375 2.204 -7.599 {"}'P' P -12.628 2.205 -7.744 {"}'P' -12.606 2.24 -7.648 {"}'P' P -12.817 2.387 -7.737 {"}'P' -12.816 2.388 -7.734 {"}'P' P -11.697 2.393 -7.597 {"}'P' -11.698 2.393 -7.594 {"}'P' P -11.823 2.173 -7.606 {"}'P' -11.869 2.209 -7.529 {"}'P' P -12.017 2.011 -7.613 {"}'P' -12.069 2.094 -7.481 {"}'P' P -12.255 1.924 -7.617 {"}'P' -12.276 2.035 -7.463 {"}'P' P -12.509 1.924 -7.617 {"}'P' -12.491 2.021 -7.483 {"}'P' P -12.747 2.011 -7.613 {"}'P' -12.716 2.061 -7.533 {"}'P' P -12.941 2.173 -7.606 {"}'P' -12.937 2.176 -7.6 {"}'P' P -11.608 2.147 -7.422 {"}'P' -11.615 2.151 -7.415 {"}'P' P -11.777 1.949 -7.431 {"}'P' -11.824 1.999 -7.372 {"}'P' P -11.994 1.806 -7.437 {"}'P' -12.043 1.905 -7.342 {"}'P' P -12.244 1.73 -7.44 {"}'P' -12.263 1.852 -7.333 {"}'P' P -12.504 1.728 -7.44 {"}'P' -12.487 1.846 -7.336 {"}'P' P -12.754 1.799 -7.437 {"}'P' -12.722 1.869 -7.371 {"}'P' P -12.975 1.938 -7.431 {"}'P' -12.974 1.939 -7.43 {"}'P' P -11.783 1.757 -7.217 {"}'P' -11.82 1.809 -7.184 {"}'P' P -12.008 1.639 -7.222 {"}'P' -12.059 1.771 -7.147 {"}'P' P -12.756 1.639 -7.222 {"}'P' -12.706 1.767 -7.149 {"}'P' P -12.981 1.757 -7.217 {"}'P' -12.948 1.803 -7.187 {"}'P' P -11.664 1.727 -6.971 {"}'P' -11.678 1.744 -6.965 {"}'P' P -11.88 1.59 -6.977 {"}'P' -11.931 1.694 -6.945 {"}'P' P -12.12 1.504 -6.981 {"}'P' -12.162 1.68 -6.931 {"}'P' P -12.628 1.501 -6.981 {"}'P' -12.589 1.677 -6.931 {"}'P' P -12.87 1.583 -6.977 {"}'P' -12.82 1.687 -6.946 {"}'P' P -13.087 1.717 -6.971 {"}'P' -13.075 1.733 -6.966 {"}'P' P -11.834 1.569 -6.717 {"}'P' -11.861 1.62 -6.715 {"}'P' P -12.069 1.476 -6.721 {"}'P' -12.102 1.596 -6.716 {"}'P' P -12.319 1.435 -6.723 {"}'P' -12.327 1.59 -6.716 {"}'P' P -12.571 1.449 -6.722 {"}'P' -12.548 1.589 -6.716 {"}'P' P -12.815 1.516 -6.719 {"}'P' -12.782 1.599 -6.716 {"}'P' P -13.039 1.635 -6.714 {"}'P' -13.036 1.638 -6.714 {"}'P' P -12.12 1.481 -6.46 {"}'P' -12.13 1.522 -6.468 {"}'P' P -12.374 1.451 -6.462 {"}'P' -12.374 1.512 -6.473 {"}'P' P -12.628 1.478 -6.46 {"}'P' -12.619 1.518 -6.468 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 93 A}'P' P -12.255 1.579 -7.225 {"}'P' -12.278 1.762 -7.126 {"}'P' P -12.509 1.579 -7.225 {"}'P' -12.486 1.76 -7.127 {"}'P' P -12.374 1.474 -6.982 {"}'P' -12.375 1.678 -6.926 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 67 A}'M' green -9.302 2.415 -6.965 {"}'M' green -9.024 3.121 -6.934 {"}'M' green -9.209 2.37 -5.958 {"}'M' green -9.159 2.619 -5.948 {"}'M' green -9.061 2.852 -5.937 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 67 A}'M' greentint -9.255 2.667 -6.954 {"}'M' greentint -9.162 2.905 -6.943 {"}'M' greentint -9.355 2.285 -6.716 {"}'M' greentint -9.331 2.541 -6.705 {"}'M' greentint -9.261 2.788 -6.694 {"}'M' greentint -9.146 3.018 -6.684 {"}'M' greentint -8.991 3.223 -6.675 {"}'M' greentint -9.355 2.265 -6.458 {"}'M' greentint -9.333 2.521 -6.447 {"}'M' greentint -9.264 2.769 -6.436 {"}'M' greentint -9.151 3 -6.426 {"}'M' greentint -8.997 3.206 -6.417 {"}'M' greentint -9.301 2.39 -6.199 {"}'M' greentint -9.253 2.641 -6.188 {"}'M' greentint -9.158 2.879 -6.177 {"}'M' greentint -9.019 3.094 -6.168 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 93 A}'M' green -9.36 2.418 -6.988 {"}'M' green -9.04 3.097 -6.958 {"}'M' green -9.423 2.243 -6.754 {"}'M' green -8.973 3.328 -6.707 {"}'M' green -9.363 2.228 -6.496 {"}'M' green -8.939 3.323 -6.448 {"}'M' green -9.04 3.053 -5.959 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 93 A}'M' greentint -9.076 2.842 -6.969 {"}'M' greentint -9.186 2.608 -6.98 {"}'M' greentint -8.973 2.829 -6.728 {"}'M' greentint -9.069 2.596 -6.739 {"}'M' greentint -9.223 2.396 -6.747 {"}'M' greentint -8.94 3.078 -6.718 {"}'M' greentint -8.935 2.826 -6.47 {"}'M' greentint -9.026 2.593 -6.48 {"}'M' greentint -9.172 2.389 -6.489 {"}'M' greentint -8.906 3.075 -6.459 {"}'M' greentint -8.973 2.806 -6.211 {"}'M' greentint -9.069 2.573 -6.221 {"}'M' greentint -9.223 2.373 -6.23 {"}'M' greentint -8.94 3.056 -6.2 {"}'M' greentint -9.076 2.798 -5.97 {"}'M' greentint -9.186 2.565 -5.98 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 67 A}'M' green -9.587 1.996 -4.835 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 67 A}'M' greentint -10.229 1.51 -5.116 {"}'M' greentint -10.075 1.71 -5.107 {"}'M' greentint -9.875 1.863 -5.1 {"}'M' greentint -10.385 1.133 -4.873 {"}'M' greentint -10.325 1.376 -4.862 {"}'M' greentint -10.206 1.597 -4.853 {"}'M' greentint -10.036 1.781 -4.845 {"}'M' greentint -9.825 1.917 -4.839 {"}'M' greentint -10.325 1.254 -4.609 {"}'M' greentint -10.229 1.487 -4.598 {"}'M' greentint -10.075 1.687 -4.59 {"}'M' greentint -9.875 1.84 -4.583 {"}'M' greentint -9.642 1.937 -4.579 {"}'M' greentint -10.25 1.115 -4.373 {"}'M' greentint -10.176 1.362 -4.362 {"}'M' greentint -10.032 1.577 -4.353 {"}'M' greentint -9.832 1.739 -4.346 {"}'M' greentint -9.593 1.836 -4.342 {"}'M' greentint -9.993 1.357 -4.155 {"}'M' greentint -9.818 1.549 -4.147 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 93 A}'M' green -10.402 1.168 -4.965 {"}'M' green -10.208 1.066 -4.215 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 93 A}'M' greentint -9.835 1.858 -5.154 {"}'M' greentint -9.976 1.641 -5.164 {"}'M' greentint -10.163 1.461 -5.172 {"}'M' greentint -9.685 1.848 -4.935 {"}'M' greentint -9.808 1.627 -4.945 {"}'M' greentint -9.974 1.435 -4.953 {"}'M' greentint -10.174 1.28 -4.96 {"}'M' greentint -9.584 1.839 -4.694 {"}'M' greentint -9.7 1.611 -4.704 {"}'M' greentint -9.857 1.409 -4.713 {"}'M' greentint -10.049 1.241 -4.72 {"}'M' greentint -10.27 1.111 -4.726 {"}'M' greentint -9.537 1.818 -4.441 {"}'M' greentint -9.652 1.587 -4.451 {"}'M' greentint -9.807 1.382 -4.46 {"}'M' greentint -9.997 1.209 -4.468 {"}'M' greentint -10.216 1.074 -4.473 {"}'M' greentint -9.647 1.583 -4.193 {"}'M' greentint -9.801 1.377 -4.202 {"}'M' greentint -9.99 1.203 -4.209 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n glu A 333 2o4vA_335F_368}P -12.012 -2.024 0.816 {"}-12.012 -2.024 0.816 { ca glu A 333 2o4vA_335F_368}-11.013 -2.293 -0.212 { c glu A 333 2o4vA_335F_368}-10.733 -1.044 -1.034 { o glu A 333 2o4vA_335F_368}-11.654 -0.346 -1.449 { c glu A 333 2o4vA_335F_368}P -10.733 -1.044 -1.034 { n leu A 334 2o4vA_335F_368}-9.451 -0.763 -1.249 { ca leu A 334 2o4vA_335F_368}-9.027 0.312 -2.147 { c leu A 334 2o4vA_335F_368}-8.364 -0.28 -3.375 { o leu A 334 2o4vA_335F_368}-7.683 -1.305 -3.283 { c leu A 334 2o4vA_335F_368}P -8.364 -0.28 -3.375 { n phe A 335 2o4vA_335F_368}-8.552 0.367 -4.522 { ca phe A 335 2o4vA_335F_368}-7.87 -0.049 -5.742 { c phe A 335 2o4vA_335F_368}-7.492 1.121 -6.66 { o phe A 335 2o4vA_335F_368}-8.066 2.21 -6.592 { c phe A 335 2o4vA_335F_368}P -7.492 1.121 -6.66 { n tyr A 336 2o4vA_335F_368}-6.512 0.862 -7.515 { ca tyr A 336 2o4vA_335F_368}-6.125 1.773 -8.571 { c tyr A 336 2o4vA_335F_368}-5.935 0.976 -9.852 { o tyr A 336 2o4vA_335F_368}-5.234 -0.034 -9.86 { c tyr A 336 2o4vA_335F_368}P -5.935 0.976 -9.852 { n arg A 337 2o4vA_335F_368}-6.573 1.427 -10.926 { ca arg A 337 2o4vA_335F_368}-6.361 0.835 -12.244 { c arg A 337 2o4vA_335F_368}-5.916 1.889 -13.247 { o arg A 337 2o4vA_335F_368}-6.465 2.993 -13.304 { n thr A 366 2o4vA_335F_368}P -8.192 5.088 -12.748 {"}-8.192 5.088 -12.748 { ca thr A 366 2o4vA_335F_368}-9.369 4.806 -11.931 { c thr A 366 2o4vA_335F_368}-8.936 4.574 -10.487 { o thr A 366 2o4vA_335F_368}-8.096 3.717 -10.22 { c thr A 366 2o4vA_335F_368}P -8.936 4.574 -10.487 { n leu A 367 2o4vA_335F_368}-9.5 5.359 -9.572 { ca leu A 367 2o4vA_335F_368}-9.288 5.181 -8.142 { c leu A 367 2o4vA_335F_368}-10.624 4.909 -7.479 { o leu A 367 2o4vA_335F_368}-11.596 5.625 -7.715 { c leu A 367 2o4vA_335F_368}P -10.624 4.909 -7.479 { n gly A 368 2o4vA_335F_368}-10.678 3.872 -6.656 { ca gly A 368 2o4vA_335F_368}-11.944 3.453 -6.081 { c gly A 368 2o4vA_335F_368}-11.894 2.816 -4.707 { o gly A 368 2o4vA_335F_368}-10.845 2.371 -4.23 { c gly A 368 2o4vA_335F_368}P -11.894 2.816 -4.707 { n val A 369 2o4vA_335F_368}-13.061 2.782 -4.081 { ca val A 369 2o4vA_335F_368}-13.233 2.165 -2.786 { c val A 369 2o4vA_335F_368}-14.475 1.269 -2.841 { o val A 369 2o4vA_335F_368}-15.51 1.649 -3.403 { c val A 369 2o4vA_335F_368}P -14.475 1.269 -2.841 { n asn A 370 2o4vA_335F_368}-14.335 0.064 -2.299 { ca asn A 370 2o4vA_335F_368}-15.439 -0.877 -2.163 { c asn A 370 2o4vA_335F_368}-15.685 -1.129 -0.676 { o asn A 370 2o4vA_335F_368}-14.747 -1.409 0.074 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 333 2o4vA_335F_368}P -12.012 -2.024 0.816 { ca glu A 333 2o4vA_335F_368}P -11.013 -2.293 -0.212 { n leu A 334 2o4vA_335F_368}P -9.451 -0.763 -1.249 { ca leu A 334 2o4vA_335F_368}P -9.027 0.312 -2.147 { n phe A 335 2o4vA_335F_368}P -8.552 0.367 -4.522 { ca phe A 335 2o4vA_335F_368}P -7.87 -0.049 -5.742 { n tyr A 336 2o4vA_335F_368}P -6.512 0.862 -7.515 { ca tyr A 336 2o4vA_335F_368}P -6.125 1.773 -8.571 { n arg A 337 2o4vA_335F_368}P -6.573 1.427 -10.926 { ca arg A 337 2o4vA_335F_368}P -6.361 0.835 -12.244 { n thr A 366 2o4vA_335F_368}P -8.192 5.088 -12.748 { ca thr A 366 2o4vA_335F_368}P -9.369 4.806 -11.931 { n leu A 367 2o4vA_335F_368}P -9.5 5.359 -9.572 { ca leu A 367 2o4vA_335F_368}P -9.288 5.181 -8.142 { n gly A 368 2o4vA_335F_368}P -10.678 3.872 -6.656 { ca gly A 368 2o4vA_335F_368}P -11.944 3.453 -6.081 {"}P -11.944 3.453 -6.081 { n val A 369 2o4vA_335F_368}P -13.061 2.782 -4.081 { ca val A 369 2o4vA_335F_368}P -13.233 2.165 -2.786 { n asn A 370 2o4vA_335F_368}P -14.335 0.064 -2.299 { ca asn A 370 2o4vA_335F_368}P -15.439 -0.877 -2.163 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca glu A 333 2o4vA_335F_368}P -11.013 -2.293 -0.212 {"}-11.013 -2.293 -0.212 { ca leu A 334 2o4vA_335F_368}-9.027 0.312 -2.147 { ca phe A 335 2o4vA_335F_368}-7.87 -0.049 -5.742 { ca tyr A 336 2o4vA_335F_368}-6.125 1.773 -8.571 { ca arg A 337 2o4vA_335F_368}-6.361 0.835 -12.244 { ca thr A 366 2o4vA_335F_368}-9.369 4.806 -11.931 { ca leu A 367 2o4vA_335F_368}-9.288 5.181 -8.142 { ca gly A 368 2o4vA_335F_368}-11.944 3.453 -6.081 { ca val A 369 2o4vA_335F_368}-13.233 2.165 -2.786 { ca asn A 370 2o4vA_335F_368}-15.439 -0.877 -2.163 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca glu A 333 2o4vA_335F_368}P -11.013 -2.293 -0.212 { ca leu A 334 2o4vA_335F_368}P -9.027 0.312 -2.147 { ca phe A 335 2o4vA_335F_368}P -7.87 -0.049 -5.742 { cb phe A 335 2o4vA_335F_368}-8.7 -1.085 -6.513 { cg phe A 335 2o4vA_335F_368}-9.839 -0.489 -7.273 { cd1 phe A 335 2o4vA_335F_368}-11.06 -0.264 -6.654 { ce1 phe A 335 2o4vA_335F_368}-12.117 0.301 -7.36 { cz phe A 335 2o4vA_335F_368}-11.947 0.658 -8.685 { cg phe A 335 2o4vA_335F_368}P -9.839 -0.489 -7.273 { cd2 phe A 335 2o4vA_335F_368}-9.684 -0.124 -8.614 { ce2 phe A 335 2o4vA_335F_368}-10.727 0.438 -9.317 { cz phe A 335 2o4vA_335F_368}ghost -11.947 0.658 -8.685 { ca tyr A 336 2o4vA_335F_368}P -6.125 1.773 -8.571 { ca arg A 337 2o4vA_335F_368}P -6.361 0.835 -12.244 { ca thr A 366 2o4vA_335F_368}P -9.369 4.806 -11.931 { ca leu A 367 2o4vA_335F_368}P -9.288 5.181 -8.142 { ca val A 369 2o4vA_335F_368}P -13.233 2.165 -2.786 { ca asn A 370 2o4vA_335F_368}P -15.439 -0.877 -2.163 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 335 2o4vA_335F_368}P -8.7 -1.085 -6.513 {"}P -8.7 -1.085 -6.513 { cd1 phe A 335 2o4vA_335F_368}P -11.06 -0.264 -6.654 { cd2 phe A 335 2o4vA_335F_368}P -9.684 -0.124 -8.614 { ce1 phe A 335 2o4vA_335F_368}P -12.117 0.301 -7.36 { ce2 phe A 335 2o4vA_335F_368}P -10.727 0.438 -9.317 { cz phe A 335 2o4vA_335F_368}P -11.947 0.658 -8.685 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 335 2o4vA_335F_368}P -7.87 -0.049 -5.742 { cb phe A 335 2o4vA_335F_368}-8.7 -1.085 -6.513 { cg phe A 335 2o4vA_335F_368}-9.839 -0.489 -7.273 { cd1 phe A 335 2o4vA_335F_368}-11.06 -0.264 -6.654 { ce1 phe A 335 2o4vA_335F_368}-12.117 0.301 -7.36 { cz phe A 335 2o4vA_335F_368}-11.947 0.658 -8.685 { cg phe A 335 2o4vA_335F_368}P -9.839 -0.489 -7.273 { cd2 phe A 335 2o4vA_335F_368}-9.684 -0.124 -8.614 { ce2 phe A 335 2o4vA_335F_368}-10.727 0.438 -9.317 { cz phe A 335 2o4vA_335F_368}ghost -11.947 0.658 -8.685 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 335 2o4vA_335F_368}P -8.7 -1.085 -6.513 {"}P -8.7 -1.085 -6.513 { cd1 phe A 335 2o4vA_335F_368}P -11.06 -0.264 -6.654 { cd2 phe A 335 2o4vA_335F_368}P -9.684 -0.124 -8.614 { ce1 phe A 335 2o4vA_335F_368}P -12.117 0.301 -7.36 { ce2 phe A 335 2o4vA_335F_368}P -10.727 0.438 -9.317 { cz phe A 335 2o4vA_335F_368}P -11.947 0.658 -8.685 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 335 A}'P' sky -11.7 2.239 -7.976 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 335 A}'P' green -12.577 1.959 -7.677 {"}'P' green -11.729 2.006 -7.416 {"}'P' green -12.997 1.801 -7.164 {"}'P' green -13.044 1.715 -6.908 { CZ PHE 335 A}'P' sea -12.694 2.076 -7.983 {"}'P' sea -12.458 2.175 -7.979 {"}'P' sea -12.21 2.236 -7.976 {"}'P' sea -11.955 2.258 -7.975 {"}'P' green -12.629 1.972 -7.752 {"}'P' green -12.391 2.068 -7.748 {"}'P' green -12.14 2.122 -7.745 {"}'P' green -11.883 2.133 -7.745 {"}'P' sea -11.628 2.1 -7.746 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE1 PHE 335 A}'P' P -12.755 1.93 -7.42 {"}'P' -12.74 1.893 -7.418 {"}'P' P -12.505 2.006 -7.416 {"}'P' -12.484 1.913 -7.413 {"}'P' P -12.247 2.045 -7.415 {"}'P' -12.24 1.94 -7.411 {"}'P' P -11.987 2.045 -7.415 {"}'P' -11.992 1.979 -7.413 {"}'P' P -12.762 1.915 -7.159 {"}'P' -12.726 1.825 -7.17 {"}'P' P -12.513 1.993 -7.155 {"}'P' -12.476 1.835 -7.174 {"}'P' P -12.256 2.033 -7.153 {"}'P' -12.242 1.858 -7.174 {"}'P' P -11.995 2.034 -7.153 {"}'P' -12.004 1.902 -7.169 {"}'P' P -11.737 1.997 -7.155 {"}'P' -11.747 1.951 -7.161 {"}'P' P -12.815 1.839 -6.903 {"}'P' -12.78 1.761 -6.926 {"}'P' P -12.569 1.928 -6.899 {"}'P' -12.526 1.772 -6.943 {"}'P' P -12.313 1.977 -6.897 {"}'P' -12.291 1.789 -6.949 {"}'P' P -12.052 1.987 -6.897 {"}'P' -12.058 1.83 -6.94 {"}'P' P -11.792 1.957 -6.898 {"}'P' -11.807 1.88 -6.92 {"}'P' P -12.864 1.719 -6.658 {"}'P' -12.853 1.699 -6.668 {"}'P' P -12.628 1.818 -6.654 {"}'P' -12.596 1.724 -6.698 {"}'P' P -12.38 1.879 -6.651 {"}'P' -12.357 1.743 -6.712 {"}'P' P -12.125 1.901 -6.65 {"}'P' -12.125 1.775 -6.706 {"}'P' P -11.87 1.882 -6.651 {"}'P' -11.881 1.815 -6.681 {"}'P' P -12.561 1.711 -6.423 {"}'P' -12.551 1.68 -6.443 {"}'P' P -12.31 1.765 -6.42 {"}'P' -12.302 1.71 -6.455 {"}'P' P -12.053 1.776 -6.42 {"}'P' -12.054 1.74 -6.442 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 368 A}'P' sky -11.97 2.538 -7.836 {"}'P' sky -12.66 2.341 -7.844 {"}'P' sky -11.64 2.283 -7.522 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 368 A}'P' green -12.153 2.349 -7.844 {"}'P' green -12.406 2.277 -7.847 {"}'P' sea -11.855 2.309 -7.706 {"}'P' green -12.049 2.147 -7.713 {"}'P' green -12.541 2.06 -7.717 {"}'P' sea -12.779 2.147 -7.713 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 368 A}'P' P -12.287 2.06 -7.717 {"}'P' -12.288 2.064 -7.712 {"}'P' P -12.026 1.942 -7.537 {"}'P' -12.043 1.975 -7.505 {"}'P' P -12.276 1.866 -7.54 {"}'P' -12.285 1.928 -7.486 {"}'P' P -12.536 1.864 -7.54 {"}'P' -12.53 1.91 -7.5 {"}'P' P -11.815 1.893 -7.317 {"}'P' -11.848 1.94 -7.287 {"}'P' P -12.04 1.775 -7.322 {"}'P' -12.084 1.888 -7.258 {"}'P' P -12.287 1.715 -7.325 {"}'P' -12.305 1.857 -7.248 {"}'P' P -12.541 1.715 -7.325 {"}'P' -12.526 1.834 -7.26 {"}'P' P -12.788 1.775 -7.322 {"}'P' -12.767 1.829 -7.292 {"}'P' P -11.696 1.863 -7.071 {"}'P' -11.729 1.903 -7.057 {"}'P' P -11.912 1.726 -7.077 {"}'P' -11.972 1.848 -7.04 {"}'P' P -12.152 1.64 -7.081 {"}'P' -12.195 1.819 -7.03 {"}'P' P -12.406 1.61 -7.082 {"}'P' -12.407 1.794 -7.031 {"}'P' P -12.66 1.637 -7.081 {"}'P' -12.63 1.769 -7.044 {"}'P' P -12.902 1.719 -7.077 {"}'P' -12.88 1.765 -7.063 {"}'P' P -11.657 1.847 -6.811 {"}'P' -11.671 1.865 -6.81 {"}'P' P -11.866 1.705 -6.817 {"}'P' -11.918 1.804 -6.813 {"}'P' P -12.101 1.612 -6.821 {"}'P' -12.146 1.772 -6.814 {"}'P' P -12.351 1.571 -6.823 {"}'P' -12.36 1.746 -6.815 {"}'P' P -12.603 1.585 -6.822 {"}'P' -12.581 1.721 -6.816 {"}'P' P -12.847 1.652 -6.819 {"}'P' -12.825 1.709 -6.817 {"}'P' P -11.912 1.703 -6.557 {"}'P' -11.938 1.757 -6.568 {"}'P' P -12.152 1.617 -6.56 {"}'P' -12.176 1.718 -6.579 {"}'P' P -12.406 1.587 -6.562 {"}'P' -12.407 1.69 -6.58 {"}'P' P -12.66 1.614 -6.56 {"}'P' -12.647 1.671 -6.571 {"}'P' P -12.287 1.67 -6.31 {"}'P' -12.288 1.678 -6.314 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 335 A}'M' green -9.36 2.598 -6.959 {"}'M' green -8.954 3.238 -6.931 {"}'M' green -9.436 2.472 -6.71 {"}'M' green -8.906 3.327 -6.673 {"}'M' green -9.406 2.321 -6.204 {"}'M' green -9.264 2.55 -5.953 {"}'M' green -9.166 2.783 -5.942 {"}'M' green -9.022 2.992 -5.933 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 335 A}'M' greentint -9.267 2.836 -6.948 {"}'M' greentint -9.129 3.052 -6.939 {"}'M' greentint -9.366 2.719 -6.699 {"}'M' greentint -9.251 2.949 -6.689 {"}'M' greentint -9.096 3.154 -6.68 {"}'M' greentint -9.438 2.452 -6.452 {"}'M' greentint -9.369 2.7 -6.441 {"}'M' greentint -9.256 2.931 -6.431 {"}'M' greentint -9.102 3.137 -6.422 {"}'M' greentint -8.913 3.311 -6.415 {"}'M' greentint -9.358 2.572 -6.193 {"}'M' greentint -9.263 2.81 -6.182 {"}'M' greentint -9.124 3.025 -6.173 {"}'M' greentint -8.948 3.21 -6.165 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 368 A}'M' green -9.022 3.353 -6.881 {"}'M' green -8.922 3.334 -6.641 {"}'M' green -8.888 3.331 -6.382 {"}'M' green -9.405 2.476 -6.16 {"}'M' green -8.922 3.312 -6.123 {"}'M' green -9.058 3.054 -5.893 {"}'M' green -9.168 2.821 -5.903 {"}'M' green -9.342 2.63 -5.912 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 368 A}'M' greentint -9.058 3.098 -6.892 {"}'M' greentint -9.168 2.864 -6.903 {"}'M' greentint -9.342 2.674 -6.911 {"}'M' greentint -8.955 3.085 -6.651 {"}'M' greentint -9.051 2.852 -6.662 {"}'M' greentint -9.205 2.652 -6.67 {"}'M' greentint -9.405 2.499 -6.677 {"}'M' greentint -8.917 3.082 -6.393 {"}'M' greentint -9.008 2.849 -6.403 {"}'M' greentint -9.154 2.645 -6.412 {"}'M' greentint -9.345 2.484 -6.419 {"}'M' greentint -8.955 3.062 -6.134 {"}'M' greentint -9.051 2.829 -6.144 {"}'M' greentint -9.205 2.629 -6.153 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 335 A}'M' green -9.794 1.763 -5.103 {"}'M' green -9.637 2.006 -4.851 {"}'M' green -10.12 1.148 -4.37 {"}'M' green -9.404 2.08 -4.33 {"}'M' green -9.755 1.5 -3.906 {"}'M' green -9.58 1.692 -3.898 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 335 A}'M' greentint -10.087 1.42 -4.877 {"}'M' greentint -9.991 1.653 -4.867 {"}'M' greentint -9.837 1.853 -4.858 {"}'M' greentint -10.147 1.276 -4.624 {"}'M' greentint -10.087 1.519 -4.613 {"}'M' greentint -9.968 1.74 -4.604 {"}'M' greentint -9.798 1.924 -4.596 {"}'M' greentint -9.587 2.06 -4.59 {"}'M' greentint -10.087 1.397 -4.36 {"}'M' greentint -9.991 1.63 -4.349 {"}'M' greentint -9.837 1.83 -4.341 {"}'M' greentint -9.637 1.983 -4.334 {"}'M' greentint -10.012 1.258 -4.124 {"}'M' greentint -9.938 1.505 -4.113 {"}'M' greentint -9.794 1.72 -4.104 {"}'M' greentint -9.594 1.882 -4.097 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 368 A}'M' green -9.843 1.914 -5.094 {"}'M' green -9.984 1.697 -5.104 {"}'M' green -9.617 2.146 -4.864 {"}'M' green -10.182 1.336 -4.9 {"}'M' green -9.521 2.141 -4.624 {"}'M' green -9.475 2.121 -4.37 {"}'M' green -10.224 1.13 -4.413 {"}'M' green -9.595 1.854 -3.869 {"}'M' green -9.712 1.627 -3.879 {"}'M' green -9.87 1.426 -3.888 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 368 A}'M' greentint -9.693 1.904 -4.875 {"}'M' greentint -9.816 1.683 -4.885 {"}'M' greentint -9.982 1.491 -4.893 {"}'M' greentint -9.592 1.895 -4.634 {"}'M' greentint -9.708 1.667 -4.644 {"}'M' greentint -9.865 1.465 -4.653 {"}'M' greentint -10.057 1.297 -4.66 {"}'M' greentint -9.545 1.874 -4.381 {"}'M' greentint -9.66 1.643 -4.391 {"}'M' greentint -9.815 1.438 -4.4 {"}'M' greentint -10.005 1.265 -4.408 {"}'M' greentint -9.542 1.87 -4.123 {"}'M' greentint -9.655 1.639 -4.133 {"}'M' greentint -9.809 1.433 -4.142 {"}'M' greentint -9.998 1.259 -4.149 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n lys A 198 2porA_200Y_233}P -11.504 -1.609 1.265 {"}-11.504 -1.609 1.265 { ca lys A 198 2porA_200Y_233}-10.97 -2.169 0.032 { c lys A 198 2porA_200Y_233}-10.723 -0.928 -0.832 { o lys A 198 2porA_200Y_233}-11.512 0.038 -0.801 { c lys A 198 2porA_200Y_233}P -10.723 -0.928 -0.832 { n ala A 199 2porA_200Y_233}-9.608 -0.936 -1.549 { ca ala A 199 2porA_200Y_233}-9.228 0.175 -2.416 { c ala A 199 2porA_200Y_233}-8.472 -0.356 -3.613 { o ala A 199 2porA_200Y_233}-7.827 -1.411 -3.505 { c ala A 199 2porA_200Y_233}P -8.472 -0.356 -3.613 { n tyr A 200 2porA_200Y_233}-8.531 0.295 -4.784 { ca tyr A 200 2porA_200Y_233}-7.756 -0.184 -5.922 { c tyr A 200 2porA_200Y_233}-7.394 1.044 -6.776 { o tyr A 200 2porA_200Y_233}-8.027 2.094 -6.648 { c tyr A 200 2porA_200Y_233}P -7.394 1.044 -6.776 { n tyr A 201 2porA_200Y_233}-6.441 0.873 -7.65 { ca tyr A 201 2porA_200Y_233}-6.107 1.866 -8.619 { c tyr A 201 2porA_200Y_233}-5.856 1.038 -9.873 { o tyr A 201 2porA_200Y_233}-5.2 -0.011 -9.816 { c tyr A 201 2porA_200Y_233}P -5.856 1.038 -9.873 { n ala A 202 2porA_200Y_233}-6.342 1.495 -11.035 { ca ala A 202 2porA_200Y_233}-6.15 0.777 -12.298 { c ala A 202 2porA_200Y_233}-5.755 1.807 -13.363 { o ala A 202 2porA_200Y_233}-6.236 2.939 -13.35 { n ala A 231 2porA_200Y_233}P -8.812 4.306 -13.369 {"}-8.812 4.306 -13.369 { ca ala A 231 2porA_200Y_233}-9.977 4.046 -12.543 { c ala A 231 2porA_200Y_233}-9.438 3.828 -11.125 { o ala A 231 2porA_200Y_233}-8.326 3.302 -10.934 { c ala A 231 2porA_200Y_233}P -9.438 3.828 -11.125 { n tyr A 232 2porA_200Y_233}-10.134 4.285 -10.107 { ca tyr A 232 2porA_200Y_233}-9.73 4.02 -8.729 { c tyr A 232 2porA_200Y_233}-10.952 4.131 -7.827 { o tyr A 232 2porA_200Y_233}-11.954 4.758 -8.206 { c tyr A 232 2porA_200Y_233}P -10.952 4.131 -7.827 { n gly A 233 2porA_200Y_233}-10.971 3.508 -6.644 { ca gly A 233 2porA_200Y_233}-12.129 3.565 -5.773 { c gly A 233 2porA_200Y_233}-11.813 3 -4.394 { o gly A 233 2porA_200Y_233}-10.742 2.459 -4.109 { c gly A 233 2porA_200Y_233}P -11.813 3 -4.394 { n leu A 234 2porA_200Y_233}-12.797 3.12 -3.561 { ca leu A 234 2porA_200Y_233}-12.628 2.748 -2.187 { c leu A 234 2porA_200Y_233}-13.967 2.35 -1.618 { o leu A 234 2porA_200Y_233}-14.973 2.971 -2.017 { c leu A 234 2porA_200Y_233}P -13.967 2.35 -1.618 { n ser A 235 2porA_200Y_233}-14.023 1.345 -0.722 { ca ser A 235 2porA_200Y_233}-15.254 1.145 0.012 { c ser A 235 2porA_200Y_233}-14.93 0.836 1.462 { o ser A 235 2porA_200Y_233}-13.832 0.323 1.759 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 198 2porA_200Y_233}P -11.504 -1.609 1.265 { ca lys A 198 2porA_200Y_233}P -10.97 -2.169 0.032 { n ala A 199 2porA_200Y_233}P -9.608 -0.936 -1.549 { ca ala A 199 2porA_200Y_233}P -9.228 0.175 -2.416 { n tyr A 200 2porA_200Y_233}P -8.531 0.295 -4.784 { ca tyr A 200 2porA_200Y_233}P -7.756 -0.184 -5.922 { n tyr A 201 2porA_200Y_233}P -6.441 0.873 -7.65 { ca tyr A 201 2porA_200Y_233}P -6.107 1.866 -8.619 { n ala A 202 2porA_200Y_233}P -6.342 1.495 -11.035 { ca ala A 202 2porA_200Y_233}P -6.15 0.777 -12.298 { n ala A 231 2porA_200Y_233}P -8.812 4.306 -13.369 { ca ala A 231 2porA_200Y_233}P -9.977 4.046 -12.543 { n tyr A 232 2porA_200Y_233}P -10.134 4.285 -10.107 { ca tyr A 232 2porA_200Y_233}P -9.73 4.02 -8.729 { n gly A 233 2porA_200Y_233}P -10.971 3.508 -6.644 { ca gly A 233 2porA_200Y_233}P -12.129 3.565 -5.773 {"}P -12.129 3.565 -5.773 { n leu A 234 2porA_200Y_233}P -12.797 3.12 -3.561 { ca leu A 234 2porA_200Y_233}P -12.628 2.748 -2.187 { n ser A 235 2porA_200Y_233}P -14.023 1.345 -0.722 { ca ser A 235 2porA_200Y_233}P -15.254 1.145 0.012 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca lys A 198 2porA_200Y_233}P -10.97 -2.169 0.032 {"}-10.97 -2.169 0.032 { ca ala A 199 2porA_200Y_233}-9.228 0.175 -2.416 { ca tyr A 200 2porA_200Y_233}-7.756 -0.184 -5.922 { ca tyr A 201 2porA_200Y_233}-6.107 1.866 -8.619 { ca ala A 202 2porA_200Y_233}-6.15 0.777 -12.298 { ca ala A 231 2porA_200Y_233}P -9.977 4.046 -12.543 {"}-9.977 4.046 -12.543 { ca tyr A 232 2porA_200Y_233}-9.73 4.02 -8.729 { ca gly A 233 2porA_200Y_233}-12.129 3.565 -5.773 { ca leu A 234 2porA_200Y_233}-12.628 2.748 -2.187 { ca ser A 235 2porA_200Y_233}-15.254 1.145 0.012 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca lys A 198 2porA_200Y_233}P -10.97 -2.169 0.032 { ca ala A 199 2porA_200Y_233}P -9.228 0.175 -2.416 { ca tyr A 200 2porA_200Y_233}P -7.756 -0.184 -5.922 { cb tyr A 200 2porA_200Y_233}-8.563 -1.185 -6.784 { cg tyr A 200 2porA_200Y_233}-9.714 -0.52 -7.562 { cd1 tyr A 200 2porA_200Y_233}-10.93 -0.225 -6.953 { ce1 tyr A 200 2porA_200Y_233}-11.926 0.445 -7.668 { cz tyr A 200 2porA_200Y_233}-11.692 0.819 -8.999 { oh tyr A 200 2porA_200Y_233}-12.649 1.506 -9.736 { cg tyr A 200 2porA_200Y_233}P -9.714 -0.52 -7.562 { cd2 tyr A 200 2porA_200Y_233}-9.501 -0.146 -8.901 { ce2 tyr A 200 2porA_200Y_233}-10.488 0.525 -9.617 { cz tyr A 200 2porA_200Y_233}ghost -11.692 0.819 -8.999 { ca tyr A 201 2porA_200Y_233}P -6.107 1.866 -8.619 { ca ala A 202 2porA_200Y_233}P -6.15 0.777 -12.298 { ca ala A 231 2porA_200Y_233}P -9.977 4.046 -12.543 { ca tyr A 232 2porA_200Y_233}P -9.73 4.02 -8.729 { ca leu A 234 2porA_200Y_233}P -12.628 2.748 -2.187 { ca ser A 235 2porA_200Y_233}P -15.254 1.145 0.012 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 200 2porA_200Y_233}P -8.563 -1.185 -6.784 {"}P -8.563 -1.185 -6.784 { cd1 tyr A 200 2porA_200Y_233}P -10.93 -0.225 -6.953 { cd2 tyr A 200 2porA_200Y_233}P -9.501 -0.146 -8.901 { ce1 tyr A 200 2porA_200Y_233}P -11.926 0.445 -7.668 { ce2 tyr A 200 2porA_200Y_233}P -10.488 0.525 -9.617 { oh tyr A 200 2porA_200Y_233}P -12.649 1.506 -9.736 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 200 2porA_200Y_233}P -7.756 -0.184 -5.922 { cb tyr A 200 2porA_200Y_233}-8.563 -1.185 -6.784 { cg tyr A 200 2porA_200Y_233}-9.714 -0.52 -7.562 { cd1 tyr A 200 2porA_200Y_233}-10.93 -0.225 -6.953 { ce1 tyr A 200 2porA_200Y_233}-11.926 0.445 -7.668 { cz tyr A 200 2porA_200Y_233}-11.692 0.819 -8.999 { oh tyr A 200 2porA_200Y_233}-12.649 1.506 -9.736 { cg tyr A 200 2porA_200Y_233}P -9.714 -0.52 -7.562 { cd2 tyr A 200 2porA_200Y_233}-9.501 -0.146 -8.901 { ce2 tyr A 200 2porA_200Y_233}-10.488 0.525 -9.617 { cz tyr A 200 2porA_200Y_233}ghost -11.692 0.819 -8.999 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 200 2porA_200Y_233}P -8.563 -1.185 -6.784 {"}P -8.563 -1.185 -6.784 { cd1 tyr A 200 2porA_200Y_233}P -10.93 -0.225 -6.953 { cd2 tyr A 200 2porA_200Y_233}P -9.501 -0.146 -8.901 { ce1 tyr A 200 2porA_200Y_233}P -11.926 0.445 -7.668 { ce2 tyr A 200 2porA_200Y_233}P -10.488 0.525 -9.617 { oh tyr A 200 2porA_200Y_233}P -12.649 1.506 -9.736 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 200 A}'P' sky -12.853 1.859 -7.216 {"}'P' sky -12.624 1.983 -7.211 {"}'P' sky -12.378 2.072 -7.207 {"}'P' sky -12.89 1.729 -6.972 {"}'P' sky -12.827 1.624 -6.741 {"}'P' sky -12.617 1.577 -6.526 { HE1 TYR 200 A}'P' blue -13.138 1.6 -6.89 {"}'P' blue -13.089 1.499 -6.653 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 200 A}'P' sea -12.673 1.863 -6.966 {"}'P' sea -12.437 1.962 -6.962 {"}'P' sea -12.608 1.759 -6.735 {"}'P' sea -12.37 1.855 -6.731 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 233 A}'P' blue -12.593 2.408 -7.163 {"}'P' blue -12.831 2.321 -7.167 {"}'P' sky -12.82 2.127 -6.99 {"}'P' blue -13.08 2.125 -6.99 {"}'P' blue -13.085 1.976 -6.775 {"}'P' sky -12.696 1.901 -6.531 {"}'P' sky -12.95 1.871 -6.532 {"}'P' blue -13.204 1.898 -6.531 {"}'P' blue -12.645 1.873 -6.271 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 233 A}'P' sea -12.57 2.203 -6.987 {"}'P' sea -12.584 2.036 -6.772 {"}'P' sea -12.831 1.976 -6.775 {"}'P' sea -12.456 1.987 -6.527 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 200 A}'M' sky -9.09 2.936 -6.995 {"}'M' sky -9.421 2.1 -6.777 {"}'M' sky -9.367 1.949 -6.271 {"}'M' sky -8.909 3.094 -6.221 {"}'M' sky -8.983 2.876 -5.989 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 200 A}'M' sea -9.321 2.482 -7.015 {"}'M' sea -9.228 2.72 -7.004 {"}'M' green -9.397 2.356 -6.766 {"}'M' green -9.327 2.603 -6.755 {"}'M' green -9.212 2.833 -6.745 {"}'M' sea -9.057 3.038 -6.736 {"}'M' sea -9.421 2.08 -6.519 {"}'M' green -9.399 2.336 -6.508 {"}'M' green -9.217 2.815 -6.487 {"}'M' sea -9.063 3.021 -6.478 {"}'M' green -9.367 2.205 -6.26 {"}'M' green -9.319 2.456 -6.249 {"}'M' green -9.224 2.694 -6.238 {"}'M' green -9.085 2.909 -6.229 {"}'M' sea -9.275 2.185 -6.019 {"}'M' sea -9.225 2.434 -6.009 {"}'M' sea -9.127 2.667 -5.998 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 200 A}'M' greentint -9.33 2.584 -6.497 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 233 A}'M' -9.549 2.748 -7.001 {"}'M' -9.662 2.323 -6.812 {"}'M' -9.725 2.148 -6.578 {"}'M' -9.275 3.233 -6.531 {"}'M' -9.665 2.133 -6.32 {"}'M' -9.241 3.228 -6.272 {"}'M' -9.378 2.703 -5.794 {"}'M' -9.488 2.47 -5.804 @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 233 A}'M' green -9.378 2.747 -6.793 {"}'M' green -9.488 2.513 -6.804 {"}'M' sea -9.342 3.002 -6.782 {"}'M' green -9.275 2.734 -6.552 {"}'M' green -9.371 2.501 -6.563 {"}'M' green -9.525 2.301 -6.571 {"}'M' green -9.242 2.983 -6.542 {"}'M' green -9.237 2.731 -6.294 {"}'M' green -9.328 2.498 -6.304 {"}'M' green -9.474 2.294 -6.313 {"}'M' green -9.208 2.98 -6.283 {"}'M' green -9.275 2.711 -6.035 {"}'M' green -9.371 2.478 -6.045 {"}'M' sea -9.525 2.278 -6.054 {"}'M' sea -9.242 2.961 -6.024 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 200 A}'M' sea -9.918 1.607 -5.194 {"}'M' sea -9.764 1.807 -5.185 {"}'M' sea -10.074 1.23 -4.951 {"}'M' green -10.014 1.473 -4.94 {"}'M' green -9.895 1.694 -4.931 {"}'M' green -9.725 1.878 -4.923 {"}'M' green -9.514 2.014 -4.917 {"}'M' sea -10.047 1.102 -4.697 {"}'M' green -10.014 1.351 -4.687 {"}'M' green -9.564 1.937 -4.661 {"}'M' sea -9.331 2.034 -4.657 {"}'M' green -9.939 1.212 -4.451 {"}'M' green -9.521 1.836 -4.424 {"}'M' sea -9.282 1.933 -4.42 {"}'M' sea -9.776 1.212 -4.244 {"}'M' green -9.682 1.454 -4.233 {"}'M' green -9.507 1.646 -4.225 {"}'M' sea -9.275 1.762 -4.22 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 200 A}'M' greentint -9.918 1.584 -4.676 {"}'M' greentint -9.764 1.784 -4.668 {"}'M' greentint -9.865 1.459 -4.44 {"}'M' greentint -9.721 1.674 -4.431 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 233 A}'M' sky -9.936 2.015 -5.164 {"}'M' sky -10.098 1.815 -5.173 {"}'M' sky -9.653 2.246 -4.963 {"}'M' sky -10.292 1.474 -4.996 {"}'M' sky -10.307 1.312 -4.784 {"}'M' sky -9.418 2.229 -4.503 {"}'M' sky -9.895 1.347 -4.028 @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 233 A}'M' green -9.74 2.002 -4.973 {"}'M' green -9.881 1.785 -4.983 {"}'M' green -10.068 1.605 -4.991 {"}'M' sea -9.514 2.234 -4.743 {"}'M' green -9.59 1.992 -4.754 {"}'M' green -10.079 1.424 -4.779 {"}'M' green -9.489 1.983 -4.513 {"}'M' green -9.954 1.385 -4.539 {"}'M' sea -10.175 1.255 -4.545 {"}'M' sea -9.442 1.962 -4.26 {"}'M' green -9.557 1.731 -4.27 {"}'M' green -9.712 1.526 -4.279 {"}'M' green -9.902 1.353 -4.287 {"}'M' sea -10.121 1.218 -4.292 {"}'M' sea -9.552 1.727 -4.012 {"}'M' sea -9.706 1.521 -4.021 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 233 A}'M' greentint -9.713 1.771 -4.764 {"}'M' greentint -9.879 1.579 -4.772 {"}'M' greentint -9.605 1.755 -4.523 {"}'M' greentint -9.762 1.553 -4.532 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n gly A 246 2porA_248Y_264}P -11.362 -1.622 1.62 {"}-11.362 -1.622 1.62 { ca gly A 246 2porA_248Y_264}-10.561 -1.947 0.458 { c gly A 246 2porA_248Y_264}-10.584 -0.877 -0.629 { o gly A 246 2porA_248Y_264}-11.401 0.057 -0.572 { c gly A 246 2porA_248Y_264}P -10.584 -0.877 -0.629 { n gly A 247 2porA_248Y_264}-9.724 -1.025 -1.632 { ca gly A 247 2porA_248Y_264}-9.676 -0.062 -2.702 { c gly A 247 2porA_248Y_264}-8.848 -0.613 -3.82 { o gly A 247 2porA_248Y_264}-8.253 -1.68 -3.662 { c gly A 247 2porA_248Y_264}P -8.848 -0.613 -3.82 { n tyr A 248 2porA_248Y_264}-8.773 0.108 -4.94 { ca tyr A 248 2porA_248Y_264}-8.024 -0.36 -6.086 { c tyr A 248 2porA_248Y_264}-7.521 0.87 -6.85 { o tyr A 248 2porA_248Y_264}-8.061 1.977 -6.649 { c tyr A 248 2porA_248Y_264}P -7.521 0.87 -6.85 { n val A 249 2porA_248Y_264}-6.547 0.694 -7.733 { ca val A 249 2porA_248Y_264}-6.159 1.769 -8.646 { c val A 249 2porA_248Y_264}-5.728 1.06 -9.917 { o val A 249 2porA_248Y_264}-5.129 -0.026 -9.902 { c val A 249 2porA_248Y_264}P -5.728 1.06 -9.917 { n gln A 250 2porA_248Y_264}-6.151 1.599 -11.06 { ca gln A 250 2porA_248Y_264}-5.836 0.999 -12.329 { c gln A 250 2porA_248Y_264}-5.424 2.143 -13.25 { o gln A 250 2porA_248Y_264}-5.844 3.296 -13.036 { n tyr A 262 2porA_248Y_264}P -7.778 5.506 -12.642 {"}-7.778 5.506 -12.642 { ca tyr A 262 2porA_248Y_264}-9.099 5.478 -12.033 { c tyr A 262 2porA_248Y_264}-8.98 4.594 -10.79 { o tyr A 262 2porA_248Y_264}-8.145 3.679 -10.719 { c tyr A 262 2porA_248Y_264}P -8.98 4.594 -10.79 { n tyr A 263 2porA_248Y_264}-9.736 4.931 -9.776 { ca tyr A 263 2porA_248Y_264}-9.561 4.277 -8.502 { c tyr A 263 2porA_248Y_264}-10.847 4.354 -7.675 { o tyr A 263 2porA_248Y_264}-11.774 5.109 -7.984 { c tyr A 263 2porA_248Y_264}P -10.847 4.354 -7.675 { n gly A 264 2porA_248Y_264}-10.925 3.643 -6.561 { ca gly A 264 2porA_248Y_264}-12.084 3.63 -5.691 { c gly A 264 2porA_248Y_264}-11.66 3.062 -4.338 { o gly A 264 2porA_248Y_264}-10.652 2.349 -4.216 { c gly A 264 2porA_248Y_264}P -11.66 3.062 -4.338 { n leu A 265 2porA_248Y_264}-12.46 3.418 -3.363 { ca leu A 265 2porA_248Y_264}-12.201 3.122 -1.971 { c leu A 265 2porA_248Y_264}-13.584 2.905 -1.346 { o leu A 265 2porA_248Y_264}-14.498 3.75 -1.486 { c leu A 265 2porA_248Y_264}P -13.584 2.905 -1.346 { n gly A 266 2porA_248Y_264}-13.791 1.779 -0.662 { ca gly A 266 2porA_248Y_264}-15.07 1.563 -0.001 { c gly A 266 2porA_248Y_264}-14.982 0.64 1.203 { o gly A 266 2porA_248Y_264}-13.946 0.018 1.473 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 246 2porA_248Y_264}P -11.362 -1.622 1.62 { ca gly A 246 2porA_248Y_264}P -10.561 -1.947 0.458 {"}P -10.561 -1.947 0.458 { n gly A 247 2porA_248Y_264}P -9.724 -1.025 -1.632 { ca gly A 247 2porA_248Y_264}P -9.676 -0.062 -2.702 {"}P -9.676 -0.062 -2.702 { n tyr A 248 2porA_248Y_264}P -8.773 0.108 -4.94 { ca tyr A 248 2porA_248Y_264}P -8.024 -0.36 -6.086 { n val A 249 2porA_248Y_264}P -6.547 0.694 -7.733 { ca val A 249 2porA_248Y_264}P -6.159 1.769 -8.646 { n gln A 250 2porA_248Y_264}P -6.151 1.599 -11.06 { ca gln A 250 2porA_248Y_264}P -5.836 0.999 -12.329 { n tyr A 262 2porA_248Y_264}P -7.778 5.506 -12.642 { ca tyr A 262 2porA_248Y_264}P -9.099 5.478 -12.033 { n tyr A 263 2porA_248Y_264}P -9.736 4.931 -9.776 { ca tyr A 263 2porA_248Y_264}P -9.561 4.277 -8.502 { n gly A 264 2porA_248Y_264}P -10.925 3.643 -6.561 { ca gly A 264 2porA_248Y_264}P -12.084 3.63 -5.691 {"}P -12.084 3.63 -5.691 { n leu A 265 2porA_248Y_264}P -12.46 3.418 -3.363 { ca leu A 265 2porA_248Y_264}P -12.201 3.122 -1.971 { n gly A 266 2porA_248Y_264}P -13.791 1.779 -0.662 { ca gly A 266 2porA_248Y_264}P -15.07 1.563 -0.001 {"}P -15.07 1.563 -0.001 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca gly A 246 2porA_248Y_264}P -10.561 -1.947 0.458 {"}-10.561 -1.947 0.458 { ca gly A 247 2porA_248Y_264}-9.676 -0.062 -2.702 { ca tyr A 248 2porA_248Y_264}-8.024 -0.36 -6.086 { ca val A 249 2porA_248Y_264}-6.159 1.769 -8.646 { ca gln A 250 2porA_248Y_264}-5.836 0.999 -12.329 { ca tyr A 262 2porA_248Y_264}P -9.099 5.478 -12.033 {"}-9.099 5.478 -12.033 { ca tyr A 263 2porA_248Y_264}-9.561 4.277 -8.502 { ca gly A 264 2porA_248Y_264}-12.084 3.63 -5.691 { ca leu A 265 2porA_248Y_264}-12.201 3.122 -1.971 { ca gly A 266 2porA_248Y_264}-15.07 1.563 -0.001 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca tyr A 248 2porA_248Y_264}P -8.024 -0.36 -6.086 { cb tyr A 248 2porA_248Y_264}-8.925 -1.21 -7.011 { cg tyr A 248 2porA_248Y_264}-10.097 -0.444 -7.632 { cd1 tyr A 248 2porA_248Y_264}-9.883 0.261 -8.807 { ce1 tyr A 248 2porA_248Y_264}-10.893 1.038 -9.357 { cz tyr A 248 2porA_248Y_264}-12.133 1.129 -8.757 { oh tyr A 248 2porA_248Y_264}-13.103 1.936 -9.364 { cg tyr A 248 2porA_248Y_264}P -10.097 -0.444 -7.632 { cd2 tyr A 248 2porA_248Y_264}-11.341 -0.362 -7.021 { ce2 tyr A 248 2porA_248Y_264}-12.362 0.422 -7.571 { cz tyr A 248 2porA_248Y_264}ghost -12.133 1.129 -8.757 { ca val A 249 2porA_248Y_264}P -6.159 1.769 -8.646 { ca gln A 250 2porA_248Y_264}P -5.836 0.999 -12.329 { ca tyr A 262 2porA_248Y_264}P -9.099 5.478 -12.033 { ca tyr A 263 2porA_248Y_264}P -9.561 4.277 -8.502 { ca leu A 265 2porA_248Y_264}P -12.201 3.122 -1.971 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 248 2porA_248Y_264}P -8.925 -1.21 -7.011 {"}P -8.925 -1.21 -7.011 { cd1 tyr A 248 2porA_248Y_264}P -9.883 0.261 -8.807 { cd2 tyr A 248 2porA_248Y_264}P -11.341 -0.362 -7.021 { ce1 tyr A 248 2porA_248Y_264}P -10.893 1.038 -9.357 { ce2 tyr A 248 2porA_248Y_264}P -12.362 0.422 -7.571 { oh tyr A 248 2porA_248Y_264}P -13.103 1.936 -9.364 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 248 2porA_248Y_264}P -8.024 -0.36 -6.086 { cb tyr A 248 2porA_248Y_264}-8.925 -1.21 -7.011 { cg tyr A 248 2porA_248Y_264}-10.097 -0.444 -7.632 { cd1 tyr A 248 2porA_248Y_264}-9.883 0.261 -8.807 { ce1 tyr A 248 2porA_248Y_264}-10.893 1.038 -9.357 { cz tyr A 248 2porA_248Y_264}-12.133 1.129 -8.757 { oh tyr A 248 2porA_248Y_264}-13.103 1.936 -9.364 { cg tyr A 248 2porA_248Y_264}P -10.097 -0.444 -7.632 { cd2 tyr A 248 2porA_248Y_264}-11.341 -0.362 -7.021 { ce2 tyr A 248 2porA_248Y_264}-12.362 0.422 -7.571 { cz tyr A 248 2porA_248Y_264}ghost -12.133 1.129 -8.757 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 248 2porA_248Y_264}P -8.925 -1.21 -7.011 {"}P -8.925 -1.21 -7.011 { cd1 tyr A 248 2porA_248Y_264}P -9.883 0.261 -8.807 { cd2 tyr A 248 2porA_248Y_264}P -11.341 -0.362 -7.021 { ce1 tyr A 248 2porA_248Y_264}P -10.893 1.038 -9.357 { ce2 tyr A 248 2porA_248Y_264}P -12.362 0.422 -7.571 { oh tyr A 248 2porA_248Y_264}P -13.103 1.936 -9.364 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 248 A}'P' blue -12.758 2.114 -7.366 {"}'P' blue -12.501 2.154 -7.364 {"}'P' sky -13.06 1.96 -7.114 {"}'P' sky -12.297 2.108 -7.108 {"}'P' blue -13.263 1.601 -6.644 {"}'P' sky -13.053 1.554 -6.429 {"}'P' sky -12.305 1.74 -6.421 {"}'P' blue -12.803 1.471 -6.241 {"}'P' sky -12.555 1.54 -6.238 { CZ TYR 248 A}'P' blue -12.588 2.37 -7.611 {"}'P' blue -12.574 2.178 -7.427 {"}'P' blue -12.326 2.247 -7.424 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 248 A}'P' sea -12.814 2.049 -7.11 {"}'P' sea -12.558 2.098 -7.108 {"}'P' sea -13.109 1.84 -6.869 {"}'P' green -12.873 1.939 -6.865 {"}'P' green -12.625 2 -6.862 {"}'P' sea -12.37 2.022 -6.861 {"}'P' sea -13.044 1.736 -6.638 {"}'P' green -12.806 1.832 -6.634 {"}'P' green -12.555 1.886 -6.631 {"}'P' sea -12.298 1.897 -6.631 {"}'P' sea -12.817 1.663 -6.425 {"}'P' sea -12.565 1.726 -6.422 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 264 A}'P' blue -12.625 2.628 -7.201 {"}'P' sky -12.521 2.426 -7.07 {"}'P' sky -12.759 2.339 -7.074 {"}'P' sky -13.013 2.339 -7.074 {"}'P' sky -12.281 2.364 -6.888 {"}'P' blue -13.258 2.214 -6.894 {"}'P' sky -13.26 2.054 -6.679 {"}'P' sky -13.132 1.916 -6.438 {"}'P' sky -12.573 1.891 -6.178 {"}'P' sky -12.823 1.85 -6.18 {"}'P' blue -13.075 1.864 -6.179 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 264 A}'P' sea -12.498 2.221 -6.894 {"}'P' green -12.748 2.145 -6.897 {"}'P' sea -13.008 2.143 -6.897 {"}'P' sea -12.287 2.172 -6.674 {"}'P' green -12.512 2.054 -6.679 {"}'P' green -12.759 1.994 -6.682 {"}'P' sea -13.013 1.994 -6.682 {"}'P' sea -12.384 2.005 -6.434 {"}'P' green -12.624 1.919 -6.438 {"}'P' sea -12.878 1.889 -6.439 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 248 A}'M' sky -9.355 2.365 -7.016 {"}'M' sky -9.262 2.603 -7.005 {"}'M' sky -9.124 2.819 -6.996 {"}'M' sky -9.455 1.963 -6.52 {"}'M' sky -8.908 3.078 -6.472 {"}'M' sky -9.309 2.068 -6.02 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 248 A}'M' sea -9.431 2.239 -6.767 {"}'M' green -9.361 2.486 -6.756 {"}'M' green -9.246 2.716 -6.746 {"}'M' sea -9.091 2.921 -6.737 {"}'M' sea -9.433 2.219 -6.509 {"}'M' green -9.364 2.467 -6.498 {"}'M' green -9.251 2.698 -6.488 {"}'M' green -9.097 2.904 -6.479 {"}'M' sea -9.401 2.088 -6.261 {"}'M' green -9.353 2.339 -6.25 {"}'M' green -9.258 2.577 -6.239 {"}'M' green -9.119 2.792 -6.23 {"}'M' sea -8.943 2.977 -6.222 {"}'M' sea -9.259 2.317 -6.01 {"}'M' sea -9.161 2.55 -5.999 {"}'M' sea -9.017 2.759 -5.99 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 264 A}'M' -9.522 2.833 -6.957 {"}'M' -9.658 2.612 -6.966 {"}'M' -9.315 3.087 -6.738 {"}'M' -9.698 2.233 -6.534 {"}'M' -9.215 3.046 -5.98 {"}'M' blue -9.461 2.555 -5.76 @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 264 A}'M' sea -9.351 2.832 -6.749 {"}'M' green -9.461 2.598 -6.76 {"}'M' sea -9.635 2.408 -6.768 {"}'M' green -9.248 2.819 -6.508 {"}'M' green -9.344 2.586 -6.519 {"}'M' green -9.498 2.386 -6.527 {"}'M' sea -9.215 3.068 -6.498 {"}'M' green -9.21 2.816 -6.25 {"}'M' green -9.301 2.583 -6.26 {"}'M' green -9.447 2.379 -6.269 {"}'M' sea -9.638 2.218 -6.276 {"}'M' sea -9.181 3.065 -6.239 {"}'M' sea -9.248 2.796 -5.991 {"}'M' sea -9.344 2.563 -6.001 {"}'M' sea -9.498 2.363 -6.01 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 248 A}'M' green -10.052 1.49 -5.304 {"}'M' green -9.898 1.69 -5.295 {"}'M' green -9.698 1.843 -5.288 {"}'M' green -10.073 1.095 -4.561 {"}'M' green -9.91 1.095 -4.354 {"}'M' green -9.409 1.645 -4.33 {"}'M' green -9.652 1.201 -4.19 {"}'M' green -9.472 1.387 -4.182 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 248 A}'M' greentint -10.148 1.356 -5.05 {"}'M' greentint -10.029 1.577 -5.041 {"}'M' greentint -9.859 1.761 -5.033 {"}'M' greentint -9.648 1.897 -5.027 {"}'M' greentint -10.148 1.234 -4.797 {"}'M' greentint -10.052 1.467 -4.786 {"}'M' greentint -9.898 1.667 -4.778 {"}'M' greentint -9.698 1.82 -4.771 {"}'M' greentint -9.465 1.917 -4.767 {"}'M' greentint -9.999 1.342 -4.55 {"}'M' greentint -9.855 1.557 -4.541 {"}'M' greentint -9.655 1.719 -4.534 {"}'M' greentint -9.416 1.816 -4.53 {"}'M' greentint -9.816 1.337 -4.343 {"}'M' greentint -9.641 1.529 -4.335 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 264 A}'M' green -9.846 1.905 -5.271 {"}'M' green -10.008 1.705 -5.28 {"}'M' green -10.202 1.364 -5.103 {"}'M' green -10.217 1.202 -4.891 {"}'M' green -9.399 1.873 -4.62 {"}'M' green -9.352 1.852 -4.367 {"}'M' green -10.031 1.108 -4.399 {"}'M' green -9.616 1.411 -4.128 {"}'M' green -9.805 1.237 -4.135 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 264 A}'M' greentint -9.65 1.892 -5.08 {"}'M' greentint -9.791 1.675 -5.09 {"}'M' greentint -9.978 1.495 -5.098 {"}'M' greentint -9.5 1.882 -4.861 {"}'M' greentint -9.623 1.661 -4.871 {"}'M' greentint -9.789 1.469 -4.879 {"}'M' greentint -9.989 1.314 -4.886 {"}'M' greentint -9.515 1.645 -4.63 {"}'M' greentint -9.672 1.443 -4.639 {"}'M' greentint -9.864 1.275 -4.646 {"}'M' greentint -10.085 1.145 -4.652 {"}'M' greentint -9.467 1.621 -4.377 {"}'M' greentint -9.622 1.416 -4.386 {"}'M' greentint -9.812 1.243 -4.394 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n leu A 57 2tnfA_59Y_153G}P -11.743 -1.513 1.019 {"}-11.743 -1.513 1.019 { ca leu A 57 2tnfA_59Y_153G}-11.086 -2.097 -0.147 { c leu A 57 2tnfA_59Y_153G}-10.673 -0.863 -0.961 { o leu A 57 2tnfA_59Y_153G}-11.504 -0.007 -1.273 { c leu A 57 2tnfA_59Y_153G}P -10.673 -0.863 -0.961 { n val A 58 2tnfA_59Y_153G}-9.393 -0.778 -1.305 { ca val A 58 2tnfA_59Y_153G}-8.851 0.345 -2.06 { c val A 58 2tnfA_59Y_153G}-8.197 -0.233 -3.303 { o val A 58 2tnfA_59Y_153G}-7.41 -1.179 -3.203 { c val A 58 2tnfA_59Y_153G}P -8.197 -0.233 -3.303 { n tyr A 59 2tnfA_59Y_153G}-8.505 0.335 -4.466 { ca tyr A 59 2tnfA_59Y_153G}-7.931 -0.186 -5.7 { c tyr A 59 2tnfA_59Y_153G}-7.786 0.922 -6.731 { o tyr A 59 2tnfA_59Y_153G}-8.443 1.966 -6.635 { c tyr A 59 2tnfA_59Y_153G}P -7.786 0.922 -6.731 { n ser A 60 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width= 1 master= {vdw contact} { CE1 TYR 59 A}'P' blue -12.414 1.777 -7.737 {"}'P' sky -12.168 1.866 -7.733 {"}'P' sky -11.724 1.839 -7.484 {"}'P' sky -11.401 1.522 -7.046 { CE2 TYR 59 A}'P' sky -11.923 1.087 -5.869 {"}'P' sky -12.749 1.143 -5.608 {"}'P' sky -12.228 1.123 -5.609 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 59 A}'P' green -12.227 1.756 -7.488 {"}'P' sea -11.979 1.817 -7.485 {"}'P' green -11.909 1.703 -7.254 {"}'P' sea -11.652 1.714 -7.254 {"}'P' green -11.659 1.557 -7.044 {"}'P' sea -11.652 1.37 -6.861 { CE2 TYR 59 A}'P' sea -11.915 1.096 -6.131 {"}'P' sea -12.949 1.159 -5.866 {"}'P' green -12.692 1.199 -5.864 {"}'P' green -12.431 1.2 -5.864 {"}'P' green -12.173 1.163 -5.866 {"}'P' sea -12.488 1.153 -5.608 { CZ TYR 59 A}'P' green -12.374 1.79 -7.355 {"}'P' green -11.811 1.379 -6.603 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 59 A}'P' P -12.632 1.829 -7.354 {"}'P' -12.632 1.828 -7.354 {"}'P' P -12.901 1.817 -7.092 {"}'P' -12.896 1.753 -7.1 {"}'P' P -12.64 1.818 -7.092 {"}'P' -12.647 1.711 -7.105 {"}'P' P -12.382 1.781 -7.094 {"}'P' -12.405 1.677 -7.107 {"}'P' P -12.132 1.705 -7.097 {"}'P' -12.154 1.648 -7.104 {"}'P' P -13.214 1.712 -6.838 {"}'P' -13.209 1.692 -6.844 {"}'P' P -12.958 1.761 -6.836 {"}'P' -12.945 1.649 -6.867 {"}'P' P -12.697 1.771 -6.836 {"}'P' -12.703 1.598 -6.883 {"}'P' P -12.437 1.741 -6.837 {"}'P' -12.472 1.562 -6.887 {"}'P' P -12.185 1.672 -6.84 {"}'P' -12.233 1.542 -6.878 {"}'P' P -11.947 1.565 -6.845 {"}'P' -11.974 1.517 -6.859 {"}'P' P -13.273 1.602 -6.593 {"}'P' -13.27 1.594 -6.597 {"}'P' P -13.025 1.663 -6.59 {"}'P' -13.007 1.559 -6.637 {"}'P' P -12.77 1.685 -6.589 {"}'P' -12.769 1.509 -6.667 {"}'P' P -12.266 1.607 -6.593 {"}'P' -12.319 1.447 -6.667 {"}'P' P -12.03 1.511 -6.597 {"}'P' -12.073 1.427 -6.638 {"}'P' P -13.206 1.495 -6.362 {"}'P' -13.203 1.485 -6.368 {"}'P' P -12.955 1.549 -6.359 {"}'P' -12.942 1.457 -6.418 {"}'P' P -12.698 1.56 -6.359 {"}'P' -12.704 1.415 -6.451 {"}'P' P -12.443 1.527 -6.36 {"}'P' -12.475 1.381 -6.455 {"}'P' P -12.197 1.452 -6.363 {"}'P' -12.237 1.355 -6.429 {"}'P' P -11.967 1.336 -6.369 {"}'P' -11.981 1.315 -6.384 {"}'P' P -12.965 1.389 -6.15 {"}'P' -12.961 1.365 -6.171 {"}'P' P -12.705 1.403 -6.149 {"}'P' -12.708 1.337 -6.207 {"}'P' P -12.447 1.368 -6.151 {"}'P' -12.464 1.302 -6.21 {"}'P' P -12.201 1.284 -6.154 {"}'P' -12.213 1.259 -6.178 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { CZ TYR 59 A}'P' P -12.515 1.666 -6.59 {"}'P' -12.546 1.468 -6.679 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 59 A}'P' sky -13.452 1.749 -7.216 {"}'P' sky -13.583 1.692 -6.977 { HH TYR 59 A}'P' blue -13.723 1.658 -6.828 {"}'P' blue -13.763 1.639 -6.57 {"}'P' sky -13.609 1.439 -6.578 {"}'P' blue -13.735 1.44 -6.337 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 153 A}'P' sky -11.991 2.143 -7.388 {"}'P' sky -13.459 1.853 -6.606 {"}'P' blue -13.438 1.74 -6.35 {"}'P' blue -13.544 1.97 -6.34 {"}'P' sky -12.297 1.408 -5.635 {"}'P' sky -12.807 1.476 -5.632 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 153 A}'P' sea -12.174 1.954 -7.396 {"}'P' sea -11.876 1.914 -7.258 {"}'P' sea -11.661 1.888 -7.074 {"}'P' green -11.83 1.69 -7.083 {"}'P' sea -11.646 1.667 -6.862 {"}'P' sea -12.061 1.336 -5.86 {"}'P' green -12.308 1.275 -5.862 {"}'P' green -12.562 1.275 -5.862 {"}'P' green -12.809 1.336 -5.86 {"}'P' sea -12.557 1.405 -5.635 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 153 A}'P' P -12.308 1.665 -7.269 {"}'P' -12.314 1.696 -7.227 {"}'P' P -12.562 1.665 -7.269 {"}'P' -12.553 1.711 -7.206 {"}'P' P -12.8 1.752 -7.265 {"}'P' -12.787 1.773 -7.232 {"}'P' P -12.047 1.547 -7.089 {"}'P' -12.066 1.584 -7.053 {"}'P' P -12.297 1.471 -7.092 {"}'P' -12.313 1.573 -7.003 {"}'P' P -12.557 1.469 -7.092 {"}'P' -12.539 1.594 -6.982 {"}'P' P -12.807 1.54 -7.089 {"}'P' -12.763 1.636 -6.998 {"}'P' P -13.028 1.679 -7.083 {"}'P' -12.997 1.713 -7.044 {"}'P' P -11.836 1.498 -6.869 {"}'P' -11.838 1.501 -6.867 {"}'P' P -12.061 1.38 -6.874 {"}'P' -12.096 1.47 -6.823 {"}'P' P -12.308 1.32 -6.877 {"}'P' -12.328 1.481 -6.79 {"}'P' P -12.809 1.38 -6.874 {"}'P' -12.747 1.539 -6.783 {"}'P' P -13.034 1.498 -6.869 {"}'P' -12.97 1.588 -6.811 {"}'P' P -13.224 1.667 -6.862 {"}'P' -13.209 1.68 -6.851 {"}'P' P -11.933 1.331 -6.629 {"}'P' -11.956 1.379 -6.614 {"}'P' P -12.173 1.245 -6.633 {"}'P' -12.205 1.38 -6.595 {"}'P' P -12.427 1.215 -6.634 {"}'P' -12.428 1.406 -6.581 {"}'P' P -12.923 1.324 -6.629 {"}'P' -12.853 1.469 -6.586 {"}'P' P -13.14 1.458 -6.623 {"}'P' -13.088 1.524 -6.601 {"}'P' P -12.122 1.217 -6.373 {"}'P' -12.143 1.291 -6.37 {"}'P' P -12.372 1.176 -6.375 {"}'P' -12.379 1.31 -6.369 {"}'P' P -12.624 1.19 -6.374 {"}'P' -12.6 1.339 -6.368 {"}'P' P -12.868 1.257 -6.371 {"}'P' -12.822 1.374 -6.366 {"}'P' P -13.092 1.376 -6.366 {"}'P' -13.057 1.427 -6.364 {"}'P' P -12.173 1.222 -6.112 {"}'P' -12.174 1.224 -6.113 {"}'P' P -12.427 1.192 -6.114 {"}'P' -12.427 1.238 -6.122 {"}'P' P -12.681 1.219 -6.112 {"}'P' -12.67 1.27 -6.122 {"}'P' P -12.923 1.301 -6.109 {"}'P' -12.914 1.32 -6.113 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {bad overlap} { HA3 GLY 153 A}'P' P -12.562 1.32 -6.877 {"}'P' -12.539 1.508 -6.775 {"}'P' P -12.681 1.242 -6.633 {"}'P' -12.638 1.436 -6.578 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 59 A}'M' greentint -9.639 2.368 -7.242 {"}'M' greentint -9.539 2.601 -7.232 {"}'M' greentint -9.394 2.809 -7.223 {"}'M' greentint -9.21 2.983 -7.215 {"}'M' greentint -9.784 2.102 -7.013 {"}'M' greentint -9.737 2.354 -7.002 {"}'M' greentint -9.644 2.592 -6.991 {"}'M' greentint -9.506 2.808 -6.982 {"}'M' greentint -9.331 2.994 -6.974 {"}'M' greentint -9.123 3.144 -6.967 {"}'M' greentint -9.837 1.972 -6.764 {"}'M' greentint -9.813 2.228 -6.753 {"}'M' greentint -9.743 2.475 -6.742 {"}'M' greentint -9.628 2.705 -6.732 {"}'M' greentint -9.473 2.91 -6.723 {"}'M' greentint -9.283 3.083 -6.716 {"}'M' greentint -9.064 3.218 -6.71 {"}'M' greentint -9.837 1.952 -6.506 {"}'M' greentint -9.815 2.208 -6.495 {"}'M' greentint -9.746 2.456 -6.484 {"}'M' greentint -9.633 2.687 -6.474 {"}'M' greentint -9.479 2.893 -6.465 {"}'M' greentint -9.29 3.067 -6.458 {"}'M' greentint -9.072 3.203 -6.452 {"}'M' greentint -9.783 2.077 -6.247 {"}'M' greentint -9.735 2.328 -6.236 {"}'M' greentint -9.64 2.566 -6.225 {"}'M' greentint -9.501 2.781 -6.216 {"}'M' greentint -9.325 2.966 -6.208 {"}'M' greentint -9.641 2.306 -5.996 {"}'M' greentint -9.543 2.539 -5.985 {"}'M' greentint -9.399 2.748 -5.976 @subgroup {2->1} dominant @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { H GLY 153 A}'M' P -9.107 2.39 -6.656 {"}'M' -9.112 2.393 -6.656 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 153 A}'M' greentint -9.328 2.64 -7.353 {"}'M' greentint -9.464 2.419 -7.362 {"}'M' greentint -9.157 2.639 -7.145 {"}'M' greentint -9.267 2.405 -7.156 {"}'M' greentint -9.441 2.215 -7.164 {"}'M' greentint -9.663 2.083 -7.17 {"}'M' greentint -9.121 2.894 -7.134 {"}'M' greentint -9.054 2.626 -6.904 {"}'M' greentint -9.15 2.393 -6.915 {"}'M' greentint -9.304 2.193 -6.923 {"}'M' greentint -9.504 2.04 -6.93 {"}'M' greentint -9.737 1.943 -6.934 {"}'M' greentint -9.054 3.125 -6.883 {"}'M' greentint -9.021 2.875 -6.894 {"}'M' greentint -9.016 2.623 -6.646 {"}'M' greentint -9.253 2.186 -6.665 {"}'M' greentint -9.444 2.025 -6.672 {"}'M' greentint -9.67 1.916 -6.676 {"}'M' greentint -9.02 3.12 -6.624 {"}'M' greentint -8.987 2.872 -6.635 {"}'M' greentint -9.054 2.603 -6.387 {"}'M' greentint -9.15 2.37 -6.397 {"}'M' greentint -9.304 2.17 -6.406 {"}'M' greentint -9.504 2.017 -6.413 {"}'M' greentint -9.737 1.921 -6.417 {"}'M' greentint -9.054 3.102 -6.366 {"}'M' greentint -9.021 2.853 -6.376 {"}'M' greentint -9.157 2.595 -6.146 {"}'M' greentint -9.267 2.362 -6.156 {"}'M' greentint -9.441 2.171 -6.165 {"}'M' greentint -9.663 2.04 -6.171 {"}'M' greentint -9.121 2.85 -6.135 {"}'M' greentint -9.328 2.578 -5.94 {"}'M' greentint -9.464 2.357 -5.949 {"}'M' greentint -9.28 2.833 -5.929 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 59 A}'M' greentint -9.758 1.72 -5.05 {"}'M' greentint -10.051 1.377 -4.824 {"}'M' greentint -9.955 1.61 -4.814 {"}'M' greentint -9.801 1.81 -4.805 {"}'M' greentint -9.601 1.963 -4.798 {"}'M' greentint -9.368 2.059 -4.794 {"}'M' greentint -10.111 1.233 -4.571 {"}'M' greentint -10.051 1.476 -4.56 {"}'M' greentint -9.932 1.697 -4.551 {"}'M' greentint -9.762 1.881 -4.543 {"}'M' greentint -9.551 2.017 -4.537 {"}'M' greentint -9.313 2.096 -4.533 {"}'M' greentint -10.051 1.354 -4.307 {"}'M' greentint -9.955 1.587 -4.296 {"}'M' greentint -9.801 1.787 -4.288 {"}'M' greentint -9.601 1.94 -4.281 {"}'M' greentint -9.368 2.037 -4.277 {"}'M' greentint -9.976 1.215 -4.071 {"}'M' greentint -9.902 1.462 -4.06 {"}'M' greentint -9.758 1.677 -4.051 {"}'M' greentint -9.558 1.839 -4.044 {"}'M' greentint -9.319 1.936 -4.04 {"}'M' greentint -9.719 1.457 -3.853 {"}'M' greentint -9.544 1.649 -3.845 {"}'M' greentint -9.312 1.765 -3.84 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 153 A}'M' greentint -9.615 1.769 -4.993 {"}'M' greentint -9.802 1.589 -5.001 {"}'M' greentint -9.324 1.976 -4.764 {"}'M' greentint -9.447 1.755 -4.774 {"}'M' greentint -9.613 1.563 -4.782 {"}'M' greentint -9.813 1.408 -4.789 {"}'M' greentint -10.041 1.296 -4.794 {"}'M' greentint -9.223 1.967 -4.523 {"}'M' greentint -9.339 1.739 -4.533 {"}'M' greentint -9.496 1.537 -4.542 {"}'M' greentint -9.688 1.369 -4.549 {"}'M' greentint -9.909 1.239 -4.555 {"}'M' greentint -9.176 1.946 -4.27 {"}'M' greentint -9.291 1.715 -4.28 {"}'M' greentint -9.446 1.51 -4.289 {"}'M' greentint -9.636 1.337 -4.297 {"}'M' greentint -9.855 1.202 -4.302 {"}'M' greentint -9.286 1.711 -4.022 {"}'M' greentint -9.44 1.505 -4.031 {"}'M' greentint -9.629 1.331 -4.038 {"}'M' greentint -9.847 1.194 -4.044 {"}'M' greentint -9.501 1.498 -3.777 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n thr A 207 3prnA_227Y_209}P -8.203 5.143 -12.831 {"}-8.203 5.143 -12.831 { ca thr A 207 3prnA_227Y_209}-9.385 5.139 -11.955 { c thr A 207 3prnA_227Y_209}-8.965 4.735 -10.554 { o thr A 207 3prnA_227Y_209}-8.039 3.928 -10.38 { c thr A 207 3prnA_227Y_209}P -8.965 4.735 -10.554 { n val A 208 3prnA_227Y_209}-9.56 5.29 -9.5 { ca val A 208 3prnA_227Y_209}-9.248 4.936 -8.136 { c val A 208 3prnA_227Y_209}-10.606 4.74 -7.455 { o val A 208 3prnA_227Y_209}-11.533 5.516 -7.735 { c val A 208 3prnA_227Y_209}P -10.606 4.74 -7.455 { n gly A 209 3prnA_227Y_209}-10.722 3.707 -6.632 { ca gly A 209 3prnA_227Y_209}-11.996 3.474 -5.988 { c gly A 209 3prnA_227Y_209}-11.797 2.885 -4.582 { o gly A 209 3prnA_227Y_209}-10.734 2.47 -4.134 { c gly A 209 3prnA_227Y_209}P -11.797 2.885 -4.582 { n leu A 210 3prnA_227Y_209}-12.896 2.881 -3.877 { ca leu A 210 3prnA_227Y_209}-13.015 2.439 -2.521 { c leu A 210 3prnA_227Y_209}-14.343 1.729 -2.353 { o leu A 210 3prnA_227Y_209}-15.385 2.347 -2.516 { c leu A 210 3prnA_227Y_209}P -14.343 1.729 -2.353 { n asn A 211 3prnA_227Y_209}-14.294 0.481 -1.931 { ca asn A 211 3prnA_227Y_209}-15.475 -0.295 -1.634 { c asn A 211 3prnA_227Y_209}-15.456 -0.666 -0.144 { o asn A 211 3prnA_227Y_209}-14.381 -1.04 0.372 { n thr A 225 3prnA_227Y_209}P -11.8 -1.999 0.776 {"}-11.8 -1.999 0.776 { ca thr A 225 3prnA_227Y_209}-10.872 -2.305 -0.314 { c thr A 225 3prnA_227Y_209}-10.65 -0.989 -1.078 { o thr A 225 3prnA_227Y_209}-11.629 -0.332 -1.438 { c thr A 225 3prnA_227Y_209}P -10.65 -0.989 -1.078 { n leu A 226 3prnA_227Y_209}-9.391 -0.698 -1.247 { ca leu A 226 3prnA_227Y_209}-8.932 0.455 -2.005 { c leu A 226 3prnA_227Y_209}-8.188 -0.076 -3.225 { o leu A 226 3prnA_227Y_209}-7.272 -0.898 -3.13 { c leu A 226 3prnA_227Y_209}P -8.188 -0.076 -3.225 { n tyr A 227 3prnA_227Y_209}-8.632 0.38 -4.419 { ca tyr A 227 3prnA_227Y_209}-7.965 -0.121 -5.617 { c tyr A 227 3prnA_227Y_209}-7.795 0.952 -6.67 { o tyr A 227 3prnA_227Y_209}-8.429 2.007 -6.627 { c tyr A 227 3prnA_227Y_209}P -7.795 0.952 -6.67 { n gly A 228 3prnA_227Y_209}-6.96 0.632 -7.646 { ca gly A 228 3prnA_227Y_209}-6.755 1.578 -8.735 { c gly A 228 3prnA_227Y_209}-6.214 0.879 -9.97 { o gly A 228 3prnA_227Y_209}-5.653 -0.225 -9.894 { c gly A 228 3prnA_227Y_209}P -6.214 0.879 -9.97 { n asn A 229 3prnA_227Y_209}-6.361 1.539 -11.113 { ca asn A 229 3prnA_227Y_209}-5.822 0.949 -12.336 { c asn A 229 3prnA_227Y_209}-5.445 2.107 -13.286 { o asn A 229 3prnA_227Y_209}-6.017 3.202 -13.19 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 207 3prnA_227Y_209}P -8.203 5.143 -12.831 { ca thr A 207 3prnA_227Y_209}P -9.385 5.139 -11.955 { n val A 208 3prnA_227Y_209}P -9.56 5.29 -9.5 { ca val A 208 3prnA_227Y_209}P -9.248 4.936 -8.136 { n gly A 209 3prnA_227Y_209}P -10.722 3.707 -6.632 { ca gly A 209 3prnA_227Y_209}P -11.996 3.474 -5.988 {"}P -11.996 3.474 -5.988 { n leu A 210 3prnA_227Y_209}P -12.896 2.881 -3.877 { ca leu A 210 3prnA_227Y_209}P -13.015 2.439 -2.521 { n asn A 211 3prnA_227Y_209}P -14.294 0.481 -1.931 { ca asn A 211 3prnA_227Y_209}P -15.475 -0.295 -1.634 { n thr A 225 3prnA_227Y_209}P -11.8 -1.999 0.776 { ca thr A 225 3prnA_227Y_209}P -10.872 -2.305 -0.314 { n leu A 226 3prnA_227Y_209}P -9.391 -0.698 -1.247 { ca leu A 226 3prnA_227Y_209}P -8.932 0.455 -2.005 { n tyr A 227 3prnA_227Y_209}P -8.632 0.38 -4.419 { ca tyr A 227 3prnA_227Y_209}P -7.965 -0.121 -5.617 { n gly A 228 3prnA_227Y_209}P -6.96 0.632 -7.646 { ca gly A 228 3prnA_227Y_209}P -6.755 1.578 -8.735 {"}P -6.755 1.578 -8.735 { n asn A 229 3prnA_227Y_209}P -6.361 1.539 -11.113 { ca asn A 229 3prnA_227Y_209}P -5.822 0.949 -12.336 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca thr A 207 3prnA_227Y_209}P -9.385 5.139 -11.955 {"}-9.385 5.139 -11.955 { ca val A 208 3prnA_227Y_209}-9.248 4.936 -8.136 { ca gly A 209 3prnA_227Y_209}-11.996 3.474 -5.988 { ca leu A 210 3prnA_227Y_209}-13.015 2.439 -2.521 { ca asn A 211 3prnA_227Y_209}-15.475 -0.295 -1.634 { ca thr A 225 3prnA_227Y_209}P -10.872 -2.305 -0.314 {"}-10.872 -2.305 -0.314 { ca leu A 226 3prnA_227Y_209}-8.932 0.455 -2.005 { ca tyr A 227 3prnA_227Y_209}-7.965 -0.121 -5.617 { ca gly A 228 3prnA_227Y_209}-6.755 1.578 -8.735 { ca asn A 229 3prnA_227Y_209}-5.822 0.949 -12.336 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca thr A 207 3prnA_227Y_209}P -9.385 5.139 -11.955 { ca val A 208 3prnA_227Y_209}P -9.248 4.936 -8.136 {"}P -9.248 4.936 -8.136 { ca leu A 210 3prnA_227Y_209}P -13.015 2.439 -2.521 { ca asn A 211 3prnA_227Y_209}P -15.475 -0.295 -1.634 { ca thr A 225 3prnA_227Y_209}P -10.872 -2.305 -0.314 { ca leu A 226 3prnA_227Y_209}P -8.932 0.455 -2.005 { ca tyr A 227 3prnA_227Y_209}P -7.965 -0.121 -5.617 { cb tyr A 227 3prnA_227Y_209}-8.803 -1.276 -6.262 { cg tyr A 227 3prnA_227Y_209}-10.119 -0.776 -6.843 { cd1 tyr A 227 3prnA_227Y_209}-11.194 -0.598 -5.983 { ce1 tyr A 227 3prnA_227Y_209}-12.428 -0.154 -6.409 { cz tyr A 227 3prnA_227Y_209}-12.58 0.175 -7.753 { oh tyr A 227 3prnA_227Y_209}-13.828 0.674 -8.134 { cg tyr A 227 3prnA_227Y_209}P -10.119 -0.776 -6.843 { cd2 tyr A 227 3prnA_227Y_209}-10.301 -0.435 -8.174 { ce2 tyr A 227 3prnA_227Y_209}-11.533 0.035 -8.628 { cz tyr A 227 3prnA_227Y_209}ghost -12.58 0.175 -7.753 { ca asn A 229 3prnA_227Y_209}P -5.822 0.949 -12.336 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 227 3prnA_227Y_209}P -8.803 -1.276 -6.262 {"}P -8.803 -1.276 -6.262 { cd1 tyr A 227 3prnA_227Y_209}P -11.194 -0.598 -5.983 { cd2 tyr A 227 3prnA_227Y_209}P -10.301 -0.435 -8.174 { ce1 tyr A 227 3prnA_227Y_209}P -12.428 -0.154 -6.409 { ce2 tyr A 227 3prnA_227Y_209}P -11.533 0.035 -8.628 { oh tyr A 227 3prnA_227Y_209}P -13.828 0.674 -8.134 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 227 3prnA_227Y_209}P -7.965 -0.121 -5.617 { cb tyr A 227 3prnA_227Y_209}-8.803 -1.276 -6.262 { cg tyr A 227 3prnA_227Y_209}-10.119 -0.776 -6.843 { cd1 tyr A 227 3prnA_227Y_209}-11.194 -0.598 -5.983 { ce1 tyr A 227 3prnA_227Y_209}-12.428 -0.154 -6.409 { cz tyr A 227 3prnA_227Y_209}-12.58 0.175 -7.753 { oh tyr A 227 3prnA_227Y_209}-13.828 0.674 -8.134 { cg tyr A 227 3prnA_227Y_209}P -10.119 -0.776 -6.843 { cd2 tyr A 227 3prnA_227Y_209}-10.301 -0.435 -8.174 { ce2 tyr A 227 3prnA_227Y_209}-11.533 0.035 -8.628 { cz tyr A 227 3prnA_227Y_209}ghost -12.58 0.175 -7.753 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 227 3prnA_227Y_209}P -8.803 -1.276 -6.262 {"}P -8.803 -1.276 -6.262 { cd1 tyr A 227 3prnA_227Y_209}P -11.194 -0.598 -5.983 { cd2 tyr A 227 3prnA_227Y_209}P -10.301 -0.435 -8.174 { ce1 tyr A 227 3prnA_227Y_209}P -12.428 -0.154 -6.409 { ce2 tyr A 227 3prnA_227Y_209}P -11.533 0.035 -8.628 { oh tyr A 227 3prnA_227Y_209}P -13.828 0.674 -8.134 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 227 A}'P' sky -11.859 1.47 -6.728 {"}'P' sky -13.073 1.46 -6.208 {"}'P' sky -12.88 1.473 -5.948 {"}'P' sky -12.624 1.522 -5.946 { CZ TYR 227 A}'P' sky -13.278 1.713 -7.296 {"}'P' sky -13.327 1.593 -7.051 {"}'P' sky -11.848 1.601 -7.051 {"}'P' sky -13.262 1.489 -6.82 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 227 A}'P' sea -12.111 1.538 -6.725 {"}'P' sea -13.066 1.475 -6.469 {"}'P' green -12.816 1.551 -6.465 {"}'P' green -12.558 1.59 -6.464 {"}'P' green -12.298 1.59 -6.464 {"}'P' sea -12.04 1.551 -6.465 {"}'P' sea -12.824 1.538 -6.204 {"}'P' green -12.567 1.578 -6.202 {"}'P' green -12.306 1.579 -6.202 { CZ TYR 227 A}'P' sea -12.976 1.867 -7.548 {"}'P' green -12.719 1.907 -7.546 {"}'P' green -12.458 1.908 -7.546 {"}'P' sea -12.2 1.871 -7.548 {"}'P' green -13.032 1.802 -7.292 {"}'P' green -12.776 1.851 -7.29 {"}'P' green -12.255 1.831 -7.291 {"}'P' sea -12.003 1.762 -7.294 {"}'P' green -13.091 1.692 -7.047 {"}'P' green -12.084 1.697 -7.047 {"}'P' green -13.024 1.585 -6.816 {"}'P' green -12.773 1.639 -6.813 {"}'P' green -12.261 1.617 -6.814 {"}'P' sea -12.015 1.542 -6.817 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CZ TYR 227 A}'P' P -12.515 1.861 -7.29 {"}'P' -12.515 1.855 -7.291 {"}'P' P -12.843 1.753 -7.044 {"}'P' -12.841 1.744 -7.048 {"}'P' P -12.588 1.775 -7.043 {"}'P' -12.588 1.745 -7.056 {"}'P' P -12.333 1.756 -7.044 {"}'P' -12.334 1.748 -7.047 {"}'P' P -12.516 1.65 -6.813 {"}'P' -12.516 1.645 -6.816 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 227 A}'P' blue -13.269 1.881 -7.698 {"}'P' sky -13.4 1.824 -7.459 {"}'P' blue -13.634 1.736 -7.243 {"}'P' sky -13.385 1.662 -7.246 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 209 A}'P' sky -12.235 2.194 -7.538 {"}'P' blue -13.389 2.109 -7.135 {"}'P' sky -11.882 1.91 -6.896 {"}'P' sky -13.305 1.9 -6.896 {"}'P' sky -13.088 1.743 -6.382 {"}'P' sky -12.974 1.778 -6.133 {"}'P' sky -12.722 1.847 -5.908 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 209 A}'P' sea -12.473 2.107 -7.542 {"}'P' sea -12.727 2.107 -7.542 {"}'P' green -12.212 1.989 -7.362 {"}'P' green -12.462 1.913 -7.365 {"}'P' green -12.722 1.911 -7.365 {"}'P' green -12.972 1.982 -7.362 {"}'P' sea -12.001 1.94 -7.142 {"}'P' green -12.226 1.822 -7.147 {"}'P' green -12.974 1.822 -7.147 {"}'P' sea -13.199 1.94 -7.142 {"}'P' green -12.098 1.773 -6.902 {"}'P' green -12.338 1.687 -6.906 {"}'P' green -12.846 1.684 -6.906 {"}'P' green -13.088 1.766 -6.902 {"}'P' sea -12.052 1.752 -6.642 {"}'P' green -12.287 1.659 -6.646 {"}'P' green -12.537 1.618 -6.648 {"}'P' green -12.789 1.632 -6.647 {"}'P' sea -13.033 1.699 -6.644 {"}'P' sea -12.098 1.75 -6.382 {"}'P' green -12.338 1.664 -6.385 {"}'P' green -12.592 1.634 -6.387 {"}'P' green -12.846 1.661 -6.385 {"}'P' green -12.473 1.717 -6.135 {"}'P' sea -12.727 1.717 -6.135 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 209 A}'P' P -12.473 1.762 -7.15 {"}'P' -12.476 1.783 -7.138 {"}'P' P -12.727 1.762 -7.15 {"}'P' -12.725 1.782 -7.139 {"}'P' P -12.592 1.657 -6.907 {"}'P' -12.592 1.678 -6.901 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 227 A}'M' greentint -9.723 2.395 -6.994 {"}'M' greentint -9.63 2.633 -6.983 {"}'M' greentint -9.492 2.849 -6.974 {"}'M' greentint -9.317 3.035 -6.966 {"}'M' greentint -9.799 2.269 -6.745 {"}'M' greentint -9.729 2.516 -6.734 {"}'M' greentint -9.614 2.746 -6.724 {"}'M' greentint -9.459 2.951 -6.715 {"}'M' greentint -9.269 3.124 -6.708 {"}'M' greentint -9.801 2.249 -6.487 {"}'M' greentint -9.732 2.497 -6.476 {"}'M' greentint -9.619 2.728 -6.466 {"}'M' greentint -9.465 2.934 -6.457 {"}'M' greentint -9.276 3.108 -6.45 {"}'M' greentint -9.058 3.244 -6.444 {"}'M' greentint -9.769 2.118 -6.239 {"}'M' greentint -9.721 2.369 -6.228 {"}'M' greentint -9.626 2.607 -6.217 {"}'M' greentint -9.487 2.822 -6.208 {"}'M' greentint -9.311 3.007 -6.2 {"}'M' greentint -9.102 3.155 -6.193 {"}'M' greentint -9.627 2.347 -5.988 {"}'M' greentint -9.529 2.58 -5.977 {"}'M' greentint -9.385 2.789 -5.968 {"}'M' greentint -9.202 2.965 -5.961 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 209 A}'M' greentint -9.336 2.834 -7.127 {"}'M' greentint -9.472 2.613 -7.136 {"}'M' greentint -9.165 2.833 -6.919 {"}'M' greentint -9.275 2.599 -6.93 {"}'M' greentint -9.449 2.409 -6.938 {"}'M' greentint -9.671 2.277 -6.944 {"}'M' greentint -9.129 3.088 -6.908 {"}'M' greentint -9.062 2.82 -6.678 {"}'M' greentint -9.158 2.587 -6.689 {"}'M' greentint -9.312 2.387 -6.697 {"}'M' greentint -9.512 2.234 -6.704 {"}'M' greentint -9.745 2.137 -6.708 {"}'M' greentint -9.029 3.069 -6.668 {"}'M' greentint -9.024 2.817 -6.42 {"}'M' greentint -9.115 2.584 -6.43 {"}'M' greentint -9.261 2.38 -6.439 {"}'M' greentint -9.452 2.219 -6.446 {"}'M' greentint -9.678 2.11 -6.45 {"}'M' greentint -8.995 3.066 -6.409 {"}'M' greentint -9.062 2.797 -6.161 {"}'M' greentint -9.158 2.564 -6.171 {"}'M' greentint -9.312 2.364 -6.18 {"}'M' greentint -9.512 2.211 -6.187 {"}'M' greentint -9.745 2.115 -6.191 {"}'M' greentint -9.029 3.047 -6.15 {"}'M' greentint -9.165 2.789 -5.92 {"}'M' greentint -9.275 2.556 -5.93 {"}'M' greentint -9.449 2.365 -5.939 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 227 A}'M' greentint -10.214 1.526 -4.8 {"}'M' greentint -10.06 1.726 -4.791 {"}'M' greentint -9.86 1.879 -4.784 {"}'M' greentint -9.627 1.975 -4.78 {"}'M' greentint -10.31 1.392 -4.546 {"}'M' greentint -10.191 1.613 -4.537 {"}'M' greentint -10.021 1.797 -4.529 {"}'M' greentint -9.81 1.933 -4.523 {"}'M' greentint -9.572 2.012 -4.519 {"}'M' greentint -10.31 1.27 -4.293 {"}'M' greentint -10.214 1.503 -4.282 {"}'M' greentint -10.06 1.703 -4.274 {"}'M' greentint -9.86 1.856 -4.267 {"}'M' greentint -9.627 1.953 -4.263 {"}'M' greentint -10.161 1.378 -4.046 {"}'M' greentint -10.017 1.593 -4.037 {"}'M' greentint -9.817 1.755 -4.03 {"}'M' greentint -9.578 1.852 -4.026 {"}'M' greentint -9.978 1.373 -3.839 {"}'M' greentint -9.803 1.565 -3.831 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 209 A}'M' green -9.873 1.796 -5.008 {"}'M' green -10.06 1.616 -5.016 {"}'M' green -9.582 2.003 -4.779 {"}'M' green -10.409 1.181 -4.574 {"}'M' green -10.353 1.136 -4.322 {"}'M' green -9.953 1.357 -3.799 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 209 A}'M' greentint -9.705 1.782 -4.789 {"}'M' greentint -9.871 1.59 -4.797 {"}'M' greentint -10.071 1.435 -4.804 {"}'M' greentint -10.299 1.323 -4.809 {"}'M' greentint -9.481 1.994 -4.538 {"}'M' greentint -9.597 1.766 -4.548 {"}'M' greentint -9.754 1.564 -4.557 {"}'M' greentint -9.946 1.396 -4.564 {"}'M' greentint -10.167 1.266 -4.57 {"}'M' greentint -9.434 1.973 -4.285 {"}'M' greentint -9.549 1.742 -4.295 {"}'M' greentint -9.704 1.537 -4.304 {"}'M' greentint -9.894 1.364 -4.312 {"}'M' greentint -10.113 1.229 -4.317 {"}'M' greentint -9.544 1.738 -4.037 {"}'M' greentint -9.698 1.532 -4.046 {"}'M' greentint -9.887 1.358 -4.053 {"}'M' greentint -10.105 1.221 -4.059 {"}'M' greentint -9.759 1.525 -3.792 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n arg A 238 3prnA_240Y_254}P -11.656 -1.63 1.42 {"}-11.656 -1.63 1.42 { ca arg A 238 3prnA_240Y_254}-11.082 -2.018 0.134 { c arg A 238 3prnA_240Y_254}-10.646 -0.81 -0.698 { o arg A 238 3prnA_240Y_254}-11.265 0.249 -0.605 { c arg A 238 3prnA_240Y_254}P -10.646 -0.81 -0.698 { n ala A 239 3prnA_240Y_254}-9.642 -1.007 -1.542 { ca ala A 239 3prnA_240Y_254}-9.186 0.068 -2.423 { c ala A 239 3prnA_240Y_254}-8.589 -0.514 -3.687 { o ala A 239 3prnA_240Y_254}-8.139 -1.648 -3.692 { c ala A 239 3prnA_240Y_254}P -8.589 -0.514 -3.687 { n tyr A 240 3prnA_240Y_254}-8.486 0.253 -4.76 { ca tyr A 240 3prnA_240Y_254}-7.812 -0.158 -5.971 { c tyr A 240 3prnA_240Y_254}-7.415 1.073 -6.797 { o tyr A 240 3prnA_240Y_254}-8.035 2.126 -6.612 { c tyr A 240 3prnA_240Y_254}P -7.415 1.073 -6.797 { n val A 241 3prnA_240Y_254}-6.463 0.876 -7.698 { ca val A 241 3prnA_240Y_254}-6.089 1.896 -8.638 { c val A 241 3prnA_240Y_254}-5.952 1.095 -9.948 { o val A 241 3prnA_240Y_254}-5.495 -0.055 -9.83 { c val A 241 3prnA_240Y_254}P -5.952 1.095 -9.948 { n ser A 242 3prnA_240Y_254}-6.341 1.665 -11.067 { ca ser A 242 3prnA_240Y_254}-6.19 0.904 -12.326 { c ser A 242 3prnA_240Y_254}-5.817 1.906 -13.433 { o ser A 242 3prnA_240Y_254}-6.329 3.03 -13.418 { n ala A 252 3prnA_240Y_254}P -8.035 5.185 -12.904 {"}-8.035 5.185 -12.904 { ca ala A 252 3prnA_240Y_254}-9.287 4.906 -12.192 { c ala A 252 3prnA_240Y_254}-8.895 4.469 -10.774 { o ala A 252 3prnA_240Y_254}-7.83 3.878 -10.562 { c ala A 252 3prnA_240Y_254}P -8.895 4.469 -10.774 { n tyr A 253 3prnA_240Y_254}-9.76 4.758 -9.846 { ca tyr A 253 3prnA_240Y_254}-9.545 4.379 -8.472 { c tyr A 253 3prnA_240Y_254}-10.877 4.227 -7.736 { o tyr A 253 3prnA_240Y_254}-11.941 4.672 -8.101 { c tyr A 253 3prnA_240Y_254}P -10.877 4.227 -7.736 { n gly A 254 3prnA_240Y_254}-10.765 3.515 -6.581 { ca gly A 254 3prnA_240Y_254}-11.98 3.338 -5.771 { c gly A 254 3prnA_240Y_254}-11.623 2.999 -4.331 { o gly A 254 3prnA_240Y_254}-10.598 2.387 -4.031 { c gly A 254 3prnA_240Y_254}P -11.623 2.999 -4.331 { n ile A 255 3prnA_240Y_254}-12.511 3.37 -3.439 { ca ile A 255 3prnA_240Y_254}-12.381 3.09 -2.029 { c ile A 255 3prnA_240Y_254}-13.759 2.663 -1.52 { o ile A 255 3prnA_240Y_254}-14.807 3.205 -1.886 { c ile A 255 3prnA_240Y_254}P -13.759 2.663 -1.52 { n gly A 256 3prnA_240Y_254}-13.795 1.564 -0.736 { ca gly A 256 3prnA_240Y_254}-15.1 1.141 -0.231 { c gly A 256 3prnA_240Y_254}-14.932 0.415 1.103 { o gly A 256 3prnA_240Y_254}-13.843 0.143 1.619 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 238 3prnA_240Y_254}P -11.656 -1.63 1.42 { ca arg A 238 3prnA_240Y_254}P -11.082 -2.018 0.134 { n ala A 239 3prnA_240Y_254}P -9.642 -1.007 -1.542 { ca ala A 239 3prnA_240Y_254}P -9.186 0.068 -2.423 { n tyr A 240 3prnA_240Y_254}P -8.486 0.253 -4.76 { ca tyr A 240 3prnA_240Y_254}P -7.812 -0.158 -5.971 { n val A 241 3prnA_240Y_254}P -6.463 0.876 -7.698 { ca val A 241 3prnA_240Y_254}P -6.089 1.896 -8.638 { n ser A 242 3prnA_240Y_254}P -6.341 1.665 -11.067 { ca ser A 242 3prnA_240Y_254}P -6.19 0.904 -12.326 { n ala A 252 3prnA_240Y_254}P -8.035 5.185 -12.904 { ca ala A 252 3prnA_240Y_254}P -9.287 4.906 -12.192 { n tyr A 253 3prnA_240Y_254}P -9.76 4.758 -9.846 { ca tyr A 253 3prnA_240Y_254}P -9.545 4.379 -8.472 { n gly A 254 3prnA_240Y_254}P -10.765 3.515 -6.581 { ca gly A 254 3prnA_240Y_254}P -11.98 3.338 -5.771 {"}P -11.98 3.338 -5.771 { n ile A 255 3prnA_240Y_254}P -12.511 3.37 -3.439 { ca ile A 255 3prnA_240Y_254}P -12.381 3.09 -2.029 { n gly A 256 3prnA_240Y_254}P -13.795 1.564 -0.736 { ca gly A 256 3prnA_240Y_254}P -15.1 1.141 -0.231 {"}P -15.1 1.141 -0.231 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca arg A 238 3prnA_240Y_254}P -11.082 -2.018 0.134 {"}-11.082 -2.018 0.134 { ca ala A 239 3prnA_240Y_254}-9.186 0.068 -2.423 { ca tyr A 240 3prnA_240Y_254}-7.812 -0.158 -5.971 { ca val A 241 3prnA_240Y_254}-6.089 1.896 -8.638 { ca ser A 242 3prnA_240Y_254}-6.19 0.904 -12.326 { ca ala A 252 3prnA_240Y_254}P -9.287 4.906 -12.192 {"}-9.287 4.906 -12.192 { ca tyr A 253 3prnA_240Y_254}-9.545 4.379 -8.472 { ca gly A 254 3prnA_240Y_254}-11.98 3.338 -5.771 { ca ile A 255 3prnA_240Y_254}-12.381 3.09 -2.029 { ca gly A 256 3prnA_240Y_254}-15.1 1.141 -0.231 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca arg A 238 3prnA_240Y_254}P -11.082 -2.018 0.134 { ca ala A 239 3prnA_240Y_254}P -9.186 0.068 -2.423 { ca tyr A 240 3prnA_240Y_254}P -7.812 -0.158 -5.971 { cb tyr A 240 3prnA_240Y_254}-8.636 -1.091 -6.907 { cg tyr A 240 3prnA_240Y_254}-9.842 -0.431 -7.541 { cd1 tyr A 240 3prnA_240Y_254}-9.684 0.214 -8.785 { ce1 tyr A 240 3prnA_240Y_254}-10.758 0.82 -9.416 { cz tyr A 240 3prnA_240Y_254}-12.021 0.778 -8.832 { oh tyr A 240 3prnA_240Y_254}-13.043 1.422 -9.523 { cg tyr A 240 3prnA_240Y_254}P -9.842 -0.431 -7.541 { cd2 tyr A 240 3prnA_240Y_254}-11.103 -0.47 -6.976 { ce2 tyr A 240 3prnA_240Y_254}-12.196 0.144 -7.63 { cz tyr A 240 3prnA_240Y_254}ghost -12.021 0.778 -8.832 { ca val A 241 3prnA_240Y_254}P -6.089 1.896 -8.638 {"}P -6.089 1.896 -8.638 { ca ser A 242 3prnA_240Y_254}P -6.19 0.904 -12.326 { ca ala A 252 3prnA_240Y_254}P -9.287 4.906 -12.192 { ca tyr A 253 3prnA_240Y_254}P -9.545 4.379 -8.472 { ca ile A 255 3prnA_240Y_254}P -12.381 3.09 -2.029 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 240 3prnA_240Y_254}P -8.636 -1.091 -6.907 {"}P -8.636 -1.091 -6.907 { cd1 tyr A 240 3prnA_240Y_254}P -9.684 0.214 -8.785 { cd2 tyr A 240 3prnA_240Y_254}P -11.103 -0.47 -6.976 { ce1 tyr A 240 3prnA_240Y_254}P -10.758 0.82 -9.416 { ce2 tyr A 240 3prnA_240Y_254}P -12.196 0.144 -7.63 { oh tyr A 240 3prnA_240Y_254}P -13.043 1.422 -9.523 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca tyr A 240 3prnA_240Y_254}P -7.812 -0.158 -5.971 { cb tyr A 240 3prnA_240Y_254}-8.636 -1.091 -6.907 { cg tyr A 240 3prnA_240Y_254}-9.842 -0.431 -7.541 { cd1 tyr A 240 3prnA_240Y_254}-9.684 0.214 -8.785 { ce1 tyr A 240 3prnA_240Y_254}-10.758 0.82 -9.416 { cz tyr A 240 3prnA_240Y_254}-12.021 0.778 -8.832 { oh tyr A 240 3prnA_240Y_254}-13.043 1.422 -9.523 { cg tyr A 240 3prnA_240Y_254}P -9.842 -0.431 -7.541 { cd2 tyr A 240 3prnA_240Y_254}-11.103 -0.47 -6.976 { ce2 tyr A 240 3prnA_240Y_254}-12.196 0.144 -7.63 { cz tyr A 240 3prnA_240Y_254}ghost -12.021 0.778 -8.832 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 240 3prnA_240Y_254}P -8.636 -1.091 -6.907 {"}P -8.636 -1.091 -6.907 { cd1 tyr A 240 3prnA_240Y_254}P -9.684 0.214 -8.785 { cd2 tyr A 240 3prnA_240Y_254}P -11.103 -0.47 -6.976 { ce1 tyr A 240 3prnA_240Y_254}P -10.758 0.82 -9.416 { ce2 tyr A 240 3prnA_240Y_254}P -12.196 0.144 -7.63 { oh tyr A 240 3prnA_240Y_254}P -13.043 1.422 -9.523 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 240 A}'P' sky -13.16 1.428 -6.934 {"}'P' sky -11.7 1.666 -6.924 { CZ TYR 240 A}'P' blue -12.476 2.019 -7.686 {"}'P' blue -12.224 2.082 -7.683 {"}'P' sky -12.214 1.896 -7.499 {"}'P' blue -11.957 1.909 -7.499 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 240 A}'P' sea -12.592 1.836 -7.425 {"}'P' sea -12.335 1.876 -7.423 {"}'P' sea -12.894 1.682 -7.173 {"}'P' green -12.648 1.771 -7.169 {"}'P' green -12.392 1.82 -7.167 {"}'P' green -12.131 1.83 -7.167 {"}'P' sea -11.871 1.8 -7.168 {"}'P' green -12.943 1.562 -6.928 {"}'P' green -11.949 1.725 -6.921 {"}'P' sea -13.097 1.323 -6.703 {"}'P' green -12.878 1.458 -6.697 {"}'P' green -11.877 1.586 -6.691 {"}'P' sea -12.887 1.276 -6.488 {"}'P' green -12.651 1.385 -6.484 {"}'P' green -12.139 1.462 -6.48 {"}'P' sea -11.881 1.427 -6.482 {"}'P' sea -12.637 1.193 -6.3 {"}'P' green -12.389 1.262 -6.297 {"}'P' sea -12.132 1.275 -6.297 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { CE2 TYR 240 A}'P' P -12.707 1.661 -6.924 {"}'P' -12.703 1.649 -6.93 {"}'P' P -12.459 1.722 -6.921 {"}'P' -12.453 1.689 -6.936 {"}'P' P -12.204 1.744 -6.92 {"}'P' -12.204 1.731 -6.926 {"}'P' P -12.64 1.554 -6.693 {"}'P' -12.631 1.525 -6.711 {"}'P' P -12.389 1.608 -6.69 {"}'P' -12.383 1.566 -6.717 {"}'P' P -12.132 1.619 -6.69 {"}'P' -12.132 1.606 -6.698 {"}'P' P -12.399 1.448 -6.481 {"}'P' -12.397 1.438 -6.49 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 254 A}'P' sky -12.591 2.075 -7.274 {"}'P' sky -12.964 1.945 -7.14 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 254 A}'P' green -12.234 1.945 -7.14 {"}'P' green -12.472 1.858 -7.144 {"}'P' green -12.726 1.858 -7.144 {"}'P' green -11.994 1.883 -6.958 {"}'P' green -12.971 1.733 -6.964 {"}'P' sea -11.81 1.86 -6.737 {"}'P' green -12 1.691 -6.744 {"}'P' green -12.973 1.573 -6.749 {"}'P' sea -11.881 1.661 -6.498 {"}'P' green -12.097 1.524 -6.504 {"}'P' green -12.845 1.435 -6.508 {"}'P' sea -13.087 1.517 -6.504 {"}'P' sea -12.051 1.503 -6.244 {"}'P' green -12.286 1.41 -6.248 {"}'P' green -12.536 1.369 -6.25 {"}'P' sea -12.788 1.383 -6.249 @vectorlist {x} color= blue width= 1 alpha= 0.1765 master= {small overlap} { HA3 GLY 254 A}'P' P -12.211 1.74 -6.964 {"}'P' -12.215 1.747 -6.957 {"}'P' P -12.461 1.664 -6.967 {"}'P' -12.465 1.691 -6.944 {"}'P' P -12.721 1.662 -6.967 {"}'P' -12.72 1.667 -6.963 {"}'P' P -12.225 1.573 -6.749 {"}'P' -12.236 1.603 -6.733 {"}'P' P -12.472 1.513 -6.752 {"}'P' -12.477 1.557 -6.728 {"}'P' P -12.726 1.513 -6.752 {"}'P' -12.724 1.53 -6.742 {"}'P' P -12.337 1.438 -6.508 {"}'P' -12.341 1.453 -6.503 {"}'P' P -12.591 1.408 -6.509 {"}'P' -12.591 1.415 -6.507 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 240 A}'M' green -9.329 2.514 -6.979 {"}'M' green -9.236 2.752 -6.968 {"}'M' green -9.098 2.968 -6.959 {"}'M' green -9.405 2.388 -6.73 {"}'M' green -9.429 2.112 -6.483 {"}'M' green -8.882 3.227 -6.435 {"}'M' green -9.375 2.237 -6.224 {"}'M' green -8.917 3.126 -6.185 {"}'M' green -9.283 2.217 -5.983 {"}'M' sea -8.808 3.084 -5.946 {"}'M' sea -9.085 2.471 -5.752 {"}'M' green -8.968 2.703 -5.742 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 240 A}'M' greentint -9.335 2.635 -6.719 {"}'M' greentint -9.22 2.865 -6.709 {"}'M' greentint -9.065 3.07 -6.7 {"}'M' greentint -9.407 2.368 -6.472 {"}'M' greentint -9.338 2.616 -6.461 {"}'M' greentint -9.225 2.847 -6.451 {"}'M' greentint -9.071 3.053 -6.442 {"}'M' greentint -9.327 2.488 -6.213 {"}'M' greentint -9.232 2.726 -6.202 {"}'M' greentint -9.093 2.941 -6.193 {"}'M' greentint -9.233 2.466 -5.973 {"}'M' greentint -9.135 2.699 -5.962 {"}'M' greentint -8.991 2.908 -5.953 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 254 A}'M' green -9.271 2.871 -6.945 {"}'M' green -9.407 2.65 -6.954 {"}'M' green -9.064 3.125 -6.726 {"}'M' green -9.447 2.271 -6.522 {"}'M' green -9.387 2.256 -6.264 {"}'M' green -8.964 3.084 -5.968 {"}'M' green -9.21 2.593 -5.748 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 254 A}'M' greentint -9.1 2.87 -6.737 {"}'M' greentint -9.21 2.636 -6.748 {"}'M' greentint -9.384 2.446 -6.756 {"}'M' greentint -8.997 2.857 -6.496 {"}'M' greentint -9.093 2.624 -6.507 {"}'M' greentint -9.247 2.424 -6.515 {"}'M' greentint -8.964 3.106 -6.486 {"}'M' greentint -8.959 2.854 -6.238 {"}'M' greentint -9.05 2.621 -6.248 {"}'M' greentint -9.196 2.417 -6.257 {"}'M' greentint -8.93 3.103 -6.227 {"}'M' greentint -8.997 2.834 -5.979 {"}'M' greentint -9.093 2.601 -5.989 {"}'M' greentint -9.247 2.401 -5.998 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 240 A}'M' sea -9.801 1.436 -5.057 {"}'M' green -9.705 1.669 -5.047 {"}'M' green -9.551 1.869 -5.038 {"}'M' green -9.861 1.292 -4.804 {"}'M' green -9.301 2.076 -4.77 {"}'M' green -9.834 1.164 -4.55 {"}'M' sea -9.118 2.096 -4.51 {"}'M' green -9.726 1.274 -4.304 {"}'M' green -9.308 1.898 -4.277 {"}'M' sea -9.069 1.995 -4.273 {"}'M' green -9.563 1.274 -4.097 {"}'M' green -9.469 1.516 -4.086 {"}'M' green -9.294 1.708 -4.078 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 240 A}'M' greentint -9.801 1.535 -4.793 {"}'M' greentint -9.682 1.756 -4.784 {"}'M' greentint -9.512 1.94 -4.776 {"}'M' greentint -9.801 1.413 -4.54 {"}'M' greentint -9.705 1.646 -4.529 {"}'M' greentint -9.551 1.846 -4.521 {"}'M' greentint -9.351 1.999 -4.514 {"}'M' greentint -9.652 1.521 -4.293 {"}'M' greentint -9.508 1.736 -4.284 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 254 A}'M' sea -9.792 1.943 -5.086 {"}'M' sea -9.509 2.174 -4.885 {"}'M' green -9.596 1.93 -4.895 {"}'M' green -9.737 1.713 -4.905 {"}'M' green -9.924 1.533 -4.913 {"}'M' green -9.37 2.162 -4.665 {"}'M' green -9.935 1.352 -4.701 {"}'M' green -9.274 2.157 -4.425 {"}'M' green -9.81 1.313 -4.461 {"}'M' sea -10.031 1.183 -4.467 {"}'M' sea -9.228 2.137 -4.171 {"}'M' green -9.298 1.89 -4.182 {"}'M' green -9.758 1.281 -4.209 {"}'M' sea -9.295 1.886 -3.924 {"}'M' green -9.408 1.655 -3.934 {"}'M' green -9.562 1.449 -3.943 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 254 A}'M' greentint -9.446 1.92 -4.676 {"}'M' greentint -9.569 1.699 -4.686 {"}'M' greentint -9.735 1.507 -4.694 {"}'M' greentint -9.345 1.911 -4.435 {"}'M' greentint -9.461 1.683 -4.445 {"}'M' greentint -9.618 1.481 -4.454 {"}'M' greentint -9.413 1.659 -4.192 {"}'M' greentint -9.568 1.454 -4.201 @subgroup {mainchain} @vectorlist {mc} color= blue alpha= 0.1765 master= {mainchain} { n ala A 97 4bclA_114F_99G}P -9.058 4.185 -13.296 {"}-9.058 4.185 -13.296 { ca ala A 97 4bclA_114F_99G}-10.039 4.3 -12.246 { c ala A 97 4bclA_114F_99G}-9.374 4.281 -10.913 { o ala A 97 4bclA_114F_99G}-8.341 3.689 -10.733 { c ala A 97 4bclA_114F_99G}P -9.374 4.281 -10.913 { n val A 98 4bclA_114F_99G}-10.022 4.854 -9.922 { ca val A 98 4bclA_114F_99G}-9.463 4.759 -8.603 { c val A 98 4bclA_114F_99G}-10.68 4.713 -7.698 { o val A 98 4bclA_114F_99G}-11.593 5.581 -7.905 { c val A 98 4bclA_114F_99G}P -10.68 4.713 -7.698 { n gly A 99 4bclA_114F_99G}-10.701 3.76 -6.782 { ca gly A 99 4bclA_114F_99G}-11.874 3.764 -5.992 { c gly A 99 4bclA_114F_99G}-11.706 3.012 -4.733 { o gly A 99 4bclA_114F_99G}-10.657 2.567 -4.389 { c gly A 99 4bclA_114F_99G}P -11.706 3.012 -4.733 { n glu A 100 4bclA_114F_99G}-12.823 2.811 -4.044 { ca glu A 100 4bclA_114F_99G}-12.792 2.066 -2.825 { c glu A 100 4bclA_114F_99G}-14.16 1.538 -2.505 { o glu A 100 4bclA_114F_99G}-15.131 2.088 -3.008 { c glu A 100 4bclA_114F_99G}P -14.16 1.538 -2.505 { n gly A 101 4bclA_114F_99G}-14.231 0.57 -1.597 { ca gly A 101 4bclA_114F_99G}-15.588 0.11 -1.325 { c gly A 101 4bclA_114F_99G}-15.504 -0.959 -0.287 { o gly A 101 4bclA_114F_99G}-14.504 -1.106 0.395 { n phe A 112 4bclA_114F_99G}P -11.839 -2.461 0.769 {"}-11.839 -2.461 0.769 { ca phe A 112 4bclA_114F_99G}-10.781 -2.472 -0.237 { c phe A 112 4bclA_114F_99G}-10.693 -1.133 -0.916 { o phe A 112 4bclA_114F_99G}-11.627 -0.339 -0.831 { c phe A 112 4bclA_114F_99G}P -10.693 -1.133 -0.916 { n ser A 113 4bclA_114F_99G}-9.522 -0.919 -1.562 { ca ser A 113 4bclA_114F_99G}-9.32 0.246 -2.363 { c ser A 113 4bclA_114F_99G}-8.445 -0.123 -3.514 { o ser A 113 4bclA_114F_99G}-7.765 -1.123 -3.483 { c ser A 113 4bclA_114F_99G}P -8.445 -0.123 -3.514 { n phe A 114 4bclA_114F_99G}-8.57 0.598 -4.617 { ca phe A 114 4bclA_114F_99G}-7.743 0.118 -5.694 { c phe A 114 4bclA_114F_99G}-7.502 1.223 -6.662 { o phe A 114 4bclA_114F_99G}-8.136 2.294 -6.68 { c phe A 114 4bclA_114F_99G}P -7.502 1.223 -6.662 { n glu A 115 4bclA_114F_99G}-6.598 0.893 -7.544 { ca glu A 115 4bclA_114F_99G}-6.379 1.842 -8.593 { c glu A 115 4bclA_114F_99G}-6.169 0.976 -9.863 { o glu A 115 4bclA_114F_99G}-5.582 -0.112 -9.814 { c glu A 115 4bclA_114F_99G}P -6.169 0.976 -9.863 { n gly A 116 4bclA_114F_99G}-6.542 1.457 -11.048 { ca gly A 116 4bclA_114F_99G}-6.243 0.532 -12.117 { c gly A 116 4bclA_114F_99G}-6.285 1.232 -13.42 { o gly A 116 4bclA_114F_99G}-6.798 2.334 -13.639 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 97 4bclA_114F_99G}P -9.058 4.185 -13.296 { ca ala A 97 4bclA_114F_99G}P -10.039 4.3 -12.246 { n val A 98 4bclA_114F_99G}P -10.022 4.854 -9.922 { ca val A 98 4bclA_114F_99G}P -9.463 4.759 -8.603 { n gly A 99 4bclA_114F_99G}P -10.701 3.76 -6.782 { ca gly A 99 4bclA_114F_99G}P -11.874 3.764 -5.992 {"}P -11.874 3.764 -5.992 { n glu A 100 4bclA_114F_99G}P -12.823 2.811 -4.044 { ca glu A 100 4bclA_114F_99G}P -12.792 2.066 -2.825 { n gly A 101 4bclA_114F_99G}P -14.231 0.57 -1.597 { ca gly A 101 4bclA_114F_99G}P -15.588 0.11 -1.325 {"}P -15.588 0.11 -1.325 { n phe A 112 4bclA_114F_99G}P -11.839 -2.461 0.769 { ca phe A 112 4bclA_114F_99G}P -10.781 -2.472 -0.237 { n ser A 113 4bclA_114F_99G}P -9.522 -0.919 -1.562 { ca ser A 113 4bclA_114F_99G}P -9.32 0.246 -2.363 { n phe A 114 4bclA_114F_99G}P -8.57 0.598 -4.617 { ca phe A 114 4bclA_114F_99G}P -7.743 0.118 -5.694 { n glu A 115 4bclA_114F_99G}P -6.598 0.893 -7.544 { ca glu A 115 4bclA_114F_99G}P -6.379 1.842 -8.593 { n gly A 116 4bclA_114F_99G}P -6.542 1.457 -11.048 { ca gly A 116 4bclA_114F_99G}P -6.243 0.532 -12.117 {"}P -6.243 0.532 -12.117 @subgroup {mainchain} @vectorlist {Calphas} off color= blue alpha= 0.2353 { ca ala A 97 4bclA_114F_99G}P -10.039 4.3 -12.246 {"}-10.039 4.3 -12.246 { ca val A 98 4bclA_114F_99G}-9.463 4.759 -8.603 { ca gly A 99 4bclA_114F_99G}-11.874 3.764 -5.992 { ca glu A 100 4bclA_114F_99G}-12.792 2.066 -2.825 { ca gly A 101 4bclA_114F_99G}-15.588 0.11 -1.325 { ca phe A 112 4bclA_114F_99G}P -10.781 -2.472 -0.237 {"}-10.781 -2.472 -0.237 { ca ser A 113 4bclA_114F_99G}-9.32 0.246 -2.363 { ca phe A 114 4bclA_114F_99G}-7.743 0.118 -5.694 { ca glu A 115 4bclA_114F_99G}-6.379 1.842 -8.593 { ca gly A 116 4bclA_114F_99G}-6.243 0.532 -12.117 @subgroup {sidechain} @vectorlist {sc} off color= cyan master= {sidechain} { ca ala A 97 4bclA_114F_99G}P -10.039 4.3 -12.246 { ca val A 98 4bclA_114F_99G}P -9.463 4.759 -8.603 { ca glu A 100 4bclA_114F_99G}P -12.792 2.066 -2.825 { ca phe A 112 4bclA_114F_99G}P -10.781 -2.472 -0.237 { ca ser A 113 4bclA_114F_99G}P -9.32 0.246 -2.363 { ca phe A 114 4bclA_114F_99G}P -7.743 0.118 -5.694 { cb phe A 114 4bclA_114F_99G}-8.495 -1.025 -6.449 { cg phe A 114 4bclA_114F_99G}-9.762 -0.49 -7.102 { cd1 phe A 114 4bclA_114F_99G}-10.911 -0.357 -6.329 { ce1 phe A 114 4bclA_114F_99G}-12.089 0.167 -6.861 { cz phe A 114 4bclA_114F_99G}-12.073 0.569 -8.194 { cg phe A 114 4bclA_114F_99G}P -9.762 -0.49 -7.102 { cd2 phe A 114 4bclA_114F_99G}-9.77 -0.098 -8.447 { ce2 phe A 114 4bclA_114F_99G}-10.921 0.471 -8.989 { cz phe A 114 4bclA_114F_99G}ghost -12.073 0.569 -8.194 { ca glu A 115 4bclA_114F_99G}P -6.379 1.842 -8.593 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 114 4bclA_114F_99G}P -8.495 -1.025 -6.449 {"}P -8.495 -1.025 -6.449 { cd1 phe A 114 4bclA_114F_99G}P -10.911 -0.357 -6.329 { cd2 phe A 114 4bclA_114F_99G}P -9.77 -0.098 -8.447 { ce1 phe A 114 4bclA_114F_99G}P -12.089 0.167 -6.861 { ce2 phe A 114 4bclA_114F_99G}P -10.921 0.471 -8.989 { cz phe A 114 4bclA_114F_99G}P -12.073 0.569 -8.194 @subgroup {sidechain} @vectorlist {sc} color= blue alpha= 0.1765 master= {sidechain} { ca phe A 114 4bclA_114F_99G}P -7.743 0.118 -5.694 { cb phe A 114 4bclA_114F_99G}-8.495 -1.025 -6.449 { cg phe A 114 4bclA_114F_99G}-9.762 -0.49 -7.102 { cd1 phe A 114 4bclA_114F_99G}-10.911 -0.357 -6.329 { ce1 phe A 114 4bclA_114F_99G}-12.089 0.167 -6.861 { cz phe A 114 4bclA_114F_99G}-12.073 0.569 -8.194 { cg phe A 114 4bclA_114F_99G}P -9.762 -0.49 -7.102 { cd2 phe A 114 4bclA_114F_99G}-9.77 -0.098 -8.447 { ce2 phe A 114 4bclA_114F_99G}-10.921 0.471 -8.989 { cz phe A 114 4bclA_114F_99G}ghost -12.073 0.569 -8.194 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 114 4bclA_114F_99G}P -8.495 -1.025 -6.449 {"}P -8.495 -1.025 -6.449 { cd1 phe A 114 4bclA_114F_99G}P -10.911 -0.357 -6.329 { cd2 phe A 114 4bclA_114F_99G}P -9.77 -0.098 -8.447 { ce1 phe A 114 4bclA_114F_99G}P -12.089 0.167 -6.861 { ce2 phe A 114 4bclA_114F_99G}P -10.921 0.471 -8.989 { cz phe A 114 4bclA_114F_99G}P -12.073 0.569 -8.194 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 114 A}'P' blue -12.727 1.796 -6.921 {"}'P' sky -12.477 1.872 -6.917 {"}'P' blue -12.734 1.781 -6.66 {"}'P' sky -12.485 1.859 -6.656 { CZ PHE 114 A}'P' blue -12.584 2.086 -7.488 {"}'P' blue -12.336 2.147 -7.485 {"}'P' blue -12.081 2.169 -7.484 {"}'P' blue -12.755 1.883 -7.261 {"}'P' blue -12.517 1.979 -7.257 {"}'P' blue -12.266 2.033 -7.254 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 99 A}'P' blue -12.315 2.532 -7.333 {"}'P' blue -12.565 2.456 -7.336 {"}'P' blue -12.825 2.454 -7.336 {"}'P' blue -12.329 2.365 -7.118 {"}'P' blue -12.576 2.305 -7.121 {"}'P' blue -12.83 2.305 -7.121 {"}'P' sky -12.441 2.23 -6.877 {"}'P' blue -12.695 2.2 -6.878 {"}'P' sky -12.39 2.202 -6.617 {"}'P' sky -12.64 2.161 -6.619 {"}'P' blue -12.892 2.175 -6.618 {"}'P' blue -12.695 2.177 -6.358 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 114 A}'M' green -9.332 2.696 -7.287 {"}'M' green -9.232 2.929 -7.277 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 114 A}'M' greentint -9.477 2.43 -7.058 {"}'M' greentint -9.43 2.682 -7.047 {"}'M' greentint -9.337 2.92 -7.036 {"}'M' greentint -9.199 3.136 -7.027 {"}'M' greentint -9.53 2.3 -6.809 {"}'M' greentint -9.506 2.556 -6.798 {"}'M' greentint -9.436 2.803 -6.787 {"}'M' greentint -9.321 3.033 -6.777 {"}'M' greentint -9.166 3.238 -6.768 {"}'M' greentint -9.53 2.28 -6.551 {"}'M' greentint -9.508 2.536 -6.54 {"}'M' greentint -9.439 2.784 -6.529 {"}'M' greentint -9.326 3.015 -6.519 {"}'M' greentint -9.172 3.221 -6.51 {"}'M' greentint -9.476 2.405 -6.292 {"}'M' greentint -9.428 2.656 -6.281 {"}'M' greentint -9.333 2.894 -6.27 {"}'M' greentint -9.194 3.109 -6.261 {"}'M' greentint -9.334 2.634 -6.041 {"}'M' greentint -9.236 2.867 -6.03 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLY 99 A}'M' green -9.46 2.417 -7.126 {"}'M' green -9.523 2.242 -6.892 {"}'M' green -9.073 3.327 -6.845 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 99 A}'M' greentint -9.176 2.841 -7.107 {"}'M' greentint -9.286 2.607 -7.118 {"}'M' greentint -9.14 3.096 -7.096 {"}'M' greentint -9.073 2.828 -6.866 {"}'M' greentint -9.169 2.595 -6.877 {"}'M' greentint -9.323 2.395 -6.885 {"}'M' greentint -9.04 3.077 -6.856 {"}'M' greentint -9.035 2.825 -6.608 {"}'M' greentint -9.126 2.592 -6.618 {"}'M' greentint -9.272 2.388 -6.627 {"}'M' greentint -9.463 2.227 -6.634 {"}'M' greentint -9.039 3.322 -6.586 {"}'M' greentint -9.006 3.074 -6.597 {"}'M' greentint 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-7.6541 {"}'S' sky -11.9848 0.394 -8.2402 {"}'S' blue -12.14 0.2754 -8.408 {"}'S' blue -11.0868 0.4909 -7.498 {"}'S' sky -11.8569 0.4285 -8.4765 {"}'S' blue -12.0101 0.303 -8.6384 {"}'S' sky -10.5712 0.4545 -7.665 {"}'S' sky -11.5017 0.4295 -8.8593 {"}'S' sky -10.3632 0.4078 -7.8161 { CZ PHE 33 A}'S' blue -11.2424 0.4059 -9.2002 {"}'S' sky -10.9598 0.4812 -9.2464 {"}'S' sky -10.3349 0.3335 -8.8114 {"}'S' sky -10.7727 0.5157 -9.4274 {"}'S' sky -10.1499 0.3518 -9.0069 {"}'S' sky -10.2878 0.4428 -9.2094 {"}'S' blue -10.4369 0.4958 -9.4167 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 33 A}'S' sea -11.6637 0.5087 -7.8582 {"}'S' sea -11.8241 0.4725 -8.0555 {"}'S' sea -11.2293 0.5568 -7.7009 {"}'S' green -11.3812 0.5839 -7.9045 {"}'S' green -11.5388 0.5708 -8.105 {"}'S' green -11.6997 0.5182 -8.2974 {"}'S' sea -10.8906 0.5347 -7.6705 {"}'S' green -11.0374 0.5955 -7.8782 {"}'S' green -11.194 0.6185 -8.0855 {"}'S' green -11.3556 0.6011 -8.2904 {"}'S' green -11.5195 0.5444 -8.4861 {"}'S' sea -11.6807 0.4507 -8.6678 {"}'S' green -10.7091 0.5456 -7.8675 {"}'S' green -11.1773 0.5894 -8.4848 {"}'S' sea -11.3409 0.528 -8.6791 {"}'S' green -10.5003 0.4987 -8.0191 {"}'S' green -10.9683 0.5467 -8.6373 {"}'S' sea -11.1315 0.486 -8.8311 {"}'S' sea -10.288 0.4065 -8.1471 {"}'S' green -10.4357 0.466 -8.3539 {"}'S' green -10.5915 0.4875 -8.5616 {"}'S' green -10.7531 0.4686 -8.7662 {"}'S' sea -10.2278 0.3404 -8.4649 {"}'S' sea -10.3796 0.369 -8.6687 { CZ PHE 33 A}'S' sea -10.8079 0.454 -9.0428 {"}'S' sea -10.4693 0.432 -9.0124 {"}'S' sea -10.6161 0.4927 -9.2201 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 33 A}'S' P -10.8582 0.5986 -8.0748 {"}'S' -10.8587 0.5964 -8.075 {"}'S' P -11.0151 0.6129 -8.2823 {"}'S' -11.0161 0.5965 -8.2815 {"}'S' P -10.649 0.5525 -8.226 {"}'S' -10.6513 0.5433 -8.2254 {"}'S' P -10.8066 0.5697 -8.4334 {"}'S' -10.8107 0.5432 -8.4295 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ARG 20 A}'S' blue -11.9377 0.7822 -7.832 {"}'S' blue -11.7747 0.8189 -7.6313 {"}'S' sky -11.9506 0.7116 -8.2573 {"}'S' sky -11.468 0.7822 -7.6531 {"}'S' blue -11.3075 0.8799 -7.4732 {"}'S' sky -11.9 0.7226 -8.6299 {"}'S' sky -11.1084 0.8319 -7.6361 {"}'S' blue -11.7793 0.7725 -8.9154 {"}'S' blue -11.5215 0.7775 -8.9982 {"}'S' blue -11.3097 0.8492 -9.1352 { HB2 ARG 20 A}'S' sky -10.9115 0.8171 -7.7224 {"}'S' sky -10.3883 0.7167 -7.8611 {"}'S' sky -11.0042 0.7456 -9.0956 {"}'S' sky -10.8138 0.8489 -9.2896 {"}'S' sky -10.1196 0.6461 -8.3356 {"}'S' sky -10.474 0.7712 -9.1953 {"}'S' sky -10.3391 0.6763 -8.9944 {"}'S' sky -10.1833 0.6521 -8.7862 { HB3 ARG 20 A}'S' blue -12.3586 0.6562 -8.4076 {"}'S' blue -12.1992 0.6866 -8.2103 {"}'S' blue -12.1951 0.701 -8.6181 {"}'S' sky -12.0373 0.7179 -8.42 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ARG 20 A}'S' sea -11.7929 0.6971 -8.0504 {"}'S' sea -11.6308 0.7206 -7.8479 {"}'S' sea -11.7514 0.6688 -8.423 {"}'S' green 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-8.1958 {"}'S' P -10.8554 0.5242 -8.4112 {"}'S' -10.8509 0.5518 -8.4129 {"}'S' P -10.6999 0.5362 -8.2133 {"}'S' -10.6995 0.5501 -8.2159 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 33 A}'M' green -9.1962 1.953 -6.6438 {"}'M' green -9.1284 2.0351 -6.8962 {"}'M' green -8.5361 2.7409 -7.0903 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 33 A}'M' greentint -8.9031 2.3574 -5.9288 {"}'M' greentint -9.0517 2.2004 -6.0773 {"}'M' greentint -9.1555 2.1041 -6.3748 {"}'M' greentint -8.7539 2.5875 -5.991 {"}'M' greentint -8.9125 2.4943 -6.1694 {"}'M' greentint -9.0517 2.3264 -6.3026 {"}'M' greentint -9.1251 2.1981 -6.6196 {"}'M' greentint -8.5669 2.7766 -6.0589 {"}'M' greentint -8.7271 2.7184 -6.2508 {"}'M' greentint -8.8819 2.5953 -6.4155 {"}'M' greentint -9.0176 2.4178 -6.5417 {"}'M' greentint -9.0472 2.2783 -6.8578 {"}'M' greentint -8.4842 2.8966 -6.303 {"}'M' greentint -8.6462 2.8144 -6.4886 {"}'M' greentint -8.7985 2.6785 -6.6486 {"}'M' greentint -8.9351 2.4969 -6.7734 {"}'M' greentint -8.9327 2.3231 -7.0875 {"}'M' greentint -8.3893 2.9594 -6.5619 {"}'M' greentint -8.5451 2.8607 -6.7352 {"}'M' greentint -8.6913 2.7171 -6.8851 {"}'M' greentint -8.8221 2.5351 -7.0036 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 20 A}'M' greentint -9.0548 2.0135 -6.3054 {"}'M' greentint -8.9045 2.138 -6.1456 {"}'M' greentint -8.7714 2.3136 -6.0225 {"}'M' greentint -8.6662 2.5282 -5.9447 {"}'M' greentint -9.0042 2.011 -6.639 {"}'M' greentint -8.8435 2.087 -6.4521 {"}'M' greentint -8.694 2.2324 -6.2997 {"}'M' greentint -8.5694 2.4323 -6.1939 {"}'M' greentint -8.4808 2.6699 -6.1458 {"}'M' greentint -8.9105 2.1218 -6.8917 {"}'M' greentint -8.7482 2.1668 -6.6937 {"}'M' greentint -8.5939 2.2994 -6.532 {"}'M' greentint -8.4697 2.5027 -6.4274 {"}'M' greentint -8.3914 2.7484 -6.3953 {"}'M' greentint -8.7995 2.3053 -7.0621 {"}'M' greentint -8.6385 2.3334 -6.8621 {"}'M' greentint -8.4905 2.4853 -6.7133 {"}'M' greentint -8.3957 2.7194 -6.6559 {"}'M' greentint -8.666 2.5232 -7.1156 {"}'M' greentint -8.506 2.6201 -6.9362 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 33 A}'M' green -9.6109 0.8833 -4.4835 {"}'M' green -9.6798 0.6322 -4.9321 {"}'M' green -9.2329 1.6244 -4.6299 {"}'M' green -9.63 0.7067 -5.2314 {"}'M' green -9.1385 1.7168 -4.8774 {"}'M' green -9.4693 0.9887 -5.5016 {"}'M' green -9.1574 1.6187 -5.2739 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 33 A}'M' greentint -9.5559 1.1366 -4.4833 {"}'M' greentint -9.6663 1.0372 -4.7635 {"}'M' greentint -9.6826 0.7835 -4.7142 {"}'M' greentint -9.4235 1.4233 -4.5573 {"}'M' greentint -9.5715 1.2713 -4.7062 {"}'M' greentint -9.6381 1.1347 -5.0171 {"}'M' greentint -9.6885 0.88 -5.0125 {"}'M' greentint -9.3932 1.5333 -4.8128 {"}'M' greentint -9.5346 1.3628 -4.9483 {"}'M' greentint -9.5412 1.2089 -5.2572 {"}'M' greentint -9.6095 0.9599 -5.2748 {"}'M' greentint -9.2951 1.6047 -5.0488 {"}'M' greentint -9.4337 1.43 -5.1795 {"}'M' greentint -9.3958 1.2285 -5.4747 {"}'M' greentint -9.2906 1.4431 -5.397 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 20 A}'M' green -9.3679 1.4509 -4.4483 {"}'M' green -9.6878 0.6761 -5.0095 {"}'M' green -9.2303 1.7798 -4.725 {"}'M' green -9.368 1.2183 -5.513 {"}'M' green -9.2727 1.4546 -5.4555 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 20 A}'M' greentint -9.6609 0.7884 -4.6429 {"}'M' greentint -9.5389 0.985 -4.5399 {"}'M' greentint -9.4405 1.2099 -4.4739 {"}'M' greentint -9.5424 0.8378 -4.8665 {"}'M' greentint -9.4178 1.0402 -4.7629 {"}'M' greentint -9.3213 1.2733 -4.7031 {"}'M' greentint -9.2576 1.5251 -4.6905 {"}'M' greentint -9.6149 0.7566 -5.2547 {"}'M' greentint -9.4682 0.9062 -5.1071 {"}'M' greentint -9.3445 1.1059 -5.0024 {"}'M' greentint -9.2527 1.3401 -4.9491 {"}'M' greentint -9.2007 1.591 -4.9507 {"}'M' greentint -9.4994 0.9344 -5.4124 {"}'M' greentint -9.3609 1.1049 -5.2809 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{"}'S' P -11.7688 0.2594 -7.5587 {"}'S' -11.7586 0.3218 -7.5624 {"}'S' P -11.9175 0.4808 -8.2431 {"}'S' -11.8932 0.5457 -8.2007 {"}'S' P -11.8013 0.349 -8.0577 {"}'S' -11.7769 0.4623 -8.0109 {"}'S' P -11.6648 0.2677 -7.8576 {"}'S' -11.6546 0.3871 -7.8333 {"}'S' P -11.5124 0.2427 -7.6538 {"}'S' -11.5157 0.3136 -7.6524 {"}'S' P -11.7271 0.5841 -8.4371 {"}'S' -11.724 0.6044 -8.4169 {"}'S' P -11.6245 0.4313 -8.2621 {"}'S' -11.6205 0.5075 -8.2124 {"}'S' P -11.4961 0.3305 -8.0669 {"}'S' -11.503 0.4283 -8.0269 {"}'S' P -11.3488 0.2875 -7.8644 {"}'S' -11.3618 0.3554 -7.8497 {"}'S' P -11.3873 0.5064 -8.3428 {"}'S' -11.3907 0.5275 -8.3267 {"}'S' P -11.2524 0.4116 -8.1419 {"}'S' -11.2613 0.4399 -8.1264 {"}'S' P -11.1502 0.6193 -8.376 {"}'S' -11.1553 0.6298 -8.3667 {"}'S' P -11.013 0.5442 -8.1766 {"}'S' -11.018 0.5518 -8.1714 {HG21 THR 45 A}'S' P -13.7334 0.2725 -8.591 {"}'S' -13.7361 0.2876 -8.5879 {"}'S' P -13.637 0.3966 -8.8686 {"}'S' -13.6409 0.4103 -8.8617 {"}'S' P -13.4812 0.3724 -8.6604 {"}'S' -13.4921 0.3963 -8.6534 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 68 A}'M' greentint -9.0579 2.2142 -5.9863 {"}'M' greentint -9.2168 2.1255 -6.1679 {"}'M' greentint -9.3604 2.0177 -6.4404 {"}'M' greentint -8.9548 2.4467 -6.0353 {"}'M' greentint -9.1181 2.4134 -6.2371 {"}'M' greentint -9.2667 2.2565 -6.3856 {"}'M' greentint -9.3704 2.1601 -6.6831 {"}'M' greentint -9.4269 1.9106 -6.6863 {"}'M' greentint -8.8109 2.6519 -6.0973 {"}'M' greentint -8.9688 2.6435 -6.2993 {"}'M' greentint -9.1274 2.5504 -6.4777 {"}'M' greentint -9.2667 2.3824 -6.6109 {"}'M' greentint -9.34 2.2541 -6.9279 {"}'M' greentint -9.4112 2.009 -6.9521 {"}'M' greentint -8.7819 2.8326 -6.3671 {"}'M' greentint -8.9421 2.7744 -6.5591 {"}'M' greentint -9.0968 2.6513 -6.7238 {"}'M' greentint -9.2326 2.4738 -6.85 {"}'M' greentint -9.2621 2.3343 -7.1661 {"}'M' greentint -8.6991 2.9526 -6.6112 {"}'M' greentint -8.8612 2.8704 -6.7969 {"}'M' greentint -9.0134 2.7345 -6.9569 {"}'M' greentint -9.1501 2.5529 -7.0817 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 45 A}'M' greentint -9.1946 1.9942 -6.1315 {"}'M' greentint -9.0614 2.1698 -6.0084 {"}'M' greentint -9.2942 1.8673 -6.6249 {"}'M' greentint -9.1336 1.9432 -6.4381 {"}'M' greentint -8.984 2.0886 -6.2857 {"}'M' greentint -8.8595 2.2886 -6.1798 {"}'M' greentint -8.7709 2.5262 -6.1318 {"}'M' greentint -9.3493 2.0277 -7.0837 {"}'M' greentint -9.2005 1.9781 -6.8776 {"}'M' greentint -9.0382 2.023 -6.6797 {"}'M' greentint -8.884 2.1556 -6.5179 {"}'M' greentint -8.7597 2.3589 -6.4133 {"}'M' greentint -8.6814 2.6046 -6.3812 {"}'M' greentint -8.6605 2.86 -6.4245 {"}'M' greentint -9.2213 2.2633 -7.2462 {"}'M' greentint -9.0895 2.1616 -7.048 {"}'M' greentint -8.9285 2.1896 -6.8481 {"}'M' greentint -8.7805 2.3416 -6.6992 {"}'M' greentint -8.6857 2.5757 -6.6419 {"}'M' greentint -8.6694 2.8294 -6.6912 {"}'M' greentint -9.0602 2.5346 -7.2794 {"}'M' greentint -8.956 2.3794 -7.1016 {"}'M' greentint -8.7961 2.4763 -6.9221 {"}'M' greentint -8.7411 2.7296 -6.9219 {"}'M' greentint -8.8744 2.626 -7.1214 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 68 A}'M' greentint -10.1117 0.7771 -4.467 {"}'M' greentint -10.2449 0.6735 -4.6665 {"}'M' greentint -10.03 1.0237 -4.4868 {"}'M' greentint -10.19 0.9267 -4.6663 {"}'M' greentint -10.3004 0.8274 -4.9465 {"}'M' greentint -10.3167 0.5737 -4.8972 {"}'M' greentint -9.8965 1.2415 -4.5404 {"}'M' greentint -10.0575 1.2134 -4.7403 {"}'M' greentint -10.2056 1.0615 -4.8892 {"}'M' greentint -10.2721 0.9248 -5.2001 {"}'M' greentint -10.3225 0.6701 -5.1955 {"}'M' greentint -9.7081 1.4114 -4.607 {"}'M' greentint -9.867 1.4145 -4.8129 {"}'M' greentint -10.0272 1.3234 -4.9958 {"}'M' greentint -10.1687 1.1529 -5.1313 {"}'M' greentint -10.1752 0.9991 -5.4402 {"}'M' greentint -10.2435 0.7501 -5.4578 {"}'M' greentint -9.6112 1.5461 -4.8625 {"}'M' greentint -9.7726 1.5069 -5.0604 {"}'M' greentint -9.9292 1.3948 -5.2318 {"}'M' greentint -10.0678 1.2201 -5.3625 {"}'M' greentint -9.7915 1.4088 -5.4569 {"}'M' greentint -9.9246 1.2333 -5.58 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O THR 45 A}'M' green -10.0777 0.7 -4.3859 {"}'M' green -9.6175 1.5025 -4.6937 {"}'M' green -10.2321 0.739 -5.5337 @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 45 A}'M' greentint -10.2625 0.4774 -4.9259 {"}'M' greentint -10.1046 0.5877 -4.7525 {"}'M' greentint -9.9593 0.7494 -4.6095 {"}'M' greentint -9.8347 0.9518 -4.5059 {"}'M' greentint -9.7382 1.1849 -4.4461 {"}'M' greentint -10.1915 0.5795 -5.1787 {"}'M' greentint -10.0318 0.6681 -4.9977 {"}'M' greentint -9.8851 0.8177 -4.8501 {"}'M' greentint -9.7614 1.0175 -4.7454 {"}'M' greentint -9.6695 1.2516 -4.6921 {"}'M' greentint -10.0732 0.7501 -5.3328 {"}'M' greentint -9.9162 0.8459 -5.1554 {"}'M' greentint -9.7778 1.0165 -5.0239 {"}'M' greentint -9.6748 1.24 -4.953 {"}'M' greentint -9.6204 1.4897 -4.9527 {"}'M' greentint -10.0978 0.9469 -5.6094 {"}'M' greentint -9.9346 0.9761 -5.4068 {"}'M' greentint -9.7848 1.1298 -5.256 {"}'M' greentint -9.6896 1.3661 -5.1985 {"}'M' greentint -9.8264 1.274 -5.467 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 64 1ajkA_66F_206Y}P -11.3303 -1.0056 1.2721 {"}-11.3303 -1.0056 1.2721 { ca tyr A 64 1ajkA_66F_206Y}-10.7037 -1.7804 0.2376 { c tyr A 64 1ajkA_66F_206Y}-10.5764 -0.8591 -0.9829 { o tyr A 64 1ajkA_66F_206Y}-11.4915 -0.023 -1.2129 { c tyr A 64 1ajkA_66F_206Y}P -10.5764 -0.8591 -0.9829 { n ala A 65 1ajkA_66F_206Y}-9.5366 -1.0266 -1.8065 { ca ala A 65 1ajkA_66F_206Y}-9.4272 -0.0931 -2.9159 { c ala A 65 1ajkA_66F_206Y}-8.6631 -0.7579 -4.0438 { o ala A 65 1ajkA_66F_206Y}-7.8402 -1.6881 -3.8158 { c ala A 65 1ajkA_66F_206Y}P -8.6631 -0.7579 -4.0438 { n phe A 66 1ajkA_66F_206Y}-8.9171 -0.2325 -5.2354 { ca phe A 66 1ajkA_66F_206Y}-8.0145 -0.588 -6.3284 { c phe A 66 1ajkA_66F_206Y}-7.6791 0.6843 -7.1106 { o phe A 66 1ajkA_66F_206Y}-8.5406 1.5385 -7.3055 { c phe A 66 1ajkA_66F_206Y}P -7.6791 0.6843 -7.1106 { n asp A 67 1ajkA_66F_206Y}-6.3989 0.7762 -7.4426 { ca asp A 67 1ajkA_66F_206Y}-5.9397 1.8999 -8.295 { c asp A 67 1ajkA_66F_206Y}-5.7382 1.3433 -9.6647 { o asp A 67 1ajkA_66F_206Y}-4.9197 0.4503 -9.892 { c asp A 67 1ajkA_66F_206Y}P -5.7382 1.3433 -9.6647 { n trp A 68 1ajkA_66F_206Y}-6.5761 1.7954 -10.6551 { ca trp A 68 1ajkA_66F_206Y}-6.6181 1.2279 -11.9671 { c trp A 68 1ajkA_66F_206Y}-5.9833 2.2388 -12.9484 { o trp A 68 1ajkA_66F_206Y}-6.5249 3.3284 -13.0744 { n gly A 204 1ajkA_66F_206Y}P -8.2723 5.5371 -12.3083 {"}-8.2723 5.5371 -12.3083 { ca gly A 204 1ajkA_66F_206Y}-8.2994 6.3183 -11.0609 { c gly A 204 1ajkA_66F_206Y}-8.3438 5.3269 -9.8819 { o gly A 204 1ajkA_66F_206Y}-8.2451 4.089 -10.0523 { c gly A 204 1ajkA_66F_206Y}P -8.3438 5.3269 -9.8819 { n leu A 205 1ajkA_66F_206Y}-8.4773 5.8711 -8.6934 { ca leu A 205 1ajkA_66F_206Y}-8.4982 5.1154 -7.4677 { c leu A 205 1ajkA_66F_206Y}-9.9391 4.9331 -7.003 { o leu A 205 1ajkA_66F_206Y}-10.6559 5.9109 -6.7569 { c leu A 205 1ajkA_66F_206Y}P -9.9391 4.9331 -7.003 { n tyr A 206 1ajkA_66F_206Y}-10.3559 3.6688 -6.8348 { ca tyr A 206 1ajkA_66F_206Y}-11.6754 3.3264 -6.3112 { c tyr A 206 1ajkA_66F_206Y}-11.5976 2.7746 -4.9015 { o tyr A 206 1ajkA_66F_206Y}-10.8021 1.8341 -4.6591 { c tyr A 206 1ajkA_66F_206Y}P -11.5976 2.7746 -4.9015 { n glu A 207 1ajkA_66F_206Y}-12.2639 3.4231 -3.9437 { ca glu A 207 1ajkA_66F_206Y}-12.1817 3.0291 -2.5556 { c glu A 207 1ajkA_66F_206Y}-13.6047 2.7481 -2.0729 { o glu A 207 1ajkA_66F_206Y}-14.5339 3.4797 -2.4163 { c glu A 207 1ajkA_66F_206Y}P -13.6047 2.7481 -2.0729 { n val A 208 1ajkA_66F_206Y}-13.693 1.7166 -1.2166 { ca val A 208 1ajkA_66F_206Y}-14.9958 1.4301 -0.6147 { c val A 208 1ajkA_66F_206Y}-14.7822 1.0624 0.8224 { o val A 208 1ajkA_66F_206Y}-13.7748 0.3795 1.0463 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 64 1ajkA_66F_206Y}P -11.3303 -1.0056 1.2721 { ca tyr A 64 1ajkA_66F_206Y}P -10.7037 -1.7804 0.2376 { n ala A 65 1ajkA_66F_206Y}P -9.5366 -1.0266 -1.8065 { ca ala A 65 1ajkA_66F_206Y}P -9.4272 -0.0931 -2.9159 { n phe A 66 1ajkA_66F_206Y}P -8.9171 -0.2325 -5.2354 { ca phe A 66 1ajkA_66F_206Y}P -8.0145 -0.588 -6.3284 { n asp A 67 1ajkA_66F_206Y}P -6.3989 0.7762 -7.4426 { ca asp A 67 1ajkA_66F_206Y}P -5.9397 1.8999 -8.295 { n trp A 68 1ajkA_66F_206Y}P -6.5761 1.7954 -10.6551 { ca trp A 68 1ajkA_66F_206Y}P -6.6181 1.2279 -11.9671 { n gly A 204 1ajkA_66F_206Y}P -8.2723 5.5371 -12.3083 { ca gly A 204 1ajkA_66F_206Y}P -8.2994 6.3183 -11.0609 {"}P -8.2994 6.3183 -11.0609 { n leu A 205 1ajkA_66F_206Y}P -8.4773 5.8711 -8.6934 { ca leu A 205 1ajkA_66F_206Y}P -8.4982 5.1154 -7.4677 { n tyr A 206 1ajkA_66F_206Y}P -10.3559 3.6688 -6.8348 { ca tyr A 206 1ajkA_66F_206Y}P -11.6754 3.3264 -6.3112 { n glu A 207 1ajkA_66F_206Y}P -12.2639 3.4231 -3.9437 { ca glu A 207 1ajkA_66F_206Y}P -12.1817 3.0291 -2.5556 { n val A 208 1ajkA_66F_206Y}P -13.693 1.7166 -1.2166 { ca val A 208 1ajkA_66F_206Y}P -14.9958 1.4301 -0.6147 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 64 1ajkA_66F_206Y}P -10.7037 -1.7804 0.2376 {"}-10.7037 -1.7804 0.2376 { ca ala A 65 1ajkA_66F_206Y}-9.4272 -0.0931 -2.9159 { ca phe A 66 1ajkA_66F_206Y}-8.0145 -0.588 -6.3284 { ca asp A 67 1ajkA_66F_206Y}-5.9397 1.8999 -8.295 { ca trp A 68 1ajkA_66F_206Y}-6.6181 1.2279 -11.9671 { ca gly A 204 1ajkA_66F_206Y}P -8.2994 6.3183 -11.0609 {"}-8.2994 6.3183 -11.0609 { ca leu A 205 1ajkA_66F_206Y}-8.4982 5.1154 -7.4677 { ca tyr A 206 1ajkA_66F_206Y}-11.6754 3.3264 -6.3112 { ca glu A 207 1ajkA_66F_206Y}-12.1817 3.0291 -2.5556 { ca val A 208 1ajkA_66F_206Y}-14.9958 1.4301 -0.6147 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 66 1ajkA_66F_206Y}P -8.0145 -0.588 -6.3284 { cb phe A 66 1ajkA_66F_206Y}-8.4913 -1.6741 -7.2926 { cg phe A 66 1ajkA_66F_206Y}-9.8895 -1.6044 -7.8662 { cd1 phe A 66 1ajkA_66F_206Y}-10.1526 -0.8166 -8.9918 { ce1 phe A 66 1ajkA_66F_206Y}-11.4531 -0.7291 -9.4751 { cz phe A 66 1ajkA_66F_206Y}-12.4496 -1.4102 -8.8617 { cg phe A 66 1ajkA_66F_206Y}P -9.8895 -1.6044 -7.8662 { cd2 phe A 66 1ajkA_66F_206Y}-10.9161 -2.2805 -7.2729 { ce2 phe A 66 1ajkA_66F_206Y}-12.1982 -2.2258 -7.7782 { cz phe A 66 1ajkA_66F_206Y}ghost -12.4496 -1.4102 -8.8617 { ca tyr A 206 1ajkA_66F_206Y}P -11.6754 3.3264 -6.3112 { cb tyr A 206 1ajkA_66F_206Y}-12.1983 2.2261 -7.2738 { cg tyr A 206 1ajkA_66F_206Y}-12.4632 2.6043 -8.7167 { cd1 tyr A 206 1ajkA_66F_206Y}-11.4341 2.8551 -9.6521 { ce1 tyr A 206 1ajkA_66F_206Y}-11.6852 3.1948 -10.9494 { cz tyr A 206 1ajkA_66F_206Y}-13.0131 3.3341 -11.3453 { oh tyr A 206 1ajkA_66F_206Y}-13.3064 3.6651 -12.6575 { cg tyr A 206 1ajkA_66F_206Y}P -12.4632 2.6043 -8.7167 { cd2 tyr A 206 1ajkA_66F_206Y}-13.7829 2.727 -9.142 { ce2 tyr A 206 1ajkA_66F_206Y}-14.0616 3.0861 -10.4628 { cz tyr A 206 1ajkA_66F_206Y}ghost -13.0131 3.3341 -11.3453 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 66 1ajkA_66F_206Y}P -8.4913 -1.6741 -7.2926 {"}P -8.4913 -1.6741 -7.2926 { cd1 phe A 66 1ajkA_66F_206Y}P -10.1526 -0.8166 -8.9918 { cd2 phe A 66 1ajkA_66F_206Y}P -10.9161 -2.2805 -7.2729 { ce1 phe A 66 1ajkA_66F_206Y}P -11.4531 -0.7291 -9.4751 { ce2 phe A 66 1ajkA_66F_206Y}P -12.1982 -2.2258 -7.7782 { cz phe A 66 1ajkA_66F_206Y}P -12.4496 -1.4102 -8.8617 { cb tyr A 206 1ajkA_66F_206Y}P -12.1983 2.2261 -7.2738 {"}P -12.1983 2.2261 -7.2738 { cd1 tyr A 206 1ajkA_66F_206Y}P -11.4341 2.8551 -9.6521 { cd2 tyr A 206 1ajkA_66F_206Y}P -13.7829 2.727 -9.142 { ce1 tyr A 206 1ajkA_66F_206Y}P -11.6852 3.1948 -10.9494 { ce2 tyr A 206 1ajkA_66F_206Y}P -14.0616 3.0861 -10.4628 { oh tyr A 206 1ajkA_66F_206Y}P -13.3064 3.6651 -12.6575 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 66 A}'S' blue -10.9688 -0.0535 -7.6447 {"}'S' sky -11.0741 0.1077 -7.8254 {"}'S' sky -10.8086 0.1962 -7.7238 {"}'S' blue 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-11.2169 0.9349 -8.9871 {"}'S' blue -12.007 0.8508 -9.9844 {"}'S' sky -11.0354 0.9458 -9.184 {"}'S' sky -10.8267 0.8989 -9.3357 {"}'S' sky -11.4578 0.8862 -10.1476 {"}'S' sky -10.762 0.8662 -9.6705 {"}'S' sky -10.9178 0.8876 -9.8781 {"}'S' sky -11.0795 0.8688 -10.0828 {"}'S' blue -11.2429 0.8115 -10.2778 { CZ PHE 66 A}'S' blue -12.2817 0.107 -8.0062 {"}'S' blue -12.4097 0.2099 -8.2012 { HE1 PHE 66 A}'S' blue -11.9512 0.8292 -10.1477 {"}'S' sky -11.6687 0.8794 -10.1968 {"}'S' blue -11.823 0.8802 -10.3959 {"}'S' blue -11.4797 0.8733 -10.3797 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 66 A}'S' sea -10.9275 0.3229 -7.9135 {"}'S' sea -11.0703 0.3894 -8.117 {"}'S' sea -10.7282 0.4833 -7.9716 {"}'S' sea -10.8705 0.5536 -8.1735 { CE1 PHE 66 A}'S' sea -12.1709 0.6411 -8.6569 {"}'S' sea -12.3252 0.6588 -8.8615 {"}'S' sea -11.505 0.1949 -7.99 {"}'S' sea -11.5769 0.3949 -8.139 {"}'S' sea -11.6758 0.5605 -8.3137 {"}'S' sea -11.9379 0.7678 -8.709 {"}'S' green -12.0909 0.802 -8.9174 {"}'S' green -12.2519 0.787 -9.1204 {"}'S' sea -12.4147 0.7244 -9.3133 {"}'S' sea -11.2607 0.2755 -8.0556 {"}'S' sea -11.3356 0.4703 -8.2059 {"}'S' sea -11.4333 0.6342 -8.3785 {"}'S' sea -11.6862 0.8535 -8.7657 {"}'S' green -11.8342 0.9033 -8.9707 {"}'S' green -11.9901 0.9089 -9.1748 {"}'S' green -12.1505 0.8727 -9.3721 {"}'S' sea -11.0792 0.4814 -8.2681 {"}'S' sea -11.1725 0.6504 -8.4359 {"}'S' sea -11.5556 0.957 -9.0175 {"}'S' green -11.7075 0.9841 -9.221 {"}'S' green -11.8652 0.971 -9.4216 {"}'S' sea -12.026 0.9184 -9.614 {"}'S' sea -11.3637 0.9957 -9.1947 {"}'S' green -11.5204 1.0187 -9.4021 {"}'S' green -11.6819 1.0012 -9.607 {"}'S' sea -11.8458 0.9446 -9.8027 {"}'S' green -11.1845 0.9988 -9.3914 {"}'S' green -11.3414 1.0131 -9.5988 {"}'S' green -11.5036 0.9896 -9.8014 {"}'S' sea -11.6672 0.9282 -9.9956 {"}'S' sea -10.9753 0.9526 -9.5426 {"}'S' sea -11.1329 0.9699 -9.75 {"}'S' sea -11.2947 0.9469 -9.9538 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 206 A}'S' blue -12.3704 0.7121 -8.1357 {"}'S' blue -12.242 0.6086 -7.94 {"}'S' sky -12.1572 0.789 -8.2719 {"}'S' sky -12.0302 0.6803 -8.077 {"}'S' sky -11.9207 0.8716 -8.347 {"}'S' sky -11.6823 0.9777 -8.3854 { CG TYR 206 A}'S' blue -12.5795 0.8618 -8.5992 {"}'S' sky -12.6226 0.9034 -9.0948 {"}'S' sky -12.147 0.8999 -8.4799 {"}'S' sky -12.5069 0.9868 -9.3829 {"}'S' blue -12.422 1.1671 -9.7148 {"}'S' sky -11.5219 1.1391 -8.5431 {"}'S' blue -12.1856 1.2498 -9.7899 {"}'S' sky -11.4267 1.1971 -8.7936 { CD1 TYR 206 A}'S' sky -12.056 1.2247 -9.7847 {"}'S' blue -11.9938 1.2745 -10.152 {"}'S' sky -11.8563 1.1827 -9.95 {"}'S' blue -11.0647 1.292 -8.9562 {"}'S' sky -11.7355 1.2326 -10.2354 {"}'S' sky -10.9552 1.2264 -9.2255 {"}'S' blue -11.4778 1.2376 -10.3183 {"}'S' sky -11.3366 1.1707 -10.117 {"}'S' sky -10.8663 1.2051 -9.5196 {"}'S' blue -10.7083 1.2936 -9.3392 {"}'S' blue -11.124 1.2412 -10.2526 {"}'S' sky -10.9712 1.2142 -10.0479 {"}'S' sky -10.8122 1.2311 -9.8464 { HB2 TYR 206 A}'S' sky -11.9029 0.6484 -8.0546 {"}'S' sky -11.8152 0.4723 -7.8912 {"}'S' sky -11.699 0.3405 -7.7057 {"}'S' sky -11.3938 0.322 -7.715 {"}'S' blue -11.2466 0.279 -7.5124 {"}'S' sky -10.9943 0.3788 -7.5818 {"}'S' blue -10.8311 0.4277 -7.3852 {"}'S' sky -11.2056 0.9748 -8.3278 {"}'S' sky -10.7544 0.5465 -7.6254 {"}'S' blue -10.9608 1.0421 -8.2616 {"}'S' sky -10.893 0.8336 -8.1162 {"}'S' sky -10.5961 0.7595 -7.7122 {"}'S' blue -10.6347 0.9564 -7.9603 @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 206 A}'S' sea -12.4702 0.8625 -8.8875 {"}'S' sea -12.3108 0.8618 -8.6797 {"}'S' sea -12.3657 0.9199 -9.1815 {"}'S' green -12.2134 0.8921 -8.9773 {"}'S' green -12.0558 0.9039 -8.7765 {"}'S' sea -11.8955 0.9542 -8.5842 {"}'S' sea -12.2951 1.0584 -9.5199 {"}'S' green -12.1531 0.9904 -9.3172 {"}'S' green -11.9999 0.9642 -9.1121 {"}'S' green -11.8413 0.9803 -8.9109 {"}'S' sea -11.6799 1.0392 -8.7191 {"}'S' sea -12.0544 1.1445 -9.5916 {"}'S' green -11.9079 1.0857 -9.3849 {"}'S' green -11.7502 1.074 -9.1785 {"}'S' sea -11.588 1.112 -8.9793 { CD1 TYR 206 A}'S' sea -11.9069 1.1717 -9.5774 {"}'S' green -11.7077 1.1289 -9.7431 {"}'S' green -11.5504 1.1126 -9.5346 {"}'S' green -11.3883 1.1347 -9.3318 {"}'S' sea -11.2259 1.1955 -9.1374 {"}'S' sea -11.5935 1.1542 -10.0302 {"}'S' green -11.4411 1.1133 -9.8229 {"}'S' green -11.2817 1.1127 -9.6151 {"}'S' sea -11.1179 1.1507 -9.4153 {"}'S' sea -11.1843 1.1429 -9.9127 {"}'S' sea -11.0267 1.1547 -9.7119 { HB2 TYR 206 A}'S' sea -11.6959 0.7719 -8.2306 {"}'S' sea -11.6249 0.5756 -8.0852 {"}'S' sea -11.5223 0.4228 -7.9102 {"}'S' sea -11.4532 0.8655 -8.3115 {"}'S' sea -11.3887 0.6566 -8.1688 {"}'S' sea -11.285 0.4979 -7.9909 {"}'S' sea -11.1501 0.403 -7.79 {"}'S' sea -11.1505 0.7635 -8.1992 {"}'S' sea -11.0479 0.6107 -8.0241 {"}'S' sea -10.9108 0.5357 -7.8247 {"}'S' sea -10.7596 0.7309 -7.9156 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 66 A}'M' greentint -9.4507 2.2522 -6.5165 {"}'M' greentint -9.614 2.2188 -6.7184 {"}'M' greentint -9.7626 2.0619 -6.8669 {"}'M' greentint -9.8663 1.9655 -7.1644 {"}'M' greentint -9.3068 2.4573 -6.5786 {"}'M' greentint -9.4647 2.4489 -6.7806 {"}'M' greentint -9.6233 2.3558 -6.959 {"}'M' greentint -9.7626 2.1878 -7.0921 {"}'M' greentint -9.8359 2.0596 -7.4092 {"}'M' greentint -9.1216 2.6274 -6.6445 {"}'M' greentint -9.2778 2.6381 -6.8484 {"}'M' greentint -9.4379 2.5798 -7.0404 {"}'M' greentint -9.5927 2.4568 -7.2051 {"}'M' greentint -9.7285 2.2792 -7.3312 {"}'M' greentint -9.758 2.1398 -7.6474 {"}'M' greentint -8.8816 2.7456 -6.6835 {"}'M' greentint -9.0345 2.7815 -6.8905 {"}'M' greentint -9.195 2.758 -7.0925 {"}'M' greentint -9.3571 2.6759 -7.2782 {"}'M' greentint -9.5093 2.5399 -7.4381 {"}'M' greentint -9.646 2.3583 -7.5629 {"}'M' greentint -8.941 2.872 -7.1593 {"}'M' greentint -9.1002 2.8209 -7.3515 {"}'M' greentint -9.256 2.7221 -7.5248 {"}'M' greentint -9.4021 2.5786 -7.6747 {"}'M' greentint -9.5329 2.3966 -7.7931 {"}'M' greentint -8.9434 2.8553 -7.5569 {"}'M' greentint -9.1003 2.7494 -7.73 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 206 A}'M' greentint -9.7517 1.9249 -6.7404 {"}'M' greentint -9.5967 2.0221 -6.5679 {"}'M' greentint -9.7953 1.8856 -7.2148 {"}'M' greentint -9.641 1.8849 -7.0157 {"}'M' greentint -9.4828 1.9486 -6.8294 {"}'M' greentint -9.3325 2.073 -6.6696 {"}'M' greentint -9.1994 2.2486 -6.5465 {"}'M' greentint -9.0942 2.4633 -6.4687 {"}'M' greentint -9.7318 2.0169 -7.5698 {"}'M' greentint -9.5904 1.9438 -7.3667 {"}'M' greentint -9.4322 1.9461 -7.163 {"}'M' greentint -9.2715 2.022 -6.9761 {"}'M' greentint -9.122 2.1674 -6.8237 {"}'M' greentint -8.9974 2.3674 -6.7179 {"}'M' greentint -8.9088 2.6049 -6.6699 {"}'M' greentint -9.6033 2.2435 -7.81 {"}'M' greentint -9.4873 2.1065 -7.6218 {"}'M' greentint -9.3385 2.0569 -7.4157 {"}'M' greentint -9.1762 2.1018 -7.2177 {"}'M' greentint -9.0219 2.2344 -7.056 {"}'M' greentint -8.8977 2.4377 -6.9514 {"}'M' greentint -8.8194 2.6834 -6.9193 {"}'M' greentint -9.3593 2.3421 -7.7843 {"}'M' greentint -9.2275 2.2404 -7.5861 {"}'M' greentint -9.0665 2.2684 -7.3861 {"}'M' greentint -8.9185 2.4204 -7.2373 {"}'M' greentint -8.8237 2.6545 -7.1799 {"}'M' greentint -8.8074 2.9082 -7.2292 {"}'M' greentint -9.1982 2.6134 -7.8175 {"}'M' greentint -9.094 2.4582 -7.6396 {"}'M' greentint -8.934 2.5551 -7.4602 {"}'M' greentint -8.8791 2.8084 -7.46 {"}'M' greentint -9.0123 2.7048 -7.6595 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 66 A}'M' greentint -10.4501 0.554 -4.858 {"}'M' greentint -10.2642 0.6454 -4.7 {"}'M' greentint -10.3684 0.8005 -4.8779 {"}'M' greentint -10.5284 0.7036 -5.0573 {"}'M' greentint -10.0365 0.7113 -4.5902 {"}'M' greentint -10.1031 0.9166 -4.7332 {"}'M' greentint -10.2349 1.0184 -4.9314 {"}'M' greentint -10.3959 0.9903 -5.1314 {"}'M' greentint -10.5439 0.8384 -5.2802 {"}'M' greentint -9.8184 0.9189 -4.6283 {"}'M' greentint -9.9116 1.0934 -4.7971 {"}'M' greentint -10.0465 1.1882 -4.998 {"}'M' greentint -10.2053 1.1914 -5.2039 {"}'M' greentint -10.3656 1.1003 -5.3868 {"}'M' greentint -10.507 0.9298 -5.5224 {"}'M' greentint -9.6697 1.1783 -4.8517 {"}'M' greentint -9.7979 1.2875 -5.0484 {"}'M' greentint -9.9496 1.3229 -5.2535 {"}'M' greentint -10.1109 1.2838 -5.4514 {"}'M' greentint -10.2675 1.1717 -5.6228 {"}'M' greentint -9.6671 1.3732 -5.3027 {"}'M' greentint -9.8214 1.3739 -5.5018 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 206 A}'M' green -10.6357 0.5199 -5.1126 {"}'M' green -10.3267 0.5179 -4.7137 {"}'M' green -10.2726 1.1444 -5.7568 {"}'M' green -9.5765 1.1911 -4.869 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 206 A}'M' greentint -10.4847 0.494 -4.9104 {"}'M' greentint -10.5273 0.6642 -5.3767 {"}'M' greentint -10.381 0.6009 -5.1709 {"}'M' greentint -10.2238 0.5963 -4.9652 {"}'M' greentint -10.0612 0.652 -4.7711 {"}'M' greentint -9.9034 0.7622 -4.5976 {"}'M' greentint -10.4231 0.8912 -5.6227 {"}'M' greentint -10.2975 0.7787 -5.4288 {"}'M' greentint -10.1495 0.7317 -5.2243 {"}'M' greentint -9.9903 0.7541 -5.0238 {"}'M' greentint -9.8306 0.8427 -4.8428 {"}'M' greentint -9.6839 0.9923 -4.6952 {"}'M' greentint -10.1692 0.9905 -5.5803 {"}'M' greentint -10.0309 0.9136 -5.3788 {"}'M' greentint -9.872 0.9246 -5.1779 {"}'M' greentint -9.715 1.0205 -5.0006 {"}'M' greentint -10.0295 1.225 -5.6548 {"}'M' greentint -9.8965 1.1215 -5.4546 {"}'M' greentint -9.7334 1.1507 -5.2519 {"}'M' greentint -9.5836 1.3044 -5.1011 {"}'M' greentint -9.7839 1.3513 -5.4898 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 7 1ajkA_9F_97M}P -12.4623 -2.7223 -0.4489 {"}-12.4623 -2.7223 -0.4489 { ca ser A 7 1ajkA_9F_97M}-11.1743 -2.514 -1.1233 { c ser A 7 1ajkA_9F_97M}-10.8449 -1.0227 -1.2613 { o ser A 7 1ajkA_9F_97M}-11.6479 -0.1357 -1.1514 { c ser A 7 1ajkA_9F_97M}P -10.8449 -1.0227 -1.2613 { n phe A 8 1ajkA_9F_97M}-9.5603 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-6.3967 {"}'M' greentint -8.7672 3.2343 -6.5823 {"}'M' greentint -8.9194 3.0984 -6.7423 {"}'M' greentint -9.0561 2.9168 -6.8671 {"}'M' greentint -9.0536 2.743 -7.1812 {"}'M' greentint -8.5103 3.3793 -6.6556 {"}'M' greentint -8.6661 3.2806 -6.829 {"}'M' greentint -8.8123 3.137 -6.9789 {"}'M' greentint -8.943 2.955 -7.0973 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H MET 97 A}'M' greentint -9.2307 2.2646 -6.3981 {"}'M' greentint -9.0725 2.3283 -6.2118 {"}'M' greentint -8.9223 2.4527 -6.052 {"}'M' greentint -8.7892 2.6283 -5.9289 {"}'M' greentint -8.6839 2.843 -5.8512 {"}'M' greentint -9.1802 2.3235 -6.7492 {"}'M' greentint -9.022 2.3258 -6.5454 {"}'M' greentint -8.8613 2.4017 -6.3586 {"}'M' greentint -8.7118 2.5471 -6.2062 {"}'M' greentint -8.5872 2.7471 -6.1003 {"}'M' greentint -8.4986 2.9847 -6.0523 {"}'M' greentint -8.4541 3.2394 -6.065 {"}'M' greentint -9.077 2.4862 -7.0042 {"}'M' greentint -8.9283 2.4366 -6.7981 {"}'M' greentint -8.7659 2.4815 -6.6002 {"}'M' greentint -8.6117 2.6141 -6.4384 {"}'M' greentint -8.4875 2.8174 -6.3338 {"}'M' greentint -8.4092 3.0631 -6.3017 {"}'M' greentint -8.3882 3.3185 -6.345 {"}'M' greentint -8.949 2.7218 -7.1667 {"}'M' greentint -8.8173 2.6201 -6.9685 {"}'M' greentint -8.6563 2.6481 -6.7686 {"}'M' greentint -8.5082 2.8001 -6.6197 {"}'M' greentint -8.4134 3.0342 -6.5624 {"}'M' greentint -8.3971 3.2879 -6.6117 {"}'M' greentint -8.788 2.9931 -7.1999 {"}'M' greentint -8.6838 2.8379 -7.0221 {"}'M' greentint -8.5238 2.9348 -6.8426 {"}'M' greentint -8.4689 3.1881 -6.8424 {"}'M' greentint -8.6021 3.0845 -7.0419 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 9 A}'M' greentint -9.6532 1.4986 -3.9914 {"}'M' greentint -9.7865 1.395 -4.1909 {"}'M' greentint -9.5716 1.7452 -4.0113 {"}'M' greentint -9.7315 1.6483 -4.1907 {"}'M' greentint -9.8419 1.5489 -4.471 {"}'M' greentint -9.8582 1.2952 -4.4217 {"}'M' greentint -9.4381 1.963 -4.0648 {"}'M' greentint -9.5991 1.935 -4.2648 {"}'M' greentint -9.7471 1.783 -4.4136 {"}'M' greentint -9.8137 1.6463 -4.7246 {"}'M' greentint -9.8641 1.3917 -4.72 {"}'M' greentint -9.8554 1.1438 -4.6395 {"}'M' greentint -9.4085 2.136 -4.3373 {"}'M' greentint -9.5688 2.045 -4.5202 {"}'M' greentint -9.7102 1.8745 -4.6558 {"}'M' greentint -9.7168 1.7206 -4.9646 {"}'M' greentint -9.7851 1.4716 -4.9823 {"}'M' greentint -9.8056 1.2184 -4.9388 {"}'M' greentint -9.3141 2.2284 -4.5848 {"}'M' greentint -9.4707 2.1164 -4.7562 {"}'M' greentint -9.6093 1.9417 -4.8869 {"}'M' greentint -9.5714 1.7401 -5.1822 {"}'M' greentint -9.6449 1.5003 -5.2091 {"}'M' greentint -9.333 2.1304 -4.9813 {"}'M' greentint -9.4662 1.9548 -5.1044 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O MET 97 A}'M' greentint -9.8156 1.1288 -4.351 {"}'M' greentint -9.6753 1.2908 -4.215 {"}'M' greentint -9.5533 1.4874 -4.112 {"}'M' greentint -9.4549 1.7122 -4.046 {"}'M' greentint -9.3823 1.9532 -4.0205 {"}'M' greentint -9.7022 1.1784 -4.5816 {"}'M' greentint -9.5568 1.3401 -4.4386 {"}'M' greentint -9.4322 1.5425 -4.335 {"}'M' greentint -9.3357 1.7757 -4.2752 {"}'M' greentint -9.272 2.0274 -4.2626 {"}'M' greentint -9.6293 1.2589 -4.8268 {"}'M' greentint -9.4826 1.4085 -4.6792 {"}'M' greentint -9.3589 1.6082 -4.5745 {"}'M' greentint -9.267 1.8424 -4.5212 {"}'M' greentint -9.2151 2.0933 -4.5228 {"}'M' greentint -9.6708 1.3408 -5.1619 {"}'M' greentint -9.5138 1.4367 -4.9846 {"}'M' greentint -9.3753 1.6073 -4.853 {"}'M' greentint -9.2724 1.8307 -4.7822 {"}'M' greentint -9.2179 2.0805 -4.7819 {"}'M' greentint -9.5322 1.5669 -5.2359 {"}'M' greentint -9.3824 1.7206 -5.0851 {"}'M' greentint -9.2871 1.9569 -5.0276 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 83 1b5fA_101F_85S}P -6.1485 5.9865 -11.1657 {"}-6.1485 5.9865 -11.1657 { ca phe A 83 1b5fA_101F_85S}-6.8073 6.5706 -10.0292 { c phe A 83 1b5fA_101F_85S}-7.3447 5.4602 -9.1107 { o phe A 83 1b5fA_101F_85S}-7.6109 4.3474 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1b5fA_101F_85S}-6.3896 0.9127 -9.7082 { o ile A 102 1b5fA_101F_85S}-6.0882 -0.2488 -9.9727 { c ile A 102 1b5fA_101F_85S}P -6.3896 0.9127 -9.7082 { n glu A 103 1b5fA_101F_85S}-7.2174 1.6444 -10.4547 { ca glu A 103 1b5fA_101F_85S}-7.5265 1.1182 -11.7874 { c glu A 103 1b5fA_101F_85S}-6.6154 1.9017 -12.7256 { o glu A 103 1b5fA_101F_85S}-6.6867 3.1213 -12.8006 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 83 1b5fA_101F_85S}P -6.1485 5.9865 -11.1657 { ca phe A 83 1b5fA_101F_85S}P -6.8073 6.5706 -10.0292 { n phe A 84 1b5fA_101F_85S}P -7.4805 5.8067 -7.8409 { ca phe A 84 1b5fA_101F_85S}P -8.1079 4.9556 -6.8739 { n ser A 85 1b5fA_101F_85S}P -10.0935 3.6471 -6.8146 { ca ser A 85 1b5fA_101F_85S}P -11.492 3.272 -6.7316 { n gln A 86 1b5fA_101F_85S}P -12.9383 2.165 -5.1251 { ca gln A 86 1b5fA_101F_85S}P -13.2393 1.2383 -4.0468 { n asp A 87 1b5fA_101F_85S}P -14.0008 -1.0625 -4.1489 { ca asp A 87 1b5fA_101F_85S}P -14.9911 -2.1081 -4.3939 { n gln A 99 1b5fA_101F_85S}P -12.4659 -2.3059 -0.4172 { ca gln A 99 1b5fA_101F_85S}P -11.0455 -2.3477 -0.7375 { n asp A 100 1b5fA_101F_85S}P -9.7413 -0.4279 -1.389 { ca asp A 100 1b5fA_101F_85S}P -9.2398 0.5432 -2.3573 { n phe A 101 1b5fA_101F_85S}P -8.2532 0.273 -4.5494 { ca phe A 101 1b5fA_101F_85S}P -7.2474 -0.1963 -5.4975 { n ile A 102 1b5fA_101F_85S}P -5.9833 0.7196 -7.3162 { ca ile A 102 1b5fA_101F_85S}P -5.8271 1.6027 -8.468 { n glu A 103 1b5fA_101F_85S}P -7.2174 1.6444 -10.4547 { ca glu A 103 1b5fA_101F_85S}P -7.5265 1.1182 -11.7874 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 83 1b5fA_101F_85S}P -6.8073 6.5706 -10.0292 {"}-6.8073 6.5706 -10.0292 { ca phe A 84 1b5fA_101F_85S}-8.1079 4.9556 -6.8739 { ca ser A 85 1b5fA_101F_85S}-11.492 3.272 -6.7316 { ca gln A 86 1b5fA_101F_85S}-13.2393 1.2383 -4.0468 { ca asp A 87 1b5fA_101F_85S}-14.9911 -2.1081 -4.3939 { ca gln A 99 1b5fA_101F_85S}P -11.0455 -2.3477 -0.7375 {"}-11.0455 -2.3477 -0.7375 { ca asp A 100 1b5fA_101F_85S}-9.2398 0.5432 -2.3573 { ca phe A 101 1b5fA_101F_85S}-7.2474 -0.1963 -5.4975 { ca ile A 102 1b5fA_101F_85S}-5.8271 1.6027 -8.468 { ca glu A 103 1b5fA_101F_85S}-7.5265 1.1182 -11.7874 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser A 85 1b5fA_101F_85S}P -11.492 3.272 -6.7316 { cb ser A 85 1b5fA_101F_85S}-11.9543 2.6435 -8.042 { og ser A 85 1b5fA_101F_85S}-11.9319 3.59 -9.092 { ca phe A 101 1b5fA_101F_85S}P -7.2474 -0.1963 -5.4975 { cb phe A 101 1b5fA_101F_85S}-7.6045 -1.5452 -6.1272 { cg phe A 101 1b5fA_101F_85S}-8.9348 -1.4818 -6.849 { cd1 phe A 101 1b5fA_101F_85S}-10.1055 -1.493 -6.1192 { ce1 phe A 101 1b5fA_101F_85S}-11.3208 -1.4098 -6.7722 { cz phe A 101 1b5fA_101F_85S}-11.3503 -1.3433 -8.152 { cg phe A 101 1b5fA_101F_85S}P -8.9348 -1.4818 -6.849 { cd2 phe A 101 1b5fA_101F_85S}-8.9626 -1.394 -8.2229 { ce2 phe A 101 1b5fA_101F_85S}-10.1769 -1.3326 -8.8765 { cz phe A 101 1b5fA_101F_85S}ghost -11.3503 -1.3433 -8.152 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser A 85 1b5fA_101F_85S}P -11.9543 2.6435 -8.042 {"}P -11.9543 2.6435 -8.042 { og ser A 85 1b5fA_101F_85S}P -11.9319 3.59 -9.092 { cb phe A 101 1b5fA_101F_85S}P -7.6045 -1.5452 -6.1272 {"}P -7.6045 -1.5452 -6.1272 { cd1 phe A 101 1b5fA_101F_85S}P -10.1055 -1.493 -6.1192 { cd2 phe A 101 1b5fA_101F_85S}P -8.9626 -1.394 -8.2229 { ce1 phe A 101 1b5fA_101F_85S}P -11.3208 -1.4098 -6.7722 { ce2 phe A 101 1b5fA_101F_85S}P -10.1769 -1.3326 -8.8765 { cz phe A 101 1b5fA_101F_85S}P -11.3503 -1.3433 -8.152 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 101 A}'S' blue -10.7139 0.3054 -8.5762 {"}'S' blue -10.8743 0.2692 -8.7735 { CZ PHE 101 A}'S' blue -11.4528 0.3427 -7.6943 {"}'S' sky -11.6047 0.3699 -7.8979 {"}'S' blue -11.7623 0.3568 -8.0984 {"}'S' sky -11.2609 0.3815 -7.8716 {"}'S' sky -11.5791 0.387 -8.2838 {"}'S' blue -11.743 0.3304 -8.4795 {"}'S' blue -10.9326 0.3315 -7.8609 {"}'S' sky -11.0817 0.3845 -8.0682 {"}'S' sky -11.4007 0.3754 -8.4783 {"}'S' blue -11.5643 0.314 -8.6725 {"}'S' sky -10.8725 0.3384 -8.2194 {"}'S' sky -11.0301 0.3557 -8.4268 {"}'S' sky -11.1918 0.3327 -8.6307 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 101 A}'S' sea -11.4175 0.4045 -8.0789 {"}'S' sea -11.2386 0.3989 -8.2757 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 SER 85 A}'S' blue -11.8042 0.7383 -8.2154 {"}'S' sky -11.6522 0.7125 -8.0121 {"}'S' blue -11.4928 0.743 -7.8148 {"}'S' sky -11.6498 0.6842 -8.4329 {"}'S' sky -11.3469 0.6545 -8.0327 {"}'S' sky -11.1883 0.719 -7.846 {"}'S' blue -11.535 0.7321 -8.7296 {"}'S' sky -11.3985 0.6507 -8.5295 {"}'S' sky -11.0867 0.6562 -8.1285 {"}'S' blue -10.9287 0.742 -7.9475 {"}'S' blue -11.2298 0.7136 -8.7388 {"}'S' sky -11.0826 0.6706 -8.5363 {"}'S' sky -10.9244 0.6883 -8.3378 {"}'S' blue -10.8303 0.7704 -8.6056 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 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0.713 -9.2053 {"}'S' P -11.0769 0.7162 -9.4036 {"}'S' -11.0695 0.682 -9.4044 {"}'S' P -11.2377 0.6636 -9.596 {"}'S' -11.2328 0.65 -9.5948 {"}'S' P -10.7321 0.7639 -9.3841 {"}'S' -10.73 0.7181 -9.3861 {"}'S' P -10.8937 0.7464 -9.589 {"}'S' -10.8853 0.6859 -9.5843 {"}'S' P -11.0576 0.6898 -9.7847 {"}'S' -11.0492 0.6542 -9.7771 {"}'S' P -10.5532 0.7583 -9.5809 {"}'S' -10.556 0.7201 -9.5777 {"}'S' P -10.7153 0.7348 -9.7834 {"}'S' -10.7146 0.6881 -9.7753 {"}'S' P -10.8789 0.6734 -9.9777 {"}'S' -10.8765 0.6563 -9.9722 { CZ PHE 19 A}'S' P -12.0057 0.3163 -7.9229 {"}'S' -12.0059 0.3129 -7.9258 {"}'S' P -11.7401 0.3411 -7.9756 {"}'S' -11.7405 0.3315 -7.9809 {"}'S' P -11.8681 0.4441 -8.1706 {"}'S' -11.8692 0.4261 -8.1784 {"}'S' P -11.9753 0.5717 -8.7581 {"}'S' -11.974 0.56 -8.7589 {"}'S' P -12.1368 0.5543 -8.963 {"}'S' -12.1369 0.5529 -8.9627 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 52 A}'S' sky -12.2805 0.3504 -6.8878 {"}'S' sky -12.1175 0.3872 -6.6872 {"}'S' sky -12.58 0.423 -7.724 {"}'S' sky -11.8107 0.3505 -6.7089 {"}'S' sky -12.6071 0.6659 -8.2607 {"}'S' sky -11.3046 0.7149 -8.4995 {"}'S' sky -11.0498 0.8271 -8.4726 { CG TYR 52 A}'S' blue -12.8313 0.7265 -8.7365 {"}'S' sky -12.6794 0.6852 -8.528 {"}'S' sky -12.6817 0.6646 -8.9536 {"}'S' sky -12.6195 0.7145 -9.3209 {"}'S' sky -11.8917 0.7492 -9.6242 {"}'S' sky -11.1186 0.8299 -8.6475 { CD1 TYR 52 A}'S' sky -11.626 0.7335 -9.8574 {"}'S' sky -10.4797 0.9322 -8.8657 {"}'S' sky -11.3056 0.7414 -10.3081 {"}'S' sky -11.0478 0.7464 -10.3909 {"}'S' sky -10.129 0.8716 -9.9873 { HB2 TYR 52 A}'S' sky -11.4043 0.3056 -6.7584 {"}'S' sky -11.0221 0.2766 -6.6668 {"}'S' sky -10.723 0.2821 -6.7139 {"}'S' sky -10.4663 0.3249 -6.8256 {"}'S' sky -10.7702 0.1176 -7.5696 {"}'S' sky -10.3039 0.3428 -7.0298 {"}'S' sky -10.9768 0.7042 -8.3687 {"}'S' sky -10.6738 0.2417 -7.8472 {"}'S' sky -10.518 0.2175 -7.639 {"}'S' sky -10.1975 0.3848 -7.2717 {"}'S' blue -10.0585 0.5617 -7.1408 {"}'S' sky 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{"}'S' green -12.2488 0.4564 -8.1674 {"}'S' green -12.122 0.3408 -7.9712 {"}'S' green -11.98 0.2624 -7.766 {"}'S' green -11.8276 0.2215 -7.5587 {"}'S' green -11.6682 0.2209 -7.3509 {"}'S' green -12.1044 0.5887 -8.4326 {"}'S' green -11.7231 0.2789 -7.8527 {"}'S' green -11.5708 0.2511 -7.6485 {"}'S' green -11.7794 0.5261 -8.386 {"}'S' green -11.5105 0.3494 -7.9884 {"}'S' green -11.543 0.6088 -8.4611 {"}'S' green -11.4118 0.5035 -8.2628 { CG TYR 52 A}'S' green -12.5326 0.6117 -8.7463 {"}'S' green -12.3749 0.5972 -8.5394 {"}'S' sea -12.482 0.6227 -9.1189 {"}'S' green -12.3334 0.5689 -8.912 {"}'S' green -12.1761 0.5525 -8.7035 {"}'S' green -12.014 0.5746 -8.5007 {"}'S' sea -12.3613 0.6725 -9.4043 {"}'S' green -12.2192 0.5942 -9.1991 {"}'S' green -11.7436 0.5906 -8.5842 {"}'S' sea -12.1035 0.6775 -9.4872 {"}'S' green -11.9623 0.6107 -9.2859 {"}'S' green -11.81 0.5829 -9.0816 {"}'S' green -11.6524 0.5947 -8.8808 {"}'S' green -11.4921 0.645 -8.6885 {"}'S' sea -11.7497 0.6811 -9.4215 {"}'S' green -11.5965 0.655 -9.2164 {"}'S' green -11.4379 0.6711 -9.0153 {"}'S' sea -11.2765 0.73 -8.8234 { CD1 TYR 52 A}'S' green -11.4769 0.6805 -9.65 {"}'S' green -11.3192 0.666 -9.4432 {"}'S' green -11.1571 0.6895 -9.2406 {"}'S' green -10.9943 0.7511 -9.0458 {"}'S' sea -10.8339 0.8488 -8.8659 {"}'S' sea -11.4264 0.6915 -10.0226 {"}'S' green -11.2777 0.6377 -9.8157 {"}'S' green -10.6348 0.8008 -9.0288 {"}'S' green -11.1635 0.663 -10.1028 {"}'S' green -10.3669 0.8491 -9.1248 {"}'S' green -10.9067 0.6795 -10.1896 {"}'S' green -10.2783 0.8024 -9.4118 {"}'S' sea -10.126 0.9266 -9.2491 {"}'S' sea -10.6941 0.75 -10.3252 {"}'S' green -10.5409 0.7238 -10.1201 {"}'S' green -10.3823 0.7399 -9.919 {"}'S' green -10.2208 0.7988 -9.7272 {"}'S' sea -10.0629 0.8987 -9.5512 {"}'S' sea -10.2911 0.8336 -10.1866 { HB2 TYR 52 A}'S' green -11.4918 0.1854 -7.2487 {"}'S' green -11.3399 0.1596 -7.0454 {"}'S' sea -11.1805 0.1901 -6.8482 {"}'S' green -11.4682 0.2256 -7.6613 {"}'S' green -11.3375 0.1312 -7.4662 {"}'S' green -11.1902 0.0896 -7.2639 {"}'S' green -11.0346 0.1015 -7.0661 {"}'S' green -10.876 0.166 -6.8793 {"}'S' green -11.3389 0.3109 -7.9484 {"}'S' green -11.2227 0.1792 -7.7629 {"}'S' green -11.0862 0.0978 -7.5629 {"}'S' sea -10.9338 0.0728 -7.3591 {"}'S' green -10.7744 0.1033 -7.1619 {"}'S' sea -10.6164 0.189 -6.9809 {"}'S' green -11.1485 0.4142 -8.1424 {"}'S' green -11.0459 0.2615 -7.9673 {"}'S' sea -10.9175 0.1607 -7.7722 {"}'S' sea -10.6121 0.1354 -7.3712 {"}'S' sea -10.4543 0.2114 -7.1883 {"}'S' sea -10.9124 0.4953 -8.226 {"}'S' sea -10.8087 0.3365 -8.0481 {"}'S' sea -10.3548 0.2664 -7.4424 {"}'S' sea -10.6742 0.6022 -8.2564 {"}'S' sea -10.5716 0.4494 -8.0813 {"}'S' sea -10.4344 0.3744 -7.8818 { HB3 TYR 52 A}'S' sea -12.492 0.3363 -7.2318 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB TYR 52 A}'S' P -11.9926 0.4493 -8.2498 {"}'S' -11.9922 0.4589 -8.2445 {"}'S' P -11.8643 0.3458 -8.0541 {"}'S' -11.8643 0.3645 -8.0464 {"}'S' P -11.6524 0.4175 -8.1911 {"}'S' -11.653 0.4238 -8.1881 { CG TYR 52 A}'S' P -12.0668 0.5533 -8.9918 {"}'S' -12.0667 0.5564 -8.9906 {"}'S' P -11.9074 0.5526 -8.784 {"}'S' -11.9087 0.5626 -8.7847 { CD1 TYR 52 A}'S' P -11.1205 0.6214 -9.6073 {"}'S' -11.1185 0.6583 -9.6096 {"}'S' P -10.9584 0.6435 -9.4045 {"}'S' -10.9602 0.6909 -9.4127 {"}'S' P -10.796 0.7043 -9.2101 {"}'S' -10.7976 0.7226 -9.2164 {"}'S' P -11.0112 0.6221 -9.8955 {"}'S' -11.0111 0.6472 -9.8926 {"}'S' P -10.8518 0.6215 -9.6878 {"}'S' -10.8568 0.6797 -9.6892 {"}'S' P -10.688 0.6595 -9.488 {"}'S' -10.6983 0.711 -9.495 {"}'S' P -10.5252 0.7352 -9.2982 {"}'S' -10.5283 0.7435 -9.3008 {"}'S' P -10.7544 0.6518 -9.9854 {"}'S' -10.7567 0.6659 -9.9832 {"}'S' P -10.5967 0.6635 -9.7846 {"}'S' -10.6046 0.6969 -9.7842 {"}'S' P -10.4364 0.7139 -9.5923 {"}'S' -10.442 0.729 -9.5932 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 19 A}'M' greentint -9.5806 2.1106 -7.0804 {"}'M' greentint -9.3374 2.5078 -6.8763 {"}'M' greentint -9.4731 2.3303 -7.0025 {"}'M' greentint -9.5027 2.1908 -7.3187 {"}'M' greentint -9.1018 2.7269 -6.9494 {"}'M' greentint -9.254 2.591 -7.1094 {"}'M' greentint -9.3907 2.4094 -7.2342 {"}'M' greentint -9.3882 2.2356 -7.5483 {"}'M' greentint -8.8449 2.872 -7.0227 {"}'M' greentint -9.0007 2.7732 -7.1961 {"}'M' greentint -9.1468 2.6296 -7.346 {"}'M' greentint -9.2776 2.4476 -7.4644 {"}'M' greentint -9.2372 2.2573 -7.7571 {"}'M' greentint -8.6881 2.9064 -7.2282 {"}'M' greentint -8.845 2.8005 -7.4013 {"}'M' greentint -8.9916 2.6534 -7.5511 {"}'M' greentint -9.1237 2.4704 -7.6711 {"}'M' greentint -8.6699 2.7866 -7.5929 {"}'M' greentint -8.8166 2.6357 -7.7402 {"}'M' greentint -8.9488 2.4499 -7.8596 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 52 A}'M' greentint -9.5753 2.0469 -7.0433 {"}'M' greentint -9.4204 2.1441 -6.8709 {"}'M' greentint -9.2791 2.2949 -6.7292 {"}'M' greentint -9.4647 2.0069 -7.3187 {"}'M' greentint -9.3065 2.0706 -7.1324 {"}'M' greentint -9.1562 2.195 -6.9725 {"}'M' greentint -9.0231 2.3706 -6.8494 {"}'M' greentint -8.9179 2.5853 -6.7717 {"}'M' greentint -9.2559 2.0681 -7.4659 {"}'M' greentint -9.0952 2.144 -7.2791 {"}'M' greentint -8.9457 2.2894 -7.1267 {"}'M' greentint -8.8211 2.4894 -7.0209 {"}'M' greentint -8.7325 2.727 -6.9728 {"}'M' greentint -9.1622 2.1789 -7.7186 {"}'M' greentint -8.9998 2.2238 -7.5207 {"}'M' greentint -8.8456 2.3564 -7.359 {"}'M' greentint -8.7214 2.5598 -7.2543 {"}'M' greentint -8.6431 2.8054 -7.2222 {"}'M' greentint -8.8902 2.3904 -7.6891 {"}'M' greentint -8.7422 2.5424 -7.5402 {"}'M' greentint -8.6473 2.7765 -7.4829 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 19 A}'M' green -10.196 0.6469 -4.5747 {"}'M' green -10.0101 0.7383 -4.4167 {"}'M' green -10.3847 0.6972 -5.0543 {"}'M' green -10.3564 0.7946 -5.3079 {"}'M' green -10.1521 1.0899 -5.4702 {"}'M' green -9.5674 1.4668 -5.2185 {"}'M' green -9.7256 1.4031 -5.4048 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 19 A}'M' greentint -10.1143 0.8935 -4.5946 {"}'M' greentint -10.2743 0.7965 -4.774 {"}'M' greentint -9.8491 1.0096 -4.4499 {"}'M' greentint -9.9808 1.1113 -4.6481 {"}'M' greentint -10.1418 1.0832 -4.8481 {"}'M' greentint -10.2899 0.9313 -4.9969 {"}'M' greentint -9.6575 1.1863 -4.5138 {"}'M' greentint -9.7924 1.2812 -4.7147 {"}'M' greentint -9.9513 1.2843 -4.9206 {"}'M' greentint -10.1116 1.1932 -5.1035 {"}'M' greentint -10.253 1.0227 -5.2391 {"}'M' greentint -9.5439 1.3804 -4.7651 {"}'M' greentint -9.6955 1.4159 -4.9702 {"}'M' greentint -9.8569 1.3767 -5.1681 {"}'M' greentint -10.0135 1.2647 -5.3395 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 52 A}'M' green -10.4193 0.6904 -4.7788 {"}'M' green -10.2613 0.7143 -4.582 {"}'M' green -10.1033 0.7884 -4.3982 {"}'M' green -10.4619 0.8606 -5.245 {"}'M' green -9.6927 1.1204 -4.323 {"}'M' green -10.1039 1.1869 -5.4487 {"}'M' green -9.5112 1.3875 -4.7374 {"}'M' green -9.5183 1.5009 -4.9695 {"}'M' green -9.7185 1.5478 -5.3581 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 52 A}'M' greentint -10.3157 0.7974 -5.0392 {"}'M' greentint -10.1585 0.7928 -4.8336 {"}'M' greentint -9.9959 0.8484 -4.6394 {"}'M' greentint -9.838 0.9587 -4.466 {"}'M' greentint -10.2321 0.9752 -5.2971 {"}'M' greentint -10.0841 0.9281 -5.0927 {"}'M' greentint -9.9249 0.9506 -4.8922 {"}'M' greentint -9.7652 1.0392 -4.7112 {"}'M' greentint -9.6185 1.1888 -4.5636 {"}'M' greentint -9.9655 1.1101 -5.2472 {"}'M' greentint -9.8067 1.1211 -5.0463 {"}'M' greentint -9.6496 1.217 -4.8689 {"}'M' greentint -9.8312 1.3179 -5.3229 {"}'M' greentint -9.668 1.3472 -5.1203 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 250 1b6aA_252F_263}P -11.5113 -2.0035 0.786 {"}-11.5113 -2.0035 0.786 { ca ile A 250 1b6aA_252F_263}-10.8865 -2.4472 -0.4547 { c ile A 250 1b6aA_252F_263}-10.6919 -1.2084 -1.3259 { o ile A 250 1b6aA_252F_263}-11.6496 -0.5832 -1.7831 { c ile A 250 1b6aA_252F_263}P -10.6919 -1.2084 -1.3259 { n asp A 251 1b6aA_252F_263}-9.4286 -0.84 -1.5067 { ca asp A 251 1b6aA_252F_263}-9.0764 0.3839 -2.2497 { c asp A 251 1b6aA_252F_263}-8.0366 -0.0089 -3.2901 { o asp A 251 1b6aA_252F_263}-6.9327 -0.3932 -2.9565 { c asp A 251 1b6aA_252F_263}P -8.0366 -0.0089 -3.2901 { n phe A 252 1b6aA_252F_263}-8.4322 0.0513 -4.5726 { ca phe A 252 1b6aA_252F_263}-7.4497 -0.3718 -5.5887 { c phe A 252 1b6aA_252F_263}-7.6366 0.5139 -6.8171 { o phe A 252 1b6aA_252F_263}-8.6535 1.1735 -6.934 { c phe A 252 1b6aA_252F_263}P -7.6366 0.5139 -6.8171 { n gly A 253 1b6aA_252F_263}-6.556 0.5761 -7.5963 { ca gly A 253 1b6aA_252F_263}-6.5177 1.5391 -8.6933 { c gly A 253 1b6aA_252F_263}-6.0361 0.8603 -9.9769 { o gly A 253 1b6aA_252F_263}-5.2463 -0.0868 -10.0228 { c gly A 253 1b6aA_252F_263}P -6.0361 0.8603 -9.9769 { n thr A 254 1b6aA_252F_263}-6.6435 1.3305 -11.0648 { ca thr A 254 1b6aA_252F_263}-6.2832 0.9295 -12.4136 { c thr A 254 1b6aA_252F_263}-5.8796 2.182 -13.1834 { o thr A 254 1b6aA_252F_263}-6.2416 3.2887 -12.7876 { n ile A 261 1b6aA_252F_263}P -7.765 5.6389 -11.9885 {"}-7.765 5.6389 -11.9885 { ca ile A 261 1b6aA_252F_263}-9.0171 5.5338 -11.2305 { c ile A 261 1b6aA_252F_263}-8.6488 5.1088 -9.8064 { o ile A 261 1b6aA_252F_263}-8.0037 4.0682 -9.6373 { c ile A 261 1b6aA_252F_263}P -8.6488 5.1088 -9.8064 { n asp A 262 1b6aA_252F_263}-9.054 5.902 -8.8392 { ca asp A 262 1b6aA_252F_263}-8.9397 5.5459 -7.4209 { c asp A 262 1b6aA_252F_263}-10.3844 5.3969 -6.9366 { o asp A 262 1b6aA_252F_263}-11.1342 6.3676 -6.9544 { c asp A 262 1b6aA_252F_263}P -10.3844 5.3969 -6.9366 { n cys A 263 1b6aA_252F_263}-10.7748 4.1677 -6.6052 { ca cys A 263 1b6aA_252F_263}-12.166 3.9576 -6.1808 { c cys A 263 1b6aA_252F_263}-12.1651 2.8753 -5.1106 { o cys A 263 1b6aA_252F_263}-11.3008 1.9805 -5.1879 { c cys A 263 1b6aA_252F_263}P -12.1651 2.8753 -5.1106 { n ala A 264 1b6aA_252F_263}-13.0331 3.0234 -4.116 { ca ala A 264 1b6aA_252F_263}-12.9025 2.1746 -2.9253 { c ala A 264 1b6aA_252F_263}-14.2596 1.9671 -2.272 { o ala A 264 1b6aA_252F_263}-15.1543 2.813 -2.3705 { c ala A 264 1b6aA_252F_263}P -14.2596 1.9671 -2.272 { n phe A 265 1b6aA_252F_263}-14.3758 0.785 -1.6381 { ca phe A 265 1b6aA_252F_263}-15.6082 0.4595 -0.9157 { c phe A 265 1b6aA_252F_263}-15.2387 -0.3794 0.3105 { o phe A 265 1b6aA_252F_263}-14.0897 -0.7743 0.4998 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 250 1b6aA_252F_263}P -11.5113 -2.0035 0.786 { ca ile A 250 1b6aA_252F_263}P -10.8865 -2.4472 -0.4547 { n asp A 251 1b6aA_252F_263}P -9.4286 -0.84 -1.5067 { ca asp A 251 1b6aA_252F_263}P -9.0764 0.3839 -2.2497 { n phe A 252 1b6aA_252F_263}P -8.4322 0.0513 -4.5726 { ca phe A 252 1b6aA_252F_263}P -7.4497 -0.3718 -5.5887 { n gly A 253 1b6aA_252F_263}P -6.556 0.5761 -7.5963 { ca gly A 253 1b6aA_252F_263}P -6.5177 1.5391 -8.6933 {"}P -6.5177 1.5391 -8.6933 { n thr A 254 1b6aA_252F_263}P -6.6435 1.3305 -11.0648 { ca thr A 254 1b6aA_252F_263}P -6.2832 0.9295 -12.4136 { n ile A 261 1b6aA_252F_263}P -7.765 5.6389 -11.9885 { ca ile A 261 1b6aA_252F_263}P -9.0171 5.5338 -11.2305 { n asp A 262 1b6aA_252F_263}P -9.054 5.902 -8.8392 { ca asp A 262 1b6aA_252F_263}P -8.9397 5.5459 -7.4209 { n cys A 263 1b6aA_252F_263}P -10.7748 4.1677 -6.6052 { ca cys A 263 1b6aA_252F_263}P -12.166 3.9576 -6.1808 { n ala A 264 1b6aA_252F_263}P -13.0331 3.0234 -4.116 { ca ala A 264 1b6aA_252F_263}P -12.9025 2.1746 -2.9253 { n phe A 265 1b6aA_252F_263}P -14.3758 0.785 -1.6381 { ca phe A 265 1b6aA_252F_263}P -15.6082 0.4595 -0.9157 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 250 1b6aA_252F_263}P -10.8865 -2.4472 -0.4547 {"}-10.8865 -2.4472 -0.4547 { ca asp A 251 1b6aA_252F_263}-9.0764 0.3839 -2.2497 { ca phe A 252 1b6aA_252F_263}-7.4497 -0.3718 -5.5887 { ca gly A 253 1b6aA_252F_263}-6.5177 1.5391 -8.6933 { ca thr A 254 1b6aA_252F_263}-6.2832 0.9295 -12.4136 { ca ile A 261 1b6aA_252F_263}P -9.0171 5.5338 -11.2305 {"}-9.0171 5.5338 -11.2305 { ca asp A 262 1b6aA_252F_263}-8.9397 5.5459 -7.4209 { ca cys A 263 1b6aA_252F_263}-12.166 3.9576 -6.1808 { ca ala A 264 1b6aA_252F_263}-12.9025 2.1746 -2.9253 { ca phe A 265 1b6aA_252F_263}-15.6082 0.4595 -0.9157 @subgroup {sidechain} off @vectorlist {sc} color= green alpha= 0.2353 master= {sidechain} { ca phe A 252 1b6aA_252F_263}P -7.4497 -0.3718 -5.5887 { ca cys A 263 1b6aA_252F_263}P -12.166 3.9576 -6.1808 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 252 A}'M' blue -9.5777 2.0839 -6.409 {"}'M' blue -9.7363 1.9908 -6.5875 {"}'M' blue -9.3907 2.273 -6.4769 {"}'M' sky -9.5509 2.2148 -6.6689 {"}'M' blue -9.7057 2.0917 -6.8336 {"}'M' blue -9.1475 2.4164 -6.519 {"}'M' sky -9.308 2.393 -6.721 {"}'M' sky -9.47 2.3108 -6.9067 {"}'M' blue -9.6223 2.1749 -7.0666 {"}'M' blue -9.054 2.507 -6.7878 {"}'M' blue -9.2131 2.4559 -6.98 {"}'M' blue -9.3689 2.3571 -7.1533 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H CYS 263 A}'M' blue -9.9934 2.4234 -6.9283 {"}'M' -9.8353 2.4256 -6.7246 {"}'M' -9.6746 2.5016 -6.5377 {"}'M' blue -9.5251 2.647 -6.3853 {"}'M' -9.7416 2.5364 -6.9772 {"}'M' -9.5792 2.5814 -6.7793 {"}'M' blue -9.425 2.714 -6.6176 {"}'M' blue -9.4696 2.748 -6.9477 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 252 A}'M' blue -10.2929 0.573 -4.7826 {"}'M' -10.0501 0.9591 -4.5764 {"}'M' -10.1981 0.8071 -4.7253 {"}'M' -10.2646 0.6705 -5.0362 {"}'M' -9.8595 1.1602 -4.649 {"}'M' -10.1678 0.7447 -5.2762 {"}'M' -9.7651 1.2526 -4.8964 {"}'M' blue -10.0224 0.7643 -5.4938 {"}'M' -9.784 1.1545 -5.293 {"}'M' -9.9172 0.9789 -5.416 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 252 A}'M' sea -10.0198 1.0691 -4.8318 {"}'M' sea -10.1612 0.8986 -4.9674 {"}'M' sea -9.9217 1.1405 -5.0678 {"}'M' sea -10.0603 0.9658 -5.1985 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O CYS 263 A}'M' blue -10.6674 0.7383 -5.0587 {"}'M' sky -10.5156 0.859 -4.8959 {"}'M' sky -10.3752 1.021 -4.7598 {"}'M' sky -10.2533 1.2176 -4.6568 {"}'M' blue -10.1549 1.4424 -4.5908 {"}'M' blue -10.56 0.7984 -5.2999 {"}'M' blue -10.0357 1.5059 -4.82 {"}'M' sky -10.3293 0.9891 -5.3716 {"}'M' blue -9.967 1.5726 -5.0661 {"}'M' blue -10.2137 1.1669 -5.5294 {"}'M' sky -10.0753 1.3375 -5.3979 @dotlist {x} color= red width= 1 master= {vdw contact} { O CYS 263 A}'M' sea -10.4022 0.9086 -5.1264 {"}'M' sea -10.2568 1.0704 -4.9835 {"}'M' sea -10.1322 1.2728 -4.8799 {"}'M' sea -10.1826 1.1387 -5.2241 {"}'M' sea -10.0589 1.3385 -5.1194 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 230 1b8aA_406F_232}P -7.5727 5.4842 -12.3175 {"}-7.5727 5.4842 -12.3175 { ca ile A 230 1b8aA_406F_232}-8.9727 5.2485 -11.9915 { c ile A 230 1b8aA_406F_232}-8.8837 4.6147 -10.5991 { o ile A 230 1b8aA_406F_232}-8.4954 3.4437 -10.447 { c ile A 230 1b8aA_406F_232}P -8.8837 4.6147 -10.5991 { n asp A 231 1b8aA_406F_232}-9.2407 5.3936 -9.5782 { ca asp A 231 1b8aA_406F_232}-9.1506 4.9492 -8.1967 { c asp A 231 1b8aA_406F_232}-10.5185 4.7706 -7.5785 { o asp A 231 1b8aA_406F_232}-11.4643 5.483 -7.9043 { c asp A 231 1b8aA_406F_232}P -10.5185 4.7706 -7.5785 { n ser A 232 1b8aA_406F_232}-10.6062 3.7969 -6.6866 { ca ser A 232 1b8aA_406F_232}-11.8492 3.5511 -5.99 { c ser A 232 1b8aA_406F_232}-11.5239 2.9889 -4.6241 { o ser A 232 1b8aA_406F_232}-10.4831 2.3722 -4.4142 { c ser A 232 1b8aA_406F_232}P -11.5239 2.9889 -4.6241 { n glu A 233 1b8aA_406F_232}-12.4483 3.1917 -3.6952 { ca glu A 233 1b8aA_406F_232}-12.2739 2.6571 -2.3591 { c glu A 233 1b8aA_406F_232}-13.722 2.4244 -1.9254 { o glu A 233 1b8aA_406F_232}-14.6099 3.2349 -2.2183 { c glu A 233 1b8aA_406F_232}P -13.722 2.4244 -1.9254 { n met A 234 1b8aA_406F_232}-13.9592 1.3051 -1.2558 { ca met A 234 1b8aA_406F_232}-15.3044 0.955 -0.8528 { c met A 234 1b8aA_406F_232}-15.2919 0.3809 0.5582 { o met A 234 1b8aA_406F_232}-14.4144 -0.4273 0.9115 { n gly A 404 1b8aA_406F_232}P -11.5646 -1.3035 1.3207 {"}-11.5646 -1.3035 1.3207 { ca gly A 404 1b8aA_406F_232}-10.5601 -1.7646 0.3704 { c gly A 404 1b8aA_406F_232}-10.7716 -1.0307 -0.9457 { o gly A 404 1b8aA_406F_232}-11.8067 -0.3917 -1.1511 { c gly A 404 1b8aA_406F_232}P -10.7716 -1.0307 -0.9457 { n gly A 405 1b8aA_406F_232}-9.8229 -1.1561 -1.8692 { ca gly A 405 1b8aA_406F_232}-9.9587 -0.4273 -3.1166 { c gly A 405 1b8aA_406F_232}-8.8661 -0.8281 -4.0848 { o gly A 405 1b8aA_406F_232}-8.176 -1.8394 -3.8831 { c gly A 405 1b8aA_406F_232}P -8.8661 -0.8281 -4.0848 { n phe A 406 1b8aA_406F_232}-8.7073 -0.026 -5.1274 { ca phe A 406 1b8aA_406F_232}-7.7122 -0.3173 -6.1445 { c phe A 406 1b8aA_406F_232}-7.3722 0.9246 -6.927 { o phe A 406 1b8aA_406F_232}-8.1203 1.8946 -6.9218 { c phe A 406 1b8aA_406F_232}P -7.3722 0.9246 -6.927 { n gly A 407 1b8aA_406F_232}-6.2268 0.8598 -7.6025 { ca gly A 407 1b8aA_406F_232}-5.8038 1.9069 -8.5006 { c gly A 407 1b8aA_406F_232}-5.713 1.1825 -9.8532 { o gly A 407 1b8aA_406F_232}-4.9861 0.2074 -9.965 { c gly A 407 1b8aA_406F_232}P -5.713 1.1825 -9.8532 { n leu A 408 1b8aA_406F_232}-6.4636 1.6371 -10.8548 { ca leu A 408 1b8aA_406F_232}-6.4945 1.0438 -12.1987 { c leu A 408 1b8aA_406F_232}-5.9358 2.0853 -13.1972 { o leu A 408 1b8aA_406F_232}-6.5248 3.1496 -13.3582 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 230 1b8aA_406F_232}P -7.5727 5.4842 -12.3175 { ca ile A 230 1b8aA_406F_232}P -8.9727 5.2485 -11.9915 { n asp A 231 1b8aA_406F_232}P -9.2407 5.3936 -9.5782 { ca asp A 231 1b8aA_406F_232}P -9.1506 4.9492 -8.1967 { n ser A 232 1b8aA_406F_232}P -10.6062 3.7969 -6.6866 { ca ser A 232 1b8aA_406F_232}P -11.8492 3.5511 -5.99 { n glu A 233 1b8aA_406F_232}P -12.4483 3.1917 -3.6952 { ca glu A 233 1b8aA_406F_232}P -12.2739 2.6571 -2.3591 { n met A 234 1b8aA_406F_232}P -13.9592 1.3051 -1.2558 { ca met A 234 1b8aA_406F_232}P -15.3044 0.955 -0.8528 { n gly A 404 1b8aA_406F_232}P -11.5646 -1.3035 1.3207 { ca gly A 404 1b8aA_406F_232}P -10.5601 -1.7646 0.3704 {"}P -10.5601 -1.7646 0.3704 { n gly A 405 1b8aA_406F_232}P -9.8229 -1.1561 -1.8692 { ca gly A 405 1b8aA_406F_232}P -9.9587 -0.4273 -3.1166 {"}P -9.9587 -0.4273 -3.1166 { n phe A 406 1b8aA_406F_232}P -8.7073 -0.026 -5.1274 { ca phe A 406 1b8aA_406F_232}P -7.7122 -0.3173 -6.1445 { n gly A 407 1b8aA_406F_232}P -6.2268 0.8598 -7.6025 { ca gly A 407 1b8aA_406F_232}P -5.8038 1.9069 -8.5006 {"}P -5.8038 1.9069 -8.5006 { n leu A 408 1b8aA_406F_232}P -6.4636 1.6371 -10.8548 { ca leu A 408 1b8aA_406F_232}P -6.4945 1.0438 -12.1987 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 230 1b8aA_406F_232}P -8.9727 5.2485 -11.9915 {"}-8.9727 5.2485 -11.9915 { ca asp A 231 1b8aA_406F_232}-9.1506 4.9492 -8.1967 { ca ser A 232 1b8aA_406F_232}-11.8492 3.5511 -5.99 { ca glu A 233 1b8aA_406F_232}-12.2739 2.6571 -2.3591 { ca met A 234 1b8aA_406F_232}-15.3044 0.955 -0.8528 { ca gly A 404 1b8aA_406F_232}P -10.5601 -1.7646 0.3704 {"}-10.5601 -1.7646 0.3704 { ca gly A 405 1b8aA_406F_232}-9.9587 -0.4273 -3.1166 { ca phe A 406 1b8aA_406F_232}-7.7122 -0.3173 -6.1445 { ca gly A 407 1b8aA_406F_232}-5.8038 1.9069 -8.5006 { ca leu A 408 1b8aA_406F_232}-6.4945 1.0438 -12.1987 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser A 232 1b8aA_406F_232}P -11.8492 3.5511 -5.99 { cb ser A 232 1b8aA_406F_232}-12.699 2.529 -6.7336 { og ser A 232 1b8aA_406F_232}-13.9712 2.4225 -6.1463 { ca phe A 406 1b8aA_406F_232}P -7.7122 -0.3173 -6.1445 { cb phe A 406 1b8aA_406F_232}-8.2508 -1.3507 -7.1557 { cg phe A 406 1b8aA_406F_232}-9.5441 -0.9336 -7.8446 { cd1 phe A 406 1b8aA_406F_232}-9.5301 -0.0624 -8.9437 { ce1 phe A 406 1b8aA_406F_232}-10.7368 0.3503 -9.5507 { cz phe A 406 1b8aA_406F_232}-11.9448 -0.1096 -9.0599 { cg phe A 406 1b8aA_406F_232}P -9.5441 -0.9336 -7.8446 { cd2 phe A 406 1b8aA_406F_232}-10.7705 -1.3847 -7.3672 { ce2 phe A 406 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{"}'S' green -12.3188 1.0787 -8.9776 {"}'S' sea -12.138 1.2486 -9.2051 {"}'S' green -12.0665 1.0517 -9.059 {"}'S' green -11.8449 1.1446 -9.1891 {"}'S' sea -11.6082 1.2355 -9.2658 {"}'S' green -11.523 1.0499 -9.1034 {"}'S' sea -11.2839 1.1517 -9.1417 {"}'S' sea -11.1739 1.0082 -8.9585 { CD2 TYR 120 A}'S' sea -10.633 1.3733 -9.9158 {"}'S' sea -10.4757 1.357 -9.7073 {"}'S' sea -10.3664 1.3578 -9.9956 { HB2 TYR 120 A}'S' green -11.5137 0.4949 -7.462 {"}'S' green -11.2919 0.3668 -7.55 {"}'S' sea -11.1325 0.3972 -7.3528 {"}'S' green -11.1421 0.2967 -7.7685 {"}'S' green -10.9866 0.3087 -7.5706 {"}'S' sea -10.828 0.3732 -7.3839 {"}'S' green -11.0381 0.305 -8.0674 {"}'S' sea -10.8857 0.28 -7.8637 {"}'S' sea -10.7264 0.3104 -7.6665 {"}'S' green -11.1716 0.8177 -8.7924 {"}'S' green -10.8695 0.3678 -8.2768 {"}'S' sea -10.564 0.3426 -7.8757 {"}'S' green -10.9288 0.9114 -8.8732 {"}'S' green -10.8643 0.7024 -8.7306 {"}'S' green -10.7607 0.5437 -8.5527 {"}'S' green -10.6258 0.4489 -8.3518 {"}'S' sea 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{"}'S' P -11.8492 0.5557 -8.225 {"}'S' -11.8474 0.5729 -8.2212 {"}'S' P -11.6969 0.5148 -8.0177 {"}'S' -11.6965 0.5238 -8.0159 {"}'S' P -11.9737 0.8819 -8.8917 {"}'S' -11.966 0.9203 -8.8626 {"}'S' P -11.8619 0.7426 -8.7088 {"}'S' -11.8543 0.811 -8.6695 {"}'S' P -11.7335 0.639 -8.5131 {"}'S' -11.732 0.7052 -8.4868 {"}'S' P -11.5924 0.5722 -8.3118 {"}'S' -11.593 0.598 -8.3049 {"}'S' P -11.7582 0.9655 -9.0263 {"}'S' -11.7572 0.9829 -9.0102 {"}'S' P -11.6487 0.8194 -8.845 {"}'S' -11.6504 0.8691 -8.8108 {"}'S' P -11.5217 0.7107 -8.6501 {"}'S' -11.5276 0.762 -8.6237 {"}'S' P -11.4123 0.9021 -8.9201 {"}'S' -11.414 0.9081 -8.9153 { HB2 TYR 120 A}'S' P -11.5812 0.474 -7.9528 {"}'S' -11.576 0.4811 -7.9525 {"}'S' P -11.4438 0.3925 -7.7533 {"}'S' -11.4412 0.398 -7.7544 {"}'S' P -11.5289 0.5734 -8.345 {"}'S' -11.5144 0.5963 -8.332 {"}'S' P -11.4201 0.4328 -8.1659 {"}'S' -11.4183 0.4373 -8.1644 {"}'S' P -11.2894 0.3384 -7.9708 {"}'S' -11.2857 0.3502 -7.9684 {"}'S' P -11.3785 0.6942 -8.6164 {"}'S' -11.3653 0.7179 -8.5918 {"}'S' P -11.2909 0.5181 -8.4529 {"}'S' -11.2764 0.5562 -8.4282 {"}'S' P -11.1747 0.3863 -8.2675 {"}'S' -11.1734 0.3972 -8.2631 {"}'S' P -11.1005 0.6214 -8.647 {"}'S' -11.0978 0.6345 -8.6342 {"}'S' P -10.9979 0.4686 -8.4719 {"}'S' -10.9978 0.472 -8.469 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 169 A}'M' greentint -9.2451 2.3384 -6.0091 {"}'M' greentint -9.403 2.3301 -6.2111 {"}'M' greentint -9.5616 2.2369 -6.3895 {"}'M' greentint -9.7008 2.0689 -6.5226 {"}'M' greentint -9.0599 2.5085 -6.0751 {"}'M' greentint -9.216 2.5192 -6.2789 {"}'M' greentint -9.3762 2.4609 -6.4709 {"}'M' greentint -9.531 2.3379 -6.6356 {"}'M' greentint -9.6667 2.1603 -6.7617 {"}'M' greentint -8.8199 2.6267 -6.114 {"}'M' greentint -8.9728 2.6626 -6.321 {"}'M' greentint -9.1329 2.6386 -6.5223 {"}'M' greentint -9.2953 2.557 -6.7087 {"}'M' greentint -9.4476 2.421 -6.8687 {"}'M' greentint -9.5842 2.2394 -6.9935 {"}'M' greentint -8.5787 2.7036 -6.1882 {"}'M' greentint -8.7241 2.754 -6.3898 {"}'M' greentint -8.8793 2.7531 -6.5898 {"}'M' greentint -9.0384 2.702 -6.782 {"}'M' greentint -9.1942 2.6032 -6.9553 {"}'M' greentint -9.3404 2.4597 -7.1052 {"}'M' greentint -9.4712 2.2777 -7.2236 {"}'M' greentint -8.5634 2.8097 -6.5964 {"}'M' greentint -8.7214 2.7971 -6.7977 {"}'M' greentint -8.8817 2.7364 -6.9874 {"}'M' greentint -9.0385 2.6305 -7.1605 {"}'M' greentint -9.1852 2.4834 -7.3103 {"}'M' greentint -8.546 2.7944 -6.9913 {"}'M' greentint -8.7069 2.7273 -7.1805 {"}'M' greentint -8.8634 2.6167 -7.3521 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 120 A}'M' greentint -9.6265 2.0725 -6.3091 {"}'M' greentint -9.4691 2.1364 -6.1223 {"}'M' greentint -9.6396 2.0123 -6.737 {"}'M' greentint -9.4906 1.988 -6.538 {"}'M' greentint -9.3339 2.0254 -6.3462 {"}'M' greentint -9.179 2.1226 -6.1737 {"}'M' greentint -9.0377 2.2734 -6.0321 {"}'M' greentint -8.9171 2.4676 -5.9304 {"}'M' greentint -9.5175 2.0511 -7.0199 {"}'M' greentint -9.3776 1.9861 -6.8206 {"}'M' greentint -9.2232 1.9853 -6.6215 {"}'M' greentint -9.065 2.0491 -6.4352 {"}'M' greentint -8.9148 2.1735 -6.2754 {"}'M' greentint -8.7817 2.3491 -6.1523 {"}'M' greentint -8.6764 2.5637 -6.0745 {"}'M' greentint -9.314 2.1173 -7.1756 {"}'M' greentint -9.1727 2.0443 -6.9725 {"}'M' greentint -9.0145 2.0465 -6.7688 {"}'M' greentint -8.8538 2.1225 -6.5819 {"}'M' greentint -8.7043 2.2679 -6.4295 {"}'M' greentint -8.5797 2.4678 -6.3237 {"}'M' greentint -8.4911 2.7054 -6.2757 {"}'M' greentint -9.1856 2.344 -7.4158 {"}'M' greentint -9.0695 2.207 -7.2276 {"}'M' greentint -8.9208 2.1574 -7.0215 {"}'M' greentint -8.7584 2.2023 -6.8235 {"}'M' greentint -8.6042 2.3349 -6.6618 {"}'M' greentint -8.48 2.5382 -6.5572 {"}'M' greentint -8.4017 2.7839 -6.5251 {"}'M' greentint -8.9415 2.4426 -7.3901 {"}'M' greentint -8.8098 2.3409 -7.1919 {"}'M' greentint -8.6488 2.3689 -6.9919 {"}'M' greentint -8.5007 2.5209 -6.8431 {"}'M' greentint -8.4059 2.755 -6.7857 {"}'M' greentint -8.6763 2.5587 -7.2454 {"}'M' greentint -8.5163 2.6556 -7.066 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 169 A}'M' green -10.1416 0.5718 -4.514 {"}'M' green -9.8364 0.9427 -4.8291 {"}'M' green -9.8599 1.0291 -5.2825 {"}'M' green -10.3014 0.6653 -5.7517 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 169 A}'M' greentint -10.4068 0.4557 -4.6586 {"}'M' greentint -10.5668 0.3588 -4.838 {"}'M' greentint -10.6772 0.2594 -5.1183 {"}'M' greentint -10.2733 0.6736 -4.7121 {"}'M' greentint -10.4343 0.6455 -4.9121 {"}'M' greentint -10.5824 0.4936 -5.061 {"}'M' greentint -10.6489 0.3569 -5.3719 {"}'M' greentint -10.0849 0.8434 -4.7788 {"}'M' greentint -10.2438 0.8466 -4.9847 {"}'M' greentint -10.404 0.7555 -5.1675 {"}'M' greentint -10.5455 0.585 -5.3031 {"}'M' greentint -10.552 0.4312 -5.6119 {"}'M' greentint -9.988 0.9781 -5.0342 {"}'M' greentint -10.1494 0.939 -5.2321 {"}'M' greentint -10.306 0.8269 -5.4035 {"}'M' greentint -10.4446 0.6522 -5.5343 {"}'M' greentint -10.0181 0.9654 -5.4688 {"}'M' greentint -10.1683 0.8409 -5.6287 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 120 A}'M' green -10.211 0.5546 -4.5434 {"}'M' green -10.7156 0.2809 -5.4833 {"}'M' green -9.8081 1.0946 -5.1106 {"}'M' green -10.2311 0.8015 -5.767 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 120 A}'M' greentint -10.6612 0.1979 -5.0261 {"}'M' greentint -10.5032 0.2719 -4.8423 {"}'M' greentint -10.3513 0.3926 -4.6795 {"}'M' greentint -10.5584 0.2763 -5.2776 {"}'M' greentint -10.3958 0.332 -5.0835 {"}'M' greentint -10.2379 0.4423 -4.91 {"}'M' greentint -10.0926 0.604 -4.767 {"}'M' greentint -9.968 0.8064 -4.6634 {"}'M' greentint -10.484 0.4117 -5.5367 {"}'M' greentint -10.3248 0.4342 -5.3362 {"}'M' greentint -10.1651 0.5227 -5.1552 {"}'M' greentint -10.0184 0.6723 -5.0077 {"}'M' greentint -9.8947 0.8721 -4.9029 {"}'M' greentint -10.3654 0.5937 -5.6912 {"}'M' greentint -10.2066 0.6047 -5.4903 {"}'M' greentint -10.0495 0.7006 -5.313 {"}'M' greentint -9.9111 0.8711 -5.1814 {"}'M' greentint -10.0679 0.8307 -5.5643 {"}'M' greentint -9.9181 0.9844 -5.4135 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 100 1btkA_102F_113}P -12.0351 -1.2181 0.9383 {"}-12.0351 -1.2181 0.9383 { ca tyr A 100 1btkA_102F_113}-11.0386 -1.8724 0.0881 { c tyr A 100 1btkA_102F_113}-10.6969 -1.1933 -1.2387 { o tyr A 100 1btkA_102F_113}-11.406 -1.3716 -2.2424 { c tyr A 100 1btkA_102F_113}P -10.6969 -1.1933 -1.2387 { n pro A 101 1btkA_102F_113}-9.5631 -0.4567 -1.2705 { ca pro A 101 1btkA_102F_113}-9.1376 0.248 -2.4833 { c pro A 101 1btkA_102F_113}-8.3514 -0.5159 -3.538 { o pro A 101 1btkA_102F_113}-7.6092 -1.4653 -3.2518 { c pro A 101 1btkA_102F_113}P -8.3514 -0.5159 -3.538 { n phe A 102 1btkA_102F_113}-8.5569 -0.1052 -4.7841 { ca phe A 102 1btkA_102F_113}-7.7947 -0.6451 -5.8919 { c phe A 102 1btkA_102F_113}-7.5337 0.5151 -6.8372 { o phe A 102 1btkA_102F_113}-8.1566 1.5578 -6.7288 { c phe A 102 1btkA_102F_113}P -7.5337 0.5151 -6.8372 { n gln A 103 1btkA_102F_113}-6.5374 0.3636 -7.6967 { ca gln A 103 1btkA_102F_113}-6.144 1.4305 -8.5936 { c gln A 103 1btkA_102F_113}-6.1412 0.983 -10.0375 { o gln A 103 1btkA_102F_113}-5.8101 -0.1612 -10.3508 { c gln A 103 1btkA_102F_113}P -6.1412 0.983 -10.0375 { n val A 104 1btkA_102F_113}-6.5329 1.8996 -10.9087 { ca val A 104 1btkA_102F_113}-6.5368 1.6529 -12.3461 { c val A 104 1btkA_102F_113}-5.5105 2.6547 -12.8654 { o val A 104 1btkA_102F_113}-5.6845 3.8617 -12.7447 { n leu A 111 1btkA_102F_113}P -6.5328 6.1346 -11.0463 {"}-6.5328 6.1346 -11.0463 { ca leu A 111 1btkA_102F_113}-7.9257 6.2621 -10.6107 { c leu A 111 1btkA_102F_113}-7.994 5.3633 -9.3762 { o leu A 111 1btkA_102F_113}-7.6357 4.1893 -9.4542 { c leu A 111 1btkA_102F_113}P -7.994 5.3633 -9.3762 { n tyr A 112 1btkA_102F_113}-8.4484 5.9242 -8.2593 { ca tyr A 112 1btkA_102F_113}-8.5698 5.1859 -7.0058 { c tyr A 112 1btkA_102F_113}-10.0387 4.9391 -6.7116 { o tyr A 112 1btkA_102F_113}-10.8154 5.8873 -6.5782 { c tyr A 112 1btkA_102F_113}P -10.0387 4.9391 -6.7116 { n val A 113 1btkA_102F_113}-10.3717 3.6598 -6.5723 { ca val A 113 1btkA_102F_113}-11.727 3.1771 -6.3545 { c val A 113 1btkA_102F_113}-11.7765 2.3335 -5.0727 { o val A 113 1btkA_102F_113}-10.9216 1.4674 -4.8771 { c val A 113 1btkA_102F_113}P -11.7765 2.3335 -5.0727 { n phe A 114 1btkA_102F_113}-12.7751 2.5796 -4.2192 { ca phe A 114 1btkA_102F_113}-12.9334 1.8431 -2.9585 { c phe A 114 1btkA_102F_113}-14.1459 0.9189 -2.995 { o phe A 114 1btkA_102F_113}-15.2724 1.3672 -3.2408 { c phe A 114 1btkA_102F_113}P -14.1459 0.9189 -2.995 { n ser A 115 1btkA_102F_113}-13.9023 -0.3668 -2.7856 { ca ser A 115 1btkA_102F_113}-14.9505 -1.3808 -2.7922 { c ser A 115 1btkA_102F_113}-15.4906 -1.6791 -1.381 { o ser A 115 1btkA_102F_113}-14.7673 -1.5882 -0.3806 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 100 1btkA_102F_113}P -12.0351 -1.2181 0.9383 { ca tyr A 100 1btkA_102F_113}P -11.0386 -1.8724 0.0881 { ca pro A 101 1btkA_102F_113}P -9.1376 0.248 -2.4833 { n phe A 102 1btkA_102F_113}P -8.5569 -0.1052 -4.7841 { ca phe A 102 1btkA_102F_113}P -7.7947 -0.6451 -5.8919 { n gln A 103 1btkA_102F_113}P -6.5374 0.3636 -7.6967 { ca gln A 103 1btkA_102F_113}P -6.144 1.4305 -8.5936 { n val A 104 1btkA_102F_113}P -6.5329 1.8996 -10.9087 { ca val A 104 1btkA_102F_113}P -6.5368 1.6529 -12.3461 { n leu A 111 1btkA_102F_113}P -6.5328 6.1346 -11.0463 { ca leu A 111 1btkA_102F_113}P -7.9257 6.2621 -10.6107 { n tyr A 112 1btkA_102F_113}P -8.4484 5.9242 -8.2593 { ca tyr A 112 1btkA_102F_113}P -8.5698 5.1859 -7.0058 { n val A 113 1btkA_102F_113}P -10.3717 3.6598 -6.5723 { ca val A 113 1btkA_102F_113}P -11.727 3.1771 -6.3545 { n phe A 114 1btkA_102F_113}P -12.7751 2.5796 -4.2192 { ca phe A 114 1btkA_102F_113}P -12.9334 1.8431 -2.9585 { n ser A 115 1btkA_102F_113}P -13.9023 -0.3668 -2.7856 { ca ser A 115 1btkA_102F_113}P -14.9505 -1.3808 -2.7922 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 100 1btkA_102F_113}P -11.0386 -1.8724 0.0881 {"}-11.0386 -1.8724 0.0881 { ca pro A 101 1btkA_102F_113}-9.1376 0.248 -2.4833 { ca phe A 102 1btkA_102F_113}-7.7947 -0.6451 -5.8919 { ca gln A 103 1btkA_102F_113}-6.144 1.4305 -8.5936 { ca val A 104 1btkA_102F_113}-6.5368 1.6529 -12.3461 { ca leu A 111 1btkA_102F_113}P -7.9257 6.2621 -10.6107 {"}-7.9257 6.2621 -10.6107 { ca tyr A 112 1btkA_102F_113}-8.5698 5.1859 -7.0058 { ca val A 113 1btkA_102F_113}-11.727 3.1771 -6.3545 { ca phe A 114 1btkA_102F_113}-12.9334 1.8431 -2.9585 { ca ser A 115 1btkA_102F_113}-14.9505 -1.3808 -2.7922 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 102 1btkA_102F_113}P -7.7947 -0.6451 -5.8919 { cb phe A 102 1btkA_102F_113}-8.4268 -1.8699 -6.5583 { cg phe A 102 1btkA_102F_113}-9.7068 -1.6174 -7.3042 { cd1 phe A 102 1btkA_102F_113}-10.9371 -1.7133 -6.6467 { ce1 phe A 102 1btkA_102F_113}-12.1426 -1.5867 -7.3663 { cz phe A 102 1btkA_102F_113}-12.1051 -1.3558 -8.7536 { cg phe A 102 1btkA_102F_113}P -9.7068 -1.6174 -7.3042 { cd2 phe A 102 1btkA_102F_113}-9.6909 -1.38 -8.6833 { ce2 phe A 102 1btkA_102F_113}-10.8691 -1.249 -9.4092 { cz phe A 102 1btkA_102F_113}ghost -12.1051 -1.3558 -8.7536 { ca val A 113 1btkA_102F_113}P -11.727 3.1771 -6.3545 { cb val A 113 1btkA_102F_113}-12.121 2.2983 -7.5622 { cg1 val A 113 1btkA_102F_113}-13.5539 1.8785 -7.4734 { cb val A 113 1btkA_102F_113}P -12.121 2.2983 -7.5622 { cg2 val A 113 1btkA_102F_113}-11.9131 3.0785 -8.866 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 102 1btkA_102F_113}P -8.4268 -1.8699 -6.5583 {"}P -8.4268 -1.8699 -6.5583 { cd1 phe A 102 1btkA_102F_113}P -10.9371 -1.7133 -6.6467 { cd2 phe A 102 1btkA_102F_113}P -9.6909 -1.38 -8.6833 { ce1 phe A 102 1btkA_102F_113}P -12.1426 -1.5867 -7.3663 { ce2 phe A 102 1btkA_102F_113}P -10.8691 -1.249 -9.4092 { cz phe A 102 1btkA_102F_113}P -12.1051 -1.3558 -8.7536 { cb val A 113 1btkA_102F_113}P -12.121 2.2983 -7.5622 { cg1 val A 113 1btkA_102F_113}P -13.5539 1.8785 -7.4734 {"}P -13.5539 1.8785 -7.4734 {"}P -13.5539 1.8785 -7.4734 { cg2 val A 113 1btkA_102F_113}P -11.9131 3.0785 -8.866 {"}P -11.9131 3.0785 -8.866 {"}P -11.9131 3.0785 -8.866 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 102 A}'S' blue -11.1659 0.0171 -6.7785 {"}'S' blue -11.3298 -0.0396 -6.9742 {"}'S' blue -10.9875 0.0055 -6.9729 {"}'S' blue -11.1512 -0.056 -7.1672 {"}'S' blue -10.9418 -0.0979 -7.3192 { CE1 PHE 102 A}'S' blue -12.7804 -0.0557 -6.8085 {"}'S' sky -12.9414 -0.0706 -7.0116 {"}'S' sky -13.1042 -0.1333 -7.2044 {"}'S' blue -13.2629 -0.2423 -7.3792 {"}'S' blue -12.5237 0.0456 -6.8619 {"}'S' sky -12.6796 0.0512 -7.0659 {"}'S' sky -12.84 0.015 -7.2632 {"}'S' sky -13.0007 -0.0634 -7.4479 {"}'S' blue -13.1558 -0.1821 -7.6157 {"}'S' blue -12.397 0.1265 -7.1122 {"}'S' sky -12.5547 0.1133 -7.3127 {"}'S' sky -12.7155 0.0608 -7.5051 {"}'S' sky -12.8728 -0.029 -7.6842 {"}'S' blue -13.0259 -0.1544 -7.8461 {"}'S' blue -11.9064 0.0773 -6.8782 {"}'S' sky -12.0532 0.138 -7.0859 {"}'S' sky -12.2099 0.161 -7.2932 {"}'S' sky -12.3714 0.1436 -7.4981 {"}'S' sky -12.5353 0.0869 -7.6938 {"}'S' blue -11.587 -0.0029 -6.8727 {"}'S' sky -11.7249 0.0881 -7.0752 {"}'S' sky -12.1931 0.132 -7.6925 {"}'S' blue -11.379 -0.0497 -7.0238 {"}'S' sky -11.3039 -0.051 -7.3548 {"}'S' blue -11.2436 -0.117 -7.6726 { CE2 PHE 102 A}'S' blue -11.0917 0.0407 -8.2478 {"}'S' blue -11.2139 0.167 -8.4403 {"}'S' blue -11.3538 0.2479 -8.6431 {"}'S' blue -10.8492 0.1143 -8.3126 {"}'S' blue -10.9668 0.2434 -8.501 {"}'S' blue -11.1022 0.3336 -8.6998 { CZ PHE 102 A}'S' blue -13.0228 -0.1499 -7.8788 {"}'S' blue -13.1805 -0.1499 -8.0824 {"}'S' blue -13.3413 -0.2142 -8.2721 {"}'S' sky -12.8229 0.0144 -7.9353 {"}'S' sky -12.9772 0.032 -8.14 {"}'S' sky -13.1385 -0.0058 -8.3381 {"}'S' sky -13.2971 -0.0965 -8.5187 {"}'S' blue -13.4477 -0.2359 -8.674 {"}'S' sky -12.5899 0.141 -7.9875 {"}'S' sky -12.7429 0.1752 -8.1958 {"}'S' sky -12.9039 0.1603 -8.3989 {"}'S' sky -13.2254 -0.0114 -8.7665 {"}'S' blue -13.3746 -0.1629 -8.9172 {"}'S' sky -12.2028 0.1365 -7.8453 {"}'S' blue -12.3382 0.2267 -8.0442 {"}'S' sky -12.4862 0.2765 -8.2492 {"}'S' sky -12.6421 0.2821 -8.4533 {"}'S' sky -12.8024 0.2459 -8.6505 {"}'S' sky -12.9631 0.1675 -8.8352 {"}'S' blue -13.1183 0.0488 -9.003 {"}'S' sky -12.2076 0.3302 -8.2959 {"}'S' blue -12.3595 0.3574 -8.4995 {"}'S' blue -12.678 0.2917 -8.8925 {"}'S' sky -12.0157 0.3689 -8.4732 {"}'S' blue -12.1723 0.3919 -8.6805 {"}'S' sky -11.3222 -0.053 -7.8869 {"}'S' sky -11.6874 0.319 -8.4625 {"}'S' blue -11.8365 0.372 -8.6698 {"}'S' blue -11.2193 0.0549 -8.2186 {"}'S' sky -11.3415 0.1812 -8.4111 {"}'S' blue -11.4786 0.2721 -8.6141 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 102 A}'S' sea -11.874 0.1411 -7.2825 {"}'S' sea -12.0309 0.1554 -7.49 {"}'S' sea -11.5162 0.0412 -7.2268 {"}'S' sea -11.6648 0.095 -7.4337 {"}'S' sea -11.8224 0.1122 -7.6411 {"}'S' sea -11.4515 0.0085 -7.5616 {"}'S' sea -11.6073 0.03 -7.7693 { CZ PHE 102 A}'S' sea -13.0667 0.0976 -8.5917 {"}'S' sea -11.9372 0.1614 -7.8981 {"}'S' sea -12.0651 0.2643 -8.093 {"}'S' sea -11.6159 0.0761 -7.8735 {"}'S' sea -11.7346 0.2098 -8.0645 {"}'S' sea -11.8689 0.3082 -8.2655 {"}'S' sea -11.4272 0.1034 -8.0661 {"}'S' sea -11.5495 0.228 -8.26 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 113 A}'S' blue -12.3946 0.5721 -7.6532 {"}'S' blue -12.4225 0.6758 -8.1456 {"}'S' blue -12.2804 0.5974 -7.9403 {"}'S' blue -12.2938 0.7845 -8.4235 {"}'S' blue -12.1647 0.6808 -8.2284 { CG1 VAL 113 A}'S' blue -13.4016 0.136 -7.4364 {"}'S' sky -13.2378 0.1741 -7.2366 {"}'S' sky -13.075 0.2498 -7.0468 {"}'S' blue -12.9167 0.3636 -6.8735 {"}'S' blue -13.3042 0.1663 -7.734 {"}'S' sky -13.1465 0.1781 -7.5332 {"}'S' sky -12.9862 0.2285 -7.3409 {"}'S' sky -12.8281 0.317 -7.1605 {"}'S' blue -12.6758 0.4412 -6.9977 {"}'S' sky -13.2439 0.2646 -8.0739 {"}'S' sky -13.0907 0.2384 -7.8688 {"}'S' sky -12.9321 0.2545 -7.6677 {"}'S' sky -12.7706 0.3134 -7.4758 {"}'S' sky -12.6127 0.4133 -7.2999 {"}'S' blue -12.4617 0.5507 -7.1436 {"}'S' sky -12.9987 0.3599 -8.1416 {"}'S' sky -12.8409 0.3482 -7.9353 {"}'S' sky -12.6788 0.3862 -7.736 {"}'S' sky -12.5174 0.4713 -7.5503 {"}'S' sky -12.755 0.492 -8.1822 {"}'S' sky -12.5965 0.504 -7.9803 {"}'S' blue -12.4353 0.5704 -7.7904 {"}'S' blue -12.6408 0.6736 -8.3547 {"}'S' blue -12.4836 0.6714 -8.1513 { HB VAL 113 A}'S' sky -12.1992 0.4935 -7.3836 {"}'S' sky -12.052 0.4505 -7.1811 {"}'S' blue -11.8946 0.4684 -6.982 {"}'S' blue -12.2348 0.5613 -7.8578 {"}'S' sky -12.1194 0.4296 -7.6718 {"}'S' sky -11.6708 0.3528 -7.0718 {"}'S' sky -12.0672 0.529 -8.064 {"}'S' sky -11.3662 0.3288 -7.1029 {"}'S' blue -11.2133 0.4448 -6.9375 {"}'S' sky -11.9168 0.6498 -8.3354 {"}'S' sky -11.2646 0.266 -7.3855 {"}'S' blue -11.1066 0.3518 -7.2045 {"}'S' sky -11.6388 0.577 -8.366 {"}'S' sky -11.2605 0.2804 -7.7932 {"}'S' blue -11.4026 0.658 -8.4496 {"}'S' sky -11.2989 0.4993 -8.2717 {"}'S' blue -11.164 0.4044 -8.0708 {"}'S' blue -11.0618 0.6121 -8.3049 {"}'S' blue -10.9247 0.5371 -8.1054 {HG11 VAL 113 A}'S' blue -13.5905 0.1189 -8.1778 {"}'S' blue -13.5863 0.1333 -8.5855 {"}'S' sky -13.4282 0.151 -8.387 {"}'S' sky -13.2704 0.2271 -8.2042 {"}'S' blue -13.4899 0.2573 -8.8631 {"}'S' sky -13.3341 0.2331 -8.6549 {"}'S' sky -13.0136 0.4004 -8.2875 {"}'S' sky -13.2505 0.39 -8.8977 {"}'S' sky -13.0942 0.4008 -8.6984 {"}'S' sky -12.9381 0.4962 -8.5239 {"}'S' blue -12.9358 0.6138 -8.7853 {HG12 VAL 113 A}'S' blue -13.0731 0.3261 -6.6651 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 113 A}'S' sea -11.9821 0.3481 -7.4723 {"}'S' sea -11.8302 0.3223 -7.269 {"}'S' sea -11.9584 0.3883 -7.8849 {"}'S' sea -11.8277 0.294 -7.6898 {"}'S' green -11.6804 0.2523 -7.4875 {"}'S' sea -11.5249 0.2643 -7.2897 {"}'S' sea -11.8291 0.4737 -8.172 {"}'S' sea -11.7129 0.3419 -7.9865 {"}'S' sea -11.5764 0.2605 -7.7864 {"}'S' sea -11.424 0.2356 -7.5827 {"}'S' sea -11.5362 0.4242 -8.1909 {"}'S' sea -11.4077 0.3234 -7.9958 {HG11 VAL 113 A}'S' sea -13.1709 0.282 -8.4583 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 102 A}'M' green -8.9229 2.4766 -6.0018 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 102 A}'M' greentint -9.23 2.2381 -6.1417 {"}'M' greentint -9.3787 2.0812 -6.2902 {"}'M' greentint -9.4824 1.9848 -6.5876 {"}'M' greentint -9.0808 2.4682 -6.2038 {"}'M' greentint -9.2394 2.3751 -6.3822 {"}'M' greentint -9.3786 2.2071 -6.5154 {"}'M' greentint -9.452 2.0788 -6.8324 {"}'M' greentint -8.8938 2.6574 -6.2717 {"}'M' greentint -9.054 2.5991 -6.4637 {"}'M' greentint -9.2088 2.476 -6.6283 {"}'M' greentint -9.3445 2.2985 -6.7545 {"}'M' greentint -9.3741 2.159 -7.0707 {"}'M' greentint -8.8111 2.7773 -6.5158 {"}'M' greentint -8.9731 2.6951 -6.7014 {"}'M' greentint -9.1254 2.5592 -6.8614 {"}'M' greentint -9.262 2.3776 -6.9862 {"}'M' greentint -8.7162 2.8402 -6.7747 {"}'M' greentint -8.8721 2.7414 -6.9481 {"}'M' greentint -9.0182 2.5979 -7.098 {"}'M' greentint -9.149 2.4159 -7.2164 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H VAL 113 A}'M' green -9.4947 1.9939 -6.9193 {"}'M' green -9.3916 2.1565 -7.1743 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 113 A}'M' greentint -9.3871 1.9986 -6.3819 {"}'M' greentint -9.2369 2.123 -6.2221 {"}'M' greentint -9.1037 2.2986 -6.099 {"}'M' greentint -9.3365 1.9961 -6.7155 {"}'M' greentint -9.1758 2.0721 -6.5287 {"}'M' greentint -9.0263 2.2174 -6.3763 {"}'M' greentint -8.9017 2.4174 -6.2704 {"}'M' greentint -8.8131 2.655 -6.2224 {"}'M' greentint -9.2428 2.1069 -6.9682 {"}'M' greentint -9.0805 2.1518 -6.7703 {"}'M' greentint -8.9263 2.2844 -6.6085 {"}'M' greentint -8.802 2.4878 -6.5039 {"}'M' greentint -8.7237 2.7334 -6.4718 {"}'M' greentint -9.1318 2.2904 -7.1386 {"}'M' greentint -8.9708 2.3184 -6.9387 {"}'M' greentint -8.8228 2.4704 -6.7898 {"}'M' greentint -8.728 2.7045 -6.7325 {"}'M' greentint -8.9983 2.5082 -7.1922 {"}'M' greentint -8.8384 2.6051 -7.0127 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 102 A}'M' greentint -10.0122 0.7523 -4.4381 {"}'M' greentint -10.1454 0.6487 -4.6376 {"}'M' greentint -10.0412 0.4935 -4.4598 {"}'M' greentint -9.8263 0.8437 -4.2801 {"}'M' greentint -9.9305 0.9989 -4.458 {"}'M' greentint -10.0905 0.902 -4.6374 {"}'M' greentint -10.2009 0.8026 -4.9177 {"}'M' greentint -10.2172 0.5489 -4.8684 {"}'M' greentint -10.1505 0.3436 -4.7253 {"}'M' greentint -9.797 1.2167 -4.5115 {"}'M' greentint -9.958 1.1887 -4.7115 {"}'M' greentint -10.1061 1.0367 -4.8603 {"}'M' greentint -10.1726 0.9 -5.1713 {"}'M' greentint -10.223 0.6454 -5.1666 {"}'M' greentint -10.2143 0.3975 -5.0862 {"}'M' greentint -9.6086 1.3866 -4.5781 {"}'M' greentint -9.7675 1.3897 -4.784 {"}'M' greentint -9.9277 1.2987 -4.9669 {"}'M' greentint -10.0691 1.1282 -5.1025 {"}'M' greentint -10.0757 0.9743 -5.4113 {"}'M' greentint -10.144 0.7253 -5.429 {"}'M' greentint -10.1645 0.4721 -5.3855 {"}'M' greentint -9.673 1.4821 -5.0315 {"}'M' greentint -9.8297 1.3701 -5.2029 {"}'M' greentint -9.9682 1.1953 -5.3336 {"}'M' greentint -9.9304 0.9938 -5.6289 {"}'M' greentint -10.0038 0.754 -5.6558 {"}'M' greentint -9.692 1.3841 -5.428 {"}'M' greentint -9.8251 1.2085 -5.5511 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 113 A}'M' greentint -9.996 0.5079 -4.4491 {"}'M' greentint -9.874 0.7045 -4.3461 {"}'M' greentint -9.7757 0.9294 -4.28 {"}'M' greentint -10.1807 0.2853 -4.9891 {"}'M' greentint -10.0229 0.3956 -4.8156 {"}'M' greentint -9.8775 0.5573 -4.6727 {"}'M' greentint -9.7529 0.7597 -4.5691 {"}'M' greentint -9.6565 0.9928 -4.5092 {"}'M' greentint -9.5927 1.2446 -4.4966 {"}'M' greentint -10.1098 0.3875 -5.2418 {"}'M' greentint -9.9501 0.476 -5.0608 {"}'M' greentint -9.8034 0.6256 -4.9133 {"}'M' greentint -9.6796 0.8254 -4.8086 {"}'M' greentint -9.5878 1.0595 -4.7553 {"}'M' greentint -9.5358 1.3104 -4.7569 {"}'M' greentint -9.9915 0.558 -5.3959 {"}'M' greentint -9.8345 0.6538 -5.2186 {"}'M' greentint -9.696 0.8244 -5.0871 {"}'M' greentint -9.5931 1.0479 -5.0162 {"}'M' greentint -9.5387 1.2976 -5.0159 {"}'M' greentint -9.8529 0.784 -5.47 {"}'M' greentint -9.7031 0.9377 -5.3191 {"}'M' greentint -9.6078 1.174 -5.2616 {"}'M' greentint -9.5915 1.4305 -5.3115 {"}'M' greentint -9.7447 1.0819 -5.5302 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 232 1bueA_247Y_234}P -5.694 6.194 -10.4124 {"}-5.694 6.194 -10.4124 { ca gly A 232 1bueA_247Y_234}-7.1368 6.2881 -10.5774 { c gly A 232 1bueA_247Y_234}-7.6818 5.1803 -9.6956 { o gly A 232 1bueA_247Y_234}-7.3478 4.0228 -9.9147 { c gly A 232 1bueA_247Y_234}P -7.6818 5.1803 -9.6956 { n asp A 233 1bueA_247Y_234}-8.5297 5.5026 -8.7202 { ca asp A 233 1bueA_247Y_234}-9.0278 4.4653 -7.816 { c asp A 233 1bueA_247Y_234}-10.4463 4.6648 -7.2968 { o asp A 233 1bueA_247Y_234}-11.0944 5.6803 -7.5616 { c asp A 233 1bueA_247Y_234}P -10.4463 4.6648 -7.2968 { n lys A 234 1bueA_247Y_234}-10.9107 3.6536 -6.5694 { ca lys A 234 1bueA_247Y_234}-12.2018 3.6866 -5.8944 { c lys A 234 1bueA_247Y_234}-12.0217 2.9253 -4.5911 { o lys A 234 1bueA_247Y_234}-11.6076 1.7672 -4.5879 { c lys A 234 1bueA_247Y_234}P -12.0217 2.9253 -4.5911 { n thr A 235 1bueA_247Y_234}-12.3042 3.6031 -3.4845 { ca thr A 235 1bueA_247Y_234}-12.1836 3.0169 -2.1589 { c thr A 235 1bueA_247Y_234}-13.4987 2.4154 -1.6796 { o thr A 235 1bueA_247Y_234}-14.5648 2.6733 -2.2386 { c thr A 235 1bueA_247Y_234}P -13.4987 2.4154 -1.6796 { n gly A 236 1bueA_247Y_234}-13.4029 1.6443 -0.6053 { ca gly A 236 1bueA_247Y_234}-14.5695 1.0331 -0.0097 { c gly A 236 1bueA_247Y_234}-14.301 0.9445 1.4762 { o gly A 236 1bueA_247Y_234}-13.2189 0.5231 1.8774 { n asn A 245 1bueA_247Y_234}P -11.1089 -1.3415 1.6428 {"}-11.1089 -1.3415 1.6428 { ca asn A 245 1bueA_247Y_234}-10.4348 -1.7734 0.4344 { c asn A 245 1bueA_247Y_234}-10.1595 -0.6095 -0.5162 { o asn A 245 1bueA_247Y_234}-10.5135 0.5402 -0.2456 { c asn A 245 1bueA_247Y_234}P -10.1595 -0.6095 -0.5162 { n asp A 246 1bueA_247Y_234}-9.529 -0.9345 -1.6377 { ca asp A 246 1bueA_247Y_234}-9.1916 0.0419 -2.6605 { c asp A 246 1bueA_247Y_234}-8.6821 -0.7085 -3.8879 { o asp A 246 1bueA_247Y_234}-8.0154 -1.7339 -3.7646 { c asp A 246 1bueA_247Y_234}P -8.6821 -0.7085 -3.8879 { n tyr A 247 1bueA_247Y_234}-9.0737 -0.249 -5.0681 { ca tyr A 247 1bueA_247Y_234}-8.5664 -0.8414 -6.2987 { c tyr A 247 1bueA_247Y_234}-8.1861 0.3246 -7.1797 { o tyr A 247 1bueA_247Y_234}-8.783 1.3977 -7.0818 { c tyr A 247 1bueA_247Y_234}P -8.1861 0.3246 -7.1797 { n ala A 248 1bueA_247Y_234}-7.187 0.1301 -8.0306 { ca ala A 248 1bueA_247Y_234}-6.7411 1.2237 -8.8652 { c ala A 248 1bueA_247Y_234}-6.0102 0.8319 -10.1316 { o ala A 248 1bueA_247Y_234}-5.5443 -0.2992 -10.2859 { c ala A 248 1bueA_247Y_234}P -6.0102 0.8319 -10.1316 { n val A 249 1bueA_247Y_234}-5.9973 1.7783 -11.0614 { ca val A 249 1bueA_247Y_234}-5.2446 1.6538 -12.2958 { c val A 249 1bueA_247Y_234}-4.135 2.6465 -11.9695 { o val A 249 1bueA_247Y_234}-4.4084 3.7825 -11.5653 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 232 1bueA_247Y_234}P -5.694 6.194 -10.4124 { ca gly A 232 1bueA_247Y_234}P -7.1368 6.2881 -10.5774 {"}P -7.1368 6.2881 -10.5774 { n asp A 233 1bueA_247Y_234}P -8.5297 5.5026 -8.7202 { ca asp A 233 1bueA_247Y_234}P -9.0278 4.4653 -7.816 { n lys A 234 1bueA_247Y_234}P -10.9107 3.6536 -6.5694 { ca lys A 234 1bueA_247Y_234}P -12.2018 3.6866 -5.8944 { n thr A 235 1bueA_247Y_234}P -12.3042 3.6031 -3.4845 { ca thr A 235 1bueA_247Y_234}P -12.1836 3.0169 -2.1589 { n gly A 236 1bueA_247Y_234}P -13.4029 1.6443 -0.6053 { ca gly A 236 1bueA_247Y_234}P -14.5695 1.0331 -0.0097 {"}P -14.5695 1.0331 -0.0097 { n asn A 245 1bueA_247Y_234}P -11.1089 -1.3415 1.6428 { ca asn A 245 1bueA_247Y_234}P -10.4348 -1.7734 0.4344 { n asp A 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{ ce2 tyr A 247 1bueA_247Y_234}-13.3232 -1.2772 -7.2459 { cz tyr A 247 1bueA_247Y_234}ghost -13.402 -0.3414 -8.2576 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb lys A 234 1bueA_247Y_234}P -13.3282 3.0571 -6.7093 {"}P -13.3282 3.0571 -6.7093 { cg lys A 234 1bueA_247Y_234}P -14.6771 3.085 -5.967 {"}P -14.6771 3.085 -5.967 { cd lys A 234 1bueA_247Y_234}P -15.1719 4.5176 -5.7416 {"}P -15.1719 4.5176 -5.7416 { ce lys A 234 1bueA_247Y_234}P -16.3543 4.5878 -4.7728 {"}P -16.3543 4.5878 -4.7728 { nz lys A 234 1bueA_247Y_234}P -15.9406 4.8384 -3.3588 {"}P -15.9406 4.8384 -3.3588 {"}P -15.9406 4.8384 -3.3588 { cb tyr A 247 1bueA_247Y_234}P -9.5553 -1.8032 -6.9762 {"}P -9.5553 -1.8032 -6.9762 { cd1 tyr A 247 1bueA_247Y_234}P -11.0068 -0.2958 -8.4156 { cd2 tyr A 247 1bueA_247Y_234}P -12.0777 -1.7196 -6.8166 { ce1 tyr A 247 1bueA_247Y_234}P -12.25 0.1582 -8.8477 { ce2 tyr A 247 1bueA_247Y_234}P -13.3232 -1.2772 -7.2459 { oh tyr A 247 1bueA_247Y_234}P -14.6311 0.0902 -8.6913 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 247 A}'S' green -12.5418 0.9657 -7.3222 {"}'S' green -12.9678 1.5284 -8.0295 {"}'S' sea -13.1221 1.546 -8.2341 {"}'S' green -12.3019 1.0821 -7.3626 {"}'S' green -12.7347 1.655 -8.0816 {"}'S' sea -12.8877 1.6892 -8.29 {"}'S' sea -12.0575 1.1627 -7.4282 {"}'S' green -12.1325 1.3575 -7.5784 {"}'S' green -12.2301 1.5214 -7.7511 {"}'S' green -12.3477 1.6505 -7.9395 {"}'S' sea -12.4831 1.7407 -8.1383 { CZ TYR 247 A}'S' green -13.5257 0.7825 -6.9215 {"}'S' green -13.6246 0.9482 -7.0962 {"}'S' green -13.7468 1.0745 -7.2886 {"}'S' green -13.8867 1.1554 -7.4915 {"}'S' sea -13.2096 0.6631 -6.838 {"}'S' green -13.2845 0.8579 -6.9883 {"}'S' green -13.783 1.2909 -7.7532 {"}'S' sea -12.9557 0.6737 -6.9036 {"}'S' sea -13.6563 1.3718 -8.0035 {"}'S' sea -12.7335 0.7302 -7.0469 {"}'S' green -13.3126 1.3833 -7.9772 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 247 A}'S' P -13.0248 1.2976 -7.7694 {"}'S' -13.007 1.2716 -7.7938 {"}'S' P -12.6073 1.1688 -7.4649 {"}'S' -12.5997 1.147 -7.4957 {"}'S' P -12.704 1.336 -7.6352 {"}'S' -12.6857 1.2897 -7.6834 {"}'S' P -12.8255 1.458 -7.8275 {"}'S' -12.809 1.4197 -7.856 {"}'S' P -12.3737 1.2821 -7.5116 {"}'S' -12.3736 1.2775 -7.5172 {"}'S' P -12.4726 1.4478 -7.6863 {"}'S' -12.469 1.4234 -7.7082 {"}'S' P -12.5948 1.5741 -7.8788 {"}'S' -12.5911 1.5584 -7.8888 { CZ TYR 247 A}'S' P -13.3821 1.0218 -7.1609 {"}'S' -13.3822 0.9803 -7.1942 {"}'S' P -13.4997 1.1509 -7.3493 {"}'S' -13.4968 1.098 -7.3812 {"}'S' P -13.6351 1.2411 -7.5482 {"}'S' -13.6326 1.2237 -7.5561 {"}'S' P -13.0281 0.869 -7.0505 {"}'S' -13.0297 0.8626 -7.0581 {"}'S' P -13.1214 1.038 -7.2183 {"}'S' -13.133 0.977 -7.2647 {"}'S' P -13.234 1.1758 -7.4021 {"}'S' -13.2433 1.0883 -7.4512 {"}'S' P -13.362 1.2787 -7.597 {"}'S' -13.3648 1.2116 -7.6249 {"}'S' P -13.5044 1.3446 -7.7999 {"}'S' -13.5045 1.3432 -7.7997 {"}'S' P -12.8126 0.9241 -7.2027 {"}'S' -12.8159 0.9165 -7.2088 {"}'S' P -12.9127 1.0905 -7.3775 {"}'S' -12.9322 1.0332 -7.4132 {"}'S' P -13.0314 1.2242 -7.5685 {"}'S' -13.0489 1.1501 -7.6011 {"}'S' P -13.1658 1.3226 -7.7695 {"}'S' -13.172 1.2794 -7.7818 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 LYS 234 A}'S' green -13.8188 1.1724 -7.2539 {"}'S' green -13.7034 1.0408 -7.0678 {"}'S' sea -13.5661 0.9593 -6.8683 {"}'S' green -13.7324 1.3226 -7.616 {"}'S' green -13.2644 0.8635 -6.8835 {"}'S' green -13.5571 1.4727 -7.8619 {"}'S' green -13.008 0.8467 -6.9787 {"}'S' green -13.2938 1.3845 -7.9074 {"}'S' sea -12.6867 0.9085 -6.9912 {"}'S' sea -13.0704 1.7204 -8.0803 {"}'S' green -13.0511 1.4781 -7.9883 {"}'S' green -12.5923 0.9914 -7.2586 {"}'S' sea -12.8039 1.8315 -8.0728 {"}'S' green -12.3523 1.159 -7.3022 {"}'S' sea -12.5423 1.9125 -7.9885 {"}'S' green -12.5588 1.6547 -7.9384 {"}'S' green -12.194 1.372 -7.389 {"}'S' green -12.3376 1.7253 -7.8163 {"}'S' green -12.2326 1.5689 -7.6371 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 LYS 234 A}'S' P -13.6512 1.1402 -7.46 {"}'S' -13.6393 1.1583 -7.4496 {"}'S' P -13.5424 0.9995 -7.2809 {"}'S' -13.5258 1.0367 -7.2684 {"}'S' P -13.4117 0.9051 -7.0858 {"}'S' -13.4065 0.9235 -7.083 {"}'S' P -13.5008 1.261 -7.7314 {"}'S' -13.4899 1.2804 -7.7107 {"}'S' P -13.4131 1.0848 -7.568 {"}'S' -13.3887 1.1514 -7.5242 {"}'S' P -13.297 0.9531 -7.3825 {"}'S' -13.2791 1.0361 -7.3481 {"}'S' P -13.1604 0.8717 -7.1825 {"}'S' -13.1559 0.9269 -7.1718 {"}'S' P -13.2228 1.1881 -7.762 {"}'S' -13.2141 1.2346 -7.7164 {"}'S' P -13.1202 1.0353 -7.5869 {"}'S' -13.1155 1.1158 -7.534 {"}'S' P -12.9917 0.9346 -7.3918 {"}'S' -12.9961 1.0064 -7.3629 {"}'S' P -12.8445 0.8915 -7.1892 {"}'S' -12.8469 0.9043 -7.1869 {"}'S' P -12.9866 1.2692 -7.8456 {"}'S' -12.9895 1.296 -7.8147 {"}'S' P -12.8829 1.1104 -7.6677 {"}'S' -12.8911 1.1521 -7.6353 {"}'S' P -12.748 1.0156 -7.4668 {"}'S' -12.754 1.0372 -7.456 {"}'S' P -12.8035 1.5873 -8.0046 {"}'S' -12.8035 1.5873 -8.0046 {"}'S' P -12.7484 1.3761 -7.876 {"}'S' -12.7639 1.4073 -7.8309 {"}'S' P -12.6458 1.2233 -7.7009 {"}'S' -12.6703 1.2696 -7.6578 {"}'S' P -12.5087 1.1483 -7.5014 {"}'S' -12.5223 1.17 -7.4875 {"}'S' P -12.4909 1.4462 -7.793 {"}'S' -12.5078 1.4628 -7.7686 {"}'S' P -12.3575 1.3434 -7.5923 {"}'S' -12.3638 1.349 -7.5868 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 247 A}'M' green -9.7962 1.8788 -6.2439 {"}'M' green -9.9551 1.7901 -6.4254 {"}'M' sea -10.0987 1.6824 -6.6979 {"}'M' sea -9.5588 2.0116 -6.0916 {"}'M' green -9.6931 2.1114 -6.2928 {"}'M' green -10.1087 1.8247 -6.9407 {"}'M' sea -9.4114 2.2372 -6.1552 {"}'M' sea -10.0783 1.9187 -7.1854 {"}'M' green -9.364 2.4866 -6.4208 {"}'M' green -9.9709 2.1384 -7.1075 {"}'M' sea -9.2769 2.6407 -6.6667 {"}'M' green -9.437 2.6166 -6.8681 {"}'M' green -9.5995 2.535 -7.0545 {"}'M' green -9.7517 2.3991 -7.2144 {"}'M' sea -9.8884 2.2175 -7.3392 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 247 A}'M' greentint -9.8564 2.078 -6.4947 {"}'M' greentint -10.005 1.9211 -6.6432 {"}'M' greentint -9.5492 2.3165 -6.3548 {"}'M' greentint -9.7072 2.3081 -6.5568 {"}'M' greentint -9.8657 2.215 -6.7352 {"}'M' greentint -10.005 2.047 -6.8684 {"}'M' greentint -9.5202 2.4972 -6.6247 {"}'M' greentint -9.6804 2.439 -6.8167 {"}'M' greentint -9.8351 2.3159 -6.9813 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H LYS 234 A}'M' green -10.2058 1.8718 -6.744 {"}'M' green -10.0476 1.8741 -6.5403 {"}'M' green -9.8869 1.95 -6.3534 {"}'M' green -9.7374 2.0954 -6.201 {"}'M' sea -9.6128 2.2954 -6.0952 {"}'M' green -10.1027 2.0345 -6.9991 {"}'M' green -9.5131 2.3657 -6.3287 {"}'M' sea -9.4348 2.6114 -6.2965 {"}'M' green -9.9746 2.2701 -7.1615 {"}'M' green -9.4391 2.5825 -6.5572 {"}'M' green -9.8136 2.5414 -7.1947 {"}'M' green -9.4945 2.7364 -6.8373 {"}'M' green -9.6277 2.6328 -7.0368 @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 234 A}'M' greentint -9.9539 1.9849 -6.7929 {"}'M' greentint -9.7916 2.0298 -6.595 {"}'M' greentint -9.6373 2.1624 -6.4333 {"}'M' greentint -9.8429 2.1684 -6.9634 {"}'M' greentint -9.6819 2.1964 -6.7634 {"}'M' greentint -9.5339 2.3484 -6.6145 {"}'M' greentint -9.7094 2.3862 -7.0169 {"}'M' greentint -9.5494 2.4831 -6.8375 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 247 A}'M' -10.7079 0.5666 -5.3227 {"}'M' -10.5606 0.8955 -5.5673 {"}'M' -9.9966 1.4425 -4.9896 @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 247 A}'M' sea -10.4971 0.6735 -4.5941 {"}'M' sea -10.6303 0.5699 -4.7936 {"}'M' sea -10.3112 0.7649 -4.4361 {"}'M' green -10.4154 0.9201 -4.614 {"}'M' green -10.5754 0.8232 -4.7934 {"}'M' green -10.6858 0.7238 -5.0737 {"}'M' sea -10.702 0.4701 -5.0244 {"}'M' sea -10.1502 1.0362 -4.4693 {"}'M' green -10.2819 1.1379 -4.6675 {"}'M' green -10.6575 0.8212 -5.3273 {"}'M' sea -10.0935 1.3078 -4.7341 {"}'M' green -10.2524 1.311 -4.9401 {"}'M' green -10.4126 1.2199 -5.1229 {"}'M' green -10.554 1.0494 -5.2585 {"}'M' sea -10.1579 1.4033 -5.1875 {"}'M' sea -10.3146 1.2913 -5.3589 {"}'M' sea -10.4531 1.1166 -5.4896 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 247 A}'M' greentint -10.4429 1.1099 -4.8675 {"}'M' greentint -10.5909 0.9579 -5.0163 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LYS 234 A}'M' sky -10.8668 0.5851 -4.6999 {"}'M' sky -10.439 1.0594 -4.2798 {"}'M' sky -10.2738 1.3593 -4.466 {"}'M' sky -10.2247 1.5974 -4.7267 {"}'M' sky -10.3754 1.633 -5.2398 @dotlist {x} color= red width= 1 master= {vdw contact} { O LYS 234 A}'M' sea -10.7089 0.6953 -4.5264 {"}'M' sea -10.5636 0.857 -4.3834 {"}'M' sea -10.955 0.6648 -5.1531 {"}'M' green -10.7958 0.6872 -4.9526 {"}'M' green -10.6361 0.7758 -4.7716 {"}'M' green -10.4894 0.9254 -4.6241 {"}'M' green -10.3657 1.1251 -4.5193 {"}'M' sea -10.8364 0.8467 -5.3076 {"}'M' green -10.6776 0.8577 -5.1067 {"}'M' green -10.2791 1.3476 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1crzA_195Y_206}-8.433 5.8694 -8.776 { ca leu A 205 1crzA_195Y_206}-8.4772 5.2654 -7.4477 { c leu A 205 1crzA_195Y_206}-9.9417 5.0169 -7.101 { o leu A 205 1crzA_195Y_206}-10.7631 5.9384 -7.1387 { c leu A 205 1crzA_195Y_206}P -9.9417 5.0169 -7.101 { n val A 206 1crzA_195Y_206}-10.2796 3.7779 -6.764 { ca val A 206 1crzA_195Y_206}-11.6606 3.4765 -6.4021 { c val A 206 1crzA_195Y_206}-11.7116 2.7034 -5.0941 { o val A 206 1crzA_195Y_206}-10.687 2.2562 -4.5947 { c val A 206 1crzA_195Y_206}P -11.7116 2.7034 -5.0941 { n ile A 207 1crzA_195Y_206}-12.9119 2.5738 -4.5416 { ca ile A 207 1crzA_195Y_206}-13.137 1.8396 -3.3094 { c ile A 207 1crzA_195Y_206}-14.337 0.9524 -3.5748 { o ile A 207 1crzA_195Y_206}-15.4488 1.431 -3.8143 { c ile A 207 1crzA_195Y_206}P -14.337 0.9524 -3.5748 { n gln A 208 1crzA_195Y_206}-14.1024 -0.3505 -3.5464 { ca gln A 208 1crzA_195Y_206}-15.1534 -1.3146 -3.8109 { c gln A 208 1crzA_195Y_206}-15.5815 -2.0556 -2.5471 { o gln A 208 1crzA_195Y_206}-14.7345 -2.5409 -1.781 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1crzA_195Y_206}-7.4871 -1.4091 -5.8799 { cg tyr A 195 1crzA_195Y_206}-8.7856 -1.6841 -6.5631 { cd1 tyr A 195 1crzA_195Y_206}-8.8874 -1.6165 -7.9446 { ce1 tyr A 195 1crzA_195Y_206}-10.0837 -1.8947 -8.5831 { cz tyr A 195 1crzA_195Y_206}-11.2059 -2.2447 -7.8292 { oh tyr A 195 1crzA_195Y_206}-12.4052 -2.5115 -8.4574 { cg tyr A 195 1crzA_195Y_206}P -8.7856 -1.6841 -6.5631 { cd2 tyr A 195 1crzA_195Y_206}-9.9192 -2.0349 -5.8263 { ce2 tyr A 195 1crzA_195Y_206}-11.1272 -2.3155 -6.4529 { cz tyr A 195 1crzA_195Y_206}ghost -11.2059 -2.2447 -7.8292 { ca val A 206 1crzA_195Y_206}P -11.6606 3.4765 -6.4021 { cb val A 206 1crzA_195Y_206}-12.384 2.6424 -7.4996 { cg1 val A 206 1crzA_195Y_206}-12.3396 3.3772 -8.8284 { cb val A 206 1crzA_195Y_206}P -12.384 2.6424 -7.4996 { cg2 val A 206 1crzA_195Y_206}-11.7632 1.2707 -7.6196 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 195 1crzA_195Y_206}P -7.4871 -1.4091 -5.8799 {"}P -7.4871 -1.4091 -5.8799 { cd1 tyr A 195 1crzA_195Y_206}P -8.8874 -1.6165 -7.9446 { cd2 tyr A 195 1crzA_195Y_206}P -9.9192 -2.0349 -5.8263 { ce1 tyr A 195 1crzA_195Y_206}P -10.0837 -1.8947 -8.5831 { ce2 tyr A 195 1crzA_195Y_206}P -11.1272 -2.3155 -6.4529 { oh tyr A 195 1crzA_195Y_206}P -12.4052 -2.5115 -8.4574 { cb val A 206 1crzA_195Y_206}P -12.384 2.6424 -7.4996 { cg1 val A 206 1crzA_195Y_206}P -12.3396 3.3772 -8.8284 {"}P -12.3396 3.3772 -8.8284 {"}P -12.3396 3.3772 -8.8284 { cg2 val A 206 1crzA_195Y_206}P -11.7632 1.2707 -7.6196 {"}P -11.7632 1.2707 -7.6196 {"}P -11.7632 1.2707 -7.6196 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 195 A}'S' blue -10.6592 -0.5948 -7.5629 {"}'S' sky -10.8015 -0.5245 -7.7648 {"}'S' sky -10.5684 -0.3978 -7.817 {"}'S' sky -11.0453 -0.4412 -8.4212 {"}'S' blue -11.2039 -0.5502 -8.5961 {"}'S' blue -10.3168 -0.3121 -7.8737 {"}'S' sky -10.4647 -0.2623 -8.0787 {"}'S' sky -10.6206 -0.2567 -8.2828 {"}'S' sky -10.781 -0.2929 -8.4801 {"}'S' blue -10.9417 -0.3713 -8.6647 {"}'S' blue -10.338 -0.1814 -8.329 {"}'S' blue -10.4957 -0.1946 -8.5295 {"}'S' blue -10.6565 -0.2471 -8.722 { CE2 TYR 195 A}'S' sky -11.6641 -0.6775 -6.1526 {"}'S' sky -11.8245 -0.7137 -6.3499 {"}'S' blue -11.9852 -0.7922 -6.5345 {"}'S' sky -11.3816 -0.6023 -6.1988 {"}'S' sky -11.7001 -0.668 -6.5918 {"}'S' sky -11.8573 -0.7577 -6.7709 {"}'S' sky -11.1944 -0.5677 -6.3798 {"}'S' sky -11.5199 -0.6418 -6.7804 {"}'S' sky -11.681 -0.7355 -6.9622 {"}'S' blue -11.0155 -0.5733 -6.5766 {"}'S' sky -11.1776 -0.5968 -6.7792 {"}'S' sky -11.3413 -0.6582 -6.9734 {"}'S' blue -10.9687 -0.6395 -6.9316 { CZ TYR 195 A}'S' sky -11.6906 -0.7478 -7.063 {"}'S' sky -11.8436 -0.7136 -7.2714 {"}'S' sky -12.0047 -0.7286 -7.4744 {"}'S' blue -12.1675 -0.7912 -7.6673 {"}'S' sky -11.439 -0.6621 -7.1198 {"}'S' sky -12.0639 -0.7214 -7.9108 {"}'S' blue -12.219 -0.84 -8.0786 {"}'S' sky -11.1659 -0.6245 -7.1686 {"}'S' sky -11.936 -0.6869 -8.1471 {"}'S' blue -12.0892 -0.8124 -8.309 {"}'S' sky -10.9697 -0.5807 -7.3411 {"}'S' sky -11.7597 -0.6648 -8.3384 {"}'S' blue -11.9152 -0.7945 -8.5042 {"}'S' sky -10.7882 -0.5699 -7.5381 {"}'S' sky -11.4199 -0.5874 -8.3497 {"}'S' blue -11.5808 -0.6859 -8.5299 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 195 A}'S' sea -10.9558 -0.5068 -7.9695 {"}'S' sea -10.7214 -0.3636 -8.0254 {"}'S' sea -10.8825 -0.3785 -8.2284 { CE2 TYR 195 A}'S' sea -11.5392 -0.6154 -6.3993 {"}'S' sea -11.356 -0.5851 -6.5847 { CZ TYR 195 A}'S' sea -11.5869 -0.6123 -7.3247 {"}'S' green -11.7428 -0.6068 -7.5288 {"}'S' sea -11.9032 -0.643 -7.7261 {"}'S' sea -11.3083 -0.5587 -7.3715 {"}'S' green -11.4602 -0.5315 -7.5751 {"}'S' green -11.6179 -0.5446 -7.7756 {"}'S' green -11.7787 -0.5972 -7.968 {"}'S' sea -11.1165 -0.5199 -7.5488 {"}'S' green -11.2731 -0.4969 -7.7561 {"}'S' green -11.4347 -0.5144 -7.961 {"}'S' sea -11.5986 -0.5711 -8.1567 {"}'S' sea -10.9373 -0.5169 -7.7454 {"}'S' sea -11.0942 -0.5025 -7.9529 {"}'S' sea -11.2563 -0.526 -8.1554 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 206 A}'S' blue -12.236 -0.4127 -7.5449 {"}'S' sky -12.0783 -0.4271 -7.338 {"}'S' sky -11.9162 -0.4037 -7.1354 {"}'S' sky -12.1854 -0.4017 -7.9175 {"}'S' sky -11.5551 -0.3889 -7.1049 {"}'S' blue -11.1259 -0.2441 -7.0197 {"}'S' sky -11.0374 -0.2908 -7.3067 {"}'S' sky -11.5951 -0.2751 -8.4228 {"}'S' blue -10.822 -0.1945 -7.4461 {"}'S' blue -11.3544 -0.1891 -8.4945 {"}'S' sky -11.208 -0.2479 -8.2878 {"}'S' sky -10.7267 -0.1365 -7.6965 {"}'S' sky -11.1144 -0.0737 -8.533 {"}'S' sky -10.9642 -0.1157 -8.3284 {"}'S' sky -10.6445 -0.0373 -7.9366 {"}'S' blue -10.4895 0.0799 -7.7685 {"}'S' blue -10.8501 0.0658 -8.5009 {"}'S' sky -10.6929 0.0637 -8.2975 {"}'S' blue -10.5318 0.126 -8.1069 {HG21 VAL 206 A}'S' blue -12.3289 -0.4418 -8.1368 {"}'S' blue -12.228 -0.4705 -8.4299 {"}'S' sky -12.0686 -0.4401 -8.2327 {"}'S' blue -12.0645 -0.4257 -8.6404 {"}'S' sky -11.9063 -0.408 -8.4419 {"}'S' blue -11.649 -0.2769 -8.5132 {HG23 VAL 206 A}'S' blue -12.0457 -0.4071 -6.594 {"}'S' sky -11.8902 -0.3952 -6.3961 {"}'S' sky -11.7315 -0.3307 -6.2094 {"}'S' blue -11.9417 -0.3989 -6.8929 {"}'S' sky -11.7893 -0.4239 -6.6892 {"}'S' sky -11.472 -0.3077 -6.311 {"}'S' blue -11.3219 -0.1718 -6.1556 {"}'S' sky -11.6258 -0.3791 -6.8997 {"}'S' sky -11.3099 -0.2853 -6.5184 {"}'S' blue -11.1595 -0.1539 -6.3599 {"}'S' blue -11.2103 -0.2303 -6.7725 @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 206 A}'S' sea -12.0368 -0.4555 -7.7106 {"}'S' sea -11.8795 -0.4718 -7.5021 {"}'S' sea -11.7174 -0.4497 -7.2993 {"}'S' sea -11.9226 -0.4302 -7.9977 {"}'S' green -11.7702 -0.471 -7.7904 {"}'S' green -11.6108 -0.4717 -7.5826 {"}'S' green -11.447 -0.4337 -7.3828 {"}'S' sea -11.2843 -0.3579 -7.193 {"}'S' sea -11.6657 -0.4137 -8.0845 {"}'S' green -11.5134 -0.4414 -7.8802 {"}'S' green -11.3558 -0.4297 -7.6794 {"}'S' green -11.1955 -0.3793 -7.4871 {"}'S' sea -11.4531 -0.3432 -8.2201 {"}'S' green -11.3004 -0.3702 -8.0154 {"}'S' green -11.1413 -0.3533 -7.8139 {"}'S' sea -10.9799 -0.2944 -7.622 {"}'S' sea -11.0502 -0.2596 -8.0815 {"}'S' sea -10.888 -0.2216 -7.8822 {"}'S' sea -10.8058 -0.1038 -8.1265 {HG23 VAL 206 A}'S' sea -11.6299 -0.3934 -6.492 {"}'S' sea -11.4676 -0.3613 -6.7012 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 195 A}'M' green -9.3995 2.0207 -6.5338 {"}'M' green -8.85 2.6548 -6.1908 {"}'M' green -8.6434 3.0184 -6.9637 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 195 A}'M' greentint -9.1572 2.4163 -6.3306 {"}'M' greentint -9.3058 2.2594 -6.4791 {"}'M' greentint -9.4096 2.163 -6.7766 {"}'M' greentint -9.008 2.6464 -6.3928 {"}'M' greentint -9.1666 2.5533 -6.5712 {"}'M' greentint -9.3058 2.3853 -6.7043 {"}'M' greentint -9.3792 2.257 -7.0214 {"}'M' greentint -8.821 2.8356 -6.4606 {"}'M' greentint -8.9812 2.7773 -6.6526 {"}'M' greentint -9.136 2.6542 -6.8173 {"}'M' greentint -9.2717 2.4767 -6.9434 {"}'M' greentint -9.3013 2.3372 -7.2596 {"}'M' greentint -8.7383 2.9555 -6.7047 {"}'M' greentint -8.9003 2.8733 -6.8904 {"}'M' greentint -9.0526 2.7374 -7.0503 {"}'M' greentint -9.1892 2.5558 -7.1752 {"}'M' greentint -8.7992 2.9196 -7.137 {"}'M' greentint -8.9454 2.7761 -7.2869 {"}'M' greentint -9.0762 2.5941 -7.4053 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 206 A}'M' greentint -9.3411 2.0764 -6.5078 {"}'M' greentint -9.1909 2.2009 -6.3479 {"}'M' greentint -9.0577 2.3765 -6.2248 {"}'M' greentint -9.2905 2.0739 -6.8414 {"}'M' greentint -9.1299 2.1499 -6.6545 {"}'M' greentint -8.9803 2.2953 -6.5021 {"}'M' greentint -8.8558 2.4952 -6.3963 {"}'M' greentint -8.7672 2.7328 -6.3482 {"}'M' greentint -9.1968 2.1848 -7.094 {"}'M' greentint -9.0345 2.2297 -6.8961 {"}'M' greentint -8.8803 2.3623 -6.7344 {"}'M' greentint -8.756 2.5656 -6.6298 {"}'M' greentint -8.6777 2.8113 -6.5976 {"}'M' greentint -9.0858 2.3683 -7.2645 {"}'M' greentint -8.9248 2.3963 -7.0645 {"}'M' greentint -8.7768 2.5483 -6.9156 {"}'M' greentint -8.682 2.7824 -6.8583 {"}'M' greentint -8.9524 2.5861 -7.318 {"}'M' greentint -8.7924 2.683 -7.1386 {"}'M' greentint -8.7374 2.9363 -7.1384 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 195 A}'M' green -9.4399 1.6438 -4.2422 {"}'M' green -9.2863 2.0501 -4.7625 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 195 A}'M' greentint -9.7868 1.2811 -4.367 {"}'M' greentint -9.9201 1.1775 -4.5665 {"}'M' greentint -9.7051 1.5277 -4.3868 {"}'M' greentint -9.8651 1.4308 -4.5663 {"}'M' greentint -9.9755 1.3314 -4.8465 {"}'M' greentint -9.9918 1.0777 -4.7972 {"}'M' greentint -9.5716 1.7455 -4.4404 {"}'M' greentint -9.7326 1.7175 -4.6403 {"}'M' greentint -9.8807 1.5655 -4.7892 {"}'M' greentint -9.9472 1.4289 -5.1001 {"}'M' greentint -9.9976 1.1742 -5.0955 {"}'M' greentint -9.3832 1.9154 -4.507 {"}'M' greentint -9.5421 1.9186 -4.7129 {"}'M' greentint -9.7024 1.8275 -4.8958 {"}'M' greentint -9.8438 1.657 -5.0313 {"}'M' greentint -9.8503 1.5031 -5.3401 {"}'M' greentint -9.4477 2.0109 -4.9604 {"}'M' greentint -9.6043 1.8989 -5.1317 {"}'M' greentint -9.7429 1.7242 -5.2625 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 206 A}'M' green -9.4219 1.7815 -4.2268 {"}'M' green -10.0344 1.1537 -5.16 {"}'M' green -9.3041 2.0863 -4.7335 {"}'M' green -9.6688 1.7733 -5.4254 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 206 A}'M' greentint -9.9462 1.074 -4.7067 {"}'M' greentint -9.7884 1.1843 -4.5333 {"}'M' greentint -9.643 1.346 -4.3903 {"}'M' greentint -9.5184 1.5484 -4.2867 {"}'M' greentint -9.8752 1.1762 -4.9595 {"}'M' greentint -9.7155 1.2648 -4.7785 {"}'M' greentint -9.5688 1.4143 -4.6309 {"}'M' greentint -9.4451 1.6141 -4.5262 {"}'M' greentint -9.3532 1.8483 -4.4729 {"}'M' greentint -9.9158 1.3357 -5.3145 {"}'M' greentint -9.757 1.3467 -5.1136 {"}'M' greentint -9.5999 1.4426 -4.9362 {"}'M' greentint -9.4615 1.6131 -4.8047 {"}'M' greentint -9.3585 1.8366 -4.7338 {"}'M' greentint -9.7815 1.5435 -5.3902 {"}'M' greentint -9.6183 1.5727 -5.1876 {"}'M' greentint -9.4686 1.7265 -5.0368 {"}'M' greentint -9.3733 1.9628 -4.9793 {"}'M' greentint -9.5101 1.8707 -5.2478 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 281 1crzA_283F_294}P -12.2673 -2.6317 -0.3927 {"}-12.2673 -2.6317 -0.3927 { ca leu A 281 1crzA_283F_294}-10.9061 -2.4212 -0.8428 { c leu A 281 1crzA_283F_294}-10.8346 -1.1196 -1.5942 { o leu A 281 1crzA_283F_294}-11.8059 -0.7057 -2.2352 { c leu A 281 1crzA_283F_294}P -10.8346 -1.1196 -1.5942 { n ala A 282 1crzA_283F_294}-9.6882 -0.4667 -1.499 { ca ala A 282 1crzA_283F_294}-9.4578 0.7139 -2.2909 { c ala A 282 1crzA_283F_294}-8.434 0.0545 -3.2138 { o ala A 282 1crzA_283F_294}-7.7537 -0.8871 -2.8005 { c ala A 282 1crzA_283F_294}P -8.434 0.0545 -3.2138 { n phe A 283 1crzA_283F_294}-8.3375 0.5132 -4.4529 { ca phe A 283 1crzA_283F_294}-7.3649 -0.0482 -5.3792 { c phe A 283 1crzA_283F_294}-7.14 0.918 -6.5262 { o phe A 283 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-7.9934 {"}'S' -11.6366 0.52 -7.9963 {"}'S' P -11.8014 0.5752 -8.1983 {"}'S' -11.7952 0.5261 -8.194 {"}'S' P -11.017 0.4287 -7.5729 {"}'S' -11.0303 0.3916 -7.5844 {"}'S' P -11.1549 0.5197 -7.7754 {"}'S' -11.1795 0.4185 -7.7927 {"}'S' P -11.304 0.5727 -7.9827 {"}'S' -11.322 0.454 -7.9887 {"}'S' P -11.4609 0.587 -8.1902 {"}'S' -11.4663 0.5069 -8.1844 {"}'S' P -11.6231 0.5636 -8.3927 {"}'S' -11.6229 0.5398 -8.3889 {"}'S' P -10.809 0.3819 -7.724 {"}'S' -10.8285 0.3419 -7.733 {"}'S' P -10.9461 0.4728 -7.927 {"}'S' -10.9861 0.3693 -7.9358 {"}'S' P -11.0948 0.5266 -8.1339 {"}'S' -11.1302 0.4041 -8.1287 {"}'S' P -11.2524 0.5438 -8.3413 {"}'S' -11.2681 0.4562 -8.3274 {"}'S' P -11.4141 0.5208 -8.5452 {"}'S' -11.4147 0.5134 -8.5426 {"}'S' P -10.7338 0.3806 -8.055 {"}'S' -10.7625 0.3282 -8.0549 {"}'S' P -10.8815 0.4401 -8.2618 {"}'S' -10.9136 0.3657 -8.2528 {"}'S' P -11.0373 0.4616 -8.4695 {"}'S' -11.0542 0.4125 -8.4574 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 294 A}'S' sky -11.9458 0.8529 -6.8254 {"}'S' blue -11.7935 0.9785 -6.6629 {"}'S' sky -11.5024 0.9539 -6.6953 {"}'S' blue -11.2087 0.9768 -6.7502 {"}'S' blue -11.0097 0.9274 -6.9129 { HB2 TYR 294 A}'S' blue -10.8801 0.8665 -6.9868 {"}'S' blue -10.5011 0.6174 -7.268 {"}'S' sky -10.1151 0.5594 -7.9627 {"}'S' sky -10.0395 0.6551 -8.1991 {"}'S' sky -10.2008 0.7441 -8.6637 { HB3 TYR 294 A}'S' blue -12.6551 0.7214 -7.0163 {"}'S' blue -12.8231 0.5344 -7.6134 {"}'S' blue -12.6676 0.5464 -7.4156 {"}'S' sky -12.509 0.6109 -7.2288 {"}'S' sky -12.356 0.7269 -7.0634 {"}'S' sky -12.7192 0.5426 -7.9124 {"}'S' sky -12.5505 0.6055 -8.1217 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 294 A}'S' sea -12.1043 0.7625 -7.0043 {"}'S' sea -12.1393 0.5831 -7.4145 {"}'S' green -11.9764 0.6199 -7.2139 {"}'S' green -11.8128 0.6955 -7.0246 {"}'S' sea -11.6541 0.8073 -6.8503 {"}'S' green -12.3014 0.5656 -8.0472 {"}'S' green -12.1523 0.5126 -7.8399 {"}'S' green -11.9946 0.4981 -7.633 {"}'S' green -11.8324 0.5216 -7.4304 {"}'S' green -11.6696 0.5832 -7.2356 {"}'S' green -11.5092 0.6809 -7.0557 {"}'S' sea -11.3537 0.8131 -6.8922 {"}'S' sea -12.2392 0.6154 -8.4145 {"}'S' green -12.1017 0.5236 -8.2124 {"}'S' green -11.4713 0.5364 -7.3999 {"}'S' green -11.3101 0.6329 -7.2187 {"}'S' sea -11.1551 0.7643 -7.0556 {"}'S' green -11.9809 0.5735 -8.4979 {"}'S' sea -11.8515 0.682 -8.7764 {"}'S' green -11.7231 0.5785 -8.5808 {"}'S' sea -11.5113 0.6501 -8.7178 { HB2 TYR 294 A}'S' green -11.3219 0.4802 -7.4494 {"}'S' green -11.1637 0.557 -7.2661 {"}'S' sea -11.0129 0.6875 -7.1086 {"}'S' green -10.9396 0.4512 -7.3578 {"}'S' sea -10.7903 0.5872 -7.2019 {"}'S' green -11.4945 0.5409 -8.5314 {"}'S' green -10.7935 0.3406 -7.5703 {"}'S' sea -10.6406 0.4567 -7.4049 {"}'S' green -11.2564 0.4855 -8.6394 {"}'S' green -10.9635 0.436 -8.6583 {"}'S' green -10.3719 0.386 -7.8793 {"}'S' sea -10.8299 0.6699 -8.917 {"}'S' green -10.7262 0.5111 -8.7391 {"}'S' green -10.2723 0.441 -8.1334 {"}'S' green -10.4891 0.624 -8.7723 {"}'S' green -10.352 0.549 -8.5728 {"}'S' green -10.1956 0.5597 -8.3736 { HB3 TYR 294 A}'S' sea -12.5668 0.5177 -7.7086 {"}'S' sea -12.4074 0.5481 -7.5114 {"}'S' sea -12.2494 0.6339 -7.3304 {"}'S' sea -12.4032 0.5625 -7.9191 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB TYR 294 A}'S' P -11.9531 0.4698 -8.0055 {"}'S' -11.9468 0.5091 -8.0025 {"}'S' P -11.7958 0.4535 -7.7971 {"}'S' -11.7921 0.5053 -7.8005 {"}'S' P -11.6337 0.4756 -7.5943 {"}'S' -11.635 0.5014 -7.5985 {"}'S' P -11.8388 0.4951 -8.2927 {"}'S' -11.8365 0.5258 -8.2862 {"}'S' P -11.6865 0.4542 -8.0854 {"}'S' -11.6861 0.5225 -8.0782 {"}'S' P -11.582 0.5116 -8.3794 {"}'S' -11.5834 0.5375 -8.3719 { HB2 TYR 294 A}'S' P -11.4792 0.4623 -7.6485 {"}'S' -11.4605 0.494 -7.6608 {"}'S' P -11.5467 0.4415 -8.1392 {"}'S' -11.5057 0.5043 -8.1316 {"}'S' P -11.4094 0.36 -7.9397 {"}'S' -11.3621 0.4594 -7.9474 {"}'S' P -11.2574 0.3342 -7.7364 {"}'S' -11.2293 0.4234 -7.7593 {"}'S' P -11.0981 0.3647 -7.5392 {"}'S' -11.0924 0.3976 -7.5544 {"}'S' P -11.3857 0.4002 -8.3523 {"}'S' -11.3544 0.4683 -8.3301 {"}'S' P -11.255 0.3058 -8.1572 {"}'S' -11.218 0.4256 -8.1426 {"}'S' P -11.1077 0.2641 -7.9549 {"}'S' -11.087 0.3882 -7.9618 {"}'S' P -10.9522 0.2761 -7.7571 {"}'S' -10.9496 0.3541 -7.7747 {"}'S' P -11.1402 0.3537 -8.4539 {"}'S' -11.1279 0.4143 -8.4286 {"}'S' P -11.0037 0.2724 -8.2539 {"}'S' -10.9951 0.3709 -8.2338 {"}'S' P -10.8513 0.2474 -8.0501 {"}'S' -10.8554 0.3336 -8.048 {"}'S' P -10.6919 0.2779 -7.8529 {"}'S' -10.6977 0.3047 -7.8566 {"}'S' P -10.835 0.3353 -8.4632 {"}'S' -10.8367 0.3641 -8.4515 {"}'S' P -10.6878 0.2922 -8.2606 {"}'S' -10.696 0.3343 -8.2524 {"}'S' P -10.53 0.3092 -8.0626 {"}'S' -10.5338 0.3196 -8.0615 {"}'S' P -10.5913 0.4163 -8.5382 {"}'S' -10.5962 0.4341 -8.5285 {"}'S' P -10.4355 0.392 -8.33 {"}'S' -10.4431 0.409 -8.3253 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O PHE 283 A}'M' P -9.1611 2.4123 -6.7758 {"}'M' -9.1562 2.4107 -6.7756 {"}'M' P -9.0536 2.6319 -6.6979 {"}'M' -9.008 2.6034 -6.6973 {"}'M' P -9.0832 2.4925 -7.014 {"}'M' -9.0775 2.4897 -7.0125 {"}'M' P -8.9711 2.7111 -6.9296 {"}'M' -8.9382 2.6871 -6.9219 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 283 A}'M' greentint -9.0378 2.2836 -6.0158 {"}'M' greentint -9.1814 2.1759 -6.2883 {"}'M' greentint -8.9391 2.5715 -6.085 {"}'M' greentint -9.0877 2.4146 -6.2335 {"}'M' greentint -9.1914 2.3183 -6.531 {"}'M' greentint -9.248 2.0688 -6.5342 {"}'M' greentint -8.7899 2.8017 -6.1472 {"}'M' greentint -8.9485 2.7085 -6.3256 {"}'M' greentint -9.0877 2.5405 -6.4588 {"}'M' greentint -9.2322 2.1672 -6.8 {"}'M' greentint -9.2628 1.9134 -6.7685 {"}'M' greentint -8.6029 2.9908 -6.215 {"}'M' greentint -8.7631 2.9325 -6.407 {"}'M' greentint -8.9179 2.8095 -6.5717 {"}'M' greentint -9.1644 2.2493 -7.0524 {"}'M' greentint -9.2118 1.9949 -7.0421 {"}'M' greentint -8.5198 3.1102 -6.4585 {"}'M' greentint -8.6822 3.0286 -6.6448 {"}'M' greentint -8.8345 2.8926 -6.8048 {"}'M' greentint -8.9687 2.5372 -7.2437 {"}'M' greentint -9.0542 2.3024 -7.2882 {"}'M' greentint -9.1107 2.0557 -7.292 {"}'M' greentint -8.4253 3.1736 -6.7181 {"}'M' greentint -8.5811 3.0749 -6.8914 {"}'M' greentint -8.7273 2.9313 -7.0413 {"}'M' greentint -8.8581 2.7493 -7.1597 {"}'M' greentint -8.8177 2.559 -7.4525 {"}'M' greentint -8.9063 2.3239 -7.5027 {"}'M' greentint -8.4254 3.1022 -7.0967 {"}'M' greentint -8.5721 2.955 -7.2465 {"}'M' greentint -8.7042 2.7721 -7.3664 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H TYR 294 A}'M' P -8.5947 2.0774 -6.6019 {"}'M' -8.6094 2.0935 -6.6069 {"}'M' P -8.4701 2.2774 -6.4961 {"}'M' -8.4951 2.2934 -6.5066 {"}'M' P -8.4946 2.1444 -6.8342 {"}'M' -8.5339 2.178 -6.8341 {"}'M' P -8.3704 2.3477 -6.7296 {"}'M' -8.4232 2.3733 -6.7358 {"}'M' P -8.3911 2.3304 -7.0155 {"}'M' -8.4063 2.3386 -7.0125 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 294 A}'M' greentint -9.2243 1.8349 -6.5186 {"}'M' greentint -9.0694 1.9321 -6.3461 {"}'M' greentint -8.9281 2.0829 -6.2045 {"}'M' greentint -8.8075 2.2771 -6.1028 {"}'M' greentint -8.715 2.5032 -6.0468 {"}'M' greentint -8.6577 2.7476 -6.0397 {"}'M' greentint -9.1136 1.7949 -6.7939 {"}'M' greentint -8.9554 1.8586 -6.6076 {"}'M' greentint -8.8052 1.983 -6.4478 {"}'M' greentint -8.6721 2.1586 -6.3247 {"}'M' greentint -8.5668 2.3733 -6.2469 {"}'M' greentint -8.4933 2.6131 -6.22 {"}'M' greentint -8.4603 2.8621 -6.2454 {"}'M' greentint -8.4676 3.102 -6.322 {"}'M' greentint -9.063 1.8538 -7.1449 {"}'M' greentint -8.9049 1.8561 -6.9412 {"}'M' greentint -8.7442 1.932 -6.7543 {"}'M' greentint -8.3815 2.515 -6.4481 {"}'M' greentint -8.337 2.7697 -6.4608 {"}'M' greentint -8.3402 3.0167 -6.5335 {"}'M' greentint -8.9599 2.0165 -7.4 {"}'M' greentint -8.8112 1.9669 -7.1939 {"}'M' greentint -8.6488 2.0118 -6.9959 {"}'M' greentint -8.2921 2.5934 -6.6975 {"}'M' greentint -8.2711 2.8488 -6.7408 {"}'M' greentint -8.3093 3.0791 -6.8541 {"}'M' greentint -8.8319 2.2521 -7.5625 {"}'M' greentint -8.7002 2.1504 -7.3643 {"}'M' greentint -8.5392 2.1784 -7.1643 {"}'M' greentint -8.2963 2.5645 -6.9581 {"}'M' greentint -8.28 2.8182 -7.0074 {"}'M' greentint -8.3467 3.0235 -7.1505 {"}'M' greentint -8.6709 2.5234 -7.5957 {"}'M' greentint -8.5667 2.3682 -7.4178 {"}'M' greentint -8.4067 2.4651 -7.2384 {"}'M' greentint -8.3517 2.7184 -7.2382 {"}'M' greentint -8.4559 2.8736 -7.416 {"}'M' greentint -8.485 2.6148 -7.4377 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 283 A}'M' greentint -9.6812 1.4156 -4.226 {"}'M' greentint -9.8144 1.3119 -4.4255 {"}'M' greentint -9.4953 1.5069 -4.068 {"}'M' greentint -9.5995 1.6621 -4.2458 {"}'M' greentint -9.7595 1.5652 -4.4252 {"}'M' greentint -9.8699 1.4658 -4.7055 {"}'M' greentint -9.8862 1.2121 -4.6562 {"}'M' greentint -9.8195 1.0068 -4.5131 {"}'M' greentint -9.466 1.88 -4.2993 {"}'M' greentint -9.627 1.8519 -4.4993 {"}'M' greentint -9.7751 1.7 -4.6482 {"}'M' greentint -9.8416 1.5633 -4.9591 {"}'M' greentint -9.892 1.3086 -4.9545 {"}'M' greentint -9.8833 1.0608 -4.8741 {"}'M' greentint -9.2776 2.0498 -4.366 {"}'M' greentint -9.4365 2.053 -4.5719 {"}'M' greentint -9.5967 1.9619 -4.7548 {"}'M' greentint -9.7382 1.7914 -4.8903 {"}'M' greentint -9.7447 1.6376 -5.1991 {"}'M' greentint -9.813 1.3886 -5.2168 {"}'M' greentint -9.8335 1.1353 -5.1734 {"}'M' greentint -9.8073 0.8986 -5.0732 {"}'M' greentint -9.3421 2.1454 -4.8194 {"}'M' greentint -9.4987 2.0333 -4.9907 {"}'M' greentint -9.6373 1.8586 -5.1215 {"}'M' greentint -9.5994 1.6571 -5.4167 {"}'M' greentint -9.6728 1.4173 -5.4436 {"}'M' greentint -9.7058 1.1682 -5.4182 {"}'M' greentint -9.2108 2.1718 -5.056 {"}'M' greentint -9.361 2.0473 -5.2159 {"}'M' greentint -9.4941 1.8717 -5.339 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 294 A}'M' greentint -9.4097 1.4327 -4.1887 {"}'M' greentint -9.337 1.6737 -4.1632 {"}'M' greentint -9.657 0.8989 -4.7243 {"}'M' greentint -9.5116 1.0607 -4.5813 {"}'M' greentint -9.387 1.2631 -4.4777 {"}'M' greentint -9.2905 1.4962 -4.4179 {"}'M' greentint -9.2268 1.7479 -4.4053 {"}'M' greentint -9.1995 2.0027 -4.4398 {"}'M' greentint -9.7438 0.8908 -5.1505 {"}'M' greentint -9.5841 0.9794 -4.9695 {"}'M' greentint -9.4374 1.129 -4.8219 {"}'M' greentint -9.3137 1.3288 -4.7172 {"}'M' greentint -9.2218 1.5629 -4.6639 {"}'M' greentint -9.1699 1.8138 -4.6655 {"}'M' greentint -9.16 2.064 -4.7228 {"}'M' greentint -9.6256 1.0613 -5.3046 {"}'M' greentint -9.4685 1.1572 -5.1272 {"}'M' greentint -9.3301 1.3278 -4.9957 {"}'M' greentint -9.2272 1.5513 -4.9249 {"}'M' greentint -9.1727 1.801 -4.9246 {"}'M' greentint -9.173 2.0479 -4.9933 {"}'M' greentint -9.4869 1.2874 -5.3786 {"}'M' greentint -9.3372 1.4411 -5.2278 {"}'M' greentint -9.2419 1.6774 -5.1703 {"}'M' greentint -9.2255 1.9339 -5.2201 {"}'M' greentint -9.3787 1.5853 -5.4389 {"}'M' greentint -9.3234 1.8366 -5.4377 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 30 1daaA_89F_32E}P -6.792 5.8556 -12.2478 {"}-6.792 5.8556 -12.2478 { ca val A 30 1daaA_89F_32E}-8.041 6.1564 -11.5508 { c val A 30 1daaA_89F_32E}-8.2086 5.1683 -10.423 { o val A 30 1daaA_89F_32E}-7.6226 4.0824 -10.4953 { c val A 30 1daaA_89F_32E}P -8.2086 5.1683 -10.423 { n tyr A 31 1daaA_89F_32E}-8.9711 5.5179 -9.3782 { ca tyr A 31 1daaA_89F_32E}-9.1288 4.6325 -8.2347 { c tyr A 31 1daaA_89F_32E}-10.5329 4.5785 -7.626 { o tyr A 31 1daaA_89F_32E}-11.379 5.4397 -7.8803 { c tyr A 31 1daaA_89F_32E}P -10.5329 4.5785 -7.626 { n glu A 32 1daaA_89F_32E}-10.7515 3.6056 -6.7423 { ca glu A 32 1daaA_89F_32E}-11.9814 3.5152 -5.9642 { c glu A 32 1daaA_89F_32E}-11.7115 3.0129 -4.5528 { o glu A 32 1daaA_89F_32E}-10.6805 2.3865 -4.3267 { c glu A 32 1daaA_89F_32E}P -11.7115 3.0129 -4.5528 { n val A 33 1daaA_89F_32E}-12.5932 3.3485 -3.5925 { ca val A 33 1daaA_89F_32E}-12.5898 2.8227 -2.2238 { c val A 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-10.0416 0.6872 -8.1016 {"}'S' sea -10.202 0.651 -8.2989 { CE1 PHE 257 A}'S' green -11.1586 0.2421 -7.8965 {"}'S' green -11.2802 0.3641 -8.0887 {"}'S' green -11.4224 0.4345 -8.2907 {"}'S' green -10.8284 0.1882 -7.7728 {"}'S' green -11.3424 0.5954 -8.5512 {"}'S' green -11.0856 0.6966 -8.6045 {"}'S' sea -11.2415 0.7022 -8.8086 {"}'S' green -10.5367 0.5815 -8.2534 {"}'S' green -10.6646 0.6844 -8.4484 {"}'S' green -10.8071 0.7503 -8.6513 {"}'S' sea -10.959 0.7775 -8.8549 {"}'S' sea -10.3341 0.6299 -8.4199 {"}'S' sea -10.4684 0.7283 -8.6209 { CE2 PHE 257 A}'S' sea -12.3879 0.0919 -6.7792 {"}'S' sea -12.5483 0.0557 -6.9765 {"}'S' sea -12.1054 0.1671 -6.8254 {"}'S' green -12.263 0.154 -7.0259 {"}'S' sea -12.4239 0.1014 -7.2184 {"}'S' sea -11.9182 0.2017 -7.0064 {"}'S' green -12.0798 0.1842 -7.2113 {"}'S' sea -12.2437 0.1276 -7.407 {"}'S' sea -11.5824 0.1818 -6.9957 {"}'S' green -11.7393 0.1961 -7.2032 {"}'S' green -11.9014 0.1726 -7.4058 {"}'S' sea -11.5308 0.1529 -7.3544 { CZ PHE 257 A}'S' sea -12.2331 0.1644 -7.4812 {"}'S' green -12.373 0.2453 -7.6841 {"}'S' sea -12.526 0.2795 -7.8925 {"}'S' green -11.986 0.2408 -7.542 {"}'S' green -12.1214 0.331 -7.7408 {"}'S' green -12.2693 0.3808 -7.9458 {"}'S' green -12.4252 0.3864 -8.1499 {"}'S' green -11.7203 0.2656 -7.5947 {"}'S' green -12.1426 0.4616 -8.1961 {"}'S' sea -12.3003 0.4485 -8.3966 {"}'S' sea -11.399 0.1803 -7.5701 {"}'S' green -11.5177 0.314 -7.7611 {"}'S' green -11.6521 0.4124 -7.9621 {"}'S' green -11.7989 0.4732 -8.1698 {"}'S' green -11.9555 0.4962 -8.3771 {"}'S' sea -12.1171 0.4787 -8.582 {"}'S' green -11.2103 0.2076 -7.7628 {"}'S' green -11.3326 0.3322 -7.9567 {"}'S' green -11.4706 0.4233 -8.1591 {"}'S' green -11.6196 0.4763 -8.3664 {"}'S' sea -11.7766 0.4906 -8.5739 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 257 A}'S' P -10.9272 0.3539 -7.9475 {"}'S' -10.9273 0.3522 -7.949 {"}'S' P -11.0495 0.4802 -8.14 {"}'S' -11.0437 0.4562 -8.1556 {"}'S' P -11.1894 0.5611 -8.3428 {"}'S' -11.1883 0.557 -8.3456 {"}'S' P -10.6848 0.4275 -8.0123 {"}'S' -10.6848 0.4275 -8.0123 {"}'S' P -10.8023 0.5566 -8.2007 {"}'S' -10.8008 0.5282 -8.2177 {"}'S' P -10.9377 0.6468 -8.3995 {"}'S' -10.9349 0.6285 -8.4085 { CZ PHE 257 A}'S' P -11.8483 0.3686 -7.7897 {"}'S' -11.8485 0.3624 -7.792 {"}'S' P -11.9907 0.4345 -7.9925 {"}'S' -11.9904 0.4209 -7.9959 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 211 A}'S' sky -12.7213 0.5256 -7.778 {"}'S' sky -11.952 0.4531 -6.763 {"}'S' blue -11.7915 0.5508 -6.5831 {"}'S' sky -12.6434 0.6107 -8.1353 {"}'S' sky -11.5924 0.5027 -6.7461 {"}'S' sky -12.4998 0.7081 -8.4057 {"}'S' sky -11.4829 0.4372 -7.0154 {"}'S' sky -12.0301 0.7748 -8.6213 {"}'S' blue -11.5558 0.961 -8.7367 {"}'S' blue -11.309 1.0579 -8.7155 { CG TYR 211 A}'S' blue -12.6455 0.811 -8.6454 {"}'S' blue -12.5363 0.8118 -8.9337 {"}'S' blue -12.3768 0.8111 -8.7259 {"}'S' blue -12.2794 0.8414 -9.0235 {"}'S' blue -12.1218 0.8532 -8.8227 {"}'S' blue -11.9074 0.9296 -8.9571 {"}'S' blue -11.6541 1.0612 -9.0255 { CD2 TYR 211 A}'S' blue -11.6805 0.9509 -9.5952 {"}'S' blue -11.5181 1.0117 -9.4008 {"}'S' blue -11.3569 1.1082 -9.2196 {"}'S' blue -11.5739 0.9289 -9.8785 {"}'S' blue -11.4101 0.9669 -9.6787 {"}'S' sky -11.2473 1.0426 -9.4889 {"}'S' blue -11.089 1.1564 -9.3156 {"}'S' blue -11.3189 0.9709 -9.9753 {"}'S' blue -11.1585 1.0213 -9.783 {"}'S' blue -11.0004 1.1098 -9.6026 {"}'S' blue -10.8481 1.234 -9.4398 {"}'S' blue -10.9429 1.1062 -9.9179 { HB2 TYR 211 A}'S' sky -11.4041 0.3892 -7.353 {"}'S' sky -11.2447 0.4197 -7.1558 {"}'S' blue -11.0862 0.5062 -6.9744 {"}'S' sky -11.0988 0.3311 -7.3736 {"}'S' blue -10.9401 0.3956 -7.1869 {"}'S' blue -10.7872 0.5117 -7.0214 {"}'S' sky -10.8385 0.3329 -7.4695 {"}'S' blue -10.6805 0.4186 -7.2885 {"}'S' blue -10.5304 0.5545 -7.1331 {"}'S' sky -10.3681 0.5724 -7.3374 {"}'S' sky -10.1226 0.7913 -7.4483 {"}'S' sky -10.7934 1.043 -8.6926 {"}'S' sky -10.049 0.8783 -7.6854 {"}'S' sky -10.0333 0.9817 -7.925 {"}'S' blue -10.2225 1.0246 -8.325 { HB3 TYR 211 A}'S' sky -12.8875 0.2463 -6.8957 {"}'S' sky -12.732 0.2583 -6.6979 {"}'S' sky -12.5734 0.3228 -6.5111 {"}'S' blue -12.9201 0.3359 -7.3947 {"}'S' sky -12.7835 0.2545 -7.1947 {"}'S' sky -12.3138 0.3457 -6.6127 {"}'S' blue -12.1637 0.4816 -6.4574 {"}'S' blue -12.8459 0.5709 -7.7742 {"}'S' sky -12.7433 0.4182 -7.5991 {"}'S' sky -12.6149 0.3174 -7.404 {"}'S' sky -12.0013 0.4995 -6.6616 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 211 A}'S' sea -12.5215 0.4853 -7.9418 {"}'S' green -12.384 0.3935 -7.7398 {"}'S' green -12.2354 0.3397 -7.5329 {"}'S' green -12.0781 0.3234 -7.3245 {"}'S' green -11.916 0.3454 -7.1217 {"}'S' sea -11.7536 0.4062 -6.9273 {"}'S' green -12.39 0.559 -8.2215 {"}'S' green -12.2632 0.4434 -8.0253 {"}'S' green -12.1212 0.365 -7.8201 {"}'S' green -11.9688 0.3241 -7.6128 {"}'S' green -11.8094 0.3234 -7.405 {"}'S' sea -11.6456 0.3615 -7.2052 {"}'S' sea -12.2456 0.6912 -8.4867 {"}'S' green -12.1338 0.5519 -8.3038 {"}'S' green -11.712 0.3537 -7.7026 {"}'S' sea -11.5544 0.3655 -7.5018 {"}'S' green -11.9206 0.6287 -8.4401 {"}'S' green -11.7937 0.52 -8.2452 {"}'S' green -11.6517 0.452 -8.0424 {"}'S' sea -11.6842 0.7114 -8.5152 {"}'S' green -11.553 0.6061 -8.3169 {"}'S' sea -11.4458 0.8175 -8.5536 { HB2 TYR 211 A}'S' green -11.4016 0.3608 -7.7738 {"}'S' sea -11.2543 0.3192 -7.5715 {"}'S' green -11.403 0.5405 -8.2559 {"}'S' green -11.2869 0.4088 -8.0705 {"}'S' green -11.1503 0.3274 -7.8704 {"}'S' sea -10.9979 0.3024 -7.6667 {"}'S' sea -11.2838 0.8402 -8.5954 {"}'S' green -11.2127 0.6438 -8.45 {"}'S' green -10.8344 0.3472 -7.8772 {"}'S' sea -10.6762 0.365 -7.6787 {"}'S' sea -10.5185 0.441 -7.4959 {"}'S' sea -11.041 0.9338 -8.6762 {"}'S' green -10.9765 0.7249 -8.5336 {"}'S' green -10.5822 0.4471 -7.9466 {"}'S' green -10.4189 0.496 -7.75 {"}'S' sea -10.2617 0.6144 -7.5792 {"}'S' green -10.7383 0.8318 -8.5639 {"}'S' green -10.6357 0.679 -8.3889 {"}'S' green -10.4986 0.604 -8.1894 {"}'S' green -10.3422 0.6147 -7.9902 {"}'S' green -10.1861 0.7101 -7.8156 {"}'S' sea -10.4808 0.9019 -8.481 {"}'S' sea -10.3474 0.7991 -8.2803 {"}'S' sea -10.1839 0.8277 -8.077 { HB3 TYR 211 A}'S' sea -12.6312 0.2295 -6.9909 {"}'S' sea -12.4718 0.26 -6.7937 {"}'S' sea -12.4676 0.2743 -7.2014 {"}'S' green -12.3094 0.2921 -7.003 {"}'S' sea -12.1517 0.3681 -6.8201 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB TYR 211 A}'S' P -12.0055 0.4483 -8.1082 {"}'S' -12.0057 0.4538 -8.1062 {"}'S' P -11.8643 0.3815 -7.9068 {"}'S' -11.8646 0.3951 -7.9035 { HB2 TYR 211 A}'S' P -11.1101 0.4911 -8.2749 {"}'S' -11.1095 0.5115 -8.2617 {"}'S' P -10.9817 0.3903 -8.0798 {"}'S' -10.9828 0.4128 -8.071 {"}'S' P -10.8728 0.5661 -8.3557 {"}'S' -10.8773 0.59 -8.3365 {"}'S' P -10.7379 0.4713 -8.1548 {"}'S' -10.7435 0.4923 -8.1433 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 257 A}'M' greentint -9.3514 2.1922 -6.35 {"}'M' greentint -9.1091 2.5878 -6.1467 {"}'M' greentint -9.2577 2.4309 -6.2952 {"}'M' greentint -9.3614 2.3346 -6.5927 {"}'M' greentint -9.418 2.0851 -6.596 {"}'M' greentint -8.9599 2.818 -6.2089 {"}'M' greentint -9.1185 2.7248 -6.3873 {"}'M' greentint -9.2577 2.5568 -6.5205 {"}'M' greentint -9.331 2.4286 -6.8375 {"}'M' greentint -9.4022 2.1835 -6.8617 {"}'M' greentint -8.7729 3.0071 -6.2768 {"}'M' greentint -8.9331 2.9488 -6.4688 {"}'M' greentint -9.0879 2.8258 -6.6334 {"}'M' greentint -9.2236 2.6482 -6.7596 {"}'M' greentint -9.2531 2.5088 -7.0758 {"}'M' greentint -9.3343 2.2656 -7.1141 {"}'M' greentint -8.6901 3.1271 -6.5209 {"}'M' greentint -8.8522 3.0449 -6.7065 {"}'M' greentint -9.0044 2.9089 -6.8665 {"}'M' greentint -9.1411 2.7274 -6.9913 {"}'M' greentint -9.1386 2.5535 -7.3054 {"}'M' greentint -9.2242 2.3187 -7.35 {"}'M' greentint -8.7511 3.0911 -6.9532 {"}'M' greentint -8.8972 2.9476 -7.103 {"}'M' greentint -9.028 2.7656 -7.2215 {"}'M' greentint -8.7421 2.9713 -7.3082 {"}'M' greentint -8.8741 2.7884 -7.4282 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 211 A}'M' greentint -9.263 2.2838 -6.1869 {"}'M' greentint -9.2904 2.0595 -6.59 {"}'M' greentint -9.1401 2.1839 -6.4302 {"}'M' greentint -9.007 2.3595 -6.3071 {"}'M' greentint -8.9018 2.5741 -6.2294 {"}'M' greentint -8.8283 2.8139 -6.2025 {"}'M' greentint -9.2398 2.0569 -6.9236 {"}'M' greentint -9.0791 2.1329 -6.7368 {"}'M' greentint -8.9296 2.2783 -6.5844 {"}'M' greentint -8.805 2.4782 -6.4785 {"}'M' greentint -8.7164 2.7158 -6.4305 {"}'M' greentint -8.6719 2.9706 -6.4432 {"}'M' greentint -9.1461 2.1678 -7.1763 {"}'M' greentint -8.9838 2.2127 -6.9784 {"}'M' greentint -8.8295 2.3453 -6.8166 {"}'M' greentint -8.7053 2.5486 -6.712 {"}'M' greentint -8.627 2.7943 -6.6799 {"}'M' greentint -8.606 3.0497 -6.7232 {"}'M' greentint -9.0351 2.3513 -7.3467 {"}'M' greentint -8.8741 2.3793 -7.1468 {"}'M' greentint -8.7261 2.5313 -6.9979 {"}'M' greentint -8.6313 2.7654 -6.9406 {"}'M' greentint -8.615 3.0191 -6.9899 {"}'M' greentint -8.9016 2.5691 -7.4003 {"}'M' greentint -8.7416 2.666 -7.2208 {"}'M' greentint -8.6867 2.9193 -7.2206 {"}'M' greentint -8.8199 2.8157 -7.4201 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 257 A}'M' greentint -9.9427 1.1091 -4.3067 {"}'M' greentint -10.076 1.0055 -4.5062 {"}'M' greentint -9.7569 1.2005 -4.1487 {"}'M' greentint -9.8611 1.3557 -4.3266 {"}'M' greentint -10.021 1.2588 -4.506 {"}'M' greentint -10.1314 1.1594 -4.7863 {"}'M' greentint -10.1477 0.9057 -4.737 {"}'M' greentint -9.5958 1.4718 -4.1819 {"}'M' greentint -9.7276 1.5735 -4.3801 {"}'M' greentint -9.8886 1.5455 -4.5801 {"}'M' greentint -10.0366 1.3935 -4.7289 {"}'M' greentint -10.1031 1.2568 -5.0399 {"}'M' greentint -10.1535 1.0022 -5.0353 {"}'M' greentint -9.5392 1.7434 -4.4467 {"}'M' greentint -9.698 1.7466 -4.6527 {"}'M' greentint -9.8583 1.6555 -4.8355 {"}'M' greentint -9.9997 1.485 -4.9711 {"}'M' greentint -10.0063 1.3311 -5.2799 {"}'M' greentint -9.4423 1.8781 -4.7022 {"}'M' greentint -9.6036 1.8389 -4.9001 {"}'M' greentint -9.7602 1.7269 -5.0715 {"}'M' greentint -9.8988 1.5522 -5.2022 {"}'M' greentint -9.6225 1.7409 -5.2966 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 211 A}'M' greentint -10.1224 0.8932 -4.8106 {"}'M' greentint -9.9598 0.9489 -4.6164 {"}'M' greentint -9.8019 1.0592 -4.443 {"}'M' greentint -9.6566 1.2209 -4.3 {"}'M' greentint -9.532 1.4233 -4.1964 {"}'M' greentint -10.048 1.0286 -5.0697 {"}'M' greentint -9.8888 1.0511 -4.8692 {"}'M' greentint -9.7291 1.1397 -4.6882 {"}'M' greentint -9.5824 1.2892 -4.5406 {"}'M' greentint -9.4587 1.489 -4.4359 {"}'M' greentint -9.3668 1.7232 -4.3826 {"}'M' greentint -9.9294 1.2106 -5.2242 {"}'M' greentint -9.7705 1.2216 -5.0233 {"}'M' greentint -9.6135 1.3175 -4.8459 {"}'M' greentint -9.4751 1.488 -4.7144 {"}'M' greentint -9.3721 1.7115 -4.6435 {"}'M' greentint -9.7951 1.4184 -5.2999 {"}'M' greentint -9.6319 1.4476 -5.0973 {"}'M' greentint -9.4821 1.6014 -4.9465 {"}'M' greentint -9.3869 1.8377 -4.889 {"}'M' greentint -9.6824 1.6482 -5.3351 {"}'M' greentint -9.5237 1.7456 -5.1575 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr B 64 1dhkB_66F_135V}P -12.1754 -1.8329 0.6305 {"}-12.1754 -1.8329 0.6305 { ca thr B 64 1dhkB_66F_135V}-11.1673 -2.1704 -0.3548 { c thr B 64 1dhkB_66F_135V}-10.838 -0.9849 -1.2468 { o thr B 64 1dhkB_66F_135V}-11.7214 -0.2091 -1.6163 { c thr B 64 1dhkB_66F_135V}P -10.838 -0.9849 -1.2468 { n asn B 65 1dhkB_66F_135V}-9.5503 -0.8045 -1.5205 { ca asn B 65 1dhkB_66F_135V}-9.0883 0.2749 -2.3828 { c asn B 65 1dhkB_66F_135V}-8.2694 -0.3502 -3.4792 { o asn B 65 1dhkB_66F_135V}-7.5358 -1.3087 -3.2351 { c asn B 65 1dhkB_66F_135V}P -8.2694 -0.3502 -3.4792 { n phe B 66 1dhkB_66F_135V}-8.3758 0.198 -4.6793 { ca phe B 66 1dhkB_66F_135V}-7.5636 -0.2583 -5.7942 { c phe B 66 1dhkB_66F_135V}-7.4346 0.8608 -6.8098 { o phe B 66 1dhkB_66F_135V}-8.2675 1.7656 -6.8611 { c phe B 66 1dhkB_66F_135V}P -7.4346 0.8608 -6.8098 { n thr B 67 1dhkB_66F_135V}-6.3168 0.8732 -7.5149 { ca thr B 67 1dhkB_66F_135V}-6.0791 1.8871 -8.522 { c thr B 67 1dhkB_66F_135V}-6.0723 1.1566 -9.8582 { o thr B 67 1dhkB_66F_135V}-5.4372 0.1094 -10.0038 { c thr B 67 1dhkB_66F_135V}P -6.0723 1.1566 -9.8582 { n met B 68 1dhkB_66F_135V}-6.8672 1.6509 -10.7978 { ca met B 68 1dhkB_66F_135V}-6.9735 1.0276 -12.1063 { c met B 68 1dhkB_66F_135V}-6.68 2.0264 -13.2115 { o met B 68 1dhkB_66F_135V}-6.639 3.2343 -12.9765 { n ala B 133 1dhkB_66F_135V}P -6.9807 5.825 -11.8664 {"}-6.9807 5.825 -11.8664 { ca ala B 133 1dhkB_66F_135V}-8.2169 6.1184 -11.1691 { c ala B 133 1dhkB_66F_135V}-8.1879 5.3469 -9.863 { o ala B 133 1dhkB_66F_135V}-7.8136 4.1723 -9.8421 { c ala B 133 1dhkB_66F_135V}P -8.1879 5.3469 -9.863 { n glu B 134 1dhkB_66F_135V}-8.5228 6.016 -8.7681 { ca glu B 134 1dhkB_66F_135V}-8.5504 5.3709 -7.4607 { c glu B 134 1dhkB_66F_135V}-9.9868 4.9904 -7.1224 { o glu B 134 1dhkB_66F_135V}-10.8999 5.8126 -7.2234 { c glu B 134 1dhkB_66F_135V}P -9.9868 4.9904 -7.1224 { n val B 135 1dhkB_66F_135V}-10.1852 3.7336 -6.7477 { ca val B 135 1dhkB_66F_135V}-11.5077 3.2306 -6.419 { c val B 135 1dhkB_66F_135V}-11.5771 2.721 -4.9878 { o val B 135 1dhkB_66F_135V}-10.6582 2.048 -4.5147 { c val B 135 1dhkB_66F_135V}P -11.5771 2.721 -4.9878 { n arg B 136 1dhkB_66F_135V}-12.6531 3.067 -4.2919 { ca arg B 136 1dhkB_66F_135V}-12.8659 2.5829 -2.9343 { c arg B 136 1dhkB_66F_135V}-14.2695 2.025 -2.8439 { o arg B 136 1dhkB_66F_135V}-15.2294 2.6699 -3.2623 { c arg B 136 1dhkB_66F_135V}P -14.2695 2.025 -2.8439 { n ile B 137 1dhkB_66F_135V}-14.3787 0.8029 -2.3519 { ca ile B 137 1dhkB_66F_135V}-15.6646 0.1484 -2.1914 { c ile B 137 1dhkB_66F_135V}-15.7336 -0.2458 -0.7279 { o ile B 137 1dhkB_66F_135V}-14.8071 -0.8642 -0.1971 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr B 64 1dhkB_66F_135V}P -12.1754 -1.8329 0.6305 { ca thr B 64 1dhkB_66F_135V}P -11.1673 -2.1704 -0.3548 { n asn B 65 1dhkB_66F_135V}P -9.5503 -0.8045 -1.5205 { ca asn B 65 1dhkB_66F_135V}P -9.0883 0.2749 -2.3828 { n phe B 66 1dhkB_66F_135V}P -8.3758 0.198 -4.6793 { ca phe B 66 1dhkB_66F_135V}P -7.5636 -0.2583 -5.7942 { n thr B 67 1dhkB_66F_135V}P -6.3168 0.8732 -7.5149 { ca thr B 67 1dhkB_66F_135V}P -6.0791 1.8871 -8.522 { n met B 68 1dhkB_66F_135V}P -6.8672 1.6509 -10.7978 { ca met B 68 1dhkB_66F_135V}P -6.9735 1.0276 -12.1063 { n ala B 133 1dhkB_66F_135V}P -6.9807 5.825 -11.8664 { ca ala B 133 1dhkB_66F_135V}P -8.2169 6.1184 -11.1691 { n glu B 134 1dhkB_66F_135V}P -8.5228 6.016 -8.7681 { ca glu B 134 1dhkB_66F_135V}P -8.5504 5.3709 -7.4607 { n val B 135 1dhkB_66F_135V}P -10.1852 3.7336 -6.7477 { ca val B 135 1dhkB_66F_135V}P -11.5077 3.2306 -6.419 { n arg B 136 1dhkB_66F_135V}P -12.6531 3.067 -4.2919 { ca arg B 136 1dhkB_66F_135V}P -12.8659 2.5829 -2.9343 { n ile B 137 1dhkB_66F_135V}P -14.3787 0.8029 -2.3519 { ca ile B 137 1dhkB_66F_135V}P -15.6646 0.1484 -2.1914 @subgroup {mainchain} @vectorlist 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{"}'S' green -10.6789 0.2303 -7.5423 {"}'S' sea -10.5156 0.2792 -7.3457 {"}'S' sea -10.835 0.615 -8.1596 {"}'S' green -10.7324 0.4622 -7.9845 {"}'S' green -10.5953 0.3872 -7.7851 {"}'S' green -10.439 0.398 -7.5858 {"}'S' sea -10.2828 0.4934 -7.4113 {"}'S' sea -10.4442 0.5824 -7.876 {"}'S' sea -10.2806 0.611 -7.6727 {HG11 VAL 135 B}'S' green -13.4646 -0.4932 -7.6831 {"}'S' green -13.3052 -0.4628 -7.4859 {"}'S' green -13.1472 -0.377 -7.3049 {"}'S' sea -12.9971 -0.2412 -7.1495 {"}'S' green -13.4483 -0.4054 -8.0962 {"}'S' green -12.8347 -0.2232 -7.3538 {"}'S' sea -13.3395 -0.2295 -8.3721 {"}'S' green -13.1024 -0.1167 -8.4053 {"}'S' green -12.5156 0.0827 -7.7018 {"}'S' sea -12.9475 0.1062 -8.4974 {"}'S' green -12.8141 0.0035 -8.2967 {"}'S' green -12.4999 0.186 -7.9414 {"}'S' sea -12.6891 0.229 -8.3414 {HG21 VAL 135 B}'S' sea -11.7773 0.6079 -9.1007 {"}'S' sea -11.6153 0.6303 -9.3082 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} {HG11 VAL 135 B}'S' P -13.301 -0.4484 -7.8936 {"}'S' -13.3016 -0.4424 -7.8924 {"}'S' P -13.1429 -0.4307 -7.6951 {"}'S' -13.1552 -0.3963 -7.6942 {"}'S' P -12.9851 -0.3546 -7.5123 {"}'S' -12.999 -0.3274 -7.5153 {"}'S' P -13.2046 -0.3244 -8.1712 {"}'S' -13.2059 -0.3179 -8.1677 {"}'S' P -13.0488 -0.3486 -7.963 {"}'S' -13.0748 -0.2922 -7.9464 {"}'S' P -12.8856 -0.2997 -7.7664 {"}'S' -12.927 -0.2359 -7.759 {"}'S' P -12.7283 -0.1813 -7.5956 {"}'S' -12.7572 -0.1499 -7.5978 {"}'S' P -12.9652 -0.1917 -8.2058 {"}'S' -12.9805 -0.1683 -8.191 {"}'S' P -12.8089 -0.1809 -8.0066 {"}'S' -12.8497 -0.132 -7.9864 {"}'S' P -12.6528 -0.0855 -7.832 {"}'S' -12.6879 -0.0549 -7.8239 {"}'S' P -12.6506 0.0321 -8.0934 {"}'S' -12.6573 0.0365 -8.0899 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O PHE 66 B}'M' P -9.1649 2.807 -6.596 {"}'M' -9.1618 2.8023 -6.5975 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 66 B}'M' greentint -9.1776 2.4793 -6.0721 {"}'M' greentint -9.3409 2.446 -6.274 {"}'M' greentint -9.4895 2.289 -6.4225 {"}'M' greentint -9.5932 2.1927 -6.72 {"}'M' greentint -9.0337 2.6845 -6.1341 {"}'M' greentint -9.1917 2.6761 -6.3361 {"}'M' greentint -9.3503 2.583 -6.5145 {"}'M' greentint -9.4895 2.415 -6.6477 {"}'M' greentint -9.5628 2.2867 -6.9647 {"}'M' greentint -8.8485 2.8546 -6.2001 {"}'M' greentint -9.0047 2.8652 -6.404 {"}'M' greentint -9.3197 2.6839 -6.7606 {"}'M' greentint -9.4554 2.5064 -6.8868 {"}'M' greentint -9.4849 2.3669 -7.203 {"}'M' greentint -8.6085 2.9727 -6.2391 {"}'M' greentint -8.7614 3.0086 -6.4461 {"}'M' greentint -8.9215 2.9846 -6.6474 {"}'M' greentint -9.084 2.903 -6.8338 {"}'M' greentint -9.2362 2.7671 -6.9937 {"}'M' greentint -9.3729 2.5855 -7.1185 {"}'M' greentint -8.5128 3.1 -6.5149 {"}'M' greentint -8.668 3.0992 -6.7149 {"}'M' greentint -8.8271 3.0481 -6.9071 {"}'M' greentint -8.9829 2.9493 -7.0804 {"}'M' greentint -9.1291 2.8057 -7.2303 {"}'M' greentint -9.2598 2.6237 -7.3487 {"}'M' greentint -8.5101 3.1432 -6.9227 {"}'M' greentint -8.6703 3.0825 -7.1125 {"}'M' greentint -8.8272 2.9766 -7.2856 {"}'M' greentint -8.9739 2.8295 -7.4354 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H VAL 135 B}'M' P -8.8387 2.2852 -6.8274 {"}'M' -8.8465 2.296 -6.8251 {"}'M' P -8.6845 2.4178 -6.6657 {"}'M' -8.6853 2.418 -6.6651 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 135 B}'M' greentint -9.5708 2.0709 -6.542 {"}'M' greentint -9.4142 2.1083 -6.3501 {"}'M' greentint -9.2593 2.2055 -6.1776 {"}'M' greentint -9.118 2.3563 -6.036 {"}'M' greentint -9.5978 2.134 -7.0238 {"}'M' greentint -9.4578 2.069 -6.8245 {"}'M' greentint -9.3035 2.0683 -6.6254 {"}'M' greentint -9.1453 2.132 -6.4391 {"}'M' greentint -8.9951 2.2564 -6.2793 {"}'M' greentint -8.862 2.432 -6.1562 {"}'M' greentint -8.7567 2.6467 -6.0784 {"}'M' greentint -9.3943 2.2003 -7.1795 {"}'M' greentint -9.2529 2.1273 -6.9764 {"}'M' greentint -9.0947 2.1295 -6.7727 {"}'M' greentint -8.9341 2.2054 -6.5858 {"}'M' greentint -8.7846 2.3508 -6.4334 {"}'M' greentint -8.66 2.5508 -6.3276 {"}'M' greentint -8.5714 2.7884 -6.2796 {"}'M' greentint -9.2659 2.4269 -7.4197 {"}'M' greentint -9.1498 2.2899 -7.2315 {"}'M' greentint -9.001 2.2403 -7.0254 {"}'M' greentint -8.5603 2.6212 -6.5611 {"}'M' greentint -8.482 2.8668 -6.529 {"}'M' greentint -9.0218 2.5255 -7.394 {"}'M' greentint -8.8901 2.4238 -7.1958 {"}'M' greentint -8.7291 2.4518 -6.9958 {"}'M' greentint -8.581 2.6038 -6.847 {"}'M' greentint -8.4862 2.8379 -6.7896 {"}'M' greentint -8.4699 3.0916 -6.839 {"}'M' greentint -8.8608 2.7968 -7.4272 {"}'M' greentint -8.7566 2.6416 -7.2493 {"}'M' greentint -8.5966 2.7385 -7.0699 {"}'M' greentint -8.5416 2.9918 -7.0697 {"}'M' greentint -8.6749 2.8882 -7.2692 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 66 B}'M' green -9.5985 1.2024 -4.1412 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 66 B}'M' greentint -9.7844 1.111 -4.2992 {"}'M' greentint -9.9176 1.0074 -4.4987 {"}'M' greentint -9.7027 1.3576 -4.3191 {"}'M' greentint -9.8627 1.2607 -4.4985 {"}'M' greentint -9.9731 1.1613 -4.7788 {"}'M' greentint -9.9894 0.9076 -4.7295 {"}'M' greentint -9.4375 1.4737 -4.1744 {"}'M' greentint -9.5692 1.5754 -4.3726 {"}'M' greentint -9.7302 1.5474 -4.5726 {"}'M' greentint -9.8783 1.3954 -4.7214 {"}'M' greentint -9.9448 1.2587 -5.0324 {"}'M' greentint -9.9952 1.0041 -5.0278 {"}'M' greentint -9.3808 1.7453 -4.4392 {"}'M' greentint -9.5397 1.7484 -4.6451 {"}'M' greentint -9.6999 1.6574 -4.828 {"}'M' greentint -9.8414 1.4868 -4.9636 {"}'M' greentint -9.8479 1.333 -5.2724 {"}'M' greentint -9.2839 1.88 -4.6947 {"}'M' greentint -9.4453 1.8408 -4.8926 {"}'M' greentint -9.6019 1.7288 -5.064 {"}'M' greentint -9.7405 1.554 -5.1947 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 135 B}'M' green -10.0056 0.9456 -5.0799 {"}'M' green -9.2753 1.8782 -4.6535 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 135 B}'M' greentint -9.9174 0.8659 -4.6267 {"}'M' greentint -9.7596 0.9761 -4.4532 {"}'M' greentint -9.6142 1.1378 -4.3102 {"}'M' greentint -9.4896 1.3402 -4.2066 {"}'M' greentint -9.8464 0.968 -4.8794 {"}'M' greentint -9.6867 1.0566 -4.6984 {"}'M' greentint -9.54 1.2062 -4.5509 {"}'M' greentint -9.4163 1.4059 -4.4462 {"}'M' greentint -9.3244 1.6401 -4.3929 {"}'M' greentint -9.887 1.1275 -5.2344 {"}'M' greentint -9.7282 1.1385 -5.0335 {"}'M' greentint -9.5711 1.2344 -4.8562 {"}'M' greentint -9.4327 1.4049 -4.7247 {"}'M' greentint -9.3298 1.6284 -4.6538 {"}'M' greentint -9.7527 1.3354 -5.3102 {"}'M' greentint -9.5895 1.3646 -5.1076 {"}'M' greentint -9.4398 1.5183 -4.9567 {"}'M' greentint -9.3445 1.7546 -4.8992 {"}'M' greentint -9.64 1.5652 -5.3454 {"}'M' greentint -9.4813 1.6625 -5.1678 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 10 1dj0A_72F_12I}P -7.1428 5.9276 -11.7748 {"}-7.1428 5.9276 -11.7748 { ca tyr A 10 1dj0A_72F_12I}-8.2525 6.1853 -10.8621 { c tyr A 10 1dj0A_72F_12I}-8.1082 5.3375 -9.5914 { o tyr A 10 1dj0A_72F_12I}-7.609 4.2195 -9.6946 { c tyr A 10 1dj0A_72F_12I}P -8.1082 5.3375 -9.5914 { n lys A 11 1dj0A_72F_12I}-8.486 5.8812 -8.4547 { ca lys A 11 1dj0A_72F_12I}-8.452 5.1103 -7.2018 { c lys A 11 1dj0A_72F_12I}-9.9165 4.9598 -6.7971 { o lys A 11 1dj0A_72F_12I}-10.6955 5.9118 -6.7924 { c lys A 11 1dj0A_72F_12I}P -9.9165 4.9598 -6.7971 { n ile A 12 1dj0A_72F_12I}-10.2757 3.6959 -6.5912 { ca ile A 12 1dj0A_72F_12I}-11.6625 3.3235 -6.3357 { c ile A 12 1dj0A_72F_12I}-11.7927 2.5235 -5.0527 { o ile A 12 1dj0A_72F_12I}-10.9625 1.6339 -4.795 { c ile A 12 1dj0A_72F_12I}P -11.7927 2.5235 -5.0527 { n ala A 13 1dj0A_72F_12I}-12.8517 2.8148 -4.2853 { ca ala A 13 1dj0A_72F_12I}-13.1127 2.0429 -3.068 { c ala A 13 1dj0A_72F_12I}-14.3884 1.2162 -3.2797 { o ala A 13 1dj0A_72F_12I}-15.2833 1.6819 -3.9855 { c ala A 13 1dj0A_72F_12I}P -14.3884 1.2162 -3.2797 { n leu A 14 1dj0A_72F_12I}-14.3855 0.0423 -2.6678 { ca leu A 14 1dj0A_72F_12I}-15.5725 -0.8115 -2.7623 { c leu A 14 1dj0A_72F_12I}-15.929 -1.3444 -1.3645 { o leu A 14 1dj0A_72F_12I}-15.0215 -1.6374 -0.5852 { n val A 70 1dj0A_72F_12I}P -12.3484 -2.0895 0.492 {"}-12.3484 -2.0895 0.492 { ca val A 70 1dj0A_72F_12I}-11.0283 -2.1536 -0.172 { c val A 70 1dj0A_72F_12I}-10.8248 -0.9034 -1.0269 { o val A 70 1dj0A_72F_12I}-11.8134 -0.2263 -1.3859 { c val A 70 1dj0A_72F_12I}P -10.8248 -0.9034 -1.0269 { n his A 71 1dj0A_72F_12I}-9.5613 -0.6699 -1.4038 { ca his A 71 1dj0A_72F_12I}-9.33 0.2973 -2.4842 { c his A 71 1dj0A_72F_12I}-8.4331 -0.4205 -3.5142 { o his A 71 1dj0A_72F_12I}-7.7513 -1.3797 -3.194 { c his A 71 1dj0A_72F_12I}P -8.4331 -0.4205 -3.5142 { n phe A 72 1dj0A_72F_12I}-8.4584 0.1261 -4.7604 { ca phe A 72 1dj0A_72F_12I}-7.5218 -0.3687 -5.77 { c phe A 72 1dj0A_72F_12I}-7.3321 0.7935 -6.7501 { o phe A 72 1dj0A_72F_12I}-8.0913 1.7381 -6.7969 { c phe A 72 1dj0A_72F_12I}P -7.3321 0.7935 -6.7501 { n glu A 73 1dj0A_72F_12I}-6.2449 0.7106 -7.5146 { ca glu A 73 1dj0A_72F_12I}-5.9915 1.7062 -8.5745 { c glu A 73 1dj0A_72F_12I}-6.1792 0.9907 -9.9186 { o glu A 73 1dj0A_72F_12I}-5.9199 -0.2073 -10.0393 { c glu A 73 1dj0A_72F_12I}P -6.1792 0.9907 -9.9186 { n thr A 74 1dj0A_72F_12I}-6.6496 1.7493 -10.8989 { ca thr A 74 1dj0A_72F_12I}-6.8445 1.188 -12.2435 { c thr A 74 1dj0A_72F_12I}-6.6627 2.3105 -13.2595 { o thr A 74 1dj0A_72F_12I}-6.9158 3.4807 -12.9839 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 10 1dj0A_72F_12I}P -7.1428 5.9276 -11.7748 { ca tyr A 10 1dj0A_72F_12I}P -8.2525 6.1853 -10.8621 { n lys A 11 1dj0A_72F_12I}P -8.486 5.8812 -8.4547 { ca lys A 11 1dj0A_72F_12I}P -8.452 5.1103 -7.2018 { n ile A 12 1dj0A_72F_12I}P -10.2757 3.6959 -6.5912 { ca ile A 12 1dj0A_72F_12I}P -11.6625 3.3235 -6.3357 { n ala A 13 1dj0A_72F_12I}P -12.8517 2.8148 -4.2853 { ca ala A 13 1dj0A_72F_12I}P -13.1127 2.0429 -3.068 { n leu A 14 1dj0A_72F_12I}P -14.3855 0.0423 -2.6678 { ca leu A 14 1dj0A_72F_12I}P -15.5725 -0.8115 -2.7623 { n val A 70 1dj0A_72F_12I}P -12.3484 -2.0895 0.492 { ca val A 70 1dj0A_72F_12I}P -11.0283 -2.1536 -0.172 { n his A 71 1dj0A_72F_12I}P -9.5613 -0.6699 -1.4038 { ca his A 71 1dj0A_72F_12I}P -9.33 0.2973 -2.4842 { n phe A 72 1dj0A_72F_12I}P -8.4584 0.1261 -4.7604 { ca phe A 72 1dj0A_72F_12I}P -7.5218 -0.3687 -5.77 { n glu A 73 1dj0A_72F_12I}P -6.2449 0.7106 -7.5146 { ca glu A 73 1dj0A_72F_12I}P -5.9915 1.7062 -8.5745 { n thr A 74 1dj0A_72F_12I}P -6.6496 1.7493 -10.8989 { ca thr A 74 1dj0A_72F_12I}P -6.8445 1.188 -12.2435 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 10 1dj0A_72F_12I}P -8.2525 6.1853 -10.8621 {"}-8.2525 6.1853 -10.8621 { ca lys A 11 1dj0A_72F_12I}-8.452 5.1103 -7.2018 { ca ile A 12 1dj0A_72F_12I}-11.6625 3.3235 -6.3357 { ca ala A 13 1dj0A_72F_12I}-13.1127 2.0429 -3.068 { ca leu A 14 1dj0A_72F_12I}-15.5725 -0.8115 -2.7623 { ca val A 70 1dj0A_72F_12I}P -11.0283 -2.1536 -0.172 {"}-11.0283 -2.1536 -0.172 { ca his A 71 1dj0A_72F_12I}-9.33 0.2973 -2.4842 { ca phe A 72 1dj0A_72F_12I}-7.5218 -0.3687 -5.77 { ca glu A 73 1dj0A_72F_12I}-5.9915 1.7062 -8.5745 { ca thr A 74 1dj0A_72F_12I}-6.8445 1.188 -12.2435 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ile A 12 1dj0A_72F_12I}P -11.6625 3.3235 -6.3357 { cb ile A 12 1dj0A_72F_12I}-12.1386 2.4753 -7.5309 { cg1 ile A 12 1dj0A_72F_12I}-12.1575 3.3903 -8.7772 { cd1 ile A 12 1dj0A_72F_12I}-12.4493 2.6965 -10.0602 { cb ile A 12 1dj0A_72F_12I}P -12.1386 2.4753 -7.5309 { cg2 ile A 12 1dj0A_72F_12I}-13.5437 1.9499 -7.2996 { ca phe A 72 1dj0A_72F_12I}P -7.5218 -0.3687 -5.77 { cb phe A 72 1dj0A_72F_12I}-8.0291 -1.6289 -6.4867 { cg phe A 72 1dj0A_72F_12I}-9.3016 -1.4166 -7.2576 { cd1 phe A 72 1dj0A_72F_12I}-10.5596 -1.4565 -6.6627 { ce1 phe A 72 1dj0A_72F_12I}-11.6986 -1.2674 -7.4218 { cz phe A 72 1dj0A_72F_12I}-11.6256 -1.0183 -8.8024 { cg phe A 72 1dj0A_72F_12I}P -9.3016 -1.4166 -7.2576 { cd2 phe A 72 1dj0A_72F_12I}-9.2435 -1.1756 -8.638 { ce2 phe A 72 1dj0A_72F_12I}-10.3695 -0.9718 -9.3861 { cz phe A 72 1dj0A_72F_12I}ghost -11.6256 -1.0183 -8.8024 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ile A 12 1dj0A_72F_12I}P -12.1386 2.4753 -7.5309 { cg1 ile A 12 1dj0A_72F_12I}P -12.1575 3.3903 -8.7772 {"}P -12.1575 3.3903 -8.7772 { cg2 ile A 12 1dj0A_72F_12I}P -13.5437 1.9499 -7.2996 {"}P -13.5437 1.9499 -7.2996 {"}P -13.5437 1.9499 -7.2996 { cd1 ile A 12 1dj0A_72F_12I}P -12.4493 2.6965 -10.0602 {"}P -12.4493 2.6965 -10.0602 {"}P -12.4493 2.6965 -10.0602 { cb phe A 72 1dj0A_72F_12I}P -8.0291 -1.6289 -6.4867 {"}P -8.0291 -1.6289 -6.4867 { cd1 phe A 72 1dj0A_72F_12I}P -10.5596 -1.4565 -6.6627 { cd2 phe A 72 1dj0A_72F_12I}P -9.2435 -1.1756 -8.638 { ce1 phe A 72 1dj0A_72F_12I}P -11.6986 -1.2674 -7.4218 { ce2 phe A 72 1dj0A_72F_12I}P -10.3695 -0.9718 -9.3861 { cz phe A 72 1dj0A_72F_12I}P -11.6256 -1.0183 -8.8024 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 72 A}'S' blue -10.7737 0.2008 -7.1832 { CE1 PHE 72 A}'S' blue -12.774 -0.0615 -6.7506 {"}'S' blue -12.5707 0.1205 -6.8082 {"}'S' sky -12.732 0.0827 -7.0063 {"}'S' sky -12.8905 -0.008 -7.187 {"}'S' blue -13.0411 -0.1474 -7.3422 {"}'S' blue -12.3363 0.2637 -6.8641 {"}'S' sky -12.4974 0.2487 -7.0671 {"}'S' sky -12.8188 0.077 -7.4348 {"}'S' blue -12.9681 -0.0745 -7.5854 {"}'S' blue -12.0796 0.365 -6.9174 {"}'S' sky -12.2355 0.3706 -7.1215 {"}'S' sky -12.7117 0.1373 -7.6713 {"}'S' blue -12.8573 -0.0169 -7.8162 {"}'S' sky -11.801 0.4187 -6.9641 {"}'S' sky -12.2714 0.3801 -7.5607 {"}'S' sky -12.4287 0.2904 -7.7398 {"}'S' blue -12.5819 0.1649 -7.9017 {"}'S' sky -11.4624 0.3966 -6.9337 {"}'S' blue -11.143 0.3164 -6.9283 {"}'S' sky -10.8598 0.2684 -7.4103 { CE2 PHE 72 A}'S' blue -10.7144 0.4441 -8.4171 {"}'S' blue -10.9424 0.6757 -9.525 {"}'S' blue -11.0997 0.586 -9.7041 {"}'S' blue -11.2528 0.4605 -9.866 {"}'S' blue -10.7622 0.7018 -9.7136 {"}'S' blue -10.9234 0.6081 -9.8954 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-7.2599 {"}'S' sea -12.3959 0.3344 -7.3188 {"}'S' sea -12.5566 0.2559 -7.5034 {"}'S' sea -11.9529 0.4458 -7.1677 {"}'S' sea -12.1106 0.4327 -7.3682 {"}'S' green -11.6092 0.4574 -7.1414 {"}'S' green -11.7658 0.4804 -7.3487 {"}'S' green -11.9274 0.4629 -7.5536 {"}'S' sea -12.0913 0.4063 -7.7493 {"}'S' sea -11.2809 0.4074 -7.1307 {"}'S' green -11.43 0.4605 -7.338 {"}'S' green -11.749 0.4513 -7.7481 {"}'S' sea -11.0721 0.3606 -7.2824 {"}'S' green -11.2207 0.4143 -7.4892 {"}'S' green -11.3784 0.4316 -7.6967 {"}'S' sea -11.0074 0.3279 -7.6171 { CZ PHE 72 A}'S' sea -12.1103 0.4786 -8.0363 {"}'S' green -11.7233 0.4741 -7.8941 {"}'S' green -11.8587 0.5643 -8.093 {"}'S' green -12.0066 0.6141 -8.298 {"}'S' green -11.728 0.6678 -8.3447 {"}'S' sea -11.8799 0.6949 -8.5483 {"}'S' green -11.1363 0.4137 -7.9223 {"}'S' green -11.255 0.5473 -8.1133 {"}'S' green -11.3894 0.6457 -8.3143 {"}'S' green -11.5362 0.7065 -8.522 {"}'S' sea -11.6928 0.7295 -8.7293 {"}'S' sea -10.9477 0.441 -8.1149 {"}'S' green 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{"}'S' sea -11.8957 0.8647 -8.4446 {"}'S' green -11.8081 0.6886 -8.2811 {"}'S' green -11.403 0.4505 -7.6919 {"}'S' green -11.2436 0.4809 -7.4947 {"}'S' sea -11.0856 0.5667 -7.3137 {"}'S' green -11.6177 0.7919 -8.4752 {"}'S' green -11.2394 0.4953 -7.9024 {"}'S' sea -11.0813 0.513 -7.7039 {"}'S' sea -11.3816 0.8729 -8.5588 {"}'S' green -11.2779 0.7142 -8.3808 {"}'S' green -11.143 0.6193 -8.18 {"}'S' sea -10.9872 0.5951 -7.9718 {"}'S' sea -11.0408 0.827 -8.414 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 12 A}'S' P -11.6593 0.4672 -7.5967 {"}'S' -11.6593 0.47 -7.5972 {"}'S' P -11.6919 0.5568 -8.0957 {"}'S' -11.6894 0.567 -8.0912 {"}'S' P -11.5554 0.4755 -7.8956 {"}'S' -11.5553 0.4768 -7.8959 {"}'S' P -11.5151 0.6391 -8.3001 {"}'S' -11.5148 0.6456 -8.296 {"}'S' P -11.3867 0.5383 -8.1049 {"}'S' -11.3874 0.5515 -8.1003 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 72 A}'M' greentint -9.2634 2.1306 -6.1405 {"}'M' greentint -9.407 2.0228 -6.413 {"}'M' greentint -9.0014 2.4518 -6.0079 {"}'M' greentint -9.1647 2.4184 -6.2097 {"}'M' greentint -9.3133 2.2615 -6.3582 {"}'M' greentint -9.417 2.1652 -6.6557 {"}'M' greentint -8.8575 2.657 -6.0699 {"}'M' greentint -9.0155 2.6486 -6.2719 {"}'M' greentint -9.1741 2.5554 -6.4503 {"}'M' greentint -9.3133 2.3875 -6.5835 {"}'M' greentint -9.3866 2.2592 -6.9005 {"}'M' greentint -9.4578 2.0141 -6.9247 {"}'M' greentint -8.8285 2.8377 -6.3397 {"}'M' greentint -8.9887 2.7795 -6.5317 {"}'M' greentint -9.1435 2.6564 -6.6964 {"}'M' greentint -9.2792 2.4788 -6.8226 {"}'M' greentint -9.3087 2.3394 -7.1387 {"}'M' greentint -8.7453 2.9571 -6.5832 {"}'M' greentint -8.9078 2.8755 -6.7695 {"}'M' greentint -9.0601 2.7396 -6.9295 {"}'M' greentint -9.1967 2.558 -7.0543 {"}'M' greentint -8.8067 2.9218 -7.0161 {"}'M' greentint -8.9529 2.7782 -7.166 {"}'M' greentint -9.0837 2.5962 -7.2845 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 12 A}'M' greentint -9.3278 2.0023 -6.3684 {"}'M' greentint -9.1776 2.1268 -6.2086 {"}'M' greentint -9.0445 2.3024 -6.0855 {"}'M' greentint -8.9392 2.517 -6.0078 {"}'M' greentint -9.4354 1.9976 -6.9058 {"}'M' greentint -9.2773 1.9998 -6.702 {"}'M' greentint -9.1166 2.0758 -6.5152 {"}'M' greentint -8.9671 2.2211 -6.3628 {"}'M' greentint -8.8425 2.4211 -6.2569 {"}'M' greentint -8.7539 2.6587 -6.2089 {"}'M' greentint -9.3323 2.1603 -7.1608 {"}'M' greentint -9.1836 2.1106 -6.9547 {"}'M' greentint -9.0212 2.1555 -6.7568 {"}'M' greentint -8.867 2.2882 -6.595 {"}'M' greentint -8.7428 2.4915 -6.4904 {"}'M' greentint -8.6645 2.7372 -6.4583 {"}'M' greentint -9.2043 2.3958 -7.3233 {"}'M' greentint -9.0726 2.2941 -7.1251 {"}'M' greentint -8.9116 2.3222 -6.9252 {"}'M' greentint -8.7635 2.4741 -6.7763 {"}'M' greentint -8.6687 2.7082 -6.719 {"}'M' greentint -8.6524 2.9619 -6.7683 {"}'M' greentint -8.9391 2.5119 -7.1787 {"}'M' greentint -8.7791 2.6089 -6.9992 {"}'M' greentint -8.7241 2.8621 -6.999 {"}'M' greentint -8.8574 2.7585 -7.1985 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 72 A}'M' green -9.8828 0.7638 -4.4792 {"}'M' green -9.9921 0.6139 -4.7447 {"}'M' green -10.006 0.7424 -5.4049 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 72 A}'M' greentint -9.8537 1.0226 -4.4576 {"}'M' greentint -9.987 0.919 -4.657 {"}'M' greentint -9.7721 1.2692 -4.4774 {"}'M' greentint -9.932 1.1723 -4.6568 {"}'M' greentint -10.0424 1.0729 -4.9371 {"}'M' greentint -10.0587 0.8192 -4.8878 {"}'M' greentint -9.6386 1.4871 -4.5309 {"}'M' greentint -9.7996 1.459 -4.7309 {"}'M' greentint -9.9476 1.3071 -4.8798 {"}'M' greentint -10.0141 1.1704 -5.1907 {"}'M' greentint -10.0645 0.9157 -5.1861 {"}'M' greentint -10.0558 0.6679 -5.1057 {"}'M' greentint -9.609 1.6601 -4.8035 {"}'M' greentint -9.7693 1.569 -4.9863 {"}'M' greentint -9.9107 1.3985 -5.1219 {"}'M' greentint -9.9173 1.2447 -5.4307 {"}'M' greentint -9.9856 0.9956 -5.4484 {"}'M' greentint -9.6712 1.6404 -5.2223 {"}'M' greentint -9.8098 1.4657 -5.3531 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 12 A}'M' green -9.6336 1.411 -4.4145 {"}'M' green -9.5668 1.7271 -4.732 {"}'M' green -10.0324 0.7244 -5.3138 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 12 A}'M' greentint -9.9184 0.7237 -4.5905 {"}'M' greentint -9.7938 0.9261 -4.4869 {"}'M' greentint -9.6974 1.1592 -4.4271 {"}'M' greentint -9.991 0.6424 -4.9787 {"}'M' greentint -9.8443 0.792 -4.8311 {"}'M' greentint -9.7205 0.9918 -4.7264 {"}'M' greentint -9.6287 1.226 -4.6731 {"}'M' greentint -9.5767 1.4768 -4.6747 {"}'M' greentint -9.8754 0.8203 -5.1365 {"}'M' greentint -9.7369 0.9908 -5.0049 {"}'M' greentint -9.634 1.2143 -4.9341 {"}'M' greentint -9.5796 1.464 -4.9338 {"}'M' greentint -9.5799 1.7109 -5.0025 {"}'M' greentint -9.8938 0.9504 -5.3878 {"}'M' greentint -9.744 1.1042 -5.237 {"}'M' greentint -9.6487 1.3405 -5.1795 {"}'M' greentint -9.6323 1.5969 -5.2294 {"}'M' greentint -9.7856 1.2484 -5.4481 {"}'M' greentint -9.7302 1.4997 -5.4469 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n mse A 79 1dnlA_81F_181F}P -12.4037 -1.3198 0.6099 {"}-12.4037 -1.3198 0.6099 { ca mse A 79 1dnlA_81F_181F}-11.1888 -1.8586 0.001 { c mse A 79 1dnlA_81F_181F}-10.8366 -1.0451 -1.2379 { o mse A 79 1dnlA_81F_181F}-11.7012 -0.7428 -2.0648 { c mse A 79 1dnlA_81F_181F}P -10.8366 -1.0451 -1.2379 { n val A 80 1dnlA_81F_181F}-9.5516 -0.7235 -1.3664 { ca val A 80 1dnlA_81F_181F}-9.0723 0.1339 -2.4485 { c val A 80 1dnlA_81F_181F}-8.161 -0.5072 -3.4968 { o val A 80 1dnlA_81F_181F}-7.2623 -1.2876 -3.1651 { c val A 80 1dnlA_81F_181F}P -8.161 -0.5072 -3.4968 { n phe A 81 1dnlA_81F_181F}-8.4098 -0.1798 -4.7643 { ca phe A 81 1dnlA_81F_181F}-7.5512 -0.6253 -5.8678 { c phe A 81 1dnlA_81F_181F}-7.3952 0.5556 -6.8264 { o phe A 81 1dnlA_81F_181F}-8.2096 1.4798 -6.8108 { c phe A 81 1dnlA_81F_181F}P -7.3952 0.5556 -6.8264 { n tyr A 82 1dnlA_81F_181F}-6.3391 0.5388 -7.6383 { ca tyr A 82 1dnlA_81F_181F}-6.1034 1.6195 -8.5932 { c tyr A 82 1dnlA_81F_181F}-6.1883 1.0703 -10.0091 { o tyr A 82 1dnlA_81F_181F}-5.9416 -0.1155 -10.2352 { c tyr A 82 1dnlA_81F_181F}P -6.1883 1.0703 -10.0091 { n thr A 83 1dnlA_81F_181F}-6.5301 1.9337 -10.9604 { ca thr A 83 1dnlA_81F_181F}-6.6884 1.4872 -12.3394 { c thr A 83 1dnlA_81F_181F}-6.7093 2.6916 -13.2769 { o thr A 83 1dnlA_81F_181F}-6.6628 3.8444 -12.822 { n gly A 179 1dnlA_81F_181F}P -6.3559 6.5833 -11.6434 {"}-6.3559 6.5833 -11.6434 { ca gly A 179 1dnlA_81F_181F}-7.1632 6.8554 -10.4746 { c gly A 179 1dnlA_81F_181F}-7.3689 5.6298 -9.6114 { o gly A 179 1dnlA_81F_181F}-6.6798 4.6256 -9.7613 { c gly A 179 1dnlA_81F_181F}P -7.3689 5.6298 -9.6114 { n gly A 180 1dnlA_81F_181F}-8.3306 5.7219 -8.7065 { ca gly A 180 1dnlA_81F_181F}-8.6018 4.6132 -7.8176 { c gly A 180 1dnlA_81F_181F}-10.0402 4.5756 -7.3485 { o gly A 180 1dnlA_81F_181F}-10.7941 5.5596 -7.4569 { c gly A 180 1dnlA_81F_181F}P -10.0402 4.5756 -7.3485 { n phe A 181 1dnlA_81F_181F}-10.4271 3.418 -6.832 { ca phe A 181 1dnlA_81F_181F}-11.7749 3.2339 -6.3321 { c phe A 181 1dnlA_81F_181F}-11.7306 2.5959 -4.9605 { o phe A 181 1dnlA_81F_181F}-10.863 1.7781 -4.6868 { c phe A 181 1dnlA_81F_181F}P -11.7306 2.5959 -4.9605 { n arg A 182 1dnlA_81F_181F}-12.6697 2.999 -4.1094 { ca arg A 182 1dnlA_81F_181F}-12.817 2.4174 -2.7853 { c arg A 182 1dnlA_81F_181F}-14.1578 1.7116 -2.8128 { o arg A 182 1dnlA_81F_181F}-15.1829 2.3285 -3.1072 { c arg A 182 1dnlA_81F_181F}P -14.1578 1.7116 -2.8128 { n val A 183 1dnlA_81F_181F}-14.1556 0.4177 -2.5127 { ca val A 183 1dnlA_81F_181F}-15.3897 -0.3751 -2.5045 { c val A 183 1dnlA_81F_181F}-15.9054 -0.4849 -1.0636 { o val A 183 1dnlA_81F_181F}-15.2123 -1.0122 -0.1889 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n mse A 79 1dnlA_81F_181F}P -12.4037 -1.3198 0.6099 { ca mse A 79 1dnlA_81F_181F}P -11.1888 -1.8586 0.001 { n val A 80 1dnlA_81F_181F}P -9.5516 -0.7235 -1.3664 { ca val A 80 1dnlA_81F_181F}P -9.0723 0.1339 -2.4485 { n phe A 81 1dnlA_81F_181F}P -8.4098 -0.1798 -4.7643 { ca phe A 81 1dnlA_81F_181F}P -7.5512 -0.6253 -5.8678 { n tyr A 82 1dnlA_81F_181F}P -6.3391 0.5388 -7.6383 { ca tyr A 82 1dnlA_81F_181F}P -6.1034 1.6195 -8.5932 { n thr A 83 1dnlA_81F_181F}P -6.5301 1.9337 -10.9604 { ca thr A 83 1dnlA_81F_181F}P -6.6884 1.4872 -12.3394 { n gly A 179 1dnlA_81F_181F}P -6.3559 6.5833 -11.6434 { ca gly A 179 1dnlA_81F_181F}P -7.1632 6.8554 -10.4746 {"}P -7.1632 6.8554 -10.4746 { n gly A 180 1dnlA_81F_181F}P -8.3306 5.7219 -8.7065 { ca gly A 180 1dnlA_81F_181F}P -8.6018 4.6132 -7.8176 {"}P -8.6018 4.6132 -7.8176 { n phe A 181 1dnlA_81F_181F}P -10.4271 3.418 -6.832 { ca phe A 181 1dnlA_81F_181F}P -11.7749 3.2339 -6.3321 { n arg A 182 1dnlA_81F_181F}P -12.6697 2.999 -4.1094 { ca arg A 182 1dnlA_81F_181F}P -12.817 2.4174 -2.7853 { n val A 183 1dnlA_81F_181F}P -14.1556 0.4177 -2.5127 { ca val A 183 1dnlA_81F_181F}P -15.3897 -0.3751 -2.5045 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca mse A 79 1dnlA_81F_181F}P -11.1888 -1.8586 0.001 {"}-11.1888 -1.8586 0.001 { ca val A 80 1dnlA_81F_181F}-9.0723 0.1339 -2.4485 { ca phe A 81 1dnlA_81F_181F}-7.5512 -0.6253 -5.8678 { ca tyr A 82 1dnlA_81F_181F}-6.1034 1.6195 -8.5932 { ca thr A 83 1dnlA_81F_181F}-6.6884 1.4872 -12.3394 { ca gly A 179 1dnlA_81F_181F}P -7.1632 6.8554 -10.4746 {"}-7.1632 6.8554 -10.4746 { ca gly A 180 1dnlA_81F_181F}-8.6018 4.6132 -7.8176 { ca phe A 181 1dnlA_81F_181F}-11.7749 3.2339 -6.3321 { ca arg A 182 1dnlA_81F_181F}-12.817 2.4174 -2.7853 { ca val A 183 1dnlA_81F_181F}-15.3897 -0.3751 -2.5045 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 81 1dnlA_81F_181F}P -7.5512 -0.6253 -5.8678 { cb phe A 81 1dnlA_81F_181F}-8.1188 -1.8394 -6.628 { cg phe A 81 1dnlA_81F_181F}-9.4238 -1.5816 -7.3459 { cd1 phe A 81 1dnlA_81F_181F}-10.6399 -1.7282 -6.6916 { ce1 phe A 81 1dnlA_81F_181F}-11.8433 -1.5472 -7.378 { cz phe A 81 1dnlA_81F_181F}-11.8344 -1.2068 -8.727 { cg phe A 81 1dnlA_81F_181F}P -9.4238 -1.5816 -7.3459 { cd2 phe A 81 1dnlA_81F_181F}-9.4324 -1.2386 -8.6954 { ce2 phe A 81 1dnlA_81F_181F}-10.6264 -1.0538 -9.3869 { cz phe A 81 1dnlA_81F_181F}ghost -11.8344 -1.2068 -8.727 { ca phe A 181 1dnlA_81F_181F}P -11.7749 3.2339 -6.3321 { cb phe A 181 1dnlA_81F_181F}-12.5919 2.3137 -7.2439 { cg phe A 181 1dnlA_81F_181F}-12.8835 2.8891 -8.5991 { cd1 phe A 181 1dnlA_81F_181F}-12.0534 2.6122 -9.6724 { ce1 phe A 181 1dnlA_81F_181F}-12.3128 3.1615 -10.9401 { cz phe A 181 1dnlA_81F_181F}-13.4149 3.996 -11.1228 { cg phe A 181 1dnlA_81F_181F}P -12.8835 2.8891 -8.5991 { cd2 phe A 181 1dnlA_81F_181F}-13.9804 3.7241 -8.7902 { ce2 phe A 181 1dnlA_81F_181F}-14.2517 4.2761 -10.0458 { cz phe A 181 1dnlA_81F_181F}ghost -13.4149 3.996 -11.1228 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 81 1dnlA_81F_181F}P -8.1188 -1.8394 -6.628 {"}P -8.1188 -1.8394 -6.628 { cd1 phe A 81 1dnlA_81F_181F}P -10.6399 -1.7282 -6.6916 { cd2 phe A 81 1dnlA_81F_181F}P -9.4324 -1.2386 -8.6954 { ce1 phe A 81 1dnlA_81F_181F}P -11.8433 -1.5472 -7.378 { ce2 phe A 81 1dnlA_81F_181F}P -10.6264 -1.0538 -9.3869 { cz phe A 81 1dnlA_81F_181F}P -11.8344 -1.2068 -8.727 { cb phe A 181 1dnlA_81F_181F}P -12.5919 2.3137 -7.2439 {"}P -12.5919 2.3137 -7.2439 { cd1 phe A 181 1dnlA_81F_181F}P -12.0534 2.6122 -9.6724 { cd2 phe A 181 1dnlA_81F_181F}P -13.9804 3.7241 -8.7902 { ce1 phe A 181 1dnlA_81F_181F}P -12.3128 3.1615 -10.9401 { ce2 phe A 181 1dnlA_81F_181F}P -14.2517 4.2761 -10.0458 { cz phe A 181 1dnlA_81F_181F}P -13.4149 3.996 -11.1228 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 81 A}'S' sky -12.0764 0.0353 -6.6686 {"}'S' blue -12.7013 -0.0239 -7.4597 {"}'S' sky -11.8034 0.0729 -6.7175 {"}'S' sky -12.5735 0.0106 -7.696 {"}'S' blue -11.2169 0.0807 -7.2386 { CE2 PHE 81 A}'S' blue -11.1633 0.5841 -9.0866 {"}'S' blue -11.3237 0.5479 -9.2839 {"}'S' blue -11.4844 0.4695 -9.4685 {"}'S' blue -10.8808 0.6594 -9.1328 {"}'S' sky -11.0384 0.6463 -9.3334 {"}'S' blue -11.1993 0.5937 -9.5258 {"}'S' blue -11.3565 0.504 -9.7049 {"}'S' blue -10.6936 0.694 -9.3139 {"}'S' sky -10.8552 0.6765 -9.5188 {"}'S' blue -11.0191 0.6198 -9.7145 {"}'S' blue -10.5147 0.6884 -9.5106 {"}'S' blue -10.6768 0.6649 -9.7132 {"}'S' blue -10.8404 0.6034 -9.9074 { CZ PHE 81 A}'S' sky -12.3714 0.4312 -8.4266 {"}'S' sky -11.3452 0.2252 -7.8469 {"}'S' blue -11.9017 0.541 -8.6539 {"}'S' blue -11.2788 0.3771 -8.2334 {"}'S' blue -11.4168 0.4681 -8.4359 {"}'S' blue -11.8849 0.512 -9.0532 {"}'S' blue -12.0485 0.4505 -9.2475 {"}'S' blue -11.676 0.4692 -9.2057 {"}'S' blue -11.8391 0.4086 -9.3995 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 81 A}'S' sea -12.2244 0.0851 -6.8736 {"}'S' sea -12.3803 0.0907 -7.0777 {"}'S' sea -12.5407 0.0545 -7.275 {"}'S' green -11.9458 0.1388 -6.9204 {"}'S' green -12.0977 0.166 -7.1239 {"}'S' green -12.2554 0.1528 -7.3245 {"}'S' sea -12.4162 0.1003 -7.5169 {"}'S' sea -11.6071 0.1168 -6.89 {"}'S' green -11.7539 0.1776 -7.0976 {"}'S' green -11.9106 0.2005 -7.305 {"}'S' green -12.0721 0.1831 -7.5099 {"}'S' sea -11.4256 0.1276 -7.087 {"}'S' green -11.5747 0.1806 -7.2943 {"}'S' green -11.7316 0.1949 -7.5017 {"}'S' sea -11.3655 0.1345 -7.4455 {"}'S' sea -11.5231 0.1517 -7.6529 { CZ PHE 81 A}'S' sea -12.41 0.0931 -7.7067 {"}'S' sea -12.5523 0.1635 -7.9087 {"}'S' green -12.1793 0.2092 -7.758 {"}'S' green -12.3192 0.2901 -7.9608 {"}'S' sea -12.4722 0.3243 -8.1692 {"}'S' green -11.9321 0.2856 -7.8187 {"}'S' green -12.0676 0.3758 -8.0176 {"}'S' green -12.2155 0.4256 -8.2225 {"}'S' sea -11.5538 0.1727 -7.6877 {"}'S' green -11.6665 0.3105 -7.8714 {"}'S' green -11.7945 0.4134 -8.0664 {"}'S' green -11.9369 0.4793 -8.2693 {"}'S' sea -12.0888 0.5065 -8.4729 {"}'S' sea -11.4639 0.3588 -8.0379 {"}'S' sea -11.5983 0.4573 -8.2389 {"}'S' sea -11.7451 0.518 -8.4466 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 181 A}'S' blue -12.2063 0.9378 -9.1882 {"}'S' blue -12.0435 0.9994 -8.9934 {"}'S' blue -12.0076 0.8917 -9.3521 {"}'S' blue -11.8452 0.9525 -9.1577 {"}'S' blue -11.7372 0.9078 -9.4356 {"}'S' blue -11.4856 0.9621 -9.5399 { HB2 PHE 181 A}'S' blue -12.685 0.3918 -7.4895 {"}'S' sky -12.0779 0.4016 -6.708 {"}'S' sky -12.6327 0.4912 -7.8816 {"}'S' sky -11.7788 0.4071 -6.7551 {"}'S' sky -12.4823 0.612 -8.1531 {"}'S' sky -11.5221 0.4498 -6.8668 {"}'S' sky -12.2754 0.7355 -8.329 {"}'S' sky -11.3597 0.4678 -7.0711 {"}'S' sky -12.0326 0.8291 -8.4099 {"}'S' sky -11.3339 0.5101 -7.7238 {"}'S' sky -11.4725 0.7973 -8.2147 {"}'S' sky -11.3391 0.6945 -8.014 { HD1 PHE 181 A}'S' blue -11.2981 0.971 -9.407 {"}'S' blue -11.1415 1.0085 -9.2152 {"}'S' blue -11.1851 0.9691 -9.6896 {"}'S' sky -11.0308 0.9684 -9.4905 {"}'S' blue -10.8726 1.0321 -9.3042 {"}'S' blue -10.9802 1.0274 -9.8415 {"}'S' blue -10.822 1.0296 -9.6378 {"}'S' blue -10.6614 1.1056 -9.4509 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 PHE 181 A}'S' sea -12.5476 0.3103 -7.29 {"}'S' sea -12.3957 0.2846 -7.0867 {"}'S' sea -12.2363 0.315 -6.8895 {"}'S' sea -12.524 0.3506 -7.7025 {"}'S' green -12.3933 0.2562 -7.5075 {"}'S' green -12.2459 0.2145 -7.3052 {"}'S' green -12.0904 0.2265 -7.1073 {"}'S' green -11.9318 0.291 -6.9206 {"}'S' green -12.3947 0.4359 -7.9896 {"}'S' green -12.2785 0.3041 -7.8042 {"}'S' green -12.142 0.2228 -7.6041 {"}'S' green -11.9896 0.1978 -7.4004 {"}'S' green -11.8302 0.2282 -7.2031 {"}'S' sea -11.6722 0.314 -7.0222 {"}'S' green -12.2043 0.5392 -8.1837 {"}'S' green -12.1017 0.3864 -8.0086 {"}'S' green -11.9733 0.2856 -7.8134 {"}'S' green -11.826 0.2426 -7.6109 {"}'S' green -11.6678 0.2604 -7.4124 {"}'S' sea -11.5101 0.3364 -7.2296 {"}'S' green -11.9682 0.6202 -8.2673 {"}'S' green -11.8645 0.4615 -8.0893 {"}'S' green -11.7296 0.3667 -7.8885 {"}'S' green -11.5738 0.3424 -7.6803 {"}'S' sea -11.4105 0.3914 -7.4837 {"}'S' sea -11.7299 0.7271 -8.2976 {"}'S' green -11.6274 0.5744 -8.1225 {"}'S' sea -11.4902 0.4993 -7.9231 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 81 A}'M' greentint -9.5253 1.7645 -6.4269 {"}'M' greentint -9.2831 2.1601 -6.2236 {"}'M' greentint -9.4317 2.0032 -6.3721 {"}'M' greentint -9.5354 1.9068 -6.6696 {"}'M' greentint -9.5919 1.6573 -6.6729 {"}'M' greentint -9.1338 2.3902 -6.2858 {"}'M' greentint -9.2924 2.2971 -6.4642 {"}'M' greentint -9.4316 2.1291 -6.5974 {"}'M' greentint -9.505 2.0008 -6.9144 {"}'M' greentint -9.5761 1.7557 -6.9386 {"}'M' greentint -8.9468 2.5793 -6.3537 {"}'M' greentint -9.107 2.5211 -6.5456 {"}'M' greentint -9.2618 2.398 -6.7103 {"}'M' greentint -9.3975 2.2205 -6.8365 {"}'M' greentint -9.4271 2.081 -7.1527 {"}'M' greentint -9.5083 1.8379 -7.191 {"}'M' greentint -8.8637 2.6987 -6.5971 {"}'M' greentint -9.0262 2.6171 -6.7834 {"}'M' greentint -9.1784 2.4812 -6.9434 {"}'M' greentint -9.315 2.2996 -7.0682 {"}'M' greentint -9.3126 2.1258 -7.3823 {"}'M' greentint -8.9251 2.6634 -7.0301 {"}'M' greentint -9.0712 2.5198 -7.1799 {"}'M' greentint -9.202 2.3379 -7.2984 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 181 A}'M' greentint -9.5304 1.689 -6.526 {"}'M' greentint -9.3802 1.8135 -6.3662 {"}'M' greentint -9.2471 1.9891 -6.2431 {"}'M' greentint -9.1418 2.2037 -6.1653 {"}'M' greentint -9.4798 1.6865 -6.8596 {"}'M' greentint -9.3192 1.7625 -6.6727 {"}'M' greentint -9.1696 1.9079 -6.5203 {"}'M' greentint -9.0451 2.1078 -6.4145 {"}'M' greentint -8.9565 2.3454 -6.3664 {"}'M' greentint -8.912 2.6002 -6.3791 {"}'M' greentint -9.3861 1.7974 -7.1123 {"}'M' greentint -9.2238 1.8423 -6.9143 {"}'M' greentint -9.0696 1.9749 -6.7526 {"}'M' greentint -8.9453 2.1782 -6.648 {"}'M' greentint -8.8671 2.4239 -6.6158 {"}'M' greentint -8.8461 2.6793 -6.6592 {"}'M' greentint -9.2752 1.9808 -7.2827 {"}'M' greentint -9.1142 2.0089 -7.0827 {"}'M' greentint -8.9661 2.1608 -6.9339 {"}'M' greentint -8.8713 2.395 -6.8765 {"}'M' greentint -8.855 2.6487 -6.9258 {"}'M' greentint -9.1417 2.1987 -7.3362 {"}'M' greentint -8.9817 2.2956 -7.1568 {"}'M' greentint -8.9267 2.5489 -7.1566 {"}'M' greentint -9.06 2.4452 -7.3561 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 81 A}'M' green -9.9646 0.5516 -4.4452 {"}'M' green -10.0979 0.448 -4.6447 {"}'M' green -9.883 0.7982 -4.4651 {"}'M' sea -9.6177 0.9143 -4.3204 {"}'M' sea -10.1754 0.4447 -5.1738 {"}'M' green -9.5611 1.1859 -4.5852 {"}'M' green -10.0282 0.7736 -5.4184 {"}'M' green -9.4642 1.3206 -4.8407 {"}'M' sea -9.4942 1.3078 -5.2753 {"}'M' green -9.6444 1.1834 -5.4351 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 81 A}'M' greentint -10.0429 0.7013 -4.6445 {"}'M' greentint -10.1533 0.6019 -4.9248 {"}'M' greentint -9.7495 1.016 -4.5186 {"}'M' greentint -9.9105 0.988 -4.7186 {"}'M' greentint -10.0585 0.836 -4.8674 {"}'M' greentint -10.125 0.6993 -5.1784 {"}'M' greentint -9.7199 1.1891 -4.7911 {"}'M' greentint -9.8802 1.098 -4.974 {"}'M' greentint -10.0216 0.9275 -5.1096 {"}'M' greentint -9.6255 1.2814 -5.0386 {"}'M' greentint -9.7821 1.1694 -5.21 {"}'M' greentint -9.9207 0.9947 -5.3407 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 181 A}'M' sea -10.2295 0.5359 -4.5576 {"}'M' green -10.0777 0.6566 -4.3948 {"}'M' green -10.2847 0.5403 -4.9929 {"}'M' green -9.6943 1.0703 -4.3788 {"}'M' green -10.2104 0.6757 -5.252 {"}'M' sea -9.5292 1.3702 -4.565 {"}'M' green -10.0917 0.8576 -5.4065 {"}'M' green -9.5345 1.3585 -4.8259 {"}'M' green -9.9574 1.0655 -5.4823 {"}'M' sea -9.5492 1.4847 -5.0713 {"}'M' sea -9.6861 1.3926 -5.3399 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 181 A}'M' greentint -10.1221 0.596 -4.7988 {"}'M' greentint -9.9643 0.7062 -4.6253 {"}'M' greentint -9.8189 0.8679 -4.4824 {"}'M' greentint -10.0512 0.6981 -5.0515 {"}'M' greentint -9.8915 0.7867 -4.8705 {"}'M' greentint -9.7448 0.9363 -4.723 {"}'M' greentint -9.621 1.136 -4.6183 {"}'M' greentint -9.9329 0.8686 -5.2056 {"}'M' greentint -9.7759 0.9645 -5.0283 {"}'M' greentint -9.6374 1.1351 -4.8968 {"}'M' greentint -9.7943 1.0947 -5.2797 {"}'M' greentint -9.6445 1.2484 -5.1288 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 83 1dpjA_101F_85S}P -6.0883 5.8996 -11.1593 {"}-6.0883 5.8996 -11.1593 { ca tyr A 83 1dpjA_101F_85S}-6.6595 6.5528 -9.9906 { c tyr A 83 1dpjA_101F_85S}-7.2775 5.4911 -9.0737 { o tyr A 83 1dpjA_101F_85S}-7.4961 4.3518 -9.4987 { c tyr A 83 1dpjA_101F_85S}P -7.2775 5.4911 -9.0737 { n ile A 84 1dpjA_101F_85S}-7.484 5.9067 -7.8343 { ca ile A 84 1dpjA_101F_85S}-8.0082 5.0224 -6.8058 { c ile A 84 1dpjA_101F_85S}-9.5268 4.8642 -6.9348 { o ile A 84 1dpjA_101F_85S}-10.2387 5.8385 -7.1835 { c ile A 84 1dpjA_101F_85S}P -9.5268 4.8642 -6.9348 { n ser A 85 1dpjA_101F_85S}-9.9915 3.6177 -6.7984 { ca ser A 85 1dpjA_101F_85S}-11.4254 3.2888 -6.8154 { c ser A 85 1dpjA_101F_85S}-11.5931 2.271 -5.6656 { o ser A 85 1dpjA_101F_85S}-10.6009 1.7005 -5.1721 { c ser A 85 1dpjA_101F_85S}P -11.5931 2.271 -5.6656 { n gln A 86 1dpjA_101F_85S}-12.8336 2.0322 -5.2747 { ca gln A 86 1dpjA_101F_85S}-13.103 1.1151 -4.1486 { c gln A 86 1dpjA_101F_85S}-14.1958 0.1342 -4.5587 { o gln A 86 1dpjA_101F_85S}-15.1798 0.5156 -5.1755 { c gln A 86 1dpjA_101F_85S}P -14.1958 0.1342 -4.5587 { n asp A 87 1dpjA_101F_85S}-13.986 -1.1397 -4.2887 { ca asp A 87 1dpjA_101F_85S}-14.988 -2.1346 -4.6059 { c asp A 87 1dpjA_101F_85S}-14.7455 -3.3579 -3.7235 { o asp A 87 1dpjA_101F_85S}-13.8087 -3.3733 -2.9061 { n gln A 99 1dpjA_101F_85S}P -12.555 -2.4188 -0.4722 {"}-12.555 -2.4188 -0.4722 { ca gln A 99 1dpjA_101F_85S}-11.1007 -2.4376 -0.7531 { c gln A 99 1dpjA_101F_85S}-10.7116 -1.299 -1.7285 { o gln A 99 1dpjA_101F_85S}-11.3065 -1.2088 -2.81 { c gln A 99 1dpjA_101F_85S}P -10.7116 -1.299 -1.7285 { n asp A 100 1dpjA_101F_85S}-9.7421 -0.4638 -1.3546 { ca asp A 100 1dpjA_101F_85S}-9.2294 0.6013 -2.2692 { c asp A 100 1dpjA_101F_85S}-8.1639 -0.0611 -3.148 { o asp A 100 1dpjA_101F_85S}-7.3703 -0.9162 -2.6936 { c asp A 100 1dpjA_101F_85S}P -8.1639 -0.0611 -3.148 { n phe A 101 1dpjA_101F_85S}-8.1189 0.3483 -4.4275 { ca phe A 101 1dpjA_101F_85S}-7.1544 -0.1781 -5.3678 { c phe A 101 1dpjA_101F_85S}-7.0609 0.852 -6.5055 { o phe A 101 1dpjA_101F_85S}-7.8164 1.8014 -6.5415 { c phe A 101 1dpjA_101F_85S}P -7.0609 0.852 -6.5055 { n ala A 102 1dpjA_101F_85S}-6.0815 0.6674 -7.3753 { ca ala A 102 1dpjA_101F_85S}-5.9189 1.5734 -8.4963 { c ala A 102 1dpjA_101F_85S}-6.427 0.9441 -9.7647 { o ala A 102 1dpjA_101F_85S}-6.1445 -0.2338 -10.0121 { c ala A 102 1dpjA_101F_85S}P -6.427 0.9441 -9.7647 { n glu A 103 1dpjA_101F_85S}-7.1976 1.6937 -10.5756 { ca glu A 103 1dpjA_101F_85S}-7.5496 1.1449 -11.8782 { c glu A 103 1dpjA_101F_85S}-6.5952 1.9405 -12.8298 { o glu A 103 1dpjA_101F_85S}-6.5649 3.159 -12.7999 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 83 1dpjA_101F_85S}P -6.0883 5.8996 -11.1593 { ca tyr A 83 1dpjA_101F_85S}P -6.6595 6.5528 -9.9906 { n ile A 84 1dpjA_101F_85S}P -7.484 5.9067 -7.8343 { ca ile A 84 1dpjA_101F_85S}P -8.0082 5.0224 -6.8058 { n ser A 85 1dpjA_101F_85S}P -9.9915 3.6177 -6.7984 { ca ser A 85 1dpjA_101F_85S}P -11.4254 3.2888 -6.8154 { n gln A 86 1dpjA_101F_85S}P -12.8336 2.0322 -5.2747 { ca gln A 86 1dpjA_101F_85S}P -13.103 1.1151 -4.1486 { n asp A 87 1dpjA_101F_85S}P -13.986 -1.1397 -4.2887 { ca asp A 87 1dpjA_101F_85S}P -14.988 -2.1346 -4.6059 { n gln A 99 1dpjA_101F_85S}P -12.555 -2.4188 -0.4722 { ca gln A 99 1dpjA_101F_85S}P -11.1007 -2.4376 -0.7531 { n asp A 100 1dpjA_101F_85S}P -9.7421 -0.4638 -1.3546 { ca asp A 100 1dpjA_101F_85S}P -9.2294 0.6013 -2.2692 { n phe A 101 1dpjA_101F_85S}P -8.1189 0.3483 -4.4275 { ca phe A 101 1dpjA_101F_85S}P -7.1544 -0.1781 -5.3678 { n ala A 102 1dpjA_101F_85S}P -6.0815 0.6674 -7.3753 { ca ala A 102 1dpjA_101F_85S}P -5.9189 1.5734 -8.4963 { n glu A 103 1dpjA_101F_85S}P -7.1976 1.6937 -10.5756 { ca glu A 103 1dpjA_101F_85S}P -7.5496 1.1449 -11.8782 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 83 1dpjA_101F_85S}P -6.6595 6.5528 -9.9906 {"}-6.6595 6.5528 -9.9906 { ca ile A 84 1dpjA_101F_85S}-8.0082 5.0224 -6.8058 { ca ser A 85 1dpjA_101F_85S}-11.4254 3.2888 -6.8154 { ca gln A 86 1dpjA_101F_85S}-13.103 1.1151 -4.1486 { ca asp A 87 1dpjA_101F_85S}-14.988 -2.1346 -4.6059 { ca gln A 99 1dpjA_101F_85S}P -11.1007 -2.4376 -0.7531 {"}-11.1007 -2.4376 -0.7531 { ca asp A 100 1dpjA_101F_85S}-9.2294 0.6013 -2.2692 { ca phe A 101 1dpjA_101F_85S}-7.1544 -0.1781 -5.3678 { ca ala A 102 1dpjA_101F_85S}-5.9189 1.5734 -8.4963 { ca glu A 103 1dpjA_101F_85S}-7.5496 1.1449 -11.8782 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser A 85 1dpjA_101F_85S}P -11.4254 3.2888 -6.8154 { cb ser A 85 1dpjA_101F_85S}-11.8583 2.6278 -8.1105 { og ser A 85 1dpjA_101F_85S}-11.8177 3.6003 -9.176 { ca phe A 101 1dpjA_101F_85S}P -7.1544 -0.1781 -5.3678 { cb phe A 101 1dpjA_101F_85S}-7.5786 -1.5177 -5.9544 { cg phe A 101 1dpjA_101F_85S}-8.8994 -1.4719 -6.7073 { cd1 phe A 101 1dpjA_101F_85S}-8.9237 -1.3925 -8.1138 { ce1 phe A 101 1dpjA_101F_85S}-10.1395 -1.405 -8.8122 { cz phe A 101 1dpjA_101F_85S}-11.332 -1.4966 -8.092 { cg phe A 101 1dpjA_101F_85S}P -8.8994 -1.4719 -6.7073 { cd2 phe A 101 1dpjA_101F_85S}-10.1012 -1.5591 -6.0111 { ce2 phe A 101 1dpjA_101F_85S}-11.3087 -1.5778 -6.6763 { cz phe A 101 1dpjA_101F_85S}ghost -11.332 -1.4966 -8.092 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser A 85 1dpjA_101F_85S}P -11.8583 2.6278 -8.1105 {"}P -11.8583 2.6278 -8.1105 { og ser A 85 1dpjA_101F_85S}P -11.8177 3.6003 -9.176 { cb phe A 101 1dpjA_101F_85S}P -7.5786 -1.5177 -5.9544 {"}P -7.5786 -1.5177 -5.9544 { cd1 phe A 101 1dpjA_101F_85S}P -8.9237 -1.3925 -8.1138 { cd2 phe A 101 1dpjA_101F_85S}P -10.1012 -1.5591 -6.0111 { ce1 phe A 101 1dpjA_101F_85S}P -10.1395 -1.405 -8.8122 { ce2 phe A 101 1dpjA_101F_85S}P -11.3087 -1.5778 -6.6763 { cz phe A 101 1dpjA_101F_85S}P -11.332 -1.4966 -8.092 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 101 A}'S' blue -10.6765 0.2329 -8.5119 { CZ PHE 101 A}'S' blue -11.3992 0.2511 -8.0189 {"}'S' blue -11.5608 0.2337 -8.2238 {"}'S' blue -11.0634 0.2312 -8.0082 {"}'S' blue -11.2203 0.2455 -8.2157 {"}'S' blue -11.3824 0.2221 -8.4182 {"}'S' blue -11.0118 0.2023 -8.3668 {"}'S' blue -11.1735 0.1793 -8.5707 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 SER 85 A}'S' blue -11.5434 0.7 -8.0621 {"}'S' blue -11.541 0.6716 -8.4829 {"}'S' blue -11.3937 0.6299 -8.2806 {"}'S' blue -11.2382 0.6419 -8.0828 {"}'S' blue -11.2897 0.6381 -8.5796 {"}'S' blue -11.1373 0.6132 -8.3758 {"}'S' blue -10.9779 0.6436 -8.1786 {"}'S' blue -10.9738 0.658 -8.5863 {"}'S' blue -10.8156 0.6757 -8.3879 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 101 A}'M' greentint -9.1321 2.0861 -6.1576 {"}'M' greentint -8.8898 2.4817 -5.9544 {"}'M' greentint -9.0384 2.3248 -6.1028 {"}'M' greentint -9.1421 2.2285 -6.4003 {"}'M' greentint -9.1986 1.979 -6.4036 {"}'M' greentint -8.7405 2.7119 -6.0165 {"}'M' greentint -8.8991 2.6187 -6.1949 {"}'M' greentint -9.0384 2.4508 -6.3281 {"}'M' greentint -9.1117 2.3225 -6.6451 {"}'M' greentint -9.1829 2.0774 -6.6693 {"}'M' greentint -8.7138 2.8428 -6.2764 {"}'M' greentint -8.8685 2.7197 -6.441 {"}'M' greentint -9.0043 2.5421 -6.5672 {"}'M' greentint -9.0338 2.4027 -6.8834 {"}'M' greentint -9.115 2.1595 -6.9218 {"}'M' greentint -9.1624 1.9051 -6.9114 {"}'M' greentint -8.6329 2.9388 -6.5141 {"}'M' greentint -8.7851 2.8029 -6.6741 {"}'M' greentint -8.9218 2.6213 -6.7989 {"}'M' greentint -8.9193 2.4475 -7.113 {"}'M' greentint -9.0049 2.2126 -7.1576 {"}'M' greentint -8.5318 2.9851 -6.7608 {"}'M' greentint -8.6779 2.8415 -6.9107 {"}'M' greentint -8.8087 2.6595 -7.0291 {"}'M' greentint -8.7684 2.4692 -7.3218 {"}'M' greentint -8.5227 2.8652 -7.1158 {"}'M' greentint -8.6548 2.6823 -7.2358 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 85 A}'M' greentint -9.0618 2.1231 -6.0461 {"}'M' greentint -8.9412 2.3174 -5.9443 {"}'M' greentint -9.0891 1.8988 -6.4492 {"}'M' greentint -8.9389 2.0233 -6.2894 {"}'M' greentint -8.8057 2.1989 -6.1663 {"}'M' greentint -8.7005 2.4135 -6.0885 {"}'M' greentint -8.627 2.6533 -6.0616 {"}'M' greentint -9.0385 1.8963 -6.7828 {"}'M' greentint -8.8779 1.9723 -6.5959 {"}'M' greentint -8.7283 2.1177 -6.4435 {"}'M' greentint -8.6038 2.3176 -6.3377 {"}'M' greentint -8.5152 2.5552 -6.2896 {"}'M' greentint -8.4707 2.8099 -6.3023 {"}'M' greentint -8.9448 2.0072 -7.0355 {"}'M' greentint -8.7825 2.0521 -6.8375 {"}'M' greentint -8.6283 2.1847 -6.6758 {"}'M' greentint -8.504 2.388 -6.5712 {"}'M' greentint -8.4258 2.6337 -6.539 {"}'M' greentint -8.4048 2.8891 -6.5824 {"}'M' greentint -8.8338 2.1906 -7.2059 {"}'M' greentint -8.6728 2.2187 -7.0059 {"}'M' greentint -8.5248 2.3706 -6.8571 {"}'M' greentint -8.43 2.6048 -6.7997 {"}'M' greentint -8.4137 2.8584 -6.849 {"}'M' greentint -8.7003 2.4085 -7.2594 {"}'M' greentint -8.5404 2.5054 -7.08 {"}'M' greentint -8.4854 2.7587 -7.0798 {"}'M' greentint -8.6187 2.655 -7.2793 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 101 A}'M' greentint -9.6504 1.097 -4.4103 {"}'M' greentint -9.5955 1.3503 -4.4101 {"}'M' greentint -9.7059 1.2509 -4.6903 {"}'M' greentint -9.7221 0.9972 -4.641 {"}'M' greentint -9.463 1.637 -4.4841 {"}'M' greentint -9.6111 1.485 -4.633 {"}'M' greentint -9.6776 1.3483 -4.9439 {"}'M' greentint -9.728 1.0937 -4.9393 {"}'M' greentint -9.7193 0.8458 -4.8589 {"}'M' greentint -9.4327 1.747 -4.7396 {"}'M' greentint -9.5741 1.5764 -4.8751 {"}'M' greentint -9.5807 1.4226 -5.1839 {"}'M' greentint -9.649 1.1736 -5.2016 {"}'M' greentint -9.6695 0.9204 -5.1582 {"}'M' greentint -9.3347 1.8184 -4.9755 {"}'M' greentint -9.4732 1.6436 -5.1063 {"}'M' greentint -9.4353 1.4421 -5.4015 {"}'M' greentint -9.5088 1.2023 -5.4284 {"}'M' greentint -9.5418 0.9532 -5.403 {"}'M' greentint -9.3301 1.6568 -5.3238 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 85 A}'M' green -9.7001 0.9302 -4.4281 {"}'M' green -9.3824 1.1708 -5.6141 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 85 A}'M' greentint -9.5992 1.1553 -4.3604 {"}'M' greentint -9.5231 1.3984 -4.3307 {"}'M' greentint -9.6753 0.741 -4.744 {"}'M' greentint -9.5533 0.9376 -4.641 {"}'M' greentint -9.455 1.1624 -4.575 {"}'M' greentint -9.3823 1.4034 -4.5495 {"}'M' greentint -9.3405 1.6535 -4.5648 {"}'M' greentint -9.5568 0.7904 -4.9677 {"}'M' greentint -9.4322 0.9928 -4.8641 {"}'M' greentint -9.3358 1.2259 -4.8042 {"}'M' greentint -9.272 1.4776 -4.7916 {"}'M' greentint -9.2447 1.7324 -4.8262 {"}'M' greentint -9.4827 0.8587 -5.2083 {"}'M' greentint -9.3589 1.0585 -5.1036 {"}'M' greentint -9.2671 1.2926 -5.0503 {"}'M' greentint -9.2151 1.5435 -5.0519 {"}'M' greentint -9.2052 1.7937 -5.1092 {"}'M' greentint -9.3753 1.0575 -5.3821 {"}'M' greentint -9.2724 1.281 -5.3112 {"}'M' greentint -9.218 1.5307 -5.3109 {"}'M' greentint -9.2871 1.4071 -5.5566 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n pro A 5 1dpjA_15Y_7T}P -5.9434 8.2276 -8.7806 {"}-5.9434 8.2276 -8.7806 { ca pro A 5 1dpjA_15Y_7T}-7.213 8.0503 -8.0797 { c pro A 5 1dpjA_15Y_7T}-7.4229 6.6373 -7.5126 { o pro A 5 1dpjA_15Y_7T}-6.965 5.658 -8.0884 { c pro A 5 1dpjA_15Y_7T}P -7.4229 6.6373 -7.5126 { n leu A 6 1dpjA_15Y_7T}-8.0966 6.565 -6.3816 { ca leu A 6 1dpjA_15Y_7T}-8.4128 5.2747 -5.764 { c leu A 6 1dpjA_15Y_7T}-9.9111 5.0467 -5.8134 { o leu A 6 1dpjA_15Y_7T}-10.7138 5.9632 -5.6227 { c leu A 6 1dpjA_15Y_7T}P -9.9111 5.0467 -5.8134 { n thr A 7 1dpjA_15Y_7T}-10.2998 3.7928 -6.0704 { ca thr A 7 1dpjA_15Y_7T}-11.7018 3.432 -6.0758 { c thr A 7 1dpjA_15Y_7T}-11.9272 2.7588 -4.7264 { o thr A 7 1dpjA_15Y_7T}-11.1623 1.8898 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{HG21 THR 7 A}'S' P -13.0497 0.1376 -7.7863 {"}'S' -13.0516 0.1426 -7.7866 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 15 A}'M' greentint -9.3219 2.3886 -5.9188 {"}'M' greentint -9.4808 2.2999 -6.1004 {"}'M' greentint -9.6244 2.1922 -6.3728 {"}'M' greentint -9.0845 2.5214 -5.7665 {"}'M' greentint -9.2189 2.6212 -5.9677 {"}'M' greentint -9.3821 2.5878 -6.1696 {"}'M' greentint -9.5307 2.4309 -6.3181 {"}'M' greentint -9.6344 2.3345 -6.6156 {"}'M' greentint -8.9371 2.747 -5.8301 {"}'M' greentint -9.0749 2.8263 -6.0297 {"}'M' greentint -9.2329 2.8179 -6.2318 {"}'M' greentint -9.3915 2.7248 -6.4102 {"}'M' greentint -9.5307 2.5568 -6.5433 {"}'M' greentint -9.604 2.4286 -6.8604 {"}'M' greentint -8.8898 2.9964 -6.0957 {"}'M' greentint -9.0459 3.0071 -6.2996 {"}'M' greentint -9.2061 2.9488 -6.4916 {"}'M' greentint -9.3609 2.8258 -6.6563 {"}'M' greentint -9.4966 2.6482 -6.7824 {"}'M' greentint -9.5262 2.5088 -7.0986 {"}'M' greentint -8.8027 3.1505 -6.3417 {"}'M' greentint -8.9631 3.127 -6.5437 {"}'M' greentint -9.1252 3.0449 -6.7294 {"}'M' greentint -9.2775 2.9089 -6.8893 {"}'M' greentint -9.4141 2.7273 -7.0141 {"}'M' greentint -8.8683 3.1899 -6.8027 {"}'M' greentint -9.0241 3.0911 -6.976 {"}'M' greentint -9.1703 2.9476 -7.1259 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 7 A}'M' greentint -9.5221 2.0506 -6.2298 {"}'M' greentint -9.3639 2.1143 -6.0435 {"}'M' greentint -9.2137 2.2388 -5.8837 {"}'M' greentint -9.0806 2.4144 -5.7606 {"}'M' greentint -9.6129 2.1826 -6.7839 {"}'M' greentint -9.4716 2.1096 -6.5808 {"}'M' greentint -9.3134 2.1118 -6.3771 {"}'M' greentint -9.1527 2.1878 -6.1902 {"}'M' greentint -9.0032 2.3332 -6.0378 {"}'M' greentint -8.8786 2.5331 -5.932 {"}'M' greentint -8.79 2.7707 -5.884 {"}'M' greentint -9.4845 2.4093 -7.0241 {"}'M' greentint -9.3684 2.2723 -6.8359 {"}'M' greentint -9.2197 2.2227 -6.6298 {"}'M' greentint -9.0573 2.2676 -6.4318 {"}'M' greentint -8.9031 2.4002 -6.2701 {"}'M' greentint -8.7789 2.6035 -6.1655 {"}'M' greentint -8.7006 2.8492 -6.1334 {"}'M' greentint -8.6796 3.1046 -6.1767 {"}'M' greentint -9.3071 2.7132 -7.1414 {"}'M' greentint -9.2404 2.5079 -6.9984 {"}'M' greentint -9.1087 2.4062 -6.8002 {"}'M' greentint -8.9477 2.4342 -6.6002 {"}'M' greentint -8.7996 2.5862 -6.4514 {"}'M' greentint -8.7048 2.8203 -6.394 {"}'M' greentint -8.6885 3.074 -6.4434 {"}'M' greentint -9.0794 2.7792 -7.0316 {"}'M' greentint -8.9752 2.624 -6.8537 {"}'M' greentint -8.8152 2.7209 -6.6743 {"}'M' greentint -8.7603 2.9742 -6.6741 {"}'M' greentint -8.8645 3.1294 -6.8519 {"}'M' greentint -9.0244 3.0325 -7.0314 {"}'M' greentint -8.8935 2.8706 -6.8736 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 15 A}'M' green -10.5612 0.6799 -4.7875 {"}'M' green -9.8177 1.4228 -4.2963 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 15 A}'M' greentint -10.3562 0.8833 -4.3572 {"}'M' greentint -10.4895 0.7797 -4.5567 {"}'M' greentint -10.1703 0.9747 -4.1992 {"}'M' greentint -10.2745 1.1299 -4.3771 {"}'M' greentint -10.4345 1.033 -4.5565 {"}'M' greentint -10.5449 0.9336 -4.8368 {"}'M' greentint -10.0093 1.246 -4.2324 {"}'M' greentint -10.141 1.3477 -4.4306 {"}'M' greentint -10.302 1.3197 -4.6306 {"}'M' greentint -10.4501 1.1677 -4.7794 {"}'M' greentint -10.5166 1.0311 -5.0904 {"}'M' greentint -9.9526 1.5176 -4.4972 {"}'M' greentint -10.1115 1.5208 -4.7031 {"}'M' greentint -10.2718 1.4297 -4.886 {"}'M' greentint -10.4132 1.2592 -5.0216 {"}'M' greentint -9.8558 1.6523 -4.7527 {"}'M' greentint -10.0171 1.6131 -4.9506 {"}'M' greentint -10.1737 1.5011 -5.122 {"}'M' greentint -10.3123 1.3264 -5.2527 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O THR 7 A}'M' green -10.5841 0.6519 -4.6722 {"}'M' green -10.1183 0.9796 -4.1617 {"}'M' green -9.8285 1.4819 -4.2443 {"}'M' green -10.5295 1.0461 -5.2874 {"}'M' green -10.3897 1.2807 -5.3618 @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 7 A}'M' greentint -10.4215 0.7076 -4.4781 {"}'M' greentint -10.2637 0.8179 -4.3046 {"}'M' greentint -10.5097 0.7873 -4.9313 {"}'M' greentint -10.3505 0.8098 -4.7308 {"}'M' greentint -10.1908 0.8984 -4.5498 {"}'M' greentint -10.0441 1.0479 -4.4023 {"}'M' greentint -9.9204 1.2477 -4.2976 {"}'M' greentint -10.3911 0.9693 -5.0858 {"}'M' greentint -10.2323 0.9803 -4.8849 {"}'M' greentint -10.0752 1.0762 -4.7076 {"}'M' greentint -9.9368 1.2467 -4.5761 {"}'M' greentint -9.8338 1.4702 -4.5052 {"}'M' greentint -10.2568 1.1771 -5.1616 {"}'M' greentint -10.0936 1.2063 -4.959 {"}'M' greentint -9.9439 1.3601 -4.8081 {"}'M' greentint -9.8486 1.5964 -4.7506 {"}'M' greentint -10.1441 1.4069 -5.1968 {"}'M' greentint -9.9854 1.5043 -5.0192 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 59 1ep0A_122F_61R}P -7.9338 5.5735 -12.4487 {"}-7.9338 5.5735 -12.4487 { ca val A 59 1ep0A_122F_61R}-9.054 5.5924 -11.5249 { c val A 59 1ep0A_122F_61R}-8.6494 4.8929 -10.2295 { o val A 59 1ep0A_122F_61R}-8.0306 3.8157 -10.2162 { c val A 59 1ep0A_122F_61R}P -8.6494 4.8929 -10.2295 { n leu A 60 1ep0A_122F_61R}-8.9917 5.5326 -9.1124 { ca leu A 60 1ep0A_122F_61R}-8.7634 4.8974 -7.8129 { c leu A 60 1ep0A_122F_61R}-10.1085 4.8912 -7.1361 { o leu A 60 1ep0A_122F_61R}-10.7122 5.9417 -6.9263 { c leu A 60 1ep0A_122F_61R}P -10.1085 4.8912 -7.1361 { n arg A 61 1ep0A_122F_61R}-10.5735 3.6899 -6.7832 { ca arg A 61 1ep0A_122F_61R}-11.8406 3.5457 -6.0897 { c arg A 61 1ep0A_122F_61R}-11.5847 3.064 -4.6782 { o arg A 61 1ep0A_122F_61R}-10.8689 2.0894 -4.5147 { c arg A 61 1ep0A_122F_61R}P -11.5847 3.064 -4.6782 { n gly A 62 1ep0A_122F_61R}-12.1336 3.7177 -3.6672 { ca gly A 62 1ep0A_122F_61R}-11.9173 3.251 -2.308 { c gly A 62 1ep0A_122F_61R}-11.6185 4.3992 -1.3739 { o gly A 62 1ep0A_122F_61R}-11.7739 5.5593 -1.7691 { c gly A 62 1ep0A_122F_61R}P -11.6185 4.3992 -1.3739 { n leu A 63 1ep0A_122F_61R}-11.2452 4.1167 -0.1243 { ca leu A 63 1ep0A_122F_61R}-11.1226 2.7648 0.4783 { c leu A 63 1ep0A_122F_61R}-12.4383 2.5185 1.2142 { o leu A 63 1ep0A_122F_61R}-12.7279 3.157 2.2225 { n his A 120 1ep0A_122F_61R}P -11.2459 -1.6492 1.4677 {"}-11.2459 -1.6492 1.4677 { ca his A 120 1ep0A_122F_61R}-10.7358 -2.1052 0.1791 { c his A 120 1ep0A_122F_61R}-10.7338 -1.0155 -0.8632 { o his A 120 1ep0A_122F_61R}-11.6634 -0.213 -0.9225 { c his A 120 1ep0A_122F_61R}P -10.7338 -1.0155 -0.8632 { n gly A 121 1ep0A_122F_61R}-9.6797 -0.9647 -1.6642 { ca gly A 121 1ep0A_122F_61R}-9.673 -0.0148 -2.7673 { c gly A 121 1ep0A_122F_61R}-8.6676 -0.5211 -3.7896 { o gly A 121 1ep0A_122F_61R}-7.9188 -1.4688 -3.558 { c gly A 121 1ep0A_122F_61R}P -8.6676 -0.5211 -3.7896 { n phe A 122 1ep0A_122F_61R}-8.6851 0.0774 -4.9805 { ca phe A 122 1ep0A_122F_61R}-7.7334 -0.251 -6.0177 { c phe A 122 1ep0A_122F_61R}-7.4638 0.9301 -6.9237 { o phe A 122 1ep0A_122F_61R}-8.269 1.8867 -7.0172 { c phe A 122 1ep0A_122F_61R}P -7.4638 0.9301 -6.9237 { n leu A 123 1ep0A_122F_61R}-6.3088 0.825 -7.5819 { ca leu A 123 1ep0A_122F_61R}-5.8927 1.8 -8.5925 { c leu A 123 1ep0A_122F_61R}-5.8084 1.0668 -9.9316 { o leu A 123 1ep0A_122F_61R}-5.1566 0.0107 -10.0454 { c leu A 123 1ep0A_122F_61R}P -5.8084 1.0668 -9.9316 { n ala A 124 1ep0A_122F_61R}-6.4936 1.621 -10.9485 { ca ala A 124 1ep0A_122F_61R}-6.5032 1.0165 -12.2915 { c ala A 124 1ep0A_122F_61R}-5.1876 1.3607 -12.9969 { o ala A 124 1ep0A_122F_61R}-4.8617 2.5597 -13.1891 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 59 1ep0A_122F_61R}P -7.9338 5.5735 -12.4487 { ca val A 59 1ep0A_122F_61R}P -9.054 5.5924 -11.5249 { n leu A 60 1ep0A_122F_61R}P -8.9917 5.5326 -9.1124 { ca leu A 60 1ep0A_122F_61R}P -8.7634 4.8974 -7.8129 { n arg A 61 1ep0A_122F_61R}P -10.5735 3.6899 -6.7832 { ca arg A 61 1ep0A_122F_61R}P -11.8406 3.5457 -6.0897 { n gly A 62 1ep0A_122F_61R}P -12.1336 3.7177 -3.6672 { ca gly A 62 1ep0A_122F_61R}P -11.9173 3.251 -2.308 {"}P -11.9173 3.251 -2.308 { n leu A 63 1ep0A_122F_61R}P -11.2452 4.1167 -0.1243 { ca leu A 63 1ep0A_122F_61R}P -11.1226 2.7648 0.4783 { n his A 120 1ep0A_122F_61R}P -11.2459 -1.6492 1.4677 { ca his A 120 1ep0A_122F_61R}P -10.7358 -2.1052 0.1791 { n gly A 121 1ep0A_122F_61R}P -9.6797 -0.9647 -1.6642 { ca gly A 121 1ep0A_122F_61R}P -9.673 -0.0148 -2.7673 {"}P -9.673 -0.0148 -2.7673 { n phe A 122 1ep0A_122F_61R}P -8.6851 0.0774 -4.9805 { ca phe A 122 1ep0A_122F_61R}P -7.7334 -0.251 -6.0177 { n leu A 123 1ep0A_122F_61R}P -6.3088 0.825 -7.5819 { ca leu A 123 1ep0A_122F_61R}P -5.8927 1.8 -8.5925 { n ala A 124 1ep0A_122F_61R}P -6.4936 1.621 -10.9485 { ca ala A 124 1ep0A_122F_61R}P -6.5032 1.0165 -12.2915 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 59 1ep0A_122F_61R}P -9.054 5.5924 -11.5249 {"}-9.054 5.5924 -11.5249 { ca leu A 60 1ep0A_122F_61R}-8.7634 4.8974 -7.8129 { ca arg A 61 1ep0A_122F_61R}-11.8406 3.5457 -6.0897 { ca gly A 62 1ep0A_122F_61R}-11.9173 3.251 -2.308 { ca leu A 63 1ep0A_122F_61R}-11.1226 2.7648 0.4783 { ca his A 120 1ep0A_122F_61R}-10.7358 -2.1052 0.1791 { ca gly A 121 1ep0A_122F_61R}-9.673 -0.0148 -2.7673 { ca phe A 122 1ep0A_122F_61R}-7.7334 -0.251 -6.0177 { ca leu A 123 1ep0A_122F_61R}-5.8927 1.8 -8.5925 { ca ala A 124 1ep0A_122F_61R}-6.5032 1.0165 -12.2915 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 61 1ep0A_122F_61R}P -11.8406 3.5457 -6.0897 { cb arg A 61 1ep0A_122F_61R}-12.7109 2.5025 -6.7917 { cg arg A 61 1ep0A_122F_61R}-13.0697 2.8867 -8.2207 { cd arg A 61 1ep0A_122F_61R}-13.9966 1.857 -8.8373 { ne arg A 61 1ep0A_122F_61R}-14.2044 2.0184 -10.2793 { cz arg A 61 1ep0A_122F_61R}-15.3096 2.5266 -10.819 { nh1 arg A 61 1ep0A_122F_61R}-16.3062 2.9222 -10.0465 { cz arg A 61 1ep0A_122F_61R}P -15.3096 2.5266 -10.819 { nh2 arg A 61 1ep0A_122F_61R}-15.4014 2.6293 -12.135 { ca phe A 122 1ep0A_122F_61R}P -7.7334 -0.251 -6.0177 { cb phe A 122 1ep0A_122F_61R}-8.1671 -1.5021 -6.8393 { cg phe A 122 1ep0A_122F_61R}-9.37 -1.2836 -7.6891 { cd1 phe A 122 1ep0A_122F_61R}-9.2412 -0.7216 -8.9555 { ce1 phe A 122 1ep0A_122F_61R}-10.3409 -0.5736 -9.7779 { cz phe A 122 1ep0A_122F_61R}-11.5905 -0.9783 -9.348 { cg phe A 122 1ep0A_122F_61R}P -9.37 -1.2836 -7.6891 { cd2 phe A 122 1ep0A_122F_61R}-10.5995 -1.6816 -7.2434 { ce2 phe A 122 1ep0A_122F_61R}-11.7383 -1.5391 -8.0549 { cz phe A 122 1ep0A_122F_61R}ghost -11.5905 -0.9783 -9.348 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 61 1ep0A_122F_61R}P -12.7109 2.5025 -6.7917 {"}P -12.7109 2.5025 -6.7917 { cg arg A 61 1ep0A_122F_61R}P -13.0697 2.8867 -8.2207 {"}P -13.0697 2.8867 -8.2207 { cd arg A 61 1ep0A_122F_61R}P -13.9966 1.857 -8.8373 {"}P -13.9966 1.857 -8.8373 { ne arg A 61 1ep0A_122F_61R}P -14.2044 2.0184 -10.2793 { nh1 arg A 61 1ep0A_122F_61R}P -16.3062 2.9222 -10.0465 {"}P -16.3062 2.9222 -10.0465 { nh2 arg A 61 1ep0A_122F_61R}P -15.4014 2.6293 -12.135 {"}P -15.4014 2.6293 -12.135 { cb phe A 122 1ep0A_122F_61R}P -8.1671 -1.5021 -6.8393 {"}P -8.1671 -1.5021 -6.8393 { cd1 phe A 122 1ep0A_122F_61R}P -9.2412 -0.7216 -8.9555 { cd2 phe A 122 1ep0A_122F_61R}P -10.5995 -1.6816 -7.2434 { ce1 phe A 122 1ep0A_122F_61R}P -10.3409 -0.5736 -9.7779 { ce2 phe A 122 1ep0A_122F_61R}P -11.7383 -1.5391 -8.0549 { cz phe A 122 1ep0A_122F_61R}P -11.5905 -0.9783 -9.348 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 122 A}'S' blue -12.9302 -0.2797 -7.82 {"}'S' blue -13.0808 -0.4191 -7.9753 {"}'S' sky -12.6999 -0.0856 -7.893 {"}'S' sky -13.1412 -0.5329 -8.3395 {"}'S' blue -11.9714 0.0435 -7.3454 {"}'S' blue -12.1193 0.0933 -7.5504 {"}'S' blue -12.4356 0.0627 -7.9518 {"}'S' blue -11.6983 0.0811 -7.3943 {"}'S' blue -11.8407 0.147 -7.5972 { CZ PHE 122 A}'S' sky -13.2295 -0.4799 -8.9916 {"}'S' sky -12.6037 0.4264 -9.5975 { HZ PHE 122 A}'S' blue -13.1903 -0.2609 -9.675 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 122 A}'S' sea -12.8585 -0.1946 -8.0678 {"}'S' sea -13.0078 -0.3462 -8.2185 {"}'S' sea -12.5963 -0.0158 -8.1365 {"}'S' sea -12.7514 -0.1344 -8.3043 { CZ PHE 122 A}'S' green -12.951 -0.2271 -8.5439 {"}'S' sea -13.103 -0.3872 -8.6947 {"}'S' green -12.6531 0.027 -8.3879 {"}'S' green -13.1226 -0.2507 -8.9166 {"}'S' sea -13.2248 -0.3624 -9.2342 {"}'S' green -12.5082 0.2277 -8.4733 {"}'S' green -13.1165 -0.1426 -9.1552 {"}'S' sea -12.3083 0.3919 -8.5298 {"}'S' green -12.4626 0.4096 -8.7344 {"}'S' green -13.0673 -0.041 -9.3913 {"}'S' sea -12.2283 0.5528 -8.7903 {"}'S' green -12.3893 0.5378 -8.9933 {"}'S' green -12.5521 0.4752 -9.1861 {"}'S' green -12.7108 0.3662 -9.361 {"}'S' green -12.8601 0.2146 -9.5116 {"}'S' sea -12.9935 0.0279 -9.6326 {"}'S' sea -12.4486 0.545 -9.4296 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 122 A}'S' P -12.8161 0.0192 -8.5952 {"}'S' -12.8043 0.0102 -8.6027 {"}'S' P -12.9794 -0.0771 -8.7794 {"}'S' -12.9588 -0.0907 -8.7874 {"}'S' P -12.6659 0.2276 -8.6768 {"}'S' -12.6492 0.2086 -8.6873 {"}'S' P -12.8267 0.1634 -8.8665 {"}'S' -12.7842 0.1244 -8.8833 {"}'S' P -12.9799 0.0362 -9.0298 {"}'S' -12.9482 0.0122 -9.0374 {"}'S' P -12.6239 0.3718 -8.9326 {"}'S' -12.6072 0.3507 -8.939 {"}'S' P -12.7825 0.2811 -9.1132 {"}'S' -12.7562 0.2527 -9.1186 {"}'S' P -12.9331 0.1417 -9.2684 {"}'S' -12.9256 0.135 -9.2686 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD ARG 61 A}'S' blue -12.7655 0.8614 -9.583 {"}'S' blue -12.6029 0.9603 -9.4005 { HB2 ARG 61 A}'S' blue -12.1066 0.4585 -7.2421 {"}'S' blue -11.9593 0.4155 -7.0396 {"}'S' blue -11.8628 0.5395 -7.3171 { HD2 ARG 61 A}'S' blue -13.3181 -0.1056 -8.0328 {"}'S' blue -13.1786 0.0551 -7.8959 {"}'S' blue -13.3694 -0.2844 -8.4808 {"}'S' sky -13.2114 -0.1987 -8.2998 {"}'S' sky -12.9272 0.1171 -8.021 {"}'S' sky -12.8584 0.5637 -9.5156 @dotlist {x} color= white width= 1 master= {vdw contact} { HD2 ARG 61 A}'S' sea -13.0613 -0.0629 -8.1444 {"}'S' sea -13.3653 -0.2701 -8.8885 {"}'S' green -13.2071 -0.2523 -8.69 {"}'S' green -13.0494 -0.1763 -8.5072 {"}'S' green -12.899 -0.0449 -8.3487 {"}'S' sea -12.7662 0.1341 -8.2268 {"}'S' green -13.2689 -0.146 -9.1661 {"}'S' green -13.1131 -0.1703 -8.9579 {"}'S' green -12.6535 0.174 -8.4596 {"}'S' sea -12.5435 0.3966 -8.3806 {"}'S' green -13.1666 0.0617 -9.4002 {"}'S' green -12.4783 0.4821 -8.6271 {"}'S' sea -13.0118 0.2846 -9.4923 {"}'S' green -12.4684 0.6014 -8.8784 {"}'S' green -12.7534 0.4073 -9.3364 {"}'S' green -12.593 0.505 -9.1565 {"}'S' sea -12.5379 0.76 -9.1549 {"}'S' sea -12.6752 0.6567 -9.3531 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HD2 ARG 61 A}'S' P -12.9498 -0.1213 -8.7613 {"}'S' -12.9607 -0.1048 -8.7594 {"}'S' P -12.7926 -0.0029 -8.5905 {"}'S' -12.8017 0.0065 -8.5915 {"}'S' P -13.0295 -0.0134 -9.2007 {"}'S' -13.0322 -0.0093 -9.1985 {"}'S' P -12.8732 -0.0026 -9.0015 {"}'S' -12.9039 0.0349 -8.9871 {"}'S' P -12.717 0.0928 -8.8269 {"}'S' -12.7581 0.1288 -8.8179 {"}'S' P -12.5799 0.261 -8.6967 {"}'S' -12.5951 0.2703 -8.6957 {"}'S' P -12.8784 0.1818 -9.2916 {"}'S' -12.883 0.1857 -9.2869 {"}'S' P -12.7148 0.2104 -9.0883 {"}'S' -12.7499 0.2357 -9.0703 {"}'S' P -12.5642 0.3643 -8.9364 {"}'S' -12.5826 0.3731 -8.931 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 122 A}'M' green -9.4411 2.2791 -6.3609 {"}'M' green -9.1931 2.7971 -6.4922 {"}'M' green -9.666 1.9089 -7.1135 {"}'M' green -9.615 1.9904 -7.3871 {"}'M' green -9.0855 3.0241 -6.9899 {"}'M' green -9.3719 2.5327 -7.5888 {"}'M' green -9.4575 2.2979 -7.6333 {"}'M' green -9.1305 2.9268 -7.3864 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 122 A}'M' greentint -9.5847 2.1714 -6.6333 {"}'M' greentint -9.3424 2.567 -6.4301 {"}'M' greentint -9.491 2.4101 -6.5786 {"}'M' greentint -9.5947 2.3137 -6.8761 {"}'M' greentint -9.6512 2.0642 -6.8793 {"}'M' greentint -9.3517 2.704 -6.6707 {"}'M' greentint -9.491 2.536 -6.8038 {"}'M' greentint -9.5643 2.4078 -7.1209 {"}'M' greentint -9.6355 2.1626 -7.1451 {"}'M' greentint -9.1664 2.928 -6.7521 {"}'M' greentint -9.3211 2.8049 -6.9168 {"}'M' greentint -9.4569 2.6274 -7.0429 {"}'M' greentint -9.4864 2.488 -7.3591 {"}'M' greentint -9.5676 2.2448 -7.3975 {"}'M' greentint -9.2377 2.8881 -7.1498 {"}'M' greentint -9.3744 2.7065 -7.2746 {"}'M' greentint -9.2613 2.7448 -7.5048 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ARG 61 A}'M' green -9.4004 2.4197 -6.3767 {"}'M' green -9.6447 2.0133 -7.3236 {"}'M' green -9.3186 2.6612 -7.5674 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 61 A}'M' greentint -9.5057 2.205 -6.4544 {"}'M' greentint -9.5778 1.9784 -6.884 {"}'M' greentint -9.4282 2.1238 -6.7317 {"}'M' greentint -9.3037 2.3238 -6.6258 {"}'M' greentint -9.2151 2.5614 -6.5778 {"}'M' greentint -9.1706 2.8161 -6.5905 {"}'M' greentint -9.4824 2.0582 -7.1256 {"}'M' greentint -9.3282 2.1908 -6.9639 {"}'M' greentint -9.2039 2.3941 -6.8593 {"}'M' greentint -9.1257 2.6398 -6.8272 {"}'M' greentint -9.1047 2.8952 -6.8705 {"}'M' greentint -9.5337 2.1968 -7.494 {"}'M' greentint -9.3727 2.2248 -7.294 {"}'M' greentint -9.2247 2.3768 -7.1452 {"}'M' greentint -9.1299 2.6109 -7.0879 {"}'M' greentint -9.1136 2.8646 -7.1372 {"}'M' greentint -9.4003 2.4146 -7.5476 {"}'M' greentint -9.2403 2.5115 -7.3681 {"}'M' greentint -9.1853 2.7648 -7.3679 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 122 A}'M' green -10.258 0.8475 -4.8334 {"}'M' green -9.9389 1.0425 -4.4759 {"}'M' green -10.2851 1.0988 -5.3671 {"}'M' green -9.5863 1.4906 -4.573 {"}'M' green -9.4726 1.6846 -4.8243 {"}'M' green -10.0808 1.3942 -5.5294 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 122 A}'M' greentint -10.1247 0.9511 -4.6339 {"}'M' greentint -10.0431 1.1977 -4.6538 {"}'M' greentint -10.203 1.1008 -4.8332 {"}'M' greentint -10.3134 1.0014 -5.1135 {"}'M' greentint -9.7778 1.3138 -4.5091 {"}'M' greentint -9.9096 1.4155 -4.7073 {"}'M' greentint -10.0706 1.3875 -4.9073 {"}'M' greentint -10.2186 1.2355 -5.0561 {"}'M' greentint -9.7212 1.5854 -4.7739 {"}'M' greentint -9.88 1.5886 -4.9798 {"}'M' greentint -10.0403 1.4975 -5.1627 {"}'M' greentint -10.1817 1.327 -5.2983 {"}'M' greentint -9.6243 1.7201 -5.0294 {"}'M' greentint -9.7856 1.6809 -5.2273 {"}'M' greentint -9.9422 1.5689 -5.3987 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 61 A}'M' green -10.4479 0.8561 -5.0265 {"}'M' green -10.2907 0.8515 -4.8209 {"}'M' green -10.1281 0.9072 -4.6267 {"}'M' green -9.9702 1.0175 -4.4533 {"}'M' green -9.8249 1.1792 -4.3103 {"}'M' green -10.3643 1.0339 -5.2845 {"}'M' green -9.627 1.4473 -4.4462 {"}'M' green -10.236 1.2457 -5.436 {"}'M' green -9.5404 1.6698 -4.6538 {"}'M' green -10.0963 1.4803 -5.5105 {"}'M' green -9.5552 1.7959 -4.8993 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 61 A}'M' greentint -10.2163 0.9869 -5.08 {"}'M' greentint -10.0571 1.0094 -4.8795 {"}'M' greentint -9.8974 1.0979 -4.6985 {"}'M' greentint -9.7507 1.2475 -4.5509 {"}'M' greentint -10.0977 1.1688 -5.2345 {"}'M' greentint -9.9389 1.1799 -5.0336 {"}'M' greentint -9.7818 1.2757 -4.8562 {"}'M' greentint -9.6434 1.4463 -4.7247 {"}'M' greentint -9.9634 1.3767 -5.3102 {"}'M' greentint -9.8002 1.4059 -5.1076 {"}'M' greentint -9.6505 1.5596 -4.9568 {"}'M' greentint -9.8507 1.6065 -5.3455 {"}'M' greentint -9.692 1.7038 -5.1678 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 105 1ex2A_118F_107}P -7.0102 5.8799 -12.0798 {"}-7.0102 5.8799 -12.0798 { ca thr A 105 1ex2A_118F_107}-8.2207 6.0429 -11.3023 { c thr A 105 1ex2A_118F_107}-8.2577 5.0387 -10.1563 { o thr A 105 1ex2A_118F_107}-8.0568 3.8406 -10.3518 { c thr A 105 1ex2A_118F_107}P -8.2577 5.0387 -10.1563 { n ala A 106 1ex2A_118F_107}-8.489 5.5476 -8.9602 { ca ala A 106 1ex2A_118F_107}-8.586 4.707 -7.7798 { c ala A 106 1ex2A_118F_107}-10.027 4.7031 -7.3117 { o ala A 106 1ex2A_118F_107}-10.7561 5.689 -7.4823 { c ala A 106 1ex2A_118F_107}P -10.027 4.7031 -7.3117 { n val A 107 1ex2A_118F_107}-10.4187 3.59 -6.713 { ca val A 107 1ex2A_118F_107}-11.7555 3.435 -6.1636 { c val A 107 1ex2A_118F_107}-11.5732 2.8992 -4.7446 { o val A 107 1ex2A_118F_107}-10.7593 1.991 -4.527 { c val A 107 1ex2A_118F_107}P -11.5732 2.8992 -4.7446 { n ser A 108 1ex2A_118F_107}-12.2947 3.4694 -3.7794 { ca ser A 108 1ex2A_118F_107}-12.2275 2.9539 -2.4232 { c ser A 108 1ex2A_118F_107}-13.6675 2.634 -2.008 { o ser A 108 1ex2A_118F_107}-14.5841 3.4417 -2.2285 { c ser A 108 1ex2A_118F_107}P -13.6675 2.634 -2.008 { n ile A 109 1ex2A_118F_107}-13.8751 1.4538 -1.4277 { ca ile A 109 1ex2A_118F_107}-15.2109 1.0385 -0.9987 { c ile A 109 1ex2A_118F_107}-15.1069 0.804 0.494 { o ile A 109 1ex2A_118F_107}-14.2991 -0.0159 0.9273 { n glu A 116 1ex2A_118F_107}P -12.0153 -1.8011 0.8386 {"}-12.0153 -1.8011 0.8386 { ca glu A 116 1ex2A_118F_107}-11.1978 -2.2247 -0.2696 { c glu A 116 1ex2A_118F_107}-10.8725 -1.0143 -1.1334 { o glu A 116 1ex2A_118F_107}-11.7492 -0.2113 -1.4264 { c glu A 116 1ex2A_118F_107}P -10.8725 -1.0143 -1.1334 { n thr A 117 1ex2A_118F_107}-9.5991 -0.8821 -1.5045 { ca thr A 117 1ex2A_118F_107}-9.1341 0.2285 -2.334 { c thr A 117 1ex2A_118F_107}-8.1895 -0.3013 -3.4136 { o thr A 117 1ex2A_118F_107}-7.3642 -1.1791 -3.1515 { c thr A 117 1ex2A_118F_107}P -8.1895 -0.3013 -3.4136 { n phe A 118 1ex2A_118F_107}-8.3059 0.2163 -4.6289 { ca phe A 118 1ex2A_118F_107}-7.4092 -0.2122 -5.698 { c phe A 118 1ex2A_118F_107}-7.322 0.8879 -6.7288 { o phe A 118 1ex2A_118F_107}-8.1078 1.8263 -6.6943 { c phe A 118 1ex2A_118F_107}P -7.322 0.8879 -6.7288 { n tyr A 119 1ex2A_118F_107}-6.3373 0.8008 -7.6153 { ca tyr A 119 1ex2A_118F_107}-6.2638 1.7583 -8.7176 { c tyr A 119 1ex2A_118F_107}-6.2198 0.9489 -9.9936 { o tyr A 119 1ex2A_118F_107}-5.8947 -0.2408 -9.992 { c tyr A 119 1ex2A_118F_107}P -6.2198 0.9489 -9.9936 { n asp A 120 1ex2A_118F_107}-6.5819 1.6099 -11.082 { ca asp A 120 1ex2A_118F_107}-6.619 1.0062 -12.3979 { c asp A 120 1ex2A_118F_107}-5.8882 2.0123 -13.2829 { o asp A 120 1ex2A_118F_107}-6.2288 3.1896 -13.2994 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 105 1ex2A_118F_107}P -7.0102 5.8799 -12.0798 { ca thr A 105 1ex2A_118F_107}P -8.2207 6.0429 -11.3023 { n ala A 106 1ex2A_118F_107}P -8.489 5.5476 -8.9602 { ca ala A 106 1ex2A_118F_107}P -8.586 4.707 -7.7798 { n val A 107 1ex2A_118F_107}P -10.4187 3.59 -6.713 { ca val A 107 1ex2A_118F_107}P -11.7555 3.435 -6.1636 { n ser A 108 1ex2A_118F_107}P -12.2947 3.4694 -3.7794 { ca ser A 108 1ex2A_118F_107}P -12.2275 2.9539 -2.4232 { n ile A 109 1ex2A_118F_107}P -13.8751 1.4538 -1.4277 { ca ile A 109 1ex2A_118F_107}P -15.2109 1.0385 -0.9987 { n glu A 116 1ex2A_118F_107}P -12.0153 -1.8011 0.8386 { ca glu A 116 1ex2A_118F_107}P -11.1978 -2.2247 -0.2696 { n thr A 117 1ex2A_118F_107}P -9.5991 -0.8821 -1.5045 { ca thr A 117 1ex2A_118F_107}P -9.1341 0.2285 -2.334 { n phe A 118 1ex2A_118F_107}P -8.3059 0.2163 -4.6289 { ca phe A 118 1ex2A_118F_107}P -7.4092 -0.2122 -5.698 { n tyr A 119 1ex2A_118F_107}P -6.3373 0.8008 -7.6153 { ca tyr A 119 1ex2A_118F_107}P -6.2638 1.7583 -8.7176 { n asp A 120 1ex2A_118F_107}P -6.5819 1.6099 -11.082 { ca asp A 120 1ex2A_118F_107}P -6.619 1.0062 -12.3979 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca thr A 105 1ex2A_118F_107}P -8.2207 6.0429 -11.3023 {"}-8.2207 6.0429 -11.3023 { ca ala A 106 1ex2A_118F_107}-8.586 4.707 -7.7798 { ca val A 107 1ex2A_118F_107}-11.7555 3.435 -6.1636 { ca ser A 108 1ex2A_118F_107}-12.2275 2.9539 -2.4232 { ca ile A 109 1ex2A_118F_107}-15.2109 1.0385 -0.9987 { ca glu A 116 1ex2A_118F_107}P -11.1978 -2.2247 -0.2696 {"}-11.1978 -2.2247 -0.2696 { ca thr A 117 1ex2A_118F_107}-9.1341 0.2285 -2.334 { ca phe A 118 1ex2A_118F_107}-7.4092 -0.2122 -5.698 { ca tyr A 119 1ex2A_118F_107}-6.2638 1.7583 -8.7176 { ca asp A 120 1ex2A_118F_107}-6.619 1.0062 -12.3979 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 107 1ex2A_118F_107}P -11.7555 3.435 -6.1636 { cb val A 107 1ex2A_118F_107}-12.5976 2.3796 -6.9334 { cg1 val A 107 1ex2A_118F_107}-13.9229 2.1179 -6.1663 { cb val A 107 1ex2A_118F_107}P -12.5976 2.3796 -6.9334 { cg2 val A 107 1ex2A_118F_107}-12.8722 2.8535 -8.3858 { ca phe A 118 1ex2A_118F_107}P -7.4092 -0.2122 -5.698 { cb phe A 118 1ex2A_118F_107}-7.9308 -1.4924 -6.3817 { cg phe A 118 1ex2A_118F_107}-9.3574 -1.3741 -6.9267 { cd1 phe A 118 1ex2A_118F_107}-9.5949 -0.842 -8.1947 { ce1 phe A 118 1ex2A_118F_107}-10.913 -0.6965 -8.6896 { cz phe A 118 1ex2A_118F_107}-11.9908 -1.0921 -7.8955 { cg phe A 118 1ex2A_118F_107}P -9.3574 -1.3741 -6.9267 { cd2 phe A 118 1ex2A_118F_107}-10.448 -1.77 -6.1515 { ce2 phe A 118 1ex2A_118F_107}-11.7605 -1.6296 -6.6309 { cz phe A 118 1ex2A_118F_107}ghost -11.9908 -1.0921 -7.8955 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A 107 1ex2A_118F_107}P -12.5976 2.3796 -6.9334 { cg1 val A 107 1ex2A_118F_107}P -13.9229 2.1179 -6.1663 {"}P -13.9229 2.1179 -6.1663 {"}P -13.9229 2.1179 -6.1663 { cg2 val A 107 1ex2A_118F_107}P -12.8722 2.8535 -8.3858 {"}P -12.8722 2.8535 -8.3858 {"}P -12.8722 2.8535 -8.3858 { cb phe A 118 1ex2A_118F_107}P -7.9308 -1.4924 -6.3817 {"}P -7.9308 -1.4924 -6.3817 { cd1 phe A 118 1ex2A_118F_107}P -9.5949 -0.842 -8.1947 { cd2 phe A 118 1ex2A_118F_107}P -10.448 -1.77 -6.1515 { ce1 phe A 118 1ex2A_118F_107}P -10.913 -0.6965 -8.6896 { ce2 phe A 118 1ex2A_118F_107}P -11.7605 -1.6296 -6.6309 { cz phe A 118 1ex2A_118F_107}P -11.9908 -1.0921 -7.8955 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 118 A}'S' sky -11.9464 0.6536 -8.2742 {"}'S' sky -11.0367 0.4274 -7.3535 {"}'S' sky -11.7118 0.8196 -8.3349 {"}'S' sky -10.8931 0.6668 -7.593 {"}'S' sky -11.0107 0.7959 -7.7814 {"}'S' sky -11.1461 0.8861 -7.9802 {"}'S' sky -11.294 0.9359 -8.1852 { CE2 PHE 118 A}'S' sky -12.0149 0.0836 -6.3768 {"}'S' sky -12.1726 0.0705 -6.5773 {"}'S' blue -11.6711 0.0952 -6.3505 {"}'S' 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PHE 118 A}'S' P -12.3357 0.3239 -6.9265 {"}'S' -12.3344 0.3174 -6.93 {"}'S' P -12.4756 0.4048 -7.1294 {"}'S' -12.4702 0.3878 -7.1386 {"}'S' P -12.0886 0.4003 -6.9872 {"}'S' -12.0854 0.3448 -7.0215 {"}'S' P -12.224 0.4905 -7.1861 {"}'S' -12.2113 0.4065 -7.2247 {"}'S' P -12.3719 0.5403 -7.3911 {"}'S' -12.3576 0.4779 -7.4103 {"}'S' P -11.8229 0.4251 -7.04 {"}'S' -11.8293 0.3666 -7.0728 {"}'S' P -11.9509 0.5281 -7.2349 {"}'S' -11.9537 0.4236 -7.2781 {"}'S' P -12.0933 0.594 -7.4378 {"}'S' -12.0872 0.4899 -7.4655 {"}'S' P -12.2452 0.6211 -7.6414 {"}'S' -12.2374 0.5676 -7.6492 {"}'S' P -11.6203 0.4735 -7.2064 {"}'S' -11.6308 0.4291 -7.226 {"}'S' P -11.7547 0.5719 -7.4074 {"}'S' -11.7661 0.4899 -7.4316 {"}'S' P -11.9015 0.6327 -7.6151 {"}'S' -11.9053 0.5609 -7.6261 {"}'S' P -12.0581 0.6557 -7.8224 {"}'S' -12.0574 0.639 -7.8228 {"}'S' P -11.5732 0.5828 -7.6044 {"}'S' -11.5752 0.571 -7.6062 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 107 A}'S' sky 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{"}'M' greentint -9.2107 2.4724 -7.2658 {"}'M' greentint -8.9693 2.8664 -7.0634 {"}'M' greentint -9.1001 2.6845 -7.1819 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 107 A}'M' greentint -9.3747 1.9874 -6.2104 {"}'M' greentint -9.2415 2.163 -6.0873 {"}'M' greentint -9.1363 2.3777 -6.0095 {"}'M' greentint -9.4743 1.8605 -6.7038 {"}'M' greentint -9.3137 1.9364 -6.5169 {"}'M' greentint -9.1641 2.0818 -6.3645 {"}'M' greentint -9.0396 2.2818 -6.2587 {"}'M' greentint -8.951 2.5194 -6.2106 {"}'M' greentint -8.9065 2.7741 -6.2233 {"}'M' greentint -9.3806 1.9713 -6.9565 {"}'M' greentint -9.2183 2.0162 -6.7585 {"}'M' greentint -9.0641 2.1488 -6.5968 {"}'M' greentint -8.9398 2.3521 -6.4922 {"}'M' greentint -8.8615 2.5978 -6.46 {"}'M' greentint -8.8406 2.8532 -6.5034 {"}'M' greentint -9.2696 2.1548 -7.1269 {"}'M' greentint -9.1086 2.1828 -6.9269 {"}'M' greentint -8.9606 2.3348 -6.7781 {"}'M' greentint -8.8658 2.5689 -6.7207 {"}'M' greentint -8.8495 2.8226 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-8.4699 {"}'S' green -11.1775 0.0472 -8.2948 {"}'S' green -11.0491 -0.0535 -8.0996 {"}'S' green -10.9018 -0.0966 -7.8971 {"}'S' sea -10.7436 -0.0788 -7.6986 {"}'S' sea -11.1084 0.49 -8.6961 {"}'S' green -11.0439 0.2811 -8.5535 {"}'S' green -10.6496 0.0032 -7.9665 {"}'S' sea -10.4863 0.0522 -7.7699 {"}'S' sea -10.8608 0.5992 -8.7125 {"}'S' green -10.8057 0.388 -8.5838 {"}'S' green -10.7031 0.2352 -8.4087 {"}'S' green -10.566 0.1602 -8.2093 {"}'S' sea -10.4097 0.1709 -8.01 {"}'S' green -10.5483 0.4581 -8.5008 {"}'S' green -10.4149 0.3553 -8.3002 {HG21 ILE 34 A}'S' sea -13.0451 -0.5805 -8.2416 {"}'S' sea -12.8818 -0.5316 -8.045 {"}'S' sea -12.7246 -0.4132 -7.8742 {"}'S' sea -12.9615 -0.4236 -8.4844 {"}'S' green -12.8051 -0.4128 -8.2851 {"}'S' sea -12.649 -0.3175 -8.1106 {"}'S' sea -12.6468 -0.1998 -8.372 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 34 A}'S' P -10.9402 0.1223 -8.3755 {"}'S' -10.9421 0.134 -8.3671 {"}'S' P -10.8054 0.0275 -8.1746 {"}'S' -10.8078 0.0364 -8.1698 {HD12 ILE 34 A}'S' P -11.6415 -0.1446 -9.5003 {"}'S' -11.6308 -0.1097 -9.5313 {"}'S' P -11.4907 -0.0141 -9.3428 {"}'S' -11.4856 0.0232 -9.3887 {"}'S' P -11.3579 0.1649 -9.2209 {"}'S' -11.3584 0.1772 -9.2432 {"}'S' P -11.7352 -0.3674 -9.9706 {"}'S' -11.7316 -0.3537 -9.9739 {"}'S' P -11.5758 -0.3369 -9.7734 {"}'S' -11.5598 -0.2459 -9.815 {"}'S' P -11.4174 -0.2504 -9.592 {"}'S' -11.4135 -0.1244 -9.6786 {"}'S' P -11.2681 -0.1144 -9.436 {"}'S' -11.2844 -0.0007 -9.5492 {"}'S' P -11.1336 0.0646 -9.3136 {"}'S' -11.1605 0.1332 -9.4121 {"}'S' P -11.0229 0.2794 -9.2302 {"}'S' -11.038 0.2968 -9.2701 {"}'S' P -11.5855 -0.4375 -10.1891 {"}'S' -11.5804 -0.4063 -10.191 {"}'S' P -11.4299 -0.4255 -9.9912 {"}'S' -11.4251 -0.2966 -10.0209 {"}'S' P -10.8574 0.1127 -9.4016 {"}'S' -10.9234 0.1882 -9.5074 {"}'S' P -10.7615 0.3384 -9.3392 {"}'S' -10.7876 0.3541 -9.3784 {"}'S' P -11.3291 -0.4542 -10.2843 {"}'S' -11.3336 -0.3702 -10.2823 {"}'S' P -11.1697 -0.4237 -10.0871 {"}'S' -11.2033 -0.2484 -10.1132 {"}'S' P -10.6173 0.1919 -9.5443 {"}'S' -10.6959 0.2447 -9.6161 {"}'S' P -10.5353 0.4311 -9.504 {"}'S' -10.5411 0.4332 -9.5089 {"}'S' P -11.1655 -0.4094 -10.4948 {"}'S' -11.1857 -0.3046 -10.4728 {"}'S' P -11.0074 -0.3916 -10.2963 {"}'S' -11.0707 -0.2099 -10.2893 {"}'S' P -10.5664 -0.0052 -9.8331 {"}'S' -10.6865 0.0996 -9.8947 {"}'S' P -10.4578 0.2098 -9.7526 {"}'S' -10.5265 0.2472 -9.79 {"}'S' P -11.0691 -0.2853 -10.7724 {"}'S' -11.0809 -0.2474 -10.7527 {"}'S' P -10.9133 -0.3096 -10.5642 {"}'S' -10.9762 -0.1741 -10.5238 {"}'S' P -10.5928 -0.1422 -10.1968 {"}'S' -10.7205 -0.0056 -10.206 {"}'S' P -10.4538 0.0347 -10.0659 {"}'S' -10.5335 0.0922 -10.0821 {"}'S' P -10.3437 0.2573 -9.9869 {"}'S' -10.3608 0.2642 -9.9912 {"}'S' P -10.8297 -0.1526 -10.807 {"}'S' -10.8529 -0.1166 -10.7837 {"}'S' P -10.6734 -0.1419 -10.6078 {"}'S' -10.7496 -0.0506 -10.5705 {"}'S' P -10.5173 -0.0465 -10.4332 {"}'S' -10.6106 0.0348 -10.4135 {"}'S' P -10.3801 0.1217 -10.303 {"}'S' -10.4225 0.1465 -10.3 {"}'S' P -10.5151 0.0711 -10.6946 {"}'S' -10.5301 0.0817 -10.6867 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} {HD12 ILE 34 A}'S' P -11.2713 -0.361 -9.8045 {"}'S' -11.2921 -0.1736 -9.8826 {"}'S' P -11.1183 -0.2449 -9.6391 {"}'S' -11.1719 -0.0547 -9.7609 {"}'S' P -10.9789 -0.0842 -9.5022 {"}'S' -11.0531 0.0593 -9.6381 {"}'S' P -11.0117 -0.338 -9.9061 {"}'S' -11.0879 -0.1232 -9.9772 {"}'S' P -10.8616 -0.2021 -9.7507 {"}'S' -10.9731 -0.008 -9.8569 {"}'S' P -10.7275 -0.0222 -9.6273 {"}'S' -10.8433 0.106 -9.7363 {"}'S' P -10.8496 -0.3156 -10.1135 {"}'S' -10.9501 -0.1232 -10.1392 {"}'S' P -10.6992 -0.1842 -9.955 {"}'S' -10.8246 -0.0217 -10.0096 {"}'S' P -10.7501 -0.2606 -10.3676 {"}'S' -10.8671 -0.0819 -10.3462 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 48 A}'M' greentint -9.0869 2.1725 -6.0899 {"}'M' greentint -9.2355 2.0155 -6.2384 {"}'M' greentint -9.3392 1.9192 -6.5359 {"}'M' greentint -8.9376 2.4026 -6.152 {"}'M' greentint -9.0962 2.3094 -6.3305 {"}'M' greentint -9.2354 2.1415 -6.4636 {"}'M' greentint -9.3088 2.0132 -6.7806 {"}'M' greentint -9.3799 1.7681 -6.8049 {"}'M' greentint -8.7506 2.5917 -6.2199 {"}'M' greentint -8.9108 2.5335 -6.4119 {"}'M' greentint -9.0656 2.4104 -6.5766 {"}'M' greentint -9.2013 2.2329 -6.7027 {"}'M' greentint -9.2309 2.0934 -7.0189 {"}'M' greentint -9.3121 1.8502 -7.0573 {"}'M' greentint -8.6679 2.7117 -6.464 {"}'M' greentint -8.83 2.6295 -6.6497 {"}'M' greentint -8.9822 2.4936 -6.8096 {"}'M' greentint -9.1188 2.312 -6.9344 {"}'M' greentint -9.1164 2.1382 -7.2486 {"}'M' greentint -8.573 2.7745 -6.723 {"}'M' greentint -8.7289 2.6758 -6.8963 {"}'M' greentint -8.875 2.5322 -7.0462 {"}'M' greentint -9.0058 2.3502 -7.1646 {"}'M' greentint -8.5731 2.7031 -7.1015 {"}'M' greentint -8.7198 2.556 -7.2513 {"}'M' greentint -8.8519 2.373 -7.3713 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 34 A}'M' greentint -9.2046 1.9131 -6.2617 {"}'M' greentint -9.0633 2.0639 -6.1201 {"}'M' greentint -8.9427 2.2581 -6.0184 {"}'M' greentint -9.2489 1.7758 -6.7095 {"}'M' greentint -9.0907 1.8395 -6.5232 {"}'M' greentint -8.9404 1.964 -6.3634 {"}'M' greentint -8.8073 2.1396 -6.2403 {"}'M' greentint -8.7021 2.3542 -6.1625 {"}'M' greentint -8.6286 2.594 -6.1356 {"}'M' greentint -9.1983 1.8348 -7.0605 {"}'M' greentint -9.0401 1.837 -6.8568 {"}'M' greentint -8.8794 1.913 -6.6699 {"}'M' greentint -8.7299 2.0584 -6.5175 {"}'M' greentint -8.6053 2.2583 -6.4117 {"}'M' greentint -8.5167 2.4959 -6.3637 {"}'M' greentint -8.4722 2.7507 -6.3764 {"}'M' greentint -9.0952 1.9975 -7.3156 {"}'M' greentint -8.9464 1.9479 -7.1095 {"}'M' greentint -8.7841 1.9928 -6.9115 {"}'M' greentint -8.6298 2.1254 -6.7498 {"}'M' greentint -8.5056 2.3287 -6.6452 {"}'M' greentint -8.4273 2.5744 -6.6131 {"}'M' greentint -8.4063 2.8298 -6.6564 {"}'M' greentint -8.8354 2.1313 -7.2799 {"}'M' greentint -8.6744 2.1594 -7.0799 {"}'M' greentint -8.5264 2.3113 -6.9311 {"}'M' greentint -8.4315 2.5455 -6.8737 {"}'M' greentint -8.4153 2.7992 -6.9231 {"}'M' greentint -8.7019 2.3492 -7.3334 {"}'M' greentint -8.5419 2.4461 -7.154 {"}'M' greentint -8.487 2.6994 -7.1538 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 48 A}'M' green -9.8875 0.6749 -4.4859 {"}'M' green -10.0208 0.5713 -4.6853 {"}'M' green -10.0925 0.4715 -4.9161 {"}'M' green -9.5406 1.0376 -4.3611 {"}'M' green -10.0983 0.568 -5.2144 {"}'M' green -9.4839 1.3092 -4.6259 {"}'M' green -9.9511 0.8969 -5.459 {"}'M' green -9.387 1.4439 -4.8814 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 48 A}'M' greentint -9.8058 0.9215 -4.5057 {"}'M' greentint -9.9658 0.8246 -4.6851 {"}'M' greentint -10.0762 0.7252 -4.9654 {"}'M' greentint -9.6723 1.1393 -4.5592 {"}'M' greentint -9.8333 1.1113 -4.7592 {"}'M' greentint -9.9814 0.9593 -4.9081 {"}'M' greentint -10.0479 0.8226 -5.219 {"}'M' greentint -9.6428 1.3123 -4.8318 {"}'M' greentint -9.8031 1.2213 -5.0146 {"}'M' greentint -9.9445 1.0507 -5.1502 {"}'M' greentint -9.5484 1.4047 -5.0792 {"}'M' greentint -9.705 1.2927 -5.2506 {"}'M' greentint -9.8436 1.1179 -5.3814 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 34 A}'M' green -10.1137 0.5365 -4.8454 {"}'M' green -9.6859 1.0109 -4.4254 {"}'M' green -9.5894 1.244 -4.3656 {"}'M' green -10.2019 0.6162 -5.2987 {"}'M' green -9.5207 1.3108 -4.6116 {"}'M' green -10.0833 0.7982 -5.4532 {"}'M' green -9.4716 1.5488 -4.8722 {"}'M' green -9.949 1.006 -5.529 {"}'M' green -9.5408 1.4253 -5.118 {"}'M' green -9.8363 1.2358 -5.5642 {"}'M' green -9.6776 1.3332 -5.3865 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 34 A}'M' greentint -9.9559 0.6468 -4.672 {"}'M' greentint -9.8105 0.8085 -4.529 {"}'M' greentint -10.0427 0.6387 -5.0982 {"}'M' greentint -9.883 0.7273 -4.9172 {"}'M' greentint -9.7363 0.8768 -4.7696 {"}'M' greentint -9.6126 1.0766 -4.6649 {"}'M' greentint -9.9245 0.8092 -5.2523 {"}'M' greentint -9.7675 0.9051 -5.0749 {"}'M' greentint -9.629 1.0756 -4.9434 {"}'M' greentint -9.5261 1.2991 -4.8726 {"}'M' greentint -9.7858 1.0352 -5.3263 {"}'M' greentint -9.6361 1.189 -5.1755 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 4 1fnyA_6F_231F}P -11.6123 -1.5783 1.2191 {"}-11.6123 -1.5783 1.2191 { ca leu A 4 1fnyA_6F_231F}-11.2044 -2.0092 -0.1125 { c leu A 4 1fnyA_6F_231F}-10.7621 -0.7869 -0.8995 { o leu A 4 1fnyA_6F_231F}-11.3886 0.2658 -0.8152 { c leu A 4 1fnyA_6F_231F}P -10.7621 -0.7869 -0.8995 { n ser A 5 1fnyA_6F_231F}-9.6784 -0.9199 -1.6521 { ca ser A 5 1fnyA_6F_231F}-9.2151 0.1721 -2.4969 { c ser A 5 1fnyA_6F_231F}-8.4473 -0.4394 -3.6472 { o ser A 5 1fnyA_6F_231F}-7.9406 -1.5579 -3.5418 { c ser A 5 1fnyA_6F_231F}P -8.4473 -0.4394 -3.6472 { n phe A 6 1fnyA_6F_231F}-8.3992 0.2849 -4.7567 { ca phe A 6 1fnyA_6F_231F}-7.6574 -0.1697 -5.9187 { c phe A 6 1fnyA_6F_231F}-7.4688 0.9839 -6.8796 { o phe A 6 1fnyA_6F_231F}-8.0835 2.0427 -6.7344 { c phe A 6 1fnyA_6F_231F}P -7.4688 0.9839 -6.8796 { n ser A 7 1fnyA_6F_231F}-6.5984 0.7736 -7.8531 { ca ser A 7 1fnyA_6F_231F}-6.3276 1.782 -8.8496 { c ser A 7 1fnyA_6F_231F}-5.8771 1.1014 -10.1325 { o ser A 7 1fnyA_6F_231F}-5.0101 0.2231 -10.1142 { c ser A 7 1fnyA_6F_231F}P -5.8771 1.1014 -10.1325 { n phe A 8 1fnyA_6F_231F}-6.4968 1.5053 -11.2375 { ca phe A 8 1fnyA_6F_231F}-6.1829 0.9869 -12.563 { c phe A 8 1fnyA_6F_231F}-5.9669 2.1876 -13.48 { o phe A 8 1fnyA_6F_231F}-6.915 2.9021 -13.8025 { n trp A 229 1fnyA_6F_231F}P -9.7059 3.9014 -13.486 {"}-9.7059 3.9014 -13.486 { ca trp A 229 1fnyA_6F_231F}-10.6117 3.7659 -12.3553 { c trp A 229 1fnyA_6F_231F}-9.9011 3.4847 -11.0396 { o trp A 229 1fnyA_6F_231F}-9.064 2.592 -10.9614 { c trp A 229 1fnyA_6F_231F}P -9.9011 3.4847 -11.0396 { n ser A 230 1fnyA_6F_231F}-10.2373 4.2569 -10.0093 { ca ser A 230 1fnyA_6F_231F}-9.6702 4.0534 -8.6854 { c ser A 230 1fnyA_6F_231F}-10.857 4.0493 -7.7296 { o ser A 230 1fnyA_6F_231F}-11.8947 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-12.3064 0.1962 -6.6677 {"}'S' P -12.1916 0.0621 -6.4835 {"}'S' -12.1855 0.0915 -6.4716 {"}'S' P -12.055 -0.0193 -6.2834 {"}'S' -12.0531 -0.0007 -6.2799 {"}'S' P -12.1885 0.4935 -7.0084 {"}'S' -12.1786 0.5195 -6.9683 {"}'S' P -12.1174 0.2971 -6.863 {"}'S' -12.112 0.3281 -6.8319 {"}'S' P -12.0148 0.1444 -6.6879 {"}'S' -12.0131 0.1715 -6.6696 {"}'S' P -11.8864 0.0436 -6.4928 {"}'S' -11.8887 0.0771 -6.4796 {"}'S' P -11.9457 0.5871 -7.0893 {"}'S' -11.9462 0.6029 -7.0593 {"}'S' P -11.8813 0.3782 -6.9466 {"}'S' -11.8839 0.4024 -6.9182 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 6 A}'M' green -9.1754 2.2776 -5.8897 {"}'M' green -9.4672 1.973 -6.53 {"}'M' green -9.4806 2.0649 -6.8308 {"}'M' green -9.3822 2.4008 -7.1147 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 6 A}'M' greentint -9.3156 2.1849 -6.0858 {"}'M' greentint -9.0967 2.5238 -5.8965 {"}'M' greentint -9.2556 2.4351 -6.0781 {"}'M' greentint -9.3992 2.3274 -6.3505 {"}'M' greentint -9.413 2.0715 -6.2973 {"}'M' greentint -8.9937 2.7564 -5.9454 {"}'M' greentint -9.1569 2.723 -6.1473 {"}'M' greentint -9.3055 2.5661 -6.2958 {"}'M' greentint -9.4093 2.4697 -6.5933 {"}'M' greentint -9.4658 2.2202 -6.5965 {"}'M' greentint -9.0077 2.9531 -6.2095 {"}'M' greentint -9.1663 2.86 -6.3879 {"}'M' greentint -9.3055 2.692 -6.521 {"}'M' greentint -9.3789 2.5638 -6.8381 {"}'M' greentint -9.45 2.3186 -6.8623 {"}'M' greentint -8.9809 3.084 -6.4693 {"}'M' greentint -9.1357 2.9609 -6.634 {"}'M' greentint -9.2714 2.7834 -6.7601 {"}'M' greentint -9.301 2.6439 -7.0763 {"}'M' greentint -9.0523 3.0441 -6.867 {"}'M' greentint -9.1889 2.8625 -6.9918 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 231 A}'M' greentint -9.3394 2.0413 -6.2667 {"}'M' greentint -9.1899 2.1867 -6.1143 {"}'M' greentint -9.0653 2.3866 -6.0085 {"}'M' greentint -8.9767 2.6242 -5.9605 {"}'M' greentint -9.4064 2.0761 -6.7063 {"}'M' greentint -9.244 2.1211 -6.5083 {"}'M' greentint -9.0898 2.2537 -6.3466 {"}'M' greentint -8.9656 2.457 -6.242 {"}'M' greentint -8.8873 2.7027 -6.2099 {"}'M' greentint -8.8663 2.9581 -6.2532 {"}'M' greentint -9.2954 2.2596 -6.8767 {"}'M' greentint -9.1344 2.2877 -6.6767 {"}'M' greentint -8.9863 2.4396 -6.5279 {"}'M' greentint -8.8915 2.6737 -6.4705 {"}'M' greentint -8.8753 2.9274 -6.5198 {"}'M' greentint -8.9419 3.1327 -6.6629 {"}'M' greentint -9.2661 2.6326 -7.1081 {"}'M' greentint -9.1619 2.4775 -6.9302 {"}'M' greentint -9.0019 2.5744 -6.7508 {"}'M' greentint -8.947 2.8277 -6.7506 {"}'M' greentint -9.0512 2.9828 -6.9284 {"}'M' greentint -9.0802 2.724 -6.9501 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 6 A}'M' green -9.0012 1.7012 -4.0385 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 6 A}'M' greentint -9.6328 1.3363 -4.2683 {"}'M' greentint -9.7661 1.2327 -4.4678 {"}'M' greentint -9.447 1.4277 -4.1103 {"}'M' greentint -9.5512 1.5829 -4.2881 {"}'M' greentint -9.7111 1.486 -4.4676 {"}'M' greentint -9.8215 1.3866 -4.7478 {"}'M' greentint -9.2193 1.4937 -4.0004 {"}'M' greentint -9.2859 1.699 -4.1435 {"}'M' greentint -9.4177 1.8008 -4.3417 {"}'M' greentint -9.5787 1.7727 -4.5416 {"}'M' greentint -9.7267 1.6207 -4.6905 {"}'M' greentint -9.0944 1.8758 -4.2074 {"}'M' greentint -9.2293 1.9706 -4.4083 {"}'M' greentint -9.3881 1.9738 -4.6142 {"}'M' greentint -9.5484 1.8827 -4.7971 {"}'M' greentint -9.6898 1.7122 -4.9326 {"}'M' greentint -8.9807 2.0698 -4.4586 {"}'M' greentint -9.1324 2.1053 -4.6638 {"}'M' greentint -9.2937 2.0662 -4.8617 {"}'M' greentint -9.4503 1.9541 -5.0331 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 231 A}'M' green -9.8865 1.3161 -4.7727 {"}'M' green -9.7823 1.5431 -5.0187 {"}'M' green -9.6318 1.7964 -5.1528 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 231 A}'M' greentint -9.7403 1.2528 -4.5669 {"}'M' greentint -9.5831 1.2482 -4.3613 {"}'M' greentint -9.4205 1.3039 -4.1671 {"}'M' greentint -9.2626 1.4142 -3.9937 {"}'M' greentint -9.6567 1.4307 -4.8248 {"}'M' greentint -9.5087 1.3836 -4.6204 {"}'M' greentint -9.3495 1.4061 -4.4199 {"}'M' greentint -9.1898 1.4947 -4.2389 {"}'M' greentint -9.0431 1.6443 -4.0913 {"}'M' greentint -9.5284 1.6424 -4.9764 {"}'M' greentint -9.3901 1.5656 -4.7749 {"}'M' greentint -9.2312 1.5766 -4.574 {"}'M' greentint -9.0742 1.6725 -4.3966 {"}'M' greentint -8.9358 1.843 -4.2651 {"}'M' greentint -9.3887 1.877 -5.0509 {"}'M' greentint -9.2558 1.7734 -4.8506 {"}'M' greentint -9.0926 1.8026 -4.648 {"}'M' greentint -8.9428 1.9564 -4.4972 {"}'M' greentint -9.1431 2.0033 -4.8858 {"}'M' greentint -8.9844 2.1006 -4.7082 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 167 1ftrA_169F_246}P -11.3208 -0.6824 1.5138 {"}-11.3208 -0.6824 1.5138 { ca gly A 167 1ftrA_169F_246}-10.9962 -1.5889 0.4179 { c gly A 167 1ftrA_169F_246}-10.7737 -0.7577 -0.8383 { o gly A 167 1ftrA_169F_246}-11.3942 0.2929 -0.9811 { c gly A 167 1ftrA_169F_246}P -10.7737 -0.7577 -0.8383 { n asn A 168 1ftrA_169F_246}-9.7735 -1.1049 -1.6475 { ca asn A 168 1ftrA_169F_246}-9.3857 -0.2185 -2.7348 { c asn A 168 1ftrA_169F_246}-8.6974 -0.9365 -3.8705 { o asn A 168 1ftrA_169F_246}-8.1748 -2.0395 -3.6956 { c asn A 168 1ftrA_169F_246}P -8.6974 -0.9365 -3.8705 { n phe A 169 1ftrA_169F_246}-8.7075 -0.3122 -5.0419 { ca phe A 169 1ftrA_169F_246}-7.7397 -0.6362 -6.0803 { c phe A 169 1ftrA_169F_246}-7.4903 0.5652 -6.9842 { o phe A 169 1ftrA_169F_246}-8.2434 1.5353 -6.9601 { c phe A 169 1ftrA_169F_246}P -7.4903 0.5652 -6.9842 { n tyr A 170 1ftrA_169F_246}-6.3485 0.5453 -7.6663 { ca tyr A 170 1ftrA_169F_246}-5.9511 1.6151 -8.5703 { c tyr A 170 1ftrA_169F_246}-6.0427 1.112 -9.987 { o tyr A 170 1ftrA_169F_246}-5.6038 -0.0047 -10.2944 { c tyr A 170 1ftrA_169F_246}P -6.0427 1.112 -9.987 { n ile A 171 1ftrA_169F_246}-6.6126 1.94 -10.8558 { ca ile A 171 1ftrA_169F_246}-6.6053 1.6677 -12.2858 { c ile A 171 1ftrA_169F_246}-5.5402 2.5535 -12.9102 { o ile A 171 1ftrA_169F_246}-5.564 3.7797 -12.7562 { n tyr A 244 1ftrA_169F_246}P -6.5745 6.3185 -11.3982 {"}-6.5745 6.3185 -11.3982 { ca tyr A 244 1ftrA_169F_246}-7.7495 6.5918 -10.5801 { c tyr A 244 1ftrA_169F_246}-7.7823 5.542 -9.4763 { o tyr A 244 1ftrA_169F_246}-7.426 4.3882 -9.7068 { c tyr A 244 1ftrA_169F_246}P -7.7823 5.542 -9.4763 { n glu A 245 1ftrA_169F_246}-8.2592 5.9412 -8.3002 { ca glu A 245 1ftrA_169F_246}-8.4924 4.9895 -7.2226 { c glu A 245 1ftrA_169F_246}-9.9878 4.7622 -7.0119 { o glu A 245 1ftrA_169F_246}-10.7778 5.6992 -7.0922 { c glu A 245 1ftrA_169F_246}P -9.9878 4.7622 -7.0119 { n ile A 246 1ftrA_169F_246}-10.366 3.5001 -6.8151 { ca ile A 246 1ftrA_169F_246}-11.7003 3.1526 -6.3277 { c ile A 246 1ftrA_169F_246}-11.5997 2.7097 -4.8639 { o ile A 246 1ftrA_169F_246}-10.9239 1.7291 -4.5589 { c ile A 246 1ftrA_169F_246}P -11.5997 2.7097 -4.8639 { n val A 247 1ftrA_169F_246}-12.3609 3.38 -3.9999 { ca val A 247 1ftrA_169F_246}-12.4251 3.0713 -2.5749 { c val A 247 1ftrA_169F_246}-13.8077 2.5146 -2.239 { o val A 247 1ftrA_169F_246}-14.8253 3.0848 -2.6424 { c val A 247 1ftrA_169F_246}P -13.8077 2.5146 -2.239 { n ile A 248 1ftrA_169F_246}-13.8309 1.3737 -1.5438 { ca ile A 248 1ftrA_169F_246}-15.0569 0.612 -1.2855 { c ile A 248 1ftrA_169F_246}-15.2096 0.3523 0.221 { o ile A 248 1ftrA_169F_246}-14.2862 -0.1416 0.8695 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 167 1ftrA_169F_246}P -11.3208 -0.6824 1.5138 { ca gly A 167 1ftrA_169F_246}P -10.9962 -1.5889 0.4179 {"}P -10.9962 -1.5889 0.4179 { n asn A 168 1ftrA_169F_246}P -9.7735 -1.1049 -1.6475 { ca asn A 168 1ftrA_169F_246}P -9.3857 -0.2185 -2.7348 { n phe A 169 1ftrA_169F_246}P -8.7075 -0.3122 -5.0419 { ca phe A 169 1ftrA_169F_246}P -7.7397 -0.6362 -6.0803 { n tyr A 170 1ftrA_169F_246}P -6.3485 0.5453 -7.6663 { ca tyr A 170 1ftrA_169F_246}P -5.9511 1.6151 -8.5703 { n ile A 171 1ftrA_169F_246}P -6.6126 1.94 -10.8558 { ca ile A 171 1ftrA_169F_246}P -6.6053 1.6677 -12.2858 { n tyr A 244 1ftrA_169F_246}P -6.5745 6.3185 -11.3982 { ca tyr A 244 1ftrA_169F_246}P -7.7495 6.5918 -10.5801 { n glu A 245 1ftrA_169F_246}P -8.2592 5.9412 -8.3002 { ca glu A 245 1ftrA_169F_246}P -8.4924 4.9895 -7.2226 { n ile A 246 1ftrA_169F_246}P -10.366 3.5001 -6.8151 { ca ile A 246 1ftrA_169F_246}P -11.7003 3.1526 -6.3277 { n val A 247 1ftrA_169F_246}P -12.3609 3.38 -3.9999 { ca val A 247 1ftrA_169F_246}P -12.4251 3.0713 -2.5749 { n ile A 248 1ftrA_169F_246}P -13.8309 1.3737 -1.5438 { ca ile A 248 1ftrA_169F_246}P -15.0569 0.612 -1.2855 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 167 1ftrA_169F_246}P -10.9962 -1.5889 0.4179 {"}-10.9962 -1.5889 0.4179 { ca asn A 168 1ftrA_169F_246}-9.3857 -0.2185 -2.7348 { ca phe A 169 1ftrA_169F_246}-7.7397 -0.6362 -6.0803 { ca tyr A 170 1ftrA_169F_246}-5.9511 1.6151 -8.5703 { ca ile A 171 1ftrA_169F_246}-6.6053 1.6677 -12.2858 { ca tyr A 244 1ftrA_169F_246}P -7.7495 6.5918 -10.5801 {"}-7.7495 6.5918 -10.5801 { ca glu A 245 1ftrA_169F_246}-8.4924 4.9895 -7.2226 { ca ile A 246 1ftrA_169F_246}-11.7003 3.1526 -6.3277 { ca val A 247 1ftrA_169F_246}-12.4251 3.0713 -2.5749 { ca ile A 248 1ftrA_169F_246}-15.0569 0.612 -1.2855 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 169 1ftrA_169F_246}P -7.7397 -0.6362 -6.0803 { cb phe A 169 1ftrA_169F_246}-8.1782 -1.8651 -6.8912 { cg phe A 169 1ftrA_169F_246}-9.4906 -1.6992 -7.6052 { cd1 phe A 169 1ftrA_169F_246}-9.5204 -1.352 -8.959 { ce1 phe A 169 1ftrA_169F_246}-10.726 -1.264 -9.6426 { cz phe A 169 1ftrA_169F_246}-11.9155 -1.513 -8.9815 { cg phe A 169 1ftrA_169F_246}P -9.4906 -1.6992 -7.6052 { cd2 phe A 169 1ftrA_169F_246}-10.6933 -1.95 -6.9482 { ce2 phe A 169 1ftrA_169F_246}-11.8995 -1.856 -7.6305 { cz phe A 169 1ftrA_169F_246}ghost -11.9155 -1.513 -8.9815 { ca ile A 246 1ftrA_169F_246}P -11.7003 3.1526 -6.3277 { cb ile A 246 1ftrA_169F_246}-12.3247 1.9786 -7.1473 { cg1 ile A 246 1ftrA_169F_246}-12.1319 2.2136 -8.6497 { cd1 ile A 246 1ftrA_169F_246}-12.8414 3.4042 -9.1666 { cb ile A 246 1ftrA_169F_246}P -12.3247 1.9786 -7.1473 { cg2 ile A 246 1ftrA_169F_246}-13.8197 1.8187 -6.8199 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 169 1ftrA_169F_246}P -8.1782 -1.8651 -6.8912 {"}P -8.1782 -1.8651 -6.8912 { cd1 phe A 169 1ftrA_169F_246}P -9.5204 -1.352 -8.959 { cd2 phe A 169 1ftrA_169F_246}P -10.6933 -1.95 -6.9482 { ce1 phe A 169 1ftrA_169F_246}P -10.726 -1.264 -9.6426 { ce2 phe A 169 1ftrA_169F_246}P -11.8995 -1.856 -7.6305 { cz phe A 169 1ftrA_169F_246}P -11.9155 -1.513 -8.9815 { cb ile A 246 1ftrA_169F_246}P -12.3247 1.9786 -7.1473 { cg1 ile A 246 1ftrA_169F_246}P -12.1319 2.2136 -8.6497 {"}P -12.1319 2.2136 -8.6497 { cg2 ile A 246 1ftrA_169F_246}P -13.8197 1.8187 -6.8199 {"}P -13.8197 1.8187 -6.8199 {"}P -13.8197 1.8187 -6.8199 { cd1 ile A 246 1ftrA_169F_246}P -12.8414 3.4042 -9.1666 {"}P -12.8414 3.4042 -9.1666 {"}P -12.8414 3.4042 -9.1666 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 169 A}'S' blue -11.4922 -0.4338 -6.5934 {"}'S' blue -11.0744 -0.3176 -6.4437 {"}'S' sky -11.2303 -0.312 -6.6478 {"}'S' sky -11.3907 -0.3482 -6.8451 {"}'S' blue -10.9477 -0.2368 -6.6941 {"}'S' sky -11.1054 -0.2499 -6.8946 {"}'S' sky -11.2662 -0.3025 -7.087 {"}'S' blue -10.9222 -0.2196 -7.08 {"}'S' blue -11.0861 -0.2763 -7.2757 { CE1 PHE 169 A}'S' blue -11.2108 0.2328 -8.8764 {"}'S' blue -11.3638 0.267 -9.0848 {"}'S' sky -11.5248 0.2521 -9.2879 {"}'S' blue -11.107 0.3683 -9.1382 {"}'S' blue -11.2629 0.3739 -9.3422 {"}'S' sky -11.4233 0.3377 -9.5395 {"}'S' sky -11.584 0.2593 -9.7242 {"}'S' blue -11.7391 0.1407 -9.892 { CE2 PHE 169 A}'S' blue -12.2444 -0.4401 -6.6615 {"}'S' blue -12.3843 -0.3591 -6.8644 {"}'S' sky -11.9973 -0.3636 -6.7222 {"}'S' sky -12.4365 -0.2181 -7.3302 {"}'S' blue -11.619 -0.4766 -6.5912 {"}'S' sky -12.3116 -0.1559 -7.5769 {"}'S' sky -12.1284 -0.1257 -7.7623 {"}'S' sky -11.3439 -0.2722 -7.137 {"}'S' sky -11.7879 -0.1138 -7.7542 {"}'S' blue -11.2731 -0.2281 -7.491 {"}'S' blue -11.4217 -0.1743 -7.6979 { CZ PHE 169 A}'S' blue -12.5533 0.018 -8.4238 {"}'S' sky -12.7143 0.0031 -8.6268 {"}'S' sky -12.8772 -0.0596 -8.8196 {"}'S' blue -12.0133 -0.0207 -8.0733 {"}'S' blue -12.1487 0.0695 -8.2721 {"}'S' sky -12.9287 -0.1084 -9.231 {"}'S' blue -11.6349 -0.1336 -7.9423 {"}'S' blue -11.7476 0.0042 -8.126 {"}'S' blue -11.8756 0.1071 -8.321 {"}'S' sky -12.7989 -0.0807 -9.4614 {"}'S' blue -11.6794 0.1509 -8.4934 {"}'S' sky -12.6248 -0.0629 -9.6566 {"}'S' blue -11.4979 0.1618 -8.6904 {"}'S' sky -11.6469 0.2148 -8.8977 {"}'S' sky -11.9203 0.1023 -9.654 {"}'S' sky -12.0815 0.0058 -9.8353 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 169 A}'S' sea -11.6876 0.1894 -9.4807 { CE2 PHE 169 A}'S' sea -12.1327 -0.2734 -6.9211 {"}'S' sea -12.2806 -0.2236 -7.1261 {"}'S' sea -11.7316 -0.3388 -6.775 {"}'S' green -11.8596 -0.2358 -6.9699 {"}'S' green -12.002 -0.17 -7.1728 {"}'S' sea -12.1539 -0.1428 -7.3764 {"}'S' sea -11.529 -0.2904 -6.9414 {"}'S' green -11.6634 -0.192 -7.1424 {"}'S' green -11.8102 -0.1312 -7.3501 {"}'S' sea -11.9668 -0.1082 -7.5574 {"}'S' sea -11.4819 -0.1812 -7.3394 {"}'S' sea -11.631 -0.1282 -7.5467 { CZ PHE 169 A}'S' sea -12.2966 0.1193 -8.4771 {"}'S' green -12.4525 0.1249 -8.6812 {"}'S' green -12.6129 0.0887 -8.8785 {"}'S' sea -12.7736 0.0103 -9.0631 {"}'S' sea -12.018 0.173 -8.5239 {"}'S' green -12.1699 0.2002 -8.7274 {"}'S' green -12.3276 0.187 -8.9279 {"}'S' green -12.4884 0.1345 -9.1204 {"}'S' green -12.6457 0.0447 -9.2995 {"}'S' sea -11.8262 0.2117 -8.7011 {"}'S' green -11.9828 0.2347 -8.9085 {"}'S' green -12.3083 0.1606 -9.309 {"}'S' green -12.4694 0.0669 -9.4908 {"}'S' green -11.8039 0.2291 -9.1052 {"}'S' green -11.966 0.2057 -9.3078 {"}'S' green -12.1296 0.1442 -9.502 {"}'S' sea -12.2905 0.0457 -9.6823 {"}'S' sea -11.7571 0.1629 -9.4602 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 169 A}'S' P -12.1444 0.2173 -9.1133 {"}'S' -12.1437 0.213 -9.1131 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ILE 246 A}'S' blue -12.484 0.2777 -7.5254 {"}'S' blue -12.1565 0.4328 -7.9505 { CG1 ILE 246 A}'S' blue -12.0861 0.4931 -8.3294 {"}'S' blue -11.8157 0.5092 -8.4129 {"}'S' sky -11.7245 0.5132 -8.7095 {"}'S' blue -11.5641 0.5635 -8.5172 {"}'S' blue -11.51 0.5896 -8.8439 {"}'S' blue -11.4188 0.6833 -9.1115 {"}'S' blue -11.2567 0.7212 -8.9123 {"}'S' blue -11.3329 0.8271 -9.3584 {"}'S' blue -11.1744 0.8391 -9.1565 { HB ILE 246 A}'S' blue -12.4441 0.0768 -6.9857 {"}'S' sky -12.3067 -0.0047 -6.7862 {"}'S' blue -12.1548 -0.0304 -6.5829 {"}'S' blue -12.3918 0.1762 -7.3779 {"}'S' sky -11.8495 -0.0885 -6.6036 {"}'S' sky -11.5892 -0.0868 -6.6994 {"}'S' blue -11.4312 -0.001 -6.5184 {"}'S' sky -11.9634 0.2242 -7.6799 {"}'S' sky -11.2692 0.0214 -6.7258 {"}'S' blue -11.1188 0.1528 -6.5673 {"}'S' blue -11.7272 0.3052 -7.7635 {"}'S' sky -11.6235 0.1465 -7.5856 {"}'S' sky -11.3329 0.0274 -7.1765 {"}'S' sky -11.1696 0.0763 -6.9799 {"}'S' blue -11.0124 0.1947 -6.8092 {HG13 ILE 246 A}'S' sky -12.9803 0.2708 -9.118 {"}'S' sky -12.5105 0.362 -8.5361 {"}'S' sky -12.7111 0.2646 -9.6322 {"}'S' sky -11.686 0.4702 -9.1409 {"}'S' blue -11.9228 0.4598 -9.7511 {"}'S' sky -11.7665 0.4706 -9.5519 {"}'S' sky -11.6104 0.5659 -9.3773 {"}'S' blue -11.6082 0.6836 -9.6387 @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 246 A}'S' sea -12.283 0.0355 -7.1988 {"}'S' sea -12.1523 -0.0588 -7.0038 {"}'S' sea -12.005 -0.1005 -6.8014 {"}'S' sea -12.1537 0.1209 -7.4859 {"}'S' green -12.0376 -0.0109 -7.3004 {"}'S' green -11.901 -0.0923 -7.1004 {"}'S' green -11.7486 -0.1172 -6.8966 {"}'S' sea -11.8608 0.0714 -7.5048 {"}'S' green -11.7324 -0.0294 -7.3097 {"}'S' green -11.5851 -0.0724 -7.1071 {"}'S' sea -11.4274 -0.0554 -6.9091 {"}'S' sea -11.4886 0.0516 -7.3847 {HG13 ILE 246 A}'S' sea -12.8283 0.245 -8.9147 {"}'S' sea -12.6689 0.2755 -8.7175 {"}'S' sea -12.8259 0.2166 -9.3355 {"}'S' green -12.6786 0.175 -9.1332 {"}'S' green -12.523 0.187 -8.9353 {"}'S' green -12.3644 0.2514 -8.7486 {"}'S' sea -12.2115 0.3675 -8.5832 {"}'S' green -12.5746 0.1832 -9.4321 {"}'S' green -12.4222 0.1582 -9.2284 {"}'S' green -12.1048 0.2744 -8.8502 {"}'S' sea -11.9547 0.4103 -8.6948 {"}'S' sea -12.4059 0.2461 -9.6415 {"}'S' green -12.2586 0.203 -9.4389 {"}'S' green -12.1005 0.2208 -9.2404 {"}'S' green -11.9428 0.2968 -9.0576 {"}'S' sea -11.7923 0.4282 -8.8991 {"}'S' sea -12.1622 0.3271 -9.7165 {"}'S' green -12.0064 0.3029 -9.5083 {"}'S' green -11.8432 0.3518 -9.3117 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} {HG13 ILE 246 A}'S' P -12.2628 0.1887 -9.0312 {"}'S' -12.2638 0.195 -9.0323 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 169 A}'M' greentint -9.3168 2.2156 -6.373 {"}'M' greentint -9.4654 2.0587 -6.5215 {"}'M' greentint -9.5691 1.9624 -6.819 {"}'M' greentint -9.1675 2.4458 -6.4352 {"}'M' greentint -9.3261 2.3526 -6.6136 {"}'M' greentint -9.4654 2.1847 -6.7467 {"}'M' greentint -9.5387 2.0564 -7.0638 {"}'M' greentint -9.6099 1.8113 -7.088 {"}'M' greentint -8.9806 2.6349 -6.503 {"}'M' greentint -9.1408 2.5767 -6.695 {"}'M' greentint -9.2955 2.4536 -6.8597 {"}'M' greentint -9.4313 2.2761 -6.9859 {"}'M' greentint -9.4608 2.1366 -7.302 {"}'M' greentint -9.542 1.8934 -7.3404 {"}'M' greentint -8.8978 2.7549 -6.7471 {"}'M' greentint -9.0599 2.6727 -6.9328 {"}'M' greentint -9.2121 2.5368 -7.0928 {"}'M' greentint -9.3488 2.3552 -7.2176 {"}'M' greentint -9.3463 2.1814 -7.5317 {"}'M' greentint -8.803 2.8177 -7.0061 {"}'M' greentint -8.9588 2.719 -7.1794 {"}'M' greentint -9.1049 2.5754 -7.3293 {"}'M' greentint -9.2357 2.3934 -7.4477 {"}'M' greentint -8.9497 2.5992 -7.5344 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 246 A}'M' greentint -9.6239 1.7245 -6.9437 {"}'M' greentint -9.4657 1.7882 -6.7574 {"}'M' greentint -9.3154 1.9126 -6.5976 {"}'M' greentint -9.1823 2.0882 -6.4745 {"}'M' greentint -9.077 2.3029 -6.3968 {"}'M' greentint -9.0036 2.5427 -6.3699 {"}'M' greentint -9.5733 1.7834 -7.2948 {"}'M' greentint -9.4151 1.7857 -7.091 {"}'M' greentint -9.2544 1.8616 -6.9041 {"}'M' greentint -9.1049 2.007 -6.7518 {"}'M' greentint -8.9803 2.207 -6.6459 {"}'M' greentint -8.8917 2.4445 -6.5979 {"}'M' greentint -8.8472 2.6993 -6.6106 {"}'M' greentint -9.3214 1.8965 -7.3437 {"}'M' greentint -9.159 1.9414 -7.1457 {"}'M' greentint -9.0048 2.074 -6.984 {"}'M' greentint -8.8806 2.2773 -6.8794 {"}'M' greentint -8.8023 2.523 -6.8473 {"}'M' greentint -8.7813 2.7784 -6.8906 {"}'M' greentint -9.2104 2.08 -7.5141 {"}'M' greentint -9.0494 2.108 -7.3141 {"}'M' greentint -8.9013 2.26 -7.1653 {"}'M' greentint -8.8065 2.4941 -7.108 {"}'M' greentint -8.7902 2.7478 -7.1573 {"}'M' greentint -9.0769 2.2978 -7.5677 {"}'M' greentint -8.9169 2.3947 -7.3882 {"}'M' greentint -8.862 2.648 -7.388 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 169 A}'M' green -10.1388 0.5737 -4.6866 {"}'M' green -10.272 0.4701 -4.8861 {"}'M' green -9.9529 0.6651 -4.5286 {"}'M' green -10.2992 0.7214 -5.4197 {"}'M' green -9.6003 1.1132 -4.6257 {"}'M' green -9.4867 1.3072 -4.877 {"}'M' green -9.6383 1.3427 -5.0821 {"}'M' green -9.7996 1.3035 -5.28 {"}'M' green -9.9563 1.1915 -5.4514 {"}'M' green -10.0948 1.0168 -5.5821 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 169 A}'M' greentint -10.0571 0.8203 -4.7064 {"}'M' greentint -10.2171 0.7234 -4.8859 {"}'M' greentint -10.3275 0.624 -5.1661 {"}'M' greentint -9.7919 0.9364 -4.5618 {"}'M' greentint -9.9236 1.0381 -4.76 {"}'M' greentint -10.0846 1.0101 -4.9599 {"}'M' greentint -10.2327 0.8581 -5.1088 {"}'M' greentint -9.7352 1.208 -4.8266 {"}'M' greentint -9.8941 1.2112 -5.0325 {"}'M' greentint -10.0543 1.1201 -5.2154 {"}'M' greentint -10.1957 0.9496 -5.3509 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 246 A}'M' sea -10.5028 0.4959 -5.0707 {"}'M' green -10.3456 0.4913 -4.8651 {"}'M' green -10.183 0.547 -4.6709 {"}'M' green -10.0252 0.6573 -4.4975 {"}'M' green -9.8798 0.819 -4.3545 {"}'M' green -10.4193 0.6737 -5.3286 {"}'M' green -9.6819 1.0871 -4.4904 {"}'M' green -10.291 0.8855 -5.4802 {"}'M' green -9.5954 1.3096 -4.698 {"}'M' green -10.1513 1.12 -5.5547 {"}'M' green -9.6101 1.4357 -4.9435 {"}'M' green -9.9057 1.2463 -5.3896 {"}'M' green -9.747 1.3436 -5.212 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 246 A}'M' greentint -10.2713 0.6267 -5.1242 {"}'M' greentint -10.1121 0.6491 -4.9237 {"}'M' greentint -9.9524 0.7377 -4.7427 {"}'M' greentint -9.8057 0.8873 -4.5951 {"}'M' greentint -10.1527 0.8086 -5.2787 {"}'M' greentint -9.9938 0.8196 -5.0778 {"}'M' greentint -9.8368 0.9155 -4.9004 {"}'M' greentint -9.6983 1.0861 -4.7689 {"}'M' greentint -10.0183 1.0165 -5.3544 {"}'M' greentint -9.8552 1.0457 -5.1518 {"}'M' greentint -9.7054 1.1994 -5.001 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 473 1g87A_566F_475}P -7.6524 5.8527 -12.1089 {"}-7.6524 5.8527 -12.1089 { ca thr A 473 1g87A_566F_475}-8.8156 6.0135 -11.2594 { c thr A 473 1g87A_566F_475}-8.5616 5.119 -10.0518 { o thr A 473 1g87A_566F_475}-8.1515 3.9687 -10.2063 { c thr A 473 1g87A_566F_475}P -8.5616 5.119 -10.0518 { n glu A 474 1g87A_566F_475}-8.7758 5.6471 -8.8503 { ca glu A 474 1g87A_566F_475}-8.6102 4.8282 -7.6526 { c glu A 474 1g87A_566F_475}-9.9452 4.8328 -6.9288 { o glu A 474 1g87A_566F_475}-10.4872 5.8845 -6.6075 { c glu A 474 1g87A_566F_475}P -9.9452 4.8328 -6.9288 { n ile A 475 1g87A_566F_475}-10.4696 3.6333 -6.6932 { ca ile A 475 1g87A_566F_475}-11.7585 3.4401 -6.0457 { c ile A 475 1g87A_566F_475}-11.6182 2.9952 -4.5939 { o ile A 475 1g87A_566F_475}-10.7055 2.2475 -4.2505 { c ile A 475 1g87A_566F_475}P -11.6182 2.9952 -4.5939 { n lys A 476 1g87A_566F_475}-12.4627 3.5189 -3.7451 { ca lys A 476 1g87A_566F_475}-12.6015 3.0408 -2.3749 { c lys A 476 1g87A_566F_475}-13.9178 2.3347 -2.3126 { o lys A 476 1g87A_566F_475}-14.9443 2.9422 -2.6187 { c lys A 476 1g87A_566F_475}P -13.9178 2.3347 -2.3126 { n ala A 477 1g87A_566F_475}-13.9215 1.0439 -2.0658 { ca ala A 477 1g87A_566F_475}-15.1723 0.2873 -2.051 { c ala A 477 1g87A_566F_475}-15.3248 -0.4103 -0.7091 { o ala A 477 1g87A_566F_475}-14.3465 -0.9109 -0.1566 { n val A 564 1g87A_566F_475}P -11.9979 -2.0151 0.4705 {"}-11.9979 -2.0151 0.4705 { ca val A 564 1g87A_566F_475}-10.9389 -2.3219 -0.4814 { c val A 564 1g87A_566F_475}-10.7074 -1.0774 -1.336 { o val A 564 1g87A_566F_475}-11.643 -0.5244 -1.9054 { c val A 564 1g87A_566F_475}P -10.7074 -1.0774 -1.336 { n gln A 565 1g87A_566F_475}-9.4594 -0.625 -1.3911 { ca gln A 565 1g87A_566F_475}-9.1111 0.5261 -2.2184 { c gln A 565 1g87A_566F_475}-8.2642 -0.0658 -3.3371 { o gln A 565 1g87A_566F_475}-7.3639 -0.8587 -3.0824 { c gln A 565 1g87A_566F_475}P -8.2642 -0.0658 -3.3371 { n phe A 566 1g87A_566F_475}-8.5786 0.2806 -4.5857 { ca phe A 566 1g87A_566F_475}-7.8301 -0.2555 -5.7097 { c phe A 566 1g87A_566F_475}-7.7657 0.7768 -6.8211 { o phe A 566 1g87A_566F_475}-8.6345 1.6352 -6.9485 { c phe A 566 1g87A_566F_475}P -7.7657 0.7768 -6.8211 { n arg A 567 1g87A_566F_475}-6.7245 0.6631 -7.6261 { ca arg A 567 1g87A_566F_475}-6.471 1.6057 -8.696 { c arg A 567 1g87A_566F_475}-6.1581 0.9067 -10.0057 { o arg A 567 1g87A_566F_475}-5.5795 -0.1805 -10.021 { c arg A 567 1g87A_566F_475}P -6.1581 0.9067 -10.0057 { n ile A 568 1g87A_566F_475}-6.5789 1.5212 -11.1089 { ca ile A 568 1g87A_566F_475}-6.2706 0.9985 -12.4275 { c ile A 568 1g87A_566F_475}-5.5772 2.1816 -13.0896 { o ile A 568 1g87A_566F_475}-6.0849 3.3085 -13.0479 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 473 1g87A_566F_475}P -7.6524 5.8527 -12.1089 { ca thr A 473 1g87A_566F_475}P -8.8156 6.0135 -11.2594 { n glu A 474 1g87A_566F_475}P -8.7758 5.6471 -8.8503 { ca glu A 474 1g87A_566F_475}P -8.6102 4.8282 -7.6526 { n ile A 475 1g87A_566F_475}P -10.4696 3.6333 -6.6932 { ca ile A 475 1g87A_566F_475}P -11.7585 3.4401 -6.0457 { n lys A 476 1g87A_566F_475}P -12.4627 3.5189 -3.7451 { ca lys A 476 1g87A_566F_475}P -12.6015 3.0408 -2.3749 { n ala A 477 1g87A_566F_475}P -13.9215 1.0439 -2.0658 { ca ala A 477 1g87A_566F_475}P -15.1723 0.2873 -2.051 { n val A 564 1g87A_566F_475}P -11.9979 -2.0151 0.4705 { ca val A 564 1g87A_566F_475}P -10.9389 -2.3219 -0.4814 { n gln A 565 1g87A_566F_475}P -9.4594 -0.625 -1.3911 { ca gln A 565 1g87A_566F_475}P -9.1111 0.5261 -2.2184 { n phe A 566 1g87A_566F_475}P -8.5786 0.2806 -4.5857 { ca phe A 566 1g87A_566F_475}P -7.8301 -0.2555 -5.7097 { n arg A 567 1g87A_566F_475}P -6.7245 0.6631 -7.6261 { ca arg A 567 1g87A_566F_475}P -6.471 1.6057 -8.696 { n ile A 568 1g87A_566F_475}P -6.5789 1.5212 -11.1089 { ca ile A 568 1g87A_566F_475}P -6.2706 0.9985 -12.4275 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca thr A 473 1g87A_566F_475}P -8.8156 6.0135 -11.2594 {"}-8.8156 6.0135 -11.2594 { ca glu A 474 1g87A_566F_475}-8.6102 4.8282 -7.6526 { ca ile A 475 1g87A_566F_475}-11.7585 3.4401 -6.0457 { ca lys A 476 1g87A_566F_475}-12.6015 3.0408 -2.3749 { ca ala A 477 1g87A_566F_475}-15.1723 0.2873 -2.051 { ca val A 564 1g87A_566F_475}P -10.9389 -2.3219 -0.4814 {"}-10.9389 -2.3219 -0.4814 { ca gln A 565 1g87A_566F_475}-9.1111 0.5261 -2.2184 { ca phe A 566 1g87A_566F_475}-7.8301 -0.2555 -5.7097 { ca arg A 567 1g87A_566F_475}-6.471 1.6057 -8.696 { ca ile A 568 1g87A_566F_475}-6.2706 0.9985 -12.4275 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ile A 475 1g87A_566F_475}P -11.7585 3.4401 -6.0457 { cb ile A 475 1g87A_566F_475}-12.5742 2.3371 -6.7927 { cg1 ile A 475 1g87A_566F_475}-12.7278 2.71 -8.2736 { cd1 ile A 475 1g87A_566F_475}-13.5149 3.9671 -8.5187 { cb ile A 475 1g87A_566F_475}P -12.5742 2.3371 -6.7927 { cg2 ile A 475 1g87A_566F_475}-13.9369 2.1174 -6.1135 { ca 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-8.0906 { cb ala A 360 1gpiA_142Y_360}P -11.7572 1.9273 -7.3476 {"}P -11.7572 1.9273 -7.3476 {"}P -11.7572 1.9273 -7.3476 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 142 A}'S' blue -9.9755 0.1484 -6.4648 {"}'S' sky -10.1306 0.0298 -6.6327 {"}'S' blue -9.8476 0.1829 -6.7012 {"}'S' sky -10.0008 0.0574 -6.8631 {"}'S' blue -10.1444 -0.1012 -7.0044 {"}'S' blue -9.8268 0.0753 -7.0583 { CD1 TYR 142 A}'S' blue -10.6435 0.2585 -5.9266 {"}'S' sky -10.8047 0.1648 -6.1083 {"}'S' sky -10.4649 0.2421 -6.1195 {"}'S' sky -10.2555 0.2002 -6.2715 {"}'S' sky -10.2027 0.0302 -6.5843 {"}'S' sky -10.3585 -0.1 -6.7488 {"}'S' blue -10.5039 -0.2631 -6.8915 { CD2 TYR 142 A}'S' blue -10.1224 -0.1492 -7.1564 {"}'S' blue -10.2836 -0.187 -7.3545 {"}'S' blue -9.888 -0.006 -7.2123 {"}'S' blue -10.0491 -0.0209 -7.4153 {"}'S' blue -10.2119 -0.0836 -7.6081 {"}'S' blue -9.9476 0.0647 -7.667 { CE1 TYR 142 A}'S' blue -12.0591 0.0402 -6.3351 {"}'S' blue -11.5535 0.1405 -6.1231 {"}'S' sky -11.7151 0.123 -6.328 {"}'S' sky -11.879 0.0663 -6.5237 {"}'S' sky -12.0401 -0.0274 -6.7055 {"}'S' blue -12.1955 -0.1571 -6.8712 {"}'S' sky -11.2177 0.1205 -6.1124 {"}'S' sky -11.8612 -0.0485 -6.897 {"}'S' sky -10.6639 -0.2638 -6.9579 { CE2 TYR 142 A}'S' blue -10.5748 -0.3012 -7.4359 {"}'S' sky -10.7102 -0.211 -7.6348 {"}'S' sky -10.8581 -0.1612 -7.8397 {"}'S' blue -11.014 -0.1556 -8.0438 {"}'S' blue -10.4371 -0.1734 -7.6836 {"}'S' blue -10.5796 -0.1075 -7.8865 {"}'S' blue -10.7315 -0.0803 -8.0901 { CZ TYR 142 A}'S' blue -12.1347 -0.163 -7.2515 {"}'S' sky -11.7002 -0.1149 -7.0941 {"}'S' sky -11.8521 -0.0877 -7.2977 {"}'S' sky -12.0098 -0.1009 -7.4982 {"}'S' blue -12.1706 -0.1534 -7.6907 {"}'S' sky -11.8265 -0.0706 -7.6836 {"}'S' blue -11.9904 -0.1273 -7.8793 {"}'S' sky -11.6482 -0.0822 -7.8781 {"}'S' sky -10.8341 -0.2639 -7.2093 {"}'S' sky -11.2775 -0.102 -7.8267 {"}'S' blue -11.4393 -0.125 -8.0305 {"}'S' sky -10.9066 -0.2056 -7.7472 {"}'S' blue -11.0625 -0.1842 -7.9548 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 142 A}'S' sea -10.6257 0.1436 -6.2998 {"}'S' sea -10.78 0.0121 -6.4635 {"}'S' sea -10.4168 0.1037 -6.4528 {"}'S' sea -10.5718 -0.0277 -6.6159 { CE1 TYR 142 A}'S' sea -11.3746 0.1349 -6.3199 {"}'S' sea -11.5367 0.1114 -6.5225 {"}'S' sea -11.7003 0.05 -6.7167 {"}'S' sea -11.0084 0.0744 -6.2636 {"}'S' green -11.1661 0.0917 -6.4711 {"}'S' green -11.3278 0.0687 -6.6749 {"}'S' green -11.491 0.008 -6.8687 {"}'S' sea -11.6522 -0.0885 -7.0499 {"}'S' green -10.951 0.0094 -6.5992 {"}'S' green -11.1126 -0.0094 -6.8038 {"}'S' green -11.2761 -0.0667 -6.9988 {"}'S' sea -10.7391 -0.1091 -6.7063 {"}'S' green -10.8967 -0.1208 -6.9071 {"}'S' sea -11.0567 -0.1721 -7.1004 { CZ TYR 142 A}'S' sea -11.5084 -0.0761 -7.2714 {"}'S' sea -11.665 -0.0532 -7.4787 {"}'S' green -11.1801 -0.1261 -7.2607 {"}'S' sea -11.3291 -0.0731 -7.468 {"}'S' sea -11.486 -0.0588 -7.6755 {"}'S' sea -10.9713 -0.173 -7.4124 {"}'S' sea -11.1199 -0.1192 -7.6193 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 360 A}'S' blue -12.217 0.3145 -6.8476 {"}'S' sky -12.0541 0.3512 -6.6469 {"}'S' sky -11.8905 0.4268 -6.4577 {"}'S' blue -11.7318 0.5387 -6.2834 {"}'S' blue -12.23 0.2439 -7.273 {"}'S' blue -12.0723 0.2294 -7.0661 {"}'S' sky -11.9101 0.2529 -6.8635 {"}'S' blue -12.1794 0.2549 -7.6455 {"}'S' sky -12.0307 0.2011 -7.4386 {"}'S' sky -11.8735 0.1848 -7.2302 {"}'S' sky -11.7114 0.2069 -7.0274 {"}'S' blue -12.0586 0.3048 -7.931 {"}'S' sky -11.9165 0.2264 -7.7258 {"}'S' blue -11.8008 0.3098 -8.0139 {"}'S' sky -11.6597 0.2429 -7.8125 {"}'S' sky -11.5074 0.2152 -7.6083 {"}'S' blue -11.4471 0.3134 -7.9481 { HB3 ALA 360 A}'S' sky -11.4935 0.4326 -6.3778 {"}'S' sky -11.0964 0.434 -6.2335 {"}'S' sky -10.7393 0.5127 -6.2043 {"}'S' blue -10.4631 0.5608 -6.2923 {"}'S' sky -11.3399 0.232 -7.7643 {"}'S' sky -10.3332 0.4259 -6.518 {"}'S' sky -11.047 0.1825 -7.7832 {"}'S' sky -10.9185 0.0817 -7.5881 {"}'S' sky -10.7712 0.0387 -7.3855 {"}'S' blue -10.6131 0.0564 -7.187 {"}'S' blue -10.4553 0.1325 -7.0042 {"}'S' sky -10.3049 0.2639 -6.8457 {"}'S' blue -10.1721 0.4428 -6.7238 {"}'S' blue -10.8097 0.2576 -7.864 {"}'S' sky -10.6748 0.1627 -7.6631 {"}'S' blue -10.519 0.1385 -7.4549 {"}'S' blue -10.3558 0.1874 -7.2583 {"}'S' blue -10.1985 0.3058 -7.0875 {"}'S' blue -10.0595 0.4827 -6.9566 {"}'S' blue -10.4354 0.2954 -7.6977 {"}'S' blue -10.2791 0.3062 -7.4985 {"}'S' blue -10.123 0.4016 -7.3239 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 360 A}'S' sea -11.7473 0.3145 -6.6687 {"}'S' sea -11.7642 0.1855 -7.5185 { HB3 ALA 360 A}'S' sea -11.5627 0.2088 -6.7733 {"}'S' green -11.4053 0.2267 -6.5743 {"}'S' sea -11.2472 0.3035 -6.391 {"}'S' sea -11.4929 0.1064 -7.0646 {"}'S' green -11.3409 0.0806 -6.8613 {"}'S' green -11.1815 0.1111 -6.6641 {"}'S' green -11.0231 0.1976 -6.4827 {"}'S' sea -10.8738 0.3336 -6.3267 {"}'S' sea -11.4692 0.1466 -7.4772 {"}'S' green -11.3385 0.0523 -7.2821 {"}'S' green -11.1912 0.0106 -7.0798 {"}'S' green -11.0356 0.0226 -6.882 {"}'S' green -10.877 0.0871 -6.6952 {"}'S' sea -10.724 0.2031 -6.5298 {"}'S' sea -10.5846 0.3639 -6.3929 {"}'S' sea -11.2237 0.1002 -7.5788 {"}'S' green -11.0872 0.0188 -7.3787 {"}'S' sea -10.9348 -0.0061 -7.175 {"}'S' sea -10.7754 0.0243 -6.9778 {"}'S' sea -10.6174 0.1101 -6.7968 {"}'S' sea -10.4673 0.2459 -6.6414 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 142 A}'M' greentint -9.2568 2.3174 -6.1758 {"}'M' greentint -9.0145 2.713 -5.9725 {"}'M' greentint -9.1631 2.5561 -6.121 {"}'M' greentint -9.2668 2.4597 -6.4185 {"}'M' greentint -9.3234 2.2102 -6.4218 {"}'M' greentint -8.8653 2.9431 -6.0347 {"}'M' greentint -9.0239 2.85 -6.2131 {"}'M' greentint -9.1631 2.682 -6.3463 {"}'M' greentint -9.2364 2.5537 -6.6633 {"}'M' greentint -9.3076 2.3086 -6.6875 {"}'M' greentint -9.3382 2.0549 -6.656 {"}'M' greentint -8.8385 3.074 -6.2945 {"}'M' greentint -8.9933 2.9509 -6.4592 {"}'M' greentint -9.129 2.7734 -6.5854 {"}'M' greentint -9.1585 2.6339 -6.9016 {"}'M' greentint -9.2397 2.3908 -6.9399 {"}'M' greentint -9.2871 2.1364 -6.9296 {"}'M' greentint -8.5955 3.2522 -6.3467 {"}'M' greentint -8.7576 3.17 -6.5323 {"}'M' greentint -8.9098 3.0341 -6.6923 {"}'M' greentint -9.0465 2.8525 -6.8171 {"}'M' greentint -9.044 2.6787 -7.1312 {"}'M' greentint -9.1296 2.4439 -7.1758 {"}'M' greentint -9.1861 2.1971 -7.1795 {"}'M' greentint -8.6565 3.2163 -6.779 {"}'M' greentint -8.8027 3.0727 -6.9288 {"}'M' greentint -8.9334 2.8908 -7.0473 {"}'M' greentint -8.8931 2.7005 -7.34 {"}'M' greentint -8.9816 2.4653 -7.3903 {"}'M' greentint -8.6475 3.0965 -7.134 {"}'M' greentint -8.7795 2.9135 -7.254 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 360 A}'M' greentint -9.2656 2.1584 -6.2644 {"}'M' greentint -9.1243 2.3091 -6.1227 {"}'M' greentint -9.0037 2.5034 -6.021 {"}'M' greentint -8.9112 2.7294 -5.965 {"}'M' greentint -9.3099 2.0211 -6.7122 {"}'M' greentint -9.1517 2.0848 -6.5259 {"}'M' greentint -9.0014 2.2093 -6.366 {"}'M' greentint -8.8683 2.3849 -6.2429 {"}'M' greentint -8.7631 2.5995 -6.1652 {"}'M' greentint -8.6896 2.8393 -6.1383 {"}'M' greentint -8.6566 3.0884 -6.1637 {"}'M' greentint -9.1011 2.0823 -6.8595 {"}'M' greentint -8.9404 2.1583 -6.6726 {"}'M' greentint -8.7909 2.3037 -6.5202 {"}'M' greentint -8.6663 2.5036 -6.4144 {"}'M' greentint -8.5777 2.7412 -6.3663 {"}'M' greentint -8.5332 2.996 -6.379 {"}'M' greentint -8.5365 3.2429 -6.4518 {"}'M' greentint -9.0074 2.1932 -7.1121 {"}'M' greentint -8.845 2.2381 -6.9142 {"}'M' greentint -8.6908 2.3707 -6.7525 {"}'M' greentint -8.5666 2.574 -6.6479 {"}'M' greentint -8.4883 2.8197 -6.6157 {"}'M' greentint -8.4673 3.0751 -6.659 {"}'M' greentint -8.8964 2.3766 -7.2826 {"}'M' greentint -8.7354 2.4047 -7.0826 {"}'M' greentint -8.5874 2.5567 -6.9337 {"}'M' greentint -8.4925 2.7908 -6.8764 {"}'M' greentint -8.4763 3.0445 -6.9257 {"}'M' greentint -8.7629 2.5945 -7.3361 {"}'M' greentint -8.6029 2.6914 -7.1567 {"}'M' greentint -8.548 2.9447 -7.1565 {"}'M' greentint -8.6812 2.8411 -7.3559 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 142 A}'M' greentint -9.5873 1.4786 -3.9155 {"}'M' greentint -9.7205 1.375 -4.115 {"}'M' greentint -9.5056 1.7252 -3.9353 {"}'M' greentint -9.6656 1.6283 -4.1148 {"}'M' greentint -9.776 1.5289 -4.395 {"}'M' greentint -9.7922 1.2752 -4.3457 {"}'M' greentint -9.3721 1.943 -3.9889 {"}'M' greentint -9.5331 1.915 -4.1889 {"}'M' greentint -9.6811 1.763 -4.3377 {"}'M' greentint -9.7477 1.6264 -4.6486 {"}'M' greentint -9.7981 1.3717 -4.644 {"}'M' greentint -9.7894 1.1239 -4.5636 {"}'M' greentint -9.3426 2.1161 -4.2614 {"}'M' greentint -9.5028 2.025 -4.4443 {"}'M' greentint -9.6442 1.8545 -4.5798 {"}'M' greentint -9.6508 1.7006 -4.8887 {"}'M' greentint -9.7191 1.4516 -4.9063 {"}'M' greentint -9.7396 1.1984 -4.8629 {"}'M' greentint -9.2481 2.2085 -4.5089 {"}'M' greentint -9.4048 2.0964 -4.6803 {"}'M' greentint -9.5433 1.9217 -4.811 {"}'M' greentint -9.5054 1.7202 -5.1062 {"}'M' greentint -9.2671 2.1104 -4.9054 {"}'M' greentint -9.4002 1.9348 -5.0285 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 360 A}'M' greentint -9.6186 1.2871 -3.9932 {"}'M' greentint -9.4967 1.4837 -3.8902 {"}'M' greentint -9.3983 1.7085 -3.8242 {"}'M' greentint -9.6455 1.1747 -4.3598 {"}'M' greentint -9.5001 1.3365 -4.2168 {"}'M' greentint -9.3755 1.5389 -4.1132 {"}'M' greentint -9.2791 1.772 -4.0534 {"}'M' greentint -9.2153 2.0237 -4.0408 {"}'M' greentint -9.7324 1.1666 -4.786 {"}'M' greentint -9.5727 1.2552 -4.605 {"}'M' greentint -9.426 1.4048 -4.4574 {"}'M' greentint -9.3023 1.6046 -4.3527 {"}'M' greentint -9.2104 1.8387 -4.2994 {"}'M' greentint -9.1584 2.0896 -4.301 {"}'M' greentint -9.6141 1.3371 -4.9401 {"}'M' greentint -9.4571 1.433 -4.7627 {"}'M' greentint -9.3186 1.6036 -4.6312 {"}'M' greentint -9.2157 1.8271 -4.5604 {"}'M' greentint -9.1613 2.0768 -4.56 {"}'M' greentint 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-7.6526 {"}'S' green -11.9701 0.5198 -7.4456 {"}'S' green -11.8072 0.5566 -7.2449 {"}'S' sea -11.6436 0.6322 -7.0557 {"}'S' green -11.8253 0.4348 -7.6641 {"}'S' green -11.6632 0.4583 -7.4615 {"}'S' sea -11.5004 0.5199 -7.2667 {"}'S' sea -12.2968 0.8352 -8.8185 {"}'S' green -12.1918 0.6775 -8.639 {"}'S' green -11.6266 0.3902 -7.8282 {"}'S' sea -12.0483 0.7749 -8.9094 {"}'S' green -11.9384 0.6258 -8.7252 {"}'S' sea -11.7941 0.758 -8.9904 {"}'S' green -11.6823 0.6187 -8.8075 {"}'S' green -11.469 0.6955 -8.9438 {"}'S' green -11.3421 0.5868 -8.7488 {"}'S' green -11.2326 0.7782 -9.0189 {"}'S' green -11.1014 0.6729 -8.8206 {"}'S' sea -10.9942 0.8843 -9.0573 { HB1 ALA 7 A}'S' sea -12.8685 0.5965 -8.1304 {"}'S' green -12.7211 0.5548 -7.9281 {"}'S' sea -12.5656 0.5668 -7.7302 {"}'S' green -12.7537 0.6445 -8.4271 {"}'S' green -12.6171 0.5631 -8.227 {"}'S' green -12.4648 0.5381 -8.0233 {"}'S' green -12.3054 0.5686 -7.8261 {"}'S' sea -12.5769 0.7267 -8.6315 {"}'S' green -12.4485 0.626 -8.4364 { HB3 ALA 7 A}'S' green -11.3438 0.3682 -7.4777 {"}'S' sea -11.1864 0.3862 -7.2786 {"}'S' green -11.2739 0.2659 -7.769 {"}'S' green -11.122 0.2401 -7.5657 {"}'S' sea -10.9626 0.2706 -7.3684 {"}'S' sea -10.8041 0.3571 -7.187 {"}'S' green -11.1195 0.2117 -7.9865 {"}'S' green -10.9722 0.1701 -7.7842 {"}'S' sea -10.8167 0.1821 -7.5863 {"}'S' sea -10.658 0.2465 -7.3996 {"}'S' sea -10.5051 0.3626 -7.2341 {"}'S' green -10.7158 0.1533 -7.8794 {"}'S' sea -10.5564 0.1838 -7.6821 {"}'S' green -10.3984 0.2695 -7.5011 {"}'S' sea -10.2483 0.4054 -7.3458 {"}'S' green -11.0017 0.6911 -8.808 {"}'S' green -10.5523 0.1981 -8.0899 {"}'S' green -10.3941 0.2159 -7.8914 {"}'S' green -10.2364 0.2919 -7.7086 {"}'S' sea -10.086 0.4233 -7.55 {"}'S' green -10.7589 0.7847 -8.8889 {"}'S' green -10.1368 0.3469 -7.9627 {"}'S' sea -9.9796 0.4653 -7.7919 {"}'S' green -10.4562 0.6827 -8.7766 {"}'S' green -10.3536 0.5299 -8.6015 {"}'S' green -10.2165 0.4549 -8.4021 {"}'S' green -10.0601 0.4657 -8.2028 {"}'S' sea -9.904 0.561 -8.0283 {"}'S' sea -10.0653 0.6501 -8.493 {"}'S' sea -9.9018 0.6787 -8.2897 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB ALA 7 A}'S' P -12.2697 0.5924 -8.2817 {"}'S' -12.2676 0.5946 -8.281 {"}'S' P -12.1321 0.5023 -8.0783 {"}'S' -12.1219 0.5274 -8.0768 {"}'S' P -11.983 0.4493 -7.871 {"}'S' -11.9794 0.4619 -7.8723 {"}'S' P -12.0699 0.5521 -8.4455 {"}'S' -12.058 0.5854 -8.4351 {"}'S' P -11.9325 0.4603 -8.2435 {"}'S' -11.9172 0.5209 -8.233 {"}'S' P -11.7838 0.4065 -8.0366 {"}'S' -11.776 0.4551 -8.0336 {"}'S' P -11.8117 0.5102 -8.529 {"}'S' -11.8029 0.5539 -8.5134 {"}'S' P -11.6696 0.4318 -8.3238 {"}'S' -11.6646 0.4894 -8.3112 {"}'S' P -11.5173 0.3909 -8.1165 {"}'S' -11.5169 0.4232 -8.1131 {"}'S' P -11.5539 0.5151 -8.6119 {"}'S' -11.5538 0.5268 -8.6076 {"}'S' P -11.4128 0.4483 -8.4105 {"}'S' -11.4131 0.4619 -8.4072 { HB1 ALA 7 A}'S' P -12.3012 0.5829 -8.2338 {"}'S' -12.3007 0.5851 -8.2336 { HB3 ALA 7 A}'S' P -11.4113 0.3474 -7.9685 {"}'S' -11.4074 0.3538 -7.968 {"}'S' P -11.2502 0.3061 -8.1815 {"}'S' -11.2417 0.3235 -8.1756 {"}'S' P -11.1209 0.3915 -8.4686 {"}'S' -11.1106 0.419 -8.4506 {"}'S' P -11.0048 0.2597 -8.2832 {"}'S' -10.9966 0.2985 -8.2672 {"}'S' P -10.8682 0.1783 -8.0831 {"}'S' -10.8675 0.1864 -8.0823 {"}'S' P -10.9306 0.4947 -8.6627 {"}'S' -10.9259 0.5211 -8.6366 {"}'S' P -10.828 0.342 -8.4876 {"}'S' -10.825 0.3969 -8.4516 {"}'S' P -10.6996 0.2412 -8.2924 {"}'S' -10.7022 0.2841 -8.2752 {"}'S' P -10.6944 0.5758 -8.7463 {"}'S' -10.6946 0.5801 -8.7424 {"}'S' P -10.5907 0.4171 -8.5683 {"}'S' -10.5963 0.4451 -8.5464 {"}'S' P -10.4558 0.3222 -8.3674 {"}'S' -10.4583 0.3311 -8.3626 {"}'S' P -10.3001 0.298 -8.1593 {"}'S' -10.3034 0.3064 -8.1572 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 38 A}'M' green -9.1149 2.1863 -5.7538 {"}'M' green -9.2585 2.0786 -6.0263 {"}'M' green -8.5239 2.8828 -5.7492 {"}'M' green -8.4368 3.0369 -5.9951 {"}'M' green -8.5024 3.0763 -6.4561 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 38 A}'M' greentint -8.853 2.5076 -5.6212 {"}'M' greentint -9.0162 2.4742 -5.823 {"}'M' greentint -9.1648 2.3173 -5.9715 {"}'M' greentint -9.2686 2.2209 -6.269 {"}'M' greentint -8.7091 2.7127 -5.6832 {"}'M' greentint -8.867 2.7043 -5.8852 {"}'M' greentint -9.0256 2.6112 -6.0636 {"}'M' greentint -9.1648 2.4432 -6.1967 {"}'M' greentint -9.2382 2.3149 -6.5138 {"}'M' greentint -8.68 2.8934 -5.953 {"}'M' greentint -8.8402 2.8352 -6.145 {"}'M' greentint -8.995 2.7121 -6.3097 {"}'M' greentint -9.1307 2.5346 -6.4359 {"}'M' greentint -8.5969 3.0128 -6.1964 {"}'M' greentint -8.7593 2.9312 -6.3828 {"}'M' greentint -8.9116 2.7953 -6.5428 {"}'M' greentint -9.0482 2.6137 -6.6676 {"}'M' greentint -8.6582 2.9775 -6.6294 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 7 A}'M' greentint -9.1381 2.1764 -5.8823 {"}'M' greentint -8.9879 2.3009 -5.7225 {"}'M' greentint -8.8547 2.4765 -5.5994 {"}'M' greentint -9.2457 2.1717 -6.4196 {"}'M' greentint -9.0875 2.1739 -6.2159 {"}'M' greentint -8.9269 2.2499 -6.029 {"}'M' greentint -8.7773 2.3952 -5.8766 {"}'M' greentint -8.6528 2.5952 -5.7708 {"}'M' greentint -8.5642 2.8328 -5.7228 {"}'M' greentint -9.1426 2.3344 -6.6747 {"}'M' greentint -8.9938 2.2847 -6.4686 {"}'M' greentint -8.8315 2.3296 -6.2706 {"}'M' greentint -8.6773 2.4623 -6.1089 {"}'M' greentint -8.553 2.6656 -6.0043 {"}'M' greentint -8.4747 2.9113 -5.9722 {"}'M' greentint -8.8829 2.4682 -6.639 {"}'M' greentint -8.7219 2.4963 -6.439 {"}'M' greentint -8.5738 2.6482 -6.2902 {"}'M' greentint -8.479 2.8823 -6.2328 {"}'M' greentint -8.7494 2.686 -6.6925 {"}'M' greentint -8.5894 2.783 -6.5131 {"}'M' greentint -8.5344 3.0362 -6.5129 {"}'M' greentint -8.6677 2.9326 -6.7124 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 38 A}'M' greentint -9.9943 0.7982 -4.2721 {"}'M' greentint -10.1276 0.6946 -4.4716 {"}'M' greentint -9.9127 1.0448 -4.292 {"}'M' greentint -10.0726 0.9479 -4.4714 {"}'M' greentint -10.183 0.8485 -4.7517 {"}'M' greentint -10.1993 0.5948 -4.7024 {"}'M' greentint -9.7792 1.2626 -4.3455 {"}'M' greentint -9.9402 1.2346 -4.5455 {"}'M' greentint -10.0882 1.0826 -4.6943 {"}'M' greentint -10.1547 0.946 -5.0053 {"}'M' greentint -10.2051 0.6913 -5.0006 {"}'M' greentint -9.5908 1.4325 -4.4121 {"}'M' greentint -9.7496 1.4357 -4.618 {"}'M' greentint -9.9099 1.3446 -4.8009 {"}'M' greentint -10.0513 1.1741 -4.9365 {"}'M' greentint -10.0579 1.0202 -5.2453 {"}'M' greentint -10.1262 0.7712 -5.263 {"}'M' greentint -9.4939 1.5672 -4.6676 {"}'M' greentint -9.6552 1.5281 -4.8655 {"}'M' greentint -9.8118 1.416 -5.0369 {"}'M' greentint -9.9504 1.2413 -5.1676 {"}'M' greentint -9.9125 1.0398 -5.4629 {"}'M' greentint -9.986 0.8 -5.4898 {"}'M' greentint -9.5239 1.5544 -5.1022 {"}'M' greentint -9.6741 1.43 -5.262 {"}'M' greentint -9.8073 1.2544 -5.3851 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 7 A}'M' greentint -10.1664 0.4784 -4.7419 {"}'M' greentint -10.0146 0.5991 -4.5791 {"}'M' greentint -9.8743 0.7611 -4.4431 {"}'M' greentint -9.7524 0.9577 -4.3401 {"}'M' greentint -9.654 1.1825 -4.274 {"}'M' greentint -10.0591 0.5385 -4.9831 {"}'M' greentint -9.9012 0.6487 -4.8097 {"}'M' greentint -9.7559 0.8105 -4.6667 {"}'M' greentint -9.6313 1.0129 -4.5631 {"}'M' greentint -9.5348 1.246 -4.5032 {"}'M' greentint -9.471 1.4977 -4.4907 {"}'M' greentint -9.9881 0.6406 -5.2359 {"}'M' greentint -9.8284 0.7292 -5.0549 {"}'M' greentint -9.6817 0.8788 -4.9073 {"}'M' greentint -9.558 1.0785 -4.8026 {"}'M' greentint -9.4661 1.3127 -4.7493 {"}'M' greentint -9.4141 1.5636 -4.7509 {"}'M' greentint -9.8698 0.8111 -5.39 {"}'M' greentint -9.7128 0.907 -5.2126 {"}'M' greentint -9.5743 1.0776 -5.0811 {"}'M' greentint -9.4714 1.3011 -5.0102 {"}'M' greentint -9.417 1.5508 -5.0099 {"}'M' greentint -9.7312 1.0372 -5.464 {"}'M' greentint -9.5814 1.1909 -5.3132 {"}'M' greentint -9.4861 1.4272 -5.2557 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 24 1gu7A_46F_26A}P -6.5992 6.1163 -11.2526 {"}-6.5992 6.1163 -11.2526 { ca ile A 24 1gu7A_46F_26A}-7.818 6.3749 -10.5116 { c ile A 24 1gu7A_46F_26A}-7.7965 5.4782 -9.2829 { o ile A 24 1gu7A_46F_26A}-7.4276 4.3199 -9.3824 { c ile A 24 1gu7A_46F_26A}P -7.7965 5.4782 -9.2829 { n thr A 25 1gu7A_46F_26A}-8.1551 6.0185 -8.1225 { ca thr A 25 1gu7A_46F_26A}-8.2167 5.203 -6.915 { c thr A 25 1gu7A_46F_26A}-9.6963 4.8732 -6.726 { o thr A 25 1gu7A_46F_26A}-10.5214 5.778 -6.5324 { c thr A 25 1gu7A_46F_26A}P -9.6963 4.8732 -6.726 { n ala A 26 1gu7A_46F_26A}-10.0142 3.5874 -6.8174 { ca ala A 26 1gu7A_46F_26A}-11.3919 3.1059 -6.6885 { c ala A 26 1gu7A_46F_26A}-11.6361 2.3697 -5.3744 { o ala A 26 1gu7A_46F_26A}-10.6899 2.0161 -4.6618 { c ala A 26 1gu7A_46F_26A}P -11.6361 2.3697 -5.3744 { n gln A 27 1gu7A_46F_26A}-12.9076 2.1478 -5.0434 { ca gln A 27 1gu7A_46F_26A}-13.2686 1.4418 -3.8086 { c gln A 27 1gu7A_46F_26A}-14.2259 0.3102 -4.1683 { o gln A 27 1gu7A_46F_26A}-15.1354 0.523 -4.9731 { c gln A 27 1gu7A_46F_26A}P -14.2259 0.3102 -4.1683 { n ala A 28 1gu7A_46F_26A}-14.0237 -0.8711 -3.5883 { ca ala A 28 1gu7A_46F_26A}-14.916 -2.0016 -3.856 { c ala A 28 1gu7A_46F_26A}-15.3319 -2.694 -2.5728 { o ala A 28 1gu7A_46F_26A}-14.5403 -2.8086 -1.6322 { n gln A 44 1gu7A_46F_26A}P -12.3855 -2.1463 0.0595 {"}-12.3855 -2.1463 0.0595 { ca gln A 44 1gu7A_46F_26A}-11.0132 -2.2304 -0.409 { c gln A 44 1gu7A_46F_26A}-10.7077 -1.1424 -1.4172 { o gln A 44 1gu7A_46F_26A}-11.4586 -0.9269 -2.3662 { c gln A 44 1gu7A_46F_26A}P -10.7077 -1.1424 -1.4172 { n ser A 45 1gu7A_46F_26A}-9.5733 -0.4549 -1.2165 { ca ser A 45 1gu7A_46F_26A}-9.209 0.5639 -2.1746 { c ser A 45 1gu7A_46F_26A}-8.3354 -0.1134 -3.2338 { o ser A 45 1gu7A_46F_26A}-7.5493 -1.0063 -2.9125 { c ser A 45 1gu7A_46F_26A}P -8.3354 -0.1134 -3.2338 { n phe A 46 1gu7A_46F_26A}-8.4956 0.2623 -4.5023 { ca phe A 46 1gu7A_46F_26A}-7.6642 -0.3335 -5.5557 { c phe A 46 1gu7A_46F_26A}-7.4404 0.6803 -6.6723 { o 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{"}'M' P -8.5486 2.3582 -6.6407 {"}'M' -8.549 2.3588 -6.6414 {"}'M' P -8.7274 2.0926 -7.1405 {"}'M' -8.7317 2.0981 -7.1391 {"}'M' P -8.5732 2.2252 -6.9788 {"}'M' -8.6062 2.2528 -6.9789 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 26 A}'M' greentint -9.4381 2.0267 -6.4393 {"}'M' greentint -9.287 2.151 -6.28 {"}'M' greentint -9.1552 2.3259 -6.1568 {"}'M' greentint -9.4595 1.8783 -6.8551 {"}'M' greentint -9.3029 1.9157 -6.6632 {"}'M' greentint -9.1479 2.0129 -6.4907 {"}'M' greentint -9.0066 2.1637 -6.3491 {"}'M' greentint -8.886 2.3579 -6.2474 {"}'M' greentint -8.7936 2.5839 -6.1914 {"}'M' greentint -9.3465 1.8764 -7.1376 {"}'M' greentint -9.1922 1.8757 -6.9385 {"}'M' greentint -9.034 1.9394 -6.7522 {"}'M' greentint -8.8838 2.0638 -6.5924 {"}'M' greentint -8.7506 2.2394 -6.4693 {"}'M' greentint -8.6454 2.4541 -6.3915 {"}'M' greentint -8.5719 2.6939 -6.3646 {"}'M' greentint -8.5389 2.9429 -6.39 {"}'M' greentint -9.283 2.0077 -7.4926 {"}'M' greentint -9.1416 1.9346 -7.2895 {"}'M' greentint -8.9834 1.9369 -7.0858 {"}'M' greentint -8.4601 2.5957 -6.5927 {"}'M' greentint -8.4155 2.8505 -6.6054 {"}'M' greentint -9.0385 2.0973 -7.5446 {"}'M' greentint -8.8897 2.0477 -7.3385 {"}'M' greentint -8.4489 2.4285 -6.8742 {"}'M' greentint -8.3706 2.6742 -6.8421 {"}'M' greentint -8.3496 2.9296 -6.8854 {"}'M' greentint -8.9105 2.3329 -7.7071 {"}'M' greentint -8.7787 2.2312 -7.5089 {"}'M' greentint -8.6177 2.2592 -7.3089 {"}'M' greentint -8.4697 2.4112 -7.1601 {"}'M' greentint -8.3749 2.6453 -7.1027 {"}'M' greentint -8.3586 2.899 -7.152 {"}'M' greentint -8.6452 2.449 -7.5624 {"}'M' greentint -8.4853 2.5459 -7.383 {"}'M' greentint -8.4303 2.7992 -7.3828 {"}'M' greentint -8.5636 2.6956 -7.5823 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 46 A}'M' greentint -9.937 1.11 -4.2136 {"}'M' greentint -10.0702 1.0063 -4.4131 {"}'M' greentint -9.7511 1.2014 -4.0556 {"}'M' greentint -9.8553 1.3565 -4.2335 {"}'M' greentint -10.0153 1.2596 -4.4129 {"}'M' greentint -10.1257 1.1602 -4.6932 {"}'M' greentint -10.142 0.9065 -4.6439 {"}'M' greentint -9.5901 1.4726 -4.0888 {"}'M' greentint -9.7218 1.5744 -4.287 {"}'M' greentint -9.8828 1.5463 -4.487 {"}'M' greentint -10.0309 1.3944 -4.6358 {"}'M' greentint -10.0974 1.2577 -4.9468 {"}'M' greentint -10.1478 1.003 -4.9421 {"}'M' greentint -10.1391 0.7552 -4.8617 {"}'M' greentint -9.5334 1.7442 -4.3536 {"}'M' greentint -9.6923 1.7474 -4.5595 {"}'M' greentint -9.8525 1.6563 -4.7424 {"}'M' greentint -9.9939 1.4858 -4.878 {"}'M' greentint -10.0005 1.332 -5.1868 {"}'M' greentint -10.0688 1.083 -5.2045 {"}'M' greentint -9.4365 1.879 -4.6091 {"}'M' greentint -9.5978 1.8398 -4.807 {"}'M' greentint -9.7545 1.7277 -4.9784 {"}'M' greentint -9.893 1.553 -5.1091 {"}'M' greentint -9.8551 1.3515 -5.4044 {"}'M' greentint -9.3083 1.9299 -4.8574 {"}'M' greentint -9.4665 1.8662 -5.0437 {"}'M' greentint -9.6168 1.7417 -5.2035 {"}'M' greentint -9.7499 1.5661 -5.3266 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 26 A}'M' greentint -10.0565 0.7739 -4.5326 {"}'M' greentint -9.9046 0.8946 -4.3697 {"}'M' greentint -9.7643 1.0565 -4.2337 {"}'M' greentint -9.6424 1.2532 -4.1307 {"}'M' greentint -10.1117 0.7783 -4.9679 {"}'M' greentint -9.9491 0.834 -4.7738 {"}'M' greentint -9.7912 0.9442 -4.6003 {"}'M' greentint -9.6459 1.1059 -4.4573 {"}'M' greentint -9.5213 1.3083 -4.3537 {"}'M' greentint -9.4248 1.5415 -4.2939 {"}'M' greentint -10.0373 0.9137 -5.227 {"}'M' greentint -9.8781 0.9361 -5.0265 {"}'M' greentint -9.7184 1.0247 -4.8455 {"}'M' greentint -9.5717 1.1743 -4.6979 {"}'M' greentint -9.448 1.374 -4.5932 {"}'M' greentint -9.3561 1.6082 -4.5399 {"}'M' greentint -9.3041 1.8591 -4.5415 {"}'M' greentint -9.9187 1.0956 -5.3815 {"}'M' greentint -9.7598 1.1066 -5.1806 {"}'M' greentint -9.6028 1.2025 -5.0033 {"}'M' greentint -9.4644 1.3731 -4.8717 {"}'M' greentint -9.3614 1.5965 -4.8009 {"}'M' greentint -9.307 1.8463 -4.8006 {"}'M' greentint -9.7844 1.3035 -5.4573 {"}'M' greentint -9.6212 1.3327 -5.2546 {"}'M' greentint -9.4714 1.4864 -5.1038 {"}'M' greentint -9.3762 1.7227 -5.0463 {"}'M' greentint -9.513 1.6306 -5.3149 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 79 1guiA_81F_119F}P -11.847 -1.6384 1.0401 {"}-11.847 -1.6384 1.0401 { ca ile A 79 1guiA_81F_119F}-11.2812 -2.2009 -0.1754 { c ile A 79 1guiA_81F_119F}-10.8762 -1.0478 -1.0864 { o ile A 79 1guiA_81F_119F}-11.7355 -0.2165 -1.4288 { c ile A 79 1guiA_81F_119F}P -10.8762 -1.0478 -1.0864 { n ser A 80 1guiA_81F_119F}-9.6101 -1.0156 -1.5232 { ca ser A 80 1guiA_81F_119F}-9.1384 0.0692 -2.4009 { c ser A 80 1guiA_81F_119F}-8.2223 -0.4524 -3.4871 { o ser A 80 1guiA_81F_119F}-7.4631 -1.3972 -3.2693 { c ser A 80 1guiA_81F_119F}P -8.2223 -0.4524 -3.4871 { n phe A 81 1guiA_81F_119F}-8.2725 0.1925 -4.6548 { ca phe A 81 1guiA_81F_119F}-7.3753 -0.112 -5.7565 { c phe A 81 1guiA_81F_119F}-7.3045 1.0226 -6.7869 { o phe A 81 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1guiA_81F_119F}P -11.2812 -2.2009 -0.1754 { n ser A 80 1guiA_81F_119F}P -9.6101 -1.0156 -1.5232 { ca ser A 80 1guiA_81F_119F}P -9.1384 0.0692 -2.4009 { n phe A 81 1guiA_81F_119F}P -8.2725 0.1925 -4.6548 { ca phe A 81 1guiA_81F_119F}P -7.3753 -0.112 -5.7565 { n lys A 82 1guiA_81F_119F}P -6.2095 1.0578 -7.5385 { ca lys A 82 1guiA_81F_119F}P -6.0238 1.9215 -8.6969 { n ala A 83 1guiA_81F_119F}P -6.7107 1.6325 -11.0274 { ca ala A 83 1guiA_81F_119F}P -6.852 0.927 -12.3001 { n gln A 117 1guiA_81F_119F}P -7.0825 6.0281 -12.1374 { ca gln A 117 1guiA_81F_119F}P -8.0036 6.4938 -11.0811 { n thr A 118 1guiA_81F_119F}P -8.504 6.0331 -8.7395 { ca thr A 118 1guiA_81F_119F}P -8.6193 5.2753 -7.4937 { n phe A 119 1guiA_81F_119F}P -10.3711 3.8624 -6.628 { ca phe A 119 1guiA_81F_119F}P -11.7067 3.3871 -6.25 { n thr A 120 1guiA_81F_119F}P -12.5099 3.2786 -3.9155 { ca thr A 120 1guiA_81F_119F}P -12.4788 2.8697 -2.5032 { n phe A 121 1guiA_81F_119F}P -14.1088 1.4652 -1.3345 { ca phe A 121 1guiA_81F_119F}P 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-7.7648 -1.441 -6.4384 { cd1 phe A 81 1guiA_81F_119F}P -10.2485 -1.6552 -6.2639 { cd2 phe A 81 1guiA_81F_119F}P -9.3157 -1.1699 -8.4166 { ce1 phe A 81 1guiA_81F_119F}P -11.5227 -1.6419 -6.7969 { ce2 phe A 81 1guiA_81F_119F}P -10.6376 -1.1607 -8.9557 { cz phe A 81 1guiA_81F_119F}P -11.7167 -1.3945 -8.1285 { cb phe A 119 1guiA_81F_119F}P -12.1549 2.2669 -7.2186 {"}P -12.1549 2.2669 -7.2186 { cd1 phe A 119 1guiA_81F_119F}P -13.1644 3.2372 -9.3188 { cd2 phe A 119 1guiA_81F_119F}P -10.914 2.4569 -9.4092 { ce1 phe A 119 1guiA_81F_119F}P -13.0848 3.6263 -10.6624 { ce2 phe A 119 1guiA_81F_119F}P -10.8446 2.8144 -10.7424 { cz phe A 119 1guiA_81F_119F}P -11.9356 3.4162 -11.3712 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 81 A}'S' sky -11.6252 0.0441 -6.3393 {"}'S' sky -11.7771 0.0713 -6.5428 {"}'S' sky -12.0956 0.0056 -6.9358 {"}'S' blue -11.2865 0.0221 -6.3088 {"}'S' sky -11.105 0.0329 -6.5058 {"}'S' sky -11.0449 0.0398 -6.8644 {"}'S' sky 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{"}'S' sky -11.0388 0.0647 -7.441 {"}'S' sky -11.4481 0.3333 -8.0447 {"}'S' blue -10.9531 0.1425 -7.786 {"}'S' blue -11.0903 0.2334 -7.989 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 81 A}'S' sea -11.9347 0.0582 -6.7433 {"}'S' sea -11.4333 0.0829 -6.5165 {"}'S' green -11.59 0.1059 -6.7238 {"}'S' green -11.7515 0.0884 -6.9287 {"}'S' sea -11.9154 0.0318 -7.1244 {"}'S' sea -11.2541 0.086 -6.7131 {"}'S' green -11.411 0.1003 -6.9206 {"}'S' green -11.5732 0.0768 -7.1232 {"}'S' sea -11.2025 0.0571 -7.0718 { CE2 PHE 81 A}'S' sea -11.0496 0.5394 -8.9022 {"}'S' sea -10.7048 0.5871 -8.8827 {"}'S' sea -10.8664 0.5696 -9.0876 {"}'S' sea -11.0303 0.5129 -9.2833 {"}'S' sea -10.5259 0.5815 -9.0794 {"}'S' sea -10.688 0.558 -9.282 {"}'S' sea -10.8516 0.4965 -9.4762 {"}'S' sea -10.4791 0.5153 -9.4345 { CZ PHE 81 A}'S' sea -11.8144 0.0979 -7.2202 {"}'S' green -11.9498 0.1881 -7.4191 {"}'S' sea -12.0978 0.2379 -7.6241 {"}'S' green -11.5488 0.1227 -7.273 {"}'S' green -11.6768 0.2257 -7.4679 {"}'S' green -11.8192 0.2915 -7.6708 {"}'S' sea -11.9711 0.3187 -7.8744 {"}'S' sea -11.2275 0.0374 -7.2484 {"}'S' green -11.3462 0.1711 -7.4394 {"}'S' green -11.4805 0.2695 -7.6404 {"}'S' sea -11.6273 0.3303 -7.8481 {"}'S' sea -11.1611 0.1893 -7.6349 {"}'S' sea -11.299 0.2803 -7.8374 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 119 A}'S' blue -12.4564 0.6444 -7.802 {"}'S' blue -12.3143 0.566 -7.5967 {"}'S' blue -12.1986 0.6494 -7.8848 {"}'S' blue -11.9868 0.7211 -8.0218 {"}'S' blue -11.7461 0.8071 -8.0936 { CD2 PHE 119 A}'S' blue -11.3739 0.844 -8.9091 {"}'S' blue -11.211 0.8808 -8.7085 {"}'S' blue -11.3868 0.7735 -9.3345 {"}'S' sky -11.2291 0.759 -9.1276 {"}'S' sky -10.9042 0.844 -8.7302 {"}'S' blue -10.7438 0.9417 -8.5504 {"}'S' sky -11.1876 0.7307 -9.5002 {"}'S' sky -10.5447 0.8937 -8.7133 {"}'S' blue -11.0734 0.756 -9.7873 {"}'S' blue -10.2768 0.942 -8.8093 {"}'S' blue -10.8166 0.7725 -9.8741 {"}'S' sky -10.6642 0.7447 -9.6698 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{"}'S' sea -10.5066 0.7565 -9.469 { HB2 PHE 119 A}'S' sea -11.8754 0.2979 -6.7648 {"}'S' sea -11.716 0.3284 -6.5676 {"}'S' sea -12.0037 0.3639 -7.3807 {"}'S' sea -11.873 0.2695 -7.1856 {"}'S' green -11.7256 0.2278 -6.9833 {"}'S' green -11.5701 0.2398 -6.7854 {"}'S' sea -11.4115 0.3043 -6.5987 {"}'S' sea -11.8744 0.4492 -7.6677 {"}'S' green -11.7582 0.3174 -7.4823 {"}'S' green -11.6217 0.2361 -7.2822 {"}'S' green -11.4693 0.2111 -7.0785 {"}'S' green -11.3099 0.2416 -6.8813 {"}'S' sea -11.684 0.5525 -7.8618 {"}'S' green -11.5814 0.3997 -7.6867 {"}'S' green -11.453 0.299 -7.4916 {"}'S' green -11.3057 0.2559 -7.289 {"}'S' sea -11.148 0.2729 -7.091 {"}'S' sea -11.3442 0.4748 -7.7675 {"}'S' sea -11.2093 0.38 -7.5666 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 81 A}'M' green -9.3853 2.2274 -6.2181 {"}'M' green -8.7728 3.1174 -6.9204 {"}'M' green -9.0748 2.8751 -7.2437 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 81 A}'M' greentint 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-13.2116 0.8193 -7.0372 {"}'S' green -13.4755 1.0116 -7.4314 {"}'S' sea -13.6297 1.0293 -7.636 {"}'S' green -12.8814 0.7654 -6.9135 {"}'S' green -13.3954 1.1725 -7.6919 {"}'S' green -12.6401 0.8408 -6.9804 {"}'S' green -12.7378 1.0047 -7.153 {"}'S' green -13.1387 1.2738 -7.7452 {"}'S' sea -13.2946 1.2794 -7.9493 {"}'S' green -12.477 1.0209 -7.2104 {"}'S' green -12.5897 1.1586 -7.3941 {"}'S' green -12.7177 1.2616 -7.5891 {"}'S' green -12.8601 1.3275 -7.792 {"}'S' sea -13.012 1.3546 -7.9956 {"}'S' sea -12.3871 1.207 -7.5606 {"}'S' sea -12.5215 1.3054 -7.7616 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 102 A}'S' P -13.3332 0.9413 -7.2294 {"}'S' -13.3303 0.9328 -7.2356 {"}'S' P -12.9803 0.9311 -7.0882 {"}'S' -12.9788 0.9196 -7.099 {"}'S' P -13.1025 1.0574 -7.2807 {"}'S' -13.0933 1.0183 -7.3071 {"}'S' P -13.2424 1.1383 -7.4835 {"}'S' -13.2341 1.1132 -7.4973 {"}'S' P -12.8553 1.1338 -7.3414 {"}'S' -12.8538 1.1053 -7.3584 {"}'S' P -12.9908 1.224 -7.5403 {"}'S' -12.9869 1.2001 -7.5517 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 86 A}'S' sky -13.7285 0.9756 -7.1042 {"}'S' sky -13.5978 0.8812 -6.9092 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 86 A}'S' sea -13.6869 1.2371 -7.5548 {"}'S' green -13.5992 1.0609 -7.3913 {"}'S' green -13.483 0.9292 -7.2059 {"}'S' green -13.3465 0.8478 -7.0058 {"}'S' sea -13.1941 0.8228 -6.8021 {"}'S' sea -13.4799 1.3606 -7.7307 {"}'S' green -13.4088 1.1642 -7.5854 {"}'S' green -13.0305 0.8676 -7.0126 {"}'S' sea -12.8728 0.8846 -6.8145 {"}'S' sea -13.2371 1.4542 -7.8116 {"}'S' green -13.1727 1.2453 -7.669 {"}'S' green -12.7783 0.9675 -7.082 {"}'S' sea -12.6151 1.0164 -6.8854 {"}'S' sea -12.9896 1.5634 -7.828 {"}'S' green -12.9345 1.3522 -7.6993 {"}'S' green -12.5384 1.1351 -7.1255 {"}'S' green -12.677 1.4223 -7.6164 {"}'S' green -12.5436 1.3195 -7.4157 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 86 A}'S' P -13.3063 1.0114 -7.4103 {"}'S' -13.3056 1.0336 -7.3957 {"}'S' P -13.1778 0.9107 -7.2151 {"}'S' -13.1799 0.9388 -7.2039 {"}'S' P -13.069 1.0865 -7.491 {"}'S' -13.0758 1.1214 -7.4639 {"}'S' P -12.9341 0.9917 -7.2902 {"}'S' -12.9451 1.028 -7.2708 {"}'S' P -12.8319 1.1994 -7.5242 {"}'S' -12.837 1.2099 -7.5149 {"}'S' P -12.6947 1.1244 -7.3248 {"}'S' -12.6947 1.1244 -7.3248 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 102 A}'M' green -9.6687 2.3131 -7.5238 {"}'M' green -9.4273 2.7072 -7.3214 {"}'M' green -9.5581 2.5252 -7.4399 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 102 A}'M' greentint -9.7378 2.0595 -6.2959 {"}'M' greentint -9.8814 1.9518 -6.5684 {"}'M' greentint -9.6391 2.3474 -6.3651 {"}'M' greentint -9.7877 2.1905 -6.5136 {"}'M' greentint -9.8914 2.0941 -6.8111 {"}'M' greentint -9.948 1.8446 -6.8144 {"}'M' greentint -9.4899 2.5775 -6.4273 {"}'M' greentint -9.6485 2.4844 -6.6057 {"}'M' greentint -9.7877 2.3164 -6.7389 {"}'M' greentint -9.861 2.1881 -7.0559 {"}'M' greentint -9.9322 1.943 -7.0801 {"}'M' greentint -9.4631 2.7084 -6.6871 {"}'M' greentint -9.6179 2.5853 -6.8518 {"}'M' greentint -9.7536 2.4078 -6.978 {"}'M' greentint -9.7832 2.2683 -7.2942 {"}'M' greentint -9.8644 2.0252 -7.3325 {"}'M' greentint -9.3822 2.8045 -6.9249 {"}'M' greentint -9.5345 2.6685 -7.0849 {"}'M' greentint -9.6711 2.4869 -7.2097 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ALA 86 A}'M' green -9.6359 2.2416 -6.2272 {"}'M' green -9.9739 1.7244 -6.9215 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 86 A}'M' greentint -9.7411 2.0269 -6.305 {"}'M' greentint -9.8133 1.8004 -6.7346 {"}'M' greentint -9.6637 1.9457 -6.5822 {"}'M' greentint -9.5392 2.1457 -6.4764 {"}'M' greentint -9.4506 2.3833 -6.4283 {"}'M' greentint -9.4061 2.638 -6.441 {"}'M' greentint -9.8802 1.8352 -7.1742 {"}'M' greentint -9.7179 1.8801 -6.9762 {"}'M' greentint -9.5637 2.0128 -6.8145 {"}'M' greentint -9.4394 2.2161 -6.7099 {"}'M' greentint -9.3611 2.4618 -6.6778 {"}'M' greentint -9.3402 2.7172 -6.7211 {"}'M' greentint -9.7692 2.0187 -7.3446 {"}'M' greentint -9.6082 2.0468 -7.1446 {"}'M' greentint -9.4602 2.1987 -6.9958 {"}'M' greentint -9.3654 2.4328 -6.9384 {"}'M' greentint -9.3491 2.6865 -6.9877 {"}'M' greentint -9.6357 2.2365 -7.3981 {"}'M' greentint -9.4758 2.3335 -7.2187 {"}'M' greentint -9.4208 2.5867 -7.2185 {"}'M' greentint -9.5541 2.4831 -7.418 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 102 A}'M' green -10.2287 0.7345 -4.5009 {"}'M' green -10.0428 0.8259 -4.3429 {"}'M' green -9.6 1.5544 -5.1447 {"}'M' green -9.7582 1.4907 -5.331 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 102 A}'M' greentint -10.147 0.981 -4.5208 {"}'M' greentint -10.307 0.8841 -4.7002 {"}'M' greentint -10.4173 0.7847 -4.9805 {"}'M' greentint -9.8817 1.0971 -4.3761 {"}'M' greentint -10.0135 1.1989 -4.5743 {"}'M' greentint -10.1745 1.1708 -4.7743 {"}'M' greentint -10.3225 1.0189 -4.9231 {"}'M' greentint -10.3891 0.8822 -5.2341 {"}'M' greentint -9.6902 1.2739 -4.44 {"}'M' greentint -9.8251 1.3687 -4.6409 {"}'M' greentint -9.984 1.3719 -4.8468 {"}'M' greentint -10.1442 1.2808 -5.0297 {"}'M' greentint -10.2856 1.1103 -5.1653 {"}'M' greentint -9.5765 1.468 -4.6913 {"}'M' greentint -9.7282 1.5034 -4.8964 {"}'M' greentint -9.8895 1.4643 -5.0943 {"}'M' greentint -10.0461 1.3522 -5.2657 {"}'M' greentint -10.1847 1.1775 -5.3964 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 86 A}'M' green -10.3553 0.6845 -4.6096 {"}'M' green -10.1972 0.7585 -4.4258 {"}'M' green -10.0454 0.8792 -4.263 {"}'M' green -9.5887 1.3587 -4.4865 {"}'M' green -10.1978 1.1571 -5.4763 {"}'M' green -9.8125 1.5179 -5.3857 {"}'M' green -9.6537 1.6152 -5.2081 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 86 A}'M' greentint -10.4096 0.7675 -5.0668 {"}'M' greentint -10.2524 0.7629 -4.8612 {"}'M' greentint -10.0898 0.8186 -4.667 {"}'M' greentint -9.932 0.9288 -4.4935 {"}'M' greentint -9.7866 1.0906 -4.3506 {"}'M' greentint -10.3261 0.9453 -5.3247 {"}'M' greentint -10.1781 0.8983 -5.1202 {"}'M' greentint -10.0189 0.9207 -4.9197 {"}'M' greentint -9.8591 1.0093 -4.7387 {"}'M' greentint -9.7124 1.1589 -4.5912 {"}'M' greentint -10.0594 1.0802 -5.2747 {"}'M' greentint -9.9006 1.0912 -5.0738 {"}'M' greentint -9.7436 1.1871 -4.8965 {"}'M' greentint -9.6051 1.3577 -4.765 {"}'M' greentint -9.9251 1.2881 -5.3505 {"}'M' greentint -9.762 1.3173 -5.1479 {"}'M' greentint -9.6122 1.471 -4.997 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 86 1gwyA_88F_100V}P -12.0173 -2.1285 0.721 {"}-12.0173 -2.1285 0.721 { ca ala A 86 1gwyA_88F_100V}-10.7813 -2.0281 -0.0375 { c ala A 86 1gwyA_88F_100V}-10.7088 -0.8405 -0.9732 { o ala A 86 1gwyA_88F_100V}-11.7016 -0.1663 -1.2452 { c ala A 86 1gwyA_88F_100V}P -10.7088 -0.8405 -0.9732 { n ala A 87 1gwyA_88F_100V}-9.4967 -0.601 -1.4527 { ca ala A 87 1gwyA_88F_100V}-9.2323 0.4353 -2.4283 { c ala A 87 1gwyA_88F_100V}-8.4448 -0.2936 -3.5113 { o ala A 87 1gwyA_88F_100V}-7.5993 -1.1365 -3.2058 { c ala A 87 1gwyA_88F_100V}P -8.4448 -0.2936 -3.5113 { n phe A 88 1gwyA_88F_100V}-8.7609 -0.0305 -4.7707 { ca phe A 88 1gwyA_88F_100V}-8.0199 -0.6424 -5.862 { c phe A 88 1gwyA_88F_100V}-7.7459 0.4712 -6.8541 { o phe A 88 1gwyA_88F_100V}-8.4079 1.5121 -6.826 { c phe A 88 1gwyA_88F_100V}P -7.7459 0.4712 -6.8541 { n ala A 89 1gwyA_88F_100V}-6.774 0.2711 -7.7273 { ca ala A 89 1gwyA_88F_100V}-6.436 1.3429 -8.6411 { c ala A 89 1gwyA_88F_100V}-6.1056 0.9037 -10.0477 { o ala A 89 1gwyA_88F_100V}-5.5835 -0.1845 -10.2717 { c ala A 89 1gwyA_88F_100V}P -6.1056 0.9037 -10.0477 { n tyr A 90 1gwyA_88F_100V}-6.4205 1.7835 -10.9917 { ca tyr A 90 1gwyA_88F_100V}-6.1517 1.5496 -12.3993 { c tyr A 90 1gwyA_88F_100V}-5.3421 2.7075 -12.9412 { o tyr A 90 1gwyA_88F_100V}-5.6307 3.8664 -12.6502 { n leu A 98 1gwyA_88F_100V}P -6.755 6.0731 -11.3412 {"}-6.755 6.0731 -11.3412 { ca leu A 98 1gwyA_88F_100V}-8.1386 6.0897 -10.8932 { c leu A 98 1gwyA_88F_100V}-8.17 5.2566 -9.6215 { o leu A 98 1gwyA_88F_100V}-7.8538 4.0632 -9.6483 { c leu A 98 1gwyA_88F_100V}P -8.17 5.2566 -9.6215 { n gly A 99 1gwyA_88F_100V}-8.5212 5.8932 -8.5106 { ca gly A 99 1gwyA_88F_100V}-8.5977 5.1834 -7.2484 { c gly A 99 1gwyA_88F_100V}-10.0589 4.934 -6.9364 { o gly A 99 1gwyA_88F_100V}-10.8804 5.8377 -7.0606 { c gly A 99 1gwyA_88F_100V}P -10.0589 4.934 -6.9364 { n val A 100 1gwyA_88F_100V}-10.3867 3.7071 -6.5455 { ca val A 100 1gwyA_88F_100V}-11.7567 3.3351 -6.2124 { c val A 100 1gwyA_88F_100V}-11.7832 2.6871 -4.8328 { o val A 100 1gwyA_88F_100V}-10.9514 1.8339 -4.5384 { c val A 100 1gwyA_88F_100V}P -11.7832 2.6871 -4.8328 { n met A 101 1gwyA_88F_100V}-12.7254 3.1016 -3.9902 { ca met A 101 1gwyA_88F_100V}-12.8565 2.5372 -2.6445 { c met A 101 1gwyA_88F_100V}-14.284 2.1224 -2.3528 { o met A 101 1gwyA_88F_100V}-15.2216 2.832 -2.7077 { c met A 101 1gwyA_88F_100V}P -14.284 2.1224 -2.3528 { n phe A 102 1gwyA_88F_100V}-14.4401 0.9611 -1.7253 { ca phe A 102 1gwyA_88F_100V}-15.7495 0.4916 -1.2938 { c phe A 102 1gwyA_88F_100V}-15.575 -0.0204 0.1245 { o phe A 102 1gwyA_88F_100V}-14.501 -0.5094 0.4975 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 86 1gwyA_88F_100V}P -12.0173 -2.1285 0.721 { ca ala A 86 1gwyA_88F_100V}P -10.7813 -2.0281 -0.0375 { n ala A 87 1gwyA_88F_100V}P -9.4967 -0.601 -1.4527 { ca ala A 87 1gwyA_88F_100V}P -9.2323 0.4353 -2.4283 { n phe A 88 1gwyA_88F_100V}P -8.7609 -0.0305 -4.7707 { ca phe A 88 1gwyA_88F_100V}P -8.0199 -0.6424 -5.862 { n ala A 89 1gwyA_88F_100V}P -6.774 0.2711 -7.7273 { ca ala A 89 1gwyA_88F_100V}P -6.436 1.3429 -8.6411 { n tyr A 90 1gwyA_88F_100V}P -6.4205 1.7835 -10.9917 { ca tyr A 90 1gwyA_88F_100V}P -6.1517 1.5496 -12.3993 { n leu A 98 1gwyA_88F_100V}P -6.755 6.0731 -11.3412 { ca leu A 98 1gwyA_88F_100V}P -8.1386 6.0897 -10.8932 { n gly A 99 1gwyA_88F_100V}P -8.5212 5.8932 -8.5106 { ca gly A 99 1gwyA_88F_100V}P -8.5977 5.1834 -7.2484 {"}P -8.5977 5.1834 -7.2484 { n val A 100 1gwyA_88F_100V}P -10.3867 3.7071 -6.5455 { ca val A 100 1gwyA_88F_100V}P -11.7567 3.3351 -6.2124 { n met A 101 1gwyA_88F_100V}P -12.7254 3.1016 -3.9902 { ca met A 101 1gwyA_88F_100V}P -12.8565 2.5372 -2.6445 { n phe A 102 1gwyA_88F_100V}P -14.4401 0.9611 -1.7253 { ca phe A 102 1gwyA_88F_100V}P -15.7495 0.4916 -1.2938 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 86 1gwyA_88F_100V}P -10.7813 -2.0281 -0.0375 {"}-10.7813 -2.0281 -0.0375 { ca ala A 87 1gwyA_88F_100V}-9.2323 0.4353 -2.4283 { ca phe A 88 1gwyA_88F_100V}-8.0199 -0.6424 -5.862 { ca ala A 89 1gwyA_88F_100V}-6.436 1.3429 -8.6411 { ca tyr A 90 1gwyA_88F_100V}-6.1517 1.5496 -12.3993 { ca leu A 98 1gwyA_88F_100V}P -8.1386 6.0897 -10.8932 {"}-8.1386 6.0897 -10.8932 { ca gly A 99 1gwyA_88F_100V}-8.5977 5.1834 -7.2484 { ca val A 100 1gwyA_88F_100V}-11.7567 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{"}'S' -13.314 0.537 -7.8081 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 88 A}'M' greentint -9.318 2.2258 -6.037 {"}'M' greentint -9.4813 2.1925 -6.2388 {"}'M' greentint -9.6299 2.0355 -6.3873 {"}'M' greentint -9.1741 2.431 -6.099 {"}'M' greentint -9.3321 2.4226 -6.301 {"}'M' greentint -9.4906 2.3295 -6.4794 {"}'M' greentint -9.6299 2.1615 -6.6126 {"}'M' greentint -8.9889 2.6011 -6.165 {"}'M' greentint -9.1451 2.6117 -6.3688 {"}'M' greentint -9.3053 2.5535 -6.5608 {"}'M' greentint -9.4601 2.4304 -6.7255 {"}'M' greentint -9.5958 2.2529 -6.8517 {"}'M' greentint -8.9018 2.7551 -6.4109 {"}'M' greentint -9.0619 2.7311 -6.6123 {"}'M' greentint -9.2244 2.6495 -6.7986 {"}'M' greentint -9.3766 2.5136 -6.9586 {"}'M' greentint -9.5133 2.332 -7.0834 {"}'M' greentint -8.8083 2.8457 -6.6797 {"}'M' greentint -8.9675 2.7946 -6.8719 {"}'M' greentint -9.1233 2.6958 -7.0452 {"}'M' greentint -9.2694 2.5522 -7.1951 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 100 A}'M' greentint -9.577 1.9729 -6.4135 {"}'M' greentint -9.4188 2.0366 -6.2272 {"}'M' greentint -9.2685 2.1611 -6.0673 {"}'M' greentint -9.5264 2.0319 -6.7645 {"}'M' greentint -9.3682 2.0341 -6.5608 {"}'M' greentint -9.2075 2.1101 -6.3739 {"}'M' greentint -9.058 2.2555 -6.2215 {"}'M' greentint -8.9334 2.4554 -6.1157 {"}'M' greentint -9.4233 2.1946 -7.0195 {"}'M' greentint -9.2745 2.145 -6.8134 {"}'M' greentint -9.1122 2.1899 -6.6155 {"}'M' greentint -8.9579 2.3225 -6.4538 {"}'M' greentint -8.8337 2.5258 -6.3492 {"}'M' greentint -9.2953 2.4302 -7.182 {"}'M' greentint -9.1635 2.3284 -6.9839 {"}'M' greentint -9.0025 2.3565 -6.7839 {"}'M' greentint -8.8545 2.5084 -6.635 {"}'M' greentint -8.7597 2.7426 -6.5777 {"}'M' greentint -9.03 2.5463 -7.0374 {"}'M' greentint -8.87 2.6432 -6.858 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 88 A}'M' greentint -10.2789 0.7505 -4.4502 {"}'M' greentint -10.4122 0.6469 -4.6497 {"}'M' greentint -10.093 0.8419 -4.2922 {"}'M' greentint -10.1972 0.9971 -4.4701 {"}'M' greentint -10.3572 0.9002 -4.6495 {"}'M' greentint -10.4676 0.8008 -4.9298 {"}'M' greentint -9.932 1.1132 -4.3254 {"}'M' greentint -10.0637 1.2149 -4.5236 {"}'M' greentint -10.2247 1.1869 -4.7236 {"}'M' greentint -10.3728 1.0349 -4.8724 {"}'M' greentint -10.4393 0.8983 -5.1834 {"}'M' greentint -9.7404 1.29 -4.3893 {"}'M' greentint -9.8753 1.3848 -4.5902 {"}'M' greentint -10.0342 1.388 -4.7961 {"}'M' greentint -10.1944 1.2969 -4.979 {"}'M' greentint -10.3359 1.1264 -5.1146 {"}'M' greentint -10.3424 0.9725 -5.4234 {"}'M' greentint -9.6268 1.484 -4.6406 {"}'M' greentint -9.7784 1.5195 -4.8457 {"}'M' greentint -9.9398 1.4803 -5.0436 {"}'M' greentint -10.0964 1.3683 -5.215 {"}'M' greentint -10.235 1.1936 -5.3457 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 100 A}'M' green -10.4468 0.7785 -5.3082 {"}'M' green -10.3186 0.9902 -5.4597 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 100 A}'M' greentint -10.3732 0.596 -4.8446 {"}'M' greentint -10.2106 0.6517 -4.6504 {"}'M' greentint -10.0528 0.762 -4.477 {"}'M' greentint -9.9074 0.9237 -4.334 {"}'M' greentint -10.2988 0.7314 -5.1037 {"}'M' greentint -10.1396 0.7539 -4.9032 {"}'M' greentint -9.9799 0.8424 -4.7222 {"}'M' greentint -9.8332 0.992 -4.5746 {"}'M' greentint -9.7095 1.1918 -4.4699 {"}'M' greentint -10.1802 0.9134 -5.2582 {"}'M' greentint -10.0214 0.9244 -5.0573 {"}'M' greentint -9.8643 1.0203 -4.8799 {"}'M' greentint -9.7259 1.1908 -4.7484 {"}'M' greentint -9.623 1.4143 -4.6775 {"}'M' greentint -10.0459 1.1212 -5.3339 {"}'M' greentint -9.8827 1.1504 -5.1313 {"}'M' greentint -9.733 1.3041 -4.9805 {"}'M' greentint -9.6377 1.5404 -4.923 {"}'M' greentint -9.9332 1.351 -5.3692 {"}'M' greentint -9.7745 1.4484 -5.1915 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 196 1gycA_246F_198}P -6.9527 5.9685 -11.35 {"}-6.9527 5.9685 -11.35 { ca tyr A 196 1gycA_246F_198}-8.0498 6.1858 -10.416 { c tyr A 196 1gycA_246F_198}-7.9469 5.3626 -9.1288 { o tyr A 196 1gycA_246F_198}-7.6407 4.2027 -9.2351 { c tyr A 196 1gycA_246F_198}P -7.9469 5.3626 -9.1288 { n arg A 197 1gycA_246F_198}-8.2162 6.0029 -7.9974 { ca arg A 197 1gycA_246F_198}-8.2647 5.2315 -6.7444 { c arg A 197 1gycA_246F_198}-9.752 4.8596 -6.582 { o arg A 197 1gycA_246F_198}-10.5174 5.7321 -6.2107 { c arg A 197 1gycA_246F_198}P -9.752 4.8596 -6.582 { n phe A 198 1gycA_246F_198}-10.1406 3.629 -6.8869 { ca phe A 198 1gycA_246F_198}-11.5408 3.2677 -6.6965 { c phe A 198 1gycA_246F_198}-11.669 2.7254 -5.2493 { o phe A 198 1gycA_246F_198}-10.8174 1.9284 -4.8826 { c phe A 198 1gycA_246F_198}P -11.669 2.7254 -5.2493 { n arg A 199 1gycA_246F_198}-12.707 3.1328 -4.5772 { ca arg A 199 1gycA_246F_198}-12.9389 2.7121 -3.1763 { c arg A 199 1gycA_246F_198}-14.1756 1.8085 -3.1908 { o arg A 199 1gycA_246F_198}-15.2609 2.301 -3.4178 { c arg A 199 1gycA_246F_198}P -14.1756 1.8085 -3.1908 { n leu A 200 1gycA_246F_198}-13.9119 0.5219 -3.1245 { ca leu A 200 1gycA_246F_198}-14.933 -0.501 -3.2272 { c leu A 200 1gycA_246F_198}-15.5187 -0.8134 -1.8408 { o leu A 200 1gycA_246F_198}-14.7843 -1.2888 -0.99 { n tyr A 244 1gycA_246F_198}P -12.2001 -2.2356 0.0992 {"}-12.2001 -2.2356 0.0992 { ca tyr A 244 1gycA_246F_198}-10.8787 -2.2823 -0.5141 { c tyr A 244 1gycA_246F_198}-10.7036 -1.0366 -1.3708 { o tyr A 244 1gycA_246F_198}-11.6828 -0.6825 -2.0244 { c tyr A 244 1gycA_246F_198}P -10.7036 -1.0366 -1.3708 { n ser A 245 1gycA_246F_198}-9.5063 -0.4745 -1.4092 { ca ser A 245 1gycA_246F_198}-9.2451 0.6001 -2.3655 { c ser A 245 1gycA_246F_198}-8.2877 -0.0963 -3.3759 { o ser A 245 1gycA_246F_198}-7.4245 -0.8652 -2.9467 { c ser A 245 1gycA_246F_198}P -8.2877 -0.0963 -3.3759 { n phe A 246 1gycA_246F_198}-8.4854 0.1727 -4.6662 { ca phe A 246 1gycA_246F_198}-7.6338 -0.4241 -5.6918 { c phe A 246 1gycA_246F_198}-7.3854 0.6645 -6.7473 { o phe A 246 1gycA_246F_198}-8.1936 1.5649 -6.9142 { c phe A 246 1gycA_246F_198}P -7.3854 0.6645 -6.7473 { n val A 247 1gycA_246F_198}-6.1992 0.5824 -7.3442 { ca val A 247 1gycA_246F_198}-5.8794 1.561 -8.3882 { c val A 247 1gycA_246F_198}-6.1802 0.8972 -9.7312 { o val A 247 1gycA_246F_198}-5.8652 -0.2801 -9.9478 { c val A 247 1gycA_246F_198}P -6.1802 0.8972 -9.7312 { n leu A 248 1gycA_246F_198}-6.8726 1.6431 -10.5693 { ca leu A 248 1gycA_246F_198}-7.2009 1.2698 -11.9256 { c leu A 248 1gycA_246F_198}-6.484 2.2712 -12.8763 { o leu A 248 1gycA_246F_198}-6.6909 3.47 -12.7579 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 196 1gycA_246F_198}P -6.9527 5.9685 -11.35 { ca tyr A 196 1gycA_246F_198}P -8.0498 6.1858 -10.416 { n arg A 197 1gycA_246F_198}P -8.2162 6.0029 -7.9974 { ca arg A 197 1gycA_246F_198}P -8.2647 5.2315 -6.7444 { n phe A 198 1gycA_246F_198}P -10.1406 3.629 -6.8869 { ca phe A 198 1gycA_246F_198}P -11.5408 3.2677 -6.6965 { n arg A 199 1gycA_246F_198}P -12.707 3.1328 -4.5772 { ca arg A 199 1gycA_246F_198}P -12.9389 2.7121 -3.1763 { n leu A 200 1gycA_246F_198}P -13.9119 0.5219 -3.1245 { ca leu A 200 1gycA_246F_198}P -14.933 -0.501 -3.2272 { n tyr A 244 1gycA_246F_198}P -12.2001 -2.2356 0.0992 { ca tyr A 244 1gycA_246F_198}P -10.8787 -2.2823 -0.5141 { n ser A 245 1gycA_246F_198}P -9.5063 -0.4745 -1.4092 { ca ser A 245 1gycA_246F_198}P -9.2451 0.6001 -2.3655 { n phe A 246 1gycA_246F_198}P -8.4854 0.1727 -4.6662 { ca phe A 246 1gycA_246F_198}P -7.6338 -0.4241 -5.6918 { n val A 247 1gycA_246F_198}P -6.1992 0.5824 -7.3442 { ca val A 247 1gycA_246F_198}P -5.8794 1.561 -8.3882 { n leu A 248 1gycA_246F_198}P -6.8726 1.6431 -10.5693 { ca leu A 248 1gycA_246F_198}P -7.2009 1.2698 -11.9256 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 196 1gycA_246F_198}P -8.0498 6.1858 -10.416 {"}-8.0498 6.1858 -10.416 { ca arg A 197 1gycA_246F_198}-8.2647 5.2315 -6.7444 { ca phe A 198 1gycA_246F_198}-11.5408 3.2677 -6.6965 { ca arg A 199 1gycA_246F_198}-12.9389 2.7121 -3.1763 { ca leu A 200 1gycA_246F_198}-14.933 -0.501 -3.2272 { ca tyr A 244 1gycA_246F_198}P -10.8787 -2.2823 -0.5141 {"}-10.8787 -2.2823 -0.5141 { ca ser A 245 1gycA_246F_198}-9.2451 0.6001 -2.3655 { ca phe A 246 1gycA_246F_198}-7.6338 -0.4241 -5.6918 { ca val A 247 1gycA_246F_198}-5.8794 1.561 -8.3882 { ca leu A 248 1gycA_246F_198}-7.2009 1.2698 -11.9256 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 198 1gycA_246F_198}P -11.5408 3.2677 -6.6965 { cb phe A 198 1gycA_246F_198}-11.9677 2.1831 -7.6801 { cg phe A 198 1gycA_246F_198}-12.302 2.8397 -9.0046 { cd1 phe A 198 1gycA_246F_198}-11.4435 2.657 -10.0777 { ce1 phe A 198 1gycA_246F_198}-11.7285 3.2726 -11.2913 { cz phe A 198 1gycA_246F_198}-12.8316 4.0787 -11.404 { cg phe A 198 1gycA_246F_198}P -12.302 2.8397 -9.0046 { cd2 phe A 198 1gycA_246F_198}-13.3841 3.6796 -9.1219 { ce2 phe A 198 1gycA_246F_198}-13.6848 4.2875 -10.3331 { cz phe A 198 1gycA_246F_198}ghost -12.8316 4.0787 -11.404 { ca phe A 246 1gycA_246F_198}P -7.6338 -0.4241 -5.6918 { cb phe A 246 1gycA_246F_198}-8.1671 -1.6725 -6.3612 { cg phe A 246 1gycA_246F_198}-9.4663 -1.506 -7.1274 { cd1 phe A 246 1gycA_246F_198}-9.4755 -1.062 -8.4494 { ce1 phe A 246 1gycA_246F_198}-10.6604 -0.9075 -9.132 { cz phe A 246 1gycA_246F_198}-11.8839 -1.2031 -8.5323 { cg phe A 246 1gycA_246F_198}P -9.4663 -1.506 -7.1274 { cd2 phe A 246 1gycA_246F_198}-10.6809 -1.7978 -6.5369 { ce2 phe A 246 1gycA_246F_198}-11.8711 -1.6324 -7.2155 { cz phe A 246 1gycA_246F_198}ghost -11.8839 -1.2031 -8.5323 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 198 1gycA_246F_198}P -11.9677 2.1831 -7.6801 {"}P -11.9677 2.1831 -7.6801 { cd1 phe A 198 1gycA_246F_198}P -11.4435 2.657 -10.0777 { cd2 phe A 198 1gycA_246F_198}P -13.3841 3.6796 -9.1219 { ce1 phe A 198 1gycA_246F_198}P -11.7285 3.2726 -11.2913 { ce2 phe A 198 1gycA_246F_198}P -13.6848 4.2875 -10.3331 { cz phe A 198 1gycA_246F_198}P -12.8316 4.0787 -11.404 { cb phe A 246 1gycA_246F_198}P -8.1671 -1.6725 -6.3612 {"}P -8.1671 -1.6725 -6.3612 { cd1 phe A 246 1gycA_246F_198}P -9.4755 -1.062 -8.4494 { cd2 phe A 246 1gycA_246F_198}P -10.6809 -1.7978 -6.5369 { ce1 phe A 246 1gycA_246F_198}P -10.6604 -0.9075 -9.132 { ce2 phe A 246 1gycA_246F_198}P -11.8711 -1.6324 -7.2155 { cz phe A 246 1gycA_246F_198}P -11.8839 -1.2031 -8.5323 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 246 A}'S' blue -10.3932 0.1439 -7.5747 {"}'S' sky -10.1933 0.3082 -7.6312 {"}'S' blue -9.9602 0.4349 -7.6833 {"}'S' sky -10.1132 0.4691 -7.8917 {"}'S' blue -9.8565 0.5704 -7.945 {"}'S' sky -10.0124 0.5759 -8.1491 { CE1 PHE 246 A}'S' blue -11.6221 0.546 -8.9701 {"}'S' sky -11.2333 0.74 -9.2708 {"}'S' blue -11.3906 0.6503 -9.4499 {"}'S' blue -11.5438 0.5248 -9.6118 {"}'S' sky -10.8893 0.8228 -9.2638 {"}'S' sky -11.0532 0.7661 -9.4595 {"}'S' sky -11.2143 0.6724 -9.6413 {"}'S' blue -11.3697 0.5427 -9.807 {"}'S' blue -10.5488 0.8347 -9.2557 {"}'S' sky -10.7109 0.8112 -9.4582 {"}'S' sky -10.8745 0.7497 -9.6525 {"}'S' sky -11.0354 0.6513 -9.8327 {"}'S' blue -11.1896 0.5197 -9.9964 {"}'S' blue -10.3403 0.7915 -9.4068 {"}'S' sky -10.502 0.7685 -9.6107 {"}'S' sky -10.6652 0.7078 -9.8045 {"}'S' blue -10.8264 0.6113 -9.9857 {"}'S' blue -10.2868 0.6904 -9.7396 {"}'S' blue -10.4503 0.6331 -9.9346 { CE2 PHE 246 A}'S' blue -12.2832 0.0677 -7.1619 {"}'S' blue -11.9384 0.1154 -7.1424 {"}'S' blue -12.1 0.098 -7.3473 {"}'S' blue -11.6026 0.0955 -7.1317 {"}'S' blue -11.7595 0.1098 -7.3392 {"}'S' sky -11.3933 0.0494 -7.283 {"}'S' blue -11.18 -0.0371 -7.4109 { CZ PHE 246 A}'S' blue -12.4595 0.0967 -7.5121 {"}'S' blue -12.6018 0.1671 -7.714 {"}'S' blue -12.7561 0.1847 -7.9187 {"}'S' sky -12.6828 0.313 -8.1776 {"}'S' sky -11.8641 0.1601 -7.4356 {"}'S' sky -12.5813 0.3986 -8.4293 {"}'S' sky -12.4568 0.4444 -8.6712 {"}'S' sky -11.2946 0.0624 -7.4774 {"}'S' blue -12.2767 0.4705 -8.8598 {"}'S' sky -11.9344 0.5156 -8.8586 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 246 A}'S' sea -10.3476 0.3258 -7.8358 {"}'S' sea -10.2743 0.4541 -8.0947 { CE1 PHE 246 A}'S' sea -11.0178 0.1031 -7.7491 {"}'S' green -11.1145 0.2703 -7.9195 {"}'S' green -10.7842 0.2164 -7.7958 {"}'S' green -11.4593 0.6086 -8.7773 {"}'S' green -10.543 0.2919 -7.8627 {"}'S' green -11.1974 0.7304 -8.8316 {"}'S' green -10.3799 0.4719 -8.0927 {"}'S' green -10.9148 0.8057 -8.8779 {"}'S' sea -10.2899 0.6581 -8.4429 {"}'S' green -10.4243 0.7565 -8.6439 {"}'S' sea -10.5711 0.8173 -8.8516 { CZ PHE 246 A}'S' sea -12.2288 0.2128 -7.5633 {"}'S' sea -12.3687 0.2937 -7.7662 {"}'S' sea -12.5217 0.328 -7.9746 {"}'S' green -11.9817 0.2892 -7.6241 {"}'S' green -12.1171 0.3794 -7.8229 {"}'S' green -12.265 0.4292 -8.0279 {"}'S' green -12.4209 0.4348 -8.232 {"}'S' sea -11.6034 0.1763 -7.4931 {"}'S' green -11.716 0.3141 -7.6768 {"}'S' green -11.844 0.417 -7.8718 {"}'S' green -12.1383 0.5101 -8.2782 {"}'S' green 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{"}'S' -11.0335 0.6903 -8.6377 {"}'S' P -10.4925 0.6097 -8.2764 {"}'S' -10.4922 0.6088 -8.2775 {"}'S' P -10.6205 0.7126 -8.4714 {"}'S' -10.6214 0.6923 -8.4799 {"}'S' P -10.7629 0.7785 -8.6743 {"}'S' -10.7631 0.774 -8.6752 { CZ PHE 246 A}'S' P -11.9864 0.4829 -8.0746 {"}'S' -11.9869 0.4807 -8.0748 {"}'S' P -11.5134 0.3625 -7.8432 {"}'S' -11.516 0.3492 -7.8489 {"}'S' P -11.6478 0.4609 -8.0442 {"}'S' -11.6511 0.4396 -8.0507 {"}'S' P -11.3284 0.3807 -8.0388 {"}'S' -11.3389 0.3511 -8.0482 {"}'S' P -11.4663 0.4717 -8.2412 {"}'S' -11.4735 0.4429 -8.2462 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 198 A}'S' sky -12.7271 0.6428 -8.0162 {"}'S' sky -12.5896 0.5527 -7.8127 {"}'S' sky -12.4405 0.4997 -7.6054 {"}'S' sky -12.2828 0.4852 -7.3985 {"}'S' blue -12.1206 0.5087 -7.1959 {"}'S' blue -11.9578 0.5703 -7.0011 {"}'S' sky -12.6492 0.7279 -8.3735 {"}'S' sky -11.9219 0.4626 -7.3598 {"}'S' blue -11.7595 0.5234 -7.1654 {"}'S' blue -12.5057 0.8253 -8.6438 {"}'S' sky -12.2515 0.8084 -8.7248 {"}'S' blue -12.036 0.892 -8.8595 {"}'S' sky -11.6901 0.8286 -8.7533 { CD1 PHE 198 A}'S' blue -11.5965 0.9826 -9.5935 {"}'S' blue -11.4336 1.0442 -9.3987 {"}'S' blue -11.2732 1.1419 -9.2189 {"}'S' blue -11.5598 0.9145 -9.9602 {"}'S' sky -11.3977 0.9365 -9.7574 {"}'S' sky -11.2353 0.9973 -9.563 {"}'S' sky -11.0741 1.0938 -9.3818 {"}'S' blue -10.9191 1.2252 -9.2187 {"}'S' blue -11.2911 0.9145 -10.0407 {"}'S' sky -11.1273 0.9526 -9.8409 {"}'S' sky -10.9646 1.0283 -9.6511 {"}'S' sky -10.8062 1.1421 -9.4778 {"}'S' blue -11.0361 0.9566 -10.1375 {"}'S' sky -10.8757 1.0069 -9.9452 { HB2 PHE 198 A}'S' blue -11.572 0.5123 -7.2415 {"}'S' blue -11.0436 0.3727 -7.3624 {"}'S' blue -10.4716 0.5495 -7.5129 {"}'S' sky -10.3652 0.5915 -7.7548 {"}'S' blue -10.2261 0.7684 -7.6239 {"}'S' blue -10.1525 0.8554 -7.8609 {"}'S' blue -10.1368 0.9587 -8.1006 { HB3 PHE 198 A}'S' blue -12.8935 0.6586 -7.931 {"}'S' blue -12.765 0.5578 -7.7359 {"}'S' blue -12.6177 0.5148 -7.5333 {"}'S' blue -12.4596 0.5326 -7.3348 { HD1 PHE 198 A}'S' blue -10.6417 1.1924 -9.4302 {"}'S' sky -10.6631 1.044 -9.846 {"}'S' sky -10.5065 1.0815 -9.6541 {"}'S' blue -10.3516 1.1786 -9.4816 {"}'S' blue -10.5501 1.0421 -10.1285 {"}'S' blue -10.3958 1.0414 -9.9294 {"}'S' blue -10.2376 1.1051 -9.7431 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 198 A}'S' sea -12.5274 0.6025 -8.18 {"}'S' green -12.3899 0.5107 -7.978 {"}'S' green -12.2413 0.4569 -7.7711 {"}'S' sea -12.084 0.4406 -7.5626 {"}'S' sea -12.3959 0.6762 -8.4596 {"}'S' green -12.2691 0.5606 -8.2634 {"}'S' green -12.127 0.4822 -8.0582 {"}'S' green -11.9747 0.4413 -7.8509 {"}'S' green -11.8153 0.4406 -7.6431 {"}'S' green -12.1397 0.6691 -8.5419 {"}'S' green -12.0113 0.5655 -8.3463 {"}'S' sea -11.9265 0.7459 -8.6782 {"}'S' green -11.7995 0.6372 -8.4833 { HB2 PHE 198 A}'S' green -11.6595 0.392 -7.7318 {"}'S' sea -11.5076 0.3663 -7.5285 {"}'S' green -11.3578 0.2962 -7.747 {"}'S' sea -11.2023 0.3082 -7.5492 {"}'S' sea -11.5942 0.6937 -8.5949 {"}'S' green -11.5065 0.5176 -8.4315 {"}'S' green -11.1014 0.2795 -7.8422 {"}'S' sea -10.942 0.3099 -7.645 {"}'S' sea -11.3873 0.8172 -8.7709 {"}'S' green -10.7797 0.3421 -7.8543 {"}'S' sea -11.1445 0.9108 -8.8518 {"}'S' green -10.5224 0.4731 -7.9255 {"}'S' green -10.8418 0.8088 -8.7395 {"}'S' green -10.4457 0.5918 -8.1657 {"}'S' sea -10.2896 0.6872 -7.9912 {"}'S' green -10.5843 0.879 -8.6565 {"}'S' green -10.4509 0.7762 -8.4558 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB PHE 198 A}'S' P -11.8702 0.4987 -8.1449 {"}'S' -11.8697 0.5009 -8.1448 { HB2 PHE 198 A}'S' P -11.6358 0.4323 -8.1444 {"}'S' -11.6255 0.4542 -8.137 {"}'S' P -11.5051 0.3379 -7.9493 {"}'S' -11.4963 0.3664 -7.9455 {"}'S' P -11.3904 0.3858 -8.246 {"}'S' -11.3847 0.4145 -8.2345 {"}'S' P -11.2538 0.3045 -8.0459 {"}'S' -11.2522 0.3268 -8.042 {"}'S' P -11.3162 0.6209 -8.6255 {"}'S' -11.316 0.6246 -8.6209 {"}'S' P -11.2136 0.4681 -8.4504 {"}'S' -11.2112 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0.7297 -7.2683 {"}'S' P -12.244 0.9796 -7.3438 {"}'S' -12.2575 0.9346 -7.3896 {"}'S' P -12.3373 1.1486 -7.5116 {"}'S' -12.3407 1.1285 -7.5272 {"}'S' P -12.4499 1.2863 -7.6954 {"}'S' -12.4507 1.279 -7.6999 {"}'S' P -11.8928 0.6232 -7.2063 {"}'S' -11.9007 0.615 -7.2204 {"}'S' P -11.9494 0.8408 -7.3402 {"}'S' -11.9588 0.8257 -7.3565 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 233 A}'S' sky -13.4326 0.5906 -6.4138 {"}'S' sky -13.4923 0.7658 -6.9745 {"}'S' sky -12.0492 1.671 -7.7584 {"}'S' blue -11.8259 1.7542 -7.6499 {"}'S' blue -11.7573 1.5431 -7.5029 { CG PHE 233 A}'S' blue -13.5953 0.5428 -6.2339 {"}'S' blue -13.4489 0.484 -6.0272 { HB2 PHE 233 A}'S' sky -13.5277 1.5191 -7.9126 {"}'S' sky -13.3374 1.6224 -8.1066 {"}'S' sky -13.1012 1.7034 -8.1902 {"}'S' sky -12.863 1.8103 -8.2206 { HB3 PHE 233 A}'S' sky -11.7144 0.3663 -5.8478 {"}'S' sky -11.7162 1.18 -7.3911 {"}'S' sky -11.3679 0.6395 -6.7916 {"}'S' blue -11.2173 0.7934 -6.6397 {"}'S' sky -11.5115 0.9928 -7.2189 {"}'S' blue -11.4065 0.8364 -7.0397 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 233 A}'S' sea -13.3704 0.6404 -6.781 {"}'S' green -13.233 0.5486 -6.579 {"}'S' sea -13.5084 1.2486 -7.5579 {"}'S' green -13.4397 1.0431 -7.4119 {"}'S' green -13.3488 0.8632 -7.2449 {"}'S' green -13.2389 0.7141 -7.0607 {"}'S' green -13.1122 0.5985 -6.8645 {"}'S' green -13.2589 1.213 -7.6393 {"}'S' green -13.0294 1.3156 -7.7627 {"}'S' green -12.7867 1.4145 -7.8345 {"}'S' green -12.5391 1.5195 -7.8619 {"}'S' green -12.2442 1.3946 -7.7157 {"}'S' green -12.158 1.213 -7.5547 { HB2 PHE 233 A}'S' sea -13.4115 1.3873 -7.7271 {"}'S' sea -13.2348 1.4696 -7.9315 {"}'S' green -12.9975 1.5447 -8.0123 {"}'S' sea -12.7604 1.6576 -8.0455 { HB3 PHE 233 A}'S' sea -12.1241 0.2074 -5.9016 {"}'S' green -12.0225 0.1447 -6.1841 {"}'S' green -11.8645 0.2304 -6.0031 {"}'S' green -11.7025 0.2528 -6.2106 {"}'S' sea -11.552 0.3842 -6.052 {"}'S' green -11.4457 0.4262 -6.2939 {"}'S' green -11.9778 1.099 -7.4755 {"}'S' green -11.6826 0.4158 -6.9041 {"}'S' green -11.5262 0.4265 -6.7048 {"}'S' sea -11.3701 0.5219 -6.5303 {"}'S' green -11.7326 0.9222 -7.341 {"}'S' sea -11.6648 0.7137 -7.1956 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB PHE 233 A}'S' P -13.1874 1.0161 -7.4933 {"}'S' -13.1854 1.023 -7.487 {"}'S' P -13.0945 0.8463 -7.3259 {"}'S' -13.0911 0.8664 -7.3104 {"}'S' P -12.9828 0.707 -7.143 {"}'S' -12.9828 0.7158 -7.1382 {"}'S' P -12.9658 1.109 -7.6234 {"}'S' -12.9629 1.1358 -7.5915 {"}'S' P -12.879 0.9299 -7.4605 {"}'S' -12.8764 0.9801 -7.4154 {"}'S' P -12.7699 0.7844 -7.2799 {"}'S' -12.7713 0.8318 -7.2465 {"}'S' P -12.7291 1.1999 -7.7 {"}'S' -12.7309 1.2235 -7.6668 {"}'S' P -12.6438 1.0143 -7.5377 {"}'S' -12.65 1.0646 -7.4858 {"}'S' P -12.4875 1.3009 -7.7347 {"}'S' -12.4894 1.3038 -7.731 {"}'S' P -12.4047 1.1161 -7.5759 {"}'S' -12.4136 1.1394 -7.5489 { HB3 PHE 233 A}'S' P -12.9927 0.4399 -6.6565 {"}'S' -12.9739 0.4609 -6.6492 {"}'S' P -12.8773 0.3083 -6.4704 {"}'S' -12.8505 0.3488 -6.4653 {"}'S' P -12.74 0.2268 -6.2709 {"}'S' -12.7286 0.252 -6.2731 {"}'S' P -12.9063 0.5901 -7.0186 {"}'S' -12.8881 0.6089 -6.9997 {"}'S' P -12.8251 0.4077 -6.8626 {"}'S' -12.7746 0.4845 -6.8179 {"}'S' P -12.7163 0.267 -6.6835 {"}'S' -12.6622 0.3829 -6.6445 {"}'S' P -12.5856 0.1726 -6.4885 {"}'S' -12.5496 0.288 -6.4741 {"}'S' P -12.4383 0.1309 -6.2862 {"}'S' -12.4276 0.1982 -6.2903 {"}'S' P -12.731 0.7401 -7.2645 {"}'S' -12.7023 0.7716 -7.2118 {"}'S' P -12.6747 0.5285 -7.134 {"}'S' -12.6417 0.5855 -7.0746 {"}'S' P -12.587 0.3523 -6.9706 {"}'S' -12.5411 0.476 -6.8882 {"}'S' P -12.4708 0.2206 -6.7851 {"}'S' -12.4362 0.3833 -6.7186 {"}'S' P -12.3343 0.1392 -6.5851 {"}'S' -12.3217 0.2893 -6.5543 {"}'S' P -12.1819 0.1142 -6.3813 {"}'S' -12.1864 0.1982 -6.3794 {"}'S' P -12.5022 0.8796 -7.4176 {"}'S' -12.4842 0.9072 -7.3446 {"}'S' P -12.4677 0.652 -7.31 {"}'S' -12.4458 0.7115 -7.2201 {"}'S' P -12.3967 0.4556 -7.1646 {"}'S' -12.3809 0.5426 -7.0792 {"}'S' P -12.2941 0.3028 -6.9896 {"}'S' -12.2862 0.443 -6.898 {"}'S' P -12.1656 0.2021 -6.7944 {"}'S' -12.1765 0.3506 -6.7339 {"}'S' P -12.0184 0.159 -6.5918 {"}'S' -12.0382 0.2601 -6.5703 {"}'S' P -11.8602 0.1768 -6.3934 {"}'S' -11.871 0.2067 -6.3928 {"}'S' P -12.2443 0.9879 -7.4829 {"}'S' -12.2442 0.9994 -7.441 {"}'S' P -12.225 0.7456 -7.3909 {"}'S' -12.2262 0.7878 -7.3083 {"}'S' P -12.1605 0.5367 -7.2483 {"}'S' -12.1663 0.5909 -7.1831 {"}'S' P -12.0568 0.3779 -7.0703 {"}'S' -12.0741 0.4639 -7.0025 {"}'S' P -11.9219 0.2831 -6.8694 {"}'S' -11.9477 0.3655 -6.826 {"}'S' P -11.7661 0.2588 -6.6612 {"}'S' -11.7781 0.2866 -6.6532 {"}'S' P -11.6029 0.3078 -6.4647 {"}'S' -11.6071 0.3146 -6.4635 {"}'S' P -11.9774 0.8548 -7.4073 {"}'S' -11.9823 0.8634 -7.3852 {"}'S' P -11.9223 0.6436 -7.2786 {"}'S' -11.9302 0.6597 -7.2555 {"}'S' P -11.8197 0.4908 -7.1035 {"}'S' -11.826 0.5024 -7.0926 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 6 A}'M' greentint -9.5932 2.0702 -6.1639 {"}'M' greentint -9.3743 2.4091 -5.9746 {"}'M' greentint -9.5333 2.3204 -6.1562 {"}'M' greentint -9.6768 2.2127 -6.4287 {"}'M' greentint -9.2713 2.6417 -6.0236 {"}'M' greentint -9.4346 2.6083 -6.2254 {"}'M' greentint -9.5832 2.4514 -6.3739 {"}'M' greentint -9.6869 2.355 -6.6714 {"}'M' greentint -9.7434 2.1055 -6.6746 {"}'M' greentint -9.1274 2.8468 -6.0856 {"}'M' greentint -9.2853 2.8384 -6.2876 {"}'M' greentint -9.4439 2.7453 -6.466 {"}'M' greentint -9.5832 2.5773 -6.5992 {"}'M' greentint -9.6565 2.449 -6.9162 {"}'M' greentint -9.7276 2.2039 -6.9404 {"}'M' greentint -9.0983 3.0276 -6.3555 {"}'M' greentint -9.2585 2.9693 -6.5474 {"}'M' greentint -9.4133 2.8462 -6.7121 {"}'M' greentint -9.549 2.6687 -6.8383 {"}'M' greentint -9.5786 2.5292 -7.1544 {"}'M' greentint -9.6598 2.2861 -7.1928 {"}'M' greentint -9.0152 3.1469 -6.5989 {"}'M' greentint -9.1777 3.0653 -6.7852 {"}'M' greentint -9.3299 2.9294 -6.9452 {"}'M' greentint -9.4665 2.7478 -7.07 {"}'M' greentint -9.2227 2.9681 -7.1817 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 233 A}'M' greentint -9.6175 2.0203 -6.2643 {"}'M' greentint -9.4672 2.1447 -6.1045 {"}'M' greentint -9.3341 2.3203 -5.9814 {"}'M' greentint -9.2289 2.5349 -5.9036 {"}'M' greentint -9.7251 2.0155 -6.8016 {"}'M' greentint -9.5669 2.0177 -6.5979 {"}'M' greentint -9.4062 2.0937 -6.411 {"}'M' greentint -9.2567 2.2391 -6.2586 {"}'M' greentint -9.1321 2.439 -6.1528 {"}'M' greentint -9.0435 2.6766 -6.1048 {"}'M' greentint -8.999 2.9314 -6.1175 {"}'M' greentint -9.622 2.1782 -7.0567 {"}'M' greentint -9.4732 2.1286 -6.8506 {"}'M' greentint -9.3109 2.1735 -6.6526 {"}'M' greentint -9.1566 2.3061 -6.4909 {"}'M' greentint -9.0324 2.5094 -6.3863 {"}'M' greentint -8.9541 2.7551 -6.3542 {"}'M' greentint -8.9331 3.0105 -6.3975 {"}'M' greentint -9.494 2.4138 -7.2192 {"}'M' greentint -9.3622 2.3121 -7.021 {"}'M' greentint -9.2012 2.3401 -6.821 {"}'M' greentint -9.0532 2.4921 -6.6722 {"}'M' greentint -8.9584 2.7262 -6.6148 {"}'M' greentint -8.9421 2.9799 -6.6642 {"}'M' greentint -9.3329 2.6851 -7.2524 {"}'M' greentint -9.2287 2.5299 -7.0745 {"}'M' greentint -9.0687 2.6268 -6.8951 {"}'M' greentint -9.0138 2.8801 -6.8949 {"}'M' greentint -9.118 3.0353 -7.0727 {"}'M' greentint -9.147 2.7765 -7.0944 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 6 A}'M' green -10.074 1.1942 -5.0507 {"}'M' green -9.285 1.8664 -4.9613 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 6 A}'M' greentint -9.9136 1.0465 -4.3175 {"}'M' greentint -9.7277 1.1379 -4.1595 {"}'M' greentint -9.8319 1.2931 -4.3374 {"}'M' greentint -9.9919 1.1961 -4.5168 {"}'M' greentint -10.1023 1.0968 -4.7971 {"}'M' greentint -9.5667 1.4092 -4.1927 {"}'M' greentint -9.6984 1.5109 -4.3909 {"}'M' greentint -9.8594 1.4828 -4.5909 {"}'M' greentint -10.0075 1.3309 -4.7397 {"}'M' greentint -9.3751 1.5859 -4.2566 {"}'M' greentint -9.51 1.6808 -4.4575 {"}'M' greentint -9.6689 1.6839 -4.6635 {"}'M' greentint -9.8291 1.5929 -4.8463 {"}'M' greentint -9.9706 1.4223 -4.9819 {"}'M' greentint -9.2615 1.78 -4.5079 {"}'M' greentint -9.4131 1.8155 -4.713 {"}'M' greentint -9.5745 1.7763 -4.9109 {"}'M' greentint -9.7311 1.6643 -5.0823 {"}'M' greentint -9.8697 1.4895 -5.213 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 233 A}'M' green -9.9491 0.9788 -4.3079 {"}'M' green -9.791 1.0528 -4.1241 {"}'M' green -10.1497 1.1251 -4.9709 {"}'M' green -9.3804 1.3849 -4.0489 {"}'M' green -9.6519 1.6859 -5.2491 {"}'M' green -9.2476 1.9095 -4.9064 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 233 A}'M' greentint -10.0034 1.0618 -4.7651 {"}'M' greentint -9.8462 1.0572 -4.5595 {"}'M' greentint -9.6836 1.1129 -4.3653 {"}'M' greentint -9.5258 1.2231 -4.1919 {"}'M' greentint -9.9199 1.2396 -5.023 {"}'M' greentint -9.7719 1.1926 -4.8186 {"}'M' greentint -9.6127 1.215 -4.6181 {"}'M' greentint -9.453 1.3036 -4.4371 {"}'M' greentint -9.3063 1.4532 -4.2895 {"}'M' greentint -9.7916 1.4513 -5.1746 {"}'M' greentint -9.6533 1.3745 -4.973 {"}'M' greentint -9.4944 1.3855 -4.7722 {"}'M' greentint -9.3374 1.4814 -4.5948 {"}'M' greentint -9.1989 1.652 -4.4633 {"}'M' greentint -9.5189 1.5824 -5.0488 {"}'M' greentint -9.3558 1.6116 -4.8462 {"}'M' greentint -9.206 1.7653 -4.6954 {"}'M' greentint -9.4063 1.8122 -5.084 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 294 1h6tA_296F_315}P -11.6264 -1.2313 1.3923 {"}-11.6264 -1.2313 1.3923 { ca val A 294 1h6tA_296F_315}-10.7229 -1.7577 0.3702 { c val A 294 1h6tA_296F_315}-10.6472 -0.7772 -0.7771 { o val A 294 1h6tA_296F_315}-11.485 0.13 -0.928 { c val A 294 1h6tA_296F_315}P -10.6472 -0.7772 -0.7771 { n ser A 295 1h6tA_296F_315}-9.6879 -0.9926 -1.6417 { ca ser A 295 1h6tA_296F_315}-9.5174 -0.1273 -2.8058 { c ser A 295 1h6tA_296F_315}-8.7584 -0.8145 -3.9082 { o ser A 295 1h6tA_296F_315}-8.1975 -1.8874 -3.7324 { c ser A 295 1h6tA_296F_315}P -8.7584 -0.8145 -3.9082 { n phe A 296 1h6tA_296F_315}-8.764 -0.1887 -5.0635 { ca phe A 296 1h6tA_296F_315}-7.8861 -0.5775 -6.1348 { c phe A 296 1h6tA_296F_315}-7.5098 0.6434 -6.9279 { o phe A 296 1h6tA_296F_315}-8.2655 1.6003 -7.0616 { c phe A 296 1h6tA_296F_315}P -7.5098 0.6434 -6.9279 { n ile A 297 1h6tA_296F_315}-6.3176 0.5677 -7.4821 { ca ile A 297 1h6tA_296F_315}-5.8408 1.5711 -8.3976 { c ile A 297 1h6tA_296F_315}-6.1092 1.041 -9.8054 { o ile A 297 1h6tA_296F_315}-5.9065 -0.1415 -10.0855 { c ile A 297 1h6tA_296F_315}P -6.1092 1.041 -9.8054 { n phe A 298 1h6tA_296F_315}-6.5777 1.9123 -10.6958 { ca phe A 298 1h6tA_296F_315}-6.7036 1.5771 -12.1056 { c phe A 298 1h6tA_296F_315}-5.7312 2.4163 -12.9572 { o phe A 298 1h6tA_296F_315}-5.3933 3.5431 -12.6261 { n gly A 313 1h6tA_296F_315}P -6.3409 6.3095 -11.4443 {"}-6.3409 6.3095 -11.4443 { ca gly A 313 1h6tA_296F_315}-7.1004 6.6816 -10.2757 { c gly A 313 1h6tA_296F_315}-7.3045 5.5523 -9.299 { o gly A 313 1h6tA_296F_315}-6.7674 4.4559 -9.4954 { c gly A 313 1h6tA_296F_315}P -7.3045 5.5523 -9.299 { n arg A 314 1h6tA_296F_315}-8.0798 5.8652 -8.2598 { ca arg A 314 1h6tA_296F_315}-8.3734 4.9178 -7.2025 { c arg A 314 1h6tA_296F_315}-9.854 4.8313 -6.9763 { o arg A 314 1h6tA_296F_315}-10.5223 5.8382 -6.9233 { c arg A 314 1h6tA_296F_315}P -9.854 4.8313 -6.9763 { n val A 315 1h6tA_296F_315}-10.3552 3.6008 -6.9207 { ca val A 315 1h6tA_296F_315}-11.7077 3.307 -6.5064 { c val A 315 1h6tA_296F_315}-11.6238 2.8368 -5.0523 { o val A 315 1h6tA_296F_315}-10.8447 1.9048 -4.7334 { c val A 315 1h6tA_296F_315}P -11.6238 2.8368 -5.0523 { n thr A 316 1h6tA_296F_315}-12.3102 3.5625 -4.162 { ca thr A 316 1h6tA_296F_315}-12.3587 3.2806 -2.7489 { c thr A 316 1h6tA_296F_315}-13.723 2.7376 -2.3638 { o thr A 316 1h6tA_296F_315}-14.7607 3.3049 -2.7667 { c thr A 316 1h6tA_296F_315}P -13.723 2.7376 -2.3638 { n gln A 317 1h6tA_296F_315}-13.7351 1.5907 -1.676 { ca gln A 317 1h6tA_296F_315}-14.9391 0.9067 -1.2396 { c gln A 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green -12.0652 0.8702 -9.1166 {"}'S' green -12.2793 0.7448 -9.7258 {"}'S' green -12.1161 0.7938 -9.5293 {"}'S' green -11.9589 0.9122 -9.3585 {"}'S' sea -12.1957 0.9017 -9.9687 {"}'S' green -12.0394 0.9125 -9.7694 {"}'S' green -11.8833 1.0079 -9.5949 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB VAL 315 A}'S' P -12.3235 0.5409 -8.0325 {"}'S' -12.3235 0.5511 -8.028 { HB VAL 315 A}'S' P -12.1243 0.2196 -7.2443 {"}'S' -12.1243 0.2196 -7.2443 {"}'S' P -12.2094 0.4005 -7.836 {"}'S' -12.1976 0.4187 -7.8256 {"}'S' P -12.1006 0.2598 -7.6569 {"}'S' -12.0913 0.2788 -7.6502 {"}'S' P -11.9699 0.1655 -7.4618 {"}'S' -11.9616 0.1918 -7.4582 {"}'S' P -11.8226 0.1238 -7.2595 {"}'S' -11.818 0.1528 -7.2616 {"}'S' P -12.059 0.5213 -8.1074 {"}'S' -12.0495 0.538 -8.0897 {"}'S' P -11.9713 0.3452 -7.944 {"}'S' -11.9531 0.393 -7.9129 {"}'S' P -11.8552 0.2134 -7.7585 {"}'S' -11.8464 0.2561 -7.7409 {"}'S' P -11.7186 0.132 -7.5585 {"}'S' -11.7171 0.1498 -7.5554 {"}'S' P -11.5662 0.1071 -7.3547 {"}'S' -11.5669 0.1127 -7.3552 {"}'S' P -11.781 0.4485 -8.138 {"}'S' -11.7769 0.472 -8.1155 {"}'S' P -11.6784 0.2957 -7.9629 {"}'S' -11.6767 0.3303 -7.9395 {"}'S' P -11.55 0.1949 -7.7678 {"}'S' -11.5503 0.1972 -7.7671 {HG21 VAL 315 A}'S' P -12.5357 0.6306 -9.2487 {"}'S' -12.5365 0.6322 -9.2484 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 296 A}'M' green -9.0027 2.6999 -6.6045 {"}'M' green -9.454 2.0115 -7.6777 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 296 A}'M' greentint -9.3389 2.2806 -6.4745 {"}'M' greentint -9.4875 2.1237 -6.623 {"}'M' greentint -9.5913 2.0274 -6.9205 {"}'M' greentint -9.1897 2.5108 -6.5367 {"}'M' greentint -9.3483 2.4176 -6.7151 {"}'M' greentint -9.4875 2.2497 -6.8482 {"}'M' greentint -9.5609 2.1214 -7.1653 {"}'M' greentint -9.632 1.8763 -7.1895 {"}'M' greentint -9.1629 2.6417 -6.7965 {"}'M' greentint -9.3177 2.5186 -6.9612 {"}'M' greentint -9.4534 2.341 -7.0874 {"}'M' greentint -9.483 2.2016 -7.4035 {"}'M' greentint -9.5642 1.9584 -7.4419 {"}'M' greentint -8.92 2.8199 -6.8486 {"}'M' greentint -9.082 2.7377 -7.0343 {"}'M' greentint -9.2343 2.6018 -7.1943 {"}'M' greentint -9.3709 2.4202 -7.3191 {"}'M' greentint -9.3685 2.2464 -7.6332 {"}'M' greentint -8.9809 2.784 -7.2809 {"}'M' greentint -9.1271 2.6404 -7.4308 {"}'M' greentint -9.2579 2.4584 -7.5492 {"}'M' greentint -8.9719 2.6641 -7.6359 {"}'M' greentint -9.104 2.4812 -7.7559 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 315 A}'M' greentint -9.5186 1.8623 -6.9374 {"}'M' greentint -9.3684 1.9867 -6.7775 {"}'M' greentint -9.2353 2.1623 -6.6544 {"}'M' greentint -9.13 2.377 -6.5767 {"}'M' greentint -9.0566 2.6168 -6.5498 {"}'M' greentint -9.4681 1.8598 -7.2709 {"}'M' greentint -9.3074 1.9357 -7.0841 {"}'M' greentint -9.1579 2.0811 -6.9317 {"}'M' greentint -9.0333 2.2811 -6.8258 {"}'M' greentint -8.9447 2.5187 -6.7778 {"}'M' greentint -8.9002 2.7734 -6.7905 {"}'M' greentint -9.3744 1.9706 -7.5236 {"}'M' greentint -9.212 2.0155 -7.3257 {"}'M' greentint -9.0578 2.1481 -7.164 {"}'M' greentint -8.9336 2.3515 -7.0593 {"}'M' greentint -8.8553 2.5971 -7.0272 {"}'M' greentint -8.8343 2.8526 -7.0705 {"}'M' greentint -9.2634 2.1541 -7.694 {"}'M' greentint -9.1024 2.1821 -7.4941 {"}'M' greentint -8.9543 2.3341 -7.3452 {"}'M' greentint -8.8595 2.5682 -7.2879 {"}'M' greentint -8.8432 2.8219 -7.3372 {"}'M' greentint -9.1299 2.3719 -7.7476 {"}'M' greentint -8.9699 2.4688 -7.5681 {"}'M' greentint -8.915 2.7221 -7.5679 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 296 A}'M' green -9.9566 0.8418 -4.5159 {"}'M' green -9.4903 1.4839 -4.8642 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 296 A}'M' greentint -10.1425 0.7504 -4.6739 {"}'M' greentint -10.2757 0.6468 -4.8733 {"}'M' greentint -10.0608 0.997 -4.6937 {"}'M' greentint -10.2208 0.9001 -4.8731 {"}'M' greentint -10.3311 0.8007 -5.1534 {"}'M' greentint -9.7955 1.1131 -4.5491 {"}'M' greentint -9.9273 1.2149 -4.7472 {"}'M' greentint -10.0883 1.1868 -4.9472 {"}'M' greentint -10.2363 1.0348 -5.0961 {"}'M' greentint -10.3029 0.8982 -5.407 {"}'M' greentint -9.604 1.2899 -4.613 {"}'M' greentint -9.7389 1.3847 -4.8139 {"}'M' greentint -9.8978 1.3879 -5.0198 {"}'M' greentint -10.058 1.2968 -5.2026 {"}'M' greentint -10.1994 1.1263 -5.3382 {"}'M' greentint -9.642 1.5194 -5.0694 {"}'M' greentint -9.8033 1.4803 -5.2672 {"}'M' greentint -9.9599 1.3682 -5.4386 {"}'M' greentint -10.0985 1.1935 -5.5694 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 315 A}'M' green -10.4236 0.6716 -5.2452 {"}'M' green -10.3401 0.8494 -5.5032 {"}'M' green -10.2118 1.0612 -5.6547 {"}'M' green -9.5162 1.4853 -4.8726 {"}'M' green -9.5309 1.6114 -5.118 {"}'M' green -9.8265 1.422 -5.5642 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 315 A}'M' greentint -10.2665 0.667 -5.0396 {"}'M' greentint -10.1039 0.7227 -4.8455 {"}'M' greentint -9.946 0.8329 -4.672 {"}'M' greentint -9.8007 0.9947 -4.529 {"}'M' greentint -10.1921 0.8024 -5.2987 {"}'M' greentint -10.0329 0.8248 -5.0982 {"}'M' greentint -9.8732 0.9134 -4.9172 {"}'M' greentint -9.7265 1.063 -4.7696 {"}'M' greentint -9.6028 1.2628 -4.6649 {"}'M' greentint -10.0735 0.9843 -5.4532 {"}'M' greentint -9.9146 0.9953 -5.2523 {"}'M' greentint -9.7576 1.0912 -5.0749 {"}'M' greentint -9.6192 1.2618 -4.9434 {"}'M' greentint -9.9392 1.1922 -5.529 {"}'M' greentint -9.776 1.2214 -5.3263 {"}'M' greentint -9.6262 1.3751 -5.1755 {"}'M' greentint -9.6678 1.5193 -5.3865 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 195 1hfuA_245F_197}P -6.8292 5.7929 -11.1171 {"}-6.8292 5.7929 -11.1171 { ca tyr A 195 1hfuA_245F_197}-7.9003 6.1386 -10.201 { c tyr A 195 1hfuA_245F_197}-7.8135 5.3361 -8.9166 { o tyr A 195 1hfuA_245F_197}-7.6086 4.1243 -9.0161 { c tyr A 195 1hfuA_245F_197}P -7.8135 5.3361 -8.9166 { n arg A 196 1hfuA_245F_197}-8.0551 5.9941 -7.7787 { ca arg A 196 1hfuA_245F_197}-8.1713 5.227 -6.5405 { c arg A 196 1hfuA_245F_197}-9.6384 4.8067 -6.4248 { o arg A 196 1hfuA_245F_197}-10.4762 5.6093 -6.0083 { c arg A 196 1hfuA_245F_197}P -9.6384 4.8067 -6.4248 { n met A 197 1hfuA_245F_197}-10.0084 3.6215 -6.8839 { ca met A 197 1hfuA_245F_197}-11.3857 3.1373 -6.8069 { c met A 197 1hfuA_245F_197}-11.6085 2.5832 -5.4059 { o met A 197 1hfuA_245F_197}-10.838 1.7684 -4.9289 { c met A 197 1hfuA_245F_197}P -11.6085 2.5832 -5.4059 { n arg A 198 1hfuA_245F_197}-12.7299 3.0463 -4.8177 { ca arg A 198 1hfuA_245F_197}-12.9867 2.6119 -3.4359 { c arg A 198 1hfuA_245F_197}-14.209 1.6918 -3.4558 { o arg A 198 1hfuA_245F_197}-15.3319 2.1002 -3.7066 { c arg A 198 1hfuA_245F_197}P -14.209 1.6918 -3.4558 { n leu A 199 1hfuA_245F_197}-13.9142 0.3935 -3.3136 { ca leu A 199 1hfuA_245F_197}-14.9333 -0.6579 -3.4105 { c leu A 199 1hfuA_245F_197}-15.4513 -0.9922 -2.0189 { o leu A 199 1hfuA_245F_197}-14.6918 -1.2715 -1.1017 { n tyr A 243 1hfuA_245F_197}P -12.1504 -2.1739 -0.0965 {"}-12.1504 -2.1739 -0.0965 { ca tyr A 243 1hfuA_245F_197}-10.8461 -2.2268 -0.73 { c tyr A 243 1hfuA_245F_197}-10.6666 -0.9541 -1.5613 { o tyr A 243 1hfuA_245F_197}-11.5778 -0.6596 -2.3373 { c tyr A 243 1hfuA_245F_197}P -10.6666 -0.9541 -1.5613 { n ser A 244 1hfuA_245F_197}-9.5036 -0.3221 -1.4403 { ca ser A 244 1hfuA_245F_197}-9.1908 0.682 -2.4535 { c ser A 244 1hfuA_245F_197}-8.2653 -0.0657 -3.4393 { o ser A 244 1hfuA_245F_197}-7.318 -0.7322 -3.0076 { c ser A 244 1hfuA_245F_197}P -8.2653 -0.0657 -3.4393 { n phe A 245 1hfuA_245F_197}-8.5803 0.0651 -4.7132 { ca phe A 245 1hfuA_245F_197}-7.6561 -0.4708 -5.7252 { c phe A 245 1hfuA_245F_197}-7.4079 0.6443 -6.7358 { o phe A 245 1hfuA_245F_197}-8.2869 1.4661 -7.0705 { c phe A 245 1hfuA_245F_197}P -7.4079 0.6443 -6.7358 { n val A 246 1hfuA_245F_197}-6.1341 0.6866 -7.1594 { ca val A 246 1hfuA_245F_197}-5.8314 1.6388 -8.2396 { c val A 246 1hfuA_245F_197}-6.2634 0.944 -9.5343 { o val A 246 1hfuA_245F_197}-5.9858 -0.2361 -9.7981 { c val A 246 1hfuA_245F_197}P -6.2634 0.944 -9.5343 { n leu A 247 1hfuA_245F_197}-7.0395 1.6768 -10.313 { ca leu A 247 1hfuA_245F_197}-7.4685 1.2307 -11.6245 { c leu A 247 1hfuA_245F_197}-6.6355 2.0646 -12.6211 { o leu A 247 1hfuA_245F_197}-6.7333 3.296 -12.6223 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 195 1hfuA_245F_197}P -6.8292 5.7929 -11.1171 { ca tyr A 195 1hfuA_245F_197}P -7.9003 6.1386 -10.201 { n arg A 196 1hfuA_245F_197}P -8.0551 5.9941 -7.7787 { ca arg A 196 1hfuA_245F_197}P -8.1713 5.227 -6.5405 { n met A 197 1hfuA_245F_197}P -10.0084 3.6215 -6.8839 { ca met A 197 1hfuA_245F_197}P -11.3857 3.1373 -6.8069 { n arg A 198 1hfuA_245F_197}P -12.7299 3.0463 -4.8177 { ca arg A 198 1hfuA_245F_197}P -12.9867 2.6119 -3.4359 { n leu A 199 1hfuA_245F_197}P -13.9142 0.3935 -3.3136 { ca leu A 199 1hfuA_245F_197}P -14.9333 -0.6579 -3.4105 { n tyr A 243 1hfuA_245F_197}P -12.1504 -2.1739 -0.0965 { ca tyr A 243 1hfuA_245F_197}P -10.8461 -2.2268 -0.73 { n ser A 244 1hfuA_245F_197}P -9.5036 -0.3221 -1.4403 { ca ser A 244 1hfuA_245F_197}P -9.1908 0.682 -2.4535 { n phe A 245 1hfuA_245F_197}P -8.5803 0.0651 -4.7132 { ca phe A 245 1hfuA_245F_197}P -7.6561 -0.4708 -5.7252 { n val A 246 1hfuA_245F_197}P -6.1341 0.6866 -7.1594 { ca val A 246 1hfuA_245F_197}P -5.8314 1.6388 -8.2396 { n leu A 247 1hfuA_245F_197}P -7.0395 1.6768 -10.313 { ca leu A 247 1hfuA_245F_197}P -7.4685 1.2307 -11.6245 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 195 1hfuA_245F_197}P -7.9003 6.1386 -10.201 {"}-7.9003 6.1386 -10.201 { ca arg A 196 1hfuA_245F_197}-8.1713 5.227 -6.5405 { ca met A 197 1hfuA_245F_197}-11.3857 3.1373 -6.8069 { ca arg A 198 1hfuA_245F_197}-12.9867 2.6119 -3.4359 { ca leu A 199 1hfuA_245F_197}-14.9333 -0.6579 -3.4105 { ca tyr A 243 1hfuA_245F_197}P -10.8461 -2.2268 -0.73 {"}-10.8461 -2.2268 -0.73 { ca ser A 244 1hfuA_245F_197}-9.1908 0.682 -2.4535 { ca phe A 245 1hfuA_245F_197}-7.6561 -0.4708 -5.7252 { ca val A 246 1hfuA_245F_197}-5.8314 1.6388 -8.2396 { ca leu A 247 1hfuA_245F_197}-7.4685 1.2307 -11.6245 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca met A 197 1hfuA_245F_197}P -11.3857 3.1373 -6.8069 { cb met A 197 1hfuA_245F_197}-11.6127 2.0399 -7.8577 { cg met A 197 1hfuA_245F_197}-11.4938 2.5879 -9.2728 { sd met A 197 1hfuA_245F_197}-12.7344 3.8026 -9.6941 { ce met A 197 1hfuA_245F_197}-12.3951 4.0823 -11.4405 { ca phe A 245 1hfuA_245F_197}P -7.6561 -0.4708 -5.7252 { cb phe A 245 1hfuA_245F_197}-8.1471 -1.7596 -6.343 { cg phe A 245 1hfuA_245F_197}-9.4357 -1.6148 -7.1155 { cd1 phe A 245 1hfuA_245F_197}-9.3927 -1.2539 -8.4463 { ce1 phe A 245 1hfuA_245F_197}-10.564 -1.0934 -9.1867 { cz phe A 245 1hfuA_245F_197}-11.7832 -1.3338 -8.5647 { cg phe A 245 1hfuA_245F_197}P -9.4357 -1.6148 -7.1155 { cd2 phe A 245 1hfuA_245F_197}-10.6569 -1.8232 -6.4847 { ce2 phe A 245 1hfuA_245F_197}-11.8159 -1.7003 -7.239 { cz phe A 245 1hfuA_245F_197}ghost -11.7832 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1hpgA_52F_106V}-9.5664 -0.8291 -1.6036 { ca tyr A 51 1hpgA_52F_106V}-9.6906 0.05 -2.7702 { c tyr A 51 1hpgA_52F_106V}-9.0311 -0.6698 -3.9312 { o tyr A 51 1hpgA_52F_106V}-8.3385 -1.6664 -3.7123 { c tyr A 51 1hpgA_52F_106V}P -9.0311 -0.6698 -3.9312 { n phe A 52 1hpgA_52F_106V}-9.2125 -0.2727 -5.1772 { ca phe A 52 1hpgA_52F_106V}-8.3411 -0.7827 -6.2314 { c phe A 52 1hpgA_52F_106V}-7.8366 0.4425 -6.9972 { o phe A 52 1hpgA_52F_106V}-8.4746 1.511 -7.0519 { c phe A 52 1hpgA_52F_106V}P -7.8366 0.4425 -6.9972 { n val A 53 1hpgA_52F_106V}-6.5915 0.3663 -7.4465 { ca val A 53 1hpgA_52F_106V}-6.0195 1.4259 -8.2789 { c val A 53 1hpgA_52F_106V}-6.1166 0.9765 -9.7631 { o val A 53 1hpgA_52F_106V}-6.1661 -0.2311 -10.0508 { c val A 53 1hpgA_52F_106V}P -6.1166 0.9765 -9.7631 { n thr A 54 1hpgA_52F_106V}-6.1759 1.9273 -10.6918 { ca thr A 54 1hpgA_52F_106V}-6.3513 1.696 -12.1314 { c thr A 54 1hpgA_52F_106V}-5.7714 2.9389 -12.8186 { o thr A 54 1hpgA_52F_106V}-5.1427 3.8073 -12.1986 { n gly A 104 1hpgA_52F_106V}P -5.4154 6.3612 -10.8114 {"}-5.4154 6.3612 -10.8114 { ca gly A 104 1hpgA_52F_106V}-6.6345 6.7137 -10.1333 { c gly A 104 1hpgA_52F_106V}-6.9496 5.6066 -9.1476 { o gly A 104 1hpgA_52F_106V}-6.395 4.5165 -9.224 { c gly A 104 1hpgA_52F_106V}P -6.9496 5.6066 -9.1476 { n ile A 105 1hpgA_52F_106V}-7.8682 5.8613 -8.2363 { ca ile A 105 1hpgA_52F_106V}-8.2324 4.9048 -7.1964 { c ile A 105 1hpgA_52F_106V}-9.7483 4.9194 -7.0194 { o ile A 105 1hpgA_52F_106V}-10.3728 5.9905 -7.1348 { c ile A 105 1hpgA_52F_106V}P -9.7483 4.9194 -7.0194 { n val A 106 1hpgA_52F_106V}-10.2767 3.7077 -6.8038 { ca val A 106 1hpgA_52F_106V}-11.6916 3.4703 -6.6345 { c val A 106 1hpgA_52F_106V}-11.8791 2.7873 -5.2738 { o val A 106 1hpgA_52F_106V}-11.2068 1.8092 -4.9673 { c val A 106 1hpgA_52F_106V}P -11.8791 2.7873 -5.2738 { n arg A 107 1hpgA_52F_106V}-12.7562 3.3249 -4.4285 { ca arg A 107 1hpgA_52F_106V}-13.0853 2.7388 -3.1296 { c arg A 107 1hpgA_52F_106V}-14.1818 1.6831 -3.3416 { o arg A 107 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-6.6345 6.7137 -10.1333 {"}P -6.6345 6.7137 -10.1333 { n ile A 105 1hpgA_52F_106V}P -7.8682 5.8613 -8.2363 { ca ile A 105 1hpgA_52F_106V}P -8.2324 4.9048 -7.1964 { n val A 106 1hpgA_52F_106V}P -10.2767 3.7077 -6.8038 { ca val A 106 1hpgA_52F_106V}P -11.6916 3.4703 -6.6345 { n arg A 107 1hpgA_52F_106V}P -12.7562 3.3249 -4.4285 { ca arg A 107 1hpgA_52F_106V}P -13.0853 2.7388 -3.1296 { n tyr A 108 1hpgA_52F_106V}P -14.019 0.4581 -2.8462 { ca tyr A 108 1hpgA_52F_106V}P -15.0832 -0.5376 -2.9028 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca arg A 50 1hpgA_52F_106V}P -10.2848 -1.8675 0.466 {"}-10.2848 -1.8675 0.466 { ca tyr A 51 1hpgA_52F_106V}-9.6906 0.05 -2.7702 { ca phe A 52 1hpgA_52F_106V}-8.3411 -0.7827 -6.2314 { ca val A 53 1hpgA_52F_106V}-6.0195 1.4259 -8.2789 { ca thr A 54 1hpgA_52F_106V}-6.3513 1.696 -12.1314 { ca gly A 104 1hpgA_52F_106V}P -6.6345 6.7137 -10.1333 {"}-6.6345 6.7137 -10.1333 { ca ile A 105 1hpgA_52F_106V}-8.2324 4.9048 -7.1964 { ca val A 106 1hpgA_52F_106V}-11.6916 3.4703 -6.6345 { ca arg A 107 1hpgA_52F_106V}-13.0853 2.7388 -3.1296 { ca tyr A 108 1hpgA_52F_106V}-15.0832 -0.5376 -2.9028 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 52 1hpgA_52F_106V}P -8.3411 -0.7827 -6.2314 { cb phe A 52 1hpgA_52F_106V}-9.0584 -1.7459 -7.2073 { cg phe A 52 1hpgA_52F_106V}-10.2182 -1.2772 -8.0671 { cd1 phe A 52 1hpgA_52F_106V}-9.9734 -0.581 -9.238 { ce1 phe A 52 1hpgA_52F_106V}-11.0371 -0.1711 -10.0096 { cz phe A 52 1hpgA_52F_106V}-12.3318 -0.4432 -9.6204 { cg phe A 52 1hpgA_52F_106V}P -10.2182 -1.2772 -8.0671 { cd2 phe A 52 1hpgA_52F_106V}-11.5259 -1.5594 -7.6762 { ce2 phe A 52 1hpgA_52F_106V}-12.5792 -1.1438 -8.4692 { cz phe A 52 1hpgA_52F_106V}ghost -12.3318 -0.4432 -9.6204 { ca val A 106 1hpgA_52F_106V}P -11.6916 3.4703 -6.6345 { cb val A 106 1hpgA_52F_106V}-12.2228 2.5716 -7.8082 { cg1 val A 106 1hpgA_52F_106V}-13.6941 2.3019 -7.6659 { cb val A 106 1hpgA_52F_106V}P -12.2228 2.5716 -7.8082 { cg2 val A 106 1hpgA_52F_106V}-12.0908 3.3108 -9.1191 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 52 1hpgA_52F_106V}P -9.0584 -1.7459 -7.2073 {"}P -9.0584 -1.7459 -7.2073 { cd1 phe A 52 1hpgA_52F_106V}P -9.9734 -0.581 -9.238 { cd2 phe A 52 1hpgA_52F_106V}P -11.5259 -1.5594 -7.6762 { ce1 phe A 52 1hpgA_52F_106V}P -11.0371 -0.1711 -10.0096 { ce2 phe A 52 1hpgA_52F_106V}P -12.5792 -1.1438 -8.4692 { cz phe A 52 1hpgA_52F_106V}P -12.3318 -0.4432 -9.6204 { cb val A 106 1hpgA_52F_106V}P -12.2228 2.5716 -7.8082 { cg1 val A 106 1hpgA_52F_106V}P -13.6941 2.3019 -7.6659 {"}P -13.6941 2.3019 -7.6659 {"}P -13.6941 2.3019 -7.6659 { cg2 val A 106 1hpgA_52F_106V}P -12.0908 3.3108 -9.1191 {"}P -12.0908 3.3108 -9.1191 {"}P -12.0908 3.3108 -9.1191 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 52 A}'S' blue -10.8559 0.2539 -7.5094 {"}'S' blue -11.017 0.2389 -7.7124 {"}'S' blue -11.1798 0.1763 -7.9052 {"}'S' blue -10.7551 0.3607 -7.7668 {"}'S' sky -10.9155 0.3245 -7.9641 {"}'S' blue -11.0762 0.2461 -8.1487 { CD1 PHE 52 A}'S' blue -11.1676 0.2035 -8.2281 {"}'S' blue -10.8948 0.3432 -8.0716 {"}'S' sky -11.036 0.4243 -8.278 {"}'S' blue -10.6294 0.4318 -7.97 {"}'S' sky -10.7482 0.5585 -8.1597 {"}'S' sky -10.5489 0.7189 -8.2178 {"}'S' sky -10.6912 0.7892 -8.4198 {"}'S' blue -10.4581 0.9159 -8.4719 {"}'S' blue -10.6111 0.9501 -8.6803 { CD2 PHE 52 A}'S' blue -11.6284 0.1266 -7.2186 {"}'S' blue -11.7803 0.1538 -7.4221 {"}'S' blue -11.4365 0.1654 -7.3958 {"}'S' sky -11.5931 0.1884 -7.6032 {"}'S' blue -11.2573 0.1684 -7.5924 {"}'S' sky -11.4142 0.1828 -7.7999 {"}'S' blue -11.3674 0.1166 -8.1549 { CE1 PHE 52 A}'S' sky -11.7549 1.1991 -9.1913 {"}'S' sky -11.5218 1.3258 -9.2435 {"}'S' sky -11.6748 1.36 -9.4519 {"}'S' sky -11.8359 1.3451 -9.6549 {"}'S' sky -11.9987 1.2824 -9.8477 {"}'S' sky -11.1348 1.3213 -9.1014 {"}'S' sky -11.2702 1.4115 -9.3002 {"}'S' sky -11.4181 1.4613 -9.5052 {"}'S' sky -11.574 1.4669 -9.7093 {"}'S' sky -11.7344 1.4307 -9.9066 {"}'S' sky -11.8951 1.3522 -10.0912 {"}'S' blue -12.0502 1.2336 -10.2591 {"}'S' blue -10.6632 1.0394 -8.8025 {"}'S' blue -10.7565 1.2084 -8.9704 {"}'S' blue -10.9971 1.4491 -9.3491 {"}'S' sky -11.1395 1.515 -9.5519 {"}'S' sky -11.2914 1.5421 -9.7555 {"}'S' sky -11.4491 1.529 -9.956 {"}'S' sky -11.6099 1.4764 -10.1485 {"}'S' sky -11.7672 1.3867 -10.3276 {"}'S' blue -10.9477 1.5537 -9.7292 {"}'S' blue -11.1043 1.5767 -9.9365 {"}'S' blue -11.2659 1.5593 -10.1414 { CE2 PHE 52 A}'S' blue -13.2971 0.2264 -7.6509 {"}'S' sky -13.4514 0.2441 -7.8555 {"}'S' blue -13.6126 0.2063 -8.0537 {"}'S' blue -13.7712 0.1156 -8.2343 {"}'S' blue -12.9241 0.2722 -7.5002 {"}'S' sky -13.064 0.3531 -7.703 {"}'S' sky -13.3781 0.3724 -8.1144 {"}'S' sky -13.5409 0.3097 -8.3073 {"}'S' sky -13.6995 0.2007 -8.4821 {"}'S' sky -12.8124 0.4388 -7.7597 {"}'S' sky -13.2766 0.458 -8.3661 {"}'S' sky -12.4113 0.3734 -7.6136 {"}'S' sky -12.5393 0.4764 -7.8086 {"}'S' sky -12.6817 0.5423 -8.0115 {"}'S' sky -12.8336 0.5694 -8.2151 {"}'S' sky -12.09 0.2882 -7.5891 {"}'S' sky -11.4865 0.1615 -8.0648 { CZ PHE 52 A}'S' sky -13.5261 0.3413 -8.6104 {"}'S' sky -13.6923 0.308 -8.8163 {"}'S' sky -13.2532 0.481 -8.454 {"}'S' sky -13.6744 0.6768 -9.5408 {"}'S' sky -13.4521 0.9013 -9.6334 {"}'S' sky -12.8688 1.1948 -9.3201 {"}'S' sky -13.0292 1.1586 -9.5174 {"}'S' sky -12.5862 1.27 -9.3663 {"}'S' sky -12.7439 1.2569 -9.5668 {"}'S' blue -12.9047 1.2044 -9.7593 {"}'S' sky -12.2424 1.2816 -9.34 {"}'S' sky -12.3991 1.3046 -9.5473 {"}'S' sky -12.7245 1.2305 -9.9479 {"}'S' sky -11.9141 1.2317 -9.3293 {"}'S' sky -12.0632 1.2847 -9.5366 {"}'S' sky -12.5459 1.2141 -10.1409 {"}'S' sky -12.1734 1.2328 -10.0991 {"}'S' blue -12.3365 1.1722 -10.2929 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 52 A}'S' sea -10.8911 0.625 -8.3633 { CE1 PHE 52 A}'S' sea -11.2954 0.4045 -8.3768 {"}'S' green -11.3289 0.6364 -8.4841 {"}'S' green -11.3944 0.8396 -8.6268 {"}'S' green -11.4911 1.0068 -8.7971 {"}'S' green -11.6126 1.1288 -8.9894 {"}'S' sea -11.0444 0.5258 -8.4049 {"}'S' green -11.089 0.7529 -8.5245 {"}'S' green -11.1608 0.9529 -8.6735 {"}'S' green -11.2597 1.1186 -8.8482 {"}'S' sea -11.3819 1.2449 -9.0406 {"}'S' sea -10.8446 0.8335 -8.5901 {"}'S' sea -10.9196 1.0283 -8.7403 {"}'S' sea -11.0172 1.1922 -8.9129 { CE2 PHE 52 A}'S' sea -13.217 0.3873 -7.9114 {"}'S' sea -12.9603 0.4886 -7.9647 {"}'S' sea -13.1162 0.4942 -8.1688 {"}'S' sea -12.2087 0.4218 -7.7801 {"}'S' sea -12.3431 0.5202 -7.9811 {"}'S' sea -12.4899 0.581 -8.1888 {"}'S' sea -11.9013 0.3155 -7.7817 {"}'S' green -12.0237 0.4401 -7.9756 {"}'S' sea -11.6934 0.267 -7.9342 {"}'S' green -11.8157 0.3933 -8.1267 { CZ PHE 52 A}'S' green -13.3944 0.5621 -8.6603 {"}'S' green -13.5574 0.5543 -8.8676 {"}'S' sea -13.7207 0.458 -9.0517 {"}'S' sea -12.9878 0.5696 -8.3524 {"}'S' sea -13.1067 0.6963 -8.5421 {"}'S' green -13.2495 0.7628 -8.7456 {"}'S' green -13.4072 0.7628 -8.9492 {"}'S' green -13.568 0.6985 -9.1389 {"}'S' sea -13.7213 0.5713 -9.3022 {"}'S' sea -12.7858 0.7347 -8.4079 {"}'S' green -12.9074 0.8567 -8.6002 {"}'S' green -13.0497 0.927 -8.8021 {"}'S' green -13.2039 0.9447 -9.0068 {"}'S' green -13.3652 0.9069 -9.2049 {"}'S' sea -13.5238 0.8162 -9.3856 {"}'S' sea -12.4556 0.6808 -8.2843 {"}'S' green -12.5545 0.8465 -8.459 {"}'S' green -12.6767 0.9728 -8.6514 {"}'S' sea -12.8166 1.0537 -8.8543 {"}'S' sea -12.9696 1.0879 -9.0626 {"}'S' sea -13.1306 1.073 -9.2657 {"}'S' sea -13.2934 1.0103 -9.4585 {"}'S' green -12.1394 0.5614 -8.2008 {"}'S' green -12.2143 0.7562 -8.3511 {"}'S' green -12.312 0.9201 -8.5237 {"}'S' green -12.4295 1.0492 -8.7121 {"}'S' green -12.565 1.1394 -8.911 {"}'S' sea -12.7129 1.1892 -9.116 {"}'S' green -11.8856 0.5719 -8.2664 {"}'S' green -12.1639 1.074 -8.7649 {"}'S' green -12.2919 1.177 -8.9599 {"}'S' sea -12.4343 1.2429 -9.1627 {"}'S' sea -11.6067 0.4109 -8.2758 {"}'S' green -11.6634 0.6285 -8.4097 {"}'S' green -11.8426 0.9888 -8.7403 {"}'S' green -11.9613 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-6.5229 {"}'S' blue -12.8107 -0.138 -7.337 {"}'S' blue -12.6503 -0.0876 -7.1447 {"}'S' sky -12.4923 0.0009 -6.9642 {"}'S' sky -12.3399 0.1251 -6.8015 {"}'S' blue -12.1964 0.2823 -6.6599 {"}'S' sky -12.5962 -0.0616 -7.4714 {"}'S' sky -12.4348 -0.0027 -7.2796 {"}'S' sky -12.2768 0.0972 -7.1036 {"}'S' blue -12.1258 0.2347 -6.9474 {"}'S' blue -11.9873 0.4066 -6.8161 {"}'S' blue -12.0266 0.2838 -7.1904 {"}'S' sky -12.4191 0.176 -7.9859 {"}'S' blue -12.305 0.3575 -8.1584 {"}'S' sky -12.1478 0.3554 -7.955 { HB VAL 38 A}'S' sky -11.6695 0.3188 -7.0384 {"}'S' sky -11.5121 0.3367 -6.8394 {"}'S' sky -11.354 0.4135 -6.6561 {"}'S' blue -10.9806 0.4436 -6.5918 {"}'S' sky -10.8308 0.3131 -6.7948 {"}'S' sky -10.7242 0.2201 -7.0619 {"}'S' blue -10.5741 0.3559 -6.9065 {"}'S' sky -11.2563 0.4453 -8.2234 {"}'S' sky -10.5621 0.2425 -7.2693 {"}'S' sky -11.0202 0.5263 -8.307 {"}'S' sky -10.4626 0.2974 -7.5234 {"}'S' blue -10.782 0.6332 -8.3373 {"}'S' sky -10.3859 0.4162 -7.7635 {"}'S' blue -10.5245 0.7033 -8.2544 {"}'S' sky -10.3911 0.6006 -8.0537 {HG11 VAL 38 A}'S' blue -13.6489 -0.401 -7.9168 {"}'S' sky -13.6815 -0.3114 -8.4158 {"}'S' sky -13.0751 -0.3015 -7.6338 {"}'S' blue -12.925 -0.1657 -7.4784 {"}'S' sky -13.5047 -0.2291 -8.6202 {"}'S' sky -12.7627 -0.1477 -7.6827 {"}'S' sky -13.0303 -0.0412 -8.7341 {"}'S' sky -12.4436 0.1582 -8.0307 {"}'S' sky -12.742 0.079 -8.6256 {"}'S' sky -12.5785 0.1076 -8.4223 {"}'S' blue -12.4279 0.2615 -8.2703 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 38 A}'S' sea -11.8275 0.3487 -7.7278 {"}'S' sea -11.723 0.4061 -8.0218 { CG1 VAL 38 A}'S' sea -12.505 0.0321 -7.739 {"}'S' sea -12.3429 0.0701 -7.5398 {"}'S' sea -12.1816 0.1552 -7.354 {"}'S' sea -12.2606 0.1879 -7.784 {"}'S' sea -12.0994 0.2544 -7.5942 { HB VAL 38 A}'S' sea -11.737 0.2979 -7.5292 {"}'S' green -11.5997 0.2164 -7.3297 {"}'S' sea -11.4477 0.1906 -7.1264 {"}'S' sea -11.2883 0.2211 -6.9292 {"}'S' sea -11.1299 0.3076 -6.7477 {"}'S' green -11.576 0.2566 -7.7422 {"}'S' 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-0.2242 -8.0953 {"}'S' sea -12.6563 -0.1058 -7.9245 {"}'S' green -12.8932 -0.1162 -8.5347 {"}'S' sea -12.7368 -0.1054 -8.3354 {"}'S' sea -12.5807 -0.01 -8.1609 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 38 A}'S' P -11.194 0.1288 -7.6438 {"}'S' -11.1925 0.1467 -7.6407 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 236 A}'M' greentint -9.0268 2.4294 -5.9589 {"}'M' greentint -9.1704 2.3217 -6.2313 {"}'M' greentint -8.9281 2.7173 -6.0281 {"}'M' greentint -9.0768 2.5604 -6.1766 {"}'M' greentint -9.1805 2.464 -6.4741 {"}'M' greentint -9.237 2.2145 -6.4773 {"}'M' greentint -8.7789 2.9474 -6.0903 {"}'M' greentint -8.9375 2.8543 -6.2687 {"}'M' greentint -9.0767 2.6863 -6.4018 {"}'M' greentint -9.1501 2.558 -6.7189 {"}'M' greentint -9.2212 2.3129 -6.7431 {"}'M' greentint -8.5919 3.1365 -6.1581 {"}'M' greentint -8.7521 3.0783 -6.3501 {"}'M' greentint -8.9069 2.9552 -6.5148 {"}'M' greentint -9.0426 2.7777 -6.6409 {"}'M' greentint -9.0722 2.6382 -6.9571 {"}'M' greentint -9.1534 2.3951 -6.9955 {"}'M' greentint -8.5092 3.2565 -6.4022 {"}'M' greentint -8.6712 3.1743 -6.5879 {"}'M' greentint -8.8235 3.0384 -6.7478 {"}'M' greentint -8.9601 2.8568 -6.8727 {"}'M' greentint -8.9577 2.683 -7.1868 {"}'M' greentint -8.5702 3.2206 -6.8345 {"}'M' greentint -8.7163 3.077 -6.9844 {"}'M' greentint -8.8471 2.8951 -7.1028 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 38 A}'M' greentint -9.0971 2.2095 -6.2764 {"}'M' greentint -8.9469 2.334 -6.1166 {"}'M' greentint -8.8137 2.5096 -5.9935 {"}'M' greentint -8.7085 2.7242 -5.9157 {"}'M' greentint -9.2047 2.2048 -6.8137 {"}'M' greentint -9.0465 2.207 -6.61 {"}'M' greentint -8.8859 2.283 -6.4231 {"}'M' greentint -8.7363 2.4284 -6.2707 {"}'M' greentint -8.6117 2.6283 -6.1649 {"}'M' greentint -8.5232 2.8659 -6.1168 {"}'M' greentint -8.4787 3.1207 -6.1295 {"}'M' greentint -9.1016 2.3675 -7.0688 {"}'M' greentint -8.9528 2.3179 -6.8627 {"}'M' greentint -8.7905 2.3628 -6.6647 {"}'M' greentint -8.6363 2.4954 -6.503 {"}'M' greentint -8.512 2.6987 -6.3984 {"}'M' greentint -8.4337 2.9444 -6.3663 {"}'M' greentint -8.4128 3.1998 -6.4096 {"}'M' greentint -8.9736 2.6031 -7.2313 {"}'M' greentint -8.8418 2.5013 -7.0331 {"}'M' greentint -8.6808 2.5294 -6.8331 {"}'M' greentint -8.5328 2.6813 -6.6843 {"}'M' greentint -8.438 2.9155 -6.6269 {"}'M' greentint -8.4217 3.1692 -6.6762 {"}'M' greentint -8.7083 2.7192 -7.0866 {"}'M' greentint -8.5484 2.8161 -6.9072 {"}'M' greentint -8.4934 3.0694 -6.907 {"}'M' greentint -8.6267 2.9657 -7.1065 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 236 A}'M' greentint -9.7183 1.1551 -4.166 {"}'M' greentint -9.8516 1.0515 -4.3655 {"}'M' greentint -9.6366 1.4017 -4.1858 {"}'M' greentint -9.7966 1.3048 -4.3653 {"}'M' greentint -9.907 1.2054 -4.6455 {"}'M' greentint -9.9233 0.9517 -4.5962 {"}'M' greentint -9.5031 1.6195 -4.2394 {"}'M' greentint -9.6641 1.5915 -4.4393 {"}'M' greentint -9.8122 1.4395 -4.5882 {"}'M' greentint -9.8787 1.3028 -4.8991 {"}'M' greentint -9.9291 1.0482 -4.8945 {"}'M' greentint -9.3147 1.7894 -4.306 {"}'M' greentint -9.4736 1.7926 -4.5119 {"}'M' greentint -9.6339 1.7015 -4.6948 {"}'M' greentint -9.7753 1.531 -4.8303 {"}'M' greentint -9.7819 1.3771 -5.1392 {"}'M' greentint -9.8501 1.1281 -5.1568 {"}'M' greentint -9.3792 1.8849 -4.7594 {"}'M' greentint -9.5358 1.7729 -4.9308 {"}'M' greentint -9.6744 1.5982 -5.0615 {"}'M' greentint -9.6365 1.3966 -5.3567 {"}'M' greentint -9.3981 1.7869 -5.1559 {"}'M' greentint -9.5312 1.6113 -5.279 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 38 A}'M' green -9.2839 1.8073 -4.3055 {"}'M' green -9.4358 1.6447 -5.3391 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 38 A}'M' greentint -9.8275 0.9086 -4.394 {"}'M' greentint -9.6872 1.0706 -4.2579 {"}'M' greentint -9.5652 1.2672 -4.1549 {"}'M' greentint -9.4668 1.4921 -4.0889 {"}'M' greentint -9.8719 0.848 -4.798 {"}'M' greentint -9.7141 0.9583 -4.6245 {"}'M' greentint -9.5687 1.12 -4.4816 {"}'M' greentint -9.4441 1.3224 -4.378 {"}'M' greentint -9.3476 1.5555 -4.3181 {"}'M' greentint -9.801 0.9502 -5.0507 {"}'M' greentint -9.6412 1.0388 -4.8697 {"}'M' greentint -9.4945 1.1884 -4.7222 {"}'M' greentint -9.3708 1.3881 -4.6175 {"}'M' greentint -9.279 1.6223 -4.5642 {"}'M' greentint -9.227 1.8732 -4.5658 {"}'M' greentint -9.6827 1.1207 -5.2048 {"}'M' greentint -9.5257 1.2166 -5.0275 {"}'M' greentint -9.3872 1.3871 -4.896 {"}'M' greentint -9.2843 1.6106 -4.8251 {"}'M' greentint -9.2298 1.8603 -4.8248 {"}'M' greentint -9.5441 1.3467 -5.2789 {"}'M' greentint -9.3943 1.5005 -5.128 {"}'M' greentint -9.299 1.7368 -5.0705 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 257 1hx6A_379Y_259}P -8.1614 5.2094 -12.2921 {"}-8.1614 5.2094 -12.2921 { ca leu A 257 1hx6A_379Y_259}-9.2834 5.3017 -11.3569 { c leu A 257 1hx6A_379Y_259}-8.7787 4.9031 -9.978 { o leu A 257 1hx6A_379Y_259}-8.0353 3.9311 -9.8458 { c leu A 257 1hx6A_379Y_259}P -8.7787 4.9031 -9.978 { n tyr A 258 1hx6A_379Y_259}-9.1531 5.6792 -8.9597 { ca tyr A 258 1hx6A_379Y_259}-8.8072 5.3612 -7.5856 { c tyr A 258 1hx6A_379Y_259}-10.1889 5.1604 -6.9846 { o tyr A 258 1hx6A_379Y_259}-10.9455 6.1238 -6.8134 { c tyr A 258 1hx6A_379Y_259}P -10.1889 5.1604 -6.9846 { n asn A 259 1hx6A_379Y_259}-10.5074 3.9023 -6.7004 { ca asn A 259 1hx6A_379Y_259}-11.8245 3.5214 -6.1972 { c asn A 259 1hx6A_379Y_259}-11.8267 2.7332 -4.9078 { o asn A 259 1hx6A_379Y_259}-10.8736 2.0344 -4.5889 { c asn A 259 1hx6A_379Y_259}P -11.8267 2.7332 -4.9078 { n leu A 260 1hx6A_379Y_259}-12.9409 2.8341 -4.193 { ca leu A 260 1hx6A_379Y_259}-13.1718 2.0385 -3.0008 { c leu A 260 1hx6A_379Y_259}-14.3792 1.1975 -3.4116 { o leu A 260 1hx6A_379Y_259}-15.3047 1.7163 -4.043 { c leu A 260 1hx6A_379Y_259}P -14.3792 1.1975 -3.4116 { n glu A 261 1hx6A_379Y_259}-14.3677 -0.0827 -3.0644 { ca glu A 261 1hx6A_379Y_259}-15.4832 -0.9776 -3.373 { c glu A 261 1hx6A_379Y_259}-15.6614 -2.0012 -2.2671 { o glu A 261 1hx6A_379Y_259}-14.7085 -2.3503 -1.5719 { n tyr A 377 1hx6A_379Y_259}P -12.3211 -2.7237 -0.324 {"}-12.3211 -2.7237 -0.324 { ca tyr A 377 1hx6A_379Y_259}-11.0686 -2.5292 -1.0506 { c tyr A 377 1hx6A_379Y_259}-10.7969 -1.1107 -1.5258 { o tyr A 377 1hx6A_379Y_259}-11.7032 -0.357 -1.8822 { c tyr A 377 1hx6A_379Y_259}P -10.7969 -1.1107 -1.5258 { n glu A 378 1hx6A_379Y_259}-9.5183 -0.7661 -1.5333 { ca glu A 378 1hx6A_379Y_259}-9.0293 0.515 -2.0324 { c glu A 378 1hx6A_379Y_259}-8.1305 0.0733 -3.1895 { o glu A 378 1hx6A_379Y_259}-7.2434 -0.7478 -2.9721 { c glu A 378 1hx6A_379Y_259}P -8.1305 0.0733 -3.1895 { n tyr A 379 1hx6A_379Y_259}-8.3297 0.5807 -4.4029 { ca tyr A 379 1hx6A_379Y_259}-7.4547 0.1443 -5.498 { c tyr A 379 1hx6A_379Y_259}-7.3223 1.1606 -6.6154 { o tyr A 379 1hx6A_379Y_259}-8.0875 2.1227 -6.6812 { c tyr A 379 1hx6A_379Y_259}P -7.3223 1.1606 -6.6154 { n phe A 380 1hx6A_379Y_259}-6.3149 0.9383 -7.4707 { ca phe A 380 1hx6A_379Y_259}-6.0535 1.7605 -8.6546 { c phe A 380 1hx6A_379Y_259}-6.2809 0.8258 -9.8389 { o phe A 380 1hx6A_379Y_259}-5.9926 -0.3716 -9.7542 { c phe A 380 1hx6A_379Y_259}P -6.2809 0.8258 -9.8389 { n thr A 381 1hx6A_379Y_259}-6.7836 1.3695 -10.9371 { ca thr A 381 1hx6A_379Y_259}-6.9475 0.5798 -12.1481 { c thr A 381 1hx6A_379Y_259}-7.073 1.529 -13.3326 { o thr A 381 1hx6A_379Y_259}-7.5454 2.6577 -13.1952 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 257 1hx6A_379Y_259}P -8.1614 5.2094 -12.2921 { ca leu A 257 1hx6A_379Y_259}P -9.2834 5.3017 -11.3569 { n tyr A 258 1hx6A_379Y_259}P -9.1531 5.6792 -8.9597 { ca tyr A 258 1hx6A_379Y_259}P -8.8072 5.3612 -7.5856 { n asn A 259 1hx6A_379Y_259}P -10.5074 3.9023 -6.7004 { ca asn A 259 1hx6A_379Y_259}P -11.8245 3.5214 -6.1972 { n leu A 260 1hx6A_379Y_259}P -12.9409 2.8341 -4.193 { ca leu A 260 1hx6A_379Y_259}P -13.1718 2.0385 -3.0008 { n glu A 261 1hx6A_379Y_259}P -14.3677 -0.0827 -3.0644 { ca glu A 261 1hx6A_379Y_259}P -15.4832 -0.9776 -3.373 { n tyr A 377 1hx6A_379Y_259}P -12.3211 -2.7237 -0.324 { ca tyr A 377 1hx6A_379Y_259}P -11.0686 -2.5292 -1.0506 { n glu A 378 1hx6A_379Y_259}P -9.5183 -0.7661 -1.5333 { ca glu A 378 1hx6A_379Y_259}P -9.0293 0.515 -2.0324 { n tyr A 379 1hx6A_379Y_259}P -8.3297 0.5807 -4.4029 { ca tyr A 379 1hx6A_379Y_259}P -7.4547 0.1443 -5.498 { n phe A 380 1hx6A_379Y_259}P -6.3149 0.9383 -7.4707 { ca phe A 380 1hx6A_379Y_259}P -6.0535 1.7605 -8.6546 { n thr A 381 1hx6A_379Y_259}P -6.7836 1.3695 -10.9371 { ca thr A 381 1hx6A_379Y_259}P -6.9475 0.5798 -12.1481 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 257 1hx6A_379Y_259}P -9.2834 5.3017 -11.3569 {"}-9.2834 5.3017 -11.3569 { ca tyr A 258 1hx6A_379Y_259}-8.8072 5.3612 -7.5856 { ca asn A 259 1hx6A_379Y_259}-11.8245 3.5214 -6.1972 { ca leu A 260 1hx6A_379Y_259}-13.1718 2.0385 -3.0008 { ca glu A 261 1hx6A_379Y_259}-15.4832 -0.9776 -3.373 { ca tyr A 377 1hx6A_379Y_259}P -11.0686 -2.5292 -1.0506 {"}-11.0686 -2.5292 -1.0506 { ca glu A 378 1hx6A_379Y_259}-9.0293 0.515 -2.0324 { ca tyr A 379 1hx6A_379Y_259}-7.4547 0.1443 -5.498 { ca phe A 380 1hx6A_379Y_259}-6.0535 1.7605 -8.6546 { ca thr A 381 1hx6A_379Y_259}-6.9475 0.5798 -12.1481 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca asn A 259 1hx6A_379Y_259}P -11.8245 3.5214 -6.1972 { cb asn A 259 1hx6A_379Y_259}-12.549 2.611 -7.2069 { cg asn A 259 1hx6A_379Y_259}-12.6219 3.1929 -8.6048 { od1 asn A 259 1hx6A_379Y_259}-12.4368 4.38 -8.809 { cg asn A 259 1hx6A_379Y_259}P -12.6219 3.1929 -8.6048 { nd2 asn A 259 1hx6A_379Y_259}-12.924 2.3387 -9.5764 { ca tyr A 379 1hx6A_379Y_259}P -7.4547 0.1443 -5.498 { cb tyr A 379 1hx6A_379Y_259}-7.9608 -1.1908 -6.085 { cg tyr A 379 1hx6A_379Y_259}-9.3051 -1.0958 -6.8059 { cd1 tyr A 379 1hx6A_379Y_259}-9.3942 -0.6069 -8.1159 { ce1 tyr A 379 1hx6A_379Y_259}-10.6302 -0.4737 -8.7624 { cz tyr A 379 1hx6A_379Y_259}-11.793 -0.8365 -8.0901 { oh tyr A 379 1hx6A_379Y_259}-13.0194 -0.6894 -8.6925 { cg tyr A 379 1hx6A_379Y_259}P -9.3051 -1.0958 -6.8059 { cd2 tyr A 379 1hx6A_379Y_259}-10.4872 -1.456 -6.1606 { ce2 tyr A 379 1hx6A_379Y_259}-11.7346 -1.3257 -6.8016 { cz tyr A 379 1hx6A_379Y_259}ghost -11.793 -0.8365 -8.0901 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb asn A 259 1hx6A_379Y_259}P -12.549 2.611 -7.2069 {"}P -12.549 2.611 -7.2069 { nd2 asn A 259 1hx6A_379Y_259}P -12.924 2.3387 -9.5764 {"}P -12.924 2.3387 -9.5764 { cb tyr A 379 1hx6A_379Y_259}P -7.9608 -1.1908 -6.085 {"}P -7.9608 -1.1908 -6.085 { cd1 tyr A 379 1hx6A_379Y_259}P -9.3942 -0.6069 -8.1159 { cd2 tyr A 379 1hx6A_379Y_259}P -10.4872 -1.456 -6.1606 { ce1 tyr A 379 1hx6A_379Y_259}P -10.6302 -0.4737 -8.7624 { ce2 tyr A 379 1hx6A_379Y_259}P -11.7346 -1.3257 -6.8016 { oh tyr A 379 1hx6A_379Y_259}P -13.0194 -0.6894 -8.6925 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 379 A}'S' sky -10.8528 0.816 -7.601 {"}'S' sky -11.429 1.0425 -8.4077 {"}'S' blue -11.8997 0.7192 -8.926 {"}'S' blue -12.0351 0.3783 -9.3647 {"}'S' sky -10.8633 1.1089 -8.053 {"}'S' sky -11.0112 1.1587 -8.258 {"}'S' blue -11.6434 0.931 -9.0119 {"}'S' blue -11.7889 0.7769 -9.1569 {"}'S' blue -11.9211 0.5911 -9.2763 {"}'S' blue -11.5135 0.9587 -9.2423 {"}'S' blue -11.6571 0.8001 -9.3836 { CE2 TYR 379 A}'S' blue -12.2716 0.3123 -6.5013 {"}'S' blue -12.432 0.2761 -6.6985 {"}'S' sky -11.989 0.3875 -6.5475 {"}'S' sky -11.6452 0.3991 -6.5212 {"}'S' sky -11.466 0.4022 -6.7178 {"}'S' blue -11.2568 0.3561 -6.869 { CZ TYR 379 A}'S' sky -12.5232 0.7213 -8.4081 {"}'S' blue -12.0071 0.8208 -8.6106 {"}'S' blue -11.959 0.6823 -8.9439 {"}'S' sky -12.114 0.5509 -9.107 {"}'S' sky -12.2594 0.3878 -9.2497 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 379 A}'S' sea -11.0842 0.7042 -7.5499 {"}'S' green -11.2058 0.8262 -7.7422 {"}'S' green -11.348 0.8965 -7.9442 {"}'S' green -11.5023 0.9142 -8.1488 {"}'S' sea -10.9751 0.9423 -7.7935 {"}'S' sea -11.115 1.0232 -7.9963 {"}'S' sea -11.268 1.0574 -8.2047 { CE2 TYR 379 A}'S' sea -12.1467 0.3744 -6.748 {"}'S' sea -11.8019 0.4221 -6.7285 { CZ TYR 379 A}'S' green -12.3686 0.4633 -7.0699 {"}'S' green -12.5108 0.5337 -7.2719 {"}'S' green -12.6651 0.5514 -7.4765 {"}'S' green -12.0157 0.4531 -6.9287 {"}'S' green -12.5918 0.6796 -7.7354 {"}'S' green -11.7732 0.5268 -6.9935 {"}'S' green -12.4904 0.7652 -7.9871 {"}'S' green -11.5124 0.5429 -7.0509 {"}'S' green -11.3038 0.5954 -7.21 {"}'S' green -12.0218 0.8938 -8.222 {"}'S' sea -12.3469 0.7434 -8.5994 {"}'S' green -12.5023 0.6137 -8.7652 {"}'S' green -11.2374 0.7473 -7.5966 {"}'S' green -11.3753 0.8383 -7.799 {"}'S' green -11.5244 0.8913 -8.0064 {"}'S' green -11.6813 0.9057 -8.2138 {"}'S' sea -12.1679 0.7223 -8.7909 {"}'S' sea -12.3222 0.5907 -8.9546 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 379 A}'S' P -12.1379 0.5794 -7.1212 {"}'S' -12.1287 0.5404 -7.1476 {"}'S' P -12.2778 0.6604 -7.324 {"}'S' -12.2558 0.5934 -7.3591 {"}'S' P -12.4308 0.6946 -7.5324 {"}'S' -12.4118 0.6484 -7.5489 {"}'S' P -11.8907 0.6559 -7.1819 {"}'S' -11.886 0.5824 -7.227 {"}'S' P -12.0262 0.7461 -7.3807 {"}'S' -12.0084 0.6259 -7.435 {"}'S' P -12.1741 0.7959 -7.5857 {"}'S' -12.146 0.6789 -7.6215 {"}'S' P -12.33 0.8014 -7.7898 {"}'S' -12.3101 0.7413 -7.8002 {"}'S' P -11.6251 0.6807 -7.2346 {"}'S' -11.6309 0.626 -7.2659 {"}'S' P -11.7531 0.7837 -7.4296 {"}'S' -11.7564 0.6667 -7.4775 {"}'S' P -11.8955 0.8495 -7.6325 {"}'S' -11.8873 0.7136 -7.6689 {"}'S' P -12.0474 0.8767 -7.836 {"}'S' -12.0327 0.7749 -7.8508 {"}'S' P -12.2051 0.8636 -8.0366 {"}'S' -12.1993 0.8389 -8.0368 {"}'S' P -11.4225 0.7291 -7.4011 {"}'S' -11.429 0.7003 -7.4137 {"}'S' P -11.5569 0.8275 -7.6021 {"}'S' -11.5681 0.7486 -7.6251 {"}'S' P -11.7036 0.8883 -7.8097 {"}'S' -11.7085 0.8008 -7.8237 {"}'S' P -11.8603 0.9113 -8.0171 {"}'S' -11.8579 0.8618 -8.0196 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 379 A}'S' blue -12.8165 0.585 -8.1491 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 379 A}'S' green -13.4199 0.6441 -8.5463 {"}'S' green -13.579 0.593 -8.7385 {"}'S' green -13.1039 0.7007 -8.5529 {"}'S' green -13.5791 0.5215 -9.117 {"}'S' green -12.7742 0.6802 -8.542 {"}'S' green -13.5507 0.3567 -9.4559 {"}'S' green -12.5674 0.6359 -8.6917 {"}'S' green -13.345 0.3183 -9.6085 {"}'S' green -12.511 0.5726 -9.0223 {"}'S' green -12.9858 0.3887 -9.5849 {"}'S' green -12.4422 0.4359 -9.2935 {"}'S' green -12.6005 0.3864 -9.4848 {"}'S' sea -12.7567 0.2882 -9.6589 @dotlist {x} color= red width= 1 master= {H-bonds} { OH TYR 379 A}'S' greentint -13.262 0.6881 -8.7542 {"}'S' greentint -13.4222 0.6274 -8.9439 {"}'S' greentint -12.9274 0.7064 -8.7471 {"}'S' greentint -13.0866 0.6854 -8.9478 {"}'S' greentint -13.2474 0.6183 -9.137 {"}'S' greentint -13.404 0.5077 -9.3086 {"}'S' greentint -12.7205 0.6635 -8.8971 {"}'S' greentint -12.8804 0.644 -9.0975 {"}'S' greentint -13.0417 0.5775 -9.2873 {"}'S' greentint -13.1982 0.4682 -9.4592 {"}'S' greentint -12.6699 0.5588 -9.2226 {"}'S' greentint -12.8293 0.4966 -9.4127 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ASN 259 A}'S' blue -12.8504 0.9885 -7.7903 {"}'S' blue -12.721 1.097 -8.0688 { HB2 ASN 259 A}'S' sky -12.0608 0.6763 -6.5885 {"}'S' sky -11.7618 0.6818 -6.6356 {"}'S' sky -11.505 0.7246 -6.7473 {"}'S' sky -11.768 1.2131 -8.3068 {"}'S' sky -11.5233 1.2805 -8.2406 {"}'S' sky -11.0079 1.1518 -7.5392 {"}'S' sky -11.3021 1.3511 -8.1185 {"}'S' sky -11.0367 1.2924 -7.7594 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ASN 259 A}'S' green -12.5306 0.5851 -7.1705 {"}'S' sea -12.2193 0.5898 -6.77 {"}'S' green -12.6157 0.766 -7.7621 {"}'S' green -12.0734 0.5012 -6.9878 {"}'S' sea -11.9147 0.5657 -6.8011 {"}'S' green -11.4931 0.6111 -7.1101 {"}'S' green -11.7129 1.0019 -8.1781 {"}'S' green -11.3168 0.7848 -7.6044 {"}'S' green -11.4555 1.072 -8.0952 {"}'S' green -11.3221 0.9692 -7.8945 {"}'S' green -11.1585 0.9978 -7.6912 {"}'S' sea -11.1971 1.1947 -7.9392 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 ASN 259 A}'S' P -12.5069 0.6253 -7.583 {"}'S' -12.4976 0.6443 -7.5763 {"}'S' P -12.3762 0.5309 -7.388 {"}'S' -12.3605 0.5807 -7.3813 {"}'S' P -12.2289 0.4893 -7.1857 {"}'S' -12.2222 0.5325 -7.1881 {"}'S' P -12.3776 0.7106 -7.8701 {"}'S' -12.3655 0.7431 -7.8489 {"}'S' P -12.2615 0.5789 -7.6847 {"}'S' -12.242 0.6718 -7.6469 {"}'S' P -12.1249 0.4975 -7.4846 {"}'S' -12.115 0.6193 -7.4596 {"}'S' P -11.9725 0.4725 -7.2809 {"}'S' -11.9777 0.5732 -7.2785 {"}'S' P -11.8131 0.503 -7.0837 {"}'S' -11.8202 0.5395 -7.0897 {"}'S' P -12.1873 0.8139 -8.0642 {"}'S' -12.1842 0.8325 -8.0454 {"}'S' P -12.0847 0.6612 -7.8891 {"}'S' -12.0801 0.749 -7.8311 {"}'S' P -11.9563 0.5604 -7.694 {"}'S' -11.9654 0.6933 -7.6393 {"}'S' P -11.809 0.5173 -7.4914 {"}'S' -11.8343 0.6472 -7.4634 {"}'S' P -11.6508 0.5351 -7.2929 {"}'S' -11.6765 0.6091 -7.2902 {"}'S' P -11.9511 0.895 -8.1478 {"}'S' -11.9517 0.8985 -8.1443 {"}'S' P -11.8474 0.7362 -7.9699 {"}'S' -11.8604 0.8027 -7.9173 {"}'S' P -11.7125 0.6414 -7.769 {"}'S' -11.7436 0.7422 -7.7165 {"}'S' P -11.5568 0.6172 -7.5608 {"}'S' -11.594 0.6985 -7.5362 {"}'S' P -11.3935 0.6661 -7.3642 {"}'S' -11.4024 0.6804 -7.3625 {"}'S' P -11.6103 0.8491 -8.0031 {"}'S' -11.62 0.867 -7.9862 {"}'S' P -11.4732 0.7741 -7.8036 {"}'S' -11.4926 0.8049 -7.7842 @dotlist {x} color= sky width= 1 master= {vdw contact} { ND2 ASN 259 A}'S' blue -12.1593 1.1761 -8.8947 {"}'S' blue -11.9998 1.1912 -9.0954 {"}'S' blue -11.9533 1.1434 -9.3951 {"}'S' blue -11.8085 1.3119 -9.2545 {HD22 ASN 259 A}'S' blue -12.5192 1.0916 -8.5777 {"}'S' -12.371 0.9617 -8.7779 {"}'S' -12.2742 0.8658 -9.027 {"}'S' -12.2987 0.7328 -9.3651 {"}'S' blue -12.1745 0.9362 -9.2605 @dotlist {x} color= sky width= 1 master= {vdw contact} {HD22 ASN 259 A}'S' green -13.6471 0.6096 -9.0729 {"}'S' green -13.3278 0.6885 -8.6819 {"}'S' green -13.1791 0.8341 -8.5289 {"}'S' green -13.6158 0.5354 -9.4113 {"}'S' green -12.8807 0.8336 -8.5431 {"}'S' green -12.4762 0.747 -8.8556 {"}'S' green -12.8672 0.4423 -9.6759 {"}'S' green -12.709 0.4445 -9.4721 {"}'S' green -12.5483 0.5205 -9.2853 @dotlist {x} color= sky width= 1 master= {H-bonds} {HD22 ASN 259 A}'S' greentint -13.4889 0.6118 -8.8692 {"}'S' greentint -13.4754 0.4712 -9.2116 {"}'S' greentint -13.3211 0.4705 -9.0125 {"}'S' greentint -13.1637 0.5343 -8.8256 {"}'S' greentint -13.0126 0.6586 -8.6663 {"}'S' greentint -13.3341 0.4102 -9.4404 {"}'S' greentint -13.1851 0.3859 -9.2414 {"}'S' greentint -13.0285 0.4233 -9.0495 {"}'S' greentint -12.8735 0.5205 -8.877 {"}'S' greentint -12.7322 0.6713 -8.7354 {"}'S' greentint -13.0721 0.384 -9.524 {"}'S' greentint -12.9178 0.3833 -9.3249 {"}'S' greentint -12.7596 0.447 -9.1385 {"}'S' greentint -12.6093 0.5714 -8.9787 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 379 A}'M' green -9.4032 2.4074 -6.2973 {"}'M' green -9.1609 2.803 -6.094 {"}'M' green -9.4845 2.1449 -6.7775 {"}'M' green -9.4335 2.2264 -7.0511 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 379 A}'M' greentint -9.3095 2.6461 -6.2425 {"}'M' greentint -9.4132 2.5497 -6.54 {"}'M' greentint -9.4697 2.3002 -6.5433 {"}'M' greentint -9.1702 2.94 -6.3346 {"}'M' greentint -9.3095 2.772 -6.4678 {"}'M' greentint -9.3828 2.6437 -6.7848 {"}'M' greentint -9.454 2.3986 -6.809 {"}'M' greentint -8.9849 3.164 -6.416 {"}'M' greentint -9.1396 3.0409 -6.5807 {"}'M' greentint -9.2754 2.8634 -6.7069 {"}'M' greentint -9.3049 2.7239 -7.0231 {"}'M' greentint -9.3861 2.4808 -7.0614 {"}'M' greentint -8.904 3.26 -6.6538 {"}'M' greentint -9.0562 3.1241 -6.8138 {"}'M' greentint -9.1929 2.9425 -6.9386 {"}'M' greentint -9.1904 2.7687 -7.2527 {"}'M' greentint -9.276 2.5339 -7.2973 {"}'M' greentint -8.949 3.1628 -7.0503 {"}'M' greentint -9.0798 2.9808 -7.1688 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ASN 259 A}'M' green -9.1047 2.965 -6.196 {"}'M' green -9.4225 2.3188 -7.1699 {"}'M' green -9.3115 2.5023 -7.3403 {"}'M' green -9.178 2.7201 -7.3938 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ASN 259 A}'M' greentint -9.4165 2.3349 -6.4238 {"}'M' greentint -9.2834 2.5105 -6.3007 {"}'M' greentint -9.1781 2.7252 -6.2229 {"}'M' greentint -9.3555 2.2839 -6.7303 {"}'M' greentint -9.206 2.4293 -6.5779 {"}'M' greentint -9.0814 2.6293 -6.4721 {"}'M' greentint -8.9928 2.8669 -6.424 {"}'M' greentint -8.9483 3.1216 -6.4367 {"}'M' greentint -9.2601 2.3637 -6.9719 {"}'M' greentint -9.1059 2.4963 -6.8102 {"}'M' greentint -8.9817 2.6997 -6.7056 {"}'M' greentint -8.9034 2.9453 -6.6734 {"}'M' greentint -8.8824 3.2008 -6.7168 {"}'M' greentint -9.1505 2.5303 -7.1403 {"}'M' greentint -9.0024 2.6823 -6.9915 {"}'M' greentint -8.9076 2.9164 -6.9341 {"}'M' greentint -8.8913 3.1701 -6.9834 {"}'M' greentint -9.018 2.817 -7.2144 {"}'M' greentint -8.9631 3.0703 -7.2142 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 379 A}'M' greentint -9.8149 1.4144 -4.0427 {"}'M' greentint -9.9481 1.3108 -4.2422 {"}'M' greentint -9.7332 1.661 -4.0626 {"}'M' greentint -9.8932 1.5641 -4.242 {"}'M' greentint -10.0036 1.4647 -4.5223 {"}'M' greentint -10.0198 1.211 -4.473 {"}'M' greentint -9.5997 1.8788 -4.1161 {"}'M' greentint -9.7607 1.8508 -4.3161 {"}'M' greentint -9.9087 1.6988 -4.4649 {"}'M' greentint -9.9753 1.5621 -4.7759 {"}'M' greentint -10.0257 1.3075 -4.7713 {"}'M' greentint -10.017 1.0596 -4.6908 {"}'M' greentint -9.5702 2.0518 -4.3887 {"}'M' greentint -9.7304 1.9608 -4.5715 {"}'M' greentint -9.8718 1.7903 -4.7071 {"}'M' greentint -9.8784 1.6364 -5.0159 {"}'M' greentint -9.9467 1.3874 -5.0336 {"}'M' greentint -9.9672 1.1342 -4.9901 {"}'M' greentint -9.6324 2.0322 -4.8075 {"}'M' greentint -9.7709 1.8575 -4.9382 {"}'M' greentint -9.733 1.6559 -5.2335 {"}'M' greentint -9.6278 1.8706 -5.1557 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ASN 259 A}'M' green -9.5174 2.0663 -4.243 {"}'M' green -9.9435 1.125 -5.1078 @dotlist {x} color= red width= 1 master= {H-bonds} { O ASN 259 A}'M' greentint -9.8261 1.2715 -4.0579 {"}'M' greentint -9.7277 1.4964 -3.9918 {"}'M' greentint -9.9749 0.9626 -4.5275 {"}'M' greentint -9.8295 1.1243 -4.3845 {"}'M' greentint -9.7049 1.3267 -4.2809 {"}'M' greentint -9.6085 1.5598 -4.221 {"}'M' greentint -9.5447 1.8116 -4.2085 {"}'M' greentint -9.9021 1.043 -4.7727 {"}'M' greentint -9.7554 1.1926 -4.6251 {"}'M' greentint -9.6316 1.3924 -4.5204 {"}'M' greentint -9.5398 1.6266 -4.4671 {"}'M' greentint -9.4878 1.8774 -4.4687 {"}'M' greentint -9.4779 2.1276 -4.526 {"}'M' greentint -9.7865 1.2208 -4.9304 {"}'M' greentint -9.648 1.3914 -4.7989 {"}'M' greentint -9.5451 1.6149 -4.728 {"}'M' greentint -9.4907 1.8646 -4.7277 {"}'M' greentint -9.491 2.1115 -4.7964 {"}'M' greentint -9.8049 1.351 -5.1818 {"}'M' greentint -9.6551 1.5047 -5.031 {"}'M' greentint -9.5598 1.741 -4.9735 {"}'M' greentint -9.5435 1.9975 -5.0233 {"}'M' greentint -9.6967 1.649 -5.242 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gln A 149 1hxpA_151F_168}P -12.0825 -2.2656 0.0651 {"}-12.0825 -2.2656 0.0651 { ca gln A 149 1hxpA_151F_168}-11.0211 -2.4865 -0.9236 { c gln A 149 1hxpA_151F_168}-10.6726 -1.2385 -1.6652 { o gln A 149 1hxpA_151F_168}-11.4307 -0.7081 -2.4686 { c gln A 149 1hxpA_151F_168}P -10.6726 -1.2385 -1.6652 { n val A 150 1hxpA_151F_168}-9.4802 -0.7498 -1.3688 { ca val A 150 1hxpA_151F_168}-8.975 0.4528 -2.0328 { c val A 150 1hxpA_151F_168}-8.1355 -0.0942 -3.2008 { o val A 150 1hxpA_151F_168}-7.3429 -0.9967 -3.0324 { c val A 150 1hxpA_151F_168}P -8.1355 -0.0942 -3.2008 { n phe A 151 1hxpA_151F_168}-8.3227 0.4585 -4.386 { ca phe A 151 1hxpA_151F_168}-7.5702 0.0258 -5.5178 { c phe A 151 1hxpA_151F_168}-7.4383 1.1075 -6.514 { o phe A 151 1hxpA_151F_168}-8.061 2.1566 -6.3827 { c phe A 151 1hxpA_151F_168}P -7.4383 1.1075 -6.514 { n glu A 152 1hxpA_151F_168}-6.6409 0.8454 -7.5363 { ca glu A 152 1hxpA_151F_168}-6.4216 1.7791 -8.6084 { c glu A 152 1hxpA_151F_168}-6.1876 0.9756 -9.8703 { o glu A 152 1hxpA_151F_168}-5.4075 0.0355 -9.842 { c glu A 152 1hxpA_151F_168}P -6.1876 0.9756 -9.8703 { n asn A 153 1hxpA_151F_168}-6.8397 1.3349 -10.9649 { ca asn A 153 1hxpA_151F_168}-6.6682 0.6491 -12.2571 { c asn A 153 1hxpA_151F_168}-6.1259 1.7525 -13.0904 { o asn A 153 1hxpA_151F_168}-6.7712 2.7651 -13.3201 { n his A 166 1hxpA_151F_168}P -7.051 8.5825 -10.7959 {"}-7.051 8.5825 -10.7959 { ca his A 166 1hxpA_151F_168}-8.0142 8.3548 -9.7398 { c his A 166 1hxpA_151F_168}-8.0319 6.9223 -9.3414 { o his A 166 1hxpA_151F_168}-7.5519 6.0796 -10.0446 { c his A 166 1hxpA_151F_168}P -8.0319 6.9223 -9.3414 { n gly A 167 1hxpA_151F_168}-8.6086 6.6463 -8.1954 { ca gly A 167 1hxpA_151F_168}-8.7049 5.2983 -7.6672 { c gly A 167 1hxpA_151F_168}-10.136 5.0454 -7.2654 { o gly A 167 1hxpA_151F_168}-11.0223 5.8856 -7.5117 { c gly A 167 1hxpA_151F_168}P -10.136 5.0454 -7.2654 { n gln A 168 1hxpA_151F_168}-10.3687 3.9009 -6.6523 { ca gln A 168 1hxpA_151F_168}-11.7225 3.5719 -6.242 { c gln A 168 1hxpA_151F_168}-11.6346 2.8644 -4.9537 { o gln A 168 1hxpA_151F_168}-10.5917 2.3413 -4.5676 { c gln A 168 1hxpA_151F_168}P -11.6346 2.8644 -4.9537 { n ile A 169 1hxpA_151F_168}-12.7709 2.8725 -4.2837 { ca ile A 169 1hxpA_151F_168}-12.8608 2.2256 -2.9995 { c ile A 169 1hxpA_151F_168}-14.1798 1.4887 -2.9407 { o ile A 169 1hxpA_151F_168}-15.2322 2.119 -3.0465 { c ile A 169 1hxpA_151F_168}P -14.1798 1.4887 -2.9407 { n trp A 170 1hxpA_151F_168}-14.1276 0.171 -2.8009 { ca trp A 170 1hxpA_151F_168}-15.3403 -0.6046 -2.7367 { c trp A 170 1hxpA_151F_168}-15.4847 -1.1716 -1.3537 { o trp A 170 1hxpA_151F_168}-14.4979 -1.573 -0.7472 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gln A 149 1hxpA_151F_168}P -12.0825 -2.2656 0.0651 { ca gln A 149 1hxpA_151F_168}P -11.0211 -2.4865 -0.9236 { n val A 150 1hxpA_151F_168}P -9.4802 -0.7498 -1.3688 { ca val A 150 1hxpA_151F_168}P -8.975 0.4528 -2.0328 { n phe A 151 1hxpA_151F_168}P -8.3227 0.4585 -4.386 { ca phe A 151 1hxpA_151F_168}P -7.5702 0.0258 -5.5178 { n glu A 152 1hxpA_151F_168}P -6.6409 0.8454 -7.5363 { ca glu A 152 1hxpA_151F_168}P -6.4216 1.7791 -8.6084 { n asn A 153 1hxpA_151F_168}P -6.8397 1.3349 -10.9649 { ca asn A 153 1hxpA_151F_168}P -6.6682 0.6491 -12.2571 { n his A 166 1hxpA_151F_168}P -7.051 8.5825 -10.7959 { ca his A 166 1hxpA_151F_168}P -8.0142 8.3548 -9.7398 { n gly A 167 1hxpA_151F_168}P -8.6086 6.6463 -8.1954 { ca gly A 167 1hxpA_151F_168}P -8.7049 5.2983 -7.6672 {"}P -8.7049 5.2983 -7.6672 { n gln A 168 1hxpA_151F_168}P -10.3687 3.9009 -6.6523 { ca gln A 168 1hxpA_151F_168}P -11.7225 3.5719 -6.242 { n ile A 169 1hxpA_151F_168}P -12.7709 2.8725 -4.2837 { ca ile A 169 1hxpA_151F_168}P -12.8608 2.2256 -2.9995 { n trp A 170 1hxpA_151F_168}P -14.1276 0.171 -2.8009 { ca trp A 170 1hxpA_151F_168}P -15.3403 -0.6046 -2.7367 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gln A 149 1hxpA_151F_168}P -11.0211 -2.4865 -0.9236 {"}-11.0211 -2.4865 -0.9236 { ca val A 150 1hxpA_151F_168}-8.975 0.4528 -2.0328 { ca phe A 151 1hxpA_151F_168}-7.5702 0.0258 -5.5178 { ca glu A 152 1hxpA_151F_168}-6.4216 1.7791 -8.6084 { ca asn A 153 1hxpA_151F_168}-6.6682 0.6491 -12.2571 { ca his A 166 1hxpA_151F_168}P -8.0142 8.3548 -9.7398 {"}-8.0142 8.3548 -9.7398 { ca gly A 167 1hxpA_151F_168}-8.7049 5.2983 -7.6672 { ca gln A 168 1hxpA_151F_168}-11.7225 3.5719 -6.242 { ca ile A 169 1hxpA_151F_168}-12.8608 2.2256 -2.9995 { ca trp A 170 1hxpA_151F_168}-15.3403 -0.6046 -2.7367 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 151 1hxpA_151F_168}P -7.5702 0.0258 -5.5178 { cb phe A 151 1hxpA_151F_168}-8.1219 -1.2325 -6.159 { cg phe A 151 1hxpA_151F_168}-9.4479 -1.11 -6.8115 { cd1 phe A 151 1hxpA_151F_168}-10.6287 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-5.0044 {"}'M' greentint -9.928 1.503 -5.1352 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ASN 100 A}'M' green -10.12 1.0123 -4.4005 {"}'M' green -9.9619 1.0864 -4.2167 {"}'M' green -9.8101 1.207 -4.0538 {"}'M' green -10.1743 1.0953 -4.8577 {"}'M' green -10.0908 1.2732 -5.1156 {"}'M' green -9.9625 1.4849 -5.2671 {"}'M' green -9.2669 1.909 -4.485 {"}'M' green -9.5772 1.8457 -5.1766 @dotlist {x} color= red width= 1 master= {H-bonds} { O ASN 100 A}'M' greentint -10.0171 1.0907 -4.652 {"}'M' greentint -9.8545 1.1464 -4.4579 {"}'M' greentint -9.6967 1.2567 -4.2844 {"}'M' greentint -9.5513 1.4184 -4.1414 {"}'M' greentint -9.9428 1.2261 -4.9111 {"}'M' greentint -9.7836 1.2486 -4.7106 {"}'M' greentint -9.6239 1.3371 -4.5296 {"}'M' greentint -9.4772 1.4867 -4.382 {"}'M' greentint -9.3534 1.6865 -4.2773 {"}'M' greentint -9.8242 1.4081 -5.0656 {"}'M' greentint -9.6653 1.4191 -4.8647 {"}'M' greentint -9.5083 1.515 -4.6874 {"}'M' greentint -9.3698 1.6855 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-8.4844 { HB2 TYR 246 A}'S' P -12.4194 0.5648 -7.1199 {"}'S' -12.3869 0.5944 -7.1334 {"}'S' P -12.2637 0.5406 -6.9117 {"}'S' -12.2332 0.5771 -6.9382 {"}'S' P -12.1012 0.5896 -6.7145 {"}'S' -12.0979 0.5929 -6.7193 {"}'S' P -12.4465 0.5105 -7.5068 {"}'S' -12.3823 0.5724 -7.5049 {"}'S' P -12.3177 0.4088 -7.3126 {"}'S' -12.2693 0.4715 -7.324 {"}'S' P -12.1705 0.3658 -7.1101 {"}'S' -12.1202 0.4503 -7.1427 {"}'S' P -12.0131 0.3837 -6.911 {"}'S' -11.9857 0.4462 -6.9494 {"}'S' P -11.8549 0.4605 -6.7278 {"}'S' -11.8528 0.4659 -6.733 {"}'S' P -12.3533 0.4766 -7.7869 {"}'S' -12.2681 0.5721 -7.752 {"}'S' P -12.2379 0.3449 -7.6008 {"}'S' -12.164 0.4584 -7.5872 {"}'S' P -12.1006 0.2634 -7.4013 {"}'S' -12.0616 0.3467 -7.4081 {"}'S' P -11.9486 0.2377 -7.198 {"}'S' -11.9196 0.3281 -7.2217 {"}'S' P -11.7893 0.2681 -7.0008 {"}'S' -11.7794 0.3229 -7.0255 {"}'S' P -11.6308 0.3547 -6.8194 {"}'S' -11.6311 0.363 -6.8251 {"}'S' P -12.1857 0.4443 -7.993 {"}'S' -12.1217 0.5394 -7.9374 {"}'S' P -12.0769 0.3037 -7.8139 {"}'S' -12.0192 0.427 -7.7735 {"}'S' P -11.9462 0.2093 -7.6189 {"}'S' -11.9143 0.3137 -7.6059 {"}'S' P -11.7989 0.1676 -7.4165 {"}'S' -11.7922 0.2123 -7.4193 {"}'S' P -11.6434 0.1796 -7.2187 {"}'S' -11.6418 0.2045 -7.224 {"}'S' P -11.4847 0.2441 -7.032 {"}'S' -11.4875 0.2642 -7.0403 {"}'S' P -12.0353 0.5651 -8.2644 {"}'S' -12.0213 0.589 -8.2388 {"}'S' P -11.9476 0.389 -8.101 {"}'S' -11.9219 0.458 -8.0559 {"}'S' P -11.8314 0.2572 -7.9155 {"}'S' -11.8141 0.3395 -7.8815 {"}'S' P -11.6949 0.1759 -7.7155 {"}'S' -11.6911 0.223 -7.7056 {"}'S' P -11.8283 0.6886 -8.4404 {"}'S' -11.8244 0.6989 -8.4236 {"}'S' P -11.7573 0.4923 -8.295 {"}'S' -11.7463 0.5511 -8.2371 {"}'S' P -11.6547 0.3395 -8.12 {"}'S' -11.6503 0.4239 -8.0648 {"}'S' P -11.5262 0.2387 -7.9248 {"}'S' -11.5308 0.3044 -7.8982 {"}'S' P -11.5211 0.5733 -8.3786 {"}'S' -11.5242 0.6048 -8.3422 {"}'S' P -11.4174 0.4146 -8.2007 {"}'S' -11.4278 0.4675 -8.1586 {"}'S' P -11.2825 0.3198 -7.9998 {"}'S' -11.2911 0.3472 -7.9853 {"}'S' P -11.1267 0.2955 -7.7916 {"}'S' -11.1327 0.3094 -7.7876 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 232 A}'M' greentint -9.2895 2.2906 -6.0059 {"}'M' greentint -9.4527 2.2572 -6.2077 {"}'M' greentint -9.6013 2.1003 -6.3562 {"}'M' greentint -9.705 2.004 -6.6537 {"}'M' greentint -9.0077 2.4164 -5.8682 {"}'M' greentint -9.1455 2.4958 -6.0679 {"}'M' greentint -9.3035 2.4874 -6.2699 {"}'M' greentint -9.4621 2.3942 -6.4483 {"}'M' greentint -9.6013 2.2263 -6.5815 {"}'M' greentint -9.6746 2.098 -6.8985 {"}'M' greentint -8.9604 2.6659 -6.1339 {"}'M' greentint -9.1165 2.6765 -6.3378 {"}'M' greentint -9.2767 2.6183 -6.5297 {"}'M' greentint -9.4315 2.4952 -6.6944 {"}'M' greentint -9.5672 2.3177 -6.8206 {"}'M' greentint -8.7204 2.784 -6.1729 {"}'M' greentint -8.8733 2.8199 -6.3798 {"}'M' greentint -9.0338 2.7965 -6.5818 {"}'M' greentint -9.1958 2.7143 -6.7675 {"}'M' greentint -9.3481 2.5784 -6.9275 {"}'M' greentint -9.4847 2.3968 -7.0523 {"}'M' greentint -8.7798 2.9105 -6.6486 {"}'M' greentint -8.9389 2.8593 -6.8408 {"}'M' greentint -9.0947 2.7606 -7.0141 {"}'M' greentint -9.2409 2.617 -7.164 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 246 A}'M' greentint -9.6582 1.9511 -6.5605 {"}'M' greentint -9.5038 1.9504 -6.3614 {"}'M' greentint -9.3456 2.0141 -6.1751 {"}'M' greentint -9.1954 2.1386 -6.0152 {"}'M' greentint -9.0623 2.3142 -5.8921 {"}'M' greentint -9.5946 2.0824 -6.9155 {"}'M' greentint -9.4533 2.0094 -6.7124 {"}'M' greentint -9.2951 2.0116 -6.5086 {"}'M' greentint -9.1344 2.0876 -6.3218 {"}'M' greentint -8.9849 2.233 -6.1694 {"}'M' greentint -8.8603 2.4329 -6.0636 {"}'M' greentint -8.7717 2.6705 -6.0155 {"}'M' greentint -9.4662 2.3091 -7.1556 {"}'M' greentint -9.3501 2.1721 -6.9674 {"}'M' greentint -9.2014 2.1225 -6.7613 {"}'M' greentint -9.039 2.1674 -6.5634 {"}'M' greentint -8.8848 2.3 -6.4017 {"}'M' greentint -8.7606 2.5033 -6.297 {"}'M' greentint -8.6823 2.749 -6.2649 {"}'M' greentint -9.2221 2.4077 -7.1299 {"}'M' greentint -9.0904 2.3059 -6.9318 {"}'M' greentint -8.9294 2.334 -6.7318 {"}'M' greentint -8.7813 2.4859 -6.5829 {"}'M' greentint -8.6865 2.7201 -6.5256 {"}'M' greentint -9.0611 2.6789 -7.1631 {"}'M' greentint -8.9569 2.5238 -6.9853 {"}'M' greentint -8.7969 2.6207 -6.8058 {"}'M' greentint -8.742 2.874 -6.8056 {"}'M' greentint -8.8752 2.7703 -7.0051 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 232 A}'M' greentint -10.3434 0.7698 -4.3274 {"}'M' greentint -10.4766 0.6662 -4.5269 {"}'M' greentint -10.2617 1.0164 -4.3473 {"}'M' greentint -10.4217 0.9195 -4.5267 {"}'M' greentint -10.5321 0.8201 -4.807 {"}'M' greentint -9.9965 1.1325 -4.2026 {"}'M' greentint -10.1282 1.2342 -4.4008 {"}'M' greentint -10.2892 1.2062 -4.6008 {"}'M' greentint -10.4372 1.0542 -4.7496 {"}'M' greentint -10.5038 0.9175 -5.0606 {"}'M' greentint -10.5542 0.6629 -5.056 {"}'M' greentint -9.8049 1.3092 -4.2666 {"}'M' greentint -9.9398 1.4041 -4.4674 {"}'M' greentint -10.0987 1.4072 -4.6734 {"}'M' greentint -10.2589 1.3162 -4.8562 {"}'M' greentint -10.4003 1.1457 -4.9918 {"}'M' greentint -10.4069 0.9918 -5.3006 {"}'M' greentint -10.4752 0.7428 -5.3183 {"}'M' greentint -9.6913 1.5033 -4.5178 {"}'M' greentint -9.8429 1.5388 -4.7229 {"}'M' greentint -10.0042 1.4996 -4.9208 {"}'M' greentint -10.1608 1.3876 -5.0922 {"}'M' greentint -10.2994 1.2128 -5.2229 {"}'M' greentint -10.2615 1.0113 -5.5182 {"}'M' greentint -9.5604 1.589 -4.7721 {"}'M' greentint -9.7147 1.5897 -4.9712 {"}'M' greentint -9.8729 1.526 -5.1575 {"}'M' greentint -10.0232 1.4016 -5.3173 {"}'M' greentint -10.1563 1.226 -5.4404 {"}'M' greentint -9.5255 1.576 -5.152 {"}'M' greentint -9.6826 1.5077 -5.3358 {"}'M' greentint -9.832 1.3835 -5.4945 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 246 A}'M' greentint -10.4393 0.638 -4.6097 {"}'M' greentint -10.2797 0.7224 -4.4279 {"}'M' greentint -10.1281 0.8506 -4.267 {"}'M' greentint -9.9885 1.0179 -4.1332 {"}'M' greentint -10.4494 0.6483 -5.0256 {"}'M' greentint -10.2915 0.6722 -4.8289 {"}'M' greentint -10.1334 0.7462 -4.6451 {"}'M' greentint -9.9816 0.8669 -4.4823 {"}'M' greentint -9.8413 1.0289 -4.3462 {"}'M' greentint -9.7193 1.2255 -4.2432 {"}'M' greentint -10.3458 0.7552 -5.2861 {"}'M' greentint -10.1886 0.7506 -5.0804 {"}'M' greentint -10.026 0.8063 -4.8863 {"}'M' greentint -9.8682 0.9166 -4.7128 {"}'M' greentint -9.7228 1.0783 -4.5699 {"}'M' greentint -9.5982 1.2807 -4.4663 {"}'M' greentint -10.2622 0.9331 -5.544 {"}'M' greentint -10.1143 0.886 -5.3395 {"}'M' greentint -9.9551 0.9085 -5.139 {"}'M' greentint -9.7953 0.997 -4.958 {"}'M' greentint -9.6486 1.1466 -4.8105 {"}'M' greentint -9.5249 1.3464 -4.7058 {"}'M' greentint -9.9956 1.068 -5.494 {"}'M' greentint -9.8368 1.079 -5.2931 {"}'M' greentint -9.6798 1.1748 -5.1158 {"}'M' greentint -9.5413 1.3454 -4.9843 {"}'M' greentint -9.4384 1.5689 -4.9134 {"}'M' greentint -9.8613 1.2758 -5.5698 {"}'M' greentint -9.6982 1.305 -5.3672 {"}'M' greentint -9.5484 1.4587 -5.2163 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 79 1ix2A_101F_81Y}P -7.471 5.8195 -12.1918 {"}-7.471 5.8195 -12.1918 { ca gly A 79 1ix2A_101F_81Y}-7.7511 6.5209 -10.9558 { c gly A 79 1ix2A_101F_81Y}-7.8348 5.5677 -9.7829 { o gly A 79 1ix2A_101F_81Y}-7.4665 4.4008 -9.8984 { c gly A 79 1ix2A_101F_81Y}P -7.8348 5.5677 -9.7829 { n thr A 80 1ix2A_101F_81Y}-8.3271 6.0641 -8.6551 { ca thr A 80 1ix2A_101F_81Y}-8.4381 5.2518 -7.4492 { c thr A 80 1ix2A_101F_81Y}-9.8956 4.9249 -7.1502 { o thr A 80 1ix2A_101F_81Y}-10.7634 5.7974 -7.218 { c thr A 80 1ix2A_101F_81Y}P -9.8956 4.9249 -7.1502 { n tyr A 81 1ix2A_101F_81Y}-10.1518 3.664 -6.8179 { ca tyr A 81 1ix2A_101F_81Y}-11.5057 3.2043 -6.5316 { c tyr A 81 1ix2A_101F_81Y}-11.6704 2.5205 -5.1908 { o tyr A 81 1ix2A_101F_81Y}-10.7377 1.9185 -4.6638 { c tyr A 81 1ix2A_101F_81Y}P -11.6704 2.5205 -5.1908 { n arg A 82 1ix2A_101F_81Y}-12.8764 2.6146 -4.6443 { ca arg A 82 1ix2A_101F_81Y}-13.1804 1.9694 -3.3796 { c arg A 82 1ix2A_101F_81Y}-14.3863 1.0599 -3.5624 { o arg A 82 1ix2A_101F_81Y}-15.3963 1.4606 -4.1458 { c arg A 82 1ix2A_101F_81Y}P -14.3863 1.0599 -3.5624 { n val A 83 1ix2A_101F_81Y}-14.2666 -0.1733 -3.0867 { ca val A 83 1ix2A_101F_81Y}-15.361 -1.1287 -3.163 { c val A 83 1ix2A_101F_81Y}-15.9423 -1.295 -1.7648 { o val A 83 1ix2A_101F_81Y}-15.2111 -1.555 -0.8069 { n tyr A 99 1ix2A_101F_81Y}P -12.4623 -1.94 0.4731 {"}-12.4623 -1.94 0.4731 { ca tyr A 99 1ix2A_101F_81Y}-11.0683 -1.9867 0.0769 { c tyr A 99 1ix2A_101F_81Y}-10.8803 -1.0653 -1.1153 { o tyr A 99 1ix2A_101F_81Y}-11.8482 -0.6665 -1.7671 { c tyr A 99 1ix2A_101F_81Y}P -10.8803 -1.0653 -1.1153 { n thr A 100 1ix2A_101F_81Y}-9.6304 -0.7156 -1.3786 { ca thr A 100 1ix2A_101F_81Y}-9.3001 0.1794 -2.4712 { c thr A 100 1ix2A_101F_81Y}-8.3699 -0.4846 -3.4781 { o thr A 100 1ix2A_101F_81Y}-7.618 -1.3979 -3.1443 { c thr A 100 1ix2A_101F_81Y}P -8.3699 -0.4846 -3.4781 { n phe A 101 1ix2A_101F_81Y}-8.457 -0.0392 -4.7241 { ca phe A 101 1ix2A_101F_81Y}-7.5705 -0.5205 -5.7695 { c phe A 101 1ix2A_101F_81Y}-7.4351 0.6105 -6.7739 { o phe A 101 1ix2A_101F_81Y}-8.2388 1.5469 -6.7873 { c phe A 101 1ix2A_101F_81Y}P -7.4351 0.6105 -6.7739 { n thr A 102 1ix2A_101F_81Y}-6.4006 0.5431 -7.5986 { ca thr A 102 1ix2A_101F_81Y}-6.1573 1.5855 -8.5753 { c thr A 102 1ix2A_101F_81Y}-6.2203 1.0594 -9.9956 { o thr A 102 1ix2A_101F_81Y}-5.8409 -0.0783 -10.2632 { c thr A 102 1ix2A_101F_81Y}P -6.2203 1.0594 -9.9956 { n val A 103 1ix2A_101F_81Y}-6.7198 1.8897 -10.9021 { ca val A 103 1ix2A_101F_81Y}-6.7771 1.5299 -12.3097 { c val A 103 1ix2A_101F_81Y}-5.6865 2.3516 -12.9804 { o val A 103 1ix2A_101F_81Y}-5.6191 3.5661 -12.8015 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 79 1ix2A_101F_81Y}P -7.471 5.8195 -12.1918 { ca gly A 79 1ix2A_101F_81Y}P -7.7511 6.5209 -10.9558 {"}P -7.7511 6.5209 -10.9558 { n thr A 80 1ix2A_101F_81Y}P -8.3271 6.0641 -8.6551 { ca thr A 80 1ix2A_101F_81Y}P -8.4381 5.2518 -7.4492 { n tyr A 81 1ix2A_101F_81Y}P -10.1518 3.664 -6.8179 { ca tyr A 81 1ix2A_101F_81Y}P -11.5057 3.2043 -6.5316 { n arg A 82 1ix2A_101F_81Y}P -12.8764 2.6146 -4.6443 { ca arg A 82 1ix2A_101F_81Y}P -13.1804 1.9694 -3.3796 { n val A 83 1ix2A_101F_81Y}P -14.2666 -0.1733 -3.0867 { ca val A 83 1ix2A_101F_81Y}P -15.361 -1.1287 -3.163 { n tyr A 99 1ix2A_101F_81Y}P -12.4623 -1.94 0.4731 { ca tyr A 99 1ix2A_101F_81Y}P -11.0683 -1.9867 0.0769 { n thr A 100 1ix2A_101F_81Y}P -9.6304 -0.7156 -1.3786 { ca thr A 100 1ix2A_101F_81Y}P -9.3001 0.1794 -2.4712 { n phe A 101 1ix2A_101F_81Y}P -8.457 -0.0392 -4.7241 { ca phe A 101 1ix2A_101F_81Y}P -7.5705 -0.5205 -5.7695 { n thr A 102 1ix2A_101F_81Y}P -6.4006 0.5431 -7.5986 { ca thr A 102 1ix2A_101F_81Y}P -6.1573 1.5855 -8.5753 { n val A 103 1ix2A_101F_81Y}P -6.7198 1.8897 -10.9021 { ca val A 103 1ix2A_101F_81Y}P -6.7771 1.5299 -12.3097 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 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1ix2A_101F_81Y}-12.309 4.7924 -12.6572 { cg tyr A 81 1ix2A_101F_81Y}P -12.0592 2.8726 -8.976 { cd2 tyr A 81 1ix2A_101F_81Y}-13.2836 3.3174 -9.4692 { ce2 tyr A 81 1ix2A_101F_81Y}-13.3731 3.9512 -10.7018 { cz tyr A 81 1ix2A_101F_81Y}ghost -12.2274 4.1456 -11.4531 { ca phe A 101 1ix2A_101F_81Y}P -7.5705 -0.5205 -5.7695 { cb phe A 101 1ix2A_101F_81Y}-8.0753 -1.8131 -6.4361 { cg phe A 101 1ix2A_101F_81Y}-9.2572 -1.6328 -7.3475 { cd1 phe A 101 1ix2A_101F_81Y}-10.5529 -1.7067 -6.8545 { ce1 phe A 101 1ix2A_101F_81Y}-11.6499 -1.5808 -7.7093 { cz phe A 101 1ix2A_101F_81Y}-11.4513 -1.3751 -9.0723 { cg phe A 101 1ix2A_101F_81Y}P -9.2572 -1.6328 -7.3475 { cd2 phe A 101 1ix2A_101F_81Y}-9.07 -1.4269 -8.7108 { ce2 phe A 101 1ix2A_101F_81Y}-10.1589 -1.297 -9.5742 { cz phe A 101 1ix2A_101F_81Y}ghost -11.4513 -1.3751 -9.0723 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 81 1ix2A_101F_81Y}P -11.9703 2.2354 -7.6169 {"}P -11.9703 2.2354 -7.6169 { cd1 tyr A 81 1ix2A_101F_81Y}P 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@subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 522 A}'S' blue -10.5974 -0.0209 -6.637 {"}'S' blue -10.3331 0.1274 -6.6958 {"}'S' blue -10.4938 0.0489 -6.8805 {"}'S' blue -10.6489 -0.0697 -7.0483 {"}'S' blue -10.3659 0.0834 -7.1168 { CD1 TYR 522 A}'S' blue -10.9312 -0.2414 -7.1967 {"}'S' sky -10.7863 -0.0407 -7.282 {"}'S' blue -10.4441 0.0532 -7.1366 {"}'S' sky -10.5864 0.1235 -7.3385 {"}'S' sky -10.7407 0.1412 -7.5432 {"}'S' blue -10.3533 0.2502 -7.3907 {"}'S' sky -10.5063 0.2844 -7.599 {"}'S' blue -10.6674 0.2695 -7.8021 { CD2 TYR 522 A}'S' blue -11.1488 0.055 -5.9111 {"}'S' sky -11.3096 0.0025 -6.1035 {"}'S' sky -10.9656 0.0853 -6.0965 {"}'S' sky -10.7872 0.0737 -6.2909 {"}'S' blue -10.5783 0.031 -6.4433 {"}'S' sky -10.7415 -0.0297 -6.6371 {"}'S' sky -10.9027 -0.1262 -6.8184 { CE1 TYR 522 A}'S' sky -11.8087 0.3346 -8.1123 {"}'S' blue -11.9698 0.3197 -8.3154 {"}'S' sky -12.1326 0.257 -8.5082 {"}'S' sky -12.2912 0.148 -8.683 {"}'S' sky 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-11.604 0.0788 -7.1556 {"}'S' P -11.5665 0.2141 -7.5658 {"}'S' -11.5664 0.2158 -7.5644 {HG11 VAL 533 A}'S' P -14.0037 -0.1932 -7.7742 {"}'S' -14.0031 -0.171 -7.7596 {"}'S' P -13.8753 -0.294 -7.5791 {"}'S' -13.8778 -0.2551 -7.564 {"}'S' P -13.728 -0.337 -7.3765 {"}'S' -13.7297 -0.3258 -7.3744 {"}'S' P -13.7665 -0.1181 -7.855 {"}'S' -13.7724 -0.0892 -7.832 {"}'S' P -13.6316 -0.213 -7.6541 {"}'S' -13.6433 -0.1734 -7.633 {"}'S' P -13.4758 -0.2372 -7.4459 {"}'S' -13.4833 -0.2203 -7.4412 {"}'S' P -13.3126 -0.1883 -7.2493 {"}'S' -13.3288 -0.1628 -7.2466 {"}'S' P -13.1553 -0.0699 -7.0785 {"}'S' -13.1553 -0.0699 -7.0785 {"}'S' P -13.3922 -0.0803 -7.6887 {"}'S' -13.3968 -0.0736 -7.6845 {"}'S' P -13.2359 -0.0695 -7.4895 {"}'S' -13.2608 -0.0392 -7.4774 {"}'S' P -13.0798 0.0259 -7.3149 {"}'S' -13.0979 0.0415 -7.3109 {"}'S' P -13.0775 0.1435 -7.5763 {"}'S' -13.0791 0.1451 -7.5754 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 522 A}'M' greentint -9.6522 2.0223 -6.396 {"}'M' greentint -9.2466 2.4513 -5.9909 {"}'M' greentint -9.4099 2.4179 -6.1927 {"}'M' greentint -9.5585 2.261 -6.3412 {"}'M' greentint -9.6622 2.1647 -6.6387 {"}'M' greentint -9.1027 2.6565 -6.0529 {"}'M' greentint -9.2607 2.6481 -6.2549 {"}'M' greentint -9.4193 2.5549 -6.4333 {"}'M' greentint -9.5585 2.387 -6.5664 {"}'M' greentint -9.6318 2.2587 -6.8835 {"}'M' greentint -8.9175 2.8265 -6.1189 {"}'M' greentint -9.0737 2.8372 -6.3227 {"}'M' greentint -9.2339 2.779 -6.5147 {"}'M' greentint -9.3887 2.6559 -6.6794 {"}'M' greentint -9.5244 2.4783 -6.8056 {"}'M' greentint -9.5539 2.3389 -7.1217 {"}'M' greentint -8.8304 2.9806 -6.3648 {"}'M' greentint -8.9909 2.9572 -6.5668 {"}'M' greentint -9.153 2.875 -6.7525 {"}'M' greentint -9.3052 2.7391 -6.9125 {"}'M' greentint -9.4419 2.5575 -7.0373 {"}'M' greentint -9.4394 2.3837 -7.3514 {"}'M' greentint -8.737 3.0711 -6.6336 {"}'M' greentint -8.8961 3.02 -6.8258 {"}'M' greentint -9.0519 2.9213 -6.9991 {"}'M' greentint -9.1981 2.7777 -7.149 {"}'M' greentint -9.3288 2.5957 -7.2674 {"}'M' greentint -8.7393 3.0545 -7.0312 {"}'M' greentint -8.8962 2.9486 -7.2044 {"}'M' greentint -9.0429 2.8015 -7.3541 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 533 A}'M' greentint -9.5969 2.0312 -6.3292 {"}'M' greentint -9.442 2.1283 -6.1568 {"}'M' greentint -9.3007 2.2791 -6.0152 {"}'M' greentint -9.6405 1.9918 -6.8037 {"}'M' greentint -9.4862 1.9911 -6.6046 {"}'M' greentint -9.328 2.0548 -6.4183 {"}'M' greentint -9.1778 2.1793 -6.2584 {"}'M' greentint -9.0446 2.3549 -6.1354 {"}'M' greentint -8.9394 2.5695 -6.0576 {"}'M' greentint -9.577 2.1231 -7.1587 {"}'M' greentint -9.4356 2.0501 -6.9556 {"}'M' greentint -9.2774 2.0523 -6.7519 {"}'M' greentint -9.1168 2.1283 -6.565 {"}'M' greentint -8.9672 2.2737 -6.4126 {"}'M' greentint -8.8427 2.4736 -6.3068 {"}'M' greentint -8.7541 2.7112 -6.2587 {"}'M' greentint -8.7096 2.9659 -6.2714 {"}'M' greentint -9.3325 2.2128 -7.2106 {"}'M' greentint -9.1837 2.1631 -7.0045 {"}'M' greentint -9.0214 2.2081 -6.8066 {"}'M' greentint -8.8672 2.3407 -6.6449 {"}'M' greentint -8.7429 2.544 -6.5403 {"}'M' greentint -8.6646 2.7897 -6.5081 {"}'M' greentint -8.6437 3.0451 -6.5514 {"}'M' greentint -9.2045 2.4484 -7.3731 {"}'M' greentint -9.0727 2.3466 -7.175 {"}'M' greentint -8.9117 2.3747 -6.975 {"}'M' greentint -8.7637 2.5266 -6.8261 {"}'M' greentint -8.6689 2.7608 -6.7688 {"}'M' greentint -8.6526 3.0144 -6.8181 {"}'M' greentint -9.0434 2.7196 -7.4063 {"}'M' greentint -8.9392 2.5645 -7.2285 {"}'M' greentint -8.7793 2.6614 -7.0491 {"}'M' greentint -8.7243 2.9147 -7.0489 {"}'M' greentint -8.8576 2.811 -7.2483 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 522 A}'M' green -10.0082 0.9117 -4.1649 {"}'M' green -9.4698 1.4512 -4.1041 {"}'M' green -9.3561 1.6452 -4.3553 {"}'M' green -9.3796 1.7317 -4.8087 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 522 A}'M' greentint -9.9266 1.1583 -4.1848 {"}'M' greentint -10.0865 1.0614 -4.3642 {"}'M' greentint -10.1969 0.962 -4.6445 {"}'M' greentint -9.6613 1.2744 -4.0402 {"}'M' greentint -9.7931 1.3761 -4.2383 {"}'M' greentint -9.9541 1.3481 -4.4383 {"}'M' greentint -10.1021 1.1961 -4.5872 {"}'M' greentint -10.1686 1.0595 -4.8981 {"}'M' greentint -9.6047 1.546 -4.305 {"}'M' greentint -9.7635 1.5492 -4.5109 {"}'M' greentint -9.9238 1.4581 -4.6937 {"}'M' greentint -10.0652 1.2876 -4.8293 {"}'M' greentint -10.0718 1.1337 -5.1381 {"}'M' greentint -9.5078 1.6807 -4.5604 {"}'M' greentint -9.6691 1.6415 -4.7583 {"}'M' greentint -9.8257 1.5295 -4.9297 {"}'M' greentint -9.9643 1.3548 -5.0605 {"}'M' greentint -9.5378 1.6679 -4.995 {"}'M' greentint -9.688 1.5435 -5.1549 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 533 A}'M' green -10.1888 0.8311 -4.4327 {"}'M' green -9.7386 1.1878 -3.95 {"}'M' green -10.2431 0.9142 -4.8898 {"}'M' green -9.4955 1.4396 -4.07 {"}'M' green -10.1596 1.092 -5.1478 {"}'M' green -9.3357 1.7278 -4.5172 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 533 A}'M' greentint -10.0307 0.9052 -4.2489 {"}'M' greentint -9.8789 1.0258 -4.086 {"}'M' greentint -10.0859 0.9096 -4.6842 {"}'M' greentint -9.9233 0.9653 -4.49 {"}'M' greentint -9.7655 1.0755 -4.3166 {"}'M' greentint -9.6201 1.2372 -4.1736 {"}'M' greentint -10.0116 1.0449 -4.9433 {"}'M' greentint -9.8524 1.0674 -4.7428 {"}'M' greentint -9.6927 1.156 -4.5618 {"}'M' greentint -9.546 1.3056 -4.4142 {"}'M' greentint -9.4223 1.5053 -4.3095 {"}'M' greentint -9.893 1.2269 -5.0978 {"}'M' greentint -9.7341 1.2379 -4.8969 {"}'M' greentint -9.5771 1.3338 -4.7195 {"}'M' greentint -9.4386 1.5043 -4.588 {"}'M' greentint -9.7586 1.4347 -5.1736 {"}'M' greentint -9.5955 1.464 -4.9709 {"}'M' greentint -9.4457 1.6177 -4.8201 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 17 1j1iA_30Y_19R}P -6.7762 5.7171 -11.8425 {"}-6.7762 5.7171 -11.8425 { ca val A 17 1j1iA_30Y_19R}-7.758 6.3022 -10.941 { c val A 17 1j1iA_30Y_19R}-7.9403 5.4352 -9.7003 { o val A 17 1j1iA_30Y_19R}-7.7871 4.2153 -9.7593 { c val A 17 1j1iA_30Y_19R}P -7.9403 5.4352 -9.7003 { n glu A 18 1j1iA_30Y_19R}-8.2631 6.0721 -8.5797 { ca glu A 18 1j1iA_30Y_19R}-8.4641 5.3599 -7.3265 { c glu A 18 1j1iA_30Y_19R}-9.9397 5.0105 -7.1686 { o glu A 18 1j1iA_30Y_19R}-10.8159 5.8514 -7.3824 { c glu A 18 1j1iA_30Y_19R}P -9.9397 5.0105 -7.1686 { n arg A 19 1j1iA_30Y_19R}-10.2041 3.7668 -6.7846 { ca arg A 19 1j1iA_30Y_19R}-11.5685 3.2704 -6.6257 { c arg A 19 1j1iA_30Y_19R}-11.7078 2.4625 -5.3398 { o arg A 19 1j1iA_30Y_19R}-10.7126 2.0418 -4.7465 { c arg A 19 1j1iA_30Y_19R}P -11.7078 2.4625 -5.3398 { n phe A 20 1j1iA_30Y_19R}-12.95 2.2402 -4.9191 { ca phe A 20 1j1iA_30Y_19R}-13.2232 1.4577 -3.7212 { c phe A 20 1j1iA_30Y_19R}-14.3553 0.48 -4.0097 { o phe A 20 1j1iA_30Y_19R}-15.258 0.7761 -4.795 { c phe A 20 1j1iA_30Y_19R}P -14.3553 0.48 -4.0097 { n val A 21 1j1iA_30Y_19R}-14.3036 -0.688 -3.382 { ca val A 21 1j1iA_30Y_19R}-15.3295 -1.7011 -3.5823 { c val A 21 1j1iA_30Y_19R}-15.509 -2.5191 -2.3063 { o val A 21 1j1iA_30Y_19R}-14.571 -2.6901 -1.5355 { n thr A 28 1j1iA_30Y_19R}P -12.4424 -2.1438 0.0906 {"}-12.4424 -2.1438 0.0906 { ca thr A 28 1j1iA_30Y_19R}-11.1026 -2.2799 -0.4635 { c thr A 28 1j1iA_30Y_19R}-10.7661 -1.1858 -1.4615 { o thr A 28 1j1iA_30Y_19R}-11.591 -0.8155 -2.2958 { c thr A 28 1j1iA_30Y_19R}P -10.7661 -1.1858 -1.4615 { n arg A 29 1j1iA_30Y_19R}-9.5469 -0.6692 -1.3638 { ca arg A 29 1j1iA_30Y_19R}-9.0812 0.3808 -2.2554 { c arg A 29 1j1iA_30Y_19R}-8.1842 -0.192 -3.3373 { o arg A 29 1j1iA_30Y_19R}-7.3187 -1.0241 -3.0632 { c arg A 29 1j1iA_30Y_19R}P -8.1842 -0.192 -3.3373 { n tyr A 30 1j1iA_30Y_19R}-8.3978 0.2508 -4.5711 { ca tyr A 30 1j1iA_30Y_19R}-7.5667 -0.1971 -5.6723 { c tyr A 30 1j1iA_30Y_19R}-7.3029 0.9262 -6.6601 { o tyr A 30 1j1iA_30Y_19R}-7.991 1.9479 -6.6581 { c tyr A 30 1j1iA_30Y_19R}P -7.3029 0.9262 -6.6601 { n leu A 31 1j1iA_30Y_19R}-6.2786 0.7311 -7.4798 { ca leu A 31 1j1iA_30Y_19R}-5.9026 1.6836 -8.5128 { c leu A 31 1j1iA_30Y_19R}-6.2319 0.9944 -9.8308 { o leu A 31 1j1iA_30Y_19R}-5.9696 -0.1975 -9.9915 { c leu A 31 1j1iA_30Y_19R}P -6.2319 0.9944 -9.8308 { n glu A 32 1j1iA_30Y_19R}-6.808 1.7299 -10.7708 { ca glu A 32 1j1iA_30Y_19R}-7.1579 1.1347 -12.0513 { c glu A 32 1j1iA_30Y_19R}-6.7296 1.9716 -13.2462 { o glu A 32 1j1iA_30Y_19R}-6.7772 3.2034 -13.2113 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 17 1j1iA_30Y_19R}P -6.7762 5.7171 -11.8425 { ca val A 17 1j1iA_30Y_19R}P -7.758 6.3022 -10.941 { n glu A 18 1j1iA_30Y_19R}P -8.2631 6.0721 -8.5797 { ca glu A 18 1j1iA_30Y_19R}P -8.4641 5.3599 -7.3265 { n arg A 19 1j1iA_30Y_19R}P -10.2041 3.7668 -6.7846 { ca arg A 19 1j1iA_30Y_19R}P -11.5685 3.2704 -6.6257 { n phe A 20 1j1iA_30Y_19R}P -12.95 2.2402 -4.9191 { ca phe A 20 1j1iA_30Y_19R}P -13.2232 1.4577 -3.7212 { n val A 21 1j1iA_30Y_19R}P -14.3036 -0.688 -3.382 { ca val A 21 1j1iA_30Y_19R}P -15.3295 -1.7011 -3.5823 { n thr A 28 1j1iA_30Y_19R}P -12.4424 -2.1438 0.0906 { ca thr A 28 1j1iA_30Y_19R}P -11.1026 -2.2799 -0.4635 { n arg A 29 1j1iA_30Y_19R}P -9.5469 -0.6692 -1.3638 { ca arg A 29 1j1iA_30Y_19R}P -9.0812 0.3808 -2.2554 { n tyr A 30 1j1iA_30Y_19R}P -8.3978 0.2508 -4.5711 { ca tyr A 30 1j1iA_30Y_19R}P -7.5667 -0.1971 -5.6723 { n leu A 31 1j1iA_30Y_19R}P -6.2786 0.7311 -7.4798 { ca leu A 31 1j1iA_30Y_19R}P -5.9026 1.6836 -8.5128 { n glu A 32 1j1iA_30Y_19R}P -6.808 1.7299 -10.7708 { ca glu A 32 1j1iA_30Y_19R}P -7.1579 1.1347 -12.0513 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 17 1j1iA_30Y_19R}P -7.758 6.3022 -10.941 {"}-7.758 6.3022 -10.941 { ca glu A 18 1j1iA_30Y_19R}-8.4641 5.3599 -7.3265 { ca arg A 19 1j1iA_30Y_19R}-11.5685 3.2704 -6.6257 { ca phe A 20 1j1iA_30Y_19R}-13.2232 1.4577 -3.7212 { ca val A 21 1j1iA_30Y_19R}-15.3295 -1.7011 -3.5823 { ca thr A 28 1j1iA_30Y_19R}P -11.1026 -2.2799 -0.4635 {"}-11.1026 -2.2799 -0.4635 { ca arg A 29 1j1iA_30Y_19R}-9.0812 0.3808 -2.2554 { ca tyr A 30 1j1iA_30Y_19R}-7.5667 -0.1971 -5.6723 { ca leu A 31 1j1iA_30Y_19R}-5.9026 1.6836 -8.5128 { ca glu A 32 1j1iA_30Y_19R}-7.1579 1.1347 -12.0513 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 19 1j1iA_30Y_19R}P -11.5685 3.2704 -6.6257 { cb arg A 19 1j1iA_30Y_19R}-11.9176 2.3612 -7.8078 { cg arg A 19 1j1iA_30Y_19R}-12.9903 2.8643 -8.7583 { cd arg A 19 1j1iA_30Y_19R}-12.5118 3.9849 -9.6553 { ne arg A 19 1j1iA_30Y_19R}-13.303 4.0307 -10.8839 { cz arg A 19 1j1iA_30Y_19R}-13.2966 5.0395 -11.7513 { nh1 arg A 19 1j1iA_30Y_19R}-12.5439 6.1045 -11.5313 { cz arg A 19 1j1iA_30Y_19R}P -13.2966 5.0395 -11.7513 { nh2 arg A 19 1j1iA_30Y_19R}-14.0419 4.9768 -12.8462 { ca tyr A 30 1j1iA_30Y_19R}P -7.5667 -0.1971 -5.6723 { cb tyr A 30 1j1iA_30Y_19R}-8.1941 -1.3974 -6.4028 { cg tyr A 30 1j1iA_30Y_19R}-9.5419 -1.1672 -7.0602 { cd1 tyr A 30 1j1iA_30Y_19R}-10.7206 -1.1739 -6.3116 { ce1 tyr A 30 1j1iA_30Y_19R}-11.9757 -1.0433 -6.9289 { cz tyr A 30 1j1iA_30Y_19R}-12.0487 -0.9007 -8.3053 { oh tyr A 30 1j1iA_30Y_19R}-13.278 -0.7959 -8.9226 { cg tyr A 30 1j1iA_30Y_19R}P -9.5419 -1.1672 -7.0602 { cd2 tyr A 30 1j1iA_30Y_19R}-9.645 -1.014 -8.446 { ce2 tyr A 30 1j1iA_30Y_19R}-10.8882 -0.8802 -9.0719 { cz tyr A 30 1j1iA_30Y_19R}ghost -12.0487 -0.9007 -8.3053 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 19 1j1iA_30Y_19R}P -11.9176 2.3612 -7.8078 {"}P -11.9176 2.3612 -7.8078 { cg arg A 19 1j1iA_30Y_19R}P -12.9903 2.8643 -8.7583 {"}P -12.9903 2.8643 -8.7583 { cd arg A 19 1j1iA_30Y_19R}P -12.5118 3.9849 -9.6553 {"}P -12.5118 3.9849 -9.6553 { ne arg A 19 1j1iA_30Y_19R}P -13.303 4.0307 -10.8839 { nh1 arg A 19 1j1iA_30Y_19R}P -12.5439 6.1045 -11.5313 {"}P -12.5439 6.1045 -11.5313 { nh2 arg A 19 1j1iA_30Y_19R}P -14.0419 4.9768 -12.8462 {"}P -14.0419 4.9768 -12.8462 { cb tyr A 30 1j1iA_30Y_19R}P -8.1941 -1.3974 -6.4028 {"}P -8.1941 -1.3974 -6.4028 { cd1 tyr A 30 1j1iA_30Y_19R}P -10.7206 -1.1739 -6.3116 { cd2 tyr A 30 1j1iA_30Y_19R}P -9.645 -1.014 -8.446 { ce1 tyr A 30 1j1iA_30Y_19R}P -11.9757 -1.0433 -6.9289 { ce2 tyr A 30 1j1iA_30Y_19R}P -10.8882 -0.8802 -9.0719 { oh tyr A 30 1j1iA_30Y_19R}P -13.278 -0.7959 -8.9226 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 30 A}'S' blue -10.8684 0.483 -7.9752 {"}'S' sky -10.986 0.6121 -8.1636 {"}'S' sky -11.5856 0.7215 -8.9689 {"}'S' blue -10.7203 0.637 -8.2164 {"}'S' sky -10.8483 0.7399 -8.4113 {"}'S' sky -11.3003 0.8198 -9.0183 {"}'S' blue -10.5177 0.6854 -8.3828 {"}'S' sky -10.6521 0.7838 -8.5838 {"}'S' sky -10.9555 0.8675 -8.9988 {"}'S' blue -11.1171 0.8501 -9.2037 {"}'S' blue -10.4706 0.7946 -8.7808 {"}'S' sky -10.6197 0.8476 -8.9881 {"}'S' blue -10.7766 0.8619 -9.1956 { CZ TYR 30 A}'S' blue -12.758 0.5495 -8.9804 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 30 A}'S' green -12.859 0.3891 -7.4088 { CE2 TYR 30 A}'S' sea -11.1214 0.7023 -8.3625 {"}'S' green -11.2693 0.7521 -8.5675 {"}'S' sea -11.4252 0.7577 -8.7716 {"}'S' sea -10.9907 0.8058 -8.6142 {"}'S' sea -11.1426 0.833 -8.8178 {"}'S' sea -10.7989 0.8446 -8.7915 { CZ TYR 30 A}'S' green -12.4414 0.773 -8.6329 {"}'S' green -12.0992 0.818 -8.6316 {"}'S' sea -12.2628 0.7566 -8.8258 {"}'S' green -11.2851 0.6364 -7.9629 {"}'S' green -11.7285 0.7983 -8.5802 {"}'S' green -11.8903 0.7753 -8.784 {"}'S' sea -11.5134 0.7161 -8.7083 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 30 A}'S' P -12.5126 0.5947 -6.6286 {"}'S' -12.5098 0.5841 -6.6308 {"}'S' P -12.673 0.5585 -6.8259 {"}'S' -12.6606 0.5283 -6.8276 {"}'S' P -12.8337 0.4801 -7.0105 {"}'S' -12.8298 0.4742 -7.0107 {"}'S' P -12.2301 0.6699 -6.6748 {"}'S' -12.2203 0.6001 -6.6849 {"}'S' P -12.3877 0.6568 -6.8754 {"}'S' -12.3583 0.5343 -6.879 {"}'S' P -12.5485 0.6043 -7.0678 {"}'S' -12.5062 0.4819 -7.0572 {"}'S' P -12.7058 0.5145 -7.2469 {"}'S' -12.6724 0.4408 -7.2322 {"}'S' P -11.8863 0.6815 -6.6485 {"}'S' -11.8884 0.6461 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{ CD1 PHE 57 A}'S' sky -11.1298 0.3233 -7.7133 {"}'S' blue -11.2671 0.4246 -7.9189 {"}'S' sky -11.1354 0.6453 -7.9688 {"}'S' sky -10.7288 0.6528 -7.6608 {"}'S' sky -10.9905 0.846 -8.0541 {"}'S' blue -10.4301 0.6507 -7.546 {"}'S' blue -10.5268 0.8179 -7.7163 {"}'S' sky -10.6484 0.9399 -7.9086 {"}'S' blue -10.7906 1.0103 -8.1106 { CD2 PHE 57 A}'S' blue -12.8144 -1.2546 -6.2549 {"}'S' sky -12.6373 -1.1674 -6.0824 {"}'S' sky -12.4359 -1.0738 -5.9446 {"}'S' sky -12.2109 -1.0062 -5.8303 {"}'S' sky -11.9695 -0.935 -5.7559 {"}'S' sky -11.7419 -0.7405 -5.7848 {"}'S' blue -11.5019 -0.624 -5.8252 {"}'S' sky -11.5738 -0.424 -5.9742 {"}'S' sky -11.6727 -0.2583 -6.1488 {"}'S' sky -11.7949 -0.132 -6.3413 {"}'S' sky -11.9348 -0.0511 -6.5441 {"}'S' sky -12.0878 -0.0169 -6.7525 {"}'S' sky -11.6832 0.0346 -6.6009 {"}'S' sky -11.8311 0.0844 -6.8059 {"}'S' sky -11.4101 0.0722 -6.6497 {"}'S' sky -11.2139 0.116 -6.8222 {"}'S' sky -11.1814 0.1799 -7.2265 {"}'S' sky -11.3383 0.1942 -7.434 {"}'S' blue -11.5005 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-7.8505 { CD2 PHE 57 A}'S' green -12.507 -0.8647 -6.0947 {"}'S' sea -12.2662 -0.7849 -5.9632 {"}'S' green -12.3714 -0.6238 -6.1439 {"}'S' green -12.5126 -0.5427 -6.3502 {"}'S' green -12.0189 -0.7152 -5.8804 {"}'S' green -12.106 -0.5352 -6.0422 {"}'S' green -12.2249 -0.4085 -6.2319 {"}'S' green -12.3677 -0.342 -6.4355 {"}'S' sea -11.8073 -0.5373 -5.9275 {"}'S' sea -11.904 -0.3701 -6.0978 {"}'S' sea -12.0256 -0.2481 -6.29 {"}'S' sea -12.1679 -0.1778 -6.492 {"}'S' sea -11.5525 0.1381 -6.8526 {"}'S' sea -11.7044 0.1652 -7.0562 {"}'S' sea -11.3606 0.1768 -7.0299 {"}'S' sea -11.5173 0.1998 -7.2372 { CE1 PHE 57 A}'S' sea -11.5255 0.62 -7.9988 {"}'S' sea -11.559 0.8519 -8.1061 {"}'S' sea -11.6245 1.0551 -8.2488 {"}'S' sea -11.2745 0.7413 -8.027 {"}'S' sea -11.3191 0.9684 -8.1465 { CE2 PHE 57 A}'S' sea -13.614 -0.9444 -6.5762 {"}'S' green -13.6005 -0.6838 -6.6309 {"}'S' green -13.6716 -0.4746 -6.781 {"}'S' sea -13.8089 -0.3734 -6.9866 {"}'S' green -13.3763 -0.8702 -6.4476 {"}'S' green -13.6773 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-13.1194 -0.4968 -6.5697 {"}'S' P -12.9868 -0.7003 -6.4565 {"}'S' -13.0017 -0.6644 -6.4252 {"}'S' P -12.9906 0.1882 -6.9789 {"}'S' -12.9931 0.1908 -6.9693 {"}'S' P -12.9843 -0.0574 -6.9023 {"}'S' -13.0068 -0.0301 -6.8334 {"}'S' P -12.9362 -0.2782 -6.7793 {"}'S' -12.971 -0.2275 -6.6915 {"}'S' P -12.85 -0.4598 -6.6184 {"}'S' -12.8851 -0.4056 -6.5506 {"}'S' P -12.732 -0.5881 -6.4295 {"}'S' -12.7499 -0.5635 -6.4048 {"}'S' P -12.7413 -0.0018 -6.8221 {"}'S' -12.7624 0.0131 -6.7808 {"}'S' P -12.6843 -0.2213 -6.6873 {"}'S' -12.7169 -0.1909 -6.6345 {"}'S' P -12.5777 -0.3801 -6.5053 {"}'S' -12.5958 -0.3617 -6.483 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 57 A}'M' greentint -9.4276 2.4099 -6.1313 {"}'M' greentint -9.5909 2.3765 -6.3332 {"}'M' greentint -9.7395 2.2196 -6.4817 {"}'M' greentint -9.8432 2.1232 -6.7792 {"}'M' greentint -9.2837 2.615 -6.1934 {"}'M' greentint -9.4416 2.6067 -6.3954 {"}'M' greentint -9.6002 2.5135 -6.5738 {"}'M' greentint 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-8.8979 { ce2 phe A 331 1j58A_331F_262}P -11.465 -1.8427 -6.826 { cz phe A 331 1j58A_331F_262}P -11.5027 -1.644 -8.2046 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 331 A}'S' blue -10.1819 -0.1377 -7.5395 {"}'S' blue -10.1399 0.0064 -7.7952 { CD2 PHE 331 A}'S' blue -10.8114 -0.1433 -6.2847 {"}'S' blue -10.6313 -0.1172 -6.4734 {"}'S' sky -10.7924 -0.2109 -6.6551 {"}'S' blue -10.4526 -0.1335 -6.6663 {"}'S' sky -10.6135 -0.232 -6.8466 {"}'S' blue -10.4045 -0.272 -6.9996 { CE1 PHE 331 A}'S' sky -10.5479 -0.1039 -7.7365 {"}'S' sky -10.6702 0.0224 -7.9289 {"}'S' sky -10.8101 0.1034 -8.1318 {"}'S' blue -10.9631 0.1376 -8.3402 {"}'S' blue -10.3055 -0.0302 -7.8012 {"}'S' blue -10.423 0.0989 -7.9897 {"}'S' sky -10.5584 0.1891 -8.1885 {"}'S' blue -10.7064 0.2389 -8.3935 { CE2 PHE 331 A}'S' blue -12.2638 -0.3266 -6.4713 {"}'S' blue -12.4266 -0.3892 -6.6642 {"}'S' blue -12.5853 -0.4983 -6.839 {"}'S' blue -12.1624 -0.241 -6.723 {"}'S' sky -12.3231 -0.3194 -6.9076 {"}'S' blue -12.4782 -0.438 -7.0755 {"}'S' blue -12.6238 -0.5922 -7.2205 {"}'S' blue -11.5675 -0.1567 -6.3684 {"}'S' sky -11.7194 -0.1295 -6.5719 {"}'S' sky -11.8771 -0.1426 -6.7725 {"}'S' blue -12.0379 -0.1952 -6.9649 {"}'S' blue -12.1952 -0.2849 -7.144 {"}'S' blue -11.2289 -0.1787 -6.338 {"}'S' sky -11.8577 -0.1691 -7.1536 {"}'S' sky -11.0474 -0.1679 -6.5349 {"}'S' sky -10.8386 -0.2148 -6.6866 {"}'S' sky -10.7739 -0.2474 -7.0214 { CZ PHE 331 A}'S' blue -12.7283 -0.6465 -7.4518 {"}'S' blue -12.8916 -0.7428 -7.6359 {"}'S' blue -12.4205 -0.438 -7.3298 {"}'S' sky -12.5782 -0.438 -7.5334 {"}'S' sky -12.7389 -0.5023 -7.7231 {"}'S' sky -12.8922 -0.6295 -7.8864 {"}'S' blue -13.0287 -0.8083 -8.0117 {"}'S' blue -12.2206 -0.2738 -7.3863 {"}'S' sky -12.3749 -0.2561 -7.591 {"}'S' sky -12.8453 -0.524 -8.125 {"}'S' blue -12.9795 -0.7067 -8.2479 {"}'S' sky -11.9875 -0.1471 -7.4385 {"}'S' sky -12.1405 -0.1129 -7.6468 {"}'S' sky -12.3015 -0.1278 -7.8499 {"}'S' sky -12.7723 -0.4511 -8.3682 {"}'S' sky -11.8838 -0.0116 -7.7002 {"}'S' sky -12.0397 -0.006 -7.9043 {"}'S' blue -12.2001 -0.0422 -8.1016 {"}'S' blue -12.3608 -0.1207 -8.2862 {"}'S' blue -12.5159 -0.2393 -8.454 {"}'S' sky -11.9148 0.0561 -8.151 {"}'S' sky -11.57 0.1038 -8.1315 {"}'S' blue -11.7316 0.0864 -8.3364 {"}'S' blue -10.7198 -0.3411 -7.3379 {"}'S' blue -11.3911 0.0982 -8.3283 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 331 A}'S' sea -11.3757 -0.1179 -6.5456 {"}'S' sea -11.5323 -0.0949 -6.753 {"}'S' sea -11.6938 -0.1124 -6.9579 {"}'S' green -11.1964 -0.1149 -6.7423 {"}'S' green -11.3533 -0.1005 -6.9497 {"}'S' green -11.5155 -0.124 -7.1523 {"}'S' sea -10.9872 -0.161 -6.8935 {"}'S' green -11.1448 -0.1437 -7.1009 {"}'S' sea -10.9298 -0.226 -7.229 { CZ PHE 331 A}'S' sea -12.5361 -0.2939 -7.7891 {"}'S' sea -12.6947 -0.3846 -7.9698 {"}'S' sea -12.4644 -0.1905 -8.0427 {"}'S' sea -12.623 -0.2995 -8.2176 {"}'S' sea -11.6005 -0.1516 -7.2963 {"}'S' sea -11.7359 -0.0614 -7.4952 {"}'S' green -11.3348 -0.1268 -7.3491 {"}'S' green -11.4628 -0.0238 -7.544 {"}'S' green -11.6052 0.0421 -7.7469 {"}'S' sea -11.7571 0.0692 -7.9505 {"}'S' sea -11.0135 -0.212 -7.3245 {"}'S' green -11.1322 -0.0784 -7.5155 {"}'S' green -11.2666 0.02 -7.7165 {"}'S' green -11.4134 0.0808 -7.9242 {"}'S' sea -10.8248 -0.1848 -7.5171 {"}'S' sea -10.9472 -0.0602 -7.7111 {"}'S' sea -11.0851 0.0309 -7.9135 {"}'S' sea -11.2342 0.0839 -8.1208 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 262 A}'S' blue -12.0328 0.2954 -6.8939 {"}'S' blue -11.9961 0.2272 -7.2606 {"}'S' blue -12.1813 0.3472 -7.9614 {"}'S' sky -12.0392 0.2688 -7.7561 {"}'S' sky -11.8868 0.228 -7.5488 {"}'S' blue -12.0518 0.4558 -8.2399 {"}'S' sky -11.9235 0.3522 -8.0442 {"}'S' sky -11.7117 0.4239 -8.1812 {"}'S' blue -11.471 0.5099 -8.253 { CG1 VAL 262 A}'S' blue -12.8245 -0.122 -6.6708 {"}'S' blue -12.896 -0.1937 -7.1572 {"}'S' blue -12.7357 -0.1433 -6.9649 {"}'S' blue -12.5776 -0.0548 -6.7844 {"}'S' blue -12.4252 0.0694 -6.6217 {"}'S' blue -12.6815 -0.1173 -7.2916 {"}'S' sky -12.5201 -0.0584 -7.0998 {"}'S' sky -12.3621 0.0415 -6.9238 {"}'S' blue -12.2112 0.1789 -6.7676 {"}'S' sky -12.5904 -0.0236 -7.5592 {"}'S' sky -12.4282 0.0144 -7.36 {"}'S' blue -12.2669 0.0995 -7.1742 {"}'S' blue -12.1119 0.2281 -7.0106 {"}'S' sky -12.5044 0.1202 -7.8061 {"}'S' sky -12.346 0.1322 -7.6042 {"}'S' blue -12.1847 0.1986 -7.4144 {"}'S' blue -12.3903 0.3018 -7.9786 {"}'S' blue -12.2331 0.2996 -7.7752 { HB VAL 262 A}'S' blue -11.9179 0.2174 -7.0147 {"}'S' sky -11.7706 0.1743 -6.8121 {"}'S' sky -11.6133 0.1923 -6.6131 {"}'S' sky -11.8381 0.1535 -7.3029 {"}'S' sky -11.231 0.1632 -6.5215 {"}'S' sky -10.932 0.1687 -6.5686 {"}'S' sky -10.8253 0.0756 -6.8356 {"}'S' blue -10.6752 0.2115 -6.6802 {"}'S' sky -10.8214 0.0212 -7.2263 {"}'S' blue -10.6633 0.098 -7.043 {"}'S' blue -10.5128 0.2294 -6.8845 {"}'S' sky -11.1213 0.3819 -8.0807 {"}'S' sky -10.7269 0.1041 -7.4937 {"}'S' blue -10.8831 0.4888 -8.111 {"}'S' sky -10.7805 0.336 -7.936 {"}'S' sky -10.6433 0.261 -7.7365 {"}'S' blue -10.487 0.2718 -7.5373 {"}'S' blue -10.6256 0.5589 -8.0281 {"}'S' blue -10.4922 0.4562 -7.8274 {HG11 VAL 262 A}'S' sky -13.1742 -0.4378 -7.8063 {"}'S' sky -13.016 -0.361 -7.6231 {"}'S' sky -12.8656 -0.2296 -7.4646 {"}'S' sky -13.0797 -0.3549 -8.0738 {"}'S' sky -12.9961 -0.198 -8.3166 {"}'S' sky -12.5465 0.0763 -7.8126 {"}'S' blue -12.8449 -0.0029 -8.4075 {"}'S' sky -12.6814 0.0258 -8.2042 {"}'S' sky -12.5308 0.1797 -8.0522 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 262 A}'S' sea -11.7823 0.2854 -7.8429 { HB VAL 262 A}'S' sea -11.7008 0.072 -7.1034 {"}'S' green -11.5488 0.0462 -6.9001 {"}'S' sea -11.3894 0.0767 -6.7029 {"}'S' green -11.6771 0.1122 -7.516 {"}'S' green -11.5464 0.0178 -7.3209 {"}'S' green -11.3991 -0.0238 -7.1186 {"}'S' green -11.2435 -0.0118 -6.9207 {"}'S' sea -11.0849 0.0526 -6.734 {"}'S' green -11.5478 0.1976 -7.803 {"}'S' green -11.4316 0.0658 -7.6176 {"}'S' green -11.2951 -0.0156 -7.4175 {"}'S' green -11.1427 -0.0406 -7.2138 {"}'S' sea -10.9833 -0.0101 -7.0166 {"}'S' sea -11.3574 0.3008 -7.9971 {"}'S' green -11.2549 0.1481 -7.822 {"}'S' green -11.1264 0.0473 -7.6269 {"}'S' green -10.9792 0.0042 -7.4243 {"}'S' sea -11.0176 0.2232 -7.9028 {"}'S' sea -10.8827 0.1283 -7.7019 {HG11 VAL 262 A}'S' sea -12.9164 -0.306 -7.8772 {"}'S' sea -12.7592 -0.1876 -7.7064 {"}'S' sea -12.8397 -0.1872 -8.1173 {"}'S' sea -12.6836 -0.0919 -7.9428 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 331 A}'M' greentint -9.2261 2.4633 -6.1912 {"}'M' greentint -9.3747 2.3064 -6.3396 {"}'M' greentint -9.4785 2.2101 -6.6371 {"}'M' greentint -9.0769 2.6935 -6.2533 {"}'M' greentint -9.2355 2.6003 -6.4317 {"}'M' greentint -9.3747 2.4323 -6.5649 {"}'M' greentint -9.4481 2.3041 -6.8819 {"}'M' greentint -9.5192 2.059 -6.9061 {"}'M' greentint -8.8899 2.8826 -6.3212 {"}'M' greentint -9.0501 2.8243 -6.5132 {"}'M' greentint -9.2049 2.7013 -6.6778 {"}'M' greentint -9.3406 2.5237 -6.804 {"}'M' greentint -9.3702 2.3843 -7.1202 {"}'M' greentint -9.4514 2.1411 -7.1586 {"}'M' greentint -8.6467 3.026 -6.3632 {"}'M' greentint -8.8072 3.0026 -6.5653 {"}'M' greentint -8.9692 2.9204 -6.7509 {"}'M' greentint -9.1215 2.7844 -6.9109 {"}'M' greentint -9.2581 2.6029 -7.0357 {"}'M' greentint -9.2557 2.429 -7.3498 {"}'M' greentint -8.5532 3.1165 -6.6321 {"}'M' greentint -8.7123 3.0654 -6.8242 {"}'M' greentint -8.8681 2.9667 -6.9976 {"}'M' greentint -9.0143 2.8231 -7.1475 {"}'M' greentint -9.1451 2.6411 -7.2659 {"}'M' greentint -9.1047 2.4508 -7.5586 {"}'M' greentint -8.5556 3.0999 -7.0297 {"}'M' greentint -8.7124 2.994 -7.2028 {"}'M' greentint -8.8591 2.8468 -7.3526 {"}'M' greentint -8.9912 2.6639 -7.4726 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 262 A}'M' greentint -9.4328 2.0615 -6.5135 {"}'M' greentint -9.2779 2.1586 -6.3411 {"}'M' greentint -9.1366 2.3094 -6.1994 {"}'M' greentint -9.016 2.5037 -6.0977 {"}'M' greentint -9.4765 2.0221 -6.988 {"}'M' greentint -9.3222 2.0214 -6.7889 {"}'M' greentint -9.164 2.0851 -6.6026 {"}'M' greentint -9.0137 2.2096 -6.4427 {"}'M' greentint -8.8806 2.3852 -6.3196 {"}'M' greentint -8.7754 2.5998 -6.2419 {"}'M' greentint -8.7019 2.8396 -6.215 {"}'M' greentint -9.2716 2.0804 -7.1399 {"}'M' greentint -9.1134 2.0826 -6.9361 {"}'M' greentint -8.9527 2.1586 -6.7493 {"}'M' greentint -8.8032 2.304 -6.5969 {"}'M' greentint -8.6786 2.5039 -6.4911 {"}'M' greentint -8.59 2.7415 -6.443 {"}'M' greentint -8.5455 2.9963 -6.4557 {"}'M' greentint -9.1685 2.2431 -7.3949 {"}'M' greentint -9.0197 2.1934 -7.1888 {"}'M' greentint -8.8574 2.2384 -6.9909 {"}'M' greentint -8.7031 2.371 -6.8292 {"}'M' greentint -8.5789 2.5743 -6.7245 {"}'M' greentint -8.5006 2.82 -6.6924 {"}'M' greentint -8.4796 3.0754 -6.7357 {"}'M' greentint -9.0404 2.4787 -7.5574 {"}'M' greentint -8.9087 2.3769 -7.3593 {"}'M' greentint -8.7477 2.405 -7.1593 {"}'M' greentint -8.5997 2.5569 -7.0104 {"}'M' greentint -8.5049 2.7911 -6.9531 {"}'M' greentint -8.4886 3.0447 -7.0024 {"}'M' greentint -8.7752 2.5948 -7.4128 {"}'M' greentint -8.6152 2.6917 -7.2334 {"}'M' greentint -8.5603 2.945 -7.2331 {"}'M' greentint -8.6935 2.8413 -7.4326 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 331 A}'M' green -9.9627 0.9355 -5.1762 {"}'M' green -9.3305 1.7315 -4.5809 {"}'M' green -9.5107 1.5943 -5.1753 {"}'M' green -9.6439 1.4187 -5.2984 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 331 A}'M' greentint -9.8309 0.9625 -4.1854 {"}'M' greentint -9.9642 0.8589 -4.3849 {"}'M' greentint -9.7492 1.2091 -4.2052 {"}'M' greentint -9.9092 1.1122 -4.3847 {"}'M' greentint -10.0196 1.0128 -4.6649 {"}'M' greentint -10.0359 0.7591 -4.6156 {"}'M' greentint -9.6158 1.4269 -4.2587 {"}'M' greentint -9.7768 1.3989 -4.4587 {"}'M' greentint -9.9248 1.2469 -4.6076 {"}'M' greentint -9.9913 1.1102 -4.9185 {"}'M' greentint -10.0417 0.8556 -4.9139 {"}'M' greentint -9.4273 1.5968 -4.3254 {"}'M' greentint -9.5862 1.5999 -4.5313 {"}'M' greentint -9.7465 1.5089 -4.7142 {"}'M' greentint -9.8879 1.3383 -4.8497 {"}'M' greentint -9.8945 1.1845 -5.1585 {"}'M' greentint -9.4918 1.6923 -4.7788 {"}'M' greentint -9.6484 1.5803 -4.9501 {"}'M' greentint -9.787 1.4055 -5.0809 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 262 A}'M' green -9.9385 0.8118 -4.2451 {"}'M' green -9.7982 0.9738 -4.1091 {"}'M' green -9.9526 1.0128 -5.2569 {"}'M' green -9.3409 1.7635 -4.6759 {"}'M' green -9.8183 1.2207 -5.3326 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 262 A}'M' greentint -9.983 0.7512 -4.6491 {"}'M' greentint -9.8251 0.8615 -4.4757 {"}'M' greentint -9.6798 1.0232 -4.3327 {"}'M' greentint -9.5552 1.2256 -4.2291 {"}'M' greentint -9.4587 1.4587 -4.1693 {"}'M' greentint -9.912 0.8534 -4.9019 {"}'M' greentint -9.7523 0.9419 -4.7209 {"}'M' greentint -9.6056 1.0915 -4.5733 {"}'M' greentint -9.4819 1.2913 -4.4686 {"}'M' greentint -9.39 1.5255 -4.4153 {"}'M' greentint -9.7937 1.0239 -5.056 {"}'M' greentint -9.6367 1.1197 -4.8786 {"}'M' greentint -9.4983 1.2903 -4.7471 {"}'M' greentint -9.3953 1.5138 -4.6762 {"}'M' greentint -9.6551 1.2499 -5.13 {"}'M' greentint -9.5053 1.4036 -4.9792 {"}'M' greentint -9.4101 1.6399 -4.9217 {"}'M' greentint -9.5469 1.5479 -5.1902 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 93 1j71A_111F_95Y}P -6.1295 5.8416 -11.4005 {"}-6.1295 5.8416 -11.4005 { ca ser A 93 1j71A_111F_95Y}-6.911 6.526 -10.3846 { c ser A 93 1j71A_111F_95Y}-7.447 5.5049 -9.3889 { o ser A 93 1j71A_111F_95Y}-7.7062 4.3503 -9.7411 { c ser A 93 1j71A_111F_95Y}P -7.447 5.5049 -9.3889 { n phe A 94 1j71A_111F_95Y}-7.6064 5.9344 -8.1446 { ca phe A 94 1j71A_111F_95Y}-8.0886 5.0549 -7.0888 { c phe A 94 1j71A_111F_95Y}-9.5891 4.8203 -7.0816 { o phe A 94 1j71A_111F_95Y}-10.3838 5.7348 -7.3051 { c phe A 94 1j71A_111F_95Y}P -9.5891 4.8203 -7.0816 { n tyr A 95 1j71A_111F_95Y}-9.9608 3.5749 -6.8218 { ca tyr A 95 1j71A_111F_95Y}-11.3569 3.1715 -6.7359 { c tyr A 95 1j71A_111F_95Y}-11.5088 2.3526 -5.4682 { o tyr A 95 1j71A_111F_95Y}-10.5247 1.9983 -4.8147 { c tyr A 95 1j71A_111F_95Y}P -11.5088 2.3526 -5.4682 { n lys A 96 1j71A_111F_95Y}-12.757 2.0561 -5.1362 { ca lys A 96 1j71A_111F_95Y}-13.0961 1.2165 -4.0033 { c lys A 96 1j71A_111F_95Y}-14.0972 0.2459 -4.6118 { o lys A 96 1j71A_111F_95Y}-15.0003 0.6615 -5.3361 { c lys A 96 1j71A_111F_95Y}P -14.0972 0.2459 -4.6118 { n asp A 97 1j71A_111F_95Y}-13.9244 -1.0422 -4.3499 { ca asp A 97 1j71A_111F_95Y}-14.8437 -2.0362 -4.8788 { c asp A 97 1j71A_111F_95Y}-14.5959 -3.3634 -4.1757 { o asp A 97 1j71A_111F_95Y}-13.7071 -3.4812 -3.3253 { n gln A 109 1j71A_111F_95Y}P -12.6385 -2.2949 -0.8504 {"}-12.6385 -2.2949 -0.8504 { ca gln A 109 1j71A_111F_95Y}-11.1815 -2.3097 -0.8277 { c gln A 109 1j71A_111F_95Y}-10.6579 -1.2669 -1.806 { o gln A 109 1j71A_111F_95Y}-11.0903 -1.2202 -2.9597 { c gln A 109 1j71A_111F_95Y}P -10.6579 -1.2669 -1.806 { n gln A 110 1j71A_111F_95Y}-9.7319 -0.4291 -1.352 { ca gln A 110 1j71A_111F_95Y}-9.1691 0.5831 -2.2304 { c gln A 110 1j71A_111F_95Y}-8.0728 -0.0371 -3.0905 { o gln A 110 1j71A_111F_95Y}-7.2289 -0.7925 -2.6003 { c gln A 110 1j71A_111F_95Y}P -8.0728 -0.0371 -3.0905 { n phe A 111 1j71A_111F_95Y}-8.105 0.2775 -4.3769 { ca phe A 111 1j71A_111F_95Y}-7.1188 -0.2269 -5.3267 { c phe A 111 1j71A_111F_95Y}-7.1255 0.736 -6.5007 { o phe A 111 1j71A_111F_95Y}-8.0435 1.5436 -6.6377 { c phe A 111 1j71A_111F_95Y}P -7.1255 0.736 -6.5007 { n ala A 112 1j71A_111F_95Y}-6.1079 0.6686 -7.3501 { ca ala A 112 1j71A_111F_95Y}-6.0608 1.5755 -8.4839 { c ala A 112 1j71A_111F_95Y}-6.3954 0.9168 -9.8128 { o ala A 112 1j71A_111F_95Y}-6.0177 -0.2255 -10.0748 { c ala A 112 1j71A_111F_95Y}P -6.3954 0.9168 -9.8128 { n asp A 113 1j71A_111F_95Y}-7.1362 1.6494 -10.6371 { ca asp A 113 1j71A_111F_95Y}-7.4928 1.1984 -11.9751 { c asp A 113 1j71A_111F_95Y}-6.4591 1.9196 -12.8321 { o asp A 113 1j71A_111F_95Y}-6.4861 3.1431 -12.9484 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 93 1j71A_111F_95Y}P -6.1295 5.8416 -11.4005 { ca ser A 93 1j71A_111F_95Y}P -6.911 6.526 -10.3846 { n phe A 94 1j71A_111F_95Y}P -7.6064 5.9344 -8.1446 { ca phe A 94 1j71A_111F_95Y}P -8.0886 5.0549 -7.0888 { n tyr A 95 1j71A_111F_95Y}P -9.9608 3.5749 -6.8218 { ca tyr A 95 1j71A_111F_95Y}P -11.3569 3.1715 -6.7359 { n lys A 96 1j71A_111F_95Y}P -12.757 2.0561 -5.1362 { ca lys A 96 1j71A_111F_95Y}P -13.0961 1.2165 -4.0033 { n asp A 97 1j71A_111F_95Y}P -13.9244 -1.0422 -4.3499 { ca asp A 97 1j71A_111F_95Y}P -14.8437 -2.0362 -4.8788 { n gln A 109 1j71A_111F_95Y}P -12.6385 -2.2949 -0.8504 { ca gln A 109 1j71A_111F_95Y}P -11.1815 -2.3097 -0.8277 { n gln A 110 1j71A_111F_95Y}P -9.7319 -0.4291 -1.352 { ca gln A 110 1j71A_111F_95Y}P -9.1691 0.5831 -2.2304 { n phe A 111 1j71A_111F_95Y}P -8.105 0.2775 -4.3769 { ca phe A 111 1j71A_111F_95Y}P -7.1188 -0.2269 -5.3267 { n ala A 112 1j71A_111F_95Y}P -6.1079 0.6686 -7.3501 { ca ala A 112 1j71A_111F_95Y}P -6.0608 1.5755 -8.4839 { n asp A 113 1j71A_111F_95Y}P -7.1362 1.6494 -10.6371 { ca asp A 113 1j71A_111F_95Y}P -7.4928 1.1984 -11.9751 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ser A 93 1j71A_111F_95Y}P -6.911 6.526 -10.3846 {"}-6.911 6.526 -10.3846 { ca phe A 94 1j71A_111F_95Y}-8.0886 5.0549 -7.0888 { ca tyr A 95 1j71A_111F_95Y}-11.3569 3.1715 -6.7359 { ca lys A 96 1j71A_111F_95Y}-13.0961 1.2165 -4.0033 { ca asp A 97 1j71A_111F_95Y}-14.8437 -2.0362 -4.8788 { ca gln A 109 1j71A_111F_95Y}P -11.1815 -2.3097 -0.8277 {"}-11.1815 -2.3097 -0.8277 { ca gln A 110 1j71A_111F_95Y}-9.1691 0.5831 -2.2304 { ca phe A 111 1j71A_111F_95Y}-7.1188 -0.2269 -5.3267 { ca ala A 112 1j71A_111F_95Y}-6.0608 1.5755 -8.4839 { ca asp A 113 1j71A_111F_95Y}-7.4928 1.1984 -11.9751 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 95 1j71A_111F_95Y}P -11.3569 3.1715 -6.7359 { cb tyr A 95 1j71A_111F_95Y}-11.7538 2.2657 -7.9073 { cg tyr A 95 1j71A_111F_95Y}-12.1422 2.9715 -9.182 { cd1 tyr A 95 1j71A_111F_95Y}-11.1788 3.4858 -10.0435 { ce1 tyr A 95 1j71A_111F_95Y}-11.5413 4.1144 -11.2309 { cz tyr A 95 1j71A_111F_95Y}-12.8827 4.2301 -11.5597 { oh tyr A 95 1j71A_111F_95Y}-13.2551 4.8463 -12.7305 { cg tyr A 95 1j71A_111F_95Y}P -12.1422 2.9715 -9.182 { cd2 tyr A 95 1j71A_111F_95Y}-13.4841 3.1033 -9.5356 { ce2 tyr A 95 1j71A_111F_95Y}-13.8589 3.7278 -10.7166 { cz tyr A 95 1j71A_111F_95Y}ghost -12.8827 4.2301 -11.5597 { ca phe A 111 1j71A_111F_95Y}P -7.1188 -0.2269 -5.3267 { cb phe A 111 1j71A_111F_95Y}-7.4928 -1.6457 -5.7841 { cg phe A 111 1j71A_111F_95Y}-8.7547 -1.7113 -6.6035 { cd1 phe A 111 1j71A_111F_95Y}-8.709 -1.5921 -7.9901 { ce1 phe A 111 1j71A_111F_95Y}-9.8739 -1.6193 -8.7472 { cz phe A 111 1j71A_111F_95Y}-11.1073 -1.7665 -8.1181 { cg phe A 111 1j71A_111F_95Y}P -8.7547 -1.7113 -6.6035 { cd2 phe A 111 1j71A_111F_95Y}-9.9929 -1.8606 -5.9822 { ce2 phe A 111 1j71A_111F_95Y}-11.1674 -1.8872 -6.7303 { cz phe A 111 1j71A_111F_95Y}ghost -11.1073 -1.7665 -8.1181 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 95 1j71A_111F_95Y}P -11.7538 2.2657 -7.9073 {"}P -11.7538 2.2657 -7.9073 { cd1 tyr A 95 1j71A_111F_95Y}P -11.1788 3.4858 -10.0435 { cd2 tyr A 95 1j71A_111F_95Y}P -13.4841 3.1033 -9.5356 { ce1 tyr A 95 1j71A_111F_95Y}P -11.5413 4.1144 -11.2309 { ce2 tyr A 95 1j71A_111F_95Y}P -13.8589 3.7278 -10.7166 { oh tyr A 95 1j71A_111F_95Y}P -13.2551 4.8463 -12.7305 { cb phe A 111 1j71A_111F_95Y}P -7.4928 -1.6457 -5.7841 {"}P -7.4928 -1.6457 -5.7841 { cd1 phe A 111 1j71A_111F_95Y}P -8.709 -1.5921 -7.9901 { cd2 phe A 111 1j71A_111F_95Y}P -9.9929 -1.8606 -5.9822 { ce1 phe A 111 1j71A_111F_95Y}P -9.8739 -1.6193 -8.7472 { ce2 phe A 111 1j71A_111F_95Y}P -11.1674 -1.8872 -6.7303 { cz phe A 111 1j71A_111F_95Y}P -11.1073 -1.7665 -8.1181 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 111 A}'S' blue -11.1746 -0.0187 -8.045 {"}'S' blue -10.8388 -0.0386 -8.0343 {"}'S' blue -10.9957 -0.0243 -8.2418 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 95 A}'S' blue -11.1091 0.4412 -8.0622 {"}'S' blue -11.0051 0.4494 -8.3611 {"}'S' blue -10.8527 0.4244 -8.1574 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 111 A}'M' greentint -9.117 2.2239 -6.0505 {"}'M' greentint -9.2656 2.067 -6.199 {"}'M' greentint -9.3693 1.9707 -6.4965 {"}'M' greentint -8.8098 2.4625 -5.9107 {"}'M' greentint -8.9677 2.4541 -6.1127 {"}'M' greentint -9.1263 2.3609 -6.2911 {"}'M' greentint -9.2656 2.193 -6.4243 {"}'M' greentint -9.3389 2.0647 -6.7413 {"}'M' greentint -8.6246 2.6325 -5.9767 {"}'M' greentint -8.7807 2.6432 -6.1805 {"}'M' greentint -8.9409 2.585 -6.3725 {"}'M' greentint -9.0957 2.4619 -6.5372 {"}'M' greentint -9.2314 2.2844 -6.6634 {"}'M' greentint -9.261 2.1449 -6.9795 {"}'M' greentint -9.3422 1.9017 -7.0179 {"}'M' greentint -8.5375 2.7866 -6.2226 {"}'M' greentint -8.698 2.7632 -6.4246 {"}'M' greentint -8.8601 2.681 -6.6103 {"}'M' greentint -9.0123 2.5451 -6.7703 {"}'M' greentint -9.149 2.3635 -6.8951 {"}'M' greentint -9.1465 2.1897 -7.2092 {"}'M' greentint -8.444 2.8771 -6.4914 {"}'M' greentint -8.6032 2.826 -6.6836 {"}'M' greentint -8.759 2.7273 -6.8569 {"}'M' greentint -8.9051 2.5837 -7.0068 {"}'M' greentint -9.0359 2.4017 -7.1252 {"}'M' greentint -8.4464 2.8605 -6.889 {"}'M' greentint -8.6033 2.7546 -7.0622 {"}'M' greentint -8.7499 2.6075 -7.212 {"}'M' greentint -8.882 2.4245 -7.3319 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 95 A}'M' greentint -9.2738 1.881 -6.3507 {"}'M' greentint -9.1189 1.9782 -6.1782 {"}'M' greentint -8.9776 2.129 -6.0366 {"}'M' greentint -8.857 2.3232 -5.9349 {"}'M' greentint -9.3175 1.8417 -6.8252 {"}'M' greentint -9.1632 1.8409 -6.626 {"}'M' greentint -9.005 1.9046 -6.4397 {"}'M' greentint -8.8547 2.0291 -6.2799 {"}'M' greentint -8.7216 2.2047 -6.1568 {"}'M' greentint -8.6164 2.4193 -6.0791 {"}'M' greentint -8.5429 2.6591 -6.0522 {"}'M' greentint -9.254 1.9729 -7.1801 {"}'M' greentint -9.1126 1.8999 -6.9771 {"}'M' greentint -8.9544 1.9021 -6.7733 {"}'M' greentint -8.7937 1.9781 -6.5865 {"}'M' greentint -8.6442 2.1235 -6.4341 {"}'M' greentint -8.5196 2.3234 -6.3282 {"}'M' greentint -8.431 2.561 -6.2802 {"}'M' greentint -8.3865 2.8158 -6.2929 {"}'M' greentint -9.0094 2.0626 -7.2321 {"}'M' greentint -8.8607 2.013 -7.026 {"}'M' greentint -8.6983 2.0579 -6.828 {"}'M' greentint -8.5441 2.1905 -6.6663 {"}'M' greentint -8.4199 2.3938 -6.5617 {"}'M' greentint -8.3416 2.6395 -6.5296 {"}'M' greentint -8.3206 2.8949 -6.5729 {"}'M' greentint -8.8814 2.2982 -7.3946 {"}'M' greentint -8.7497 2.1964 -7.1964 {"}'M' greentint -8.5887 2.2245 -6.9964 {"}'M' greentint -8.4406 2.3765 -6.8476 {"}'M' greentint -8.3458 2.6106 -6.7903 {"}'M' greentint -8.3296 2.8643 -6.8396 {"}'M' greentint -8.6162 2.4143 -7.25 {"}'M' greentint -8.4562 2.5112 -7.0705 {"}'M' greentint -8.4013 2.7645 -7.0703 {"}'M' greentint -8.5345 2.6609 -7.2698 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 111 A}'M' green -9.7094 0.9379 -4.3811 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 111 A}'M' greentint -9.4945 1.2881 -4.2014 {"}'M' greentint -9.6544 1.1912 -4.3808 {"}'M' greentint -9.7648 1.0918 -4.6611 {"}'M' greentint -9.7811 0.8381 -4.6118 {"}'M' greentint -9.361 1.5059 -4.2549 {"}'M' greentint -9.522 1.4779 -4.4549 {"}'M' greentint -9.67 1.3259 -4.6038 {"}'M' greentint -9.7365 1.1893 -4.9147 {"}'M' greentint -9.7869 0.9346 -4.9101 {"}'M' greentint -9.3314 1.679 -4.5275 {"}'M' greentint -9.4917 1.5879 -4.7104 {"}'M' greentint -9.6331 1.4174 -4.8459 {"}'M' greentint -9.6397 1.2635 -5.1547 {"}'M' greentint -9.708 1.0145 -5.1724 {"}'M' greentint -9.237 1.7713 -4.7749 {"}'M' greentint -9.3936 1.6593 -4.9463 {"}'M' greentint -9.5322 1.4846 -5.0771 {"}'M' greentint -9.4943 1.283 -5.3723 {"}'M' greentint -9.2559 1.6733 -5.1715 {"}'M' greentint -9.3891 1.4977 -5.2946 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 95 A}'M' green -9.3788 1.4602 -4.2176 {"}'M' green -9.1958 1.7754 -4.4343 {"}'M' green -9.1389 1.8413 -4.6945 {"}'M' green -9.1418 1.8285 -4.9535 {"}'M' green -9.456 1.3149 -5.4076 {"}'M' green -9.211 1.7049 -5.1993 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 95 A}'M' greentint -9.7395 0.8768 -4.5227 {"}'M' greentint -9.5991 1.0387 -4.3867 {"}'M' greentint -9.4772 1.2354 -4.2837 {"}'M' greentint -9.7839 0.8162 -4.9267 {"}'M' greentint -9.626 0.9264 -4.7533 {"}'M' greentint -9.4807 1.0881 -4.6103 {"}'M' greentint -9.3561 1.2905 -4.5067 {"}'M' greentint -9.2596 1.5236 -4.4468 {"}'M' greentint -9.7129 0.9183 -5.1795 {"}'M' greentint -9.5532 1.0069 -4.9985 {"}'M' greentint -9.4065 1.1565 -4.8509 {"}'M' greentint -9.2828 1.3562 -4.7462 {"}'M' greentint -9.1909 1.5904 -4.6929 {"}'M' greentint -9.5947 1.0888 -5.3336 {"}'M' greentint -9.4376 1.1847 -5.1562 {"}'M' greentint -9.2992 1.3553 -5.0247 {"}'M' greentint -9.1962 1.5787 -4.9538 {"}'M' greentint -9.3063 1.4686 -5.2568 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 92 1jbsA_123Y_94L}P -6.0722 6.1096 -11.2075 {"}-6.0722 6.1096 -11.2075 { ca tyr A 92 1jbsA_123Y_94L}-6.6613 6.6521 -9.9987 { c tyr A 92 1jbsA_123Y_94L}-7.1425 5.5194 -9.1093 { o tyr A 92 1jbsA_123Y_94L}-7.1072 4.3518 -9.5003 { c tyr A 92 1jbsA_123Y_94L}P -7.1425 5.5194 -9.1093 { n leu A 93 1jbsA_123Y_94L}-7.5993 5.872 -7.9174 { ca leu A 93 1jbsA_123Y_94L}-8.0591 4.8688 -6.9753 { c leu A 93 1jbsA_123Y_94L}-9.5683 4.626 -7.0704 { o leu A 93 1jbsA_123Y_94L}-10.3423 5.5571 -7.2711 { c leu A 93 1jbsA_123Y_94L}P -9.5683 4.626 -7.0704 { n leu A 94 1jbsA_123Y_94L}-9.9641 3.3635 -6.9318 { ca leu A 94 1jbsA_123Y_94L}-11.3618 2.956 -6.9327 { c leu A 94 1jbsA_123Y_94L}-11.6921 2.4096 -5.5301 { o leu A 94 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-10.1839 {"}P -11.8093 0.76 -10.1839 { cd2 leu A 94 1jbsA_123Y_94L}P -12.7512 3.0335 -9.82 {"}P -12.7512 3.0335 -9.82 {"}P -12.7512 3.0335 -9.82 { cb tyr A 123 1jbsA_123Y_94L}P -7.8778 -1.8523 -5.9042 {"}P -7.8778 -1.8523 -5.9042 { cd1 tyr A 123 1jbsA_123Y_94L}P -10.381 -1.8113 -5.5362 { cd2 tyr A 123 1jbsA_123Y_94L}P -9.5685 -2.0507 -7.775 { ce1 tyr A 123 1jbsA_123Y_94L}P -11.6908 -1.8528 -6.0062 { ce2 tyr A 123 1jbsA_123Y_94L}P -10.8714 -2.0893 -8.2551 { oh tyr A 123 1jbsA_123Y_94L}P -13.2251 -2.0507 -7.8274 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 123 A}'S' blue -10.2658 -0.449 -7.6719 {"}'S' blue -10.1413 -0.4032 -7.9138 { CE2 TYR 123 A}'S' blue -10.8315 -0.4691 -7.5946 {"}'S' sky -10.9739 -0.4032 -7.7974 {"}'S' sky -11.1258 -0.3761 -8.001 {"}'S' blue -11.2835 -0.3892 -8.2015 {"}'S' sky -11.6015 -0.5315 -8.5731 {"}'S' sky -11.7547 -0.657 -8.735 {"}'S' sky -11.8983 -0.8155 -8.8762 {"}'S' blue -12.028 -1.0021 -8.9921 {"}'S' sky -10.6352 -0.4253 -7.767 {"}'S' sky -10.782 -0.3645 -7.9747 {"}'S' sky -10.9386 -0.3415 -8.182 {"}'S' blue -11.1002 -0.359 -8.3869 {"}'S' sky -11.8605 -0.9916 -9.1927 {"}'S' blue -11.7949 -1.2323 -9.4702 {"}'S' blue -10.4537 -0.4144 -7.964 {"}'S' sky -10.6028 -0.3614 -8.1713 {"}'S' blue -10.7597 -0.3471 -8.3788 {"}'S' blue -11.587 -1.269 -9.6255 { CZ TYR 123 A}'S' blue -11.9973 -0.2443 -7.2912 {"}'S' blue -12.1589 -0.2617 -7.4961 {"}'S' blue -11.6614 -0.2642 -7.2805 {"}'S' blue -11.8184 -0.2499 -7.488 {"}'S' blue -11.9805 -0.2733 -7.6906 {"}'S' blue -11.3036 -0.3641 -7.2248 {"}'S' blue -11.4522 -0.3103 -7.4317 {"}'S' blue -11.6098 -0.2931 -7.6391 {"}'S' blue -11.7716 -0.3161 -7.843 {"}'S' blue -11.0913 -0.4563 -7.3528 {"}'S' blue -11.2389 -0.3968 -7.5596 {"}'S' blue -11.3948 -0.3753 -7.7673 {"}'S' blue -12.0377 -0.6769 -8.514 { HE2 TYR 123 A}'S' blue -11.3298 -1.4141 -9.897 {"}'S' sky -10.9667 -1.3589 -9.873 {"}'S' blue -10.7226 -1.4661 -9.9267 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 123 A}'S' sea -11.4253 -0.5094 -8.7644 {"}'S' green -11.5807 -0.6391 -8.9301 {"}'S' sea -11.7269 -0.801 -9.0742 {"}'S' green -11.0855 -0.432 -8.7756 {"}'S' green -11.2463 -0.5305 -8.9559 {"}'S' green -11.4006 -0.6621 -9.1196 {"}'S' green -11.5456 -0.8258 -9.2616 {"}'S' sea -11.6783 -1.0175 -9.3787 {"}'S' sea -10.713 -0.4133 -8.7338 {"}'S' green -11.4701 -1.0549 -9.5333 {"}'S' green -10.4978 -0.4914 -8.8627 {"}'S' green -11.2568 -1.1286 -9.666 {"}'S' sea -10.2819 -0.6028 -8.966 {"}'S' green -10.4418 -0.6541 -9.1593 {"}'S' green -11.0271 -1.2106 -9.7605 {"}'S' sea -10.2095 -0.7834 -9.2139 {"}'S' green -10.3703 -0.8632 -9.3983 {"}'S' green -10.525 -0.9824 -9.5654 {"}'S' green -10.6702 -1.1372 -9.7097 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 123 A}'S' P -10.8761 -0.474 -8.9276 {"}'S' -10.8759 -0.4826 -8.9236 {"}'S' P -11.0373 -0.5705 -9.1088 {"}'S' -11.0319 -0.6226 -9.0792 {"}'S' P -11.1924 -0.7019 -9.2719 {"}'S' -11.1805 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{"}'S' green -12.3579 1.4977 -8.785 {"}'S' green -11.7358 1.0599 -7.8587 {"}'S' sea -12.1103 1.607 -8.8013 {"}'S' green -12.0552 1.3957 -8.6727 {"}'S' green -11.6592 1.1787 -8.0989 {"}'S' green -11.7978 1.4658 -8.5897 {"}'S' green -11.6644 1.3631 -8.389 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 PHE 136 A}'S' P -12.7185 0.9248 -7.8825 {"}'S' -12.7171 0.9299 -7.8818 {"}'S' P -12.5712 0.8831 -7.6802 {"}'S' -12.5656 0.9192 -7.6825 {"}'S' P -12.4157 0.8951 -7.4824 {"}'S' -12.4142 0.9199 -7.4877 {"}'S' P -12.7199 1.1045 -8.3647 {"}'S' -12.7153 1.1158 -8.3575 {"}'S' P -12.6038 0.9727 -8.1792 {"}'S' -12.5975 1.0052 -8.1661 {"}'S' P -12.4672 0.8913 -7.9791 {"}'S' -12.4634 0.9384 -7.9693 {"}'S' P -12.3148 0.8664 -7.7754 {"}'S' -12.3187 0.9337 -7.7739 {"}'S' P -12.1554 0.8968 -7.5782 {"}'S' -12.1633 0.9362 -7.5842 {"}'S' P -12.5296 1.2078 -8.5587 {"}'S' -12.5248 1.2358 -8.5312 {"}'S' P -12.427 1.055 -8.3836 {"}'S' -12.4243 1.1214 -8.3403 {"}'S' P -12.2986 0.9542 -8.1885 {"}'S' -12.3034 1.0239 -8.1597 {"}'S' P -12.1513 0.9112 -7.9859 {"}'S' -12.1594 0.9564 -7.9765 {"}'S' P -11.9931 0.9289 -7.7874 {"}'S' -12.0036 0.9583 -7.7862 {"}'S' P -12.2934 1.2888 -8.6423 {"}'S' -12.2957 1.3121 -8.6149 {"}'S' P -12.1897 1.1301 -8.4644 {"}'S' -12.2014 1.1914 -8.4156 {"}'S' P -12.0549 1.0352 -8.2635 {"}'S' -12.0734 1.0949 -8.2324 {"}'S' P -11.8991 1.011 -8.0553 {"}'S' -11.9024 1.0194 -8.0533 {"}'S' P -11.9526 1.2429 -8.4976 {"}'S' -11.9641 1.2651 -8.4773 {"}'S' P -11.8155 1.1679 -8.2981 {"}'S' -11.8196 1.1754 -8.2935 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 91 A}'M' green -9.4058 2.1792 -6.3889 {"}'M' green -8.9737 2.787 -6.5659 {"}'M' green -9.61 2.2993 -7.5687 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 91 A}'M' greentint -9.5647 2.0905 -6.5705 {"}'M' greentint -9.7083 1.9828 -6.843 {"}'M' greentint -9.3027 2.4118 -6.4379 {"}'M' greentint -9.466 2.3784 -6.6397 {"}'M' greentint -9.6146 2.2215 -6.7882 {"}'M' greentint -9.7183 2.1251 -7.0857 {"}'M' greentint -9.1588 2.6169 -6.4999 {"}'M' greentint -9.3168 2.6085 -6.7019 {"}'M' greentint -9.4754 2.5154 -6.8803 {"}'M' greentint -9.6146 2.3474 -7.0135 {"}'M' greentint -9.6879 2.2191 -7.3305 {"}'M' greentint -9.1298 2.7976 -6.7698 {"}'M' greentint -9.29 2.7394 -6.9617 {"}'M' greentint -9.4448 2.6163 -7.1264 {"}'M' greentint -9.5805 2.4388 -7.2526 {"}'M' greentint -9.0466 2.917 -7.0132 {"}'M' greentint -9.2091 2.8354 -7.1995 {"}'M' greentint -9.3614 2.6995 -7.3595 {"}'M' greentint -9.498 2.5179 -7.4843 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 136 A}'M' green -9.1159 2.6142 -6.4201 {"}'M' green -9.4053 2.6226 -7.5677 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 136 A}'M' greentint -9.6392 1.9553 -6.9132 {"}'M' greentint -9.4786 2.0313 -6.7263 {"}'M' greentint -9.329 2.1766 -6.574 {"}'M' greentint -9.2045 2.3766 -6.4681 {"}'M' greentint -9.6943 2.1157 -7.372 {"}'M' greentint -9.5455 2.0661 -7.1659 {"}'M' greentint -9.3832 2.111 -6.9679 {"}'M' greentint -9.229 2.2436 -6.8062 {"}'M' greentint -9.1047 2.447 -6.7016 {"}'M' greentint -9.0265 2.6926 -6.6695 {"}'M' greentint -9.5663 2.3513 -7.5345 {"}'M' greentint -9.4346 2.2496 -7.3363 {"}'M' greentint -9.2736 2.2776 -7.1364 {"}'M' greentint -9.1255 2.4296 -6.9875 {"}'M' greentint -9.0307 2.6637 -6.9302 {"}'M' greentint -9.0144 2.9174 -6.9795 {"}'M' greentint -9.3011 2.4674 -7.3899 {"}'M' greentint -9.1411 2.5643 -7.2104 {"}'M' greentint -9.0861 2.8176 -7.2102 {"}'M' greentint -9.2194 2.714 -7.4097 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 91 A}'M' greentint -10.3746 0.8827 -4.7257 {"}'M' greentint -10.5078 0.7791 -4.9251 {"}'M' greentint -10.1887 0.9741 -4.5677 {"}'M' greentint -10.2929 1.1293 -4.7455 {"}'M' greentint -10.4529 1.0324 -4.9249 {"}'M' greentint -10.5632 0.933 -5.2052 {"}'M' greentint -10.5795 0.6793 -5.1559 {"}'M' greentint -10.0277 1.2454 -4.6009 {"}'M' greentint -10.1594 1.3471 -4.799 {"}'M' greentint -10.3204 1.3191 -4.999 {"}'M' greentint -10.4684 1.1671 -5.1479 {"}'M' greentint -10.535 1.0304 -5.4588 {"}'M' greentint -10.5854 0.7758 -5.4542 {"}'M' greentint -9.971 1.517 -4.8657 {"}'M' greentint -10.1299 1.5202 -5.0716 {"}'M' greentint -10.2901 1.4291 -5.2544 {"}'M' greentint -10.4315 1.2586 -5.39 {"}'M' greentint -10.4381 1.1047 -5.6988 {"}'M' greentint -9.8741 1.6517 -5.1212 {"}'M' greentint -10.0354 1.6125 -5.319 {"}'M' greentint -10.192 1.5005 -5.4904 {"}'M' greentint -10.3306 1.3258 -5.6212 {"}'M' greentint -10.0544 1.5145 -5.7156 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 136 A}'M' green -10.3654 0.7787 -4.6535 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 136 A}'M' greentint -10.5724 0.6625 -5.2517 {"}'M' greentint -10.4098 0.7182 -5.0575 {"}'M' greentint -10.252 0.8284 -4.884 {"}'M' greentint -10.1066 0.9901 -4.7411 {"}'M' greentint -9.982 1.1925 -4.6375 {"}'M' greentint -10.4981 0.7978 -5.5107 {"}'M' greentint -10.3389 0.8203 -5.3103 {"}'M' greentint -10.1791 0.9089 -5.1293 {"}'M' greentint -10.0324 1.0585 -4.9817 {"}'M' greentint -9.9087 1.2582 -4.877 {"}'M' greentint -9.8168 1.4924 -4.8237 {"}'M' greentint -10.3794 0.9798 -5.6652 {"}'M' greentint -10.2206 0.9908 -5.4644 {"}'M' greentint -10.0636 1.0867 -5.287 {"}'M' greentint -9.9251 1.2572 -5.1555 {"}'M' greentint -9.8222 1.4807 -5.0846 {"}'M' greentint -10.2451 1.1876 -5.741 {"}'M' greentint -10.082 1.2169 -5.5384 {"}'M' greentint -9.9322 1.3706 -5.3876 {"}'M' greentint -9.8369 1.6069 -5.33 {"}'M' greentint -10.1325 1.4175 -5.7762 {"}'M' greentint -9.9737 1.5148 -5.5986 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n asp A 389 1ju3A_391Y_555}P -12.3243 -1.5653 0.5915 {"}-12.3243 -1.5653 0.5915 { ca asp A 389 1ju3A_391Y_555}-11.2465 -2.1436 -0.2095 { c asp A 389 1ju3A_391Y_555}-10.9195 -1.1547 -1.3125 { o asp A 389 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-8.9222 {"}'S' sea -10.6252 0.5975 -8.9028 { CZ TYR 391 A}'S' sea -11.5946 0.2681 -7.9172 {"}'S' sea -11.7512 0.291 -8.1246 {"}'S' sea -11.2663 0.2181 -7.9065 {"}'S' sea -11.4153 0.2711 -8.1139 {"}'S' sea -11.5723 0.2854 -8.3213 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ASN 555 A}'S' blue -12.1208 0.6664 -7.8285 {"}'S' blue -12.1638 0.708 -8.3241 {"}'S' blue -12.0115 0.6672 -8.1168 { HB2 ASN 555 A}'S' blue -11.8635 0.6428 -7.7808 {"}'S' sky -11.931 0.6219 -8.2716 {"}'S' sky -11.7937 0.5405 -8.0721 {"}'S' sky -11.4823 0.5451 -7.6716 {"}'S' sky -11.77 0.5807 -8.4847 {"}'S' blue -11.1778 0.5211 -7.7027 {"}'S' blue -11.6407 0.666 -8.7717 {"}'S' sky -10.9182 0.5441 -7.8043 {"}'S' blue -11.4503 0.7693 -8.9658 {"}'S' blue -11.2142 0.8504 -9.0494 {"}'S' sky -10.4993 0.7399 -8.095 {"}'S' sky -10.4238 0.8356 -8.3314 {"}'S' sky -10.5851 0.9246 -8.7961 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ASN 555 A}'S' sea -11.6417 0.5147 -7.8688 {"}'S' sea -11.6393 0.4863 -8.2896 {"}'S' sea -11.492 0.4446 -8.0873 {"}'S' sea -11.3364 0.4566 -7.8894 {"}'S' sea -11.5245 0.5342 -8.5863 {"}'S' green -11.388 0.4529 -8.3862 {"}'S' green -11.2356 0.4279 -8.1825 {"}'S' sea -11.0762 0.4584 -7.9853 {"}'S' sea -11.3478 0.6165 -8.7907 {"}'S' green -11.2193 0.5158 -8.5956 {"}'S' green -11.072 0.4727 -8.393 {"}'S' green -10.9139 0.4905 -8.1945 {"}'S' sea -10.7562 0.5665 -8.0117 {"}'S' sea -11.1105 0.6916 -8.8715 {"}'S' green -10.9756 0.5968 -8.6706 {"}'S' green -10.8198 0.5725 -8.4624 {"}'S' sea -10.6566 0.6215 -8.2658 {"}'S' sea -10.8734 0.8045 -8.9047 {"}'S' sea -10.7362 0.7295 -8.7052 {"}'S' sea -10.5799 0.7402 -8.506 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 391 A}'M' green -9.2636 2.2106 -6.6204 {"}'M' green -9.1598 2.4329 -6.5481 {"}'M' green -9.3043 2.0595 -6.8894 {"}'M' green -8.7544 2.9209 -6.7342 {"}'M' green -9.1828 1.948 -7.3814 {"}'M' green -8.4975 2.9945 -7.186 {"}'M' green 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-4.8671 {"}'M' green -9.6481 0.9735 -5.4914 {"}'M' green -9.3363 1.6035 -5.2636 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 391 A}'M' greentint -9.7897 0.8681 -4.4732 {"}'M' greentint -9.7348 1.1214 -4.473 {"}'M' greentint -9.8451 1.022 -4.7533 {"}'M' greentint -9.8614 0.7683 -4.704 {"}'M' greentint -9.6023 1.4081 -4.5471 {"}'M' greentint -9.7503 1.2561 -4.6959 {"}'M' greentint -9.8169 1.1195 -5.0069 {"}'M' greentint -9.8673 0.8648 -5.0023 {"}'M' greentint -9.572 1.5181 -4.8025 {"}'M' greentint -9.7134 1.3476 -4.9381 {"}'M' greentint -9.72 1.1937 -5.2469 {"}'M' greentint -9.7883 0.9447 -5.2646 {"}'M' greentint -9.8088 0.6915 -5.2211 {"}'M' greentint -9.4739 1.5895 -5.0385 {"}'M' greentint -9.6125 1.4148 -5.1692 {"}'M' greentint -9.5746 1.2133 -5.4645 {"}'M' greentint -9.4694 1.4279 -5.3867 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ASN 555 A}'M' green -9.5271 1.4181 -4.4142 {"}'M' green -9.3896 1.747 -4.6908 @dotlist {x} color= 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-0.1741 -6.7735 {"}'S' -13.332 -0.1786 -6.7739 {"}'S' P -12.913 0.0832 -6.6575 {"}'S' -12.9081 0.0707 -6.6582 {"}'S' P -13.2288 -0.1138 -7.01 {"}'S' -13.2194 -0.1267 -7.0079 {"}'S' P -11.798 0.1563 -6.4695 {"}'S' -11.8 0.1459 -6.4716 {"}'S' P -11.9471 0.2093 -6.6768 {"}'S' -11.9522 0.1775 -6.6783 {"}'S' P -12.104 0.2236 -6.8843 {"}'S' -12.1045 0.2187 -6.8839 {"}'S' P -11.5892 0.1094 -6.6211 {"}'S' -11.5973 0.0892 -6.6224 {"}'S' P -11.7378 0.1632 -6.828 {"}'S' -11.7503 0.1199 -6.8266 {"}'S' P -11.8955 0.1804 -7.0354 {"}'S' -11.8989 0.1603 -7.0321 {"}'S' P -11.5245 0.0767 -6.9559 {"}'S' -11.5277 0.0677 -6.9547 { CZ TYR1016 A}'S' P -13.2929 -0.1381 -7.2663 {"}'S' -13.2845 -0.1499 -7.2743 {"}'S' P -13.4506 -0.1381 -7.4699 {"}'S' -13.4334 -0.1563 -7.4799 {"}'S' P -13.093 0.0262 -7.3228 {"}'S' -13.0907 0.0227 -7.3258 {"}'S' P -13.2473 0.0439 -7.5275 {"}'S' -13.2328 0.0198 -7.5381 {"}'S' P -13.4086 0.0061 -7.7256 {"}'S' -13.4023 -0.0016 -7.7273 @dotlist {x} color= red width= 1 master= {vdw 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0.3513 -8.1105 {"}'S' sky -13.424 0.4186 -8.0443 {"}'S' sky -13.2028 0.4893 -7.9222 {HG21 VAL 868 A}'S' blue -13.0888 0.5723 -8.6738 {"}'S' sky -12.9314 0.5902 -8.4748 {"}'S' sky -12.7732 0.667 -8.2915 {"}'S' sky -13.0189 0.4699 -8.9651 {"}'S' blue -12.8645 0.4158 -9.1826 {"}'S' sky -12.6132 0.3824 -9.2792 {"}'S' sky -11.9934 0.6094 -8.5419 {"}'S' sky -12.2973 0.4022 -9.286 {"}'S' sky -11.831 0.6274 -8.7462 {"}'S' blue -12.2009 0.5263 -9.5636 {"}'S' sky -12.0451 0.502 -9.3554 {"}'S' sky -11.7246 0.6694 -8.988 {"}'S' blue -11.8052 0.6697 -9.399 {"}'S' blue -11.649 0.7651 -9.2244 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 868 A}'S' sea -12.3495 0.3899 -6.4837 {"}'S' sea -12.6188 0.3919 -7.2657 {"}'S' green -12.4701 0.3381 -7.0588 {"}'S' green -12.3129 0.3217 -6.8504 {"}'S' sea -12.6247 0.5574 -7.7474 {"}'S' green -12.498 0.4417 -7.5511 {"}'S' green -12.3559 0.3633 -7.3459 {"}'S' green -12.2036 0.3225 -7.1386 {"}'S' sea -12.3686 0.5503 -7.8297 {"}'S' green -12.2402 0.4467 -7.634 {"}'S' green -12.0991 0.3799 -7.4327 {"}'S' sea -12.1554 0.6271 -7.9659 {"}'S' sea -12.0284 0.5184 -7.771 { CG1 VAL 868 A}'S' green -13.2748 -0.0452 -6.2529 {"}'S' sea -13.1121 0.0306 -6.0631 {"}'S' green -13.1836 -0.0412 -6.5495 {"}'S' green -13.0232 0.0092 -6.3572 {"}'S' green -12.8652 0.0977 -6.1767 {"}'S' sea -12.7128 0.2219 -6.014 {"}'S' green -12.6497 0.194 -6.3161 {"}'S' sea -12.4987 0.3315 -6.1599 {"}'S' green -12.8779 0.1289 -6.9515 {"}'S' green -12.7158 0.1669 -6.7523 {"}'S' green -12.5545 0.252 -6.5665 {"}'S' sea -12.3995 0.3806 -6.4029 {"}'S' sea -12.792 0.2728 -7.1984 {"}'S' green -12.6335 0.2847 -6.9965 { HB VAL 868 A}'S' green -12.2286 0.3073 -6.6396 {"}'S' green -12.0813 0.2642 -6.4371 {"}'S' green -11.924 0.2821 -6.238 {"}'S' green -12.1488 0.2433 -6.9278 {"}'S' green -11.7001 0.1665 -6.3278 {"}'S' sea -11.5417 0.2531 -6.1464 {"}'S' green -12.0966 0.3427 -7.32 {"}'S' green -11.9878 0.2021 -7.1409 {"}'S' green -11.3956 0.1425 -6.3589 {"}'S' green -11.2427 0.2586 -6.1935 {"}'S' green -11.8585 0.2874 -7.428 {"}'S' green -11.7423 0.1556 -7.2425 {"}'S' green -11.136 0.1655 -6.4605 {"}'S' green -10.9859 0.3013 -6.3052 {"}'S' sea -11.6682 0.3907 -7.622 {"}'S' sea -11.5656 0.2379 -7.4469 {"}'S' green -11.4371 0.1372 -7.2518 {"}'S' green -11.2899 0.0941 -7.0492 {"}'S' green -11.1317 0.1119 -6.8508 {"}'S' green -10.974 0.1879 -6.6679 {"}'S' sea -10.8235 0.3193 -6.5094 {"}'S' sea -11.0376 0.1939 -7.1186 {"}'S' sea -10.8744 0.2429 -6.922 {HG11 VAL 868 A}'S' sea -13.6625 -0.18 -6.4393 {"}'S' sea -14.2784 -0.1512 -7.6738 {"}'S' sea -14.1622 -0.283 -7.4884 {"}'S' green -13.7139 -0.3589 -6.8874 {"}'S' green -13.5559 -0.2731 -6.7064 {"}'S' green -13.4058 -0.1373 -6.551 {"}'S' sea -14.1591 0.1484 -8.0132 {"}'S' green -14.088 -0.0479 -7.8679 {"}'S' green -13.9854 -0.2007 -7.6928 {"}'S' green -13.857 -0.3015 -7.4977 {"}'S' green -13.7097 -0.3445 -7.2951 {"}'S' green -13.5516 -0.3268 -7.0966 {"}'S' sea -13.9163 0.242 -8.0941 {"}'S' green -13.8519 0.0331 -7.9515 {"}'S' green -13.7482 -0.1256 -7.7736 {"}'S' green -13.6133 -0.2205 -7.5727 {"}'S' green -13.2943 -0.1957 -7.1679 {"}'S' green -13.6137 0.14 -7.9818 {"}'S' green -13.5111 -0.0128 -7.8068 {"}'S' green -13.0615 0.0184 -7.2335 {"}'S' green -13.3562 0.2101 -7.8989 {"}'S' green -13.0592 0.136 -7.4949 {"}'S' green -12.9086 0.2899 -7.3429 {"}'S' green -13.0978 0.3329 -7.7429 {"}'S' sea -12.9374 0.4306 -7.5631 {HG21 VAL 868 A}'S' sea -12.867 0.4442 -8.7618 {"}'S' green -12.7076 0.4746 -8.5646 {"}'S' sea -12.5492 0.5612 -8.3832 {"}'S' sea -12.7172 0.3741 -8.9803 {"}'S' green -12.5617 0.3861 -8.7824 {"}'S' green -12.4031 0.4506 -8.5957 {"}'S' sea -12.2501 0.5667 -8.4303 {"}'S' sea -12.4608 0.3574 -9.0755 {"}'S' green -12.3015 0.3878 -8.8783 {"}'S' sea -12.1435 0.4736 -8.6973 {"}'S' sea -12.1391 0.42 -9.0875 {"}'S' sea -11.9814 0.496 -8.9047 {"}'S' sea -11.8818 0.551 -9.1588 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG1 VAL 868 A}'S' P -12.9691 0.0352 -6.6839 {"}'S' -12.9728 0.0456 -6.6828 {"}'S' P -12.8077 0.0941 -6.4921 {"}'S' -12.8104 0.0993 -6.4918 { HB VAL 868 A}'S' P -12.0115 0.1619 -6.7283 {"}'S' -11.9996 0.1878 -6.73 {"}'S' P -11.8595 0.1361 -6.525 {"}'S' -11.8533 0.1552 -6.5294 {"}'S' P -11.8571 0.1077 -6.9458 {"}'S' -11.8464 0.1435 -6.9411 {"}'S' P -11.7098 0.066 -6.7435 {"}'S' -11.7035 0.1085 -6.7464 {"}'S' P -11.5543 0.078 -6.5457 {"}'S' -11.5541 0.0822 -6.5465 {"}'S' P -11.6058 0.0743 -7.0425 {"}'S' -11.605 0.0854 -7.0405 {"}'S' P -11.4534 0.0493 -6.8387 {"}'S' -11.4541 0.0522 -6.8387 {"}'S' P -11.294 0.0798 -6.6415 {"}'S' -11.2951 0.0847 -6.6424 {HG11 VAL 868 A}'S' P -13.3938 -0.2507 -6.9138 {"}'S' -13.3969 -0.245 -6.9142 {"}'S' P -13.2434 -0.1193 -6.7553 {"}'S' -13.2478 -0.1145 -6.7572 {"}'S' P -13.4575 -0.2447 -7.3645 {"}'S' -13.4616 -0.2348 -7.3621 {"}'S' P -13.137 -0.0774 -6.9971 {"}'S' -13.1449 -0.0686 -6.9979 {"}'S' P -13.3739 -0.0878 -7.6073 {"}'S' -13.3876 -0.066 -7.5934 {"}'S' P -13.2176 -0.077 -7.4081 {"}'S' -13.2363 -0.0547 -7.3994 {"}'S' P -13.2228 0.1074 -7.6982 {"}'S' -13.2271 0.1104 -7.6945 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR1016 A}'M' greentint -9.3503 2.4496 -5.9664 {"}'M' greentint -9.5136 2.4162 -6.1683 {"}'M' greentint -9.6622 2.2593 -6.3168 {"}'M' greentint -9.7659 2.1629 -6.6143 {"}'M' greentint -9.2064 2.6547 -6.0285 {"}'M' greentint -9.3644 2.6463 -6.2305 {"}'M' greentint -9.523 2.5532 -6.4089 {"}'M' greentint -9.6622 2.3852 -6.542 {"}'M' greentint -9.7355 2.2569 -6.8591 {"}'M' greentint -9.0213 2.8248 -6.0944 {"}'M' greentint -9.1774 2.8355 -6.2983 {"}'M' greentint -9.3376 2.7772 -6.4903 {"}'M' greentint -9.4924 2.6541 -6.655 {"}'M' greentint -9.6281 2.4766 -6.7811 {"}'M' greentint -9.6576 2.3371 -7.0973 {"}'M' greentint -8.9341 2.9789 -6.3404 {"}'M' greentint -9.0942 2.9548 -6.5417 {"}'M' greentint -9.2567 2.8733 -6.7281 {"}'M' greentint -9.409 2.7373 -6.888 {"}'M' greentint -9.5456 2.5557 -7.0128 {"}'M' greentint -9.5431 2.3819 -7.327 {"}'M' greentint -8.8407 3.0694 -6.6092 {"}'M' greentint -8.9998 3.0183 -6.8014 {"}'M' greentint -9.1556 2.9195 -6.9747 {"}'M' greentint -9.3018 2.776 -7.1246 {"}'M' greentint -9.4326 2.594 -7.243 {"}'M' greentint -8.843 3.0527 -7.0068 {"}'M' greentint -8.9999 2.9468 -7.1799 {"}'M' greentint -9.1466 2.7997 -7.3297 {"}'M' greentint -9.2786 2.6167 -7.4497 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 868 A}'M' greentint -9.6451 2.0837 -6.3712 {"}'M' greentint -9.4902 2.1808 -6.1988 {"}'M' greentint -9.3489 2.3316 -6.0572 {"}'M' greentint -9.2283 2.5259 -5.9554 {"}'M' greentint -9.6887 2.0443 -6.8457 {"}'M' greentint -9.5344 2.0436 -6.6466 {"}'M' greentint -9.3762 2.1073 -6.4603 {"}'M' greentint -9.226 2.2318 -6.3004 {"}'M' greentint -9.0929 2.4074 -6.1774 {"}'M' greentint -8.9876 2.622 -6.0996 {"}'M' greentint -8.9141 2.8618 -6.0727 {"}'M' greentint -9.6252 2.1756 -7.2007 {"}'M' greentint -9.4838 2.1026 -6.9976 {"}'M' greentint -9.3256 2.1048 -6.7939 {"}'M' greentint -9.165 2.1808 -6.607 {"}'M' greentint -9.0155 2.3262 -6.4546 {"}'M' greentint -8.8909 2.5261 -6.3488 {"}'M' greentint -8.8023 2.7637 -6.3007 {"}'M' greentint -8.7578 3.0184 -6.3134 {"}'M' greentint -9.3807 2.2653 -7.2526 {"}'M' greentint -9.232 2.2156 -7.0465 {"}'M' greentint -9.0696 2.2606 -6.8486 {"}'M' greentint -8.9154 2.3932 -6.6869 {"}'M' greentint -8.7911 2.5965 -6.5823 {"}'M' greentint -8.7129 2.8422 -6.5501 {"}'M' greentint -8.6919 3.0976 -6.5934 {"}'M' greentint -9.2527 2.5009 -7.4151 {"}'M' greentint -9.121 2.3991 -7.217 {"}'M' greentint -8.96 2.4272 -7.017 {"}'M' greentint -8.8119 2.5791 -6.8681 {"}'M' greentint -8.7171 2.8132 -6.8108 {"}'M' greentint -8.7008 3.0669 -6.8601 {"}'M' greentint -8.9875 2.617 -7.2705 {"}'M' greentint -8.8275 2.7139 -7.0911 {"}'M' greentint -8.7725 2.9672 -7.0909 {"}'M' greentint -8.9058 2.8635 -7.2903 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR1016 A}'M' greentint -9.9839 0.9482 -4.2083 {"}'M' greentint -10.1171 0.8446 -4.4078 {"}'M' greentint -9.798 1.0396 -4.0503 {"}'M' greentint -9.9022 1.1948 -4.2282 {"}'M' greentint -10.0622 1.0979 -4.4076 {"}'M' greentint -10.1726 0.9985 -4.6879 {"}'M' greentint -9.637 1.3109 -4.0835 {"}'M' greentint -9.7687 1.4126 -4.2817 {"}'M' greentint -9.9297 1.3845 -4.4817 {"}'M' greentint -10.0778 1.2326 -4.6305 {"}'M' greentint -10.1443 1.0959 -4.9415 {"}'M' greentint -9.4454 1.4876 -4.1474 {"}'M' greentint -9.5803 1.5825 -4.3483 {"}'M' greentint -9.7392 1.5856 -4.5542 {"}'M' greentint -9.8994 1.4946 -4.7371 {"}'M' greentint -10.0409 1.324 -4.8727 {"}'M' greentint -10.0474 1.1702 -5.1815 {"}'M' greentint -9.3318 1.6817 -4.3987 {"}'M' greentint -9.4834 1.7172 -4.6038 {"}'M' greentint -9.6448 1.678 -4.8017 {"}'M' greentint -9.8014 1.566 -4.9731 {"}'M' greentint -9.9399 1.3912 -5.1038 {"}'M' greentint -9.3553 1.7681 -4.8521 {"}'M' greentint -9.5135 1.7044 -5.0384 {"}'M' greentint -9.6637 1.5799 -5.1982 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 868 A}'M' green -10.1433 0.7804 -4.4426 {"}'M' green -10.1976 0.8634 -4.8998 {"}'M' green -10.1141 1.0413 -5.1577 {"}'M' green -9.6005 1.6139 -5.2187 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 868 A}'M' greentint -9.9852 0.8545 -4.2588 {"}'M' greentint -9.8334 0.9751 -4.096 {"}'M' greentint -10.0405 0.8588 -4.6942 {"}'M' greentint -9.8778 0.9145 -4.5 {"}'M' greentint -9.72 1.0248 -4.3266 {"}'M' greentint -9.5747 1.1865 -4.1836 {"}'M' greentint -9.45 1.3889 -4.08 {"}'M' greentint -9.9661 0.9942 -4.9533 {"}'M' greentint -9.8069 1.0167 -4.7528 {"}'M' greentint -9.6472 1.1053 -4.5718 {"}'M' greentint -9.5005 1.2549 -4.4242 {"}'M' greentint -9.3768 1.4546 -4.3195 {"}'M' greentint -9.8475 1.1762 -5.1078 {"}'M' greentint -9.6886 1.1872 -4.9069 {"}'M' greentint -9.5316 1.2831 -4.7295 {"}'M' greentint -9.3931 1.4536 -4.598 {"}'M' greentint -9.2902 1.6771 -4.5271 {"}'M' greentint -9.7131 1.384 -5.1835 {"}'M' greentint -9.55 1.4132 -4.9809 {"}'M' greentint -9.4002 1.567 -4.8301 {"}'M' greentint -9.4418 1.7112 -5.0411 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 125 1jz7A_127F_182}P -12.2044 -2.4974 -0.3545 {"}-12.2044 -2.4974 -0.3545 { ca leu A 125 1jz7A_127F_182}-10.8597 -2.4026 -0.8435 { c leu A 125 1jz7A_127F_182}-10.7247 -1.1219 -1.6621 { o leu A 125 1jz7A_127F_182}-11.6437 -0.8261 -2.4628 { c leu A 125 1jz7A_127F_182}P -10.7247 -1.1219 -1.6621 { n thr A 126 1jz7A_127F_182}-9.5752 -0.4366 -1.4402 { ca thr A 126 1jz7A_127F_182}-9.31 0.7475 -2.2162 { c thr A 126 1jz7A_127F_182}-8.2327 0.2711 -3.0804 { o thr A 126 1jz7A_127F_182}-7.2544 -0.2778 -2.6006 { c thr A 126 1jz7A_127F_182}P -8.2327 0.2711 -3.0804 { n phe A 127 1jz7A_127F_182}-8.443 0.4387 -4.4024 { ca phe A 127 1jz7A_127F_182}-7.5232 -0.1102 -5.3695 { c phe A 127 1jz7A_127F_182}-7.4494 0.8085 -6.5856 { o phe A 127 1jz7A_127F_182}-8.3054 1.6936 -6.806 { c phe A 127 1jz7A_127F_182}P -7.4494 0.8085 -6.5856 { n asn A 128 1jz7A_127F_182}-6.3377 0.5156 -7.2996 { ca asn A 128 1jz7A_127F_182}-5.9888 1.2755 -8.476 { c asn A 128 1jz7A_127F_182}-6.4859 0.7208 -9.7858 { o asn A 128 1jz7A_127F_182}-6.4389 -0.5 -9.9573 { c asn A 128 1jz7A_127F_182}P -6.4859 0.7208 -9.7858 { n val A 129 1jz7A_127F_182}-6.8325 1.6231 -10.7031 { ca val A 129 1jz7A_127F_182}-7.1954 1.258 -12.064 { c val A 129 1jz7A_127F_182}-6.4811 2.26 -12.9501 { o val A 129 1jz7A_127F_182}-6.6284 3.4801 -12.8438 { n gly A 180 1jz7A_127F_182}P -7.2098 5.7845 -11.4833 {"}-7.2098 5.7845 -11.4833 { ca gly A 180 1jz7A_127F_182}-6.5769 5.8446 -10.1449 { c gly A 180 1jz7A_127F_182}-7.3311 5.1119 -9.0656 { o gly A 180 1jz7A_127F_182}-7.7365 4.0001 -9.3471 { c gly A 180 1jz7A_127F_182}P -7.3311 5.1119 -9.0656 { n glu A 181 1jz7A_127F_182}-7.5897 5.75 -7.9482 { ca glu A 181 1jz7A_127F_182}-8.2523 5.074 -6.818 { c glu A 181 1jz7A_127F_182}-9.7361 4.8232 -6.9552 { o glu A 181 1jz7A_127F_182}-10.537 5.7062 -7.3389 { c glu A 181 1jz7A_127F_182}P -9.7361 4.8232 -6.9552 { n asn A 182 1jz7A_127F_182}-10.0901 3.5731 -6.588 { ca asn A 182 1jz7A_127F_182}-11.5019 3.2237 -6.6112 { c asn A 182 1jz7A_127F_182}-11.7436 2.3945 -5.3202 { o asn A 182 1jz7A_127F_182}-10.7456 1.8561 -4.7629 { c asn A 182 1jz7A_127F_182}P -11.7436 2.3945 -5.3202 { n arg A 183 1jz7A_127F_182}-13.01 2.3184 -4.9028 { ca arg A 183 1jz7A_127F_182}-13.2827 1.5469 -3.6811 { c arg A 183 1jz7A_127F_182}-14.4208 0.549 -3.8792 { o arg A 183 1jz7A_127F_182}-15.54 0.912 -4.2443 { c arg A 183 1jz7A_127F_182}P -14.4208 0.549 -3.8792 { n leu A 184 1jz7A_127F_182}-14.1449 -0.6983 -3.5609 { ca leu A 184 1jz7A_127F_182}-15.1891 -1.7086 -3.6348 { c leu A 184 1jz7A_127F_182}-15.8169 -1.7989 -2.249 { o leu A 184 1jz7A_127F_182}-15.0481 -1.7131 -1.2913 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 125 1jz7A_127F_182}P -12.2044 -2.4974 -0.3545 { ca leu A 125 1jz7A_127F_182}P -10.8597 -2.4026 -0.8435 { n thr A 126 1jz7A_127F_182}P -9.5752 -0.4366 -1.4402 { ca thr A 126 1jz7A_127F_182}P -9.31 0.7475 -2.2162 { n phe A 127 1jz7A_127F_182}P -8.443 0.4387 -4.4024 { ca phe A 127 1jz7A_127F_182}P -7.5232 -0.1102 -5.3695 { n asn A 128 1jz7A_127F_182}P -6.3377 0.5156 -7.2996 { ca asn A 128 1jz7A_127F_182}P -5.9888 1.2755 -8.476 { n val A 129 1jz7A_127F_182}P -6.8325 1.6231 -10.7031 { ca val A 129 1jz7A_127F_182}P -7.1954 1.258 -12.064 { n gly A 180 1jz7A_127F_182}P -7.2098 5.7845 -11.4833 { ca gly A 180 1jz7A_127F_182}P -6.5769 5.8446 -10.1449 {"}P -6.5769 5.8446 -10.1449 { n glu A 181 1jz7A_127F_182}P -7.5897 5.75 -7.9482 { ca glu A 181 1jz7A_127F_182}P -8.2523 5.074 -6.818 { n asn A 182 1jz7A_127F_182}P -10.0901 3.5731 -6.588 { ca asn A 182 1jz7A_127F_182}P -11.5019 3.2237 -6.6112 { n arg A 183 1jz7A_127F_182}P -13.01 2.3184 -4.9028 { ca arg A 183 1jz7A_127F_182}P -13.2827 1.5469 -3.6811 { n leu A 184 1jz7A_127F_182}P -14.1449 -0.6983 -3.5609 { ca leu A 184 1jz7A_127F_182}P -15.1891 -1.7086 -3.6348 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 125 1jz7A_127F_182}P -10.8597 -2.4026 -0.8435 {"}-10.8597 -2.4026 -0.8435 { ca thr A 126 1jz7A_127F_182}-9.31 0.7475 -2.2162 { ca phe A 127 1jz7A_127F_182}-7.5232 -0.1102 -5.3695 { ca asn A 128 1jz7A_127F_182}-5.9888 1.2755 -8.476 { ca val A 129 1jz7A_127F_182}-7.1954 1.258 -12.064 { ca gly A 180 1jz7A_127F_182}P -6.5769 5.8446 -10.1449 {"}-6.5769 5.8446 -10.1449 { ca glu A 181 1jz7A_127F_182}-8.2523 5.074 -6.818 { ca asn A 182 1jz7A_127F_182}-11.5019 3.2237 -6.6112 { ca arg A 183 1jz7A_127F_182}-13.2827 1.5469 -3.6811 { ca leu A 184 1jz7A_127F_182}-15.1891 -1.7086 -3.6348 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 127 1jz7A_127F_182}P -7.5232 -0.1102 -5.3695 { cb phe A 127 1jz7A_127F_182}-7.8934 -1.5585 -5.8679 { cg phe A 127 1jz7A_127F_182}-9.2302 -1.5332 -6.5525 { cd1 phe A 127 1jz7A_127F_182}-9.2856 -1.6819 -7.9322 { ce1 phe A 127 1jz7A_127F_182}-10.5141 -1.6375 -8.5911 { cz phe A 127 1jz7A_127F_182}-11.7229 -1.4042 -7.9331 { cg phe A 127 1jz7A_127F_182}P -9.2302 -1.5332 -6.5525 { cd2 phe A 127 1jz7A_127F_182}-10.435 -1.3038 -5.8916 { ce2 phe A 127 1jz7A_127F_182}-11.6657 -1.2284 -6.5468 { cz phe A 127 1jz7A_127F_182}ghost -11.7229 -1.4042 -7.9331 { ca asn A 182 1jz7A_127F_182}P -11.5019 3.2237 -6.6112 { cb asn A 182 1jz7A_127F_182}-11.8665 2.3598 -7.8419 { cg asn A 182 1jz7A_127F_182}-11.7995 3.1557 -9.1452 { od1 asn A 182 1jz7A_127F_182}-12.8009 3.6237 -9.6603 { cg asn A 182 1jz7A_127F_182}P -11.7995 3.1557 -9.1452 { nd2 asn A 182 1jz7A_127F_182}-10.5745 3.2135 -9.6544 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 127 1jz7A_127F_182}P -7.8934 -1.5585 -5.8679 {"}P -7.8934 -1.5585 -5.8679 { cd1 phe A 127 1jz7A_127F_182}P -9.2856 -1.6819 -7.9322 { cd2 phe A 127 1jz7A_127F_182}P -10.435 -1.3038 -5.8916 { ce1 phe A 127 1jz7A_127F_182}P -10.5141 -1.6375 -8.5911 { ce2 phe A 127 1jz7A_127F_182}P -11.6657 -1.2284 -6.5468 { cz phe A 127 1jz7A_127F_182}P -11.7229 -1.4042 -7.9331 { cb asn A 182 1jz7A_127F_182}P -11.8665 2.3598 -7.8419 {"}P -11.8665 2.3598 -7.8419 { nd2 asn A 182 1jz7A_127F_182}P -10.5745 3.2135 -9.6544 {"}P -10.5745 3.2135 -9.6544 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 127 A}'S' blue -10.6166 0.0485 -8.1334 {"}'S' blue -10.7685 0.0757 -8.337 {"}'S' blue -10.9262 0.0626 -8.5375 { CE2 PHE 127 A}'S' blue -11.8945 0.5019 -6.6786 {"}'S' blue -12.0584 0.4452 -6.8743 {"}'S' blue -12.2196 0.3515 -7.056 {"}'S' blue -11.554 0.5137 -6.6705 {"}'S' blue -11.7162 0.4903 -6.873 {"}'S' sky -11.8798 0.4288 -7.0672 {"}'S' blue -12.0406 0.3303 -7.2475 {"}'S' sky -11.3455 0.4705 -6.8216 {"}'S' sky -11.8317 0.2904 -7.4005 {"}'S' sky -11.1304 0.3883 -6.9498 {"}'S' sky -10.9185 0.2698 -7.0569 {"}'S' blue -10.8434 0.115 -7.3085 { CZ PHE 127 A}'S' blue -12.104 0.2281 -7.4287 {"}'S' blue -12.2599 0.2337 -7.6328 {"}'S' sky -11.8254 0.2818 -7.4755 {"}'S' sky -11.9773 0.309 -7.679 {"}'S' sky -12.135 0.2958 -7.8795 {"}'S' blue -12.2958 0.2433 -8.072 {"}'S' blue -12.1157 0.2694 -8.2607 {"}'S' blue -11.937 0.253 -8.4536 {"}'S' sky -10.9594 0.1328 -7.5906 {"}'S' blue -10.7494 0.0339 -7.7202 {"}'S' sky -11.3493 0.1937 -8.5408 {"}'S' sky -10.8239 0.0655 -8.2394 {"}'S' blue -10.9758 0.094 -8.4433 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 127 A}'S' sea -11.5073 0.4475 -7.0255 {"}'S' sea -11.6704 0.3869 -7.2193 {"}'S' sea -11.2921 0.3695 -7.1544 {"}'S' sea -11.4556 0.3122 -7.3494 {"}'S' sea -11.0762 0.2581 -7.2577 {"}'S' sea -11.2362 0.2068 -7.451 { CZ PHE 127 A}'S' green -11.6336 0.3206 -7.6527 {"}'S' green -11.7902 0.3435 -7.8601 {"}'S' sea -11.9518 0.3261 -8.065 {"}'S' green -11.3053 0.2706 -7.642 {"}'S' green -11.4544 0.3236 -7.8494 {"}'S' green -11.6113 0.3379 -8.0568 {"}'S' sea -11.7734 0.3145 -8.2594 {"}'S' green -11.0965 0.2237 -7.7937 {"}'S' green -11.2451 0.2775 -8.0006 {"}'S' green -11.4028 0.2947 -8.208 {"}'S' sea -11.5645 0.2717 -8.4118 {"}'S' sea -10.8842 0.1315 -7.9216 {"}'S' sea -11.0318 0.191 -8.1285 {"}'S' sea -11.1877 0.2125 -8.3361 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ASN 182 A}'S' blue -12.1634 0.7837 -7.1412 {"}'S' blue -11.9999 0.8593 -6.952 {"}'S' blue -12.3393 0.6764 -7.7672 {"}'S' blue -12.1816 0.6619 -7.5603 {"}'S' blue -12.0195 0.6854 -7.3578 {"}'S' sky -11.8567 0.747 -7.163 {"}'S' blue -11.6963 0.8447 -6.9831 {"}'S' blue -12.2888 0.6874 -8.1398 {"}'S' sky -12.1401 0.6336 -7.9329 {"}'S' sky -11.9828 0.6173 -7.7245 {"}'S' blue -12.0259 0.6589 -8.22 { HB2 ASN 182 A}'S' sky -11.8965 0.5914 -7.7338 {"}'S' sky -11.2829 0.7736 -6.9914 {"}'S' sky -11.0603 0.6732 -7.0846 {"}'S' sky -11.7644 0.6269 -8.4142 {"}'S' sky -10.9105 0.5428 -7.2877 {"}'S' sky -11.5264 0.5716 -8.5222 {"}'S' blue -10.8039 0.4497 -7.5547 {"}'S' sky -11.2334 0.5221 -8.5411 {"}'S' sky -10.7995 0.3961 -7.9449 {"}'S' blue -10.8613 0.5024 -8.421 {"}'S' blue -10.7055 0.4781 -8.2128 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ASN 182 A}'S' sea -11.7492 0.5484 -7.5312 {"}'S' sea -11.5918 0.5663 -7.3322 {"}'S' sea -11.4337 0.6431 -7.1489 {"}'S' sea -11.8167 0.5275 -8.022 {"}'S' green -11.6793 0.446 -7.8225 {"}'S' green -11.5274 0.4203 -7.6192 {"}'S' sea -11.368 0.4507 -7.422 {"}'S' sea -11.2096 0.5373 -7.2406 {"}'S' sea -11.6556 0.4863 -8.2351 {"}'S' green -11.5249 0.3919 -8.04 {"}'S' green -11.3776 0.3502 -7.8377 {"}'S' green -11.2221 0.3622 -7.6399 {"}'S' sea -11.0635 0.4267 -7.4531 {"}'S' sea -11.4102 0.4398 -8.3367 {"}'S' green -11.2736 0.3585 -8.1366 {"}'S' green -11.1212 0.3335 -7.9329 {"}'S' sea -10.9619 0.3639 -7.7357 {"}'S' sea -11.105 0.4213 -8.346 {"}'S' sea -10.9577 0.3783 -8.1434 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O PHE 127 A}'M' P -9.2296 2.6041 -6.281 {"}'M' -9.2096 2.5849 -6.292 {"}'M' P -9.3882 2.511 -6.4594 {"}'M' -9.3814 2.5068 -6.4612 {"}'M' P -9.2028 2.735 -6.5408 {"}'M' -9.1958 2.7258 -6.5428 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 127 A}'M' greentint -9.3973 1.9286 -5.9612 {"}'M' greentint -9.3186 2.1748 -5.968 {"}'M' greentint -9.4775 2.0861 -6.1496 {"}'M' greentint -9.6211 1.9783 -6.4221 {"}'M' greentint -9.0812 2.3075 -5.8157 {"}'M' greentint -9.2156 2.4073 -6.017 {"}'M' greentint -9.3788 2.374 -6.2188 {"}'M' greentint -9.5274 2.2171 -6.3673 {"}'M' greentint -9.6312 2.1207 -6.6648 {"}'M' greentint -8.8321 2.3777 -5.7031 {"}'M' greentint -8.9338 2.5332 -5.8793 {"}'M' greentint -9.0716 2.6125 -6.079 {"}'M' greentint -9.5274 2.343 -6.5926 {"}'M' greentint -9.6008 2.2147 -6.9096 {"}'M' greentint -8.7474 2.7042 -5.9438 {"}'M' greentint -8.8865 2.7826 -6.145 {"}'M' greentint -9.0426 2.7932 -6.3488 {"}'M' greentint -9.3576 2.6119 -6.7055 {"}'M' greentint -9.4933 2.4344 -6.8317 {"}'M' greentint -8.6465 2.9007 -6.184 {"}'M' greentint -8.7994 2.9366 -6.3909 {"}'M' greentint -8.9599 2.9132 -6.5929 {"}'M' greentint -9.1219 2.831 -6.7786 {"}'M' greentint -9.2742 2.6951 -6.9386 {"}'M' greentint -8.5507 3.028 -6.4598 {"}'M' greentint -8.7059 3.0272 -6.6597 {"}'M' greentint -8.865 2.9761 -6.8519 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H ASN 182 A}'M' P -9.0103 2.0342 -6.6543 {"}'M' -9.0107 2.0351 -6.6533 {"}'M' P -8.848 2.0791 -6.4564 {"}'M' -8.8628 2.0977 -6.4518 {"}'M' P -8.8993 2.2177 -6.8248 {"}'M' -8.9017 2.2194 -6.8233 {"}'M' P -8.7383 2.2457 -6.6248 {"}'M' -8.7655 2.2683 -6.6124 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ASN 182 A}'M' greentint -9.607 1.9279 -6.6528 {"}'M' greentint -9.4671 1.8629 -6.4535 {"}'M' greentint -9.3128 1.8621 -6.2544 {"}'M' greentint -9.1546 1.9258 -6.0681 {"}'M' greentint -9.0044 2.0503 -5.9082 {"}'M' greentint -8.8712 2.2259 -5.7852 {"}'M' greentint -9.5161 2.1361 -6.993 {"}'M' greentint -9.4036 1.9941 -6.8085 {"}'M' greentint -9.2622 1.9211 -6.6054 {"}'M' greentint -9.104 1.9233 -6.4017 {"}'M' greentint -8.9433 1.9993 -6.2148 {"}'M' greentint -8.7938 2.1447 -6.0624 {"}'M' greentint -8.6692 2.3446 -5.9566 {"}'M' greentint -8.5807 2.5822 -5.9085 {"}'M' greentint -9.2751 2.2208 -7.0486 {"}'M' greentint -9.1591 2.0838 -6.8604 {"}'M' greentint -8.6938 2.2117 -6.2947 {"}'M' greentint -8.5695 2.415 -6.1901 {"}'M' greentint -8.4912 2.6607 -6.1579 {"}'M' greentint -8.4702 2.9161 -6.2012 {"}'M' greentint -9.0977 2.5247 -7.166 {"}'M' greentint -9.0311 2.3194 -7.0229 {"}'M' greentint -8.5903 2.3977 -6.4759 {"}'M' greentint -8.4955 2.6318 -6.4186 {"}'M' greentint -8.4792 2.8855 -6.4679 {"}'M' greentint -8.87 2.5907 -7.0561 {"}'M' greentint -8.7658 2.4355 -6.8783 {"}'M' greentint -8.6059 2.5324 -6.6989 {"}'M' greentint -8.5509 2.7857 -6.6987 {"}'M' greentint -8.6551 2.9409 -6.8765 {"}'M' greentint -8.6842 2.6821 -6.8981 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H PHE 127 A}'M' P -10.0558 1.4776 -4.8547 {"}'M' -10.053 1.4755 -4.8538 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 127 A}'M' greentint -9.9988 1.1018 -4.1903 {"}'M' greentint -10.1321 0.9981 -4.3898 {"}'M' greentint -10.0279 0.8429 -4.212 {"}'M' greentint -9.813 1.1931 -4.0324 {"}'M' greentint -9.9172 1.3483 -4.2102 {"}'M' greentint -10.0771 1.2514 -4.3896 {"}'M' greentint -10.1875 1.152 -4.6699 {"}'M' greentint -10.2038 0.8983 -4.6206 {"}'M' greentint -10.1372 0.693 -4.4775 {"}'M' greentint -9.6519 1.4644 -4.0656 {"}'M' greentint -9.7837 1.5662 -4.2637 {"}'M' greentint -9.9447 1.5381 -4.4637 {"}'M' greentint -10.0927 1.3862 -4.6126 {"}'M' greentint -10.1592 1.2495 -4.9235 {"}'M' greentint -10.2097 0.9948 -4.9189 {"}'M' greentint -10.201 0.747 -4.8385 {"}'M' greentint -9.5953 1.736 -4.3304 {"}'M' greentint -9.7541 1.7392 -4.5363 {"}'M' greentint -9.9144 1.6481 -4.7191 {"}'M' greentint -10.0624 1.3238 -5.1635 {"}'M' greentint -10.1307 1.0748 -5.1812 {"}'M' greentint -10.1512 0.8215 -5.1377 {"}'M' greentint -9.4984 1.8707 -4.5858 {"}'M' greentint -9.6597 1.8316 -4.7837 {"}'M' greentint -9.8163 1.7195 -4.9551 {"}'M' greentint -9.9549 1.5448 -5.0858 {"}'M' greentint -9.917 1.3433 -5.3811 {"}'M' greentint -9.9905 1.1035 -5.408 {"}'M' greentint -10.0235 0.8544 -5.3826 {"}'M' greentint -9.3702 1.9217 -4.8341 {"}'M' greentint -9.5284 1.858 -5.0204 {"}'M' greentint -9.6786 1.7335 -5.1803 {"}'M' greentint -9.8118 1.5579 -5.3033 {"}'M' greentint -9.7273 1.3293 -5.5595 {"}'M' greentint -9.4874 1.7154 -5.3574 {"}'M' greentint -9.6197 1.5414 -5.4796 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ASN 182 A}'M' greentint -10.1122 0.6139 -4.6338 {"}'M' greentint -9.9604 0.7345 -4.4709 {"}'M' greentint -9.8201 0.8965 -4.3349 {"}'M' greentint -9.6981 1.0931 -4.2319 {"}'M' greentint -9.5997 1.318 -4.1659 {"}'M' greentint -9.5271 1.559 -4.1403 {"}'M' greentint -10.0048 0.674 -4.8749 {"}'M' greentint -9.847 0.7842 -4.7015 {"}'M' greentint -9.7016 0.9459 -4.5585 {"}'M' greentint -9.577 1.1483 -4.4549 {"}'M' greentint -9.4805 1.3814 -4.3951 {"}'M' greentint -9.4168 1.6332 -4.3825 {"}'M' greentint -9.9339 0.7761 -5.1277 {"}'M' greentint -9.7741 0.8647 -4.9467 {"}'M' greentint -9.6274 1.0143 -4.7991 {"}'M' greentint -9.5037 1.214 -4.6944 {"}'M' greentint -9.4118 1.4482 -4.6411 {"}'M' greentint -9.3599 1.6991 -4.6427 {"}'M' greentint -9.8156 0.9466 -5.2818 {"}'M' greentint -9.6586 1.0425 -5.1044 {"}'M' greentint -9.5201 1.213 -4.9729 {"}'M' greentint -9.4172 1.4365 -4.902 {"}'M' greentint -9.3627 1.6862 -4.9017 {"}'M' greentint -9.6769 1.1727 -5.3558 {"}'M' greentint -9.5272 1.3264 -5.205 {"}'M' greentint -9.4319 1.5627 -5.1475 {"}'M' greentint -9.4155 1.8192 -5.1973 {"}'M' greentint -9.5687 1.4706 -5.416 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 66 1keqA_93F_68V}P -5.8065 6.8882 -10.3863 {"}-5.8065 6.8882 -10.3863 { ca phe A 66 1keqA_93F_68V}-7.1527 7.157 -9.8969 { c phe A 66 1keqA_93F_68V}-7.534 5.8909 -9.1534 { o phe A 66 1keqA_93F_68V}-7.1603 4.7789 -9.5491 { c phe A 66 1keqA_93F_68V}P -7.534 5.8909 -9.1534 { n gln A 67 1keqA_93F_68V}-8.2635 6.0704 -8.0587 { ca gln A 67 1keqA_93F_68V}-8.5723 4.9692 -7.1631 { c gln A 67 1keqA_93F_68V}-9.9886 4.9994 -6.6057 { o gln A 67 1keqA_93F_68V}-10.5329 6.0689 -6.3053 { c gln A 67 1keqA_93F_68V}P -9.9886 4.9994 -6.6057 { n val A 68 1keqA_93F_68V}-10.5672 3.817 -6.4482 { ca val A 68 1keqA_93F_68V}-11.917 3.6686 -5.9232 { c val A 68 1keqA_93F_68V}-11.8141 3.1054 -4.5091 { o val A 68 1keqA_93F_68V}-11.2217 2.0498 -4.2975 { c val A 68 1keqA_93F_68V}P -11.8141 3.1054 -4.5091 { n glu A 69 1keqA_93F_68V}-12.4016 3.815 -3.5516 { ca glu A 69 1keqA_93F_68V}-12.337 3.4224 -2.1432 { c glu A 69 1keqA_93F_68V}-13.6167 2.7802 -1.649 { o glu A 69 1keqA_93F_68V}-14.7205 3.1882 -2.0289 { c glu A 69 1keqA_93F_68V}P -13.6167 2.7802 -1.649 { n phe A 70 1keqA_93F_68V}-13.4608 1.7875 -0.7787 { ca phe A 70 1keqA_93F_68V}-14.5949 1.0774 -0.21 { c phe A 70 1keqA_93F_68V}-14.6186 1.1609 1.3158 { o phe A 70 1keqA_93F_68V}-13.6032 1.4372 1.9586 { n lys A 91 1keqA_93F_68V}P -10.3448 -3.1135 0.1524 {"}-10.3448 -3.1135 0.1524 { ca lys A 91 1keqA_93F_68V}-10.2132 -1.7424 0.6362 { c lys A 91 1keqA_93F_68V}-10.3289 -0.7594 -0.5273 { o lys A 91 1keqA_93F_68V}-11.0504 0.2382 -0.444 { c lys A 91 1keqA_93F_68V}P -10.3289 -0.7594 -0.5273 { n gln A 92 1keqA_93F_68V}-9.6125 -1.0432 -1.6125 { ca gln A 92 1keqA_93F_68V}-9.6303 -0.1715 -2.7826 { c gln A 92 1keqA_93F_68V}-9.069 -0.8712 -4.0122 { o gln A 92 1keqA_93F_68V}-8.5179 -1.9711 -3.9239 { c gln A 92 1keqA_93F_68V}P -9.069 -0.8712 -4.0122 { n phe A 93 1keqA_93F_68V}-9.2437 -0.2347 -5.1635 { ca phe A 93 1keqA_93F_68V}-8.6652 -0.7491 -6.3967 { c phe A 93 1keqA_93F_68V}-8.2768 0.4659 -7.2266 { o phe A 93 1keqA_93F_68V}-8.9024 1.5223 -7.1265 { c phe A 93 1keqA_93F_68V}P -8.2768 0.4659 -7.2266 { n his A 94 1keqA_93F_68V}-7.2133 0.335 -8.009 { ca his A 94 1keqA_93F_68V}-6.7322 1.4478 -8.817 { c his A 94 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-13.8181 1.5804 -8.9061 {"}'S' -13.8159 1.5731 -8.9066 {"}'S' P -12.6745 0.9937 -7.6552 {"}'S' -12.6753 0.9922 -7.656 {"}'S' P -13.2232 1.6647 -8.5515 {"}'S' -13.2212 1.6215 -8.5628 {"}'S' P -13.3751 1.6919 -8.7551 {"}'S' -13.3616 1.6034 -8.7676 {"}'S' P -13.5328 1.6787 -8.9556 {"}'S' -13.5135 1.597 -8.9584 {"}'S' P -13.6936 1.6262 -9.148 {"}'S' -13.6834 1.5984 -9.1449 {"}'S' P -12.8846 1.6427 -8.5211 {"}'S' -12.8862 1.6313 -8.5242 {"}'S' P -13.0313 1.7034 -8.7288 {"}'S' -13.0345 1.651 -8.7364 {"}'S' P -13.188 1.7264 -8.9361 {"}'S' -13.1838 1.6334 -8.9399 {"}'S' P -13.3495 1.709 -9.141 {"}'S' -13.3382 1.6278 -9.1343 {"}'S' P -13.5134 1.6523 -9.3367 {"}'S' -13.5079 1.6306 -9.3328 {"}'S' P -12.8521 1.7065 -8.9254 {"}'S' -12.8539 1.6899 -8.9258 {"}'S' P -13.009 1.7208 -9.1329 {"}'S' -13.0121 1.6768 -9.1304 {"}'S' P -13.1712 1.6974 -9.3354 {"}'S' -13.1707 1.6716 -9.3306 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 68 A}'S' sky -13.3625 1.0934 -6.9504 {"}'S' blue -13.2134 1.0404 -6.7431 {"}'S' sky -13.6115 1.6122 -7.8519 {"}'S' sky -13.5271 1.4264 -7.6906 {"}'S' sky -12.3346 1.6189 -8.1126 {"}'S' blue -12.0878 1.7159 -8.0913 { CG1 VAL 68 A}'S' sky -14.0226 0.8232 -6.6906 {"}'S' blue -13.8703 0.7954 -6.4863 {"}'S' sky -13.81 0.8937 -6.8262 {"}'S' sky -13.6568 0.8675 -6.6211 {"}'S' blue -13.4982 0.8836 -6.42 {"}'S' sky -13.7113 1.0478 -7.1007 {"}'S' sky -13.5649 0.989 -6.8939 {"}'S' sky -13.4071 0.9773 -6.6876 {"}'S' blue -13.7969 1.5875 -7.6792 {"}'S' blue -13.7141 1.4027 -7.5205 {"}'S' blue -13.6041 1.2591 -7.3373 {"}'S' sky -13.4714 1.1631 -7.1391 { CG2 VAL 68 A}'S' sky -13.6333 1.7731 -8.1354 {"}'S' sky -12.0785 1.7765 -8.2223 {"}'S' blue -11.8252 1.9344 -8.2967 {"}'S' blue -12.4558 2.2368 -9.5146 {"}'S' blue -11.7431 2.0336 -8.5369 {"}'S' sky -12.091 2.2054 -9.3045 {"}'S' sky -11.7914 2.1346 -8.8977 { HB VAL 68 A}'S' blue -12.1163 0.6752 -6.4351 {"}'S' blue -11.8567 0.6982 -6.5367 {"}'S' sky -11.6947 0.7206 -6.7441 {"}'S' sky -11.9141 0.7509 -7.403 {"}'S' sky -11.7584 0.7266 -7.1948 {"}'S' blue -11.5951 0.7756 -6.9982 {"}'S' sky -11.97 1.5667 -8.009 {"}'S' sky -11.8119 0.9585 -7.6371 {"}'S' blue -11.6748 0.8835 -7.4377 {"}'S' blue -11.5184 0.8943 -7.2384 {"}'S' sky -11.7249 1.3899 -7.8746 {"}'S' sky -11.657 1.1814 -7.7292 {"}'S' blue -11.5236 1.0787 -7.5286 {HG11 VAL 68 A}'S' blue -14.6206 0.751 -7.3171 {"}'S' sky -14.4734 0.7079 -7.1146 {"}'S' sky -14.3152 0.7257 -6.9161 {"}'S' blue -14.1575 0.8017 -6.7333 {"}'S' blue -14.5118 0.9269 -7.593 {"}'S' sky -14.3769 0.832 -7.3921 {"}'S' blue -14.3773 1.1925 -7.8013 {"}'S' sky -14.2747 1.0397 -7.6262 {"}'S' blue -14.1877 1.4711 -7.8637 {"}'S' sky -14.1198 1.2626 -7.7183 {"}'S' sky -13.9864 1.1599 -7.5177 {"}'S' blue -13.9665 1.5417 -7.7416 {"}'S' blue -13.8615 1.3854 -7.5624 {HG21 VAL 68 A}'S' sky -12.7393 2.0015 -9.5118 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 68 A}'S' sea -13.4221 1.2686 -7.5112 {"}'S' sea -13.3003 1.1432 -7.3177 {"}'S' sea -13.1628 1.0514 -7.1157 {"}'S' sea -13.3695 1.5459 -7.9485 {"}'S' green -13.2786 1.366 -7.7815 {"}'S' green -13.1688 1.2169 -7.5974 {"}'S' green -13.1172 1.5189 -8.0299 {"}'S' green -13.0244 1.3491 -7.8625 {"}'S' green -12.9126 1.2098 -7.6797 {"}'S' green -12.8089 1.4327 -7.9972 {"}'S' green -12.5737 1.5171 -8.0743 { CG2 VAL 68 A}'S' sea -13.3346 1.6582 -8.1452 {"}'S' green -13.1354 1.6154 -8.3108 {"}'S' green -12.8688 1.5999 -8.3907 {"}'S' green -12.7094 1.5992 -8.1829 {"}'S' green -12.612 1.6295 -8.4805 {"}'S' sea -12.4544 1.6412 -8.2797 {"}'S' green -12.5517 1.7277 -8.8203 {"}'S' green -12.3989 1.7007 -8.6157 {"}'S' sea -12.2399 1.7176 -8.4141 {"}'S' sea -12.5842 1.9871 -9.2931 {"}'S' green -12.4529 1.8818 -9.0948 {"}'S' green -12.3065 1.823 -8.8881 {"}'S' green -12.1487 1.8113 -8.6817 {"}'S' sea -11.9866 1.8493 -8.4825 {"}'S' sea -12.3458 2.0932 -9.3315 {"}'S' green -12.213 1.9972 -9.1333 {"}'S' green -12.0628 1.9552 -8.9286 {"}'S' sea -11.9043 1.9671 -8.7267 {"}'S' sea -11.9486 2.1367 -9.1011 { HB VAL 68 A}'S' sea -13.0781 0.9416 -6.91 {"}'S' sea -12.9493 0.8399 -6.7158 {"}'S' sea -13.0734 1.0839 -7.3529 {"}'S' green -12.9849 0.9077 -7.1901 {"}'S' green -12.8695 0.776 -7.004 {"}'S' green -12.7322 0.6945 -6.8045 {"}'S' sea -12.5803 0.6688 -6.6012 {"}'S' green -12.8985 1.0578 -7.5522 {"}'S' green -12.4305 0.5987 -6.8197 {"}'S' sea -12.275 0.6107 -6.6219 {"}'S' green -12.7232 1.2079 -7.7981 {"}'S' green -12.3265 0.607 -7.1187 {"}'S' green -12.1741 0.582 -6.9149 {"}'S' sea -12.0147 0.6124 -6.7177 {"}'S' green -12.4944 1.3473 -7.9512 {"}'S' green -12.46 1.1197 -7.8436 {"}'S' green -12.3889 0.9234 -7.6982 {"}'S' green -12.2863 0.7706 -7.5231 {"}'S' green -12.1578 0.6698 -7.328 {"}'S' sea -12.0106 0.6268 -7.1254 {"}'S' sea -11.8524 0.6446 -6.927 {"}'S' sea -12.2365 1.4557 -8.0165 {"}'S' green -12.2172 1.2133 -7.9245 {"}'S' green -12.1527 1.0044 -7.7818 {"}'S' sea -12.049 0.8457 -7.6039 {"}'S' sea -11.9696 1.3226 -7.9408 {"}'S' sea -11.9145 1.1113 -7.8122 {HG11 VAL 68 A}'S' sea -14.2212 0.8078 -7.1839 {"}'S' sea -14.0579 0.8567 -6.9874 {"}'S' sea -14.1376 0.9647 -7.4268 {"}'S' sea -13.9812 0.9755 -7.2275 {HG21 VAL 68 A}'S' green -13.9478 1.6173 -8.7878 {"}'S' green -13.7959 1.5915 -8.5844 {"}'S' green -13.6365 1.622 -8.3872 {"}'S' green -13.9241 1.6575 -9.2003 {"}'S' green -13.5019 1.6934 -9.5064 {"}'S' green -13.2647 1.7685 -9.5871 {"}'S' green -12.8904 1.8063 -9.4209 {"}'S' green -12.7341 1.8171 -9.2216 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 VAL 68 A}'S' P -12.7643 1.6572 -8.6847 {"}'S' -12.7634 1.6588 -8.6839 { HB VAL 68 A}'S' P -12.8173 0.8754 -7.3962 {"}'S' -12.8164 0.877 -7.3953 {"}'S' P -12.7085 0.7348 -7.2171 {"}'S' -12.6991 0.7551 -7.2106 {"}'S' P -12.5778 0.6404 -7.022 {"}'S' -12.5778 0.6404 -7.022 {"}'S' P -12.6669 0.9962 -7.6676 {"}'S' -12.666 0.9981 -7.6651 {"}'S' P -12.5792 0.8201 -7.5042 {"}'S' -12.5783 0.8217 -7.5033 {"}'S' P -12.4631 0.6883 -7.3187 {"}'S' -12.4613 0.7 -7.3139 {HG21 VAL 68 A}'S' P -13.7934 1.5631 -9.0053 {"}'S' -13.7897 1.5764 -9.0032 {"}'S' P -13.6461 1.5215 -8.803 {"}'S' -13.6371 1.5739 -8.806 {"}'S' P -13.4906 1.5335 -8.6051 {"}'S' -13.4888 1.5825 -8.6155 {"}'S' P -13.332 1.5979 -8.4184 {"}'S' -13.3326 1.6047 -8.4208 {"}'S' P -13.6787 1.6111 -9.302 {"}'S' -13.6787 1.6111 -9.302 {"}'S' P -13.5421 1.5297 -9.1019 {"}'S' -13.5367 1.5991 -9.088 {"}'S' P -13.3898 1.5047 -8.8981 {"}'S' -13.395 1.6026 -8.8952 {"}'S' P -13.2304 1.5352 -8.7009 {"}'S' -13.246 1.6126 -8.7127 {"}'S' P -13.0724 1.6209 -8.5199 {"}'S' -13.0777 1.6373 -8.5258 {"}'S' P -13.3735 1.5926 -9.3112 {"}'S' -13.3759 1.6332 -9.2947 {"}'S' P -13.2262 1.5495 -9.1087 {"}'S' -13.2419 1.6325 -9.0909 {"}'S' P -13.0685 1.5665 -8.9106 {"}'S' -13.0937 1.6413 -8.9075 {"}'S' P -12.9103 1.6433 -8.7274 {"}'S' -12.9211 1.6648 -8.7299 {"}'S' P -13.1298 1.6736 -9.3862 {"}'S' -13.1316 1.6793 -9.3831 {"}'S' P -12.974 1.6494 -9.178 {"}'S' -12.9872 1.6779 -9.1701 {"}'S' P -12.8107 1.6983 -8.9815 {"}'S' -12.8115 1.6998 -8.9811 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 93 A}'M' greentint -9.8126 2.236 -6.3375 {"}'M' greentint -9.9758 2.2026 -6.5394 {"}'M' greentint -10.1244 2.0457 -6.6879 {"}'M' greentint -9.5308 2.3618 -6.1999 {"}'M' greentint -9.6686 2.4411 -6.3996 {"}'M' greentint -9.8266 2.4327 -6.6016 {"}'M' greentint -9.9852 2.3396 -6.78 {"}'M' greentint -10.1244 2.1716 -6.9131 {"}'M' greentint -9.3444 2.5328 -6.2643 {"}'M' greentint -9.4835 2.6112 -6.4655 {"}'M' greentint -9.6396 2.6218 -6.6694 {"}'M' greentint -9.7998 2.5636 -6.8614 {"}'M' greentint -9.9546 2.4405 -7.0261 {"}'M' greentint -10.0903 2.263 -7.1522 {"}'M' greentint -9.2435 2.7293 -6.5045 {"}'M' greentint -9.3964 2.7652 -6.7115 {"}'M' greentint -9.5569 2.7418 -6.9135 {"}'M' greentint -9.7189 2.6596 -7.0992 {"}'M' greentint -9.8712 2.5237 -7.2591 {"}'M' greentint -10.0078 2.3421 -7.3839 {"}'M' greentint -9.1477 2.8566 -6.7803 {"}'M' greentint -9.3029 2.8558 -6.9803 {"}'M' greentint -9.462 2.8047 -7.1725 {"}'M' greentint -9.6178 2.7059 -7.3458 {"}'M' greentint -9.764 2.5623 -7.4957 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 68 A}'M' greentint -10.1255 1.9633 -6.8346 {"}'M' greentint -9.9712 1.9626 -6.6355 {"}'M' greentint -9.813 2.0263 -6.4492 {"}'M' greentint -9.6627 2.1507 -6.2893 {"}'M' greentint -10.062 2.0946 -7.1896 {"}'M' greentint -9.9206 2.0216 -6.9865 {"}'M' greentint -9.7624 2.0238 -6.7827 {"}'M' greentint -9.6017 2.0998 -6.5959 {"}'M' greentint -9.4522 2.2451 -6.4435 {"}'M' greentint -9.3276 2.4451 -6.3377 {"}'M' greentint -9.9335 2.3213 -7.4297 {"}'M' greentint -9.8175 2.1842 -7.2415 {"}'M' greentint -9.6687 2.1346 -7.0354 {"}'M' greentint -9.5064 2.1795 -6.8375 {"}'M' greentint -9.3521 2.3121 -6.6758 {"}'M' greentint -9.2279 2.5155 -6.5711 {"}'M' greentint -9.1496 2.7611 -6.539 {"}'M' greentint -9.6895 2.4198 -7.404 {"}'M' greentint -9.5577 2.3181 -7.2059 {"}'M' greentint -9.3967 2.3461 -7.0059 {"}'M' greentint -9.2487 2.4981 -6.857 {"}'M' greentint -9.1539 2.7322 -6.7997 {"}'M' greentint -9.5284 2.6911 -7.4372 {"}'M' greentint -9.4242 2.5359 -7.2594 {"}'M' greentint -9.2642 2.6328 -7.08 {"}'M' greentint -9.2093 2.8861 -7.0797 {"}'M' greentint -9.3425 2.7825 -7.2792 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 93 A}'M' green -10.5437 0.7806 -4.6635 {"}'M' sea -10.6769 0.6769 -4.863 {"}'M' green -10.3578 0.872 -4.5055 {"}'M' sea -10.7324 0.8308 -5.143 {"}'M' sea -10.1301 0.9379 -4.3956 {"}'M' sea -9.9121 1.1454 -4.4337 {"}'M' green -10.0052 1.32 -4.6026 {"}'M' green -10.6006 1.1564 -5.3278 {"}'M' green -9.8916 1.514 -4.8538 {"}'M' green -10.0432 1.5495 -5.059 {"}'M' green -10.2045 1.5104 -5.2569 {"}'M' sea -10.3612 1.3983 -5.4282 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 93 A}'M' greentint -10.462 1.0271 -4.6833 {"}'M' greentint -10.622 0.9302 -4.8628 {"}'M' greentint -10.1968 1.1432 -4.5387 {"}'M' greentint -10.3285 1.245 -4.7369 {"}'M' greentint -10.4895 1.2169 -4.9368 {"}'M' greentint -10.6376 1.065 -5.0857 {"}'M' greentint -10.1401 1.4148 -4.8035 {"}'M' greentint -10.299 1.418 -5.0094 {"}'M' greentint -10.4592 1.3269 -5.1923 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 68 A}'M' sea -10.9469 0.8799 -5.0151 {"}'M' sea -10.8007 0.8166 -4.8093 {"}'M' green -10.6435 0.812 -4.6037 {"}'M' green -10.4809 0.8677 -4.4095 {"}'M' sea -10.323 0.978 -4.2361 {"}'M' sea -10.8427 1.1069 -5.2611 {"}'M' green -10.7171 0.9944 -5.0672 {"}'M' green -10.2502 1.0584 -4.4813 {"}'M' sea -10.1035 1.208 -4.3337 {"}'M' sea -10.6922 1.3601 -5.3953 {"}'M' green -10.5888 1.2062 -5.2188 {"}'M' green -9.9962 1.4068 -4.5075 {"}'M' green -10.4491 1.4407 -5.2933 {"}'M' green -10.0032 1.5201 -4.7396 {"}'M' sea -10.3077 1.7222 -5.3061 {"}'M' green -10.2035 1.567 -5.1283 {"}'M' green -10.0448 1.6643 -4.9506 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 68 A}'M' greentint -10.5691 0.9474 -4.8628 {"}'M' greentint -10.4099 0.9698 -4.6623 {"}'M' greentint -10.4505 1.1293 -5.0173 {"}'M' greentint -10.2916 1.1403 -4.8164 {"}'M' greentint -10.1346 1.2362 -4.639 {"}'M' greentint -10.3162 1.3372 -5.093 {"}'M' greentint -10.153 1.3664 -4.8904 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 142 1khbA_144F_157}P -12.0263 -2.1444 0.0595 {"}-12.0263 -2.1444 0.0595 { ca ile A 142 1khbA_144F_157}-10.9441 -2.4357 -0.8795 { c ile A 142 1khbA_144F_157}-10.5173 -1.149 -1.61 { o ile A 142 1khbA_144F_157}-11.2505 -0.6722 -2.4834 { c ile A 142 1khbA_144F_157}P -10.5173 -1.149 -1.61 { n pro A 143 1khbA_144F_157}-9.3661 -0.5576 -1.2636 { ca pro A 143 1khbA_144F_157}-8.8754 0.5969 -2.0133 { c pro A 143 1khbA_144F_157}-8.1311 0.0208 -3.2278 { o pro A 143 1khbA_144F_157}-7.2142 -0.7983 -3.071 { c pro A 143 1khbA_144F_157}P -8.1311 0.0208 -3.2278 { n phe A 144 1khbA_144F_157}-8.4917 0.455 -4.4264 { ca phe A 144 1khbA_144F_157}-7.8045 -0.109 -5.5663 { c phe A 144 1khbA_144F_157}-7.4547 0.9376 -6.6309 { o phe A 144 1khbA_144F_157}-8.1976 1.8932 -6.8647 { c phe A 144 1khbA_144F_157}P -7.4547 0.9376 -6.6309 { n ser A 145 1khbA_144F_157}-6.4042 0.6415 -7.3713 { ca ser A 145 1khbA_144F_157}-5.9765 1.5096 -8.4733 { c ser A 145 1khbA_144F_157}-6.1452 0.7839 -9.8114 { o ser A 145 1khbA_144F_157}-5.6528 -0.3769 -9.955 { c ser A 145 1khbA_144F_157}P -6.1452 0.7839 -9.8114 { n met A 146 1khbA_144F_157}-6.8013 1.4502 -10.7678 { ca met A 146 1khbA_144F_157}-6.922 0.9751 -12.159 { c met A 146 1khbA_144F_157}-5.8142 1.701 -12.9262 { o met A 146 1khbA_144F_157}-5.8508 2.9271 -13.0492 { n lys A 155 1khbA_144F_157}P -6.8542 5.6749 -12.2761 {"}-6.8542 5.6749 -12.2761 { ca lys A 155 1khbA_144F_157}-8.0089 6.153 -11.5523 { c lys A 155 1khbA_144F_157}-8.1517 5.2235 -10.3545 { o lys A 155 1khbA_144F_157}-7.8337 4.0293 -10.4846 { c lys A 155 1khbA_144F_157}P -8.1517 5.2235 -10.3545 { n ile A 156 1khbA_144F_157}-8.5823 5.7772 -9.2375 { ca ile A 156 1khbA_144F_157}-8.7547 4.9879 -8.0147 { c ile A 156 1khbA_144F_157}-10.223 4.7932 -7.6275 { o ile A 156 1khbA_144F_157}-11.086 5.6646 -7.8644 { c ile A 156 1khbA_144F_157}P -10.223 4.7932 -7.6275 { n gly A 157 1khbA_144F_157}-10.5184 3.685 -6.9648 { ca gly A 157 1khbA_144F_157}-11.8581 3.4549 -6.4894 { c gly A 157 1khbA_144F_157}-11.7573 2.8535 -5.1104 { o gly A 157 1khbA_144F_157}-10.6785 2.4447 -4.6398 { c gly A 157 1khbA_144F_157}P -11.7573 2.8535 -5.1104 { n ile A 158 1khbA_144F_157}-12.8825 2.8407 -4.4274 { ca ile A 158 1khbA_144F_157}-12.9652 2.165 -3.1421 { c ile A 158 1khbA_144F_157}-14.1094 1.2057 -3.3044 { o ile A 158 1khbA_144F_157}-15.188 1.666 -3.6431 { c ile A 158 1khbA_144F_157}P -14.1094 1.2057 -3.3044 { n glu A 159 1khbA_144F_157}-13.9215 -0.1179 -3.1215 { ca glu A 159 1khbA_144F_157}-15.0991 -0.9841 -3.2875 { c glu A 159 1khbA_144F_157}-15.4681 -1.5127 -1.9265 { o glu A 159 1khbA_144F_157}-14.626 -2.0986 -1.286 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 142 1khbA_144F_157}P -12.0263 -2.1444 0.0595 { ca ile A 142 1khbA_144F_157}P -10.9441 -2.4357 -0.8795 { ca pro A 143 1khbA_144F_157}P -8.8754 0.5969 -2.0133 { n phe A 144 1khbA_144F_157}P -8.4917 0.455 -4.4264 { ca phe A 144 1khbA_144F_157}P -7.8045 -0.109 -5.5663 { n ser A 145 1khbA_144F_157}P -6.4042 0.6415 -7.3713 { ca ser A 145 1khbA_144F_157}P -5.9765 1.5096 -8.4733 { n met A 146 1khbA_144F_157}P -6.8013 1.4502 -10.7678 { ca met A 146 1khbA_144F_157}P -6.922 0.9751 -12.159 { n lys A 155 1khbA_144F_157}P -6.8542 5.6749 -12.2761 { ca lys A 155 1khbA_144F_157}P -8.0089 6.153 -11.5523 { n ile A 156 1khbA_144F_157}P -8.5823 5.7772 -9.2375 { ca ile A 156 1khbA_144F_157}P -8.7547 4.9879 -8.0147 { n gly A 157 1khbA_144F_157}P -10.5184 3.685 -6.9648 { ca gly A 157 1khbA_144F_157}P -11.8581 3.4549 -6.4894 {"}P -11.8581 3.4549 -6.4894 { n ile A 158 1khbA_144F_157}P -12.8825 2.8407 -4.4274 { ca ile A 158 1khbA_144F_157}P -12.9652 2.165 -3.1421 { n glu A 159 1khbA_144F_157}P -13.9215 -0.1179 -3.1215 { ca glu A 159 1khbA_144F_157}P -15.0991 -0.9841 -3.2875 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 142 1khbA_144F_157}P -10.9441 -2.4357 -0.8795 {"}-10.9441 -2.4357 -0.8795 { ca pro A 143 1khbA_144F_157}-8.8754 0.5969 -2.0133 { ca phe A 144 1khbA_144F_157}-7.8045 -0.109 -5.5663 { ca ser A 145 1khbA_144F_157}-5.9765 1.5096 -8.4733 { ca met A 146 1khbA_144F_157}-6.922 0.9751 -12.159 { ca lys A 155 1khbA_144F_157}P -8.0089 6.153 -11.5523 {"}-8.0089 6.153 -11.5523 { ca ile A 156 1khbA_144F_157}-8.7547 4.9879 -8.0147 { ca gly A 157 1khbA_144F_157}-11.8581 3.4549 -6.4894 { ca ile A 158 1khbA_144F_157}-12.9652 2.165 -3.1421 { ca glu A 159 1khbA_144F_157}-15.0991 -0.9841 -3.2875 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 144 1khbA_144F_157}P -7.8045 -0.109 -5.5663 { cb phe A 144 1khbA_144F_157}-8.6491 -1.2723 -6.2142 { cg phe A 144 1khbA_144F_157}-10.0122 -0.8242 -6.7988 { cd1 phe A 144 1khbA_144F_157}-10.1446 -0.5302 -8.1678 { ce1 phe A 144 1khbA_144F_157}-11.3576 -0.0584 -8.7065 { cz phe A 144 1khbA_144F_157}-12.4933 0.0617 -7.8971 { cg phe A 144 1khbA_144F_157}P -10.0122 -0.8242 -6.7988 { cd2 phe A 144 1khbA_144F_157}-11.1391 -0.7024 -6.0017 { ce2 phe A 144 1khbA_144F_157}-12.3653 -0.2327 -6.5084 { cz phe A 144 1khbA_144F_157}ghost -12.4933 0.0617 -7.8971 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 144 1khbA_144F_157}P -8.6491 -1.2723 -6.2142 {"}P -8.6491 -1.2723 -6.2142 { cd1 phe A 144 1khbA_144F_157}P -10.1446 -0.5302 -8.1678 { cd2 phe A 144 1khbA_144F_157}P -11.1391 -0.7024 -6.0017 { ce1 phe A 144 1khbA_144F_157}P -11.3576 -0.0584 -8.7065 { ce2 phe A 144 1khbA_144F_157}P -12.3653 -0.2327 -6.5084 { cz phe A 144 1khbA_144F_157}P -12.4933 0.0617 -7.8971 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 144 A}'P' blue -12.7774 1.4673 -6.4548 {"}'P' blue -12.9382 1.4148 -6.6473 {"}'P' sky -12.7581 1.4409 -6.8359 {"}'P' blue -11.8301 1.384 -6.9114 { CZ PHE 144 A}'P' sky -12.1731 1.7607 -8.172 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 144 A}'P' sea -12.5942 1.4976 -6.6403 {"}'P' sea -12.2537 1.5094 -6.6321 {"}'P' sea -12.4158 1.486 -6.8347 {"}'P' sea -12.0451 1.4662 -6.7833 { CZ PHE 144 A}'P' sea -12.8381 1.4777 -6.9282 {"}'P' sea -12.978 1.5586 -7.131 {"}'P' sea -13.131 1.5928 -7.3394 {"}'P' green -12.591 1.5541 -6.9889 {"}'P' green -12.7264 1.6443 -7.1877 {"}'P' green -12.8743 1.6941 -7.3927 {"}'P' sea -13.0302 1.6997 -7.5968 {"}'P' green -12.3253 1.5789 -7.0416 {"}'P' sea -12.9053 1.7618 -7.8435 {"}'P' sea -12.004 1.4936 -7.017 {"}'P' green -12.1227 1.6273 -7.208 {"}'P' green -12.5605 1.8095 -7.8241 {"}'P' sea -12.7221 1.792 -8.029 {"}'P' sea -11.8154 1.5209 -7.2097 {"}'P' green -11.9377 1.6455 -7.4036 {"}'P' green -12.0756 1.7366 -7.606 {"}'P' green -12.2247 1.7896 -7.8133 {"}'P' green -12.3816 1.8039 -8.0208 {"}'P' sea -11.7297 1.5988 -7.5546 {"}'P' sea -11.8668 1.6897 -7.7577 {"}'P' sea -12.0154 1.7434 -7.9646 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 144 A}'P' P -12.4533 1.6819 -7.2366 {"}'P' -12.4547 1.6492 -7.2498 {"}'P' P -12.5957 1.7478 -7.4395 {"}'P' -12.5929 1.7061 -7.4499 {"}'P' P -12.7476 1.7749 -7.643 {"}'P' -12.7469 1.772 -7.6431 {"}'P' P -12.2571 1.7257 -7.409 {"}'P' -12.2631 1.687 -7.4204 {"}'P' P -12.4039 1.7865 -7.6167 {"}'P' -12.4062 1.7466 -7.6227 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 157 A}'P' blue -12.8089 1.843 -6.5974 {"}'P' sky -12.021 1.7264 -6.8199 {"}'P' sky -11.859 1.7488 -7.0274 @dotlist {x} color= white width= 1 master= {vdw contact} { HA3 GLY 157 A}'P' sea -13.0338 1.8043 -7.2872 {"}'P' green -12.8965 1.7228 -7.0878 {"}'P' sea -12.7445 1.697 -6.8845 {"}'P' sea -12.5851 1.7275 -6.6872 {"}'P' sea -12.9816 1.9037 -7.6794 {"}'P' green -12.8728 1.763 -7.5003 {"}'P' green -12.5948 1.627 -7.103 {"}'P' green -12.4392 1.6389 -6.9051 {"}'P' sea -12.2806 1.7034 -6.7184 {"}'P' sea -12.8312 2.0245 -7.9508 {"}'P' green -12.7435 1.8483 -7.7874 {"}'P' green -12.179 1.6407 -7.0009 {"}'P' green -12.5532 1.9516 -7.9814 {"}'P' green -12.0167 1.6728 -7.2102 {"}'P' sea -12.317 2.0327 -8.0651 {"}'P' green -12.2133 1.8739 -7.8871 {"}'P' green -12.0784 1.7791 -7.6862 {"}'P' green -11.9226 1.7549 -7.478 {"}'P' sea -11.7594 1.8038 -7.2815 {"}'P' sea -11.9762 1.9868 -7.9203 {"}'P' sea -11.839 1.9118 -7.7209 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HA3 GLY 157 A}'P' P -12.7421 1.6686 -7.3053 {"}'P' -12.7397 1.6781 -7.3042 {"}'P' P -12.6273 1.7166 -7.602 {"}'P' -12.6216 1.7452 -7.5905 {"}'P' P -12.4908 1.6352 -7.4019 {"}'P' -12.4865 1.6845 -7.3919 {"}'P' P -12.3384 1.6102 -7.1982 {"}'P' -12.3397 1.6326 -7.1982 {"}'P' P -12.4506 1.7988 -7.8064 {"}'P' -12.4499 1.8031 -7.8031 {"}'P' P -12.3221 1.6981 -7.6112 {"}'P' -12.3246 1.7356 -7.5959 {"}'P' P -12.1748 1.655 -7.4087 {"}'P' -12.1796 1.6805 -7.4039 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 144 A}'M' green -8.913 3.0769 -7.084 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 144 A}'M' greentint -9.3697 2.2857 -6.2084 {"}'M' greentint -9.5133 2.1779 -6.4808 {"}'M' greentint -9.271 2.5736 -6.2776 {"}'M' greentint -9.4196 2.4166 -6.4261 {"}'M' greentint -9.5233 2.3203 -6.7236 {"}'M' greentint -9.5798 2.0708 -6.7268 {"}'M' greentint -9.1217 2.8037 -6.3398 {"}'M' greentint -9.2803 2.7105 -6.5182 {"}'M' greentint -9.4196 2.5426 -6.6513 {"}'M' greentint -9.4929 2.4143 -6.9684 {"}'M' greentint -9.5641 2.1692 -6.9926 {"}'M' greentint -8.9348 2.9928 -6.4076 {"}'M' greentint -9.095 2.9346 -6.5996 {"}'M' greentint -9.2497 2.8115 -6.7643 {"}'M' greentint -9.3855 2.634 -6.8904 {"}'M' greentint -9.415 2.4945 -7.2066 {"}'M' greentint -9.4962 2.2513 -7.245 {"}'M' greentint -9.0141 3.0306 -6.8374 {"}'M' greentint -9.1663 2.8947 -6.9974 {"}'M' greentint -9.303 2.7131 -7.1222 {"}'M' greentint -9.3005 2.5393 -7.4363 {"}'M' greentint -9.0591 2.9333 -7.2339 {"}'M' greentint -9.1899 2.7513 -7.3523 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLY 157 A}'M' greentint -9.4051 2.159 -6.3663 {"}'M' greentint -9.272 2.3346 -6.2432 {"}'M' greentint -9.1668 2.5492 -6.1655 {"}'M' greentint -9.5048 2.032 -6.8597 {"}'M' greentint -9.3441 2.108 -6.6729 {"}'M' greentint -9.1946 2.2534 -6.5205 {"}'M' greentint -9.07 2.4533 -6.4147 {"}'M' greentint -8.9814 2.6909 -6.3666 {"}'M' greentint -8.9369 2.9457 -6.3793 {"}'M' greentint -9.4111 2.1429 -7.1124 {"}'M' greentint -9.2488 2.1878 -6.9145 {"}'M' greentint -9.0945 2.3204 -6.7528 {"}'M' greentint -8.9703 2.5237 -6.6482 {"}'M' greentint -8.892 2.7694 -6.616 {"}'M' greentint -8.871 3.0248 -6.6593 {"}'M' greentint -9.3001 2.3263 -7.2829 {"}'M' greentint -9.1391 2.3544 -7.0829 {"}'M' greentint -8.9911 2.5064 -6.934 {"}'M' greentint -8.8962 2.7405 -6.8767 {"}'M' greentint -8.88 2.9942 -6.926 {"}'M' greentint -9.1666 2.5442 -7.3364 {"}'M' greentint -9.0066 2.6411 -7.157 {"}'M' greentint -8.9517 2.8944 -7.1567 {"}'M' greentint -9.0849 2.7908 -7.3562 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 144 A}'M' greentint -9.8931 1.5523 -4.0376 {"}'M' greentint -10.0531 1.4553 -4.2171 {"}'M' greentint -10.1635 1.356 -4.4973 {"}'M' greentint -9.7596 1.7701 -4.0912 {"}'M' greentint -9.9206 1.742 -4.2911 {"}'M' greentint -10.0687 1.5901 -4.44 {"}'M' greentint -10.1352 1.4534 -4.7509 {"}'M' greentint -10.1856 1.1987 -4.7463 {"}'M' greentint -9.5712 1.94 -4.1578 {"}'M' greentint -9.7301 1.9431 -4.3637 {"}'M' greentint -9.8904 1.852 -4.5466 {"}'M' greentint -10.0318 1.6815 -4.6821 {"}'M' greentint -10.0384 1.5277 -4.9909 {"}'M' greentint -10.1066 1.2787 -5.0086 {"}'M' greentint -9.4743 2.0747 -4.4133 {"}'M' greentint -9.6357 2.0355 -4.6112 {"}'M' greentint -9.7923 1.9234 -4.7826 {"}'M' greentint -9.9309 1.7487 -4.9133 {"}'M' greentint -9.893 1.5472 -5.2085 {"}'M' greentint -9.3462 2.1256 -4.6615 {"}'M' greentint -9.5044 2.0619 -4.8479 {"}'M' greentint -9.6546 1.9374 -5.0077 {"}'M' greentint -9.7877 1.7618 -5.1308 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLY 157 A}'M' green -10.2031 1.1284 -4.6944 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLY 157 A}'M' greentint -10.0398 1.3068 -4.1325 {"}'M' greentint -9.9002 1.4741 -3.9987 {"}'M' greentint -10.0451 1.2025 -4.5106 {"}'M' greentint -9.8933 1.3231 -4.3478 {"}'M' greentint -9.7529 1.4851 -4.2117 {"}'M' greentint -9.631 1.6817 -4.1087 {"}'M' greentint -10.1003 1.2068 -4.9459 {"}'M' greentint -9.9377 1.2625 -4.7518 {"}'M' greentint -9.7798 1.3728 -4.5783 {"}'M' greentint -9.6345 1.5345 -4.4354 {"}'M' greentint -9.5099 1.7369 -4.3318 {"}'M' greentint -9.4134 1.97 -4.2719 {"}'M' greentint -9.8667 1.3647 -5.0045 {"}'M' greentint -9.707 1.4532 -4.8235 {"}'M' greentint -9.5603 1.6028 -4.676 {"}'M' greentint -9.4366 1.8026 -4.5713 {"}'M' greentint -9.3447 2.0368 -4.518 {"}'M' greentint -9.7485 1.5352 -5.1586 {"}'M' greentint -9.5914 1.6311 -4.9813 {"}'M' greentint -9.453 1.8016 -4.8498 {"}'M' greentint -9.35 2.0251 -4.7789 {"}'M' greentint -9.6098 1.7612 -5.2327 {"}'M' greentint -9.4601 1.9149 -5.0818 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 5 1kjvA_99Y_7Y}P -7.3223 6.0163 -12.0608 {"}-7.3223 6.0163 -12.0608 { ca leu A 5 1kjvA_99Y_7Y}-8.7043 5.8098 -11.6315 { c leu A 5 1kjvA_99Y_7Y}-8.6122 4.9099 -10.4048 { o leu A 5 1kjvA_99Y_7Y}-8.0255 3.837 -10.4995 { c leu A 5 1kjvA_99Y_7Y}P -8.6122 4.9099 -10.4048 { n arg A 6 1kjvA_99Y_7Y}-9.1818 5.347 -9.282 { ca arg A 6 1kjvA_99Y_7Y}-9.0888 4.6037 -8.0265 { c arg A 6 1kjvA_99Y_7Y}-10.3999 4.6771 -7.3045 { o arg A 6 1kjvA_99Y_7Y}-11.0918 5.6944 -7.3186 { c arg A 6 1kjvA_99Y_7Y}P -10.3999 4.6771 -7.3045 { n tyr A 7 1kjvA_99Y_7Y}-10.7374 3.5706 -6.6621 { ca tyr A 7 1kjvA_99Y_7Y}-11.9146 3.4906 -5.8246 { c tyr A 7 1kjvA_99Y_7Y}-11.4831 3.1158 -4.4111 { o tyr A 7 1kjvA_99Y_7Y}-10.7078 2.1916 -4.2153 { c tyr A 7 1kjvA_99Y_7Y}P -11.4831 3.1158 -4.4111 { n phe A 8 1kjvA_99Y_7Y}-12.0017 3.867 -3.4475 { ca phe A 8 1kjvA_99Y_7Y}-11.74 3.708 -2.0146 { c phe A 8 1kjvA_99Y_7Y}-13.0898 3.3962 -1.3942 { o phe A 8 1kjvA_99Y_7Y}-13.9544 4.2682 -1.3121 { c phe A 8 1kjvA_99Y_7Y}P -13.0898 3.3962 -1.3942 { n asp A 9 1kjvA_99Y_7Y}-13.2456 2.169 -0.91 { ca asp A 9 1kjvA_99Y_7Y}-14.5346 1.6901 -0.4521 { c asp A 9 1kjvA_99Y_7Y}-14.4382 1.2289 0.9982 { o asp A 9 1kjvA_99Y_7Y}-13.4051 0.7318 1.4403 { n glu A 97 1kjvA_99Y_7Y}P -11.4785 -1.3463 1.214 {"}-11.4785 -1.3463 1.214 { ca glu A 97 1kjvA_99Y_7Y}-10.875 -1.8604 0.0013 { c glu A 97 1kjvA_99Y_7Y}-10.3769 -0.6793 -0.8007 { o glu A 97 1kjvA_99Y_7Y}-11.0941 0.3229 -0.9059 { c glu A 97 1kjvA_99Y_7Y}P -10.3769 -0.6793 -0.8007 { n met A 98 1kjvA_99Y_7Y}-9.1981 -0.7993 -1.4162 { ca met A 98 1kjvA_99Y_7Y}-8.7285 0.2194 -2.362 { c met A 98 1kjvA_99Y_7Y}-8.289 -0.5064 -3.6156 { o met A 98 1kjvA_99Y_7Y}-7.5802 -1.5134 -3.5328 { c met A 98 1kjvA_99Y_7Y}P -8.289 -0.5064 -3.6156 { n tyr A 99 1kjvA_99Y_7Y}-8.7423 -0.0351 -4.758 { ca tyr A 99 1kjvA_99Y_7Y}-8.2532 -0.5784 -5.9973 { c tyr A 99 1kjvA_99Y_7Y}-8.2276 0.4627 -7.0799 { o tyr A 99 1kjvA_99Y_7Y}-8.824 1.4998 -6.9629 { c tyr A 99 1kjvA_99Y_7Y}P -8.2276 0.4627 -7.0799 { n gly A 100 1kjvA_99Y_7Y}-7.4714 0.176 -8.117 { ca gly A 100 1kjvA_99Y_7Y}-7.4646 1.0729 -9.2489 { c gly A 100 1kjvA_99Y_7Y}-6.2537 0.853 -10.1257 { o gly A 100 1kjvA_99Y_7Y}-5.4283 -0.0371 -9.9018 { c gly A 100 1kjvA_99Y_7Y}P -6.2537 0.853 -10.1257 { n cys A 101 1kjvA_99Y_7Y}-6.1735 1.7122 -11.1334 { ca cys A 101 1kjvA_99Y_7Y}-5.1436 1.6469 -12.1493 { c cys A 101 1kjvA_99Y_7Y}-4.4292 2.9721 -12.311 { o cys A 101 1kjvA_99Y_7Y}-5.0636 4.0367 -12.3479 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 5 1kjvA_99Y_7Y}P -7.3223 6.0163 -12.0608 { ca leu A 5 1kjvA_99Y_7Y}P -8.7043 5.8098 -11.6315 { n arg A 6 1kjvA_99Y_7Y}P -9.1818 5.347 -9.282 { ca arg A 6 1kjvA_99Y_7Y}P -9.0888 4.6037 -8.0265 { n tyr A 7 1kjvA_99Y_7Y}P -10.7374 3.5706 -6.6621 { ca tyr A 7 1kjvA_99Y_7Y}P -11.9146 3.4906 -5.8246 { n phe A 8 1kjvA_99Y_7Y}P -12.0017 3.867 -3.4475 { ca phe A 8 1kjvA_99Y_7Y}P -11.74 3.708 -2.0146 { n asp A 9 1kjvA_99Y_7Y}P -13.2456 2.169 -0.91 { ca asp A 9 1kjvA_99Y_7Y}P -14.5346 1.6901 -0.4521 { n glu A 97 1kjvA_99Y_7Y}P -11.4785 -1.3463 1.214 { ca glu A 97 1kjvA_99Y_7Y}P -10.875 -1.8604 0.0013 { n met A 98 1kjvA_99Y_7Y}P -9.1981 -0.7993 -1.4162 { ca met A 98 1kjvA_99Y_7Y}P -8.7285 0.2194 -2.362 { n tyr A 99 1kjvA_99Y_7Y}P -8.7423 -0.0351 -4.758 { ca tyr A 99 1kjvA_99Y_7Y}P -8.2532 -0.5784 -5.9973 { n gly A 100 1kjvA_99Y_7Y}P -7.4714 0.176 -8.117 { ca gly A 100 1kjvA_99Y_7Y}P -7.4646 1.0729 -9.2489 {"}P -7.4646 1.0729 -9.2489 { n cys A 101 1kjvA_99Y_7Y}P -6.1735 1.7122 -11.1334 { ca cys A 101 1kjvA_99Y_7Y}P -5.1436 1.6469 -12.1493 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 5 1kjvA_99Y_7Y}P -8.7043 5.8098 -11.6315 {"}-8.7043 5.8098 -11.6315 { ca arg A 6 1kjvA_99Y_7Y}-9.0888 4.6037 -8.0265 { ca tyr A 7 1kjvA_99Y_7Y}-11.9146 3.4906 -5.8246 { ca phe A 8 1kjvA_99Y_7Y}-11.74 3.708 -2.0146 { ca asp A 9 1kjvA_99Y_7Y}-14.5346 1.6901 -0.4521 { ca glu A 97 1kjvA_99Y_7Y}P -10.875 -1.8604 0.0013 {"}-10.875 -1.8604 0.0013 { ca met A 98 1kjvA_99Y_7Y}-8.7285 0.2194 -2.362 { ca tyr A 99 1kjvA_99Y_7Y}-8.2532 -0.5784 -5.9973 { ca gly A 100 1kjvA_99Y_7Y}-7.4646 1.0729 -9.2489 { ca cys A 101 1kjvA_99Y_7Y}-5.1436 1.6469 -12.1493 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 7 1kjvA_99Y_7Y}P -11.9146 3.4906 -5.8246 { cb tyr A 7 1kjvA_99Y_7Y}-12.8805 2.4205 -6.3519 { cg tyr A 7 1kjvA_99Y_7Y}-13.5953 2.8786 -7.5891 { cd1 tyr A 7 1kjvA_99Y_7Y}-14.7614 3.6065 -7.5154 { ce1 tyr A 7 1kjvA_99Y_7Y}-15.3904 4.0631 -8.6519 { cz tyr A 7 1kjvA_99Y_7Y}-14.8772 3.796 -9.882 { oh tyr A 7 1kjvA_99Y_7Y}-15.5226 4.2881 -11.0388 { cg tyr A 7 1kjvA_99Y_7Y}P -13.5953 2.8786 -7.5891 { cd2 tyr A 7 1kjvA_99Y_7Y}-13.0811 2.6143 -8.8304 { ce2 tyr A 7 1kjvA_99Y_7Y}-13.7103 3.0662 -9.9883 { cz tyr A 7 1kjvA_99Y_7Y}ghost -14.8772 3.796 -9.882 { ca tyr A 99 1kjvA_99Y_7Y}P -8.2532 -0.5784 -5.9973 { cb tyr A 99 1kjvA_99Y_7Y}-9.0884 -1.7903 -6.4247 { cg tyr A 99 1kjvA_99Y_7Y}-10.5258 -1.5185 -6.7801 { cd1 tyr A 99 1kjvA_99Y_7Y}-10.9017 -1.211 -8.092 { ce1 tyr A 99 1kjvA_99Y_7Y}-12.2143 -0.9971 -8.4447 { cz tyr A 99 1kjvA_99Y_7Y}-13.1938 -1.0932 -7.4904 { oh tyr A 99 1kjvA_99Y_7Y}-14.495 -0.8868 -7.8362 { cg tyr A 99 1kjvA_99Y_7Y}P -10.5258 -1.5185 -6.7801 { cd2 tyr A 99 1kjvA_99Y_7Y}-11.5427 -1.615 -5.8376 { ce2 tyr A 99 1kjvA_99Y_7Y}-12.8431 -1.3991 -6.1741 { cz tyr A 99 1kjvA_99Y_7Y}ghost -13.1938 -1.0932 -7.4904 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 7 1kjvA_99Y_7Y}P -12.8805 2.4205 -6.3519 {"}P -12.8805 2.4205 -6.3519 { cd1 tyr A 7 1kjvA_99Y_7Y}P -14.7614 3.6065 -7.5154 { cd2 tyr A 7 1kjvA_99Y_7Y}P -13.0811 2.6143 -8.8304 { ce1 tyr A 7 1kjvA_99Y_7Y}P -15.3904 4.0631 -8.6519 { ce2 tyr A 7 1kjvA_99Y_7Y}P -13.7103 3.0662 -9.9883 { oh tyr A 7 1kjvA_99Y_7Y}P -15.5226 4.2881 -11.0388 { cb tyr A 99 1kjvA_99Y_7Y}P -9.0884 -1.7903 -6.4247 {"}P -9.0884 -1.7903 -6.4247 { cd1 tyr A 99 1kjvA_99Y_7Y}P -10.9017 -1.211 -8.092 { cd2 tyr A 99 1kjvA_99Y_7Y}P -11.5427 -1.615 -5.8376 { ce1 tyr A 99 1kjvA_99Y_7Y}P -12.2143 -0.9971 -8.4447 { ce2 tyr A 99 1kjvA_99Y_7Y}P -12.8431 -1.3991 -6.1741 { oh tyr A 99 1kjvA_99Y_7Y}P -14.495 -0.8868 -7.8362 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 99 A}'S' blue -11.6195 0.1592 -7.2737 { CD2 TYR 99 A}'S' blue -11.7716 0.1153 -5.9694 {"}'S' blue -11.5932 0.1037 -6.1639 {"}'S' blue -11.7568 0.0422 -6.3581 { CE1 TYR 99 A}'S' sky -12.4474 0.5855 -7.7353 {"}'S' blue -12.7513 0.6409 -8.1444 {"}'S' sky -12.9117 0.6047 -8.3417 {"}'S' blue -13.0724 0.5262 -8.5264 {"}'S' blue -11.8404 0.2134 -7.2377 {"}'S' sky -11.9337 0.3824 -7.4055 {"}'S' sky -12.0464 0.5201 -7.5892 {"}'S' sky -12.1744 0.6231 -7.7842 {"}'S' sky -12.4687 0.7161 -8.1906 {"}'S' sky -12.6264 0.703 -8.3912 {"}'S' sky -12.7872 0.6504 -8.5836 {"}'S' sky -12.9445 0.5607 -8.7627 {"}'S' blue -13.0976 0.4352 -8.9246 {"}'S' blue -11.7251 0.4348 -7.5646 {"}'S' blue -11.8438 0.5685 -7.7557 {"}'S' sky -12.2816 0.7507 -8.3717 {"}'S' sky -12.4431 0.7332 -8.5766 {"}'S' sky -12.7682 0.5828 -8.954 {"}'S' blue -12.9236 0.4531 -9.1198 {"}'S' blue -11.9457 0.7308 -8.361 {"}'S' sky -12.1026 0.7451 -8.5684 {"}'S' sky -12.2648 0.7216 -8.771 {"}'S' sky -12.4284 0.6602 -8.9652 {"}'S' blue -12.5892 0.5617 -9.1455 {"}'S' blue -11.8941 0.7019 -8.7196 {"}'S' blue -12.0559 0.6789 -8.9235 {"}'S' blue -12.219 0.6182 -9.1172 { CE2 TYR 99 A}'S' blue -13.0975 0.3142 -5.92 {"}'S' blue -13.2551 0.301 -6.1205 {"}'S' blue -12.6069 0.2649 -5.686 {"}'S' sky -12.0043 0.1367 -6.1626 {"}'S' sky -11.9441 0.0706 -6.4804 {"}'S' sky -12.0959 0.0992 -6.6842 { CZ TYR 99 A}'S' sky -13.2915 0.3992 -6.5822 {"}'S' sky -13.4269 0.4894 -6.781 {"}'S' blue -13.5748 0.5392 -6.986 {"}'S' sky -13.4481 0.62 -7.2363 {"}'S' sky -13.261 0.6546 -7.4174 {"}'S' blue -13.0821 0.649 -7.6141 {"}'S' blue -13.4078 0.5641 -8.0109 {"}'S' blue -13.0353 0.5828 -7.9692 {"}'S' blue -13.1985 0.5222 -8.1629 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 99 A}'S' sea -12.1945 0.3662 -7.3481 {"}'S' sea -12.312 0.4953 -7.5365 {"}'S' sea -12.607 0.6766 -8.7723 { CE2 TYR 99 A}'S' sea -12.7537 0.3257 -5.8936 {"}'S' sea -12.9103 0.3487 -6.101 {"}'S' sea -13.0719 0.3313 -6.3059 {"}'S' sea -12.4254 0.2758 -5.883 {"}'S' green -12.5745 0.3288 -6.0903 {"}'S' green -12.7314 0.3431 -6.2978 {"}'S' green -12.8936 0.3196 -6.5003 {"}'S' sea -12.2166 0.2289 -6.0346 {"}'S' green -12.3653 0.2827 -6.2415 {"}'S' green -12.5229 0.2999 -6.4489 {"}'S' sea -12.152 0.1962 -6.3694 {"}'S' green -12.3078 0.2177 -6.5771 { CZ TYR 99 A}'S' green -13.0259 0.424 -6.6349 {"}'S' green -13.1538 0.527 -6.8299 {"}'S' sea -13.2962 0.5929 -7.0328 {"}'S' green -12.7045 0.3388 -6.6104 {"}'S' green -12.9576 0.5708 -7.0024 {"}'S' sea -13.1044 0.6316 -7.21 {"}'S' green -12.5159 0.3661 -6.803 {"}'S' green -12.7761 0.5817 -7.1993 {"}'S' sea -12.9252 0.6347 -7.4067 {"}'S' sea -12.203 0.1598 -6.776 {"}'S' green -12.308 0.3176 -6.9555 {"}'S' green -12.4302 0.4439 -7.148 {"}'S' green -12.5673 0.5348 -7.351 {"}'S' sea -12.7159 0.5886 -7.5579 {"}'S' sea -12.1011 0.2121 -7.0861 {"}'S' sea -12.2202 0.345 -7.2775 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 99 A}'S' P -12.8232 0.4724 -6.8014 {"}'S' -12.8234 0.4693 -6.8025 {"}'S' P -12.6382 0.4907 -6.9969 {"}'S' -12.6441 0.4762 -7.0017 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 7 A}'S' blue -13.6399 0.8803 -6.688 {"}'S' blue -13.5023 0.7901 -6.4846 {"}'S' blue -13.3533 0.7371 -6.2772 {"}'S' blue -13.1956 0.7227 -6.0704 {"}'S' blue -13.0334 0.7462 -5.8678 {"}'S' blue -13.562 0.9653 -7.0453 {"}'S' sky -13.4402 0.84 -6.8518 {"}'S' sky -13.3027 0.7481 -6.6498 {"}'S' blue -13.4185 1.0628 -7.3157 {"}'S' sky -13.3087 0.9137 -7.1315 {"}'S' blue -13.1643 1.0459 -7.3967 { CG TYR 7 A}'S' blue -13.4429 1.1362 -7.5521 { CD2 TYR 7 A}'S' blue -13.378 1.0383 -8.1297 {"}'S' blue -13.2341 0.94 -8.3462 {"}'S' blue -13.0712 1.0015 -8.1514 {"}'S' blue -13.1974 0.8718 -8.7129 {"}'S' sky -13.0353 0.8939 -8.5101 {"}'S' sky -12.873 0.9547 -8.3157 {"}'S' blue -12.7117 1.0512 -8.1345 {"}'S' blue -13.0881 0.8726 -9.0012 {"}'S' sky -12.9287 0.8719 -8.7934 {"}'S' sky -12.6022 0.9857 -8.4038 {"}'S' blue -12.4438 1.0995 -8.2305 {"}'S' sky -12.8313 0.9022 -9.091 {"}'S' sky -12.6737 0.914 -8.8902 {"}'S' sky -12.5133 0.9643 -8.6979 {"}'S' sky -12.3553 1.0528 -8.5175 {"}'S' blue -12.2029 1.1771 -8.3547 {"}'S' blue -12.6183 0.9735 -9.2262 {"}'S' sky -12.4592 0.9904 -9.0247 { HB2 TYR 7 A}'S' sky -13.0394 0.5872 -6.4019 {"}'S' sky -12.5766 0.6389 -5.817 {"}'S' sky -12.3525 0.533 -5.9087 {"}'S' blue -12.0535 0.5385 -5.9558 {"}'S' sky -12.8133 0.9552 -7.4842 {"}'S' sky -11.9468 0.4454 -6.2228 {"}'S' sky -12.55 0.867 -7.5297 {"}'S' sky -11.9429 0.391 -6.6135 {"}'S' blue -11.7848 0.4678 -6.4302 {"}'S' blue -12.3073 0.9606 -7.6106 {"}'S' sky -12.2428 0.7517 -7.4679 {"}'S' sky -12.0042 0.4981 -7.0891 {"}'S' sky -12.0046 0.8586 -7.4983 {"}'S' sky -11.902 0.7058 -7.3232 {"}'S' blue -11.7649 0.6308 -7.1237 { HD2 TYR 7 A}'S' sky -12.2667 1.0475 -8.7917 {"}'S' sky -12.1101 1.0849 -8.5998 {"}'S' blue -11.9551 1.1821 -8.4273 {"}'S' blue -12.1537 1.0456 -9.0742 {"}'S' sky -11.9994 1.0449 -8.8751 {"}'S' blue -11.8412 1.1086 -8.6888 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 7 A}'S' sea -12.7649 0.9099 -8.5936 { HB2 TYR 7 A}'S' sea -13.1682 0.6889 -6.596 {"}'S' sea -12.8922 0.5442 -6.1994 {"}'S' sea -12.7348 0.5621 -6.0003 {"}'S' sea -13.1635 0.8312 -7.039 {"}'S' green -13.075 0.6549 -6.8761 {"}'S' green -12.9596 0.5233 -6.6901 {"}'S' green -12.8223 0.4418 -6.4906 {"}'S' green -12.6703 0.416 -6.2873 {"}'S' green -12.511 0.4465 -6.0901 {"}'S' sea -12.9886 0.8051 -7.2383 {"}'S' green -12.9074 0.6227 -7.0823 {"}'S' green -12.6679 0.3876 -6.7081 {"}'S' green -12.5206 0.346 -6.5058 {"}'S' green -12.3651 0.358 -6.308 {"}'S' sea -12.2064 0.4225 -6.1212 {"}'S' green -12.757 0.7435 -7.3537 {"}'S' green -12.6693 0.5674 -7.1903 {"}'S' green -12.4166 0.3542 -6.8048 {"}'S' green -12.2642 0.3292 -6.601 {"}'S' sea -12.1048 0.3597 -6.4038 {"}'S' sea -12.479 0.6706 -7.3843 {"}'S' green -12.3764 0.5179 -7.2092 {"}'S' green -12.2479 0.4171 -7.0141 {"}'S' sea -12.1007 0.374 -6.8115 {"}'S' sea -12.1391 0.593 -7.29 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 7 A}'S' P -12.7986 0.482 -6.9032 {"}'S' -12.7945 0.4919 -6.8999 {"}'S' P -12.5532 0.4356 -7.0048 {"}'S' -12.5519 0.4465 -7.0004 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 99 A}'M' greentint -9.9961 1.8922 -6.3065 {"}'M' greentint -10.1397 1.7845 -6.579 {"}'M' greentint -9.7341 2.2135 -6.1739 {"}'M' greentint -9.8974 2.1801 -6.3758 {"}'M' greentint -10.046 2.0232 -6.5243 {"}'M' greentint -10.1497 1.9268 -6.8217 {"}'M' greentint -9.5902 2.4186 -6.2359 {"}'M' greentint -9.7481 2.4102 -6.4379 {"}'M' greentint -9.9067 2.3171 -6.6163 {"}'M' greentint -10.046 2.1491 -6.7495 {"}'M' greentint -10.1193 2.0208 -7.0665 {"}'M' greentint -9.405 2.5887 -6.3019 {"}'M' greentint -9.5612 2.5993 -6.5058 {"}'M' greentint -9.7214 2.5411 -6.6978 {"}'M' greentint -9.8761 2.418 -6.8624 {"}'M' greentint -10.0119 2.2405 -6.9886 {"}'M' greentint -10.0414 2.101 -7.3048 {"}'M' greentint -9.3179 2.7427 -6.5478 {"}'M' greentint -9.4784 2.7193 -6.7499 {"}'M' greentint -9.6405 2.6371 -6.9355 {"}'M' greentint -9.7927 2.5012 -7.0955 {"}'M' greentint -9.9294 2.3196 -7.2203 {"}'M' greentint -9.2244 2.8333 -6.8167 {"}'M' greentint -9.3836 2.7822 -7.0089 {"}'M' greentint -9.5394 2.6834 -7.1822 {"}'M' greentint -9.6855 2.5398 -7.3321 {"}'M' greentint -9.8163 2.3579 -7.4505 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 7 A}'M' greentint -10.0595 1.7343 -6.6682 {"}'M' greentint -9.9013 1.7981 -6.4819 {"}'M' greentint -9.7511 1.9225 -6.3221 {"}'M' greentint -9.618 2.0981 -6.199 {"}'M' greentint -9.5127 2.3127 -6.1213 {"}'M' greentint -10.0089 1.7933 -7.0193 {"}'M' greentint -9.8507 1.7955 -6.8155 {"}'M' greentint -9.6901 1.8715 -6.6286 {"}'M' greentint -9.5405 2.0169 -6.4763 {"}'M' greentint -9.416 2.2168 -6.3704 {"}'M' greentint -9.3274 2.4544 -6.3224 {"}'M' greentint -9.9058 1.956 -7.2743 {"}'M' greentint -9.757 1.9064 -7.0682 {"}'M' greentint -9.5947 1.9513 -6.8702 {"}'M' greentint -9.4405 2.0839 -6.7085 {"}'M' greentint -9.3162 2.2872 -6.6039 {"}'M' greentint -9.238 2.5329 -6.5718 {"}'M' greentint -9.217 2.7883 -6.6151 {"}'M' greentint -9.7778 2.1916 -7.4368 {"}'M' greentint -9.6461 2.0899 -7.2386 {"}'M' greentint -9.4851 2.1179 -7.0386 {"}'M' greentint -9.337 2.2699 -6.8898 {"}'M' greentint -9.2422 2.504 -6.8325 {"}'M' greentint -9.2259 2.7577 -6.8818 {"}'M' greentint -9.6168 2.4629 -7.47 {"}'M' greentint -9.5126 2.3077 -7.2922 {"}'M' greentint -9.3526 2.4046 -7.1127 {"}'M' greentint -9.2976 2.6579 -7.1125 {"}'M' greentint -9.4309 2.5543 -7.312 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 99 A}'M' green -10.2008 0.8613 -4.2441 {"}'M' green -10.0149 0.9527 -4.0861 {"}'M' green -10.3895 0.9116 -4.7236 {"}'M' green -10.3612 1.0091 -4.9772 {"}'M' green -9.5722 1.6812 -4.8878 {"}'M' green -9.7304 1.6175 -5.0741 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 99 A}'M' greentint -10.1191 1.1079 -4.2639 {"}'M' greentint -10.2791 1.011 -4.4433 {"}'M' greentint -9.8539 1.224 -4.1193 {"}'M' greentint -9.9857 1.3257 -4.3174 {"}'M' greentint -10.1467 1.2977 -4.5174 {"}'M' greentint -10.2947 1.1457 -4.6663 {"}'M' greentint -9.6623 1.4008 -4.1832 {"}'M' greentint -9.7972 1.4956 -4.3841 {"}'M' greentint -9.9561 1.4988 -4.59 {"}'M' greentint -10.1164 1.4077 -4.7728 {"}'M' greentint -10.2578 1.2372 -4.9084 {"}'M' greentint -9.5487 1.5948 -4.4344 {"}'M' greentint -9.7004 1.6303 -4.6396 {"}'M' greentint -9.8617 1.5911 -4.8374 {"}'M' greentint -10.0183 1.4791 -5.0088 {"}'M' greentint -10.1569 1.3044 -5.1396 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 7 A}'M' green -10.3903 0.8514 -4.4666 {"}'M' green -10.2324 0.8754 -4.2699 {"}'M' green -10.0743 0.9494 -4.0861 {"}'M' green -10.433 1.0217 -4.9329 {"}'M' green -9.6637 1.2814 -4.0108 {"}'M' green -9.6896 1.7088 -5.046 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 7 A}'M' greentint -10.2867 0.9584 -4.7271 {"}'M' greentint -10.1295 0.9538 -4.5214 {"}'M' greentint -9.9669 1.0095 -4.3273 {"}'M' greentint -9.8091 1.1197 -4.1538 {"}'M' greentint -10.2032 1.1362 -4.985 {"}'M' greentint -10.0552 1.0892 -4.7805 {"}'M' greentint -9.896 1.1116 -4.58 {"}'M' greentint -9.7362 1.2002 -4.399 {"}'M' greentint -9.5895 1.3498 -4.2515 {"}'M' greentint -10.0749 1.3479 -5.1365 {"}'M' greentint -9.9365 1.2711 -4.935 {"}'M' greentint -9.7777 1.2821 -4.7341 {"}'M' greentint -9.6207 1.378 -4.5568 {"}'M' greentint -9.4822 1.5486 -4.4253 {"}'M' greentint -9.8022 1.479 -5.0108 {"}'M' greentint -9.6391 1.5082 -4.8082 {"}'M' greentint -9.4893 1.6619 -4.6573 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 50 1kpfA_52F_115V}P -11.5689 -1.758 0.8802 {"}-11.5689 -1.758 0.8802 { ca thr A 50 1kpfA_52F_115V}-11.2469 -2.0836 -0.5022 { c thr A 50 1kpfA_52F_115V}-10.7346 -0.7514 -1.0733 { o thr A 50 1kpfA_52F_115V}-11.4268 0.2924 -1.0119 { c thr A 50 1kpfA_52F_115V}P -10.7346 -0.7514 -1.0733 { n his A 51 1kpfA_52F_115V}-9.5164 -0.7822 -1.6108 { ca his A 51 1kpfA_52F_115V}-8.9363 0.4091 -2.1937 { c his A 51 1kpfA_52F_115V}-7.9677 -0.069 -3.2626 { o his A 51 1kpfA_52F_115V}-6.9061 -0.6599 -2.9276 { c his A 51 1kpfA_52F_115V}P -7.9677 -0.069 -3.2626 { n phe A 52 1kpfA_52F_115V}-8.3746 0.0807 -4.5227 { ca phe A 52 1kpfA_52F_115V}-7.5213 -0.3337 -5.6338 { c phe A 52 1kpfA_52F_115V}-7.3811 0.76 -6.6795 { o phe A 52 1kpfA_52F_115V}-8.1029 1.7665 -6.6638 { c phe A 52 1kpfA_52F_115V}P -7.3811 0.76 -6.6795 { n leu A 53 1kpfA_52F_115V}-6.3987 0.5884 -7.5601 { ca leu A 53 1kpfA_52F_115V}-6.1347 1.5443 -8.6188 { c leu A 53 1kpfA_52F_115V}-6.288 0.8977 -10.0085 { o leu A 53 1kpfA_52F_115V}-6.0364 -0.3131 -10.1983 { c leu A 53 1kpfA_52F_115V}P -6.288 0.8977 -10.0085 { n val A 54 1kpfA_52F_115V}-6.6934 1.7194 -10.969 { ca val A 54 1kpfA_52F_115V}-6.8259 1.2807 -12.3332 { c val A 54 1kpfA_52F_115V}-5.9169 2.1888 -13.1266 { o val A 54 1kpfA_52F_115V}-6.0442 3.4247 -13.082 { n leu A 113 1kpfA_52F_115V}P -6.7105 5.9639 -11.715 {"}-6.7105 5.9639 -11.715 { ca leu A 113 1kpfA_52F_115V}-7.9595 6.1396 -10.9981 { c leu A 113 1kpfA_52F_115V}-8.011 5.3144 -9.6874 { o leu A 113 1kpfA_52F_115V}-7.5861 4.163 -9.6658 { c leu A 113 1kpfA_52F_115V}P -8.011 5.3144 -9.6874 { n his A 114 1kpfA_52F_115V}-8.4915 5.924 -8.5983 { ca his A 114 1kpfA_52F_115V}-8.658 5.213 -7.3222 { c his A 114 1kpfA_52F_115V}-10.1149 4.7594 -7.2328 { o his A 114 1kpfA_52F_115V}-11.0216 5.4402 -7.7354 { c his A 114 1kpfA_52F_115V}P -10.1149 4.7594 -7.2328 { n val A 115 1kpfA_52F_115V}-10.3515 3.6317 -6.5811 { ca val A 115 1kpfA_52F_115V}-11.7137 3.1741 -6.2997 { c val A 115 1kpfA_52F_115V}-11.6535 2.7107 -4.8403 { o val A 115 1kpfA_52F_115V}-10.836 1.8378 -4.4807 { c val A 115 1kpfA_52F_115V}P -11.6535 2.7107 -4.8403 { n leu A 116 1kpfA_52F_115V}-12.4658 3.3607 -4.0003 { ca leu A 116 1kpfA_52F_115V}-12.5524 3.0939 -2.5473 { c leu A 116 1kpfA_52F_115V}-13.9664 2.721 -2.0964 { o leu A 116 1kpfA_52F_115V}-14.9506 3.3982 -2.458 { c leu A 116 1kpfA_52F_115V}P -13.9664 2.721 -2.0964 { n gly A 117 1kpfA_52F_115V}-14.0444 1.6254 -1.3224 { ca gly A 117 1kpfA_52F_115V}-15.3098 1.1326 -0.8049 { c gly A 117 1kpfA_52F_115V}-15.1141 0.22 0.4124 { o gly A 117 1kpfA_52F_115V}-13.9774 0.0378 0.9481 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 50 1kpfA_52F_115V}P -11.5689 -1.758 0.8802 { ca thr A 50 1kpfA_52F_115V}P -11.2469 -2.0836 -0.5022 { n his A 51 1kpfA_52F_115V}P -9.5164 -0.7822 -1.6108 { ca his A 51 1kpfA_52F_115V}P -8.9363 0.4091 -2.1937 { n phe A 52 1kpfA_52F_115V}P -8.3746 0.0807 -4.5227 { ca phe A 52 1kpfA_52F_115V}P -7.5213 -0.3337 -5.6338 { n leu A 53 1kpfA_52F_115V}P -6.3987 0.5884 -7.5601 { ca leu A 53 1kpfA_52F_115V}P -6.1347 1.5443 -8.6188 { n val A 54 1kpfA_52F_115V}P -6.6934 1.7194 -10.969 { ca val A 54 1kpfA_52F_115V}P -6.8259 1.2807 -12.3332 { n leu A 113 1kpfA_52F_115V}P -6.7105 5.9639 -11.715 { ca leu A 113 1kpfA_52F_115V}P -7.9595 6.1396 -10.9981 { n his A 114 1kpfA_52F_115V}P -8.4915 5.924 -8.5983 { ca his A 114 1kpfA_52F_115V}P -8.658 5.213 -7.3222 { n val A 115 1kpfA_52F_115V}P -10.3515 3.6317 -6.5811 { ca val A 115 1kpfA_52F_115V}P -11.7137 3.1741 -6.2997 { n leu A 116 1kpfA_52F_115V}P -12.4658 3.3607 -4.0003 { ca leu A 116 1kpfA_52F_115V}P -12.5524 3.0939 -2.5473 { n gly A 117 1kpfA_52F_115V}P -14.0444 1.6254 -1.3224 { ca gly A 117 1kpfA_52F_115V}P -15.3098 1.1326 -0.8049 {"}P -15.3098 1.1326 -0.8049 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca thr A 50 1kpfA_52F_115V}P -11.2469 -2.0836 -0.5022 {"}-11.2469 -2.0836 -0.5022 { ca his A 51 1kpfA_52F_115V}-8.9363 0.4091 -2.1937 { ca phe A 52 1kpfA_52F_115V}-7.5213 -0.3337 -5.6338 { ca leu A 53 1kpfA_52F_115V}-6.1347 1.5443 -8.6188 { ca val A 54 1kpfA_52F_115V}-6.8259 1.2807 -12.3332 { ca leu A 113 1kpfA_52F_115V}P -7.9595 6.1396 -10.9981 {"}-7.9595 6.1396 -10.9981 { ca his A 114 1kpfA_52F_115V}-8.658 5.213 -7.3222 { ca val A 115 1kpfA_52F_115V}-11.7137 3.1741 -6.2997 { ca leu A 116 1kpfA_52F_115V}-12.5524 3.0939 -2.5473 { ca gly A 117 1kpfA_52F_115V}-15.3098 1.1326 -0.8049 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 52 1kpfA_52F_115V}P -7.5213 -0.3337 -5.6338 { cb phe A 52 1kpfA_52F_115V}-8.041 -1.6328 -6.2612 { cg phe A 52 1kpfA_52F_115V}-9.4129 -1.503 -6.9167 { cd1 phe A 52 1kpfA_52F_115V}-9.5219 -1.1324 -8.2457 { ce1 phe A 52 1kpfA_52F_115V}-10.777 -1.0436 -8.8792 { cz phe A 52 1kpfA_52F_115V}-11.9355 -1.3287 -8.1605 { cg phe A 52 1kpfA_52F_115V}P -9.4129 -1.503 -6.9167 { cd2 phe A 52 1kpfA_52F_115V}-10.5627 -1.7842 -6.2026 { ce2 phe A 52 1kpfA_52F_115V}-11.8271 -1.6972 -6.8279 { cz phe A 52 1kpfA_52F_115V}ghost -11.9355 -1.3287 -8.1605 { ca val A 115 1kpfA_52F_115V}P -11.7137 3.1741 -6.2997 { cb val A 115 1kpfA_52F_115V}-12.2213 2.0196 -7.2273 { cg1 val A 115 1kpfA_52F_115V}-13.6446 1.661 -6.847 { cb val A 115 1kpfA_52F_115V}P -12.2213 2.0196 -7.2273 { cg2 val A 115 1kpfA_52F_115V}-12.2038 2.4159 -8.7327 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 52 1kpfA_52F_115V}P -8.041 -1.6328 -6.2612 {"}P -8.041 -1.6328 -6.2612 { cd1 phe A 52 1kpfA_52F_115V}P -9.5219 -1.1324 -8.2457 { cd2 phe A 52 1kpfA_52F_115V}P -10.5627 -1.7842 -6.2026 { ce1 phe A 52 1kpfA_52F_115V}P -10.777 -1.0436 -8.8792 { ce2 phe A 52 1kpfA_52F_115V}P -11.8271 -1.6972 -6.8279 { cz phe A 52 1kpfA_52F_115V}P -11.9355 -1.3287 -8.1605 { cb val A 115 1kpfA_52F_115V}P -12.2213 2.0196 -7.2273 { cg1 val A 115 1kpfA_52F_115V}P -13.6446 1.661 -6.847 {"}P -13.6446 1.661 -6.847 {"}P -13.6446 1.661 -6.847 { cg2 val A 115 1kpfA_52F_115V}P -12.2038 2.4159 -8.7327 {"}P -12.2038 2.4159 -8.7327 {"}P -12.2038 2.4159 -8.7327 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 52 A}'S' blue -10.5845 -0.1271 -7.2856 {"}'S' blue -10.4396 0.0736 -7.3709 {"}'S' blue -10.394 0.2555 -7.632 { CD2 PHE 52 A}'S' blue -11.1356 -0.1367 -6.3414 {"}'S' blue -10.7916 -0.0539 -6.3344 {"}'S' sky -10.9555 -0.1106 -6.5301 {"}'S' blue -10.7768 -0.127 -6.7231 { CE1 PHE 52 A}'S' sky -10.829 -0.1197 -7.3941 {"}'S' sky -11.5759 0.4725 -8.5245 {"}'S' sky -11.7387 0.4099 -8.7173 {"}'S' sky -11.8973 0.3008 -8.8921 {"}'S' sky -10.6595 0.1558 -7.6099 {"}'S' sky -11.1581 0.5888 -8.3748 {"}'S' sky -11.314 0.5944 -8.5789 {"}'S' sky -11.6351 0.4797 -8.9608 {"}'S' sky -11.7902 0.3611 -9.1286 {"}'S' sky -11.9358 0.2069 -9.2736 {"}'S' blue -10.4965 0.3358 -7.8399 {"}'S' sky -10.6091 0.4736 -8.0237 {"}'S' sky -10.7371 0.5766 -8.2186 {"}'S' blue -11.0314 0.6696 -8.6251 {"}'S' sky -11.1891 0.6565 -8.8256 {"}'S' sky -11.3499 0.6039 -9.0181 {"}'S' sky -11.5072 0.5142 -9.1971 {"}'S' sky -11.6604 0.3887 -9.3591 {"}'S' blue -11.804 0.2301 -9.5003 {"}'S' blue -10.8443 0.7042 -8.8061 {"}'S' blue -11.0059 0.6867 -9.011 {"}'S' blue -11.1698 0.63 -9.2067 {"}'S' blue -11.3309 0.5363 -9.3885 {"}'S' blue -11.4863 0.4066 -9.5542 { CE2 PHE 52 A}'S' blue -12.8605 -0.3472 -6.4124 {"}'S' blue -13.0191 -0.4379 -6.593 {"}'S' blue -12.626 -0.1811 -6.4731 {"}'S' sky -12.7888 -0.2438 -6.666 {"}'S' blue -12.9474 -0.3528 -6.8408 {"}'S' blue -12.3641 -0.0593 -6.5275 {"}'S' sky -12.5245 -0.0955 -6.7248 {"}'S' sky -12.6852 -0.1739 -6.9095 {"}'S' blue -12.8403 -0.2926 -7.0773 {"}'S' sky -11.9296 -0.0112 -6.3702 {"}'S' sky -12.4 -0.0497 -6.9667 {"}'S' sky -11.2716 -0.1134 -6.3343 {"}'S' sky -10.9884 -0.1615 -6.8164 { CZ PHE 52 A}'S' blue -12.9981 -0.3235 -7.2004 {"}'S' sky -13.161 -0.3312 -7.4077 {"}'S' sky -13.3243 -0.4275 -7.5919 {"}'S' blue -13.4675 -0.6012 -7.7291 {"}'S' sky -12.7103 -0.1892 -7.0822 {"}'S' sky -12.8532 -0.1228 -7.2857 {"}'S' blue -13.4615 -0.493 -7.9677 {"}'S' sky -12.511 -0.0289 -7.1403 {"}'S' blue -13.4122 -0.3915 -8.2038 {"}'S' sky -13.0557 0.0157 -8.1735 {"}'S' sky -13.205 -0.1358 -8.3241 {"}'S' blue -12.7935 0.1946 -8.2421 {"}'S' sky -12.5083 0.3188 -8.2994 {"}'S' blue -12.6656 0.2291 -8.4785 {"}'S' sky -12.3282 0.3449 -8.488 {"}'S' sky -12.4893 0.2512 -8.6698 {"}'S' blue -12.6448 0.1215 -8.8356 {"}'S' sky -11.9859 0.39 -8.4868 {"}'S' sky -12.1495 0.3285 -8.681 {"}'S' sky -12.3104 0.2301 -8.8613 {"}'S' sky -12.4646 0.0985 -9.025 {"}'S' sky -11.9402 0.2866 -8.833 {"}'S' sky -12.1014 0.1901 -9.0143 {"}'S' blue -12.2564 0.0587 -9.1773 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 52 A}'S' sea -10.9008 0.0803 -7.5431 {"}'S' green -10.9997 0.246 -7.7177 {"}'S' green -11.1219 0.3723 -7.9102 {"}'S' green -11.2618 0.4533 -8.1131 {"}'S' sea -11.4148 0.4875 -8.3214 {"}'S' sea -10.7572 0.3197 -7.7825 {"}'S' green -10.8748 0.4488 -7.9709 {"}'S' sea -11.0102 0.539 -8.1698 {"}'S' sea -11.4744 0.5581 -8.7762 { CE2 PHE 52 A}'S' sea -12.0815 0.016 -6.5738 {"}'S' sea -12.2392 0.0028 -6.7743 {"}'S' sea -11.591 -0.0332 -6.3398 {"}'S' green -11.7378 0.0275 -6.5475 {"}'S' green -11.8944 0.0505 -6.7548 {"}'S' green -12.056 0.0331 -6.9597 {"}'S' green -11.4095 -0.0224 -6.5368 {"}'S' green -11.5586 0.0306 -6.7441 {"}'S' sea -11.2007 -0.0693 -6.6884 {"}'S' green -11.3493 -0.0155 -6.8953 {"}'S' sea -11.136 -0.102 -7.0232 { CZ PHE 52 A}'S' sea -13.0109 -0.1228 -7.4893 {"}'S' sea -13.1716 -0.1871 -7.679 {"}'S' sea -13.3249 -0.3142 -7.8423 {"}'S' sea -12.6533 0.0415 -7.3422 {"}'S' sea -12.8076 0.0592 -7.5469 {"}'S' sea -12.9689 0.0214 -7.745 {"}'S' sea -13.1274 -0.0693 -7.9257 {"}'S' sea -13.278 -0.2087 -8.0809 {"}'S' green -12.2803 0.0872 -7.1915 {"}'S' green -12.4202 0.1682 -7.3944 {"}'S' green -12.5732 0.2024 -7.6028 {"}'S' sea -12.7343 0.1874 -7.8058 {"}'S' sea -12.8971 0.1248 -7.9986 {"}'S' green -11.9156 0.0346 -7.0638 {"}'S' green -12.3165 0.3037 -7.6561 {"}'S' green -12.4724 0.3092 -7.8602 {"}'S' sea -12.6328 0.273 -8.0575 {"}'S' green -12.1898 0.3845 -7.9064 {"}'S' green -12.3475 0.3714 -8.1069 {"}'S' green -12.0027 0.4191 -8.0875 {"}'S' sea -12.1643 0.4016 -8.2923 {"}'S' green -11.1525 -0.0259 -7.2938 {"}'S' green -11.6669 0.3991 -8.0767 {"}'S' sea -11.8238 0.4135 -8.2842 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 52 A}'S' P -11.7155 0.0449 -6.9516 {"}'S' -11.7171 0.0315 -6.9507 {"}'S' P -11.507 0.0017 -7.1027 {"}'S' -11.507 -0.001 -7.1022 { CZ PHE 52 A}'S' P -12.0332 0.1636 -7.2523 {"}'S' -12.0328 0.1465 -7.2632 {"}'S' P -12.1686 0.2539 -7.4511 {"}'S' -12.1687 0.2521 -7.4525 {"}'S' P -11.6549 0.0507 -7.1213 {"}'S' -11.6582 0.0323 -7.1353 {"}'S' P -11.7675 0.1885 -7.305 {"}'S' -11.7732 0.1267 -7.3396 {"}'S' P -11.8955 0.2914 -7.5 {"}'S' -11.897 0.2267 -7.5266 {"}'S' P -12.0379 0.3573 -7.7029 {"}'S' -12.0366 0.3385 -7.707 {"}'S' P -11.4462 0.1032 -7.2804 {"}'S' -11.4581 0.0685 -7.3024 {"}'S' P -11.5649 0.2369 -7.4714 {"}'S' -11.5819 0.1636 -7.5036 {"}'S' P -11.6993 0.3353 -7.6724 {"}'S' -11.7085 0.2685 -7.6919 {"}'S' P -11.8461 0.3961 -7.8801 {"}'S' -11.8465 0.3843 -7.8814 {"}'S' P -11.2576 0.1305 -7.4731 {"}'S' -11.2626 0.1187 -7.4789 {"}'S' P -11.3799 0.2551 -7.667 {"}'S' -11.3927 0.2202 -7.6783 {"}'S' P -11.5178 0.3461 -7.8694 {"}'S' -11.5217 0.3284 -7.8724 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 115 A}'S' blue -12.3743 0.3452 -6.7431 {"}'S' sky -12.5051 0.6449 -8.272 {"}'S' blue -11.7053 0.7712 -8.3389 {"}'S' blue -11.4505 0.8834 -8.312 { CG1 VAL 115 A}'S' blue -13.2372 -0.0394 -6.9068 {"}'S' blue -13.0768 0.011 -6.7145 {"}'S' blue -12.9187 0.0995 -6.5341 {"}'S' blue -12.7664 0.2237 -6.3713 {"}'S' sky -13.1813 0.0209 -7.2424 {"}'S' sky -13.0227 0.037 -7.0412 {"}'S' sky -12.8613 0.0959 -6.8494 {"}'S' sky -12.7033 0.1958 -6.6734 {"}'S' blue -12.5523 0.3332 -6.5172 {"}'S' sky -12.7694 0.1687 -7.1096 {"}'S' blue -12.608 0.2538 -6.9239 {"}'S' sky -12.8738 0.5248 -7.9317 { CG2 VAL 115 A}'S' blue -12.5189 0.7181 -8.4511 {"}'S' sky -12.3201 0.6734 -8.6152 {"}'S' sky -12.158 0.6955 -8.4124 {"}'S' sky -12.0514 0.6735 -8.6957 {"}'S' sky -11.8876 0.7115 -8.4959 {"}'S' sky -11.7964 0.7155 -8.7925 {"}'S' sky -11.6361 0.7659 -8.6002 {"}'S' sky -11.478 0.8544 -8.4198 {"}'S' sky -11.5819 0.792 -8.9269 {"}'S' sky -11.4205 0.8508 -8.7351 {"}'S' sky -11.2626 0.9508 -8.5591 {"}'S' sky -11.4908 0.8857 -9.1946 {"}'S' sky -11.3286 0.9236 -8.9953 {"}'S' sky -11.1673 1.0087 -8.8096 {"}'S' blue -11.2464 1.0414 -9.2396 {"}'S' blue -11.0851 1.1079 -9.0497 { HB VAL 115 A}'S' sky -12.2577 0.2568 -6.919 {"}'S' sky -11.7949 0.3085 -6.3342 {"}'S' sky -11.2717 0.2081 -6.4729 {"}'S' blue -11.015 0.2509 -6.5846 {"}'S' sky -11.003 0.1374 -6.9474 {"}'S' blue -10.8526 0.2688 -6.7888 {"}'S' blue -10.6707 0.4065 -7.2671 {"}'S' sky -11.0332 0.8068 -8.0778 {"}'S' sky -10.6684 0.5242 -7.5284 {"}'S' sky -10.707 0.7211 -7.7765 {HG11 VAL 115 A}'S' sky -13.6252 -0.2557 -7.5398 {"}'S' sky -13.467 -0.1789 -7.3566 {"}'S' blue -13.3166 -0.0475 -7.1981 {"}'S' blue -13.6865 -0.1486 -8.0155 {"}'S' sky -13.5307 -0.1728 -7.8073 {"}'S' blue -13.5842 0.0591 -8.2496 {"}'S' sky -13.4471 -0.0159 -8.0501 {"}'S' sky -13.296 0.1793 -8.141 {"}'S' blue -13.171 0.4048 -8.1857 {"}'S' blue -13.0106 0.5025 -8.0059 {HG21 VAL 115 A}'S' blue -12.7558 0.5228 -8.8585 {"}'S' blue -12.5974 0.6093 -8.677 {"}'S' sky -12.6099 0.4343 -9.0763 {"}'S' sky -12.4513 0.4987 -8.8896 {"}'S' sky -12.2983 0.6148 -8.7241 {"}'S' blue -12.509 0.4055 -9.3694 {"}'S' sky -12.3497 0.436 -9.1722 {"}'S' sky -12.1917 0.5217 -8.9912 {"}'S' blue -12.0416 0.6576 -8.8358 {"}'S' blue -12.1873 0.4681 -9.3814 {"}'S' sky -12.0296 0.5441 -9.1986 {"}'S' sky -11.8792 0.6755 -9.0401 {"}'S' sky -11.93 0.5991 -9.4527 {"}'S' sky -11.7728 0.7175 -9.2819 {"}'S' blue -11.6972 0.8132 -9.5183 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 115 A}'S' sea -12.6435 0.3472 -7.5252 {"}'S' sea -12.4949 0.2934 -7.3183 {"}'S' sea -12.3376 0.2771 -7.1098 {"}'S' sea -12.6495 0.5127 -8.0068 {"}'S' green -12.5228 0.3971 -7.8106 {"}'S' green -12.3807 0.3187 -7.6054 {"}'S' green -12.3933 0.5056 -8.0892 {"}'S' green -12.265 0.4021 -7.8935 {"}'S' sea -12.1801 0.5824 -8.2254 {"}'S' green -12.0532 0.4737 -8.0305 {"}'S' sea -11.9437 0.6651 -8.3005 {"}'S' green -11.8125 0.5598 -8.1022 { CG1 VAL 115 A}'S' sea -12.9315 0.1307 -7.3088 {"}'S' sea -12.9958 0.3166 -7.7604 {"}'S' sea -12.8456 0.2745 -7.5557 {"}'S' sea -12.6871 0.2865 -7.3538 { HB VAL 115 A}'S' sea -12.1104 0.2137 -6.7165 {"}'S' sea -11.953 0.2316 -6.5174 {"}'S' green -12.1779 0.1929 -7.2072 {"}'S' green -12.0406 0.1114 -7.0078 {"}'S' green -11.8886 0.0856 -6.8045 {"}'S' green -11.7292 0.1161 -6.6072 {"}'S' sea -11.5708 0.2026 -6.4258 {"}'S' green -11.4247 0.092 -6.6384 {"}'S' green -11.3231 0.0293 -6.9209 {"}'S' sea -11.1651 0.115 -6.7399 {"}'S' green -11.7683 0.5366 -8.0468 {"}'S' green -11.1608 0.0614 -7.1302 {"}'S' sea -11.5255 0.6302 -8.1277 {"}'S' green -11.4611 0.4213 -7.9851 {"}'S' green -11.0667 0.1435 -7.398 {"}'S' sea -11.278 0.7394 -8.1441 {"}'S' green -11.2229 0.5282 -8.0154 {"}'S' green -11.1203 0.3754 -7.8403 {"}'S' green -10.9831 0.3004 -7.6409 {"}'S' sea -10.8268 0.3112 -7.4416 {"}'S' sea -10.9654 0.5983 -7.9324 {"}'S' sea -10.832 0.4955 -7.7318 {HG11 VAL 115 A}'S' sea -13.3674 -0.1239 -7.6107 {"}'S' sea -13.2102 -0.0055 -7.4399 {"}'S' sea -13.2908 -0.0051 -7.8508 {"}'S' sea -13.1346 0.0903 -7.6763 {"}'S' sea -13.1324 0.2079 -7.9377 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB VAL 115 A}'S' P -12.1238 0.3352 -7.6922 {"}'S' -12.124 0.3406 -7.6902 { HB VAL 115 A}'S' P -12.1257 0.2923 -7.5994 {"}'S' -12.1195 0.3016 -7.5949 {"}'S' P -12.0169 0.1516 -7.4203 {"}'S' -11.9981 0.191 -7.4071 {"}'S' P -11.8862 0.0572 -7.2253 {"}'S' -11.875 0.0939 -7.2201 {"}'S' P -11.7389 0.0156 -7.023 {"}'S' -11.7377 0.0269 -7.0239 {"}'S' P -11.5833 0.0275 -6.8251 {"}'S' -11.5832 0.0317 -6.8259 {"}'S' P -11.8876 0.2369 -7.7074 {"}'S' -11.8694 0.2848 -7.6763 {"}'S' P -11.7714 0.1052 -7.522 {"}'S' -11.7551 0.1827 -7.49 {"}'S' P -11.6349 0.0238 -7.3219 {"}'S' -11.63 0.0879 -7.3094 {"}'S' P -11.4825 -0.0012 -7.1182 {"}'S' -11.4824 0.0002 -7.1184 {"}'S' P -11.6972 0.3402 -7.9014 {"}'S' -11.6947 0.356 -7.8863 {"}'S' P -11.5947 0.1875 -7.7264 {"}'S' -11.5915 0.2441 -7.6889 {"}'S' P -11.4662 0.0867 -7.5312 {"}'S' -11.4702 0.1477 -7.5061 {"}'S' P -11.3189 0.0436 -7.3287 {"}'S' -11.3216 0.0587 -7.3255 {"}'S' P -11.3574 0.2625 -7.8071 {"}'S' -11.359 0.2703 -7.8009 {"}'S' P -11.2225 0.1677 -7.6062 {"}'S' -11.222 0.1685 -7.6058 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 52 A}'M' green -9.1161 2.2476 -5.8258 {"}'M' green -8.5969 3.0095 -6.2487 {"}'M' green -8.8184 2.9501 -6.883 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 52 A}'M' greentint -9.2751 2.1589 -6.0074 {"}'M' greentint -9.4186 2.0512 -6.2799 {"}'M' greentint -9.0131 2.4802 -5.8748 {"}'M' greentint -9.1764 2.4468 -6.0766 {"}'M' greentint -9.325 2.2899 -6.2251 {"}'M' greentint -9.4287 2.1935 -6.5226 {"}'M' greentint -8.8692 2.6853 -5.9368 {"}'M' greentint -9.0271 2.6769 -6.1388 {"}'M' greentint -9.1857 2.5838 -6.3172 {"}'M' greentint -9.325 2.4158 -6.4504 {"}'M' greentint -9.3983 2.2875 -6.7674 {"}'M' greentint -8.684 2.8554 -6.0028 {"}'M' greentint -8.8401 2.8661 -6.2066 {"}'M' greentint -9.0003 2.8078 -6.3986 {"}'M' greentint -9.1551 2.6847 -6.5633 {"}'M' greentint -9.2908 2.5072 -6.6895 {"}'M' greentint -8.757 2.9854 -6.45 {"}'M' greentint -8.9195 2.9038 -6.6364 {"}'M' greentint -9.0717 2.7679 -6.7964 {"}'M' greentint -9.2083 2.5863 -6.9212 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H VAL 115 A}'M' green -9.0409 2.7634 -7.0027 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 115 A}'M' greentint -9.433 2.0938 -6.5519 {"}'M' greentint -9.2748 2.096 -6.3482 {"}'M' greentint -9.1142 2.172 -6.1613 {"}'M' greentint -8.9646 2.3174 -6.0089 {"}'M' greentint -8.8401 2.5173 -5.9031 {"}'M' greentint -9.3299 2.2565 -6.807 {"}'M' greentint -9.1811 2.2069 -6.6009 {"}'M' greentint -9.0188 2.2518 -6.4029 {"}'M' greentint -8.8646 2.3844 -6.2412 {"}'M' greentint -8.7403 2.5877 -6.1366 {"}'M' greentint -8.6621 2.8334 -6.1045 {"}'M' greentint -9.2019 2.4921 -6.9695 {"}'M' greentint -9.0702 2.3903 -6.7713 {"}'M' greentint -8.9092 2.4184 -6.5713 {"}'M' greentint -8.7611 2.5703 -6.4225 {"}'M' greentint -8.6663 2.8045 -6.3651 {"}'M' greentint -8.9367 2.6082 -6.8248 {"}'M' greentint -8.7767 2.7051 -6.6454 {"}'M' greentint -8.7217 2.9584 -6.6452 {"}'M' greentint -8.855 2.8548 -6.8447 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 52 A}'M' green -10.0349 0.6391 -4.187 {"}'M' green -10.1682 0.5355 -4.3865 {"}'M' green -9.688 1.0018 -4.0622 {"}'M' green -9.5645 1.3953 -5.0171 {"}'M' green -9.7147 1.2709 -5.1769 {"}'M' green -9.8478 1.0953 -5.3 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 52 A}'M' greentint -9.9532 0.8857 -4.2069 {"}'M' greentint -10.1132 0.7888 -4.3863 {"}'M' greentint -10.2236 0.6894 -4.6666 {"}'M' greentint -9.8197 1.1035 -4.2604 {"}'M' greentint -9.9807 1.0755 -4.4604 {"}'M' greentint -10.1288 0.9235 -4.6092 {"}'M' greentint -10.1953 0.7868 -4.9202 {"}'M' greentint -9.6313 1.2734 -4.327 {"}'M' greentint -9.7902 1.2765 -4.5329 {"}'M' greentint -9.9505 1.1855 -4.7158 {"}'M' greentint -10.0919 1.0149 -4.8513 {"}'M' greentint -10.0985 0.8611 -5.1602 {"}'M' greentint -9.5344 1.4081 -4.5825 {"}'M' greentint -9.6958 1.3689 -4.7804 {"}'M' greentint -9.8524 1.2569 -4.9518 {"}'M' greentint -9.991 1.0821 -5.0825 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 115 A}'M' green -10.2026 0.5956 -4.3516 {"}'M' green -10.0508 0.7163 -4.1887 {"}'M' green -9.9104 0.8783 -4.0527 {"}'M' green -10.2578 0.6 -4.7869 {"}'M' green -9.5022 1.4299 -4.3589 {"}'M' green -10.0648 0.9173 -5.2005 {"}'M' green -9.9305 1.1252 -5.2762 {"}'M' green -9.5223 1.5444 -4.8653 {"}'M' green -9.6591 1.4523 -5.1338 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 115 A}'M' greentint -10.0952 0.6557 -4.5927 {"}'M' greentint -9.9374 0.7659 -4.4193 {"}'M' greentint -9.792 0.9277 -4.2763 {"}'M' greentint -9.6674 1.1301 -4.1727 {"}'M' greentint -10.1834 0.7354 -5.046 {"}'M' greentint -10.0242 0.7578 -4.8455 {"}'M' greentint -9.8645 0.8464 -4.6645 {"}'M' greentint -9.7178 0.996 -4.5169 {"}'M' greentint -9.5941 1.1958 -4.4122 {"}'M' greentint -9.906 0.9283 -4.9996 {"}'M' greentint -9.7489 1.0242 -4.8222 {"}'M' greentint -9.6105 1.1948 -4.6907 {"}'M' greentint -9.5076 1.4183 -4.6198 {"}'M' greentint -9.7673 1.1544 -5.0736 {"}'M' greentint -9.6176 1.3081 -4.9228 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n asn A 37 1kr4A_39F_58A}P -12.144 -1.2801 0.5969 {"}-12.144 -1.2801 0.5969 { ca asn A 37 1kr4A_39F_58A}-11.1132 -1.9764 -0.1577 { c asn A 37 1kr4A_39F_58A}-10.8644 -1.0632 -1.3419 { o asn A 37 1kr4A_39F_58A}-11.7691 -0.8083 -2.1358 { c asn A 37 1kr4A_39F_58A}P -10.8644 -1.0632 -1.3419 { n ala A 38 1kr4A_39F_58A}-9.6418 -0.5704 -1.4614 { ca ala A 38 1kr4A_39F_58A}-9.3201 0.3418 -2.544 { c ala A 38 1kr4A_39F_58A}-8.262 -0.2552 -3.4514 { o ala A 38 1kr4A_39F_58A}-7.4012 -1.0086 -3.0086 { c ala A 38 1kr4A_39F_58A}P -8.262 -0.2552 -3.4514 { n phe A 39 1kr4A_39F_58A}-8.3382 0.0735 -4.7346 { ca phe A 39 1kr4A_39F_58A}-7.3701 -0.4427 -5.6928 { c phe A 39 1kr4A_39F_58A}-7.1547 0.5384 -6.8271 { o phe A 39 1kr4A_39F_58A}-8.0362 1.3369 -7.1444 { c phe A 39 1kr4A_39F_58A}P -7.1547 0.5384 -6.8271 { n glu A 40 1kr4A_39F_58A}-5.9675 0.4881 -7.423 { ca glu A 40 1kr4A_39F_58A}-5.6319 1.3756 -8.5237 { c glu A 40 1kr4A_39F_58A}-6.3637 0.9787 -9.8007 { o glu A 40 1kr4A_39F_58A}-6.4897 -0.2026 -10.1134 { c glu A 40 1kr4A_39F_58A}P -6.3637 0.9787 -9.8007 { n ile A 41 1kr4A_39F_58A}-6.8381 1.9751 -10.5363 { ca ile A 41 1kr4A_39F_58A}-7.5385 1.7296 -11.788 { c ile A 41 1kr4A_39F_58A}-7.1181 2.7101 -12.8674 { o ile A 41 1kr4A_39F_58A}-6.5591 3.7717 -12.585 { n glu A 56 1kr4A_39F_58A}P -6.7504 6.547 -11.5643 {"}-6.7504 6.547 -11.5643 { ca glu A 56 1kr4A_39F_58A}-7.4447 6.8655 -10.3269 { c glu A 56 1kr4A_39F_58A}-7.3417 5.7058 -9.3609 { o glu A 56 1kr4A_39F_58A}-6.6316 4.7308 -9.6049 { c glu A 56 1kr4A_39F_58A}P -7.3417 5.7058 -9.3609 { n trp A 57 1kr4A_39F_58A}-8.0459 5.8413 -8.2439 { ca trp A 57 1kr4A_39F_58A}-8.1123 4.784 -7.2576 { c trp A 57 1kr4A_39F_58A}-9.5848 4.5627 -6.9811 { o trp A 57 1kr4A_39F_58A}-10.3193 5.5039 -6.6841 { c trp A 57 1kr4A_39F_58A}P -9.5848 4.5627 -6.9811 { n ala A 58 1kr4A_39F_58A}-10.0201 3.3169 -7.1225 { ca ala A 58 1kr4A_39F_58A}-11.4052 2.9653 -6.8745 { c ala A 58 1kr4A_39F_58A}-11.4889 2.4288 -5.4584 { o ala A 58 1kr4A_39F_58A}-10.4792 2.0417 -4.8717 { c ala A 58 1kr4A_39F_58A}P -11.4889 2.4288 -5.4584 { n ala A 59 1kr4A_39F_58A}-12.6923 2.4163 -4.9078 { ca ala A 59 1kr4A_39F_58A}-12.8718 1.8897 -3.572 { c ala A 59 1kr4A_39F_58A}-14.2652 1.3315 -3.4283 { o ala A 59 1kr4A_39F_58A}-15.2277 1.8924 -3.949 { c ala A 59 1kr4A_39F_58A}P -14.2652 1.3315 -3.4283 { n ile A 60 1kr4A_39F_58A}-14.3624 0.1917 -2.7541 { ca ile A 60 1kr4A_39F_58A}-15.6641 -0.3836 -2.4846 { c ile A 60 1kr4A_39F_58A}-15.8334 -0.2132 -0.9862 { o ile A 60 1kr4A_39F_58A}-14.9135 -0.4827 -0.2023 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n asn A 37 1kr4A_39F_58A}P -12.144 -1.2801 0.5969 { ca asn A 37 1kr4A_39F_58A}P -11.1132 -1.9764 -0.1577 { n ala A 38 1kr4A_39F_58A}P -9.6418 -0.5704 -1.4614 { ca ala A 38 1kr4A_39F_58A}P -9.3201 0.3418 -2.544 { n phe A 39 1kr4A_39F_58A}P -8.3382 0.0735 -4.7346 { ca phe A 39 1kr4A_39F_58A}P -7.3701 -0.4427 -5.6928 { n glu A 40 1kr4A_39F_58A}P -5.9675 0.4881 -7.423 { ca glu A 40 1kr4A_39F_58A}P -5.6319 1.3756 -8.5237 { n ile A 41 1kr4A_39F_58A}P -6.8381 1.9751 -10.5363 { ca ile A 41 1kr4A_39F_58A}P -7.5385 1.7296 -11.788 { n glu A 56 1kr4A_39F_58A}P -6.7504 6.547 -11.5643 { ca glu A 56 1kr4A_39F_58A}P -7.4447 6.8655 -10.3269 { n trp A 57 1kr4A_39F_58A}P -8.0459 5.8413 -8.2439 { ca trp A 57 1kr4A_39F_58A}P -8.1123 4.784 -7.2576 { n ala A 58 1kr4A_39F_58A}P -10.0201 3.3169 -7.1225 { ca ala A 58 1kr4A_39F_58A}P -11.4052 2.9653 -6.8745 { n ala A 59 1kr4A_39F_58A}P -12.6923 2.4163 -4.9078 { ca ala A 59 1kr4A_39F_58A}P -12.8718 1.8897 -3.572 { n ile A 60 1kr4A_39F_58A}P -14.3624 0.1917 -2.7541 { ca ile A 60 1kr4A_39F_58A}P -15.6641 -0.3836 -2.4846 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca asn A 37 1kr4A_39F_58A}P -11.1132 -1.9764 -0.1577 {"}-11.1132 -1.9764 -0.1577 { ca ala A 38 1kr4A_39F_58A}-9.3201 0.3418 -2.544 { ca phe A 39 1kr4A_39F_58A}-7.3701 -0.4427 -5.6928 { ca glu A 40 1kr4A_39F_58A}-5.6319 1.3756 -8.5237 { ca ile A 41 1kr4A_39F_58A}-7.5385 1.7296 -11.788 { ca glu A 56 1kr4A_39F_58A}P -7.4447 6.8655 -10.3269 {"}-7.4447 6.8655 -10.3269 { ca trp A 57 1kr4A_39F_58A}-8.1123 4.784 -7.2576 { ca ala A 58 1kr4A_39F_58A}-11.4052 2.9653 -6.8745 { ca ala A 59 1kr4A_39F_58A}-12.8718 1.8897 -3.572 { ca ile A 60 1kr4A_39F_58A}-15.6641 -0.3836 -2.4846 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 39 1kr4A_39F_58A}P -7.3701 -0.4427 -5.6928 { cb phe A 39 1kr4A_39F_58A}-7.8146 -1.8078 -6.2535 { cg phe A 39 1kr4A_39F_58A}-9.2358 -1.8433 -6.7661 { cd1 phe A 39 1kr4A_39F_58A}-10.3094 -1.887 -5.8807 { ce1 phe A 39 1kr4A_39F_58A}-11.6234 -1.9715 -6.3466 { cz phe A 39 1kr4A_39F_58A}-11.8732 -2.0132 -7.7192 { cg phe A 39 1kr4A_39F_58A}P -9.2358 -1.8433 -6.7661 { cd2 phe A 39 1kr4A_39F_58A}-9.4985 -1.8799 -8.137 { ce2 phe A 39 1kr4A_39F_58A}-10.8103 -1.9664 -8.6131 { cz phe A 39 1kr4A_39F_58A}ghost -11.8732 -2.0132 -7.7192 { ca ala A 58 1kr4A_39F_58A}P -11.4052 2.9653 -6.8745 { cb ala A 58 1kr4A_39F_58A}-11.8606 1.8952 -7.8576 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 39 1kr4A_39F_58A}P -7.8146 -1.8078 -6.2535 {"}P -7.8146 -1.8078 -6.2535 { cd1 phe A 39 1kr4A_39F_58A}P -10.3094 -1.887 -5.8807 { cd2 phe A 39 1kr4A_39F_58A}P -9.4985 -1.8799 -8.137 { ce1 phe A 39 1kr4A_39F_58A}P -11.6234 -1.9715 -6.3466 { ce2 phe A 39 1kr4A_39F_58A}P -10.8103 -1.9664 -8.6131 { cz phe A 39 1kr4A_39F_58A}P -11.8732 -2.0132 -7.7192 { cb ala A 58 1kr4A_39F_58A}P -11.8606 1.8952 -7.8576 {"}P -11.8606 1.8952 -7.8576 {"}P -11.8606 1.8952 -7.8576 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 39 A}'S' blue -10.2973 -0.3638 -7.7823 { CE1 PHE 39 A}'S' blue -11.4649 -0.2955 -6.8253 {"}'S' blue -11.6281 -0.3562 -7.0191 {"}'S' blue -11.2497 -0.3736 -6.9542 { CE2 PHE 39 A}'S' sky -10.908 -0.4741 -7.7049 {"}'S' sky -11.3472 -0.3285 -8.3128 {"}'S' blue -11.5076 -0.3647 -8.5101 {"}'S' blue -10.6424 -0.4492 -7.7576 {"}'S' sky -10.7703 -0.3463 -7.9526 {"}'S' sky -11.2223 -0.2664 -8.5596 {"}'S' sky -10.5741 -0.3024 -8.1251 {"}'S' sky -10.7209 -0.2416 -8.3327 {"}'S' sky -10.8775 -0.2187 -8.5401 { CZ PHE 39 A}'S' sky -11.637 -0.3492 -7.2311 {"}'S' sky -11.7838 -0.2884 -7.4388 {"}'S' sky -11.9404 -0.2654 -7.6462 {"}'S' blue -12.102 -0.2829 -7.8511 {"}'S' sky -11.3176 -0.4294 -7.2257 {"}'S' sky -11.9236 -0.2945 -8.0455 {"}'S' blue -11.1096 -0.4761 -7.3768 {"}'S' sky -11.7147 -0.3372 -8.1979 {"}'S' sky -11.0344 -0.4774 -7.7077 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 39 A}'S' sea -11.0434 -0.3839 -7.9037 {"}'S' sea -11.1913 -0.3341 -8.1087 {"}'S' sea -10.9128 -0.2804 -8.1555 {"}'S' sea -11.0647 -0.2532 -8.359 { CZ PHE 39 A}'S' sea -11.4555 -0.3383 -7.4281 {"}'S' sea -11.6046 -0.2853 -7.6355 {"}'S' sea -11.7615 -0.271 -7.8429 {"}'S' sea -11.2467 -0.3852 -7.5798 {"}'S' sea -11.3954 -0.3314 -7.7867 {"}'S' sea -11.553 -0.3142 -7.9941 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 58 A}'S' blue -12.1342 0.169 -7.9486 { HB3 ALA 58 A}'S' blue -11.9508 0.0887 -7.572 {"}'S' sky -11.8035 0.0456 -7.3694 {"}'S' blue -11.6461 0.0635 -7.1703 {"}'S' blue -11.488 0.1403 -6.9871 {"}'S' sky -11.871 0.0248 -7.8602 {"}'S' sky -11.4223 -0.052 -7.2602 {"}'S' blue -11.2639 0.0345 -7.0787 {"}'S' sky -11.71 -0.0165 -8.0732 {"}'S' blue -11.1178 -0.0761 -7.2913 {"}'S' sky -11.4645 -0.0629 -8.1749 {"}'S' sky -11.0162 -0.1388 -7.5738 {"}'S' sky -11.2878 0.0194 -8.3793 {"}'S' sky -10.8539 -0.1067 -7.7831 {"}'S' sky -11.0505 0.0944 -8.46 {"}'S' sky -10.9156 -0.0004 -8.2591 {"}'S' sky -10.7598 -0.0246 -8.051 {"}'S' blue -10.5966 0.0243 -7.8544 {"}'S' blue -10.6762 0.1323 -8.2938 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 58 A}'S' sea -11.7337 -0.0567 -7.6607 {"}'S' sea -11.5817 -0.0825 -7.4574 {"}'S' sea -11.5793 -0.1109 -7.8782 {"}'S' sea -11.432 -0.1525 -7.6759 {"}'S' sea -11.2764 -0.1406 -7.478 {"}'S' sea -11.328 -0.1443 -7.9748 {"}'S' sea -11.1756 -0.1693 -7.7711 {"}'S' sea -11.1593 -0.0814 -8.1841 {"}'S' sea -11.012 -0.1245 -7.9816 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 39 A}'M' greentint -9.2582 1.8603 -6.7057 {"}'M' greentint -9.362 1.764 -7.0032 {"}'M' greentint -8.9604 2.2474 -6.6194 {"}'M' greentint -9.119 2.1542 -6.7978 {"}'M' greentint -9.2582 1.9863 -6.931 {"}'M' greentint -9.3316 1.858 -7.248 {"}'M' greentint -9.4027 1.6129 -7.2722 {"}'M' greentint -8.7734 2.4365 -6.6873 {"}'M' greentint -8.9336 2.3783 -6.8793 {"}'M' greentint -9.0884 2.2552 -7.0439 {"}'M' greentint -9.2241 2.0776 -7.1701 {"}'M' greentint -9.2537 1.9382 -7.4863 {"}'M' greentint -9.3349 1.695 -7.5247 {"}'M' greentint -8.6907 2.5565 -6.9314 {"}'M' greentint -8.8527 2.4743 -7.117 {"}'M' greentint -9.005 2.3384 -7.277 {"}'M' greentint -9.1416 2.1568 -7.4018 {"}'M' greentint -9.1392 1.9829 -7.7159 {"}'M' greentint -9.2247 1.7481 -7.7605 {"}'M' greentint -8.5958 2.6193 -7.1903 {"}'M' greentint -8.7517 2.5206 -7.3637 {"}'M' greentint -8.8978 2.377 -7.5136 {"}'M' greentint -9.0286 2.195 -7.632 {"}'M' greentint -8.9882 2.0047 -7.9247 {"}'M' greentint -8.5959 2.5479 -7.5689 {"}'M' greentint -8.7426 2.4007 -7.7187 {"}'M' greentint -8.8747 2.2178 -7.8387 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 58 A}'M' greentint -9.4019 1.6024 -7.0875 {"}'M' greentint -9.2469 1.6995 -6.915 {"}'M' greentint -9.1056 1.8503 -6.7734 {"}'M' greentint -8.985 2.0446 -6.6717 {"}'M' greentint -8.8925 2.2706 -6.6157 {"}'M' greentint -9.2912 1.5623 -7.3628 {"}'M' greentint -9.133 1.626 -7.1765 {"}'M' greentint -8.9827 1.7505 -7.0167 {"}'M' greentint -8.8496 1.9261 -6.8936 {"}'M' greentint -8.7444 2.1407 -6.8159 {"}'M' greentint -8.6709 2.3805 -6.789 {"}'M' greentint -9.2406 1.6213 -7.7139 {"}'M' greentint -9.0824 1.6235 -7.5101 {"}'M' greentint -8.9217 1.6995 -7.3233 {"}'M' greentint -8.7722 1.8449 -7.1709 {"}'M' greentint -8.6476 2.0448 -7.065 {"}'M' greentint -8.559 2.2824 -7.017 {"}'M' greentint -8.5145 2.5372 -7.0297 {"}'M' greentint -8.9887 1.7344 -7.7628 {"}'M' greentint -8.8264 1.7793 -7.5648 {"}'M' greentint -8.6721 1.9119 -7.4031 {"}'M' greentint -8.5479 2.1152 -7.2985 {"}'M' greentint -8.4696 2.3609 -7.2664 {"}'M' greentint -8.4486 2.6163 -7.3097 {"}'M' greentint -8.8777 1.9178 -7.9332 {"}'M' greentint -8.7167 1.9459 -7.7333 {"}'M' greentint -8.5687 2.0978 -7.5844 {"}'M' greentint -8.4739 2.332 -7.5271 {"}'M' greentint -8.4576 2.5857 -7.5764 {"}'M' greentint -8.7442 2.1357 -7.9868 {"}'M' greentint -8.5842 2.2326 -7.8073 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 39 A}'M' greentint -9.7332 1.0899 -4.5406 {"}'M' greentint -9.8932 0.993 -4.72 {"}'M' greentint -10.0036 0.8936 -5.0003 {"}'M' greentint -9.468 1.206 -4.3959 {"}'M' greentint -9.5997 1.3077 -4.5941 {"}'M' greentint -9.7607 1.2797 -4.7941 {"}'M' greentint -9.9088 1.1277 -4.9429 {"}'M' greentint -9.9753 0.991 -5.2539 {"}'M' greentint -9.4113 1.4776 -4.6607 {"}'M' greentint -9.5702 1.4807 -4.8667 {"}'M' greentint -9.7304 1.3897 -5.0495 {"}'M' greentint -9.8718 1.2192 -5.1851 {"}'M' greentint -9.8784 1.0653 -5.4939 {"}'M' greentint -9.3144 1.6123 -4.9162 {"}'M' greentint -9.4757 1.5731 -5.1141 {"}'M' greentint -9.6324 1.4611 -5.2855 {"}'M' greentint -9.7709 1.2863 -5.4162 {"}'M' greentint -9.1862 1.6632 -5.1645 {"}'M' greentint -9.3444 1.5995 -5.3508 {"}'M' greentint -9.4947 1.4751 -5.5106 {"}'M' greentint -9.6278 1.2995 -5.6337 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 58 A}'M' green -9.1454 1.6338 -4.7499 {"}'M' green -9.5736 1.329 -5.6673 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 58 A}'M' greentint -10.0038 0.7254 -4.9264 {"}'M' greentint -9.8457 0.7994 -4.7426 {"}'M' greentint -9.6939 0.9201 -4.5797 {"}'M' greentint -9.5536 1.0821 -4.4437 {"}'M' greentint -9.901 0.8038 -5.1779 {"}'M' greentint -9.7383 0.8595 -4.9838 {"}'M' greentint -9.5805 0.9698 -4.8103 {"}'M' greentint -9.4352 1.1315 -4.6673 {"}'M' greentint -9.3105 1.3339 -4.5637 {"}'M' greentint -9.8266 0.9392 -5.437 {"}'M' greentint -9.6674 0.9617 -5.2365 {"}'M' greentint -9.5077 1.0502 -5.0555 {"}'M' greentint -9.361 1.1998 -4.9079 {"}'M' greentint -9.2373 1.3996 -4.8032 {"}'M' greentint -9.708 1.1211 -5.5915 {"}'M' greentint -9.5491 1.1322 -5.3906 {"}'M' greentint -9.3921 1.228 -5.2132 {"}'M' greentint -9.2536 1.3986 -5.0817 {"}'M' greentint -9.1507 1.6221 -5.0109 {"}'M' greentint -9.4105 1.3582 -5.4646 {"}'M' greentint -9.2607 1.5119 -5.3138 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 124 1krhA_126F_171}P -12.0325 -1.9994 0.6742 {"}-12.0325 -1.9994 0.6742 { ca ile A 124 1krhA_126F_171}-11.0238 -2.3068 -0.3344 { c ile A 124 1krhA_126F_171}-10.7427 -1.0571 -1.1496 { o ile A 124 1krhA_126F_171}-11.6639 -0.3268 -1.4988 { c ile A 124 1krhA_126F_171}P -10.7427 -1.0571 -1.1496 { n thr A 125 1krhA_126F_171}-9.4789 -0.7942 -1.4474 { ca thr A 125 1krhA_126F_171}-9.1572 0.3443 -2.2964 { c thr A 125 1krhA_126F_171}-8.2784 -0.1909 -3.4031 { o thr A 125 1krhA_126F_171}-7.4326 -1.0515 -3.1683 { c thr A 125 1krhA_126F_171}P -8.2784 -0.1909 -3.4031 { n phe A 126 1krhA_126F_171}-8.4948 0.2903 -4.6204 { ca phe A 126 1krhA_126F_171}-7.6712 -0.1727 -5.7233 { c phe A 126 1krhA_126F_171}-7.5314 0.8661 -6.8151 { o phe A 126 1krhA_126F_171}-8.3538 1.7709 -6.9496 { c phe A 126 1krhA_126F_171}P -7.5314 0.8661 -6.8151 { n asp A 127 1krhA_126F_171}-6.4428 0.7545 -7.5678 { ca asp A 127 1krhA_126F_171}-6.1804 1.679 -8.6557 { c asp A 127 1krhA_126F_171}-6.1016 0.9434 -9.9777 { o asp A 127 1krhA_126F_171}-5.5671 -0.1637 -10.0557 { c asp A 127 1krhA_126F_171}P -6.1016 0.9434 -9.9777 { n ile A 128 1krhA_126F_171}-6.6604 1.5597 -11.0087 { ca ile A 128 1krhA_126F_171}-6.5873 1.0041 -12.3473 { c ile A 128 1krhA_126F_171}-5.7776 2.0059 -13.1473 { o ile A 128 1krhA_126F_171}-6.16 3.1705 -13.2796 { n thr A 169 1krhA_126F_171}P -6.42 5.7958 -12.0537 {"}-6.42 5.7958 -12.0537 { ca thr A 169 1krhA_126F_171}-7.751 5.9605 -11.484 { c thr A 169 1krhA_126F_171}-7.85 5.2138 -10.1655 { o thr A 169 1krhA_126F_171}-7.1984 4.192 -9.9678 { c thr A 169 1krhA_126F_171}P -7.85 5.2138 -10.1655 { n gly A 170 1krhA_126F_171}-8.6691 5.7356 -9.2578 { ca gly A 170 1krhA_126F_171}-8.8128 5.1151 -7.9524 { c gly A 170 1krhA_126F_171}-10.2498 4.8542 -7.5601 { o gly A 170 1krhA_126F_171}-11.1608 5.546 -8.0199 { c gly A 170 1krhA_126F_171}P -10.2498 4.8542 -7.5601 { n phe A 171 1krhA_126F_171}-10.4391 3.8539 -6.6985 { ca phe A 171 1krhA_126F_171}-11.7598 3.4455 -6.223 { c phe A 171 1krhA_126F_171}-11.7243 3.0151 -4.7639 { o phe A 171 1krhA_126F_171}-10.6854 2.5935 -4.2491 { c phe A 171 1krhA_126F_171}P -11.7243 3.0151 -4.7639 { n val A 172 1krhA_126F_171}-12.873 3.1348 -4.1039 { ca val A 172 1krhA_126F_171}-13.0308 2.7328 -2.7069 { c val A 172 1krhA_126F_171}-14.256 1.8204 -2.7053 { o val A 172 1krhA_126F_171}-15.3573 2.2529 -3.0275 { c val A 172 1krhA_126F_171}P -14.256 1.8204 -2.7053 { n val A 173 1krhA_126F_171}-14.0578 0.5547 -2.3402 { ca val A 173 1krhA_126F_171}-15.1264 -0.4372 -2.3851 { c val A 173 1krhA_126F_171}-15.4317 -1.1894 -1.0927 { o val A 173 1krhA_126F_171}-14.5307 -1.5716 -0.3481 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 124 1krhA_126F_171}P -12.0325 -1.9994 0.6742 { ca ile A 124 1krhA_126F_171}P -11.0238 -2.3068 -0.3344 { n thr A 125 1krhA_126F_171}P -9.4789 -0.7942 -1.4474 { ca thr A 125 1krhA_126F_171}P -9.1572 0.3443 -2.2964 { n phe A 126 1krhA_126F_171}P -8.4948 0.2903 -4.6204 { ca phe A 126 1krhA_126F_171}P -7.6712 -0.1727 -5.7233 { n asp A 127 1krhA_126F_171}P -6.4428 0.7545 -7.5678 { ca asp A 127 1krhA_126F_171}P -6.1804 1.679 -8.6557 { n ile A 128 1krhA_126F_171}P -6.6604 1.5597 -11.0087 { ca ile A 128 1krhA_126F_171}P -6.5873 1.0041 -12.3473 { n thr A 169 1krhA_126F_171}P -6.42 5.7958 -12.0537 { ca thr A 169 1krhA_126F_171}P -7.751 5.9605 -11.484 { n gly A 170 1krhA_126F_171}P -8.6691 5.7356 -9.2578 { ca gly A 170 1krhA_126F_171}P -8.8128 5.1151 -7.9524 {"}P -8.8128 5.1151 -7.9524 { n phe A 171 1krhA_126F_171}P -10.4391 3.8539 -6.6985 { ca phe A 171 1krhA_126F_171}P -11.7598 3.4455 -6.223 { n val A 172 1krhA_126F_171}P -12.873 3.1348 -4.1039 { ca val A 172 1krhA_126F_171}P -13.0308 2.7328 -2.7069 { n val A 173 1krhA_126F_171}P -14.0578 0.5547 -2.3402 { ca val A 173 1krhA_126F_171}P -15.1264 -0.4372 -2.3851 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 124 1krhA_126F_171}P -11.0238 -2.3068 -0.3344 {"}-11.0238 -2.3068 -0.3344 { ca thr A 125 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0.5605 -9.0737 {"}'S' P -10.7666 0.5624 -9.3699 {"}'S' -10.7673 0.5653 -9.3699 { HB2 PHE 171 A}'S' P -12.1877 0.3331 -6.7861 {"}'S' -12.1758 0.3591 -6.7878 {"}'S' P -12.0357 0.3074 -6.5828 {"}'S' -12.0299 0.3271 -6.5879 {"}'S' P -12.164 0.3734 -7.1987 {"}'S' -12.151 0.4014 -7.189 {"}'S' P -12.0333 0.279 -7.0036 {"}'S' -12.0092 0.3579 -6.9938 {"}'S' P -11.886 0.2373 -6.8013 {"}'S' -11.8718 0.3251 -6.807 {"}'S' P -11.7305 0.2493 -6.6034 {"}'S' -11.7287 0.2984 -6.6139 {"}'S' P -11.9185 0.3269 -7.3003 {"}'S' -11.9063 0.3844 -7.2762 {"}'S' P -11.782 0.2456 -7.1002 {"}'S' -11.7737 0.3478 -7.0797 {"}'S' P -11.6296 0.2206 -6.8965 {"}'S' -11.6346 0.3161 -6.8943 {"}'S' P -11.4702 0.251 -6.6993 {"}'S' -11.478 0.2904 -6.7053 {"}'S' P -11.7418 0.4092 -7.5047 {"}'S' -11.7412 0.4134 -7.5014 {"}'S' P -11.6133 0.3084 -7.3096 {"}'S' -11.6167 0.3631 -7.2874 {"}'S' P -11.4661 0.2654 -7.107 {"}'S' -11.4779 0.3295 -7.0934 {"}'S' P -11.3083 0.2824 -6.909 {"}'S' -11.3161 0.3051 -6.9077 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 126 A}'M' green -9.367 2.252 -6.1116 {"}'M' green -9.5759 2.2943 -6.5109 {"}'M' green -8.9822 2.6104 -6.0229 {"}'M' green -8.7958 2.7815 -6.0874 {"}'M' green -9.5417 2.5116 -6.9753 {"}'M' green -8.6949 2.978 -6.3276 {"}'M' green -9.3226 2.7723 -7.0822 {"}'M' green -8.7543 3.1044 -6.8033 {"}'M' green -8.9134 3.0533 -6.9955 {"}'M' green -9.0693 2.9545 -7.1688 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 126 A}'M' greentint -9.264 2.4846 -6.1606 {"}'M' greentint -9.4273 2.4512 -6.3624 {"}'M' greentint -9.1201 2.6897 -6.2226 {"}'M' greentint -9.278 2.6813 -6.4246 {"}'M' greentint -9.4366 2.5882 -6.603 {"}'M' greentint -9.5758 2.4202 -6.7362 {"}'M' greentint -8.9349 2.8598 -6.2886 {"}'M' greentint -9.091 2.8705 -6.4925 {"}'M' greentint -9.2512 2.8122 -6.6844 {"}'M' greentint -9.406 2.6892 -6.8491 {"}'M' greentint -8.8478 3.0139 -6.5345 {"}'M' greentint -9.0083 2.9905 -6.7366 {"}'M' greentint -9.1703 2.9083 -6.9222 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 171 A}'M' green -9.5395 2.3245 -6.2767 {"}'M' green -9.3813 2.3882 -6.0904 {"}'M' green -9.6302 2.4565 -6.8308 {"}'M' green -8.7962 2.8774 -6.2124 {"}'M' green -8.7221 3.0941 -6.4409 {"}'M' green -9.0967 3.053 -7.0784 {"}'M' green -8.9108 3.1444 -6.9205 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 171 A}'M' greentint -9.4889 2.3835 -6.6277 {"}'M' greentint -9.3307 2.3857 -6.424 {"}'M' greentint -9.17 2.4617 -6.2371 {"}'M' greentint -9.0205 2.607 -6.0847 {"}'M' greentint -9.3857 2.5462 -6.8827 {"}'M' greentint -9.237 2.4965 -6.6766 {"}'M' greentint -9.0746 2.5414 -6.4787 {"}'M' greentint -8.9204 2.6741 -6.317 {"}'M' greentint -9.2577 2.7817 -7.0452 {"}'M' greentint -9.126 2.68 -6.8471 {"}'M' greentint -8.965 2.7081 -6.6471 {"}'M' greentint -8.8169 2.86 -6.4982 {"}'M' greentint -8.9925 2.8978 -6.9006 {"}'M' greentint -8.8325 2.9948 -6.7212 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 126 A}'M' sea -9.9744 1.1311 -4.2559 {"}'M' sea -9.7885 1.2225 -4.0979 {"}'M' green -9.8927 1.3777 -4.2758 {"}'M' green -10.0527 1.2808 -4.4552 {"}'M' sea -10.1631 1.1814 -4.7355 {"}'M' green -9.6275 1.4938 -4.1311 {"}'M' sea -10.1348 1.2789 -4.9891 {"}'M' sea -9.4359 1.6706 -4.195 {"}'M' green -10.0314 1.507 -4.9203 {"}'M' sea -9.3223 1.8646 -4.4463 {"}'M' green -9.4739 1.9001 -4.6514 {"}'M' green -9.6353 1.861 -4.8493 {"}'M' green -9.7919 1.7489 -5.0207 {"}'M' sea -9.9305 1.5742 -5.1514 {"}'M' sea -9.3458 1.9511 -4.8997 {"}'M' sea -9.504 1.8874 -5.086 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 126 A}'M' greentint -9.7592 1.5956 -4.3293 {"}'M' greentint -9.9202 1.5675 -4.5293 {"}'M' greentint -10.0683 1.4155 -4.6781 {"}'M' greentint -9.5708 1.7654 -4.3959 {"}'M' greentint -9.7297 1.7686 -4.6018 {"}'M' greentint -9.8899 1.6775 -4.7847 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 171 A}'M' sky -10.368 1.2533 -4.5005 {"}'M' sky -9.9001 1.4719 -3.9571 {"}'M' sky -9.6672 2.1106 -5.0798 @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 171 A}'M' sea -10.21 1.2772 -4.3037 {"}'M' sea -10.052 1.3513 -4.12 {"}'M' green -10.2644 1.3602 -4.7609 {"}'M' green -10.1072 1.3556 -4.5553 {"}'M' green -9.9446 1.4113 -4.3611 {"}'M' green -9.7867 1.5216 -4.1877 {"}'M' sea -9.6414 1.6833 -4.0447 {"}'M' sea -10.1808 1.5381 -5.0188 {"}'M' green -9.5672 1.7516 -4.2853 {"}'M' sea -9.4435 1.9514 -4.1806 {"}'M' sea -10.0525 1.7498 -5.1704 {"}'M' green -9.9142 1.673 -4.9689 {"}'M' green -9.4599 1.9504 -4.4591 {"}'M' green -9.7799 1.8808 -5.0446 {"}'M' green -9.6167 1.91 -4.842 {"}'M' green -9.4669 2.0638 -4.6912 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 171 A}'M' greentint -10.0328 1.491 -4.8144 {"}'M' greentint -9.8736 1.5135 -4.6139 {"}'M' greentint -9.7139 1.602 -4.4329 {"}'M' greentint -9.7554 1.684 -4.768 {"}'M' greentint -9.5983 1.7799 -4.5906 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 18 1kthA_33F_20K}P -6.8695 6.0642 -11.3298 {"}-6.8695 6.0642 -11.3298 { ca ile A 18 1kthA_33F_20K}-7.8683 6.5703 -10.3958 { c ile A 18 1kthA_33F_20K}-7.9839 5.5361 -9.2908 { o ile A 18 1kthA_33F_20K}-8.0727 4.3033 -9.5426 { c ile A 18 1kthA_33F_20K}P -7.9839 5.5361 -9.2908 { n leu A 19 1kthA_33F_20K}-8.0272 6.0368 -8.0596 { ca leu A 19 1kthA_33F_20K}-8.2425 5.1933 -6.9054 { c leu A 19 1kthA_33F_20K}-9.7288 4.8755 -6.7572 { o leu A 19 1kthA_33F_20K}-10.5383 5.8094 -6.6054 { c leu A 19 1kthA_33F_20K}P -9.7288 4.8755 -6.7572 { n lys A 20 1kthA_33F_20K}-10.043 3.6181 -6.8535 { ca lys A 20 1kthA_33F_20K}-11.3932 3.0844 -6.8443 { c lys A 20 1kthA_33F_20K}-11.5432 2.1293 -5.6574 { o lys A 20 1kthA_33F_20K}-10.5876 1.8525 -4.9254 { c lys A 20 1kthA_33F_20K}P -11.5432 2.1293 -5.6574 { n trp A 21 1kthA_33F_20K}-12.7587 1.6239 -5.5081 { ca trp A 21 1kthA_33F_20K}-13.0708 0.623 -4.4895 { c trp A 21 1kthA_33F_20K}-13.6678 -0.5978 -5.1789 { o trp A 21 1kthA_33F_20K}-14.4291 -0.4988 -6.1668 { c trp A 21 1kthA_33F_20K}P -13.6678 -0.5978 -5.1789 { n tyr A 22 1kthA_33F_20K}-13.3673 -1.778 -4.6423 { ca tyr A 22 1kthA_33F_20K}-13.9706 -3.0388 -5.0988 { c tyr A 22 1kthA_33F_20K}-14.4369 -3.8084 -3.8738 { o tyr A 22 1kthA_33F_20K}-13.8959 -3.6422 -2.7502 { n ala A 31 1kthA_33F_20K}P -12.5396 -2.5274 -0.5034 {"}-12.5396 -2.5274 -0.5034 { ca ala A 31 1kthA_33F_20K}-11.1284 -2.1232 -0.3465 { c ala A 31 1kthA_33F_20K}-10.7325 -1.2549 -1.5399 { o ala A 31 1kthA_33F_20K}-11.3509 -1.3252 -2.6288 { c ala A 31 1kthA_33F_20K}P -10.7325 -1.2549 -1.5399 { n arg A 32 1kthA_33F_20K}-9.6729 -0.4901 -1.3804 { ca arg A 32 1kthA_33F_20K}-9.1926 0.3783 -2.4346 { c arg A 32 1kthA_33F_20K}-8.3603 -0.3772 -3.4451 { o arg A 32 1kthA_33F_20K}-7.6531 -1.3325 -3.0928 { c arg A 32 1kthA_33F_20K}P -8.3603 -0.3772 -3.4451 { n phe A 33 1kthA_33F_20K}-8.3514 0.1288 -4.6917 { ca phe A 33 1kthA_33F_20K}-7.4111 -0.3771 -5.6869 { c phe A 33 1kthA_33F_20K}-7.1838 0.7558 -6.7131 { o phe A 33 1kthA_33F_20K}-8.0387 1.6211 -6.8863 { c phe A 33 1kthA_33F_20K}P -7.1838 0.7558 -6.7131 { n trp A 34 1kthA_33F_20K}-6.0366 0.6739 -7.3684 { ca trp A 34 1kthA_33F_20K}-5.7594 1.6136 -8.4532 { c trp A 34 1kthA_33F_20K}-6.2055 1.0506 -9.7957 { o trp A 34 1kthA_33F_20K}-5.7644 -0.0603 -10.156 { c trp A 34 1kthA_33F_20K}P -6.2055 1.0506 -9.7957 { n tyr A 35 1kthA_33F_20K}-7.0335 1.8043 -10.4911 { ca tyr A 35 1kthA_33F_20K}-7.4951 1.416 -11.8143 { c tyr A 35 1kthA_33F_20K}-6.7901 2.2556 -12.8571 { o tyr A 35 1kthA_33F_20K}-6.7927 3.487 -12.7864 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 18 1kthA_33F_20K}P -6.8695 6.0642 -11.3298 { ca ile A 18 1kthA_33F_20K}P -7.8683 6.5703 -10.3958 { n leu A 19 1kthA_33F_20K}P -8.0272 6.0368 -8.0596 { ca leu A 19 1kthA_33F_20K}P -8.2425 5.1933 -6.9054 { n lys A 20 1kthA_33F_20K}P -10.043 3.6181 -6.8535 { ca lys A 20 1kthA_33F_20K}P -11.3932 3.0844 -6.8443 { n trp A 21 1kthA_33F_20K}P -12.7587 1.6239 -5.5081 { ca trp A 21 1kthA_33F_20K}P -13.0708 0.623 -4.4895 { n tyr A 22 1kthA_33F_20K}P -13.3673 -1.778 -4.6423 { ca tyr A 22 1kthA_33F_20K}P -13.9706 -3.0388 -5.0988 { n ala A 31 1kthA_33F_20K}P -12.5396 -2.5274 -0.5034 { ca ala A 31 1kthA_33F_20K}P -11.1284 -2.1232 -0.3465 { n arg A 32 1kthA_33F_20K}P -9.6729 -0.4901 -1.3804 { ca arg A 32 1kthA_33F_20K}P -9.1926 0.3783 -2.4346 { n phe A 33 1kthA_33F_20K}P -8.3514 0.1288 -4.6917 { ca phe A 33 1kthA_33F_20K}P -7.4111 -0.3771 -5.6869 { n trp A 34 1kthA_33F_20K}P -6.0366 0.6739 -7.3684 { ca trp A 34 1kthA_33F_20K}P -5.7594 1.6136 -8.4532 { n tyr A 35 1kthA_33F_20K}P -7.0335 1.8043 -10.4911 { ca tyr A 35 1kthA_33F_20K}P -7.4951 1.416 -11.8143 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 18 1kthA_33F_20K}P -7.8683 6.5703 -10.3958 {"}-7.8683 6.5703 -10.3958 { ca leu A 19 1kthA_33F_20K}-8.2425 5.1933 -6.9054 { ca lys A 20 1kthA_33F_20K}-11.3932 3.0844 -6.8443 { ca trp A 21 1kthA_33F_20K}-13.0708 0.623 -4.4895 { ca tyr A 22 1kthA_33F_20K}-13.9706 -3.0388 -5.0988 { ca ala A 31 1kthA_33F_20K}P -11.1284 -2.1232 -0.3465 {"}-11.1284 -2.1232 -0.3465 { ca arg A 32 1kthA_33F_20K}-9.1926 0.3783 -2.4346 { ca phe A 33 1kthA_33F_20K}-7.4111 -0.3771 -5.6869 { ca trp A 34 1kthA_33F_20K}-5.7594 1.6136 -8.4532 { ca tyr A 35 1kthA_33F_20K}-7.4951 1.416 -11.8143 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca lys A 20 1kthA_33F_20K}P -11.3932 3.0844 -6.8443 { cb lys A 20 1kthA_33F_20K}-11.6559 2.3326 -8.1442 { cg lys A 20 1kthA_33F_20K}-11.6367 3.2102 -9.4034 { cd lys A 20 1kthA_33F_20K}-12.8557 4.1096 -9.4857 { ce lys A 20 1kthA_33F_20K}-13.0004 4.7001 -10.876 { nz lys A 20 1kthA_33F_20K}-14.2424 5.4827 -11.028 { ca phe A 33 1kthA_33F_20K}P -7.4111 -0.3771 -5.6869 { cb phe A 33 1kthA_33F_20K}-7.8636 -1.6443 -6.3868 { cg phe A 33 1kthA_33F_20K}-8.9922 -1.4888 -7.425 { cd1 phe A 33 1kthA_33F_20K}-10.282 -1.2595 -7.0408 { ce1 phe A 33 1kthA_33F_20K}-11.3226 -1.1946 -7.9703 { cz phe A 33 1kthA_33F_20K}-11.0197 -1.335 -9.293 { cg phe A 33 1kthA_33F_20K}P -8.9922 -1.4888 -7.425 { cd2 phe A 33 1kthA_33F_20K}-8.7009 -1.6171 -8.7696 { ce2 phe A 33 1kthA_33F_20K}-9.706 -1.5219 -9.7123 { cz phe A 33 1kthA_33F_20K}ghost -11.0197 -1.335 -9.293 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb lys A 20 1kthA_33F_20K}P -11.6559 2.3326 -8.1442 {"}P -11.6559 2.3326 -8.1442 { cg lys A 20 1kthA_33F_20K}P -11.6367 3.2102 -9.4034 {"}P -11.6367 3.2102 -9.4034 { cd lys A 20 1kthA_33F_20K}P -12.8557 4.1096 -9.4857 {"}P -12.8557 4.1096 -9.4857 { ce lys A 20 1kthA_33F_20K}P -13.0004 4.7001 -10.876 {"}P -13.0004 4.7001 -10.876 { nz lys A 20 1kthA_33F_20K}P -14.2424 5.4827 -11.028 {"}P -14.2424 5.4827 -11.028 {"}P -14.2424 5.4827 -11.028 { cb phe A 33 1kthA_33F_20K}P -7.8636 -1.6443 -6.3868 {"}P -7.8636 -1.6443 -6.3868 { cd1 phe A 33 1kthA_33F_20K}P -10.282 -1.2595 -7.0408 { cd2 phe A 33 1kthA_33F_20K}P -8.7009 -1.6171 -8.7696 { ce1 phe A 33 1kthA_33F_20K}P -11.3226 -1.1946 -7.9703 { ce2 phe A 33 1kthA_33F_20K}P -9.706 -1.5219 -9.7123 { cz phe A 33 1kthA_33F_20K}P -11.0197 -1.335 -9.293 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 33 A}'S' blue -10.8548 0.3881 -7.1797 {"}'S' blue -10.5108 0.4709 -7.1726 {"}'S' sky -10.6747 0.4142 -7.3683 {"}'S' sky -10.3324 0.4592 -7.3671 {"}'S' blue -10.1235 0.4165 -7.5195 {"}'S' sky -10.2867 0.3559 -7.7133 {"}'S' blue -10.0718 0.2812 -7.8434 {"}'S' blue -10.2338 0.1859 -8.026 { CE1 PHE 33 A}'S' blue -11.9603 0.3364 -7.4126 {"}'S' blue -12.1214 0.3215 -7.6156 {"}'S' blue -12.2842 0.2589 -7.8084 {"}'S' blue -11.5557 0.3879 -7.2609 {"}'S' sky -11.7036 0.4377 -7.4659 {"}'S' sky -12.1806 0.3287 -8.0519 {"}'S' sky -12.0527 0.3632 -8.2883 {"}'S' sky -11.6975 0.3641 -8.6711 { CZ PHE 33 A}'S' blue -11.5567 0.303 -8.9927 {"}'S' sky -11.2741 0.3782 -9.0389 {"}'S' sky -11.0869 0.4128 -9.2199 {"}'S' blue -10.3418 0.1242 -8.6056 {"}'S' sky -10.4641 0.2488 -8.7995 {"}'S' sky -10.602 0.3399 -9.0019 {"}'S' sky -10.7511 0.3929 -9.2092 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 33 A}'S' sea -10.496 0.3978 -7.5613 { CE1 PHE 33 A}'S' sea -11.8595 0.4433 -7.67 {"}'S' sea -12.0199 0.4071 -7.8673 {"}'S' sea -11.425 0.4914 -7.5127 {"}'S' green -11.5769 0.5186 -7.7162 {"}'S' green -11.7346 0.5054 -7.9167 {"}'S' green -11.8954 0.4529 -8.1092 {"}'S' sea -11.0864 0.4694 -7.4822 {"}'S' green -11.2332 0.5302 -7.6899 {"}'S' green -11.5514 0.5357 -8.1021 {"}'S' green -11.7153 0.479 -8.2978 {"}'S' sea -11.8764 0.3853 -8.4796 {"}'S' sea -10.767 0.3892 -7.4768 {"}'S' green -10.9049 0.4802 -7.6792 {"}'S' green -11.5366 0.4626 -8.4908 {"}'S' green -10.6961 0.4333 -7.8309 {"}'S' green -11.3273 0.4207 -8.6428 {"}'S' green -10.4838 0.3411 -7.9588 {"}'S' green -10.6314 0.4007 -8.1657 {"}'S' green -10.9489 0.4033 -8.578 {"}'S' green -11.1124 0.346 -8.773 {"}'S' sea -10.4235 0.2751 -8.2766 {"}'S' green -10.5754 0.3036 -8.4805 {"}'S' sea -10.733 0.2919 -8.6812 { CZ PHE 33 A}'S' sea -11.1222 0.3511 -8.8353 {"}'S' sea -10.7835 0.329 -8.8049 {"}'S' sea -10.9303 0.3898 -9.0126 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 33 A}'S' P -11.3898 0.5531 -7.8973 {"}'S' -11.3896 0.5467 -7.8972 {"}'S' P -11.054 0.5332 -7.8865 {"}'S' -11.0604 0.4898 -7.8888 {"}'S' P -11.2109 0.5475 -8.094 {"}'S' -11.2148 0.4888 -8.0893 {"}'S' P -11.373 0.5241 -8.2966 {"}'S' -11.3725 0.4997 -8.292 {"}'S' P -10.8447 0.4871 -8.0378 {"}'S' -10.858 0.4426 -8.0355 {"}'S' P -11.0024 0.5044 -8.2452 {"}'S' -11.0145 0.4411 -8.2353 {"}'S' P -11.1641 0.4813 -8.449 {"}'S' -11.1673 0.4515 -8.4398 {"}'S' P -10.7873 0.4221 -8.3733 {"}'S' -10.7939 0.4036 -8.3696 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 20 A}'S' blue -12.2755 0.7228 -7.8512 {"}'S' sky -12.1158 0.7198 -7.6442 {"}'S' blue -11.9528 0.7566 -7.4435 {"}'S' blue -12.2778 0.7022 -8.2769 {"}'S' sky -12.1287 0.6492 -8.0696 {"}'S' sky -11.6461 0.7198 -7.4653 {"}'S' blue -11.4856 0.8175 -7.2854 {"}'S' sky -12.0781 0.6602 -8.4421 {"}'S' sky -11.2865 0.7695 -7.4484 {"}'S' blue -11.9574 0.7101 -8.7276 {"}'S' blue -11.6996 0.7151 -8.8105 {"}'S' blue -11.4878 0.7868 -8.9474 { HB2 LYS 20 A}'S' sky -10.4919 0.742 -7.5027 {"}'S' sky -11.2473 0.6101 -8.874 {"}'S' sky -10.3747 0.6241 -7.7512 {"}'S' blue -10.2406 0.804 -7.6278 {"}'S' sky -11.0569 0.7134 -9.0681 {"}'S' blue -10.2123 0.642 -7.9555 {"}'S' blue -10.8207 0.7945 -9.1517 {"}'S' sky -10.7171 0.6357 -8.9738 { HB3 LYS 20 A}'S' blue -12.4173 0.6989 -7.9079 @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 20 A}'S' sea -11.971 0.6348 -7.8627 {"}'S' sea -11.8089 0.6583 -7.6601 {"}'S' sea -11.9295 0.6065 -8.2352 {"}'S' green -11.7722 0.5901 -8.0268 {"}'S' green -11.6101 0.6122 -7.824 {"}'S' sea -11.4478 0.673 -7.6296 {"}'S' sea -11.8153 0.6317 -8.5224 {"}'S' green -11.6629 0.5909 -8.3151 { HB2 LYS 20 A}'S' green -11.4701 0.5869 -7.8831 {"}'S' green -11.3127 0.6048 -7.6841 {"}'S' sea -11.1545 0.6816 -7.5008 {"}'S' green -11.5376 0.5661 -8.3739 {"}'S' green -10.9305 0.5758 -7.5924 {"}'S' green -11.3765 0.5248 -8.5869 {"}'S' green -10.7844 0.4652 -7.805 {"}'S' sea -10.6314 0.5813 -7.6395 {"}'S' green -11.1311 0.4784 -8.6886 {"}'S' green -10.5248 0.4882 -7.9066 {"}'S' sea -10.9543 0.5607 -8.893 {"}'S' green -10.8259 0.4599 -8.6979 {"}'S' green -10.6786 0.4168 -8.4953 {"}'S' green -10.5209 0.4338 -8.2972 {"}'S' sea -10.3627 0.5106 -8.114 {"}'S' sea -10.5822 0.5409 -8.7729 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 LYS 20 A}'S' P -11.4002 0.4846 -8.1744 {"}'S' -11.3884 0.5106 -8.1761 {"}'S' P -11.2483 0.4588 -7.9711 {"}'S' -11.2344 0.503 -7.9827 {"}'S' P -11.0889 0.4893 -7.7739 {"}'S' -11.0864 0.5072 -7.7814 {"}'S' P -11.2458 0.4304 -8.3919 {"}'S' -11.2361 0.4633 -8.3878 {"}'S' P -11.0985 0.3888 -8.1896 {"}'S' -11.0878 0.4561 -8.1937 {"}'S' P -10.943 0.4007 -7.9917 {"}'S' -10.9407 0.4545 -8.0042 {"}'S' P -10.9945 0.397 -8.4885 {"}'S' -10.9929 0.4193 -8.4845 {"}'S' P -10.8421 0.372 -8.2848 {"}'S' -10.8449 0.4125 -8.2841 {"}'S' P -10.6828 0.4025 -8.0876 {"}'S' -10.6856 0.4152 -8.0893 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 33 A}'M' greentint -9.1121 2.3014 -6.2991 {"}'M' greentint -9.2607 2.1445 -6.4476 {"}'M' greentint -9.3644 2.0482 -6.7451 {"}'M' greentint -8.9629 2.5316 -6.3613 {"}'M' greentint -9.1215 2.4384 -6.5397 {"}'M' greentint -9.2607 2.2705 -6.6729 {"}'M' greentint -9.334 2.1422 -6.9899 {"}'M' greentint -8.7759 2.7207 -6.4291 {"}'M' greentint -8.9361 2.6624 -6.6211 {"}'M' greentint -9.0909 2.5394 -6.7858 {"}'M' greentint -9.2266 2.3618 -6.912 {"}'M' greentint -9.2562 2.2224 -7.2281 {"}'M' greentint -9.3374 1.9792 -7.2665 {"}'M' greentint -8.5327 2.8641 -6.4712 {"}'M' greentint -8.6928 2.8401 -6.6725 {"}'M' greentint -8.8552 2.7585 -6.8589 {"}'M' greentint -9.0075 2.6225 -7.0189 {"}'M' greentint -9.1441 2.441 -7.1437 {"}'M' greentint -9.1417 2.2671 -7.4578 {"}'M' greentint -8.4392 2.9546 -6.74 {"}'M' greentint -8.5983 2.9035 -6.9322 {"}'M' greentint -8.7541 2.8048 -7.1055 {"}'M' greentint -8.9003 2.6612 -7.2554 {"}'M' greentint -9.0311 2.4792 -7.3738 {"}'M' greentint -8.4416 2.938 -7.1376 {"}'M' greentint -8.5984 2.8321 -7.3108 {"}'M' greentint -8.7451 2.6849 -7.4606 {"}'M' greentint -8.8772 2.502 -7.5805 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 20 A}'M' greentint -9.3089 1.9557 -6.6276 {"}'M' greentint -9.154 2.0529 -6.4552 {"}'M' greentint -9.0127 2.2037 -6.3135 {"}'M' greentint -8.8921 2.3979 -6.2118 {"}'M' greentint -9.3526 1.9164 -7.1021 {"}'M' greentint -9.1983 1.9157 -6.903 {"}'M' greentint -9.0401 1.9794 -6.7167 {"}'M' greentint -8.8898 2.1038 -6.5568 {"}'M' greentint -8.7567 2.2794 -6.4337 {"}'M' greentint -8.6514 2.4941 -6.356 {"}'M' greentint -8.578 2.7339 -6.3291 {"}'M' greentint -9.1477 1.9746 -7.254 {"}'M' greentint -8.9895 1.9769 -7.0502 {"}'M' greentint -8.8288 2.0528 -6.8634 {"}'M' greentint -8.6793 2.1982 -6.711 {"}'M' greentint -8.5547 2.3982 -6.6052 {"}'M' greentint -8.4661 2.6358 -6.5571 {"}'M' greentint -8.4216 2.8905 -6.5698 {"}'M' greentint -9.0445 2.1373 -7.509 {"}'M' greentint -8.8958 2.0877 -7.3029 {"}'M' greentint -8.7334 2.1326 -7.105 {"}'M' greentint -8.5792 2.2652 -6.9433 {"}'M' greentint -8.455 2.4685 -6.8386 {"}'M' greentint -8.3767 2.7142 -6.8065 {"}'M' greentint -8.3557 2.9696 -6.8498 {"}'M' greentint -8.9165 2.3729 -7.6715 {"}'M' greentint -8.7848 2.2712 -7.4734 {"}'M' greentint -8.6238 2.2992 -7.2734 {"}'M' greentint -8.4757 2.4512 -7.1245 {"}'M' greentint -8.3809 2.6853 -7.0672 {"}'M' greentint -8.3646 2.939 -7.1165 {"}'M' greentint -8.6513 2.489 -7.5269 {"}'M' greentint -8.4913 2.5859 -7.3475 {"}'M' greentint -8.4364 2.8392 -7.3472 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 33 A}'M' greentint -9.7387 1.0216 -4.4112 {"}'M' greentint -9.872 0.918 -4.6107 {"}'M' greentint -9.6571 1.2682 -4.4311 {"}'M' greentint -9.817 1.1712 -4.6105 {"}'M' greentint -9.9274 1.0719 -4.8908 {"}'M' greentint -9.9437 0.8182 -4.8415 {"}'M' greentint -9.5236 1.486 -4.4846 {"}'M' greentint -9.6846 1.4579 -4.6846 {"}'M' greentint -9.8326 1.306 -4.8334 {"}'M' greentint -9.8992 1.1693 -5.1444 {"}'M' greentint -9.9496 0.9146 -5.1398 {"}'M' greentint -9.9409 0.6668 -5.0594 {"}'M' greentint -9.3352 1.6559 -4.5512 {"}'M' greentint -9.494 1.659 -4.7572 {"}'M' greentint -9.6543 1.568 -4.94 {"}'M' greentint -9.7957 1.3974 -5.0756 {"}'M' greentint -9.8023 1.2436 -5.3844 {"}'M' greentint -9.8706 0.9946 -5.4021 {"}'M' greentint -9.8911 0.7414 -5.3586 {"}'M' greentint -9.2383 1.7906 -4.8067 {"}'M' greentint -9.3996 1.7514 -5.0046 {"}'M' greentint -9.5562 1.6394 -5.176 {"}'M' greentint -9.6948 1.4646 -5.3067 {"}'M' greentint -9.6569 1.2631 -5.602 {"}'M' greentint -9.7304 1.0233 -5.6289 {"}'M' greentint -9.2683 1.7778 -5.2413 {"}'M' greentint -9.4185 1.6533 -5.4011 {"}'M' greentint -9.5517 1.4777 -5.5242 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 20 A}'M' greentint -9.8023 0.731 -4.6334 {"}'M' greentint -9.662 0.893 -4.4974 {"}'M' greentint -9.54 1.0896 -4.3944 {"}'M' greentint -9.4416 1.3144 -4.3283 {"}'M' greentint -9.8467 0.6704 -5.0374 {"}'M' greentint -9.6889 0.7806 -4.864 {"}'M' greentint -9.5435 0.9424 -4.721 {"}'M' greentint -9.4189 1.1448 -4.6174 {"}'M' greentint -9.3224 1.3779 -4.5575 {"}'M' greentint -9.2587 1.6296 -4.545 {"}'M' greentint -9.7758 0.7725 -5.2902 {"}'M' greentint -9.616 0.8611 -5.1092 {"}'M' greentint -9.4693 1.0107 -4.9616 {"}'M' greentint -9.3456 1.2105 -4.8569 {"}'M' greentint -9.2537 1.4446 -4.8036 {"}'M' greentint -9.2018 1.6955 -4.8052 {"}'M' greentint -9.6575 0.943 -5.4443 {"}'M' greentint -9.5005 1.0389 -5.2669 {"}'M' greentint -9.362 1.2095 -5.1354 {"}'M' greentint -9.2591 1.433 -5.0645 {"}'M' greentint -9.2046 1.6827 -5.0642 {"}'M' greentint -9.5189 1.1691 -5.5183 {"}'M' greentint -9.3691 1.3228 -5.3675 {"}'M' greentint -9.2738 1.5591 -5.31 {"}'M' greentint -9.4106 1.467 -5.5785 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu B 246 1kw6B_248F_261}P -10.7119 -0.2267 1.485 {"}-10.7119 -0.2267 1.485 { ca leu B 246 1kw6B_248F_261}-10.5564 -1.3944 0.6158 { c leu B 246 1kw6B_248F_261}-10.7416 -0.8762 -0.8169 { o leu B 246 1kw6B_248F_261}-11.8071 -0.3886 -1.1728 { c leu B 246 1kw6B_248F_261}P -10.7416 -0.8762 -0.8169 { n ser B 247 1kw6B_248F_261}-9.6947 -0.9566 -1.6353 { ca ser B 247 1kw6B_248F_261}-9.7209 -0.3281 -2.9475 { c ser B 247 1kw6B_248F_261}-8.8644 -1.047 -3.959 { o ser B 247 1kw6B_248F_261}-8.142 -1.9915 -3.6498 { c ser B 247 1kw6B_248F_261}P -8.8644 -1.047 -3.959 { n phe B 248 1kw6B_248F_261}-8.9272 -0.5444 -5.1883 { ca phe B 248 1kw6B_248F_261}-7.9636 -0.9023 -6.2161 { c phe B 248 1kw6B_248F_261}-7.5812 0.3794 -6.9379 { o phe B 248 1kw6B_248F_261}-8.2463 1.4166 -6.8038 { c phe B 248 1kw6B_248F_261}P -7.5812 0.3794 -6.9379 { n tyr B 249 1kw6B_248F_261}-6.4831 0.3047 -7.6842 { ca tyr B 249 1kw6B_248F_261}-6.0107 1.4164 -8.4954 { c tyr B 249 1kw6B_248F_261}-6.0725 1.044 -9.9781 { o tyr B 249 1kw6B_248F_261}-5.9539 -0.1282 -10.3465 { c tyr B 249 1kw6B_248F_261}P -6.0725 1.044 -9.9781 { n ala B 250 1kw6B_248F_261}-6.2543 2.0592 -10.8137 { ca ala B 250 1kw6B_248F_261}-6.2824 1.8898 -12.2609 { c ala B 250 1kw6B_248F_261}-5.7271 3.1365 -12.9434 { o ala B 250 1kw6B_248F_261}-5.7175 4.2186 -12.3689 { n val B 259 1kw6B_248F_261}P -6.4149 6.4479 -10.8406 {"}-6.4149 6.4479 -10.8406 { ca val B 259 1kw6B_248F_261}-7.609 6.6189 -10.0338 { c val B 259 1kw6B_248F_261}-7.6088 5.482 -9.005 { o val B 259 1kw6B_248F_261}-7.1228 4.3795 -9.2682 { c val B 259 1kw6B_248F_261}P -7.6088 5.482 -9.005 { n glu B 260 1kw6B_248F_261}-8.133 5.7779 -7.8188 { ca glu B 260 1kw6B_248F_261}-8.36 4.7776 -6.7916 { c glu B 260 1kw6B_248F_261}-9.8709 4.7293 -6.5506 { o glu B 260 1kw6B_248F_261}-10.5237 5.7638 -6.4709 { c glu B 260 1kw6B_248F_261}P -9.8709 4.7293 -6.5506 { n phe B 261 1kw6B_248F_261}-10.4087 3.5231 -6.4362 { ca phe B 261 1kw6B_248F_261}-11.8447 3.3099 -6.2756 { c phe B 261 1kw6B_248F_261}-11.9788 2.3969 -5.0613 { o phe B 261 1kw6B_248F_261}-11.4898 1.2785 -5.0688 { c phe B 261 1kw6B_248F_261}P -11.9788 2.3969 -5.0613 { n gly B 262 1kw6B_248F_261}-12.6146 2.8895 -4.0022 { ca gly B 262 1kw6B_248F_261}-12.5914 2.175 -2.7344 { c gly B 262 1kw6B_248F_261}-13.8468 2.2356 -1.8922 { o gly B 262 1kw6B_248F_261}-14.8242 2.8988 -2.2584 { c gly B 262 1kw6B_248F_261}P -13.8468 2.2356 -1.8922 { n trp B 263 1kw6B_248F_261}-13.7838 1.5536 -0.7515 { ca trp B 263 1kw6B_248F_261}-14.9046 1.3839 0.1648 { c trp B 263 1kw6B_248F_261}-14.4417 1.1773 1.6051 { o trp B 263 1kw6B_248F_261}-13.3497 0.6889 1.8506 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu B 246 1kw6B_248F_261}P -10.7119 -0.2267 1.485 { ca leu B 246 1kw6B_248F_261}P -10.5564 -1.3944 0.6158 { n ser B 247 1kw6B_248F_261}P -9.6947 -0.9566 -1.6353 { ca ser B 247 1kw6B_248F_261}P -9.7209 -0.3281 -2.9475 { n phe B 248 1kw6B_248F_261}P -8.9272 -0.5444 -5.1883 { ca phe B 248 1kw6B_248F_261}P -7.9636 -0.9023 -6.2161 { n tyr B 249 1kw6B_248F_261}P -6.4831 0.3047 -7.6842 { ca tyr B 249 1kw6B_248F_261}P -6.0107 1.4164 -8.4954 { n ala B 250 1kw6B_248F_261}P -6.2543 2.0592 -10.8137 { ca ala B 250 1kw6B_248F_261}P -6.2824 1.8898 -12.2609 { n val B 259 1kw6B_248F_261}P -6.4149 6.4479 -10.8406 { ca val B 259 1kw6B_248F_261}P -7.609 6.6189 -10.0338 { n glu B 260 1kw6B_248F_261}P -8.133 5.7779 -7.8188 { ca glu B 260 1kw6B_248F_261}P -8.36 4.7776 -6.7916 { n phe B 261 1kw6B_248F_261}P -10.4087 3.5231 -6.4362 { ca phe B 261 1kw6B_248F_261}P -11.8447 3.3099 -6.2756 { n gly B 262 1kw6B_248F_261}P -12.6146 2.8895 -4.0022 { ca gly B 262 1kw6B_248F_261}P -12.5914 2.175 -2.7344 {"}P -12.5914 2.175 -2.7344 { n trp B 263 1kw6B_248F_261}P -13.7838 1.5536 -0.7515 { ca trp B 263 1kw6B_248F_261}P -14.9046 1.3839 0.1648 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu B 246 1kw6B_248F_261}P -10.5564 -1.3944 0.6158 {"}-10.5564 -1.3944 0.6158 { ca ser B 247 1kw6B_248F_261}-9.7209 -0.3281 -2.9475 { ca phe B 248 1kw6B_248F_261}-7.9636 -0.9023 -6.2161 { ca tyr B 249 1kw6B_248F_261}-6.0107 1.4164 -8.4954 { ca ala B 250 1kw6B_248F_261}-6.2824 1.8898 -12.2609 { ca val B 259 1kw6B_248F_261}P -7.609 6.6189 -10.0338 {"}-7.609 6.6189 -10.0338 { ca glu B 260 1kw6B_248F_261}-8.36 4.7776 -6.7916 { ca phe B 261 1kw6B_248F_261}-11.8447 3.3099 -6.2756 { ca gly B 262 1kw6B_248F_261}-12.5914 2.175 -2.7344 { ca trp B 263 1kw6B_248F_261}-14.9046 1.3839 0.1648 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe B 248 1kw6B_248F_261}P -7.9636 -0.9023 -6.2161 { cb phe B 248 1kw6B_248F_261}-8.4945 -1.9263 -7.2105 { cg phe B 248 1kw6B_248F_261}-9.6051 -1.401 -8.0571 { cd1 phe B 248 1kw6B_248F_261}-9.3557 -0.8381 -9.3006 { ce1 phe B 248 1kw6B_248F_261}-10.3816 -0.3263 -10.0677 { cz phe B 248 1kw6B_248F_261}-11.6752 -0.3703 -9.5992 { cg phe B 248 1kw6B_248F_261}P -9.6051 -1.401 -8.0571 { cd2 phe B 248 1kw6B_248F_261}-10.9092 -1.4351 -7.5983 { ce2 phe B 248 1kw6B_248F_261}-11.9305 -0.9208 -8.3631 { cz phe B 248 1kw6B_248F_261}ghost -11.6752 -0.3703 -9.5992 { ca phe B 261 1kw6B_248F_261}P -11.8447 3.3099 -6.2756 { cb phe B 261 1kw6B_248F_261}-12.4043 2.6845 -7.5539 { cg phe B 261 1kw6B_248F_261}-13.9117 2.6713 -7.6528 { cd1 phe B 261 1kw6B_248F_261}-14.5655 3.4785 -8.5718 { ce1 phe B 261 1kw6B_248F_261}-15.9471 3.456 -8.6813 { cz phe B 261 1kw6B_248F_261}-16.6802 2.6077 -7.8952 { cg phe B 261 1kw6B_248F_261}P -13.9117 2.6713 -7.6528 { cd2 phe B 261 1kw6B_248F_261}-14.6667 1.8261 -6.8685 { ce2 phe B 261 1kw6B_248F_261}-16.051 1.7918 -6.9839 { cz phe B 261 1kw6B_248F_261}ghost -16.6802 2.6077 -7.8952 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe B 248 1kw6B_248F_261}P -8.4945 -1.9263 -7.2105 {"}P -8.4945 -1.9263 -7.2105 { cd1 phe B 248 1kw6B_248F_261}P -9.3557 -0.8381 -9.3006 { cd2 phe B 248 1kw6B_248F_261}P -10.9092 -1.4351 -7.5983 { ce1 phe B 248 1kw6B_248F_261}P -10.3816 -0.3263 -10.0677 { ce2 phe B 248 1kw6B_248F_261}P -11.9305 -0.9208 -8.3631 { cz phe B 248 1kw6B_248F_261}P -11.6752 -0.3703 -9.5992 { cb phe B 261 1kw6B_248F_261}P -12.4043 2.6845 -7.5539 {"}P -12.4043 2.6845 -7.5539 { cd1 phe B 261 1kw6B_248F_261}P -14.5655 3.4785 -8.5718 { cd2 phe B 261 1kw6B_248F_261}P -14.6667 1.8261 -6.8685 { ce1 phe B 261 1kw6B_248F_261}P -15.9471 3.456 -8.6813 { ce2 phe B 261 1kw6B_248F_261}P -16.051 1.7918 -6.9839 { cz phe B 261 1kw6B_248F_261}P -16.6802 2.6077 -7.8952 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 248 B}'S' sky -12.593 0.8357 -8.7244 {"}'S' sky -11.6353 1.2499 -8.9386 {"}'S' blue -11.7777 1.3157 -9.1415 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 248 B}'S' green -12.2754 0.4952 -7.3941 {"}'S' green -12.5683 0.6103 -7.8053 {"}'S' green -12.7293 0.5954 -8.0084 {"}'S' green -11.9107 0.4425 -7.2664 {"}'S' green -12.6279 0.681 -8.2601 {"}'S' green -11.6499 0.4587 -7.3238 {"}'S' green -11.4413 0.5112 -7.483 {"}'S' green -11.3749 0.663 -7.8696 {"}'S' sea -11.3041 0.7072 -8.2236 { CZ PHE 248 B}'S' green -12.4501 0.7692 -8.5208 {"}'S' green -12.2508 0.9295 -8.5789 {"}'S' sea -12.3931 0.9999 -8.7809 {"}'S' green -12.0201 1.0456 -8.6302 {"}'S' green -12.16 1.1266 -8.833 {"}'S' green -11.5577 0.8291 -8.3299 {"}'S' green -11.773 1.1221 -8.6909 {"}'S' sea -11.9084 1.2123 -8.8898 {"}'S' sea -11.3013 0.8402 -8.3921 {"}'S' green -11.3946 1.0091 -8.5599 {"}'S' sea -11.5073 1.1469 -8.7436 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 248 B}'S' P -12.4153 0.5761 -7.597 {"}'S' -12.4106 0.5623 -7.6045 {"}'S' P -12.0282 0.5716 -7.4548 {"}'S' -12.0261 0.5382 -7.4751 {"}'S' P -12.1637 0.6618 -7.6537 {"}'S' -12.1519 0.5834 -7.6898 {"}'S' P -12.3116 0.7116 -7.8587 {"}'S' -12.293 0.6339 -7.8822 {"}'S' P -12.4675 0.7172 -8.0628 {"}'S' -12.4586 0.6916 -8.067 {"}'S' P -11.7626 0.5964 -7.5076 {"}'S' -11.7649 0.5643 -7.5256 {"}'S' P -11.8906 0.6994 -7.7025 {"}'S' -11.8938 0.6043 -7.7416 {"}'S' P -12.033 0.7653 -7.9054 {"}'S' -12.0261 0.6485 -7.936 {"}'S' P -12.1849 0.7924 -8.109 {"}'S' -12.1725 0.7061 -8.1219 {"}'S' P -12.3426 0.7793 -8.3095 {"}'S' -12.3405 0.7678 -8.3092 {"}'S' P -11.56 0.6448 -7.674 {"}'S' -11.566 0.6199 -7.685 {"}'S' P -11.6944 0.7432 -7.875 {"}'S' -11.7049 0.6628 -7.8984 {"}'S' P -11.8412 0.804 -8.0827 {"}'S' -11.8462 0.7107 -8.0973 {"}'S' P -11.9978 0.827 -8.29 {"}'S' -11.9956 0.7702 -8.2929 {"}'S' P -11.5129 0.7541 -8.072 {"}'S' -11.5173 0.7342 -8.0752 {"}'S' P -11.6619 0.8071 -8.2793 {"}'S' -11.6651 0.7868 -8.2807 { CZ PHE 248 B}'S' P -11.8979 0.9193 -8.4377 {"}'S' -11.8939 0.894 -8.4607 {"}'S' P -11.6554 0.993 -8.5025 {"}'S' -11.656 0.9888 -8.5058 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 261 B}'S' blue -12.4726 1.3934 -8.7333 {"}'S' sky -12.2374 1.4779 -8.8105 {"}'S' blue -11.9983 1.5797 -8.8487 {"}'S' blue -11.7515 1.6766 -8.8275 { HB3 PHE 261 B}'S' sky -12.5288 1.108 -8.5417 {"}'S' sky -11.7756 1.4668 -8.7527 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 PHE 261 B}'S' green -12.6752 0.6761 -7.7477 {"}'S' green -12.5378 0.5946 -7.5482 {"}'S' green -12.3859 0.5689 -7.3449 {"}'S' green -12.6229 0.7755 -8.1399 {"}'S' green -12.0806 0.5108 -7.3655 {"}'S' green -11.6623 0.5983 -7.2804 {"}'S' sea -12.3 1.2474 -8.6949 {"}'S' green -12.2656 1.0198 -8.5873 {"}'S' green -11.5003 0.6207 -7.4878 {"}'S' sea -12.0421 1.3558 -8.7601 {"}'S' green -12.0228 1.1134 -8.6681 {"}'S' green -11.4007 0.6756 -7.7419 {"}'S' green -11.7752 1.2227 -8.6845 {"}'S' green -11.4804 0.7836 -8.1813 {"}'S' green -11.324 0.7944 -7.9821 {"}'S' sea -11.5305 1.29 -8.6183 {"}'S' green -11.4627 1.0815 -8.4729 {"}'S' sea -11.3292 0.9788 -8.2722 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 PHE 261 B}'S' P -12.5141 0.6349 -7.9608 {"}'S' -12.5056 0.6523 -7.9549 {"}'S' P -12.3834 0.5405 -7.7657 {"}'S' -12.3677 0.5916 -7.7593 {"}'S' P -12.2361 0.4988 -7.5634 {"}'S' -12.2289 0.5442 -7.5657 {"}'S' P -12.3848 0.7202 -8.2478 {"}'S' -12.3787 0.7373 -8.2365 {"}'S' P -12.2687 0.5884 -8.0624 {"}'S' -12.2514 0.6675 -8.0296 {"}'S' P -12.1321 0.507 -7.8623 {"}'S' -12.1227 0.6168 -7.8403 {"}'S' P -11.9797 0.4821 -7.6586 {"}'S' -11.9845 0.5712 -7.6564 {"}'S' P -11.8203 0.5125 -7.4614 {"}'S' -11.8253 0.5378 -7.4654 {"}'S' P -12.1945 0.8235 -8.4419 {"}'S' -12.1943 0.8269 -8.439 {"}'S' P -12.0919 0.6707 -8.2668 {"}'S' -12.0881 0.7329 -8.2263 {"}'S' P -11.9635 0.5699 -8.0717 {"}'S' -11.9712 0.6763 -8.028 {"}'S' P -11.8162 0.5269 -7.8691 {"}'S' -11.8364 0.6303 -7.8468 {"}'S' P -11.658 0.5446 -7.6706 {"}'S' -11.6759 0.5944 -7.6689 {"}'S' P -11.9583 0.9045 -8.5255 {"}'S' -11.96 0.9239 -8.5032 {"}'S' P -11.8546 0.7458 -8.3476 {"}'S' -11.8608 0.7774 -8.3222 {"}'S' P -11.7197 0.6509 -8.1467 {"}'S' -11.7394 0.7148 -8.1129 {"}'S' P -11.564 0.6267 -7.9385 {"}'S' -11.5855 0.6723 -7.9253 {"}'S' P -11.7201 1.0114 -8.5558 {"}'S' -11.7226 1.0165 -8.5485 {"}'S' P -11.6175 0.8586 -8.3808 {"}'S' -11.6209 0.8649 -8.3748 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 248 B}'M' green -9.4184 1.8091 -6.1474 {"}'M' green -9.562 1.7013 -6.4199 {"}'M' green -9.1565 2.1303 -6.0148 {"}'M' green -9.4637 2.0179 -7.1456 {"}'M' green -8.9617 2.6003 -7.023 {"}'M' green -9.1079 2.4567 -7.1729 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 248 B}'M' greentint -9.3197 2.097 -6.2166 {"}'M' greentint -9.4683 1.94 -6.3651 {"}'M' greentint -9.572 1.8437 -6.6626 {"}'M' greentint -9.0125 2.3355 -6.0768 {"}'M' greentint -9.1705 2.3271 -6.2788 {"}'M' greentint -9.3291 2.2339 -6.4572 {"}'M' greentint -9.4683 2.066 -6.5904 {"}'M' greentint -9.5416 1.9377 -6.9074 {"}'M' greentint -8.9835 2.5162 -6.3466 {"}'M' greentint -9.1437 2.458 -6.5386 {"}'M' greentint -9.2985 2.3349 -6.7033 {"}'M' greentint -9.4342 2.1574 -6.8295 {"}'M' greentint -8.9003 2.6356 -6.5901 {"}'M' greentint -9.0628 2.554 -6.7764 {"}'M' greentint -9.2151 2.4181 -6.9364 {"}'M' greentint -9.3517 2.2365 -7.0612 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 261 B}'M' green -9.4143 1.8781 -6.0635 {"}'M' green -9.6721 1.7489 -6.7607 {"}'M' green -8.9906 2.41 -6.0638 {"}'M' green -9.569 1.9116 -7.0157 {"}'M' green -9.441 2.1472 -7.1782 {"}'M' green -8.8891 2.7132 -6.6232 {"}'M' green -9.0941 2.5098 -7.0534 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 261 B}'M' greentint -9.5139 1.7511 -6.5569 {"}'M' greentint -9.3533 1.8271 -6.3701 {"}'M' greentint -9.2037 1.9725 -6.2177 {"}'M' greentint -9.0792 2.1724 -6.1118 {"}'M' greentint -9.4202 1.862 -6.8096 {"}'M' greentint -9.2579 1.9069 -6.6117 {"}'M' greentint -9.1037 2.0395 -6.4499 {"}'M' greentint -8.9794 2.2428 -6.3453 {"}'M' greentint -8.9011 2.4885 -6.3132 {"}'M' greentint -9.3092 2.0454 -6.98 {"}'M' greentint -9.1482 2.0735 -6.7801 {"}'M' greentint -9.0002 2.2254 -6.6312 {"}'M' greentint -8.9054 2.4596 -6.5739 {"}'M' greentint -9.1757 2.2633 -7.0336 {"}'M' greentint -9.0158 2.3602 -6.8541 {"}'M' greentint -8.9608 2.6135 -6.8539 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 248 B}'M' green -10.4065 0.2703 -4.8859 {"}'M' green -10.5398 0.1667 -5.0854 {"}'M' sea -10.2207 0.3617 -4.7279 {"}'M' green -10.3249 0.5169 -4.9057 {"}'M' green -10.6115 0.0669 -5.3161 {"}'M' sea -10.0596 0.633 -4.7611 {"}'M' green -10.1914 0.7347 -4.9592 {"}'M' green -10.6173 0.1634 -5.6144 {"}'M' green -10.0029 0.9046 -5.0259 {"}'M' green -10.4701 0.4923 -5.859 {"}'M' green -10.0674 1.0001 -5.4792 {"}'M' green -10.224 0.8881 -5.6506 {"}'M' green -10.3626 0.7133 -5.7814 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 248 B}'M' greentint -10.4848 0.42 -5.0851 {"}'M' greentint -10.5952 0.3206 -5.3654 {"}'M' greentint -10.3524 0.7067 -5.1592 {"}'M' greentint -10.5004 0.5547 -5.3081 {"}'M' greentint -10.5669 0.418 -5.619 {"}'M' greentint -10.1618 0.9077 -5.2318 {"}'M' greentint -10.3221 0.8167 -5.4147 {"}'M' greentint -10.4635 0.6461 -5.5502 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 261 B}'M' sea -10.7489 0.0964 -5.1808 {"}'M' green -10.5911 0.2066 -5.0074 {"}'M' green -10.4457 0.3683 -4.8644 {"}'M' green -10.3211 0.5707 -4.7608 {"}'M' sea -10.2246 0.8039 -4.701 {"}'M' sea -10.8372 0.1761 -5.6341 {"}'M' green -10.678 0.1985 -5.4336 {"}'M' green -10.156 0.8706 -4.947 {"}'M' sea -10.7185 0.358 -5.7886 {"}'M' sea -10.1068 1.1087 -5.2076 {"}'M' green -10.5842 0.5659 -5.8643 {"}'M' green -10.176 0.9851 -5.4534 {"}'M' sea -10.4716 0.7957 -5.8996 {"}'M' green -10.3128 0.893 -5.7219 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 261 B}'M' greentint -10.5182 0.2871 -5.2526 {"}'M' greentint -10.3715 0.4367 -5.105 {"}'M' greentint -10.2478 0.6364 -5.0003 {"}'M' greentint -10.5597 0.369 -5.5877 {"}'M' greentint -10.4027 0.4649 -5.4103 {"}'M' greentint -10.2642 0.6355 -5.2788 {"}'M' greentint -10.1613 0.8589 -5.2079 {"}'M' greentint -10.4211 0.5951 -5.6617 {"}'M' greentint -10.2713 0.7488 -5.5109 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 59 1l7aA_61Y_69I}P -12.0962 -1.6269 0.7465 {"}-12.0962 -1.6269 0.7465 { ca leu A 59 1l7aA_61Y_69I}-11.1786 -2.1397 -0.2474 { c leu A 59 1l7aA_61Y_69I}-10.892 -1.0025 -1.2191 { o leu A 59 1l7aA_61Y_69I}-11.8352 -0.3771 -1.7266 { c leu A 59 1l7aA_61Y_69I}P -10.892 -1.0025 -1.2191 { n thr A 60 1l7aA_61Y_69I}-9.6214 -0.7104 -1.475 { ca thr A 60 1l7aA_61Y_69I}-9.2398 0.3419 -2.3865 { c thr A 60 1l7aA_61Y_69I}-8.2138 -0.221 -3.354 { o thr A 60 1l7aA_61Y_69I}-7.3285 -1.0127 -2.9852 { c thr A 60 1l7aA_61Y_69I}P -8.2138 -0.221 -3.354 { n tyr A 61 1l7aA_61Y_69I}-8.3196 0.1353 -4.6292 { ca tyr A 61 1l7aA_61Y_69I}-7.3815 -0.3098 -5.6499 { c tyr A 61 1l7aA_61Y_69I}-7.1926 0.7767 -6.6956 { o tyr A 61 1l7aA_61Y_69I}-7.9202 1.7644 -6.8031 { c tyr A 61 1l7aA_61Y_69I}P -7.1926 0.7767 -6.6956 { n lys A 62 1l7aA_61Y_69I}-6.1448 0.6586 -7.4923 { ca lys A 62 1l7aA_61Y_69I}-5.7791 1.5715 -8.5611 { c lys A 62 1l7aA_61Y_69I}-6.2594 0.9866 -9.8838 { o lys A 62 1l7aA_61Y_69I}-6.1989 -0.2219 -10.1062 { c lys A 62 1l7aA_61Y_69I}P -6.2594 0.9866 -9.8838 { n ser A 63 1l7aA_61Y_69I}-6.7989 1.8655 -10.726 { ca ser A 63 1l7aA_61Y_69I}-7.3538 1.4301 -12.0037 { c ser A 63 1l7aA_61Y_69I}-6.9223 2.3613 -13.1183 { o ser A 63 1l7aA_61Y_69I}-6.0217 3.1894 -13.0249 { n ala A 67 1l7aA_61Y_69I}P -6.6767 5.9664 -11.2234 {"}-6.6767 5.9664 -11.2234 { ca ala A 67 1l7aA_61Y_69I}-7.7517 6.3523 -10.3047 { c ala A 67 1l7aA_61Y_69I}-7.863 5.4209 -9.1198 { o ala A 67 1l7aA_61Y_69I}-7.7486 4.206 -9.2226 { c ala A 67 1l7aA_61Y_69I}P -7.863 5.4209 -9.1198 { n arg A 68 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gray master= {mainchain} { n leu A 59 1l7aA_61Y_69I}P -12.0962 -1.6269 0.7465 { ca leu A 59 1l7aA_61Y_69I}P -11.1786 -2.1397 -0.2474 { n thr A 60 1l7aA_61Y_69I}P -9.6214 -0.7104 -1.475 { ca thr A 60 1l7aA_61Y_69I}P -9.2398 0.3419 -2.3865 { n tyr A 61 1l7aA_61Y_69I}P -8.3196 0.1353 -4.6292 { ca tyr A 61 1l7aA_61Y_69I}P -7.3815 -0.3098 -5.6499 { n lys A 62 1l7aA_61Y_69I}P -6.1448 0.6586 -7.4923 { ca lys A 62 1l7aA_61Y_69I}P -5.7791 1.5715 -8.5611 { n ser A 63 1l7aA_61Y_69I}P -6.7989 1.8655 -10.726 { ca ser A 63 1l7aA_61Y_69I}P -7.3538 1.4301 -12.0037 { n ala A 67 1l7aA_61Y_69I}P -6.6767 5.9664 -11.2234 { ca ala A 67 1l7aA_61Y_69I}P -7.7517 6.3523 -10.3047 { n arg A 68 1l7aA_61Y_69I}P -8.1184 6.0004 -7.9538 { ca arg A 68 1l7aA_61Y_69I}P -8.3297 5.2834 -6.7118 { n ile A 69 1l7aA_61Y_69I}P -10.1008 3.6394 -6.7648 { ca ile A 69 1l7aA_61Y_69I}P -11.445 3.0971 -6.7318 { n thr A 70 1l7aA_61Y_69I}P -12.79 2.5326 -4.7911 { ca thr A 70 1l7aA_61Y_69I}P -13.0321 1.9336 -3.4934 { n gly A 71 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-9.5465 {"}'S' green -12.8686 -0.0547 -9.3456 {"}'S' green -12.7128 -0.0789 -9.1374 {"}'S' green -12.5495 -0.03 -8.9408 {"}'S' sea -12.3923 0.0884 -8.7701 {"}'S' sea -12.6292 0.078 -9.3802 {"}'S' sea -12.4729 0.0887 -9.181 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 69 A}'S' P -11.0499 0.2598 -8.3466 {"}'S' -11.0496 0.2738 -8.3374 {"}'S' P -10.9214 0.159 -8.1514 {"}'S' -10.9237 0.1912 -8.138 {"}'S' P -10.7742 0.116 -7.9489 {"}'S' -10.7761 0.1295 -7.9461 {"}'S' P -10.8126 0.3349 -8.4273 {"}'S' -10.8184 0.3656 -8.403 {"}'S' P -10.6777 0.2401 -8.2264 {"}'S' -10.6916 0.2859 -8.2029 {"}'S' P -10.5219 0.2158 -8.0182 {"}'S' -10.5287 0.2312 -8.0139 {"}'S' P -10.5755 0.4478 -8.4605 {"}'S' -10.5818 0.4594 -8.4496 {"}'S' P -10.4383 0.3727 -8.2611 {"}'S' -10.4467 0.386 -8.2533 {HG21 ILE 69 A}'S' P -12.965 -0.1788 -9.068 {"}'S' -12.9674 -0.166 -9.0657 {"}'S' P -12.8068 -0.161 -8.8696 {"}'S' -12.808 -0.1589 -8.8699 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 61 A}'M' greentint -8.9936 2.4447 -6.216 {"}'M' greentint -9.1422 2.2878 -6.3645 {"}'M' greentint -9.2459 2.1915 -6.662 {"}'M' greentint -8.8444 2.6749 -6.2781 {"}'M' greentint -9.003 2.5817 -6.4565 {"}'M' greentint -9.1422 2.4137 -6.5897 {"}'M' greentint -9.2155 2.2855 -6.9067 {"}'M' greentint -9.2867 2.0404 -6.9309 {"}'M' greentint -8.6574 2.864 -6.346 {"}'M' greentint -8.8176 2.8057 -6.538 {"}'M' greentint -8.9724 2.6827 -6.7026 {"}'M' greentint -9.1081 2.5051 -6.8288 {"}'M' greentint -9.1376 2.3657 -7.145 {"}'M' greentint -9.2188 2.1225 -7.1834 {"}'M' greentint -8.5742 2.9834 -6.5894 {"}'M' greentint -8.7367 2.9018 -6.7758 {"}'M' greentint -8.8889 2.7658 -6.9357 {"}'M' greentint -9.0256 2.5843 -7.0605 {"}'M' greentint -9.0231 2.4104 -7.3747 {"}'M' greentint -9.1087 2.1756 -7.4192 {"}'M' greentint -8.4798 3.0468 -6.8491 {"}'M' greentint -8.6356 2.948 -7.0224 {"}'M' greentint -8.7818 2.8045 -7.1723 {"}'M' greentint -8.9125 2.6225 -7.2907 {"}'M' greentint -8.8722 2.4322 -7.5834 {"}'M' greentint -8.4799 2.9754 -7.2276 {"}'M' greentint -8.6266 2.8282 -7.3774 {"}'M' greentint -8.7586 2.6453 -7.4974 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 69 A}'M' greentint -9.2027 2.0917 -6.4246 {"}'M' greentint -9.0614 2.2425 -6.283 {"}'M' greentint -8.9408 2.4368 -6.1813 {"}'M' greentint -9.247 1.9545 -6.8724 {"}'M' greentint -9.0888 2.0182 -6.6861 {"}'M' greentint -8.9385 2.1427 -6.5263 {"}'M' greentint -8.8054 2.3183 -6.4032 {"}'M' greentint -8.7002 2.5329 -6.3255 {"}'M' greentint -8.6267 2.7727 -6.2986 {"}'M' greentint -9.1964 2.0135 -7.2235 {"}'M' greentint -9.0382 2.0157 -7.0197 {"}'M' greentint -8.8775 2.0917 -6.8329 {"}'M' greentint -8.728 2.2371 -6.6805 {"}'M' greentint -8.6034 2.437 -6.5746 {"}'M' greentint -8.5148 2.6746 -6.5266 {"}'M' greentint -8.4703 2.9293 -6.5393 {"}'M' greentint -8.9445 2.1265 -7.2724 {"}'M' greentint -8.7821 2.1715 -7.0745 {"}'M' greentint -8.6279 2.3041 -6.9127 {"}'M' greentint -8.5037 2.5074 -6.8081 {"}'M' greentint -8.4254 2.7531 -6.776 {"}'M' greentint -8.4044 3.0085 -6.8193 {"}'M' greentint -8.8335 2.31 -7.4428 {"}'M' greentint -8.6725 2.3381 -7.2429 {"}'M' greentint -8.5245 2.49 -7.094 {"}'M' greentint -8.4296 2.7241 -7.0367 {"}'M' greentint -8.4134 2.9778 -7.086 {"}'M' greentint -8.7 2.5279 -7.4964 {"}'M' greentint -8.54 2.6248 -7.3169 {"}'M' greentint -8.4851 2.8781 -7.3167 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 61 A}'M' greentint -9.8258 0.8966 -4.3735 {"}'M' greentint -9.9591 0.793 -4.573 {"}'M' greentint -9.7441 1.1432 -4.3934 {"}'M' greentint -9.9041 1.0463 -4.5728 {"}'M' greentint -10.0145 0.9469 -4.8531 {"}'M' greentint -10.0308 0.6932 -4.8038 {"}'M' greentint -9.6106 1.361 -4.4469 {"}'M' greentint -9.7716 1.333 -4.6469 {"}'M' greentint -9.9197 1.181 -4.7957 {"}'M' greentint -9.9862 1.0443 -5.1067 {"}'M' greentint -10.0366 0.7897 -5.1021 {"}'M' greentint -10.0279 0.5418 -5.0216 {"}'M' greentint -9.4222 1.5309 -4.5135 {"}'M' greentint -9.5811 1.534 -4.7194 {"}'M' greentint -9.7414 1.443 -4.9023 {"}'M' greentint -9.8828 1.2725 -5.0379 {"}'M' greentint -9.8894 1.1186 -5.3467 {"}'M' greentint -9.9576 0.8696 -5.3644 {"}'M' greentint -9.9781 0.6164 -5.3209 {"}'M' greentint -9.4867 1.6264 -4.9669 {"}'M' greentint -9.6433 1.5144 -5.1383 {"}'M' greentint -9.7819 1.3396 -5.269 {"}'M' greentint -9.744 1.1381 -5.5643 {"}'M' greentint -9.8175 0.8983 -5.5912 {"}'M' greentint -9.3554 1.6528 -5.2036 {"}'M' greentint -9.5056 1.5284 -5.3634 {"}'M' greentint -9.6387 1.3528 -5.4865 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 69 A}'M' greentint -9.9351 0.5504 -4.6609 {"}'M' greentint -9.7948 0.7124 -4.5249 {"}'M' greentint -9.6728 0.909 -4.4219 {"}'M' greentint -9.5745 1.1338 -4.3559 {"}'M' greentint -9.9795 0.4898 -5.0649 {"}'M' greentint -9.8217 0.6 -4.8915 {"}'M' greentint -9.6763 0.7618 -4.7485 {"}'M' greentint -9.5517 0.9642 -4.6449 {"}'M' greentint -9.4553 1.1973 -4.5851 {"}'M' greentint -9.3915 1.449 -4.5725 {"}'M' greentint -9.9086 0.5919 -5.3177 {"}'M' greentint -9.7489 0.6805 -5.1367 {"}'M' greentint -9.6022 0.8301 -4.9891 {"}'M' greentint -9.4784 1.0299 -4.8844 {"}'M' greentint -9.3866 1.264 -4.8311 {"}'M' greentint -9.3346 1.5149 -4.8327 {"}'M' greentint -9.7903 0.7624 -5.4718 {"}'M' greentint -9.6333 0.8583 -5.2944 {"}'M' greentint -9.4948 1.0289 -5.1629 {"}'M' greentint -9.3919 1.2524 -5.0921 {"}'M' greentint -9.3375 1.5021 -5.0917 {"}'M' greentint -9.6517 0.9885 -5.5458 {"}'M' greentint -9.5019 1.1422 -5.395 {"}'M' greentint -9.4066 1.3785 -5.3375 {"}'M' greentint -9.5435 1.2864 -5.606 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n glu A 62 1lg7A_64F_139A}P -12.3047 -2.5427 -0.4454 {"}-12.3047 -2.5427 -0.4454 { ca glu A 62 1lg7A_64F_139A}-10.9675 -2.6161 -1.0189 { c glu A 62 1lg7A_64F_139A}-10.7117 -1.3528 -1.8189 { o glu A 62 1lg7A_64F_139A}-11.524 -0.9616 -2.6511 { c glu A 62 1lg7A_64F_139A}P -10.7117 -1.3528 -1.8189 { n lys A 63 1lg7A_64F_139A}-9.5789 -0.7064 -1.5546 { ca lys A 63 1lg7A_64F_139A}-9.2131 0.5182 -2.257 { c lys A 63 1lg7A_64F_139A}-8.1407 0.137 -3.2658 { o lys A 63 1lg7A_64F_139A}-7.1647 -0.5293 -2.9161 { c lys A 63 1lg7A_64F_139A}P -8.1407 0.137 -3.2658 { n phe A 64 1lg7A_64F_139A}-8.2985 0.5715 -4.5119 { ca phe A 64 1lg7A_64F_139A}-7.3389 0.1895 -5.538 { c phe A 64 1lg7A_64F_139A}-7.1945 1.1481 -6.7113 { o phe A 64 1lg7A_64F_139A}-8.0732 1.9712 -6.974 { c phe A 64 1lg7A_64F_139A}P -7.1945 1.1481 -6.7113 { n phe A 65 1lg7A_64F_139A}-6.0621 1.0354 -7.4021 { ca phe A 65 1lg7A_64F_139A}-5.8081 1.82 -8.6028 { c phe A 65 1lg7A_64F_139A}-6.2473 0.8466 -9.6968 { o phe A 65 1lg7A_64F_139A}-6.0811 -0.37 -9.5458 { c phe A 65 1lg7A_64F_139A}P -6.2473 0.8466 -9.6968 { n phe A 66 1lg7A_64F_139A}-6.8007 1.3598 -10.7891 { ca phe A 66 1lg7A_64F_139A}-7.2294 0.4817 -11.8684 { c phe A 66 1lg7A_64F_139A}-7.0525 1.1185 -13.2313 { o phe A 66 1lg7A_64F_139A}-7.1426 2.3371 -13.3831 { n gly A 137 1lg7A_64F_139A}P -8.1314 5.1304 -12.9081 {"}-8.1314 5.1304 -12.9081 { ca gly A 137 1lg7A_64F_139A}-8.4223 5.867 -11.6931 { c gly A 137 1lg7A_64F_139A}-8.2375 5.0546 -10.4314 { o gly A 137 1lg7A_64F_139A}-7.6053 4.0028 -10.4414 { c gly A 137 1lg7A_64F_139A}P -8.2375 5.0546 -10.4314 { n arg A 138 1lg7A_64F_139A}-8.7855 5.568 -9.3359 { ca arg A 138 1lg7A_64F_139A}-8.7206 4.911 -8.0394 { c arg A 138 1lg7A_64F_139A}-10.1574 4.8042 -7.5592 { o arg A 138 1lg7A_64F_139A}-10.9792 5.6566 -7.8789 { c arg A 138 1lg7A_64F_139A}P -10.1574 4.8042 -7.5592 { n ala A 139 1lg7A_64F_139A}-10.4669 3.7679 -6.7921 { ca ala A 139 1lg7A_64F_139A}-11.8225 3.5991 -6.296 { c ala A 139 1lg7A_64F_139A}-11.9049 2.5577 -5.1935 { o ala A 139 1lg7A_64F_139A}-10.9576 1.8097 -4.9651 { c ala A 139 1lg7A_64F_139A}P -11.9049 2.5577 -5.1935 { n tyr A 140 1lg7A_64F_139A}-13.0458 2.5305 -4.5096 { ca tyr A 140 1lg7A_64F_139A}-13.3017 1.5685 -3.4436 { c tyr A 140 1lg7A_64F_139A}-14.3425 0.5741 -3.9437 { o tyr A 140 1lg7A_64F_139A}-15.2147 0.9283 -4.7296 { c tyr A 140 1lg7A_64F_139A}P -14.3425 0.5741 -3.9437 { n leu A 141 1lg7A_64F_139A}-14.2548 -0.6657 -3.4811 { ca leu A 141 1lg7A_64F_139A}-15.2444 -1.668 -3.8512 { c leu A 141 1lg7A_64F_139A}-15.8109 -2.3309 -2.6064 { o leu A 141 1lg7A_64F_139A}-15.0859 -2.9844 -1.8576 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 62 1lg7A_64F_139A}P -12.3047 -2.5427 -0.4454 { ca glu A 62 1lg7A_64F_139A}P -10.9675 -2.6161 -1.0189 { n lys A 63 1lg7A_64F_139A}P -9.5789 -0.7064 -1.5546 { ca lys A 63 1lg7A_64F_139A}P -9.2131 0.5182 -2.257 { n phe A 64 1lg7A_64F_139A}P -8.2985 0.5715 -4.5119 { ca phe A 64 1lg7A_64F_139A}P -7.3389 0.1895 -5.538 { n phe A 65 1lg7A_64F_139A}P -6.0621 1.0354 -7.4021 { ca phe A 65 1lg7A_64F_139A}P -5.8081 1.82 -8.6028 { n phe A 66 1lg7A_64F_139A}P -6.8007 1.3598 -10.7891 { ca phe A 66 1lg7A_64F_139A}P -7.2294 0.4817 -11.8684 { n gly A 137 1lg7A_64F_139A}P -8.1314 5.1304 -12.9081 { ca gly A 137 1lg7A_64F_139A}P -8.4223 5.867 -11.6931 {"}P -8.4223 5.867 -11.6931 { n arg A 138 1lg7A_64F_139A}P -8.7855 5.568 -9.3359 { ca arg A 138 1lg7A_64F_139A}P -8.7206 4.911 -8.0394 { n ala A 139 1lg7A_64F_139A}P -10.4669 3.7679 -6.7921 { ca ala A 139 1lg7A_64F_139A}P -11.8225 3.5991 -6.296 { n tyr A 140 1lg7A_64F_139A}P -13.0458 2.5305 -4.5096 { ca tyr A 140 1lg7A_64F_139A}P -13.3017 1.5685 -3.4436 { n leu A 141 1lg7A_64F_139A}P -14.2548 -0.6657 -3.4811 { ca leu A 141 1lg7A_64F_139A}P -15.2444 -1.668 -3.8512 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca glu A 62 1lg7A_64F_139A}P -10.9675 -2.6161 -1.0189 {"}-10.9675 -2.6161 -1.0189 { ca lys A 63 1lg7A_64F_139A}-9.2131 0.5182 -2.257 { ca phe A 64 1lg7A_64F_139A}-7.3389 0.1895 -5.538 { ca phe A 65 1lg7A_64F_139A}-5.8081 1.82 -8.6028 { ca phe A 66 1lg7A_64F_139A}-7.2294 0.4817 -11.8684 { ca gly A 137 1lg7A_64F_139A}P -8.4223 5.867 -11.6931 {"}-8.4223 5.867 -11.6931 { ca arg A 138 1lg7A_64F_139A}-8.7206 4.911 -8.0394 { ca ala A 139 1lg7A_64F_139A}-11.8225 3.5991 -6.296 { ca tyr A 140 1lg7A_64F_139A}-13.3017 1.5685 -3.4436 { ca leu A 141 1lg7A_64F_139A}-15.2444 -1.668 -3.8512 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 64 1lg7A_64F_139A}P -7.3389 0.1895 -5.538 { cb phe A 64 1lg7A_64F_139A}-7.7403 -1.1852 -6.0787 { cg phe A 64 1lg7A_64F_139A}-9.1352 -1.2179 -6.6449 { cd1 phe A 64 1lg7A_64F_139A}-9.3847 -0.7979 -7.9516 { ce1 phe A 64 1lg7A_64F_139A}-10.6866 -0.7663 -8.4567 { cz phe A 64 1lg7A_64F_139A}-11.7543 -1.1583 -7.6494 { cg phe A 64 1lg7A_64F_139A}P -9.1352 -1.2179 -6.6449 { cd2 phe A 64 1lg7A_64F_139A}-10.213 -1.6096 -5.8533 { ce2 phe A 64 1lg7A_64F_139A}-11.5181 -1.5804 -6.3484 { cz phe A 64 1lg7A_64F_139A}ghost -11.7543 -1.1583 -7.6494 { ca ala A 139 1lg7A_64F_139A}P -11.8225 3.5991 -6.296 { cb ala A 139 1lg7A_64F_139A}-12.7481 3.2103 -7.445 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 64 1lg7A_64F_139A}P -7.7403 -1.1852 -6.0787 {"}P -7.7403 -1.1852 -6.0787 { cd1 phe A 64 1lg7A_64F_139A}P -9.3847 -0.7979 -7.9516 { cd2 phe A 64 1lg7A_64F_139A}P -10.213 -1.6096 -5.8533 { ce1 phe A 64 1lg7A_64F_139A}P -10.6866 -0.7663 -8.4567 { ce2 phe A 64 1lg7A_64F_139A}P -11.5181 -1.5804 -6.3484 { cz phe A 64 1lg7A_64F_139A}P -11.7543 -1.1583 -7.6494 { cb ala A 139 1lg7A_64F_139A}P -12.7481 3.2103 -7.445 {"}P -12.7481 3.2103 -7.445 {"}P -12.7481 3.2103 -7.445 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 64 A}'M' green -9.3052 2.1134 -6.3253 {"}'M' green -9.0864 2.4524 -6.136 {"}'M' green -9.4555 2.1488 -6.8361 {"}'M' green -8.8394 2.8901 -6.247 {"}'M' green -9.4397 2.2472 -7.1018 {"}'M' green -8.8104 3.0708 -6.5169 {"}'M' green -9.2906 2.5725 -7.3159 {"}'M' green -8.8897 3.1086 -6.9466 {"}'M' green -9.1786 2.7911 -7.2314 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 64 A}'M' greentint -9.2453 2.3637 -6.3176 {"}'M' greentint -9.3889 2.2559 -6.5901 {"}'M' greentint -8.9833 2.6849 -6.185 {"}'M' greentint -9.1466 2.6516 -6.3869 {"}'M' greentint -9.2952 2.4946 -6.5354 {"}'M' greentint -9.3989 2.3983 -6.8328 {"}'M' greentint -8.9974 2.8817 -6.449 {"}'M' greentint -9.156 2.7886 -6.6274 {"}'M' greentint -9.2952 2.6206 -6.7606 {"}'M' greentint -9.3685 2.4923 -7.0776 {"}'M' greentint -8.9706 3.0126 -6.7089 {"}'M' greentint -9.1254 2.8895 -6.8735 {"}'M' greentint -9.2611 2.712 -6.9997 {"}'M' greentint -9.042 2.9727 -7.1066 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ALA 139 A}'M' green -9.4623 2.1305 -6.6174 {"}'M' green -8.9389 2.7894 -6.1242 {"}'M' green -9.5173 2.291 -7.0761 {"}'M' green -8.8285 3.1233 -6.4169 {"}'M' green -9.3893 2.5266 -7.2386 {"}'M' green -9.2283 2.7979 -7.2718 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 139 A}'M' greentint -9.3016 2.2065 -6.4305 {"}'M' greentint -9.1521 2.3519 -6.2781 {"}'M' greentint -9.0275 2.5518 -6.1723 {"}'M' greentint -9.3686 2.2414 -6.87 {"}'M' greentint -9.2062 2.2863 -6.6721 {"}'M' greentint -9.052 2.4189 -6.5104 {"}'M' greentint -8.9278 2.6222 -6.4058 {"}'M' greentint -8.8495 2.8679 -6.3736 {"}'M' greentint -9.2576 2.4249 -7.0405 {"}'M' greentint -9.0966 2.4529 -6.8405 {"}'M' greentint -8.9485 2.6049 -6.6916 {"}'M' greentint -8.8537 2.839 -6.6343 {"}'M' greentint -8.8374 3.0927 -6.6836 {"}'M' greentint -9.1241 2.6427 -7.094 {"}'M' greentint -8.9641 2.7396 -6.9146 {"}'M' greentint -8.9092 2.9929 -6.9144 {"}'M' greentint -9.0424 2.8893 -7.1138 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 64 A}'M' green -9.9629 0.9184 -4.5078 {"}'M' green -9.8492 1.0798 -5.4128 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 64 A}'M' greentint -9.9578 1.2235 -4.4201 {"}'M' greentint -9.9028 1.4768 -4.4199 {"}'M' greentint -10.0132 1.3774 -4.7001 {"}'M' greentint -10.0295 1.1237 -4.6508 {"}'M' greentint -9.7704 1.7635 -4.4939 {"}'M' greentint -9.9184 1.6115 -4.6428 {"}'M' greentint -9.9849 1.4749 -4.9537 {"}'M' greentint -10.0353 1.2202 -4.9491 {"}'M' greentint -10.0267 0.9724 -4.8687 {"}'M' greentint -9.7401 1.8735 -4.7494 {"}'M' greentint -9.8815 1.703 -4.8849 {"}'M' greentint -9.8881 1.5491 -5.1937 {"}'M' greentint -9.9564 1.3001 -5.2114 {"}'M' greentint -9.9769 1.0469 -5.168 {"}'M' greentint -9.642 1.9449 -4.9854 {"}'M' greentint -9.7806 1.7702 -5.1161 {"}'M' greentint -9.7427 1.5687 -5.4113 {"}'M' greentint -9.8162 1.3289 -5.4382 {"}'M' greentint -9.6375 1.7833 -5.3336 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 139 A}'M' green -9.6971 1.7626 -4.3577 {"}'M' green -9.6274 1.7727 -5.3995 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 139 A}'M' greentint -9.91 1.0467 -4.434 {"}'M' greentint -9.8116 1.2716 -4.368 {"}'M' greentint -9.739 1.5126 -4.3425 {"}'M' greentint -9.9135 0.8995 -4.7606 {"}'M' greentint -9.7889 1.1019 -4.657 {"}'M' greentint -9.6924 1.335 -4.5972 {"}'M' greentint -9.6287 1.5868 -4.5846 {"}'M' greentint -9.6014 1.8415 -4.6192 {"}'M' greentint -9.8393 0.9678 -5.0013 {"}'M' greentint -9.7156 1.1676 -4.8965 {"}'M' greentint -9.6238 1.4018 -4.8432 {"}'M' greentint -9.5718 1.6526 -4.8448 {"}'M' greentint -9.5619 1.9029 -4.9021 {"}'M' greentint -9.8705 0.9961 -5.3066 {"}'M' greentint -9.732 1.1666 -5.175 {"}'M' greentint -9.6291 1.3901 -5.1042 {"}'M' greentint -9.5746 1.6398 -5.1039 {"}'M' greentint -9.5749 1.8867 -5.1726 {"}'M' greentint -9.7391 1.2799 -5.4071 {"}'M' greentint -9.6438 1.5163 -5.3496 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 247 1lgtA_249F_261}P -10.811 -0.2364 1.4679 {"}-10.811 -0.2364 1.4679 { ca val A 247 1lgtA_249F_261}-10.5988 -1.3904 0.5962 { c val A 247 1lgtA_249F_261}-10.7259 -0.7937 -0.8005 { o val A 247 1lgtA_249F_261}-11.7641 -0.2234 -1.1381 { c val A 247 1lgtA_249F_261}P -10.7259 -0.7937 -0.8005 { n ser A 248 1lgtA_249F_261}-9.6852 -0.9261 -1.6172 { ca ser A 248 1lgtA_249F_261}-9.7222 -0.3214 -2.9422 { c ser A 248 1lgtA_249F_261}-8.782 -0.9819 -3.9331 { o ser A 248 1lgtA_249F_261}-8.0587 -1.9163 -3.601 { c ser A 248 1lgtA_249F_261}P -8.782 -0.9819 -3.9331 { n phe A 249 1lgtA_249F_261}-8.8211 -0.4785 -5.1625 { ca phe A 249 1lgtA_249F_261}-7.9058 -0.9157 -6.2093 { c phe A 249 1lgtA_249F_261}-7.5338 0.3617 -6.9477 { o phe A 249 1lgtA_249F_261}-8.1821 1.3961 -6.7694 { c phe A 249 1lgtA_249F_261}P -7.5338 0.3617 -6.9477 { n tyr A 250 1lgtA_249F_261}-6.4692 0.3045 -7.7404 { ca tyr A 250 1lgtA_249F_261}-6.0335 1.4657 -8.5087 { c tyr A 250 1lgtA_249F_261}-6.044 1.0917 -9.9808 { o tyr A 250 1lgtA_249F_261}-5.8796 -0.0754 -10.3338 { c tyr A 250 1lgtA_249F_261}P -6.044 1.0917 -9.9808 { n ala A 251 1lgtA_249F_261}-6.2547 2.0853 -10.8356 { ca ala A 251 1lgtA_249F_261}-6.2936 1.8571 -12.2756 { c ala A 251 1lgtA_249F_261}-5.8099 3.0967 -13.0064 { o ala A 251 1lgtA_249F_261}-5.7958 4.1907 -12.449 { n val A 259 1lgtA_249F_261}P -6.4762 6.4112 -10.7279 {"}-6.4762 6.4112 -10.7279 { ca val A 259 1lgtA_249F_261}-7.6932 6.645 -9.9617 { c val A 259 1lgtA_249F_261}-7.7889 5.4975 -8.9658 { o val A 259 1lgtA_249F_261}-7.4781 4.3506 -9.2927 { c val A 259 1lgtA_249F_261}P -7.7889 5.4975 -8.9658 { n glu A 260 1lgtA_249F_261}-8.1814 5.8186 -7.7404 { ca glu A 260 1lgtA_249F_261}-8.3562 4.8107 -6.7069 { c glu A 260 1lgtA_249F_261}-9.8652 4.7363 -6.5086 { o glu A 260 1lgtA_249F_261}-10.537 5.7652 -6.4808 { c glu A 260 1lgtA_249F_261}P -9.8652 4.7363 -6.5086 { n tyr A 261 1lgtA_249F_261}-10.3878 3.5226 -6.375 { ca tyr A 261 1lgtA_249F_261}-11.8252 3.2951 -6.2405 { c tyr A 261 1lgtA_249F_261}-11.9843 2.4255 -4.9983 { o tyr A 261 1lgtA_249F_261}-11.5892 1.2532 -5.0007 { c tyr A 261 1lgtA_249F_261}P -11.9843 2.4255 -4.9983 { n gly A 262 1lgtA_249F_261}-12.5683 2.9862 -3.9406 { ca gly A 262 1lgtA_249F_261}-12.6716 2.221 -2.7125 { c gly A 262 1lgtA_249F_261}-13.9502 2.2451 -1.9075 { o gly A 262 1lgtA_249F_261}-14.9066 2.9625 -2.2198 { c gly A 262 1lgtA_249F_261}P -13.9502 2.2451 -1.9075 { n trp A 263 1lgtA_249F_261}-13.9252 1.466 -0.8292 { ca trp A 263 1lgtA_249F_261}-15.0754 1.3012 0.0477 { c trp A 263 1lgtA_249F_261}-14.6905 0.9999 1.5003 { o trp A 263 1lgtA_249F_261}-13.6482 0.4043 1.7656 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 247 1lgtA_249F_261}P -10.811 -0.2364 1.4679 { ca val A 247 1lgtA_249F_261}P -10.5988 -1.3904 0.5962 { n ser A 248 1lgtA_249F_261}P -9.6852 -0.9261 -1.6172 { ca ser A 248 1lgtA_249F_261}P -9.7222 -0.3214 -2.9422 { n phe A 249 1lgtA_249F_261}P -8.8211 -0.4785 -5.1625 { ca phe A 249 1lgtA_249F_261}P -7.9058 -0.9157 -6.2093 { n tyr A 250 1lgtA_249F_261}P -6.4692 0.3045 -7.7404 { ca tyr A 250 1lgtA_249F_261}P -6.0335 1.4657 -8.5087 { n ala A 251 1lgtA_249F_261}P -6.2547 2.0853 -10.8356 { ca ala A 251 1lgtA_249F_261}P -6.2936 1.8571 -12.2756 { n val A 259 1lgtA_249F_261}P -6.4762 6.4112 -10.7279 { ca val A 259 1lgtA_249F_261}P -7.6932 6.645 -9.9617 { n glu A 260 1lgtA_249F_261}P -8.1814 5.8186 -7.7404 { ca glu A 260 1lgtA_249F_261}P -8.3562 4.8107 -6.7069 { n tyr A 261 1lgtA_249F_261}P -10.3878 3.5226 -6.375 { ca tyr A 261 1lgtA_249F_261}P -11.8252 3.2951 -6.2405 { n gly A 262 1lgtA_249F_261}P -12.5683 2.9862 -3.9406 { ca gly A 262 1lgtA_249F_261}P -12.6716 2.221 -2.7125 {"}P -12.6716 2.221 -2.7125 { n trp A 263 1lgtA_249F_261}P -13.9252 1.466 -0.8292 { ca trp A 263 1lgtA_249F_261}P -15.0754 1.3012 0.0477 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 247 1lgtA_249F_261}P -10.5988 -1.3904 0.5962 {"}-10.5988 -1.3904 0.5962 { ca ser A 248 1lgtA_249F_261}-9.7222 -0.3214 -2.9422 { ca phe A 249 1lgtA_249F_261}-7.9058 -0.9157 -6.2093 { ca tyr A 250 1lgtA_249F_261}-6.0335 1.4657 -8.5087 { ca ala A 251 1lgtA_249F_261}-6.2936 1.8571 -12.2756 { ca val A 259 1lgtA_249F_261}P -7.6932 6.645 -9.9617 {"}-7.6932 6.645 -9.9617 { ca glu A 260 1lgtA_249F_261}-8.3562 4.8107 -6.7069 { ca tyr A 261 1lgtA_249F_261}-11.8252 3.2951 -6.2405 { ca gly A 262 1lgtA_249F_261}-12.6716 2.221 -2.7125 { ca trp A 263 1lgtA_249F_261}-15.0754 1.3012 0.0477 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 249 1lgtA_249F_261}P -7.9058 -0.9157 -6.2093 { cb phe A 249 1lgtA_249F_261}-8.5505 -1.93 -7.1665 { cg phe A 249 1lgtA_249F_261}-9.6204 -1.3581 -8.057 { cd1 phe A 249 1lgtA_249F_261}-9.2939 -0.7459 -9.268 { ce1 phe A 249 1lgtA_249F_261}-10.2959 -0.2682 -10.121 { cz phe A 249 1lgtA_249F_261}-11.6357 -0.3994 -9.7623 { cg phe A 249 1lgtA_249F_261}P -9.6204 -1.3581 -8.057 { cd2 phe A 249 1lgtA_249F_261}-10.9612 -1.4783 -7.7057 { ce2 phe A 249 1lgtA_249F_261}-11.9705 -1.0047 -8.5507 { cz phe A 249 1lgtA_249F_261}ghost -11.6357 -0.3994 -9.7623 { ca tyr A 261 1lgtA_249F_261}P -11.8252 3.2951 -6.2405 { cb tyr A 261 1lgtA_249F_261}-12.2973 2.5555 -7.4927 { cg tyr A 261 1lgtA_249F_261}-13.7613 2.6633 -7.8436 { cd1 tyr A 261 1lgtA_249F_261}-14.2644 3.7842 -8.512 { ce1 tyr A 261 1lgtA_249F_261}-15.6021 3.8296 -8.9376 { cz tyr A 261 1lgtA_249F_261}-16.4312 2.7437 -8.6812 { oh tyr A 261 1lgtA_249F_261}-17.7339 2.725 -9.1281 { cg tyr A 261 1lgtA_249F_261}P -13.7613 2.6633 -7.8436 { cd2 tyr A 261 1lgtA_249F_261}-14.6264 1.6019 -7.5927 { ce2 tyr A 261 1lgtA_249F_261}-15.9511 1.6376 -8.0068 { cz tyr A 261 1lgtA_249F_261}ghost -16.4312 2.7437 -8.6812 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 249 1lgtA_249F_261}P -8.5505 -1.93 -7.1665 {"}P -8.5505 -1.93 -7.1665 { cd1 phe A 249 1lgtA_249F_261}P -9.2939 -0.7459 -9.268 { cd2 phe A 249 1lgtA_249F_261}P -10.9612 -1.4783 -7.7057 { ce1 phe A 249 1lgtA_249F_261}P -10.2959 -0.2682 -10.121 { ce2 phe A 249 1lgtA_249F_261}P -11.9705 -1.0047 -8.5507 { cz phe A 249 1lgtA_249F_261}P -11.6357 -0.3994 -9.7623 { cb tyr A 261 1lgtA_249F_261}P -12.2973 2.5555 -7.4927 {"}P -12.2973 2.5555 -7.4927 { cd1 tyr A 261 1lgtA_249F_261}P -14.2644 3.7842 -8.512 { cd2 tyr A 261 1lgtA_249F_261}P -14.6264 1.6019 -7.5927 { ce1 tyr A 261 1lgtA_249F_261}P -15.6021 3.8296 -8.9376 { ce2 tyr A 261 1lgtA_249F_261}P -15.9511 1.6376 -8.0068 { oh tyr A 261 1lgtA_249F_261}P -17.7339 2.725 -9.1281 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 249 A}'S' blue -11.599 0.0527 -7.1479 {"}'S' blue -11.3423 0.154 -7.2012 {"}'S' sky -11.2156 0.2349 -7.4515 { CE2 PHE 249 A}'S' blue -13.1961 -0.0072 -7.7979 {"}'S' blue -13.3594 -0.1035 -7.982 {"}'S' blue -13.046 0.2012 -7.8795 {"}'S' sky -13.2067 0.137 -8.0692 {"}'S' blue -13.36 0.0098 -8.2325 {"}'S' blue -13.0039 0.3454 -8.1352 {"}'S' blue -13.1625 0.2547 -8.3159 {"}'S' blue -13.3131 0.1153 -8.4711 {"}'S' blue -12.9321 0.4488 -8.3888 {"}'S' blue -13.0908 0.3398 -8.5637 { CZ PHE 249 A}'S' blue -12.4105 0.7401 -8.684 {"}'S' sky -12.2112 0.9005 -8.7421 {"}'S' blue -12.3535 0.9708 -8.944 {"}'S' sky -11.9805 1.0166 -8.7933 {"}'S' blue -12.1204 1.0975 -8.9962 {"}'S' sky -11.5182 0.8 -8.493 {"}'S' sky -11.6158 0.9639 -8.6656 {"}'S' sky -11.7334 1.093 -8.8541 {"}'S' blue -11.8688 1.1832 -9.0529 {"}'S' blue -11.2618 0.8111 -8.5553 {"}'S' blue -11.4678 1.1178 -8.9068 { HE2 PHE 249 A}'S' blue -13.5627 -0.3047 -8.0037 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 249 A}'S' sea -12.4245 0.1731 -7.3382 {"}'S' green -12.5461 0.2951 -7.5305 {"}'S' sea -12.6884 0.3655 -7.7324 {"}'S' sea -12.0943 0.1193 -7.2146 {"}'S' green -12.1932 0.285 -7.3893 {"}'S' green -12.6083 0.5264 -7.993 {"}'S' green -11.853 0.1947 -7.2814 {"}'S' green -12.5075 0.6333 -8.2504 {"}'S' sea -11.5966 0.2058 -7.3436 {"}'S' green -11.6899 0.3748 -7.5115 {"}'S' green -12.2249 0.7085 -8.2966 {"}'S' sea -11.3812 0.2608 -7.4958 {"}'S' green -11.4813 0.4272 -7.6706 {"}'S' green -11.8812 0.7201 -8.2703 {"}'S' sea -12.0378 0.7431 -8.4776 {"}'S' sea -11.2926 0.4545 -7.8632 {"}'S' green -11.4149 0.5791 -8.0572 {"}'S' green -11.5529 0.6702 -8.2596 { CZ PHE 249 A}'S' sea -12.0897 0.7785 -8.5498 {"}'S' sea -11.8583 0.8903 -8.6009 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 249 A}'S' P -12.3154 0.4113 -7.5817 {"}'S' -12.3113 0.3946 -7.5928 {"}'S' P -12.4553 0.4922 -7.7846 {"}'S' -12.4524 0.4841 -7.789 {"}'S' P -11.9507 0.3586 -7.454 {"}'S' -11.9513 0.3466 -7.4641 {"}'S' P -12.0683 0.4877 -7.6425 {"}'S' -12.0651 0.4321 -7.6768 {"}'S' P -12.2037 0.5779 -7.8413 {"}'S' -12.1948 0.5178 -7.8684 {"}'S' P -12.3516 0.6277 -8.0463 {"}'S' -12.3474 0.6106 -8.052 {"}'S' P -11.8026 0.5125 -7.6952 {"}'S' -11.8076 0.4651 -7.722 {"}'S' P -11.9306 0.6155 -7.8902 {"}'S' -11.9322 0.5476 -7.9179 {"}'S' P -12.073 0.6814 -8.093 {"}'S' -12.0706 0.6389 -8.1039 {"}'S' P -11.6 0.5609 -7.8616 {"}'S' -11.603 0.5486 -7.8663 {"}'S' P -11.7344 0.6593 -8.0626 {"}'S' -11.7372 0.6388 -8.0687 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 261 A}'S' blue -12.3656 1.2644 -8.6721 {"}'S' sky -12.2561 1.1184 -8.4909 {"}'S' blue -12.2157 1.5345 -8.9117 {"}'S' sky -12.1304 1.3489 -8.7493 {"}'S' sky -12.0197 1.201 -8.566 {"}'S' blue -11.8913 1.4506 -8.7875 {"}'S' sky -11.7813 1.3071 -8.6044 {"}'S' blue -11.6445 1.5476 -8.7663 {"}'S' blue -11.5265 1.4193 -8.5774 { CD2 TYR 261 A}'S' blue -13.7512 0.1096 -7.8553 {"}'S' blue -13.5898 0.1947 -7.6696 {"}'S' blue -13.6689 0.2274 -8.0995 {"}'S' blue -13.5077 0.2938 -7.9097 {"}'S' blue -13.3526 0.4111 -7.7416 {"}'S' blue -13.556 0.3948 -8.2705 {"}'S' sky -13.3949 0.4571 -8.0799 {"}'S' blue -13.2413 0.5823 -7.9156 {"}'S' blue -13.3953 0.6063 -8.3383 {"}'S' blue -13.2327 0.7052 -8.1558 { HB3 TYR 261 A}'S' blue -11.6775 0.4381 -7.0253 {"}'S' blue -11.2587 0.6338 -7.3161 {"}'S' sky -11.5457 1.1298 -8.3632 { HD2 TYR 261 A}'S' blue -13.5275 0.1125 -7.3861 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 TYR 261 A}'S' green -12.6381 0.6153 -7.8848 {"}'S' green -12.5293 0.4747 -7.7057 {"}'S' green -12.3986 0.3803 -7.5107 {"}'S' green -12.2513 0.3386 -7.3084 {"}'S' green -12.4877 0.7361 -8.1562 {"}'S' green -11.9949 0.3219 -7.4036 {"}'S' sea -11.8355 0.3523 -7.2063 {"}'S' sea -12.2808 0.8596 -8.3322 {"}'S' green -11.6732 0.3845 -7.4156 {"}'S' sea -12.038 0.9532 -8.4131 {"}'S' green -11.9735 0.7443 -8.2705 {"}'S' green -11.5792 0.4665 -7.6834 {"}'S' sea -11.4159 0.5155 -7.4869 {"}'S' sea -11.7904 1.0625 -8.4295 {"}'S' green -11.7353 0.8512 -8.3008 {"}'S' green -11.6327 0.6984 -8.1257 {"}'S' green -11.4956 0.6234 -7.9263 {"}'S' sea -11.3392 0.6342 -7.727 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 TYR 261 A}'S' P -12.4 0.56 -7.9928 {"}'S' -12.3949 0.5738 -7.9838 {"}'S' P -12.2839 0.4282 -7.8074 {"}'S' -12.2737 0.4763 -7.7873 {"}'S' P -12.1473 0.3469 -7.6073 {"}'S' -12.1436 0.3922 -7.5989 {"}'S' P -12.2097 0.6633 -8.1869 {"}'S' -12.2088 0.6729 -8.1775 {"}'S' P -12.1071 0.5105 -8.0118 {"}'S' -12.104 0.5672 -7.9743 {"}'S' P -11.9787 0.4097 -7.8166 {"}'S' -11.9838 0.4817 -7.7871 {"}'S' P -11.8314 0.3667 -7.6141 {"}'S' -11.8389 0.4073 -7.6062 {"}'S' P -11.8698 0.5856 -8.0925 {"}'S' -11.877 0.6213 -8.0644 {"}'S' P -11.7349 0.4907 -7.8916 {"}'S' -11.7478 0.5328 -7.8692 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 249 A}'M' green -9.1953 1.8772 -5.9314 {"}'M' green -9.3542 1.7885 -6.113 {"}'M' green -9.4978 1.6808 -6.3855 {"}'M' green -9.0922 2.1098 -5.9804 {"}'M' green -8.9483 2.3149 -6.0424 {"}'M' green -8.7631 2.485 -6.1084 {"}'M' green -9.3995 1.9973 -7.1113 {"}'M' green -8.8361 2.615 -6.5557 {"}'M' green -8.8975 2.5797 -6.9887 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 249 A}'M' greentint -9.2555 2.0764 -6.1823 {"}'M' greentint -9.4041 1.9195 -6.3307 {"}'M' greentint -9.5078 1.8231 -6.6282 {"}'M' greentint -9.1063 2.3065 -6.2444 {"}'M' greentint -9.2648 2.2134 -6.4228 {"}'M' greentint -9.4041 2.0454 -6.556 {"}'M' greentint -9.4774 1.9171 -6.873 {"}'M' greentint -8.9193 2.4957 -6.3123 {"}'M' greentint -9.0795 2.4374 -6.5043 {"}'M' greentint -9.2343 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{"}'S' sky -11.0114 0.6681 -9.8278 {"}'S' blue -10.3226 0.5971 -9.3314 {"}'S' sky -10.4744 0.6257 -9.5353 {"}'S' sky -10.632 0.6139 -9.736 {"}'S' blue -10.792 0.5626 -9.9293 { CZ TYR 219 A}'S' blue -12.9305 0.2663 -7.2274 {"}'S' sky -13.0728 0.3366 -7.4294 {"}'S' blue -13.2271 0.3543 -7.634 {"}'S' sky -13.1538 0.4826 -7.8929 {"}'S' blue -12.5691 0.6237 -8.7681 {"}'S' blue -12.3597 0.5818 -8.9201 @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 219 A}'S' sea -10.7809 0.1561 -6.9248 {"}'S' sea -10.5166 0.3044 -6.9837 {"}'S' green -10.6773 0.226 -7.1683 {"}'S' green -10.8324 0.1073 -7.3362 {"}'S' sea -10.2313 0.4027 -7.0331 {"}'S' green -10.3921 0.3502 -7.2256 { CD1 TYR 219 A}'S' sea -11.2033 0.2462 -6.4667 {"}'S' sea -11.3672 0.1895 -6.6624 {"}'S' green -11.025 0.2346 -6.6612 {"}'S' green -11.1886 0.1731 -6.8554 {"}'S' sea -10.8161 0.1918 -6.8136 {"}'S' green -10.9792 0.1312 -7.0074 {"}'S' sea -11.1405 0.0347 -7.1886 { CD2 TYR 219 A}'S' sea -11.028 -0.0099 -7.4878 {"}'S' green -10.8831 0.1908 -7.5731 {"}'S' green -10.541 0.2847 -7.4277 {"}'S' green -10.6832 0.355 -7.6296 {"}'S' green -10.8375 0.3727 -7.8343 {"}'S' sea -10.3103 0.4008 -7.4789 {"}'S' green -10.4502 0.4817 -7.6818 {"}'S' green -10.6032 0.5159 -7.8902 {"}'S' sea -10.1985 0.5674 -7.7385 {"}'S' sea -10.3464 0.6172 -7.9435 {"}'S' sea -10.5023 0.6228 -8.1476 { CE1 TYR 219 A}'S' sea -12.146 0.3938 -6.6183 {"}'S' sea -12.3026 0.4168 -6.8256 {"}'S' sea -12.4642 0.3994 -7.0305 {"}'S' sea -11.8177 0.3439 -6.6076 {"}'S' green -11.9668 0.3969 -6.8149 {"}'S' green -12.1237 0.4112 -7.0224 {"}'S' green -12.2858 0.3878 -7.2249 {"}'S' sea -11.4718 0.2061 -6.5562 {"}'S' green -11.6089 0.297 -6.7592 {"}'S' green -11.7576 0.3508 -6.9661 {"}'S' green -11.9152 0.368 -7.1735 {"}'S' green -11.3966 0.2048 -6.8872 {"}'S' green -11.7001 0.2858 -7.3017 {"}'S' green -11.3364 0.1387 -7.205 { CE2 TYR 219 A}'S' green -11.7063 0.6243 -8.259 {"}'S' green -11.8594 0.6585 -8.4674 {"}'S' sea -12.0204 0.6436 -8.6704 {"}'S' green -11.0292 0.132 -7.6056 {"}'S' green -11.4547 0.71 -8.3157 {"}'S' green -11.6026 0.7598 -8.5207 {"}'S' sea -11.7585 0.7654 -8.7248 {"}'S' sea -11.9189 0.7292 -8.9221 {"}'S' green -11.1816 0.7476 -8.3646 {"}'S' green -11.3241 0.8135 -8.5675 {"}'S' green -11.476 0.8406 -8.771 {"}'S' green -11.6336 0.8275 -8.9715 {"}'S' sea -11.7945 0.775 -9.164 {"}'S' green -10.7324 0.5594 -8.145 {"}'S' green -10.851 0.693 -8.336 {"}'S' sea -10.9854 0.7914 -8.537 {"}'S' sea -11.1322 0.8522 -8.7447 {"}'S' green -11.2888 0.8752 -8.9521 {"}'S' green -11.4504 0.8578 -9.157 {"}'S' sea -11.6143 0.8011 -9.3526 {"}'S' sea -10.953 0.8553 -8.9413 {"}'S' green -11.1099 0.8696 -9.1488 {"}'S' sea -11.272 0.8461 -9.3514 {"}'S' sea -10.7438 0.8092 -9.0926 {"}'S' green -10.9014 0.8264 -9.3 {"}'S' green -11.0631 0.8034 -9.5038 {"}'S' sea -11.2263 0.7427 -9.6976 {"}'S' sea -10.5305 0.7227 -9.2205 {"}'S' sea -10.6863 0.7442 -9.4281 {"}'S' sea -10.8479 0.7253 -9.6328 { CZ TYR 219 A}'S' sea -12.6999 0.3824 -7.2786 {"}'S' sea -12.8398 0.4633 -7.4815 {"}'S' sea -12.9928 0.4975 -7.6899 {"}'S' green -12.4527 0.4588 -7.3394 {"}'S' green -12.5881 0.549 -7.5382 {"}'S' green -12.736 0.5988 -7.7432 {"}'S' sea -12.8919 0.6044 -7.9473 {"}'S' green -12.6094 0.6796 -7.9935 {"}'S' green -12.767 0.6665 -8.194 {"}'S' green -12.5838 0.6968 -8.3794 {"}'S' green -12.2433 0.7086 -8.3713 {"}'S' sea -12.4054 0.6851 -8.5739 {"}'S' green -11.3642 0.2194 -7.5332 {"}'S' green -11.7285 0.5944 -8.1082 {"}'S' green -11.8772 0.6482 -8.3151 {"}'S' green -12.0348 0.6654 -8.5225 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 219 A}'S' P -11.5443 0.2643 -7.094 {"}'S' -11.546 0.2601 -7.0938 { CE2 TYR 219 A}'S' P -11.4442 0.4171 -7.8637 {"}'S' -11.4412 0.3962 -7.8822 {"}'S' P -11.5665 0.5434 -8.0562 {"}'S' -11.5643 0.5368 -8.0603 {"}'S' P -11.1041 0.3268 -7.7558 {"}'S' -11.1048 0.3142 -7.7693 {"}'S' P -11.2018 0.4907 -7.9284 {"}'S' -11.2017 0.4509 -7.9603 {"}'S' P -11.3193 0.6198 -8.1169 {"}'S' -11.3183 0.5888 -8.1358 {"}'S' P -10.941 0.5069 -7.9859 {"}'S' -10.9443 0.4902 -7.9985 {"}'S' P -11.0537 0.6446 -8.1696 {"}'S' -11.0544 0.6285 -8.1789 { CZ TYR 219 A}'S' P -12.1871 0.4836 -7.3921 {"}'S' -12.1874 0.4771 -7.3962 {"}'S' P -12.315 0.5866 -7.5871 {"}'S' -12.3167 0.546 -7.6041 {"}'S' P -12.4575 0.6525 -7.79 {"}'S' -12.4549 0.6131 -7.7997 {"}'S' P -11.8658 0.3984 -7.3675 {"}'S' -11.8682 0.391 -7.3725 {"}'S' P -11.9844 0.532 -7.5585 {"}'S' -11.9929 0.497 -7.574 {"}'S' P -12.1188 0.6304 -7.7595 {"}'S' -12.1276 0.5645 -7.7786 {"}'S' P -12.2656 0.6912 -7.9672 {"}'S' -12.2686 0.632 -7.9766 {"}'S' P -12.4222 0.7142 -8.1746 {"}'S' -12.4214 0.7017 -8.1758 {"}'S' P -11.5721 0.2693 -7.3809 {"}'S' -11.577 0.2603 -7.3873 {"}'S' P -11.6771 0.4257 -7.5602 {"}'S' -11.6974 0.3812 -7.5812 {"}'S' P -11.7994 0.5503 -7.7541 {"}'S' -11.8141 0.5108 -7.7668 {"}'S' P -11.9373 0.6413 -7.9565 {"}'S' -11.9503 0.5888 -7.9657 {"}'S' P -12.0864 0.6943 -8.1638 {"}'S' -12.0913 0.6574 -8.1656 {"}'S' P -11.4692 0.3772 -7.7127 {"}'S' -11.4897 0.3445 -7.7248 {"}'S' P -11.5914 0.5035 -7.9051 {"}'S' -11.6064 0.4738 -7.9121 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 232 A}'S' sky -12.6819 0.7005 -6.9217 {"}'S' sky -12.5242 0.7136 -6.7212 {"}'S' blue -12.3646 0.7655 -6.5286 {"}'S' sky -12.0731 0.6985 -6.5489 { CG PHE 232 A}'S' sky -12.3703 0.9794 -8.7947 {"}'S' sky -12.1711 0.9366 -8.9604 {"}'S' sky -12.0569 0.9619 -9.2475 {"}'S' blue -11.9412 1.0452 -9.5356 {"}'S' blue -11.7294 1.1169 -9.6726 {"}'S' sky -11.5875 1.0488 -9.4699 { CD1 PHE 232 A}'S' blue -10.8398 1.167 -8.6834 {"}'S' sky -11.3283 1.0371 -9.706 {"}'S' sky -10.6965 1.0547 -8.8944 {"}'S' blue -10.5361 1.1524 -8.7145 {"}'S' sky -11.1286 0.9951 -9.8712 {"}'S' sky -10.4983 1.0079 -9.0587 {"}'S' blue -10.337 1.1044 -8.8775 {"}'S' sky -10.8658 0.9666 -9.9515 {"}'S' sky -10.7134 0.9257 -9.7442 {"}'S' sky -10.3902 0.9631 -9.3366 {"}'S' blue -10.2275 1.0388 -9.1468 {"}'S' blue -10.0691 1.1527 -8.9734 {"}'S' blue -10.4566 0.9554 -9.834 {"}'S' blue -10.299 0.9671 -9.6332 { HB2 PHE 232 A}'S' sky -11.7357 0.6325 -6.546 {"}'S' sky -11.4894 0.5033 -6.5593 {"}'S' sky -11.116 0.5335 -6.495 {"}'S' sky -10.8268 0.5637 -6.5611 {"}'S' blue -10.5754 0.6257 -6.6863 {"}'S' sky -10.4143 0.6427 -6.892 {"}'S' sky -10.3017 0.6826 -7.1249 {"}'S' blue -10.2281 0.7696 -7.3619 {"}'S' sky -10.2124 0.8729 -7.6016 {"}'S' sky -10.4016 0.9159 -8.0016 { HB3 PHE 232 A}'S' blue -12.9872 0.6704 -6.9562 {"}'S' blue -12.8286 0.7349 -6.7694 {"}'S' sky -13.1753 0.748 -7.653 {"}'S' sky -12.8863 0.6417 -7.2492 {"}'S' sky -12.727 0.6721 -7.052 {"}'S' blue -13.1011 0.9831 -8.0325 {"}'S' sky -12.9985 0.8303 -7.8574 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 232 A}'S' sea -12.7113 0.6305 -7.3543 {"}'S' sea -12.5593 0.5891 -7.1458 {"}'S' sea -12.3996 0.5862 -6.9387 {"}'S' sea -12.2367 0.6229 -6.7381 {"}'S' green -12.8223 0.7834 -7.9682 {"}'S' green -12.6992 0.6587 -7.7749 {"}'S' green 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-8.8719 { CD1 PHE 232 A}'S' sea -11.326 1.0576 -9.2803 {"}'S' sea -11.1663 1.0547 -9.0733 {"}'S' sea -11.0033 1.0914 -8.8726 {"}'S' sea -11.1792 0.9841 -9.4987 {"}'S' green -11.0215 0.9696 -9.2918 {"}'S' sea -10.8594 0.9931 -9.0892 {"}'S' sea -10.98 0.9413 -9.6643 {"}'S' green -10.8227 0.925 -9.4559 {"}'S' sea -10.6606 0.9471 -9.2531 {"}'S' sea -10.554 0.9251 -9.5364 { HB2 PHE 232 A}'S' sea -11.8982 0.5834 -6.7432 {"}'S' green -11.9522 0.4517 -7.1441 {"}'S' green -11.805 0.4086 -6.9416 {"}'S' green -11.6476 0.4265 -6.7425 {"}'S' green -11.4238 0.311 -6.8323 {"}'S' sea -11.2653 0.3975 -6.6509 {"}'S' green -11.4334 0.2105 -7.248 {"}'S' green -11.2779 0.2224 -7.0502 {"}'S' green -11.1192 0.2869 -6.8634 {"}'S' sea -10.9663 0.403 -6.698 {"}'S' green -11.3294 0.2187 -7.547 {"}'S' sea -11.177 0.1937 -7.3432 {"}'S' green -11.0176 0.2242 -7.146 {"}'S' sea -10.8596 0.3099 -6.965 {"}'S' sea -10.7095 0.4458 -6.8097 {"}'S' green -11.4629 0.7315 -8.2719 {"}'S' green -11.0135 0.2385 -7.5537 {"}'S' green -10.8553 0.2563 -7.3553 {"}'S' green -10.6976 0.3323 -7.1724 {"}'S' sea -10.5472 0.4637 -7.0139 {"}'S' green -11.2201 0.8251 -8.3528 {"}'S' green -10.7613 0.3384 -7.6231 {"}'S' green -10.598 0.3873 -7.4265 {"}'S' sea -10.4408 0.5057 -7.2558 {"}'S' sea -10.9725 0.9343 -8.3691 {"}'S' green -10.9174 0.7231 -8.2405 {"}'S' green -10.8148 0.5703 -8.0654 {"}'S' green -10.6777 0.4953 -7.866 {"}'S' green -10.5213 0.506 -7.6667 {"}'S' sea -10.3652 0.6014 -7.4922 {"}'S' sea -10.6599 0.7932 -8.1575 {"}'S' green -10.5265 0.6904 -7.9569 {"}'S' sea -10.363 0.719 -7.7535 { HB3 PHE 232 A}'S' sea -13.0387 0.6667 -7.453 {"}'S' sea -12.8701 0.7295 -7.6623 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB PHE 232 A}'S' P -12.4995 0.6184 -7.9387 {"}'S' -12.4893 0.6472 -7.9297 {"}'S' P -12.362 0.5266 -7.7367 {"}'S' -12.349 0.5791 -7.7275 {"}'S' P -12.2133 0.4728 -7.5298 {"}'S' -12.2076 0.5099 -7.5269 {"}'S' P -12.368 0.6921 -8.2184 {"}'S' -12.3655 0.7023 -8.2139 {"}'S' P -12.2412 0.5765 -8.0221 {"}'S' -12.2308 0.6319 -8.0017 {"}'S' P -12.0991 0.4981 -7.8169 {"}'S' -12.0933 0.5655 -7.8021 {"}'S' P -11.9468 0.4572 -7.6096 {"}'S' -11.947 0.4955 -7.605 {"}'S' P -12.1118 0.685 -8.3007 {"}'S' -12.1115 0.6916 -8.2966 {"}'S' P -11.9834 0.5815 -8.105 {"}'S' -11.9826 0.6219 -8.0891 {"}'S' P -11.8423 0.5146 -7.9037 {"}'S' -11.844 0.5542 -7.8928 { HB2 PHE 232 A}'S' P -11.8724 0.3878 -7.4323 {"}'S' -11.8612 0.4049 -7.4312 {"}'S' P -11.7351 0.3063 -7.2328 {"}'S' -11.7342 0.3089 -7.234 {"}'S' P -11.5832 0.2805 -7.0295 {"}'S' -11.5818 0.2839 -7.0302 {"}'S' P -11.8202 0.4872 -7.8245 {"}'S' -11.7996 0.518 -7.8068 {"}'S' P -11.7114 0.3465 -7.6454 {"}'S' -11.689 0.395 -7.6293 {"}'S' P -11.5807 0.2521 -7.4504 {"}'S' -11.5729 0.2763 -7.4469 {"}'S' P -11.5821 0.4318 -7.9325 {"}'S' -11.5724 0.4569 -7.9163 {"}'S' P -11.466 0.3001 -7.747 {"}'S' -11.4597 0.3326 -7.7339 {"}'S' P -11.3918 0.5351 -8.1265 {"}'S' -11.3867 0.5606 -8.1015 {"}'S' P -11.2892 0.3824 -7.9515 {"}'S' -11.2877 0.4227 -7.9244 {"}'S' P -11.1607 0.2816 -7.7563 {"}'S' -11.1621 0.2979 -7.7499 {"}'S' P -11.1556 0.6162 -8.2101 {"}'S' -11.1571 0.6329 -8.1903 {"}'S' P -11.0519 0.4574 -8.0322 {"}'S' -11.0581 0.489 -8.0068 {"}'S' P -10.917 0.3626 -7.8313 {"}'S' -10.9169 0.3643 -7.8299 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 219 A}'M' green -9.2961 2.1924 -6.066 {"}'M' green -8.8905 2.6214 -5.6609 {"}'M' green -8.7466 2.8265 -5.7229 {"}'M' green -9.3469 2.1836 -6.5777 {"}'M' green -8.54 3.1901 -6.4958 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 219 A}'M' greentint -9.0538 2.588 -5.8627 {"}'M' greentint -9.2024 2.4311 -6.0112 {"}'M' greentint -9.3061 2.3347 -6.3087 {"}'M' greentint -8.9046 2.8181 -5.9249 {"}'M' greentint -9.0632 2.725 -6.1033 {"}'M' greentint -9.2024 2.557 -6.2365 {"}'M' greentint -9.2757 2.4288 -6.5535 {"}'M' greentint -8.7176 3.0073 -5.9928 {"}'M' greentint -8.8778 2.949 -6.1847 {"}'M' greentint -9.0326 2.8259 -6.3494 {"}'M' greentint -9.1683 2.6484 -6.4756 {"}'M' greentint -9.1978 2.509 -6.7917 {"}'M' greentint -8.6344 3.1266 -6.2362 {"}'M' greentint -8.7969 3.0451 -6.4225 {"}'M' greentint -8.9491 2.9091 -6.5825 {"}'M' greentint -9.0858 2.7275 -6.7073 {"}'M' greentint -8.6958 3.0913 -6.6691 {"}'M' greentint -8.842 2.9478 -6.819 {"}'M' greentint -8.9727 2.7658 -6.9375 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 232 A}'M' greentint -9.2378 2.2231 -6.024 {"}'M' greentint -9.0875 2.3475 -5.8642 {"}'M' greentint -8.9544 2.5231 -5.7411 {"}'M' greentint -9.1872 2.2206 -6.3576 {"}'M' greentint -9.0265 2.2965 -6.1707 {"}'M' greentint -8.877 2.4419 -6.0183 {"}'M' greentint -8.7524 2.6419 -5.9125 {"}'M' greentint -8.6638 2.8795 -5.8645 {"}'M' greentint -9.2422 2.381 -6.8164 {"}'M' greentint -9.0935 2.3314 -6.6103 {"}'M' greentint -8.9311 2.3763 -6.4123 {"}'M' greentint -8.7769 2.5089 -6.2506 {"}'M' greentint -8.6527 2.7123 -6.146 {"}'M' greentint -8.5744 2.9579 -6.1139 {"}'M' greentint -8.9825 2.5149 -6.7807 {"}'M' greentint -8.8215 2.5429 -6.5807 {"}'M' greentint -8.6734 2.6949 -6.4319 {"}'M' greentint -8.5786 2.929 -6.3746 {"}'M' greentint -8.849 2.7327 -6.8343 {"}'M' greentint -8.689 2.8296 -6.6548 {"}'M' greentint -8.6341 3.0829 -6.6546 {"}'M' greentint -8.7673 2.9793 -6.8541 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 219 A}'M' green -9.8884 1.0434 -4.1696 {"}'M' green -10.0933 0.84 -4.5998 {"}'M' green -9.4179 1.7997 -4.9997 {"}'M' green -9.7013 1.4996 -5.2826 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 219 A}'M' greentint -10.0216 0.9398 -4.3691 {"}'M' greentint -9.8067 1.29 -4.1894 {"}'M' greentint -9.9667 1.1931 -4.3689 {"}'M' greentint -10.077 1.0937 -4.6491 {"}'M' greentint -9.6732 1.5079 -4.243 {"}'M' greentint -9.8342 1.4798 -4.4429 {"}'M' greentint -9.9822 1.3278 -4.5918 {"}'M' greentint -10.0488 1.1912 -4.9027 {"}'M' greentint -10.0992 0.9365 -4.8981 {"}'M' greentint 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-7.2777 {"}'S' P -11.7903 0.9407 -6.8704 {"}'S' -11.797 0.9127 -6.8749 {"}'S' P -11.9394 0.9937 -7.0777 {"}'S' -11.9564 0.8794 -7.0834 {"}'S' P -12.0963 1.008 -7.2852 {"}'S' -12.1075 0.8456 -7.2737 {"}'S' P -11.7301 0.9476 -7.2289 {"}'S' -11.7411 0.9108 -7.227 { CZ TYR 19 A}'S' P -12.9723 0.8609 -7.3979 {"}'S' -12.95 0.8276 -7.4299 {"}'S' P -13.1151 0.9274 -7.6015 {"}'S' -13.1086 0.9181 -7.6075 {"}'S' P -12.7729 1.0212 -7.456 {"}'S' -12.7208 0.9031 -7.5475 {"}'S' P -12.9152 1.0916 -7.658 {"}'S' -12.8675 1.0015 -7.7123 {"}'S' P -13.0695 1.1093 -7.8626 {"}'S' -13.0573 1.0884 -7.872 {"}'S' P -12.6821 1.2183 -7.7101 {"}'S' -12.6282 1.0524 -7.795 {"}'S' P -12.8351 1.2525 -7.9185 {"}'S' -12.7972 1.1602 -7.9516 {"}'S' P -12.5784 1.3538 -7.9718 {"}'S' -12.5467 1.2176 -8.0135 {"}'S' P -12.7343 1.3594 -8.1759 {"}'S' -12.7223 1.3209 -8.1831 {"}'S' P -11.9168 1.1009 -7.437 {"}'S' -11.9387 0.989 -7.5217 {"}'S' P -12.0295 1.2386 -7.6207 {"}'S' -12.0467 1.0749 -7.7129 {"}'S' P -12.1574 1.3416 -7.8157 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2.5409 -6.78 {"}'M' greentint -9.0547 3.0611 -6.4112 {"}'M' greentint -9.2095 2.9381 -6.5759 {"}'M' greentint -9.3452 2.7605 -6.702 {"}'M' greentint -9.3748 2.6211 -7.0182 {"}'M' greentint -8.9739 3.1572 -6.649 {"}'M' greentint -9.1261 3.0212 -6.8089 {"}'M' greentint -9.2628 2.8396 -6.9337 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ASN 8 A}'M' green -9.4939 2.3651 -6.104 {"}'M' green -9.3607 2.5407 -5.9809 {"}'M' green -9.5935 2.2382 -6.5974 {"}'M' green -8.9597 3.231 -6.397 {"}'M' green -8.9687 3.2003 -6.6637 {"}'M' green -9.0404 3.1005 -6.8944 {"}'M' green -9.1737 2.9969 -7.0939 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ASN 8 A}'M' greentint -9.4328 2.3141 -6.4106 {"}'M' greentint -9.2833 2.4595 -6.2582 {"}'M' greentint -9.1587 2.6595 -6.1523 {"}'M' greentint -9.0702 2.8971 -6.1043 {"}'M' greentint -9.4998 2.349 -6.8501 {"}'M' greentint -9.3375 2.3939 -6.6522 {"}'M' greentint -9.1833 2.5265 -6.4904 {"}'M' greentint -9.059 2.7298 -6.3858 {"}'M' greentint -8.9807 2.9755 -6.3537 {"}'M' greentint -9.3888 2.5325 -7.0205 {"}'M' greentint -9.2278 2.5605 -6.8206 {"}'M' greentint -9.0798 2.7125 -6.6717 {"}'M' greentint -8.985 2.9466 -6.6144 {"}'M' greentint -9.2553 2.7503 -7.0741 {"}'M' greentint -9.0954 2.8472 -6.8946 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 19 A}'M' green -10.0417 1.1348 -4.2582 {"}'M' green -10.175 1.0312 -4.4577 {"}'M' green -9.6948 1.4975 -4.1334 {"}'M' green -10.1053 1.3568 -5.2314 {"}'M' green -9.5713 1.891 -5.0883 {"}'M' green -9.7215 1.7666 -5.2481 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 19 A}'M' greentint -9.9601 1.3814 -4.2781 {"}'M' greentint -10.12 1.2845 -4.4575 {"}'M' greentint -10.2304 1.1851 -4.7378 {"}'M' greentint -9.8266 1.5992 -4.3316 {"}'M' greentint -9.9876 1.5712 -4.5316 {"}'M' greentint -10.1356 1.4192 -4.6804 {"}'M' greentint -10.2021 1.2825 -4.9914 {"}'M' greentint -9.6382 1.7691 -4.3982 {"}'M' greentint 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1mveA_40F_137R}P -13.0477 1.635 -3.5867 { n asn A 139 1mveA_40F_137R}P -14.3328 -0.4291 -3.4452 { ca asn A 139 1mveA_40F_137R}P -15.5988 -1.1128 -3.6147 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ser A 38 1mveA_40F_137R}P -11.1705 -2.4042 -0.892 {"}-11.1705 -2.4042 -0.892 { ca mse A 39 1mveA_40F_137R}-9.0291 0.4304 -2.1904 { ca phe A 40 1mveA_40F_137R}-7.4058 0.0465 -5.5815 { ca leu A 41 1mveA_40F_137R}-5.8746 1.8975 -8.5268 { ca tyr A 42 1mveA_40F_137R}-7.4477 0.767 -11.786 { ca gly A 135 1mveA_40F_137R}P -8.1619 5.924 -11.4391 {"}-8.1619 5.924 -11.4391 { ca leu A 136 1mveA_40F_137R}-8.6371 5.561 -7.6721 { ca arg A 137 1mveA_40F_137R}-11.4521 3.2561 -6.6034 { ca phe A 138 1mveA_40F_137R}-13.0477 1.635 -3.5867 { ca asn A 139 1mveA_40F_137R}-15.5988 -1.1128 -3.6147 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 40 1mveA_40F_137R}P -7.4058 0.0465 -5.5815 { cb phe A 40 1mveA_40F_137R}-7.9395 -1.2775 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{sidechain} { cb phe A 40 1mveA_40F_137R}P -7.9395 -1.2775 -6.1557 {"}P -7.9395 -1.2775 -6.1557 { cd1 phe A 40 1mveA_40F_137R}P -9.4948 -1.1993 -8.1386 { cd2 phe A 40 1mveA_40F_137R}P -10.4724 -1.2137 -5.9462 { ce1 phe A 40 1mveA_40F_137R}P -10.7895 -1.2134 -8.7241 { ce2 phe A 40 1mveA_40F_137R}P -11.7689 -1.2291 -6.5014 { cz phe A 40 1mveA_40F_137R}P -11.9401 -1.2262 -7.8929 { cb arg A 137 1mveA_40F_137R}P -11.8035 2.2312 -7.682 {"}P -11.8035 2.2312 -7.682 { cg arg A 137 1mveA_40F_137R}P -11.5569 2.7401 -9.1016 {"}P -11.5569 2.7401 -9.1016 { cd arg A 137 1mveA_40F_137R}P -12.3461 1.8776 -10.062 {"}P -12.3461 1.8776 -10.062 { ne arg A 137 1mveA_40F_137R}P -12.3336 2.4567 -11.4006 { nh1 arg A 137 1mveA_40F_137R}P -14.0946 1.1731 -12.1287 {"}P -14.0946 1.1731 -12.1287 { nh2 arg A 137 1mveA_40F_137R}P -13.089 2.6691 -13.5684 {"}P -13.089 2.6691 -13.5684 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 40 A}'S' blue -10.1873 0.3199 -6.8396 {"}'S' 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{"}'M' greentint -9.1824 2.6986 -7.0241 {"}'M' greentint -9.319 2.517 -7.1489 {"}'M' greentint -9.3166 2.3432 -7.463 {"}'M' greentint -8.929 2.8808 -7.1108 {"}'M' greentint -9.0752 2.7372 -7.2607 {"}'M' greentint -9.206 2.5553 -7.3791 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 366 A}'M' greentint -9.5375 1.7825 -6.5622 {"}'M' greentint -9.3873 1.9069 -6.4023 {"}'M' greentint -9.2542 2.0825 -6.2792 {"}'M' greentint -9.1489 2.2972 -6.2015 {"}'M' greentint -9.4869 1.78 -6.8957 {"}'M' greentint -9.3263 1.8559 -6.7089 {"}'M' greentint -9.1768 2.0013 -6.5565 {"}'M' greentint -9.0522 2.2013 -6.4507 {"}'M' greentint -8.9636 2.4389 -6.4026 {"}'M' greentint -8.9191 2.6936 -6.4153 {"}'M' greentint -9.3932 1.8908 -7.1484 {"}'M' greentint -9.2309 1.9357 -6.9505 {"}'M' greentint -9.0767 2.0683 -6.7888 {"}'M' greentint -8.9524 2.2717 -6.6841 {"}'M' greentint -8.8742 2.5173 -6.652 {"}'M' greentint -8.8532 2.7727 -6.6953 {"}'M' greentint -9.2823 2.0743 -7.3189 {"}'M' greentint -9.1213 2.1023 -7.1189 {"}'M' greentint -8.9732 2.2543 -6.97 {"}'M' greentint -8.8784 2.4884 -6.9127 {"}'M' greentint -8.8621 2.7421 -6.962 {"}'M' greentint -9.1488 2.2921 -7.3724 {"}'M' greentint -8.9888 2.389 -7.193 {"}'M' greentint -8.9338 2.6423 -7.1927 {"}'M' greentint -9.0671 2.5387 -7.3922 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 353 A}'M' green -9.9395 0.9256 -4.2947 {"}'M' green -10.0728 0.8219 -4.4942 {"}'M' green -9.7537 1.017 -4.1367 {"}'M' green -10.1282 0.9758 -4.7742 {"}'M' green -10.1 1.0733 -5.0278 {"}'M' green -9.4011 1.465 -4.2338 {"}'M' green -9.2874 1.6591 -4.485 {"}'M' green -9.4391 1.6946 -4.6902 {"}'M' green -9.8956 1.3686 -5.1902 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 353 A}'M' greentint -9.8579 1.1721 -4.3145 {"}'M' greentint -10.0178 1.0752 -4.4939 {"}'M' greentint -9.5926 1.2882 -4.1699 {"}'M' greentint -9.7244 1.39 -4.368 {"}'M' greentint -9.8854 1.3619 -4.568 {"}'M' greentint -10.0334 1.21 -4.7169 {"}'M' greentint -9.536 1.5599 -4.4347 {"}'M' greentint -9.6948 1.563 -4.6406 {"}'M' greentint -9.8551 1.4719 -4.8234 {"}'M' greentint -9.9965 1.3014 -4.959 {"}'M' greentint -9.6004 1.6554 -4.888 {"}'M' greentint -9.757 1.5433 -5.0594 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O THR 366 A}'M' green -10.289 0.8959 -4.7382 {"}'M' green -10.1318 0.8913 -4.5325 {"}'M' green -9.9692 0.947 -4.3384 {"}'M' green -9.8114 1.0572 -4.1649 {"}'M' green -9.666 1.2189 -4.022 {"}'M' green -10.2055 1.0737 -4.9961 {"}'M' green -9.4681 1.487 -4.1579 {"}'M' green -10.0772 1.2854 -5.1477 {"}'M' green -9.3816 1.7095 -4.3655 {"}'M' green -9.9375 1.52 -5.2221 {"}'M' green -9.3963 1.8357 -4.6109 {"}'M' green -9.6919 1.6463 -5.0571 {"}'M' green -9.5332 1.7436 -4.8795 @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 366 A}'M' greentint -10.0575 1.0267 -4.7916 {"}'M' greentint -9.8983 1.0491 -4.5911 {"}'M' greentint -9.7386 1.1377 -4.4101 {"}'M' greentint -9.5919 1.2873 -4.2626 {"}'M' greentint -9.9388 1.2086 -4.9461 {"}'M' greentint -9.78 1.2196 -4.7452 {"}'M' greentint -9.623 1.3155 -4.5679 {"}'M' greentint -9.4845 1.4861 -4.4364 {"}'M' greentint -9.8045 1.4165 -5.0219 {"}'M' greentint -9.6414 1.4457 -4.8193 {"}'M' greentint -9.4916 1.5994 -4.6684 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 40 1n12A_42F_120L}P -12.2569 -2.1624 0.2834 {"}-12.2569 -2.1624 0.2834 { ca lys A 40 1n12A_42F_120L}-10.9247 -2.3176 -0.2699 { c lys A 40 1n12A_42F_120L}-10.6673 -1.2651 -1.3477 { o lys A 40 1n12A_42F_120L}-11.4856 -1.0556 -2.2508 { c lys A 40 1n12A_42F_120L}P -10.6673 -1.2651 -1.3477 { n glu A 41 1n12A_42F_120L}-9.5324 -0.5847 -1.242 { ca glu A 41 1n12A_42F_120L}-9.1741 0.4378 -2.2194 { c glu A 41 1n12A_42F_120L}-8.3489 -0.2103 -3.3105 { o glu A 41 1n12A_42F_120L}-7.5795 -1.1398 -3.0447 { c glu A 41 1n12A_42F_120L}P -8.3489 -0.2103 -3.3105 { n phe A 42 1n12A_42F_120L}-8.5129 0.2485 -4.5433 { ca phe A 42 1n12A_42F_120L}-7.7352 -0.3151 -5.633 { c phe A 42 1n12A_42F_120L}-7.4962 0.7303 -6.7019 { o phe A 42 1n12A_42F_120L}-8.2019 1.7385 -6.7738 { c phe A 42 1n12A_42F_120L}P -7.4962 0.7303 -6.7019 { n thr A 43 1n12A_42F_120L}-6.489 0.4961 -7.5326 { ca thr A 43 1n12A_42F_120L}-6.1867 1.4432 -8.5865 { c thr A 43 1n12A_42F_120L}-6.3463 0.837 -9.9649 { o thr A 43 1n12A_42F_120L}-6.3025 -0.3899 -10.1428 { c thr A 43 1n12A_42F_120L}P -6.3463 0.837 -9.9649 { n val A 44 1n12A_42F_120L}-6.543 1.7168 -10.9404 { ca val A 44 1n12A_42F_120L}-6.6775 1.3176 -12.3285 { c val A 44 1n12A_42F_120L}-5.7518 2.2444 -13.0965 { o val A 44 1n12A_42F_120L}-5.8025 3.4633 -12.9245 { n ile A 118 1n12A_42F_120L}P -6.2593 5.9914 -11.5114 {"}-6.2593 5.9914 -11.5114 { ca ile A 118 1n12A_42F_120L}-7.3989 6.4254 -10.7174 { c ile A 118 1n12A_42F_120L}-7.5836 5.47 -9.5454 { o ile A 118 1n12A_42F_120L}-7.1992 4.304 -9.6186 { c ile A 118 1n12A_42F_120L}P -7.5836 5.47 -9.5454 { n ser A 119 1n12A_42F_120L}-8.155 5.9762 -8.4613 { ca ser A 119 1n12A_42F_120L}-8.3867 5.1522 -7.2862 { c ser A 119 1n12A_42F_120L}-9.8778 4.9732 -7.0822 { o ser A 119 1n12A_42F_120L}-10.644 5.9213 -7.2147 { c ser A 119 1n12A_42F_120L}P -9.8778 4.9732 -7.0822 { n leu A 120 1n12A_42F_120L}-10.2793 3.7456 -6.775 { ca leu A 120 1n12A_42F_120L}-11.6813 3.4255 -6.5418 { c leu A 120 1n12A_42F_120L}-11.761 2.5559 -5.2953 { o leu A 120 1n12A_42F_120L}-10.741 2.0797 -4.7939 { c leu A 120 1n12A_42F_120L}P -11.761 2.5559 -5.2953 { n his A 121 1n12A_42F_120L}-12.9765 2.3475 -4.7969 { ca his A 121 1n12A_42F_120L}-13.1847 1.5294 -3.6218 { c his A 121 1n12A_42F_120L}-14.2371 0.4889 -3.9289 { o his A 121 1n12A_42F_120L}-15.1355 0.7256 -4.7426 { c his A 121 1n12A_42F_120L}P -14.2371 0.4889 -3.9289 { n ala A 122 1n12A_42F_120L}-14.1281 -0.6566 -3.2689 { ca ala A 122 1n12A_42F_120L}-15.0838 -1.7369 -3.4673 { c ala A 122 1n12A_42F_120L}-15.4058 -2.3543 -2.1157 { o ala A 122 1n12A_42F_120L}-14.5425 -2.4115 -1.2337 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 40 1n12A_42F_120L}P -12.2569 -2.1624 0.2834 { ca lys A 40 1n12A_42F_120L}P -10.9247 -2.3176 -0.2699 { n glu A 41 1n12A_42F_120L}P -9.5324 -0.5847 -1.242 { ca glu A 41 1n12A_42F_120L}P -9.1741 0.4378 -2.2194 { n phe A 42 1n12A_42F_120L}P -8.5129 0.2485 -4.5433 { ca phe A 42 1n12A_42F_120L}P -7.7352 -0.3151 -5.633 { n thr A 43 1n12A_42F_120L}P -6.489 0.4961 -7.5326 { ca thr A 43 1n12A_42F_120L}P -6.1867 1.4432 -8.5865 { n val A 44 1n12A_42F_120L}P -6.543 1.7168 -10.9404 { ca val A 44 1n12A_42F_120L}P -6.6775 1.3176 -12.3285 { n ile A 118 1n12A_42F_120L}P -6.2593 5.9914 -11.5114 { ca ile A 118 1n12A_42F_120L}P -7.3989 6.4254 -10.7174 { n ser A 119 1n12A_42F_120L}P -8.155 5.9762 -8.4613 { ca ser A 119 1n12A_42F_120L}P -8.3867 5.1522 -7.2862 { n leu A 120 1n12A_42F_120L}P -10.2793 3.7456 -6.775 { ca leu A 120 1n12A_42F_120L}P -11.6813 3.4255 -6.5418 { n his A 121 1n12A_42F_120L}P -12.9765 2.3475 -4.7969 { ca his A 121 1n12A_42F_120L}P -13.1847 1.5294 -3.6218 { n ala A 122 1n12A_42F_120L}P -14.1281 -0.6566 -3.2689 { ca ala A 122 1n12A_42F_120L}P -15.0838 -1.7369 -3.4673 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 40 1n12A_42F_120L}P -10.9247 -2.3176 -0.2699 {"}-10.9247 -2.3176 -0.2699 { ca glu A 41 1n12A_42F_120L}-9.1741 0.4378 -2.2194 { ca phe A 42 1n12A_42F_120L}-7.7352 -0.3151 -5.633 { ca thr A 43 1n12A_42F_120L}-6.1867 1.4432 -8.5865 { ca val A 44 1n12A_42F_120L}-6.6775 1.3176 -12.3285 { ca ile A 118 1n12A_42F_120L}P -7.3989 6.4254 -10.7174 {"}-7.3989 6.4254 -10.7174 { ca ser A 119 1n12A_42F_120L}-8.3867 5.1522 -7.2862 { ca leu A 120 1n12A_42F_120L}-11.6813 3.4255 -6.5418 { ca his A 121 1n12A_42F_120L}-13.1847 1.5294 -3.6218 { ca ala A 122 1n12A_42F_120L}-15.0838 -1.7369 -3.4673 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 42 1n12A_42F_120L}P -7.7352 -0.3151 -5.633 { cb phe A 42 1n12A_42F_120L}-8.4335 -1.5526 -6.2281 { cg phe A 42 1n12A_42F_120L}-9.7447 -1.2595 -6.932 { cd1 phe A 42 1n12A_42F_120L}-9.7829 -1.0602 -8.3112 { ce1 phe A 42 1n12A_42F_120L}-11.0043 -0.8548 -8.9817 { cz phe A 42 1n12A_42F_120L}-12.1977 -0.8469 -8.2683 { cg phe A 42 1n12A_42F_120L}P -9.7447 -1.2595 -6.932 { cd2 phe A 42 1n12A_42F_120L}-10.9445 -1.2438 -6.224 { ce2 phe A 42 1n12A_42F_120L}-12.1718 -1.0395 -6.8818 { cz phe A 42 1n12A_42F_120L}ghost -12.1977 -0.8469 -8.2683 { ca leu A 120 1n12A_42F_120L}P -11.6813 3.4255 -6.5418 { cb leu A 120 1n12A_42F_120L}-12.2649 2.6631 -7.7413 { cg leu A 120 1n12A_42F_120L}-12.2391 3.3237 -9.1197 { cd1 leu A 120 1n12A_42F_120L}-12.8387 2.3604 -10.1312 { cg leu A 120 1n12A_42F_120L}P -12.2391 3.3237 -9.1197 { cd2 leu A 120 1n12A_42F_120L}-13.0151 4.6405 -9.1002 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 42 1n12A_42F_120L}P -8.4335 -1.5526 -6.2281 {"}P -8.4335 -1.5526 -6.2281 { cd1 phe A 42 1n12A_42F_120L}P -9.7829 -1.0602 -8.3112 { cd2 phe A 42 1n12A_42F_120L}P -10.9445 -1.2438 -6.224 { ce1 phe A 42 1n12A_42F_120L}P -11.0043 -0.8548 -8.9817 { ce2 phe A 42 1n12A_42F_120L}P -12.1718 -1.0395 -6.8818 { cz phe A 42 1n12A_42F_120L}P -12.1977 -0.8469 -8.2683 { cb leu A 120 1n12A_42F_120L}P -12.2649 2.6631 -7.7413 {"}P -12.2649 2.6631 -7.7413 { cg leu A 120 1n12A_42F_120L}P -12.2391 3.3237 -9.1197 { cd1 leu A 120 1n12A_42F_120L}P -12.8387 2.3604 -10.1312 {"}P -12.8387 2.3604 -10.1312 {"}P -12.8387 2.3604 -10.1312 { cd2 leu A 120 1n12A_42F_120L}P -13.0151 4.6405 -9.1002 {"}P -13.0151 4.6405 -9.1002 {"}P -13.0151 4.6405 -9.1002 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 42 A}'S' sky -11.7017 0.7469 -8.8787 {"}'S' sky -12.2748 0.0209 -9.8074 {"}'S' sky -11.4164 0.8453 -8.9281 {"}'S' sky -10.7681 0.8092 -8.4936 {"}'S' sky -10.9149 0.87 -8.7013 {"}'S' sky -11.0716 0.893 -8.9086 {"}'S' sky -11.9278 0.0022 -10.1968 { CE2 PHE 42 A}'S' sky -12.2391 0.7083 -6.8087 {"}'S' sky -12.4007 0.6908 -7.0136 {"}'S' sky -12.5646 0.6342 -7.2093 {"}'S' sky -11.9033 0.6884 -6.798 {"}'S' sky -11.2728 0.4302 -7.1881 { CZ PHE 42 A}'S' sky -12.8355 0.6842 -7.7106 {"}'S' blue -12.9965 0.6692 -7.9136 {"}'S' sky -12.895 0.7548 -8.1653 {"}'S' sky -12.7706 0.8006 -8.4072 {"}'S' blue -12.7516 0.733 -8.7776 {"}'S' blue -12.907 0.6033 -8.9434 {"}'S' blue -13.0532 0.4414 -9.0875 {"}'S' sky -12.4118 0.8103 -8.7888 {"}'S' sky -12.8719 0.4166 -9.2748 {"}'S' sky -12.7964 0.1875 -9.5465 {"}'S' sky -12.5831 0.1138 -9.6792 {"}'S' sky -12.3534 0.0317 -9.7737 { HE1 PHE 42 A}'S' blue -11.4731 0.099 -10.4571 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 42 A}'S' sea -10.9845 0.5085 -7.885 {"}'S' green -11.102 0.6375 -8.0735 {"}'S' green -11.2375 0.7277 -8.2723 {"}'S' green -11.3854 0.7776 -8.4773 {"}'S' green -11.5413 0.7831 -8.6814 {"}'S' sea -10.8364 0.6624 -8.1262 {"}'S' green -10.9644 0.7653 -8.3212 {"}'S' green -11.1068 0.8312 -8.524 {"}'S' sea -11.2587 0.8584 -8.7276 {"}'S' sea -11.5772 0.7927 -9.1206 {"}'S' green -11.7345 0.703 -9.2997 {"}'S' green -12.0312 0.4189 -9.6028 {"}'S' green -12.1609 0.2324 -9.7187 {"}'S' sea -12.1099 0.0282 -10.0108 {"}'S' sea -11.397 0.8188 -9.3092 {"}'S' green -11.5582 0.7251 -9.491 {"}'S' green -11.9934 0.2429 -9.9193 {"}'S' sea -11.2184 0.8024 -9.5022 {"}'S' green -11.3792 0.704 -9.6825 {"}'S' green -11.6785 0.4087 -9.9882 {"}'S' green -11.8112 0.2169 -10.1053 {"}'S' sea -11.1702 0.664 -9.8354 {"}'S' green -11.3253 0.5326 -9.9985 {"}'S' green -11.4707 0.3695 -10.1413 {"}'S' sea -11.603 0.1796 -10.2599 { CE2 PHE 42 A}'S' sea -12.0602 0.7027 -7.0055 {"}'S' green -12.2223 0.6792 -7.2081 {"}'S' sea -11.694 0.6422 -6.9492 {"}'S' green -11.8517 0.6595 -7.1566 {"}'S' sea -11.4807 0.5558 -7.0771 {"}'S' green -11.6366 0.5773 -7.2848 {"}'S' sea -11.4247 0.4588 -7.3919 { CZ PHE 42 A}'S' green -12.2954 0.6454 -7.3601 {"}'S' green -12.4308 0.7356 -7.5589 {"}'S' green -12.5787 0.7855 -7.7639 {"}'S' sea -12.7346 0.791 -7.968 {"}'S' green -12.6097 0.8531 -8.2148 {"}'S' green -11.7085 0.585 -7.3882 {"}'S' green -12.4265 0.8834 -8.4002 {"}'S' green -12.2481 0.8718 -8.5946 {"}'S' sea -12.5726 0.7118 -8.9691 {"}'S' sea -12.7268 0.5803 -9.1328 {"}'S' green -11.3119 0.5638 -7.7334 {"}'S' sea -12.2024 0.7684 -8.9408 {"}'S' green -12.3636 0.6719 -9.1221 {"}'S' green -12.5187 0.5405 -9.2852 {"}'S' sea -12.6641 0.3774 -9.4279 {"}'S' green -11.5066 0.7484 -8.4637 {"}'S' green -11.6624 0.7698 -8.6713 {"}'S' sea -11.9875 0.6937 -9.071 {"}'S' green -12.1496 0.5984 -9.2536 {"}'S' green -12.3054 0.4682 -9.4181 {"}'S' green -12.4508 0.3051 -9.5608 {"}'S' green -12.2229 0.2185 -9.6567 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 42 A}'S' P -11.8876 0.5775 -9.4616 {"}'S' -11.8841 0.5711 -9.4605 {"}'S' P -11.7136 0.5954 -9.6567 {"}'S' -11.7015 0.5706 -9.6448 {"}'S' P -11.8598 0.4335 -9.8008 {"}'S' -11.8495 0.4179 -9.79 {"}'S' P -11.5335 0.5724 -9.8462 {"}'S' -11.5319 0.5672 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{"}'S' -11.7415 0.759 -8.3327 {"}'S' P -11.8775 0.8521 -8.5432 {"}'S' -11.881 0.8319 -8.5399 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LEU 120 A}'S' blue -12.7247 1.0503 -7.2413 {"}'S' blue -12.5618 1.0871 -7.0406 {"}'S' blue -13.0243 1.1229 -8.0774 {"}'S' sky -12.8868 1.0327 -7.874 {"}'S' sky -12.58 0.9653 -7.4598 {"}'S' sky -12.8246 1.0826 -8.2412 {"}'S' sky -12.6931 1.1563 -8.5209 {"}'S' sky -12.4369 1.1492 -8.6032 { CD1 LEU 120 A}'S' blue -12.9721 0.8599 -9.2413 {"}'S' sky -12.8134 0.9717 -9.067 {"}'S' blue -12.6617 1.1183 -8.9119 {"}'S' blue -12.368 1.1412 -8.9668 { HB2 LEU 120 A}'S' sky -12.3899 0.9279 -7.2512 {"}'S' sky -12.2275 0.9769 -7.0541 {"}'S' sky -11.8304 0.9783 -6.9098 {"}'S' sky -11.6078 0.878 -7.003 {"}'S' blue -11.2013 0.7903 -7.3177 {"}'S' sky -10.9325 0.8502 -7.7638 {"}'S' sky -10.8569 0.9459 -8.0002 {"}'S' sky -11.1517 1.1377 -8.6656 {"}'S' sky -10.8547 1.0635 -8.2616 {HD12 LEU 120 A}'S' blue -12.9116 0.6539 -9.5798 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{"}'S' sea -11.3899 -0.1893 -10.4005 {"}'S' green -11.2317 -0.1715 -10.2021 {"}'S' green -10.7907 0.2149 -9.7388 {"}'S' sea -10.6822 0.4299 -9.6583 {"}'S' sea -10.9744 -0.0405 -10.2733 {"}'S' green -10.8172 0.0779 -10.1026 {"}'S' sea -10.6781 0.2548 -9.9717 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 250 A}'S' P -11.8511 0.2143 -7.837 {"}'S' -11.8476 0.222 -7.8338 {"}'S' P -11.7205 0.1199 -7.6419 {"}'S' -11.7103 0.1536 -7.6374 {"}'S' P -11.5731 0.0783 -7.4396 {"}'S' -11.5714 0.0945 -7.441 {"}'S' P -11.6057 0.1679 -7.9386 {"}'S' -11.6005 0.1943 -7.9273 {"}'S' P -11.4691 0.0865 -7.7386 {"}'S' -11.4659 0.1283 -7.7301 {"}'S' P -11.3168 0.0615 -7.5348 {"}'S' -11.3177 0.0709 -7.5348 {"}'S' P -11.3005 0.1494 -7.9479 {"}'S' -11.3008 0.1517 -7.9472 {HG21 ILE 250 A}'S' P -13.5706 -0.3189 -8.1566 {"}'S' -13.5719 -0.3114 -8.155 {"}'S' P -13.3184 -0.2191 -8.2259 {"}'S' -13.3183 -0.2177 -8.2262 {HD12 ILE 250 A}'S' P -11.6417 -0.0303 -9.4977 {"}'S' -11.6413 -0.0062 -9.5146 {"}'S' P -11.4924 0.1056 -9.3418 {"}'S' -11.4962 0.1324 -9.3684 {"}'S' P -11.358 0.2847 -9.2194 {"}'S' -11.3584 0.2853 -9.22 {"}'S' P -11.4956 -0.1409 -9.7102 {"}'S' -11.5017 -0.0859 -9.7327 {"}'S' P -11.3427 -0.0248 -9.5448 {"}'S' -11.363 0.0456 -9.5904 {"}'S' P -11.2032 0.1359 -9.4079 {"}'S' -11.2264 0.1816 -9.4517 {"}'S' P -11.0817 0.3328 -9.3073 {"}'S' -11.0845 0.3359 -9.3102 {"}'S' P -11.394 -0.2037 -9.9928 {"}'S' -11.398 -0.186 -9.9954 {"}'S' P -11.236 -0.1179 -9.8118 {"}'S' -11.2593 -0.0528 -9.8328 {"}'S' P -11.0859 0.0179 -9.6565 {"}'S' -11.1218 0.0809 -9.6908 {"}'S' P -10.9518 0.1979 -9.5331 {"}'S' -10.9752 0.2232 -9.5554 {"}'S' P -11.074 -0.0955 -10.0192 {"}'S' -11.0825 -0.0797 -10.0208 {"}'S' P -10.9236 0.0359 -9.8607 {"}'S' -10.9409 0.0592 -9.8693 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 217 A}'M' greentint -9.1646 2.1022 -6.3595 {"}'M' greentint -9.3082 1.9945 -6.632 {"}'M' greentint -8.9026 2.4235 -6.2269 {"}'M' greentint -9.0659 2.3901 -6.4287 {"}'M' greentint -9.2145 2.2332 -6.5772 {"}'M' greentint -9.3182 2.1368 -6.8747 {"}'M' greentint -9.3747 1.8873 -6.878 {"}'M' greentint -8.9166 2.6202 -6.4909 {"}'M' greentint -9.0752 2.5271 -6.6693 {"}'M' greentint -9.2145 2.3591 -6.8025 {"}'M' greentint -9.2878 2.2308 -7.1195 {"}'M' greentint -9.359 1.9857 -7.1437 {"}'M' greentint -8.7297 2.8093 -6.5588 {"}'M' greentint -8.8899 2.7511 -6.7507 {"}'M' greentint -9.0446 2.628 -6.9154 {"}'M' greentint -9.1804 2.4505 -7.0416 {"}'M' greentint -9.2099 2.311 -7.3578 {"}'M' greentint -9.2911 2.0679 -7.3961 {"}'M' greentint -8.6469 2.9293 -6.8029 {"}'M' greentint -8.809 2.8471 -6.9885 {"}'M' greentint -8.9612 2.7112 -7.1485 {"}'M' greentint -9.0979 2.5296 -7.2733 {"}'M' greentint -8.854 2.7498 -7.385 {"}'M' greentint -8.9848 2.5679 -7.5035 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 250 A}'M' greentint -9.3118 1.7935 -6.5876 {"}'M' greentint -9.1616 1.9179 -6.4278 {"}'M' greentint -9.0284 2.0935 -6.3047 {"}'M' greentint -8.9232 2.3081 -6.227 {"}'M' greentint -9.2612 1.7909 -6.9212 {"}'M' greentint -9.1005 1.8669 -6.7344 {"}'M' greentint -8.951 2.0123 -6.582 {"}'M' greentint -8.8264 2.2122 -6.4761 {"}'M' greentint -8.7379 2.4498 -6.4281 {"}'M' greentint -8.6933 2.7046 -6.4408 {"}'M' greentint -9.3163 1.9514 -7.38 {"}'M' greentint -9.1675 1.9018 -7.1739 {"}'M' greentint -9.0052 1.9467 -6.976 {"}'M' greentint -8.851 2.0793 -6.8142 {"}'M' greentint -8.7267 2.2826 -6.7096 {"}'M' greentint -8.6484 2.5283 -6.6775 {"}'M' greentint -8.6274 2.7837 -6.7208 {"}'M' greentint -9.1883 2.187 -7.5425 {"}'M' greentint -9.0565 2.0853 -7.3443 {"}'M' greentint -8.8955 2.1133 -7.1444 {"}'M' greentint -8.7475 2.2653 -6.9955 {"}'M' greentint -8.6527 2.4994 -6.9382 {"}'M' greentint -8.6364 2.7531 -6.9875 {"}'M' greentint -9.0272 2.4583 -7.5757 {"}'M' greentint -8.923 2.3031 -7.3979 {"}'M' greentint -8.7631 2.4 -7.2184 {"}'M' greentint -8.7081 2.6533 -7.2182 {"}'M' greentint -8.8414 2.5497 -7.4177 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 217 A}'M' green -9.9031 0.8622 -4.9908 {"}'M' green -9.8328 1.19 -5.3335 {"}'M' green -9.3618 1.9468 -4.936 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 217 A}'M' greentint -9.7009 1.217 -4.3427 {"}'M' greentint -9.8342 1.1134 -4.5421 {"}'M' greentint -9.6193 1.4636 -4.3625 {"}'M' greentint -9.7792 1.3667 -4.5419 {"}'M' greentint -9.8896 1.2673 -4.8222 {"}'M' greentint -9.9059 1.0136 -4.7729 {"}'M' greentint -9.4858 1.6814 -4.416 {"}'M' greentint -9.6468 1.6534 -4.616 {"}'M' greentint -9.7948 1.5014 -4.7649 {"}'M' greentint -9.8614 1.3647 -5.0758 {"}'M' greentint -9.9118 1.1101 -5.0712 {"}'M' greentint -9.4562 1.8544 -4.6886 {"}'M' greentint -9.6165 1.7634 -4.8714 {"}'M' greentint -9.7579 1.5929 -5.007 {"}'M' greentint -9.7645 1.439 -5.3158 {"}'M' greentint -9.5184 1.8348 -5.1074 {"}'M' greentint -9.657 1.6601 -5.2382 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 250 A}'M' green -9.881 0.9146 -4.6069 {"}'M' green -9.4508 1.7636 -4.2879 {"}'M' green -9.9679 0.9065 -5.0331 {"}'M' green -9.8741 1.2739 -5.4639 {"}'M' green -9.4496 1.9496 -5.1027 {"}'M' green -9.7615 1.5037 -5.4991 {"}'M' green -9.5475 1.8523 -5.3203 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 250 A}'M' greentint -9.7356 1.0763 -4.4639 {"}'M' greentint -9.611 1.2787 -4.3603 {"}'M' greentint -9.5146 1.5119 -4.3005 {"}'M' greentint -9.8082 0.9951 -4.8521 {"}'M' greentint -9.6615 1.1447 -4.7045 {"}'M' greentint -9.5377 1.3444 -4.5998 {"}'M' greentint -9.4459 1.5786 -4.5465 {"}'M' greentint -9.3939 1.8295 -4.5481 {"}'M' greentint -9.8496 1.077 -5.1872 {"}'M' greentint -9.6926 1.1729 -5.0099 {"}'M' greentint -9.5541 1.3435 -4.8783 {"}'M' greentint -9.4512 1.5669 -4.8075 {"}'M' greentint -9.3968 1.8167 -4.8072 {"}'M' greentint -9.711 1.3031 -5.2612 {"}'M' greentint -9.5612 1.4568 -5.1104 {"}'M' greentint -9.4659 1.6931 -5.0529 {"}'M' greentint -9.6028 1.601 -5.3215 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 403 1nkgA_405F_479}P -12.2128 -2.0242 0.3549 {"}-12.2128 -2.0242 0.3549 { ca ile A 403 1nkgA_405F_479}-11.0711 -2.3164 -0.4993 { c ile A 403 1nkgA_405F_479}-10.7939 -1.0945 -1.3597 { o ile A 403 1nkgA_405F_479}-11.7108 -0.5274 -1.9699 { c ile A 403 1nkgA_405F_479}P -10.7939 -1.0945 -1.3597 { n lys A 404 1nkgA_405F_479}-9.537 -0.6642 -1.3856 { ca lys A 404 1nkgA_405F_479}-9.15 0.4637 -2.2385 { c lys A 404 1nkgA_405F_479}-8.2389 -0.116 -3.3013 { o lys A 404 1nkgA_405F_479}-7.3615 -0.9395 -2.9991 { c lys A 404 1nkgA_405F_479}P -8.2389 -0.116 -3.3013 { n phe A 405 1nkgA_405F_479}-8.4278 0.2931 -4.55 { ca phe A 405 1nkgA_405F_479}-7.5545 -0.1948 -5.6049 { c phe A 405 1nkgA_405F_479}-7.3804 0.8355 -6.7026 { o phe A 405 1nkgA_405F_479}-8.2146 1.715 -6.8695 { c phe A 405 1nkgA_405F_479}P -7.3804 0.8355 -6.7026 { n thr A 406 1nkgA_405F_479}-6.2891 0.7123 -7.4437 { ca thr A 406 1nkgA_405F_479}-5.9615 1.6341 -8.5171 { c thr A 406 1nkgA_405F_479}-6.2318 0.9591 -9.8501 { o thr A 406 1nkgA_405F_479}-5.8794 -0.2069 -10.054 { c thr A 406 1nkgA_405F_479}P -6.2318 0.9591 -9.8501 { n ala A 407 1nkgA_405F_479}-6.8779 1.694 -10.7539 { ca ala A 407 1nkgA_405F_479}-7.1541 1.1693 -12.0814 { c ala A 407 1nkgA_405F_479}-6.5109 2.1069 -13.0909 { o ala A 407 1nkgA_405F_479}-6.296 3.287 -12.8051 { n gly A 477 1nkgA_405F_479}P -7.372 5.7067 -11.7027 {"}-7.372 5.7067 -11.7027 { ca gly A 477 1nkgA_405F_479}-6.9788 6.2403 -10.4171 { c gly A 477 1nkgA_405F_479}-7.5456 5.3904 -9.2976 { o gly A 477 1nkgA_405F_479}-7.7655 4.1954 -9.4758 { c gly A 477 1nkgA_405F_479}P -7.5456 5.3904 -9.2976 { n thr A 478 1nkgA_405F_479}-7.7988 6.0138 -8.154 { ca thr A 478 1nkgA_405F_479}-8.3104 5.2974 -6.9894 { c thr A 478 1nkgA_405F_479}-9.8003 4.9648 -7.077 { o thr A 478 1nkgA_405F_479}-10.6142 5.7753 -7.5336 { c thr A 478 1nkgA_405F_479}P -9.8003 4.9648 -7.077 { n asn A 479 1nkgA_405F_479}-10.126 3.7397 -6.6683 { ca asn A 479 1nkgA_405F_479}-11.4882 3.2369 -6.6381 { c asn A 479 1nkgA_405F_479}-11.7551 2.6416 -5.2675 { o asn A 479 1nkgA_405F_479}-10.8322 2.2158 -4.5754 { c asn A 479 1nkgA_405F_479}P -11.7551 2.6416 -5.2675 { n thr A 480 1nkgA_405F_479}-13.0258 2.587 -4.8899 { ca thr A 480 1nkgA_405F_479}-13.4127 2.0633 -3.5852 { c thr A 480 1nkgA_405F_479}-14.5288 1.0475 -3.6725 { o thr A 480 1nkgA_405F_479}-15.576 1.3039 -4.2787 { c thr A 480 1nkgA_405F_479}P -14.5288 1.0475 -3.6725 { n ile A 481 1nkgA_405F_479}-14.2989 -0.1134 -3.0676 { ca ile A 481 1nkgA_405F_479}-15.299 -1.1768 -2.9888 { c ile A 481 1nkgA_405F_479}-15.6401 -1.377 -1.5158 { o ile A 481 1nkgA_405F_479}-14.7506 -1.472 -0.6662 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 403 1nkgA_405F_479}P -12.2128 -2.0242 0.3549 { ca ile A 403 1nkgA_405F_479}P -11.0711 -2.3164 -0.4993 { n lys A 404 1nkgA_405F_479}P -9.537 -0.6642 -1.3856 { ca lys A 404 1nkgA_405F_479}P -9.15 0.4637 -2.2385 { n phe A 405 1nkgA_405F_479}P -8.4278 0.2931 -4.55 { ca phe A 405 1nkgA_405F_479}P -7.5545 -0.1948 -5.6049 { n thr A 406 1nkgA_405F_479}P -6.2891 0.7123 -7.4437 { ca thr A 406 1nkgA_405F_479}P -5.9615 1.6341 -8.5171 { n ala A 407 1nkgA_405F_479}P -6.8779 1.694 -10.7539 { ca ala A 407 1nkgA_405F_479}P -7.1541 1.1693 -12.0814 { n gly A 477 1nkgA_405F_479}P -7.372 5.7067 -11.7027 { ca gly A 477 1nkgA_405F_479}P -6.9788 6.2403 -10.4171 {"}P -6.9788 6.2403 -10.4171 { n thr A 478 1nkgA_405F_479}P -7.7988 6.0138 -8.154 { ca thr A 478 1nkgA_405F_479}P -8.3104 5.2974 -6.9894 { n asn A 479 1nkgA_405F_479}P -10.126 3.7397 -6.6683 { ca asn A 479 1nkgA_405F_479}P -11.4882 3.2369 -6.6381 { n thr A 480 1nkgA_405F_479}P -13.0258 2.587 -4.8899 { ca thr A 480 1nkgA_405F_479}P -13.4127 2.0633 -3.5852 { n ile A 481 1nkgA_405F_479}P -14.2989 -0.1134 -3.0676 { ca ile A 481 1nkgA_405F_479}P -15.299 -1.1768 -2.9888 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 403 1nkgA_405F_479}P -11.0711 -2.3164 -0.4993 {"}-11.0711 -2.3164 -0.4993 { ca lys A 404 1nkgA_405F_479}-9.15 0.4637 -2.2385 { ca phe A 405 1nkgA_405F_479}-7.5545 -0.1948 -5.6049 { ca thr A 406 1nkgA_405F_479}-5.9615 1.6341 -8.5171 { ca ala A 407 1nkgA_405F_479}-7.1541 1.1693 -12.0814 { ca gly A 477 1nkgA_405F_479}P -6.9788 6.2403 -10.4171 {"}-6.9788 6.2403 -10.4171 { ca thr A 478 1nkgA_405F_479}-8.3104 5.2974 -6.9894 { ca asn A 479 1nkgA_405F_479}-11.4882 3.2369 -6.6381 { ca thr A 480 1nkgA_405F_479}-13.4127 2.0633 -3.5852 { ca ile A 481 1nkgA_405F_479}-15.299 -1.1768 -2.9888 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 405 1nkgA_405F_479}P -7.5545 -0.1948 -5.6049 { cb phe A 405 1nkgA_405F_479}-8.062 -1.5216 -6.1939 { cg phe A 405 1nkgA_405F_479}-9.2886 -1.3903 -7.0595 { cd1 phe A 405 1nkgA_405F_479}-10.5573 -1.3202 -6.4856 { ce1 phe A 405 1nkgA_405F_479}-11.7014 -1.2116 -7.2829 { cz phe A 405 1nkgA_405F_479}-11.5833 -1.1709 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-11.5122 0.9225 -7.0159 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 111 A}'S' sea -13.619 0.8385 -6.9558 {"}'S' sea -13.211 0.5675 -6.3534 {"}'S' sea -13.5664 1.1158 -7.3932 {"}'S' green -13.4755 0.9359 -7.2262 {"}'S' green -13.3656 0.7868 -7.042 {"}'S' green -13.2389 0.6712 -6.8458 {"}'S' green -13.3856 1.2857 -7.6206 {"}'S' green -13.3141 1.0888 -7.4746 {"}'S' green -13.1561 1.3883 -7.7439 {"}'S' sea -12.9134 1.4872 -7.8158 {"}'S' green -12.8558 1.2726 -7.6813 {"}'S' green -12.6142 1.3736 -7.7159 {"}'S' green -12.5314 1.1888 -7.5572 {"}'S' sea -12.3709 1.4673 -7.6969 {"}'S' sea -12.2847 1.2857 -7.536 { HB3 PHE 111 A}'S' green -13.0984 0.5259 -6.6326 {"}'S' green -12.8457 0.3128 -6.2471 {"}'S' green -12.6938 0.287 -6.0438 {"}'S' green -12.3885 0.2289 -6.0644 {"}'S' green -12.1282 0.2307 -6.1603 {"}'S' sea -11.9702 0.3164 -5.9793 {"}'S' green -11.9659 0.2628 -6.3695 {"}'S' sea -11.8082 0.3388 -6.1867 {"}'S' green -11.8719 0.3449 -6.6374 {"}'S' green -11.7086 0.3938 -6.4408 {"}'S' green -12.0831 0.9408 -7.3834 {"}'S' green -11.9254 0.5768 -7.0797 {"}'S' green -11.7883 0.5018 -6.8802 {"}'S' sea -11.6319 0.5126 -6.681 {"}'S' sea -11.8384 1.0082 -7.3172 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB PHE 111 A}'S' P -13.2212 0.919 -7.3072 {"}'S' -13.2168 0.9424 -7.2894 {"}'S' P -13.1095 0.7797 -7.1243 {"}'S' -13.107 0.8078 -7.1085 {"}'S' P -13.0925 1.1817 -7.6046 {"}'S' -13.0925 1.188 -7.5976 {"}'S' P -13.0057 1.0026 -7.4418 {"}'S' -13.0036 1.0425 -7.4053 {"}'S' P -12.8962 0.8565 -7.2605 {"}'S' -12.8982 0.9089 -7.2239 {"}'S' P -12.7705 1.087 -7.519 {"}'S' -12.7741 1.1181 -7.4883 { HB3 PHE 111 A}'S' P -12.983 0.3943 -6.4466 {"}'S' -12.983 0.3943 -6.4466 {"}'S' P -13.012 0.6761 -6.9947 {"}'S' -12.9985 0.6904 -6.9814 {"}'S' P -12.9308 0.4937 -6.8388 {"}'S' -12.9203 0.5095 -6.8297 {"}'S' P -12.822 0.353 -6.6597 {"}'S' -12.793 0.4144 -6.6391 {"}'S' P -12.6913 0.2586 -6.4646 {"}'S' -12.6678 0.334 -6.4547 {"}'S' P -12.544 0.217 -6.2623 {"}'S' -12.5373 0.2602 -6.2647 {"}'S' P -12.8367 0.8262 -7.2406 {"}'S' -12.8075 0.8584 -7.1876 {"}'S' P -12.7804 0.6145 -7.1102 {"}'S' -12.7455 0.675 -7.0473 {"}'S' P -12.6927 0.4383 -6.9467 {"}'S' -12.6703 0.4984 -6.9075 {"}'S' P -12.5766 0.3066 -6.7613 {"}'S' -12.5555 0.4081 -6.7199 {"}'S' P -12.44 0.2252 -6.5612 {"}'S' -12.4311 0.3314 -6.5391 {"}'S' P -12.2876 0.2002 -6.3575 {"}'S' -12.291 0.2574 -6.3564 {"}'S' P -12.6079 0.9656 -7.3938 {"}'S' -12.5947 0.9849 -7.3426 {"}'S' P -12.5735 0.738 -7.2862 {"}'S' -12.5524 0.7959 -7.1972 {"}'S' P -12.5024 0.5416 -7.1408 {"}'S' -12.4874 0.6223 -7.0618 {"}'S' P -12.3998 0.3889 -6.9657 {"}'S' -12.3964 0.4595 -6.9191 {"}'S' P -12.2714 0.2881 -6.7706 {"}'S' -12.2777 0.3795 -6.7335 {"}'S' P -12.1241 0.245 -6.568 {"}'S' -12.1357 0.3054 -6.5549 {"}'S' P -12.35 1.0739 -7.4591 {"}'S' -12.3507 1.0747 -7.4551 {"}'S' P -12.3307 0.8316 -7.367 {"}'S' -12.3318 0.8647 -7.3027 {"}'S' P -12.2662 0.6227 -7.2244 {"}'S' -12.2719 0.6786 -7.1578 {"}'S' P -12.1625 0.4639 -7.0465 {"}'S' -12.1693 0.5005 -7.0179 {"}'S' P -12.0276 0.3691 -6.8456 {"}'S' -12.0362 0.3966 -6.8311 {"}'S' P -12.028 0.7296 -7.2548 {"}'S' -12.0324 0.7379 -7.2421 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 128 A}'M' green -9.8428 2.0064 -6.7537 {"}'M' green -9.827 2.1048 -7.0195 {"}'M' green -9.678 2.4301 -7.2335 {"}'M' green -9.1146 3.0478 -6.6779 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 128 A}'M' greentint -9.4737 2.31 -6.0537 {"}'M' greentint -9.6327 2.2213 -6.2353 {"}'M' greentint -9.7762 2.1135 -6.5077 {"}'M' greentint -9.3707 2.5425 -6.1026 {"}'M' greentint -9.534 2.5091 -6.3045 {"}'M' greentint -9.6826 2.3522 -6.453 {"}'M' greentint -9.7863 2.2559 -6.7505 {"}'M' greentint -9.2268 2.7477 -6.1646 {"}'M' greentint -9.3847 2.7393 -6.3666 {"}'M' greentint -9.5433 2.6461 -6.5451 {"}'M' greentint -9.6826 2.4782 -6.6782 {"}'M' greentint -9.7559 2.3499 -6.9953 {"}'M' greentint -9.1977 2.9284 -6.4345 {"}'M' greentint -9.3579 2.8702 -6.6265 {"}'M' greentint -9.5127 2.7471 -6.7912 {"}'M' greentint -9.6484 2.5695 -6.9173 {"}'M' greentint -9.2771 2.9662 -6.8643 {"}'M' greentint -9.4293 2.8303 -7.0242 {"}'M' greentint -9.5659 2.6487 -7.149 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 111 A}'M' green -9.2347 2.6767 -6.0653 {"}'M' green -9.8131 2.1782 -7.0172 {"}'M' green -9.5241 2.6851 -7.2129 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 111 A}'M' greentint -9.7581 2.0178 -6.5584 {"}'M' greentint -9.5974 2.0937 -6.3716 {"}'M' greentint -9.4479 2.2391 -6.2191 {"}'M' greentint -9.3233 2.4391 -6.1133 {"}'M' greentint -9.6644 2.1286 -6.8111 {"}'M' greentint -9.502 2.1735 -6.6131 {"}'M' greentint -9.3478 2.3061 -6.4514 {"}'M' greentint -9.2236 2.5094 -6.3468 {"}'M' greentint -9.1453 2.7551 -6.3147 {"}'M' greentint -9.6851 2.4138 -7.1797 {"}'M' greentint -9.5534 2.3121 -6.9815 {"}'M' greentint -9.3924 2.3401 -6.7815 {"}'M' greentint -9.2443 2.4921 -6.6327 {"}'M' greentint -9.1495 2.7262 -6.5754 {"}'M' greentint -9.1332 2.9799 -6.6247 {"}'M' greentint -9.4199 2.5299 -7.0351 {"}'M' greentint -9.2599 2.6268 -6.8556 {"}'M' greentint -9.2049 2.8801 -6.8554 {"}'M' greentint -9.3382 2.7765 -7.0549 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 128 A}'M' green -10.2379 0.8385 -4.4279 {"}'M' green -9.8244 0.9959 -4.1601 {"}'M' green -9.6063 1.2034 -4.1982 {"}'M' green -9.455 1.6577 -4.8726 {"}'M' green -9.6093 1.6584 -5.0717 {"}'M' green -9.7675 1.5947 -5.258 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 128 A}'M' greentint -10.052 0.9299 -4.27 {"}'M' greentint -10.1562 1.0851 -4.4478 {"}'M' greentint -10.3162 0.9881 -4.6272 {"}'M' greentint -9.891 1.2012 -4.3032 {"}'M' greentint -10.0227 1.3029 -4.5013 {"}'M' greentint -10.1837 1.2749 -4.7013 {"}'M' greentint -10.3318 1.1229 -4.8502 {"}'M' greentint -9.6994 1.3779 -4.3671 {"}'M' greentint -9.8343 1.4728 -4.568 {"}'M' greentint -9.9932 1.4759 -4.7739 {"}'M' greentint -10.1535 1.3849 -4.9567 {"}'M' greentint -10.2949 1.2143 -5.0923 {"}'M' greentint -9.4576 1.4629 -4.4216 {"}'M' greentint -9.5858 1.572 -4.6183 {"}'M' greentint -9.7375 1.6075 -4.8234 {"}'M' greentint -9.8988 1.5683 -5.0213 {"}'M' greentint -10.0554 1.4563 -5.1927 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 111 A}'M' green -10.4433 0.8978 -4.7171 {"}'M' green -10.2922 0.8719 -4.515 {"}'M' green -10.1343 0.8958 -4.3182 {"}'M' green -9.9762 0.9698 -4.1345 {"}'M' green -9.4915 1.3702 -4.2998 {"}'M' green -9.3841 1.569 -4.4736 {"}'M' green -9.8371 1.6029 -5.2594 {"}'M' green -9.3912 1.6823 -4.7057 {"}'M' green -9.5915 1.7292 -5.0943 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 111 A}'M' greentint -10.3349 1.0421 -4.9812 {"}'M' greentint -10.1886 0.9788 -4.7754 {"}'M' greentint -10.0314 0.9742 -4.5698 {"}'M' greentint -9.8688 1.0299 -4.3756 {"}'M' greentint -9.711 1.1401 -4.2022 {"}'M' greentint -10.2307 1.2691 -5.2272 {"}'M' greentint -10.1051 1.1566 -5.0333 {"}'M' greentint -9.9571 1.1096 -4.8289 {"}'M' greentint -9.7979 1.132 -4.6284 {"}'M' greentint -9.6382 1.2206 -4.4474 {"}'M' greentint -9.9768 1.3684 -5.1849 {"}'M' greentint -9.8384 1.2915 -4.9834 {"}'M' greentint -9.6796 1.3025 -4.7825 {"}'M' greentint -9.5226 1.3984 -4.6051 {"}'M' greentint -9.7041 1.4994 -5.0591 {"}'M' greentint -9.541 1.5286 -4.8565 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 48 1nlsA_195F_50A}P -6.9909 5.9401 -12.1663 {"}-6.9909 5.9401 -12.1663 { ca gly A 48 1nlsA_195F_50A}-7.9958 6.2961 -11.174 { c gly A 48 1nlsA_195F_50A}-7.9136 5.3982 -9.9339 { o gly A 48 1nlsA_195F_50A}-7.2168 4.3922 -9.9361 { c gly A 48 1nlsA_195F_50A}P -7.9136 5.3982 -9.9339 { n thr A 49 1nlsA_195F_50A}-8.6809 5.7875 -8.9082 { ca thr A 49 1nlsA_195F_50A}-8.7409 5.069 -7.6401 { c thr A 49 1nlsA_195F_50A}-10.179 4.868 -7.205 { o thr A 49 1nlsA_195F_50A}-10.9356 5.852 -7.1958 { c thr A 49 1nlsA_195F_50A}P -10.179 4.868 -7.205 { n ala A 50 1nlsA_195F_50A}-10.5074 3.6577 -6.7761 { ca ala A 50 1nlsA_195F_50A}-11.7976 3.322 -6.2158 { c ala A 50 1nlsA_195F_50A}-11.6296 2.8838 -4.7395 { o ala A 50 1nlsA_195F_50A}-10.7039 2.1407 -4.4274 { c ala A 50 1nlsA_195F_50A}P -11.6296 2.8838 -4.7395 { n his A 51 1nlsA_195F_50A}-12.6061 3.2614 -3.9337 { ca his A 51 1nlsA_195F_50A}-12.7052 2.8981 -2.5097 { c his A 51 1nlsA_195F_50A}-14.0906 2.2857 -2.2556 { o his A 51 1nlsA_195F_50A}-15.0899 2.8255 -2.7296 { c his A 51 1nlsA_195F_50A}P -14.0906 2.2857 -2.2556 { n ile A 52 1nlsA_195F_50A}-14.1246 1.188 -1.4859 { ca ile A 52 1nlsA_195F_50A}-15.3627 0.4854 -1.1414 { c ile A 52 1nlsA_195F_50A}-15.3518 0.2797 0.402 { o ile A 52 1nlsA_195F_50A}-14.3438 -0.1222 0.9521 { n ala A 193 1nlsA_195F_50A}P -11.9456 -1.7273 0.9086 {"}-11.9456 -1.7273 0.9086 { ca ala A 193 1nlsA_195F_50A}-11.0635 -2.0879 -0.1652 { c ala A 193 1nlsA_195F_50A}-10.7198 -0.8298 -0.972 { o ala A 193 1nlsA_195F_50A}-11.5347 0.0939 -1.0884 { c ala A 193 1nlsA_195F_50A}P -10.7198 -0.8298 -0.972 { n thr A 194 1nlsA_195F_50A}-9.5561 -0.8574 -1.5574 { ca thr A 194 1nlsA_195F_50A}-9.0992 0.2358 -2.4657 { c thr A 194 1nlsA_195F_50A}-8.3917 -0.4243 -3.6346 { o thr A 194 1nlsA_195F_50A}-7.6032 -1.3727 -3.4545 { c thr A 194 1nlsA_195F_50A}P -8.3917 -0.4243 -3.6346 { n phe A 195 1nlsA_195F_50A}-8.5957 0.0607 -4.8647 { ca phe A 195 1nlsA_195F_50A}-7.7594 -0.3649 -5.9538 { c phe A 195 1nlsA_195F_50A}-7.5093 0.8204 -6.8941 { o phe A 195 1nlsA_195F_50A}-8.3276 1.749 -7.0044 { c phe A 195 1nlsA_195F_50A}P -7.5093 0.8204 -6.8941 { n thr A 196 1nlsA_195F_50A}-6.3544 0.7903 -7.5593 { ca thr A 196 1nlsA_195F_50A}-5.9791 1.7791 -8.5674 { c thr A 196 1nlsA_195F_50A}-5.9254 1.0618 -9.9109 { o thr A 196 1nlsA_195F_50A}-5.4515 -0.0694 -9.9962 { c thr A 196 1nlsA_195F_50A}P -5.9254 1.0618 -9.9109 { n phe A 197 1nlsA_195F_50A}-6.4527 1.7521 -10.9379 { ca phe A 197 1nlsA_195F_50A}-6.6802 1.1078 -12.2125 { c phe A 197 1nlsA_195F_50A}-6.3026 2.0882 -13.3642 { o phe A 197 1nlsA_195F_50A}-6.3836 3.2832 -13.2316 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 48 1nlsA_195F_50A}P -6.9909 5.9401 -12.1663 { ca gly A 48 1nlsA_195F_50A}P -7.9958 6.2961 -11.174 {"}P -7.9958 6.2961 -11.174 { n thr A 49 1nlsA_195F_50A}P -8.6809 5.7875 -8.9082 { ca thr A 49 1nlsA_195F_50A}P -8.7409 5.069 -7.6401 { n ala A 50 1nlsA_195F_50A}P -10.5074 3.6577 -6.7761 { ca ala A 50 1nlsA_195F_50A}P -11.7976 3.322 -6.2158 { n his A 51 1nlsA_195F_50A}P -12.6061 3.2614 -3.9337 { ca his A 51 1nlsA_195F_50A}P -12.7052 2.8981 -2.5097 { n ile A 52 1nlsA_195F_50A}P -14.1246 1.188 -1.4859 { ca ile A 52 1nlsA_195F_50A}P -15.3627 0.4854 -1.1414 { n ala A 193 1nlsA_195F_50A}P -11.9456 -1.7273 0.9086 { ca ala A 193 1nlsA_195F_50A}P -11.0635 -2.0879 -0.1652 { n thr A 194 1nlsA_195F_50A}P -9.5561 -0.8574 -1.5574 { ca thr A 194 1nlsA_195F_50A}P -9.0992 0.2358 -2.4657 { n phe A 195 1nlsA_195F_50A}P -8.5957 0.0607 -4.8647 { ca phe A 195 1nlsA_195F_50A}P -7.7594 -0.3649 -5.9538 { n thr A 196 1nlsA_195F_50A}P -6.3544 0.7903 -7.5593 { ca thr A 196 1nlsA_195F_50A}P -5.9791 1.7791 -8.5674 { n phe A 197 1nlsA_195F_50A}P -6.4527 1.7521 -10.9379 { ca phe A 197 1nlsA_195F_50A}P -6.6802 1.1078 -12.2125 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 48 1nlsA_195F_50A}P -7.9958 6.2961 -11.174 {"}-7.9958 6.2961 -11.174 { ca thr A 49 1nlsA_195F_50A}-8.7409 5.069 -7.6401 { ca ala A 50 1nlsA_195F_50A}-11.7976 3.322 -6.2158 { ca his A 51 1nlsA_195F_50A}-12.7052 2.8981 -2.5097 { ca ile A 52 1nlsA_195F_50A}-15.3627 0.4854 -1.1414 { ca ala A 193 1nlsA_195F_50A}P -11.0635 -2.0879 -0.1652 {"}-11.0635 -2.0879 -0.1652 { ca thr A 194 1nlsA_195F_50A}-9.0992 0.2358 -2.4657 { ca phe A 195 1nlsA_195F_50A}-7.7594 -0.3649 -5.9538 { ca thr A 196 1nlsA_195F_50A}-5.9791 1.7791 -8.5674 { ca phe A 197 1nlsA_195F_50A}-6.6802 1.1078 -12.2125 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ala A 50 1nlsA_195F_50A}P -11.7976 3.322 -6.2158 { cb ala A 50 1nlsA_195F_50A}-12.4462 2.1973 -6.984 { ca phe A 195 1nlsA_195F_50A}P -7.7594 -0.3649 -5.9538 { cb phe A 195 1nlsA_195F_50A}-8.3073 -1.5808 -6.7053 { cg phe A 195 1nlsA_195F_50A}-9.6127 -1.4021 -7.4196 { cd1 phe A 195 1nlsA_195F_50A}-10.8492 -1.5913 -6.8108 { ce1 phe A 195 1nlsA_195F_50A}-12.0453 -1.4664 -7.5068 { cz phe A 195 1nlsA_195F_50A}-12.0183 -1.1397 -8.8654 { cg phe A 195 1nlsA_195F_50A}P -9.6127 -1.4021 -7.4196 { cd2 phe A 195 1nlsA_195F_50A}-9.6473 -1.0675 -8.8061 { ce2 phe A 195 1nlsA_195F_50A}-10.8153 -0.9086 -9.4818 { cz phe A 195 1nlsA_195F_50A}ghost -12.0183 -1.1397 -8.8654 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ala A 50 1nlsA_195F_50A}P -12.4462 2.1973 -6.984 {"}P -12.4462 2.1973 -6.984 {"}P -12.4462 2.1973 -6.984 { cb phe A 195 1nlsA_195F_50A}P -8.3073 -1.5808 -6.7053 {"}P -8.3073 -1.5808 -6.7053 { cd1 phe A 195 1nlsA_195F_50A}P -10.8492 -1.5913 -6.8108 { cd2 phe A 195 1nlsA_195F_50A}P -9.6473 -1.0675 -8.8061 { ce1 phe A 195 1nlsA_195F_50A}P -12.0453 -1.4664 -7.5068 { ce2 phe A 195 1nlsA_195F_50A}P -10.8153 -0.9086 -9.4818 { cz phe A 195 1nlsA_195F_50A}P -12.0183 -1.1397 -8.8654 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 195 A}'S' blue -11.487 -0.0602 -6.253 {"}'S' sky -11.648 -0.0751 -6.4561 {"}'S' blue -11.2303 0.0411 -6.3064 {"}'S' sky -11.1036 0.1219 -6.5567 {"}'S' sky -10.9165 0.1565 -6.7377 {"}'S' blue -10.7376 0.1509 -6.9345 {"}'S' sky -10.8997 0.1274 -7.137 {"}'S' sky -11.0633 0.066 -7.3313 { CE1 PHE 195 A}'S' blue -12.7427 0.1354 -7.4038 {"}'S' sky -11.7647 -0.0869 -6.4676 {"}'S' blue -12.6182 0.1812 -7.6457 {"}'S' sky -11.3542 0.1289 -7.7022 { CZ PHE 195 A}'S' sky -12.3632 0.2762 -7.8964 {"}'S' blue -12.5031 0.3571 -8.0993 {"}'S' sky -12.116 0.3526 -7.9572 {"}'S' blue -12.2514 0.4428 -8.156 {"}'S' blue -12.3994 0.4926 -8.361 {"}'S' sky -11.9783 0.4804 -8.2049 {"}'S' blue -12.1208 0.5463 -8.4077 {"}'S' sky -11.5291 0.2922 -7.9853 {"}'S' blue -11.6478 0.4259 -8.1763 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 195 A}'S' sea -11.3862 0.0467 -6.5104 {"}'S' sea -11.5466 0.0105 -6.7077 {"}'S' sea -11.2613 0.1088 -6.7572 {"}'S' sea -11.0781 0.1391 -6.9426 {"}'S' sea -11.242 0.0824 -7.1383 { CE1 PHE 195 A}'S' sea -12.143 0.026 -6.5986 {"}'S' green -12.2784 0.1162 -6.7974 {"}'S' green -12.4264 0.166 -7.0024 {"}'S' sea -12.5823 0.1716 -7.2065 {"}'S' green -11.8774 0.0508 -6.6513 {"}'S' green -12.0054 0.1538 -6.8463 {"}'S' green -12.2997 0.2468 -7.2527 {"}'S' sea -12.4574 0.2337 -7.4533 {"}'S' green -11.6748 0.0992 -6.8178 {"}'S' green -12.1126 0.2814 -7.4338 {"}'S' sea -12.2741 0.264 -7.6387 {"}'S' green -11.4897 0.1175 -7.0133 {"}'S' green -11.9336 0.2758 -7.6305 {"}'S' sea -11.2817 0.0707 -7.1644 {"}'S' green -11.4188 0.1616 -7.3674 {"}'S' green -11.5675 0.2154 -7.5743 {"}'S' sea -11.7251 0.2326 -7.7817 { CZ PHE 195 A}'S' sea -11.7377 0.2397 -7.8262 {"}'S' sea -11.8504 0.3775 -8.0099 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 195 A}'S' P -12.1478 0.2197 -7.0492 {"}'S' -12.1471 0.2069 -7.0521 {"}'S' P -11.8091 0.1976 -7.0188 {"}'S' -11.8131 0.1697 -7.0263 {"}'S' P -11.9559 0.2584 -7.2264 {"}'S' -11.9585 0.2222 -7.2319 {"}'S' P -11.6276 0.2085 -7.2157 {"}'S' -11.6301 0.1959 -7.218 {"}'S' P -11.7767 0.2615 -7.4231 {"}'S' -11.7779 0.2513 -7.424 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 50 A}'S' blue -12.8684 0.5249 -7.2819 {"}'S' sky -12.7198 0.4711 -7.075 {"}'S' blue -12.7477 0.5748 -7.5673 {"}'S' sky -12.6056 0.4964 -7.3621 {"}'S' blue -12.6182 0.6833 -7.8458 {"}'S' sky -12.4899 0.5797 -7.6502 {"}'S' blue -12.405 0.7601 -7.9821 {"}'S' blue -12.1686 0.8428 -8.0572 { HB3 ALA 50 A}'S' sky -12.556 0.4644 -7.2493 {"}'S' sky -11.9919 0.2559 -6.4633 {"}'S' sky -11.6874 0.2319 -6.4944 {"}'S' blue -11.5344 0.348 -6.329 {"}'S' sky -12.2379 0.5529 -7.7269 {"}'S' sky -11.2777 0.3907 -6.4407 {"}'S' sky -12.031 0.6764 -7.9029 {"}'S' sky -11.1153 0.4087 -6.6449 {"}'S' blue -11.7882 0.7701 -7.9838 {"}'S' sky -11.7237 0.5611 -7.8411 {"}'S' sky -11.0089 0.4507 -6.8868 {"}'S' blue -11.4855 0.668 -7.8715 {"}'S' blue -11.0895 0.451 -7.2977 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 50 A}'S' green -12.4406 0.3327 -7.0633 {"}'S' green -12.3032 0.2512 -6.8638 {"}'S' green -12.1513 0.2255 -6.6605 {"}'S' sea -12.3883 0.4322 -7.4555 {"}'S' green -12.2795 0.2915 -7.2764 {"}'S' green -11.846 0.1674 -6.6812 {"}'S' green -12.1503 0.3768 -7.5635 {"}'S' green -11.5858 0.1692 -6.777 {"}'S' sea -11.4278 0.2549 -6.596 {"}'S' sea -11.9599 0.4801 -7.7575 {"}'S' green -11.8573 0.3273 -7.5824 {"}'S' green -11.4234 0.2013 -6.9863 {"}'S' sea -11.2657 0.2773 -6.8034 {"}'S' sea -11.6201 0.4024 -7.6632 {"}'S' green -11.4852 0.3076 -7.4623 {"}'S' sea -11.3294 0.2833 -7.2541 {"}'S' sea -11.1661 0.3323 -7.0575 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 50 A}'S' P -12.1488 0.1971 -7.0813 {"}'S' -12.1446 0.2111 -7.0788 {"}'S' P -12.0015 0.1554 -6.879 {"}'S' -12.001 0.1604 -6.8794 {"}'S' P -12.0341 0.245 -7.378 {"}'S' -12.0318 0.2606 -7.3716 {"}'S' P -11.8975 0.1637 -7.1779 {"}'S' -11.894 0.2032 -7.1702 {"}'S' P -11.7451 0.1387 -6.9742 {"}'S' -11.7463 0.1546 -6.9742 {"}'S' P -11.7289 0.2265 -7.3873 {"}'S' -11.7293 0.2374 -7.3834 {"}'S' P -11.5816 0.1835 -7.1847 {"}'S' -11.5823 0.1864 -7.1847 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 195 A}'M' greentint -9.4997 2.1414 -6.348 {"}'M' greentint -9.6433 2.0337 -6.6205 {"}'M' greentint -9.2377 2.4627 -6.2154 {"}'M' greentint -9.401 2.4293 -6.4172 {"}'M' greentint -9.5496 2.2724 -6.5657 {"}'M' greentint -9.6533 2.176 -6.8632 {"}'M' greentint -9.7098 1.9265 -6.8665 {"}'M' greentint -9.0938 2.6678 -6.2774 {"}'M' greentint -9.2518 2.6594 -6.4794 {"}'M' greentint -9.4103 2.5663 -6.6578 {"}'M' greentint -9.5496 2.3983 -6.791 {"}'M' greentint -9.6229 2.2701 -7.108 {"}'M' greentint -9.6941 2.0249 -7.1322 {"}'M' greentint -9.0648 2.8486 -6.5473 {"}'M' greentint -9.225 2.7903 -6.7392 {"}'M' greentint -9.3797 2.6673 -6.9039 {"}'M' greentint -9.5155 2.4897 -7.0301 {"}'M' greentint -9.545 2.3503 -7.3463 {"}'M' greentint -9.6262 2.1071 -7.3846 {"}'M' greentint -8.982 2.9685 -6.7914 {"}'M' greentint -9.1441 2.8864 -6.977 {"}'M' greentint -9.2963 2.7504 -7.137 {"}'M' greentint -9.433 2.5688 -7.2618 {"}'M' greentint -9.043 2.9326 -7.2236 {"}'M' greentint -9.1891 2.7891 -7.3735 {"}'M' greentint -9.3199 2.6071 -7.492 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 50 A}'M' greentint -9.5677 1.9585 -6.5838 {"}'M' greentint -9.4175 2.083 -6.424 {"}'M' greentint -9.2844 2.2586 -6.3009 {"}'M' greentint -9.1791 2.4732 -6.2231 {"}'M' greentint -9.6753 1.9538 -7.1211 {"}'M' greentint -9.5171 1.956 -6.9174 {"}'M' greentint -9.3565 2.032 -6.7305 {"}'M' greentint -9.207 2.1774 -6.5781 {"}'M' greentint -9.0824 2.3773 -6.4723 {"}'M' greentint -8.9938 2.6149 -6.4243 {"}'M' greentint -9.5722 2.1165 -7.3762 {"}'M' greentint -9.4234 2.0668 -7.1701 {"}'M' greentint -9.2611 2.1118 -6.9721 {"}'M' greentint -9.1069 2.2444 -6.8104 {"}'M' greentint -8.9827 2.4477 -6.7058 {"}'M' greentint -8.9044 2.6934 -6.6737 {"}'M' greentint -8.8834 2.9488 -6.717 {"}'M' greentint -9.4442 2.3521 -7.5387 {"}'M' greentint -9.3125 2.2503 -7.3405 {"}'M' greentint -9.1515 2.2784 -7.1405 {"}'M' greentint -9.0034 2.4303 -6.9917 {"}'M' greentint -8.9086 2.6644 -6.9343 {"}'M' greentint -8.8923 2.9181 -6.9836 {"}'M' greentint -9.179 2.4682 -7.394 {"}'M' greentint -9.019 2.5651 -7.2146 {"}'M' greentint -8.964 2.8184 -7.2144 {"}'M' greentint -9.0973 2.7147 -7.4139 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 195 A}'M' green -10.22 0.7855 -4.7023 {"}'M' green -9.9008 0.9805 -4.3449 {"}'M' green -10.2471 1.0368 -5.236 {"}'M' green -10.0428 1.3321 -5.3984 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 195 A}'M' greentint -10.0867 0.8891 -4.5029 {"}'M' greentint -10.005 1.1357 -4.5227 {"}'M' greentint -10.165 1.0388 -4.7021 {"}'M' greentint -10.2754 0.9394 -4.9824 {"}'M' greentint -9.7398 1.2518 -4.3781 {"}'M' greentint -9.8715 1.3535 -4.5762 {"}'M' greentint -10.0326 1.3254 -4.7762 {"}'M' greentint -10.1806 1.1735 -4.9251 {"}'M' greentint -9.5482 1.4285 -4.442 {"}'M' greentint -9.6831 1.5234 -4.6429 {"}'M' greentint -9.842 1.5265 -4.8488 {"}'M' greentint -10.0023 1.4355 -5.0316 {"}'M' greentint -10.1437 1.2649 -5.1672 {"}'M' greentint -9.4346 1.6226 -4.6932 {"}'M' greentint -9.5863 1.6581 -4.8984 {"}'M' greentint -9.7476 1.6189 -5.0962 {"}'M' greentint -9.9042 1.5069 -5.2676 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 50 A}'M' green -10.2829 0.9074 -4.9392 {"}'M' green -9.6599 1.2305 -4.2229 {"}'M' green -9.462 1.4986 -4.3588 {"}'M' green -9.9313 1.5316 -5.4231 {"}'M' green -9.6857 1.6578 -5.2581 {"}'M' green -9.527 1.7552 -5.0805 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 50 A}'M' greentint -10.1257 0.9028 -4.7335 {"}'M' greentint -9.9631 0.9585 -4.5394 {"}'M' greentint -9.8052 1.0688 -4.3659 {"}'M' greentint -10.1993 1.0853 -5.1971 {"}'M' greentint -10.0513 1.0382 -4.9926 {"}'M' greentint -9.8921 1.0607 -4.7921 {"}'M' greentint -9.7324 1.1492 -4.6111 {"}'M' greentint -9.5857 1.2988 -4.4636 {"}'M' greentint -10.071 1.297 -5.3486 {"}'M' greentint -9.9327 1.2202 -5.1471 {"}'M' greentint -9.7738 1.2312 -4.9462 {"}'M' greentint -9.6168 1.3271 -4.7689 {"}'M' greentint -9.4784 1.4976 -4.6373 {"}'M' greentint -9.7984 1.428 -5.2229 {"}'M' greentint -9.6352 1.4572 -5.0202 {"}'M' greentint -9.4854 1.6109 -4.8694 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 410 1nscA_412F_423}P -12.5053 -2.1321 0.1813 {"}-12.5053 -2.1321 0.1813 { ca phe A 410 1nscA_412F_423}-11.0834 -2.2189 -0.1488 { c phe A 410 1nscA_412F_423}-10.7792 -1.1333 -1.1701 { o phe A 410 1nscA_412F_423}-11.689 -0.6864 -1.8936 { c phe A 410 1nscA_412F_423}P -10.7792 -1.1333 -1.1701 { n gly A 411 1nscA_412F_423}-9.5235 -0.6848 -1.2634 { ca gly A 411 1nscA_412F_423}-9.2262 0.309 -2.2766 { c gly A 411 1nscA_412F_423}-8.4771 -0.3893 -3.3901 { o gly A 411 1nscA_412F_423}-7.9396 -1.4842 -3.1661 { c gly A 411 1nscA_412F_423}P -8.4771 -0.3893 -3.3901 { n phe A 412 1nscA_412F_423}-8.4203 0.1483 -4.6023 { ca phe A 412 1nscA_412F_423}-7.567 -0.3676 -5.6337 { c phe A 412 1nscA_412F_423}-7.4222 0.7547 -6.6644 { o phe A 412 1nscA_412F_423}-8.1532 1.7478 -6.5795 { c phe A 412 1nscA_412F_423}P -7.4222 0.7547 -6.6644 { n glu A 413 1nscA_412F_423}-6.4923 0.6107 -7.5975 { ca glu A 413 1nscA_412F_423}-6.2066 1.6559 -8.5836 { c glu A 413 1nscA_412F_423}-6.1911 1.0613 -9.9733 { o glu A 413 1nscA_412F_423}-5.639 -0.0326 -10.1806 { c glu A 413 1nscA_412F_423}P -6.1911 1.0613 -9.9733 { n ile A 414 1nscA_412F_423}-6.8156 1.7568 -10.9155 { ca ile A 414 1nscA_412F_423}-6.8744 1.342 -12.2905 { c ile A 414 1nscA_412F_423}-5.8189 2.1682 -12.9845 { o ile A 414 1nscA_412F_423}-5.6517 3.3586 -12.6893 { n val A 421 1nscA_412F_423}P -6.1749 5.7369 -11.4507 {"}-6.1749 5.7369 -11.4507 { ca val A 421 1nscA_412F_423}-7.5345 6.0608 -11.0418 { c val A 421 1nscA_412F_423}-7.8077 5.2901 -9.7509 { o val A 421 1nscA_412F_423}-7.8166 4.0503 -9.7568 { c val A 421 1nscA_412F_423}P -7.8077 5.2901 -9.7509 { n pro A 422 1nscA_412F_423}-7.9869 5.9835 -8.6332 { ca pro A 422 1nscA_412F_423}-8.3568 5.4047 -7.3474 { c pro A 422 1nscA_412F_423}-9.8094 4.9653 -7.3236 { o pro A 422 1nscA_412F_423}-10.6946 5.7035 -7.7929 { c pro A 422 1nscA_412F_423}P -9.8094 4.9653 -7.3236 { n cys A 423 1nscA_412F_423}-10.0763 3.7961 -6.7585 { ca cys A 423 1nscA_412F_423}-11.4215 3.2715 -6.6471 { c cys A 423 1nscA_412F_423}-11.5533 2.5797 -5.2904 { o cys A 423 1nscA_412F_423}-10.5576 2.189 -4.6639 { c cys A 423 1nscA_412F_423}P -11.5533 2.5797 -5.2904 { n ile A 424 1nscA_412F_423}-12.7948 2.4314 -4.836 { ca ile A 424 1nscA_412F_423}-13.1154 1.6867 -3.6398 { c ile A 424 1nscA_412F_423}-14.1455 0.6733 -4.0902 { o ile A 424 1nscA_412F_423}-15.0948 1.045 -4.8026 { c ile A 424 1nscA_412F_423}P -14.1455 0.6733 -4.0902 { n gly A 425 1nscA_412F_423}-13.9302 -0.5898 -3.7313 { ca gly A 425 1nscA_412F_423}-14.8915 -1.6489 -3.9935 { c gly A 425 1nscA_412F_423}-15.5557 -2.0393 -2.6625 { o gly A 425 1nscA_412F_423}-14.9572 -1.8965 -1.5815 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 410 1nscA_412F_423}P -12.5053 -2.1321 0.1813 { ca phe A 410 1nscA_412F_423}P -11.0834 -2.2189 -0.1488 { n gly A 411 1nscA_412F_423}P -9.5235 -0.6848 -1.2634 { ca gly A 411 1nscA_412F_423}P -9.2262 0.309 -2.2766 {"}P -9.2262 0.309 -2.2766 { n phe A 412 1nscA_412F_423}P -8.4203 0.1483 -4.6023 { ca phe A 412 1nscA_412F_423}P -7.567 -0.3676 -5.6337 { n glu A 413 1nscA_412F_423}P -6.4923 0.6107 -7.5975 { ca glu A 413 1nscA_412F_423}P -6.2066 1.6559 -8.5836 { n ile A 414 1nscA_412F_423}P -6.8156 1.7568 -10.9155 { ca ile A 414 1nscA_412F_423}P -6.8744 1.342 -12.2905 { n val A 421 1nscA_412F_423}P -6.1749 5.7369 -11.4507 { ca val A 421 1nscA_412F_423}P -7.5345 6.0608 -11.0418 { ca pro A 422 1nscA_412F_423}P -8.3568 5.4047 -7.3474 { n cys A 423 1nscA_412F_423}P -10.0763 3.7961 -6.7585 { ca cys A 423 1nscA_412F_423}P -11.4215 3.2715 -6.6471 { n ile A 424 1nscA_412F_423}P -12.7948 2.4314 -4.836 { ca ile A 424 1nscA_412F_423}P -13.1154 1.6867 -3.6398 { n gly A 425 1nscA_412F_423}P -13.9302 -0.5898 -3.7313 { ca gly A 425 1nscA_412F_423}P -14.8915 -1.6489 -3.9935 {"}P -14.8915 -1.6489 -3.9935 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 410 1nscA_412F_423}P -11.0834 -2.2189 -0.1488 {"}-11.0834 -2.2189 -0.1488 { ca gly A 411 1nscA_412F_423}-9.2262 0.309 -2.2766 { ca phe A 412 1nscA_412F_423}-7.567 -0.3676 -5.6337 { ca glu A 413 1nscA_412F_423}-6.2066 1.6559 -8.5836 { ca ile A 414 1nscA_412F_423}-6.8744 1.342 -12.2905 { ca val A 421 1nscA_412F_423}-7.5345 6.0608 -11.0418 { ca pro A 422 1nscA_412F_423}-8.3568 5.4047 -7.3474 { ca cys A 423 1nscA_412F_423}-11.4215 3.2715 -6.6471 { ca ile A 424 1nscA_412F_423}-13.1154 1.6867 -3.6398 { ca gly A 425 1nscA_412F_423}-14.8915 -1.6489 -3.9935 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 412 1nscA_412F_423}P -7.567 -0.3676 -5.6337 { cb phe A 412 1nscA_412F_423}-8.1444 -1.624 -6.3104 { cg phe A 412 1nscA_412F_423}-9.4287 -1.4602 -7.0848 { cd1 phe A 412 1nscA_412F_423}-10.6216 -1.4709 -6.3938 { ce1 phe A 412 1nscA_412F_423}-11.8197 -1.3793 -7.08 { cz phe A 412 1nscA_412F_423}-11.7957 -1.2734 -8.464 { cg phe A 412 1nscA_412F_423}P -9.4287 -1.4602 -7.0848 { cd2 phe A 412 1nscA_412F_423}-9.3875 -1.3438 -8.4683 { ce2 phe A 412 1nscA_412F_423}-10.5824 -1.2511 -9.1554 { cz phe A 412 1nscA_412F_423}ghost -11.7957 -1.2734 -8.464 { ca cys A 423 1nscA_412F_423}P -11.4215 3.2715 -6.6471 { cb cys A 423 1nscA_412F_423}-11.6932 2.2255 -7.7299 { sg cys A 423 1nscA_412F_423}-11.4578 2.7701 -9.4309 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 412 1nscA_412F_423}P -8.1444 -1.624 -6.3104 {"}P -8.1444 -1.624 -6.3104 { cd1 phe A 412 1nscA_412F_423}P -10.6216 -1.4709 -6.3938 { cd2 phe A 412 1nscA_412F_423}P -9.3875 -1.3438 -8.4683 { ce1 phe A 412 1nscA_412F_423}P -11.8197 -1.3793 -7.08 { ce2 phe A 412 1nscA_412F_423}P -10.5824 -1.2511 -9.1554 { cz phe A 412 1nscA_412F_423}P -11.7957 -1.2734 -8.464 { cb cys A 423 1nscA_412F_423}P -11.6932 2.2255 -7.7299 {"}P -11.6932 2.2255 -7.7299 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 412 A}'S' blue -10.1261 0.1416 -6.9817 {"}'S' blue -10.0016 0.1874 -7.2236 {"}'S' blue -10.1589 0.0976 -7.4027 {"}'S' blue -10.312 -0.0279 -7.5646 {"}'S' blue -9.9826 0.1198 -7.5941 { CD1 PHE 412 A}'S' blue -11.1944 0.1766 -6.5326 {"}'S' sky -10.8504 0.2594 -6.5256 {"}'S' sky -11.0143 0.2027 -6.7213 {"}'S' sky -10.672 0.2478 -6.72 {"}'S' sky -10.4631 0.2051 -6.8725 {"}'S' blue -10.2479 0.127 -7.0014 {"}'S' sky -10.4114 0.0697 -7.1964 {"}'S' sky -10.5734 -0.0256 -7.379 { CD2 PHE 412 A}'S' blue -10.463 -0.1379 -7.7971 {"}'S' blue -10.2597 0.044 -7.8547 {"}'S' blue -10.0253 0.1872 -7.9105 {"}'S' blue -10.1864 0.1723 -8.1136 { CE1 PHE 412 A}'S' blue -12.0741 0.3339 -6.8259 {"}'S' blue -12.2318 0.3207 -7.0264 {"}'S' blue -12.3926 0.2682 -7.2189 {"}'S' sky -11.7304 0.3454 -6.7996 {"}'S' sky -12.2125 0.2943 -7.4075 {"}'S' blue -12.3736 0.2006 -7.5893 { CE2 PHE 412 A}'S' blue -10.4649 -0.0517 -7.8861 {"}'S' sky -10.5626 0.1122 -8.0587 {"}'S' sky -10.9635 0.3813 -8.651 {"}'S' blue -11.1194 0.3869 -8.8551 {"}'S' blue -10.3019 0.1284 -8.1162 {"}'S' sky -10.4145 0.2661 -8.2999 {"}'S' sky -10.5425 0.3691 -8.4949 {"}'S' sky -10.6849 0.4349 -8.6977 { CZ PHE 412 A}'S' sky -12.2805 0.2235 -7.6979 {"}'S' blue -12.4335 0.2577 -7.9063 {"}'S' sky -12.3326 0.3645 -8.1637 {"}'S' blue -12.493 0.3283 -8.361 {"}'S' blue -12.3686 0.3741 -8.6029 {"}'S' sky -11.8461 0.4453 -8.7903 {"}'S' sky -11.4755 0.4256 -8.7389 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 412 A}'S' sea -10.8356 0.1863 -6.9143 {"}'S' sea -10.6263 0.1444 -7.0663 {"}'S' sea -10.7875 0.0479 -7.2475 { CE1 PHE 412 A}'S' sea -11.887 0.3684 -7.0069 {"}'S' sea -12.0486 0.351 -7.2118 {"}'S' sea -11.4021 0.2955 -6.7889 {"}'S' green -11.5512 0.3485 -6.9962 {"}'S' green -11.7081 0.3628 -7.2037 {"}'S' sea -11.8702 0.3394 -7.4063 {"}'S' sea -12.0338 0.2779 -7.6005 {"}'S' green -11.1933 0.2486 -6.9405 {"}'S' green -11.3419 0.3024 -7.1474 {"}'S' green -11.6613 0.2966 -7.5587 {"}'S' green -10.981 0.1564 -7.0685 {"}'S' green -11.1286 0.2159 -7.2753 {"}'S' green -10.9207 0.0904 -7.3863 {"}'S' green -11.0726 0.1189 -7.5901 {"}'S' sea -10.8415 -0.04 -7.6379 { CE2 PHE 412 A}'S' sea -10.6802 0.2413 -8.2472 {"}'S' sea -10.8156 0.3315 -8.446 { CZ PHE 412 A}'S' sea -12.0288 0.3092 -7.7546 {"}'S' sea -12.1767 0.359 -7.9596 {"}'S' green -11.7557 0.3467 -7.8035 {"}'S' green -11.8982 0.4126 -8.0063 {"}'S' green -12.0501 0.4398 -8.2099 {"}'S' sea -12.2077 0.4267 -8.4104 {"}'S' green -11.5595 0.3906 -7.9759 {"}'S' green -11.7063 0.4514 -8.1836 {"}'S' green -11.8629 0.4744 -8.3909 {"}'S' sea -12.0245 0.4569 -8.5958 {"}'S' green -11.1178 0.1858 -7.7766 {"}'S' green -11.378 0.4014 -8.1729 {"}'S' green -11.5271 0.4544 -8.3802 {"}'S' sea -11.684 0.4688 -8.5877 {"}'S' sea -10.8049 -0.0204 -7.7496 {"}'S' green -10.9099 0.1373 -7.9291 {"}'S' green -11.0321 0.2636 -8.1215 {"}'S' green -11.1692 0.3545 -8.3246 {"}'S' sea -11.3179 0.4083 -8.5315 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 412 A}'S' P -11.4996 0.3196 -7.3548 {"}'S' -11.5002 0.3119 -7.354 {"}'S' P -11.2845 0.2374 -7.483 {"}'S' -11.2872 0.2291 -7.4814 { CZ PHE 412 A}'S' P -11.4252 0.2922 -7.7749 {"}'S' -11.4266 0.2867 -7.7774 {"}'S' P -11.2401 0.3104 -7.9705 {"}'S' -11.2437 0.3013 -7.9734 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 423 A}'S' blue -12.2777 0.7401 -7.0122 {"}'S' sky -12.3128 0.6156 -7.4369 {"}'S' sky -12.1531 0.6126 -7.2298 {"}'S' sky -11.9901 0.6494 -7.0292 {"}'S' blue -11.8266 0.725 -6.84 {"}'S' blue -12.4527 0.6852 -8.066 {"}'S' sky -12.3151 0.5951 -7.8625 {"}'S' sky -12.166 0.5421 -7.6552 {"}'S' blue -12.3748 0.7703 -8.4233 {"}'S' sky -12.1214 0.7186 -8.5095 {"}'S' blue -11.977 0.8508 -8.7746 {"}'S' sky -11.652 0.7883 -8.728 {"}'S' blue -11.2844 0.7657 -8.6048 { HB2 CYS 423 A}'S' sky -11.5391 0.6313 -6.7811 {"}'S' sky -10.9194 0.5324 -6.7301 {"}'S' sky -10.6302 0.5626 -6.7963 {"}'S' sky -10.5129 0.4447 -7.0448 {"}'S' sky -10.6587 0.2552 -7.5904 {"}'S' sky -10.501 0.3312 -7.4076 {"}'S' blue -10.3505 0.4626 -7.2491 {"}'S' sky -10.959 0.6151 -8.4453 {"}'S' sky -10.5646 0.3372 -7.8583 {"}'S' blue -10.4014 0.3862 -7.6617 {"}'S' blue -10.2442 0.5046 -7.4909 {"}'S' sky -10.7208 0.7219 -8.4756 {"}'S' sky -10.6182 0.5692 -8.3005 {"}'S' sky -10.4811 0.4942 -8.1011 {"}'S' blue -10.3247 0.5049 -7.9018 @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 423 A}'S' sea -12.0083 0.5276 -7.4483 {"}'S' sea -11.8462 0.5511 -7.2457 {"}'S' sea -12.2529 0.6449 -8.2298 {"}'S' sea -12.1154 0.5531 -8.0278 {"}'S' green -11.9668 0.4993 -7.8209 {"}'S' green -11.9947 0.603 -8.3132 {"}'S' green -11.8526 0.5246 -8.108 {"}'S' sea -11.8652 0.7115 -8.5918 {"}'S' green -11.7369 0.608 -8.3961 {"}'S' green -11.5957 0.5411 -8.1948 {"}'S' sea -11.5251 0.6796 -8.5331 { HB2 CYS 423 A}'S' sea -11.7016 0.5823 -6.9783 {"}'S' green -11.7556 0.4506 -7.3793 {"}'S' green -11.6083 0.4075 -7.1767 {"}'S' green -11.451 0.4254 -6.9777 {"}'S' sea -11.2928 0.5022 -6.7944 {"}'S' green -11.6758 0.3867 -7.6675 {"}'S' green -11.5385 0.3052 -7.468 {"}'S' green -11.2272 0.3099 -7.0675 {"}'S' sea -11.0687 0.3964 -6.886 {"}'S' green -11.6236 0.4861 -8.0596 {"}'S' green -11.3841 0.251 -7.6855 {"}'S' green -11.0813 0.2213 -7.2853 {"}'S' green -10.9226 0.2858 -7.0986 {"}'S' sea -10.7697 0.4019 -6.9331 {"}'S' green -11.3855 0.4307 -8.1676 {"}'S' green -11.1328 0.2176 -7.7821 {"}'S' green -10.9804 0.1926 -7.5784 {"}'S' sea -10.821 0.2231 -7.3812 {"}'S' sea -10.663 0.3088 -7.2002 {"}'S' sea -11.1952 0.534 -8.3617 {"}'S' green -11.0926 0.3812 -8.1866 {"}'S' green -10.9641 0.2805 -7.9914 {"}'S' sea -10.8169 0.2374 -7.7889 {"}'S' sea -10.8553 0.4563 -8.2673 {"}'S' sea -10.7204 0.3615 -8.0664 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 CYS 423 A}'S' P -11.3865 0.2794 -7.2647 {"}'S' -11.3829 0.2917 -7.2677 {"}'S' P -11.5148 0.3454 -7.8805 {"}'S' -11.5135 0.3477 -7.8793 {"}'S' P -11.2368 0.2093 -7.4832 {"}'S' -11.2362 0.2143 -7.4835 {"}'S' P -11.2693 0.299 -7.9822 {"}'S' -11.2681 0.3098 -7.9778 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 412 A}'M' greentint -9.0633 2.4615 -5.7905 {"}'M' greentint -9.2266 2.4281 -5.9924 {"}'M' greentint -9.3752 2.2712 -6.1408 {"}'M' greentint -8.9194 2.6667 -5.8525 {"}'M' greentint -9.0774 2.6583 -6.0545 {"}'M' greentint -9.236 2.5651 -6.2329 {"}'M' greentint -9.3752 2.3972 -6.3661 {"}'M' greentint -9.4485 2.2689 -6.6831 {"}'M' greentint -8.7342 2.8367 -5.9185 {"}'M' greentint -8.8904 2.8474 -6.1224 {"}'M' greentint -9.0506 2.7892 -6.3144 {"}'M' greentint -9.2054 2.6661 -6.479 {"}'M' greentint -9.3411 2.4886 -6.6052 {"}'M' greentint -8.6471 2.9908 -6.1644 {"}'M' greentint -8.8072 2.9668 -6.3658 {"}'M' greentint -8.9697 2.8852 -6.5521 {"}'M' greentint -9.1219 2.7493 -6.7121 {"}'M' greentint -9.2586 2.5677 -6.8369 {"}'M' greentint -8.3985 3.0822 -6.2333 {"}'M' greentint -8.5537 3.0813 -6.4333 {"}'M' greentint -8.7128 3.0302 -6.6254 {"}'M' greentint -8.8686 2.9315 -6.7988 {"}'M' greentint -9.0148 2.7879 -6.9487 {"}'M' greentint -9.1455 2.6059 -7.0671 {"}'M' greentint -8.556 3.0647 -6.8309 {"}'M' greentint -8.7129 2.9588 -7.004 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H CYS 423 A}'M' greentint -9.3336 2.2492 -6.0568 {"}'M' greentint -9.1787 2.3464 -5.8843 {"}'M' greentint -9.3773 2.2098 -6.5312 {"}'M' greentint -9.2229 2.2091 -6.3321 {"}'M' greentint -9.0647 2.2728 -6.1458 {"}'M' greentint -8.9145 2.3973 -5.986 {"}'M' greentint -8.7814 2.5729 -5.8629 {"}'M' greentint -9.3137 2.3411 -6.8862 {"}'M' greentint -9.1724 2.2681 -6.6831 {"}'M' greentint -9.0142 2.2703 -6.4794 {"}'M' greentint -8.8535 2.3463 -6.2925 {"}'M' greentint -8.704 2.4917 -6.1401 {"}'M' greentint -8.5794 2.6916 -6.0343 {"}'M' greentint -8.4908 2.9292 -5.9863 {"}'M' greentint -9.0692 2.4308 -6.9382 {"}'M' greentint -8.9205 2.3812 -6.7321 {"}'M' greentint -8.7581 2.4261 -6.5341 {"}'M' greentint -8.6039 2.5587 -6.3724 {"}'M' greentint -8.4797 2.762 -6.2678 {"}'M' greentint -8.4014 3.0077 -6.2357 {"}'M' greentint -8.9412 2.6664 -7.1007 {"}'M' greentint -8.8095 2.5646 -6.9025 {"}'M' greentint -8.6485 2.5927 -6.7025 {"}'M' greentint -8.5004 2.7447 -6.5537 {"}'M' greentint -8.4056 2.9788 -6.4963 {"}'M' greentint -8.676 2.7825 -6.956 {"}'M' greentint -8.516 2.8794 -6.7766 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 412 A}'M' green -9.7415 1.1095 -4.2778 {"}'M' green -9.9465 0.9061 -4.7081 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 412 A}'M' greentint -9.8747 1.0058 -4.4773 {"}'M' greentint -9.6598 1.356 -4.2977 {"}'M' greentint -9.8198 1.2591 -4.4771 {"}'M' greentint -9.9302 1.1598 -4.7574 {"}'M' greentint -9.5263 1.5739 -4.3512 {"}'M' greentint -9.6873 1.5458 -4.5512 {"}'M' greentint -9.8354 1.3939 -4.7 {"}'M' greentint -9.9019 1.2572 -5.011 {"}'M' greentint -9.9523 1.0025 -5.0063 {"}'M' greentint -9.3379 1.7438 -4.4178 {"}'M' greentint -9.4968 1.7469 -4.6237 {"}'M' greentint -9.657 1.6558 -4.8066 {"}'M' greentint -9.7984 1.4853 -4.9422 {"}'M' greentint -9.805 1.3315 -5.251 {"}'M' greentint -9.241 1.8785 -4.6733 {"}'M' greentint -9.4023 1.8393 -4.8712 {"}'M' greentint -9.559 1.7272 -5.0426 {"}'M' greentint -9.6975 1.5525 -5.1733 {"}'M' greentint -9.271 1.8657 -5.1079 {"}'M' greentint -9.4213 1.7412 -5.2677 {"}'M' greentint -9.5544 1.5656 -5.3908 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O CYS 423 A}'M' green -9.9241 0.9468 -4.5347 {"}'M' green -9.51 1.426 -4.1329 {"}'M' green -9.9793 0.9511 -4.9701 {"}'M' green -9.2925 1.7143 -4.296 {"}'M' green -9.905 1.0865 -5.2292 {"}'M' green -9.7863 1.2685 -5.3837 {"}'M' green -9.652 1.4763 -5.4594 {"}'M' green -9.2438 1.8956 -5.0485 {"}'M' green -9.3807 1.8035 -5.317 @dotlist {x} color= red width= 1 master= {H-bonds} { O CYS 423 A}'M' greentint -9.7723 1.0674 -4.3719 {"}'M' greentint -9.632 1.2294 -4.2359 {"}'M' greentint -9.8167 1.0068 -4.7759 {"}'M' greentint -9.6589 1.1171 -4.6025 {"}'M' greentint -9.5135 1.2788 -4.4595 {"}'M' greentint -9.3889 1.4812 -4.3559 {"}'M' greentint -9.7458 1.109 -5.0287 {"}'M' greentint -9.5861 1.1976 -4.8477 {"}'M' greentint -9.4394 1.3472 -4.7001 {"}'M' greentint -9.3156 1.5469 -4.5954 {"}'M' greentint -9.2238 1.7811 -4.5421 {"}'M' greentint -9.6275 1.2795 -5.1828 {"}'M' greentint -9.4705 1.3754 -5.0054 {"}'M' greentint -9.332 1.5459 -4.8739 {"}'M' greentint -9.2291 1.7694 -4.803 {"}'M' greentint -9.4889 1.5055 -5.2568 {"}'M' greentint -9.3391 1.6593 -5.106 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 126 1ntvA_128Y_139}P -11.8714 -1.5538 1.1413 {"}-11.8714 -1.5538 1.1413 { ca phe A 126 1ntvA_128Y_139}-10.6757 -1.7841 0.3486 { c phe A 126 1ntvA_128Y_139}-10.7975 -0.9292 -0.9 { o phe A 126 1ntvA_128Y_139}-11.8449 -0.3316 -1.159 { c phe A 126 1ntvA_128Y_139}P -10.7975 -0.9292 -0.9 { n gly A 127 1ntvA_128Y_139}-9.7173 -0.8657 -1.6647 { ca gly A 127 1ntvA_128Y_139}-9.7417 -0.0941 -2.8892 { c gly A 127 1ntvA_128Y_139}-8.7224 -0.6359 -3.8605 { o gly A 127 1ntvA_128Y_139}-7.9456 -1.5322 -3.5324 { c gly A 127 1ntvA_128Y_139}P -8.7224 -0.6359 -3.8605 { n tyr A 128 1ntvA_128Y_139}-8.7382 -0.1058 -5.0745 { ca tyr A 128 1ntvA_128Y_139}-7.7929 -0.5352 -6.0872 { c tyr A 128 1ntvA_128Y_139}-7.4498 0.6302 -6.9847 { o tyr A 128 1ntvA_128Y_139}-8.2482 1.5546 -7.1523 { c tyr A 128 1ntvA_128Y_139}P -7.4498 0.6302 -6.9847 { n val A 129 1ntvA_128Y_139}-6.2428 0.5914 -7.5357 { ca val A 129 1ntvA_128Y_139}-5.7912 1.6323 -8.4429 { c val A 129 1ntvA_128Y_139}-5.9734 1.0882 -9.8511 { o val A 129 1ntvA_128Y_139}-5.6317 -0.0629 -10.1345 { c val A 129 1ntvA_128Y_139}P -5.9734 1.0882 -9.8511 { n cys A 130 1ntvA_128Y_139}-6.5291 1.9117 -10.7335 { ca cys A 130 1ntvA_128Y_139}-6.7468 1.4961 -12.1103 { c cys A 130 1ntvA_128Y_139}-6.4206 2.6163 -13.094 { o cys A 130 1ntvA_128Y_139}-6.4091 3.7939 -12.7303 { n arg A 137 1ntvA_128Y_139}P -6.4274 6.1641 -10.9996 {"}-6.4274 6.1641 -10.9996 { ca arg A 137 1ntvA_128Y_139}-7.526 6.4935 -10.1019 { c arg A 137 1ntvA_128Y_139}-7.6529 5.4087 -9.0417 { o arg A 137 1ntvA_128Y_139}-7.4464 4.232 -9.3248 { c arg A 137 1ntvA_128Y_139}P -7.6529 5.4087 -9.0417 { n phe A 138 1ntvA_128Y_139}-7.9835 5.8184 -7.8218 { ca phe A 138 1ntvA_128Y_139}-8.1779 4.8775 -6.7227 { c phe A 138 1ntvA_128Y_139}-9.681 4.7743 -6.4774 { o phe A 138 1ntvA_128Y_139}-10.3426 5.7748 -6.2019 { c phe A 138 1ntvA_128Y_139}P -9.681 4.7743 -6.4774 { n val A 139 1ntvA_128Y_139}-10.2109 3.56 -6.5998 { ca val A 139 1ntvA_128Y_139}-11.6308 3.2754 -6.3992 { c val A 139 1ntvA_128Y_139}-11.7854 2.6627 -5.008 { o val A 139 1ntvA_128Y_139}-11.2007 1.6138 -4.728 { c val A 139 1ntvA_128Y_139}P -11.7854 2.6627 -5.008 { n ala A 140 1ntvA_128Y_139}-12.5729 3.3109 -4.1508 { ca ala A 140 1ntvA_128Y_139}-12.7797 2.8573 -2.7715 { c ala A 140 1ntvA_128Y_139}-14.1423 2.2149 -2.5699 { o ala A 140 1ntvA_128Y_139}-15.1704 2.7942 -2.923 { c ala A 140 1ntvA_128Y_139}P -14.1423 2.2149 -2.5699 { n ile A 141 1ntvA_128Y_139}-14.1328 1.033 -1.9573 { ca ile A 141 1ntvA_128Y_139}-15.3386 0.2436 -1.7437 { c ile A 141 1ntvA_128Y_139}-15.5685 -0.146 -0.2805 { o ile A 141 1ntvA_128Y_139}-14.6387 -0.5598 0.408 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 126 1ntvA_128Y_139}P -11.8714 -1.5538 1.1413 { ca phe A 126 1ntvA_128Y_139}P -10.6757 -1.7841 0.3486 { n gly A 127 1ntvA_128Y_139}P -9.7173 -0.8657 -1.6647 { ca gly A 127 1ntvA_128Y_139}P -9.7417 -0.0941 -2.8892 {"}P -9.7417 -0.0941 -2.8892 { n tyr A 128 1ntvA_128Y_139}P -8.7382 -0.1058 -5.0745 { ca tyr A 128 1ntvA_128Y_139}P -7.7929 -0.5352 -6.0872 { n val A 129 1ntvA_128Y_139}P -6.2428 0.5914 -7.5357 { ca val A 129 1ntvA_128Y_139}P -5.7912 1.6323 -8.4429 { n cys A 130 1ntvA_128Y_139}P -6.5291 1.9117 -10.7335 { ca cys A 130 1ntvA_128Y_139}P -6.7468 1.4961 -12.1103 { n arg A 137 1ntvA_128Y_139}P -6.4274 6.1641 -10.9996 { ca arg A 137 1ntvA_128Y_139}P -7.526 6.4935 -10.1019 { n phe A 138 1ntvA_128Y_139}P -7.9835 5.8184 -7.8218 { ca phe A 138 1ntvA_128Y_139}P -8.1779 4.8775 -6.7227 { n val A 139 1ntvA_128Y_139}P -10.2109 3.56 -6.5998 { ca val A 139 1ntvA_128Y_139}P -11.6308 3.2754 -6.3992 { n ala A 140 1ntvA_128Y_139}P -12.5729 3.3109 -4.1508 { ca ala A 140 1ntvA_128Y_139}P -12.7797 2.8573 -2.7715 { n ile A 141 1ntvA_128Y_139}P -14.1328 1.033 -1.9573 { ca ile A 141 1ntvA_128Y_139}P -15.3386 0.2436 -1.7437 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 126 1ntvA_128Y_139}P -10.6757 -1.7841 0.3486 {"}-10.6757 -1.7841 0.3486 { ca gly A 127 1ntvA_128Y_139}-9.7417 -0.0941 -2.8892 { ca tyr A 128 1ntvA_128Y_139}-7.7929 -0.5352 -6.0872 { ca val A 129 1ntvA_128Y_139}-5.7912 1.6323 -8.4429 { ca cys A 130 1ntvA_128Y_139}-6.7468 1.4961 -12.1103 { ca arg A 137 1ntvA_128Y_139}P -7.526 6.4935 -10.1019 {"}-7.526 6.4935 -10.1019 { ca phe A 138 1ntvA_128Y_139}-8.1779 4.8775 -6.7227 { ca val A 139 1ntvA_128Y_139}-11.6308 3.2754 -6.3992 { ca ala A 140 1ntvA_128Y_139}-12.7797 2.8573 -2.7715 { ca ile A 141 1ntvA_128Y_139}-15.3386 0.2436 -1.7437 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 128 1ntvA_128Y_139}P -7.7929 -0.5352 -6.0872 { cb tyr A 128 1ntvA_128Y_139}-8.362 -1.6998 -6.9136 { cg tyr A 128 1ntvA_128Y_139}-9.645 -1.4133 -7.6628 { cd1 tyr A 128 1ntvA_128Y_139}-9.6253 -0.9516 -8.9819 { ce1 tyr A 128 1ntvA_128Y_139}-10.8178 -0.725 -9.6843 { cz tyr A 128 1ntvA_128Y_139}-12.039 -0.9585 -9.0564 { oh tyr A 128 1ntvA_128Y_139}-13.2233 -0.7568 -9.7214 { cg tyr A 128 1ntvA_128Y_139}P -9.645 -1.4133 -7.6628 { cd2 tyr A 128 1ntvA_128Y_139}-10.8872 -1.6343 -7.0596 { ce2 tyr A 128 1ntvA_128Y_139}-12.0786 -1.4105 -7.7462 { cz tyr A 128 1ntvA_128Y_139}ghost -12.039 -0.9585 -9.0564 { ca val A 139 1ntvA_128Y_139}P -11.6308 3.2754 -6.3992 { cb val A 139 1ntvA_128Y_139}-12.1306 2.2753 -7.4607 { cg1 val A 139 1ntvA_128Y_139}-13.6036 1.9623 -7.2391 { cb val A 139 1ntvA_128Y_139}P -12.1306 2.2753 -7.4607 { cg2 val A 139 1ntvA_128Y_139}-11.9112 2.8449 -8.8562 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 128 1ntvA_128Y_139}P -8.362 -1.6998 -6.9136 {"}P -8.362 -1.6998 -6.9136 { cd1 tyr A 128 1ntvA_128Y_139}P -9.6253 -0.9516 -8.9819 { cd2 tyr A 128 1ntvA_128Y_139}P -10.8872 -1.6343 -7.0596 { ce1 tyr A 128 1ntvA_128Y_139}P -10.8178 -0.725 -9.6843 { ce2 tyr A 128 1ntvA_128Y_139}P -12.0786 -1.4105 -7.7462 { oh tyr A 128 1ntvA_128Y_139}P -13.2233 -0.7568 -9.7214 { cb val A 139 1ntvA_128Y_139}P -12.1306 2.2753 -7.4607 { cg1 val A 139 1ntvA_128Y_139}P -13.6036 1.9623 -7.2391 {"}P -13.6036 1.9623 -7.2391 {"}P -13.6036 1.9623 -7.2391 { cg2 val A 139 1ntvA_128Y_139}P -11.9112 2.8449 -8.8562 {"}P -11.9112 2.8449 -8.8562 {"}P -11.9112 2.8449 -8.8562 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 128 A}'S' blue -10.6066 0.0402 -7.5009 { CD1 TYR 128 A}'S' blue -10.543 0.2544 -8.1072 { CD2 TYR 128 A}'S' sky -11.4241 0.0037 -6.7593 {"}'S' sky -11.1416 0.0789 -6.8055 {"}'S' blue -10.7978 0.0905 -6.7792 {"}'S' sky -10.9544 0.1135 -6.9865 {"}'S' sky -10.7755 0.1079 -7.1833 {"}'S' blue -10.7287 0.0417 -7.5383 {"}'S' blue -10.8919 -0.0189 -7.7321 { CE1 TYR 128 A}'S' blue -10.8697 0.1989 -8.1992 {"}'S' sky -10.9415 0.3989 -8.3481 {"}'S' sky -11.0404 0.5646 -8.5228 {"}'S' blue -11.1626 0.6909 -8.7153 {"}'S' blue -11.3025 0.7719 -8.9181 {"}'S' blue -11.4555 0.8061 -9.1265 {"}'S' sky -11.6166 0.7911 -9.3296 {"}'S' sky -11.7794 0.7285 -9.5224 {"}'S' blue -10.7003 0.4744 -8.415 {"}'S' blue -10.7979 0.6383 -8.5876 {"}'S' blue -11.0509 0.8575 -8.9749 {"}'S' sky -11.1988 0.9074 -9.1798 {"}'S' sky -11.3547 0.9129 -9.3839 {"}'S' sky -11.5151 0.8767 -9.5812 {"}'S' sky -11.6758 0.7983 -9.7659 {"}'S' blue -11.8309 0.6797 -9.9337 {"}'S' blue -10.9202 0.961 -9.2266 {"}'S' blue -11.0721 0.9882 -9.4302 {"}'S' blue -11.2298 0.9751 -9.6307 {"}'S' sky -11.3906 0.9225 -9.8231 {"}'S' blue -11.5479 0.8328 -10.0022 { CE2 TYR 128 A}'S' blue -12.7964 -0.0403 -6.9279 {"}'S' sky -12.9507 -0.0226 -7.1326 {"}'S' sky -13.112 -0.0604 -7.3307 {"}'S' blue -13.2705 -0.1511 -7.5113 {"}'S' blue -12.5633 0.0864 -6.9801 {"}'S' sky -12.7163 0.1206 -7.1884 {"}'S' sky -13.0402 0.043 -7.5843 {"}'S' blue -13.1988 -0.0661 -7.7591 {"}'S' blue -13.3481 -0.2176 -7.9098 {"}'S' sky -12.3117 0.1721 -7.0368 {"}'S' sky -12.4596 0.2219 -7.2418 {"}'S' sky -12.6155 0.2274 -7.4458 {"}'S' sky -12.9366 0.1128 -7.8278 {"}'S' sky -13.0917 -0.0058 -7.9956 {"}'S' sky -12.4906 0.2896 -7.6926 {"}'S' sky -12.6514 0.237 -7.885 { CZ TYR 128 A}'S' blue -13.3994 -0.2073 -8.2523 {"}'S' sky -13.1016 0.0467 -8.0963 {"}'S' sky -13.2645 0.039 -8.3036 {"}'S' sky -13.4279 -0.0573 -8.4877 {"}'S' sky -12.8139 0.181 -7.978 {"}'S' sky -12.6146 0.3413 -8.0362 {"}'S' sky -12.7568 0.4117 -8.2381 {"}'S' sky -12.6768 0.5726 -8.4986 {"}'S' sky -12.8378 0.5576 -8.7017 {"}'S' sky -13.0006 0.495 -8.8945 {"}'S' blue -12.5759 0.6795 -8.7561 {"}'S' sky -12.2934 0.7547 -8.8023 {"}'S' blue -12.451 0.7416 -9.0028 {"}'S' blue -12.6119 0.689 -9.1953 {"}'S' sky -11.9496 0.7663 -8.776 {"}'S' sky -12.1062 0.7893 -8.9833 {"}'S' sky -12.4317 0.7151 -9.3839 {"}'S' blue -12.5928 0.6214 -9.5657 {"}'S' sky -11.6213 0.7163 -8.7653 {"}'S' sky -11.7704 0.7693 -8.9726 {"}'S' sky -11.9273 0.7837 -9.1801 {"}'S' sky -12.2531 0.6988 -9.5769 {"}'S' blue -12.4139 0.6003 -9.7572 {"}'S' sky -11.7188 0.7405 -9.3313 {"}'S' sky -11.8805 0.7175 -9.5351 {"}'S' sky -12.0437 0.6568 -9.7289 {"}'S' blue -12.2049 0.5603 -9.9101 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 128 A}'S' sea -11.2992 0.0658 -7.006 {"}'S' sea -11.116 0.0961 -7.1914 {"}'S' sea -10.9377 0.0844 -7.3859 { CE2 TYR 128 A}'S' sea -12.8774 0.1056 -7.3915 {"}'S' sea -12.7759 0.1912 -7.6431 {"}'S' sea -11.9107 0.1067 -6.8907 {"}'S' green -12.0386 0.2097 -7.0856 {"}'S' green -12.181 0.2755 -7.2885 {"}'S' green -12.333 0.3027 -7.4921 {"}'S' sea -11.5893 0.0214 -6.8661 {"}'S' green -11.708 0.1551 -7.0571 {"}'S' green -12.1458 0.3373 -7.6731 {"}'S' sea -12.3074 0.3198 -7.878 {"}'S' sea -11.4007 0.0487 -7.0587 {"}'S' green -11.523 0.1733 -7.2526 {"}'S' green -11.9669 0.3317 -7.8699 {"}'S' green -11.315 0.1265 -7.4037 {"}'S' green -11.2398 0.1252 -7.7347 { CZ TYR 128 A}'S' sea -12.9567 0.2475 -8.1816 {"}'S' sea -13.1144 0.2474 -8.3852 {"}'S' sea -13.2752 0.1832 -8.5749 {"}'S' sea -12.9111 0.4294 -8.4428 {"}'S' sea -13.0724 0.3916 -8.6409 {"}'S' sea -12.2616 0.3311 -7.8949 {"}'S' sea -12.3839 0.4574 -8.0874 {"}'S' sea -12.5238 0.5384 -8.2903 {"}'S' green -12.0192 0.4048 -7.9597 {"}'S' green -12.1367 0.5339 -8.1481 {"}'S' green -12.2721 0.6241 -8.347 {"}'S' sea -12.42 0.6739 -8.552 {"}'S' green -11.8711 0.5587 -8.2009 {"}'S' green -11.999 0.6617 -8.3958 {"}'S' sea -12.1415 0.7275 -8.5987 {"}'S' green -11.4497 0.307 -8.0015 {"}'S' green -11.5498 0.4734 -8.1763 {"}'S' green -11.6684 0.6071 -8.3673 {"}'S' sea -11.8028 0.7055 -8.5683 {"}'S' sea -12.2678 0.7718 -9.1882 {"}'S' sea -11.17 0.1586 -8.028 {"}'S' sea -11.2561 0.3443 -8.1897 {"}'S' sea -11.3611 0.5007 -8.3689 {"}'S' sea -11.4834 0.6253 -8.5629 {"}'S' sea -12.0894 0.7602 -9.3827 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 128 A}'S' P -11.8424 0.2535 -7.2581 {"}'S' -11.8448 0.2338 -7.2637 {"}'S' P -11.9892 0.3143 -7.4658 {"}'S' -11.9914 0.2884 -7.4697 {"}'S' P -11.6609 0.2643 -7.4551 {"}'S' -11.6706 0.2229 -7.4623 {"}'S' P -11.81 0.3173 -7.6624 {"}'S' -11.8154 0.2797 -7.6646 {"}'S' P -11.4521 0.2174 -7.6067 {"}'S' -11.4548 0.2103 -7.6071 {"}'S' P -11.6007 0.2712 -7.8136 {"}'S' -11.6025 0.267 -7.8134 { CZ TYR 128 A}'S' P -11.7584 0.4209 -8.0171 {"}'S' -11.7605 0.411 -8.0246 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 128 A}'S' blue -13.9991 -0.1429 -8.7311 {"}'S' sky -13.7499 -0.0727 -8.6185 {"}'S' sky -13.9895 0.162 -8.9944 {"}'S' sky -13.4772 -0.0791 -8.5228 {"}'S' blue -13.9604 0.3428 -9.2643 {"}'S' blue -13.7172 0.4862 -9.3063 {"}'S' sky -13.1934 0.4299 -8.9791 {"}'S' sky -13.3232 0.5272 -9.1735 {"}'S' blue -12.7712 0.5686 -9.7205 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 128 A}'S' sea -13.8516 0.0827 -8.7947 {"}'S' sea -13.5543 0.1132 -8.6755 {"}'S' sea -13.6652 0.2538 -8.8592 {"}'S' sea -13.8043 0.3321 -9.0604 {"}'S' sea -13.3177 0.212 -8.7148 {"}'S' sea -13.4294 0.3568 -8.8987 {"}'S' sea -13.5643 0.4503 -9.0994 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 139 A}'S' sky -12.4457 0.5774 -7.1791 {"}'S' sky -12.5528 0.6029 -7.7585 {"}'S' sky -12.6686 0.9175 -8.4244 {"}'S' blue -12.5072 1.0704 -8.6728 {"}'S' sky -11.9637 1.0686 -8.7172 {"}'S' sky -11.6146 1.0268 -8.5723 { CG1 VAL 139 A}'S' blue -13.2875 0.2579 -7.0024 {"}'S' blue -13.3538 0.2501 -7.4998 {"}'S' sky -13.1962 0.2619 -7.299 {"}'S' sky -13.0359 0.3123 -7.1067 {"}'S' blue -12.8778 0.4008 -6.9262 {"}'S' sky -13.1408 0.3214 -7.635 {"}'S' sky -12.8203 0.3972 -7.2416 {"}'S' blue -12.6624 0.4971 -7.0656 {"}'S' sky -13.0484 0.4437 -7.9074 {"}'S' sky -12.8906 0.432 -7.701 {"}'S' sky -12.7284 0.47 -7.5017 {"}'S' sky -12.5671 0.5551 -7.316 {"}'S' sky -12.9549 0.6179 -8.1526 {"}'S' sky -12.8046 0.5758 -7.9479 {"}'S' sky -12.6462 0.5878 -7.746 {"}'S' sky -12.8328 0.826 -8.3238 { CG2 VAL 139 A}'S' sky -12.1848 1.1187 -8.9472 {"}'S' sky -11.9183 1.1031 -9.0271 {"}'S' sky -11.7589 1.1025 -8.8193 {"}'S' blue -11.6615 1.1327 -9.1169 {"}'S' blue -11.5038 1.1445 -8.9161 {"}'S' blue -11.3435 1.1949 -8.7238 {"}'S' sky -11.448 1.2048 -9.2516 {"}'S' blue -11.2894 1.2209 -9.0505 {"}'S' blue -11.1279 1.2798 -8.8587 {"}'S' blue -11.356 1.3263 -9.5245 {"}'S' blue -11.1982 1.3146 -9.3181 {"}'S' blue -11.0361 1.3526 -9.1188 {"}'S' blue -11.1123 1.4585 -9.565 { HB VAL 139 A}'S' sky -12.4048 0.5325 -7.3916 {"}'S' sky -11.2901 0.3821 -6.7513 {"}'S' sky -11.0333 0.4249 -6.863 {"}'S' sky -10.871 0.4429 -7.0673 {"}'S' sky -10.9218 0.3664 -7.4799 {"}'S' blue -10.7646 0.4848 -7.3091 {"}'S' blue -11.0516 0.9808 -8.3562 {"}'S' blue -10.9838 0.7723 -8.2108 {"}'S' blue -10.8504 0.6696 -8.0102 {HG11 VAL 139 A}'S' blue -13.5699 0.1966 -7.6564 {"}'S' sky -14.102 0.4218 -8.8179 {"}'S' sky -13.9994 0.269 -8.6428 {"}'S' sky -13.871 0.1682 -8.4477 {"}'S' blue -13.7237 0.1252 -8.2451 {"}'S' blue -13.5656 0.143 -8.0466 {"}'S' blue -13.4078 0.219 -7.8638 {"}'S' blue -13.9303 0.7117 -9.0441 {"}'S' sky -13.4715 0.225 -8.3145 {"}'S' sky -13.3083 0.274 -8.1179 {"}'S' sky -13.151 0.3924 -7.9471 {"}'S' blue -13.6827 0.821 -9.0605 {"}'S' sky -13.3702 0.6798 -8.8489 {"}'S' sky -13.1118 0.8026 -8.6929 {"}'S' blue -12.9514 0.9003 -8.5131 {HG21 VAL 139 A}'S' blue -12.6181 1.0442 -9.3241 {"}'S' sky -12.4587 1.0747 -9.1269 {"}'S' blue -12.6156 1.0159 -9.7449 {"}'S' sky -12.4683 0.9742 -9.5426 {"}'S' sky -12.1541 1.0507 -9.158 {"}'S' blue -12.3643 0.9824 -9.8416 {"}'S' sky -12.2119 0.9575 -9.6378 {"}'S' sky -11.8946 1.0737 -9.2596 {"}'S' blue -12.0484 1.0023 -9.8483 {"}'S' sky -11.8902 1.02 -9.6499 {"}'S' sky -11.7325 1.0961 -9.467 {"}'S' sky -11.7962 1.1021 -9.9177 {"}'S' sky -11.6329 1.151 -9.7211 {"}'S' blue -11.4757 1.2694 -9.5504 {"}'S' blue -11.5563 1.2698 -9.9613 {"}'S' blue -11.4001 1.3652 -9.7868 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 139 A}'S' sea -12.4042 0.5491 -7.5516 {"}'S' sea -12.5588 0.7684 -8.2402 {"}'S' sea -12.432 0.6528 -8.044 {"}'S' sea -12.4144 0.9006 -8.5054 {"}'S' green -12.3026 0.7613 -8.3225 {"}'S' green -12.1742 0.6577 -8.1269 {"}'S' sea -12.1989 0.9842 -8.64 {"}'S' green -12.0894 0.8381 -8.4588 {"}'S' sea -11.853 0.9208 -8.5339 { CG1 VAL 139 A}'S' sea -12.9817 0.3383 -7.4334 { HB VAL 139 A}'S' sea -12.276 0.4308 -7.1975 {"}'S' sea -12.1288 0.3878 -6.9949 {"}'S' sea -12.3116 0.4985 -7.6717 {"}'S' green -12.1963 0.3669 -7.4857 {"}'S' green -12.0589 0.2854 -7.2862 {"}'S' green -11.907 0.2596 -7.0829 {"}'S' sea -11.7476 0.2901 -6.8857 {"}'S' green -12.144 0.4663 -7.8778 {"}'S' green -11.6017 0.2016 -7.1035 {"}'S' sea -11.443 0.2661 -6.9168 {"}'S' green -11.9936 0.5871 -8.1493 {"}'S' green -11.3414 0.2033 -7.1993 {"}'S' sea -11.1834 0.2891 -7.0184 {"}'S' green -11.7867 0.7106 -8.3252 {"}'S' green -11.4846 0.2607 -7.8096 {"}'S' green -11.3373 0.2177 -7.6071 {"}'S' sea -11.1796 0.2346 -7.409 {"}'S' sea -11.0214 0.3115 -7.2258 {"}'S' sea -11.5439 0.8042 -8.4061 {"}'S' green -11.4794 0.5953 -8.2635 {"}'S' green -11.3757 0.4366 -8.0855 {"}'S' sea -11.2409 0.3417 -7.8847 {"}'S' sea -11.0851 0.3175 -7.6765 {"}'S' sea -11.2412 0.7022 -8.2938 {"}'S' sea -11.1386 0.5494 -8.1187 {HG11 VAL 139 A}'S' sea -13.8659 0.5028 -8.9015 {"}'S' sea -13.7622 0.3441 -8.7236 {"}'S' sea -13.6273 0.2493 -8.5227 {"}'S' sea -13.6277 0.6097 -8.9318 {"}'S' sea -13.5251 0.457 -8.7568 {"}'S' sea -13.3879 0.3819 -8.5573 {"}'S' sea -13.2316 0.3927 -8.3581 {"}'S' sea -13.0755 0.4881 -8.1835 {"}'S' sea -13.2368 0.5771 -8.6482 {"}'S' sea -13.0732 0.6057 -8.4449 {HG21 VAL 139 A}'S' sea -12.3128 0.9862 -9.3448 {"}'S' sea -12.0525 0.9879 -9.4406 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 139 A}'S' P -12.0352 0.3256 -7.6987 {"}'S' -12.033 0.331 -7.6969 {"}'S' P -11.9045 0.2313 -7.5037 {"}'S' -11.8929 0.2701 -7.4984 {"}'S' P -11.7572 0.1896 -7.3014 {"}'S' -11.7526 0.2186 -7.3034 {"}'S' P -11.9059 0.411 -7.9858 {"}'S' -11.9046 0.4133 -7.9845 {"}'S' P -11.7898 0.2792 -7.8004 {"}'S' -11.787 0.2955 -7.7935 {"}'S' P -11.6532 0.1978 -7.6003 {"}'S' -11.6497 0.2373 -7.5925 {"}'S' P -11.5008 0.1729 -7.3966 {"}'S' -11.502 0.1873 -7.3963 {"}'S' P -11.7156 0.5143 -8.1799 {"}'S' -11.7159 0.5169 -8.1774 {"}'S' P -11.613 0.3615 -8.0048 {"}'S' -11.6128 0.3649 -8.0019 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 128 A}'M' greentint -9.2614 2.0358 -6.3143 {"}'M' greentint -9.4203 1.9471 -6.4959 {"}'M' greentint -9.5639 1.8393 -6.7684 {"}'M' greentint -9.1583 2.2683 -6.3633 {"}'M' greentint -9.3216 2.2349 -6.5651 {"}'M' greentint -9.4702 2.078 -6.7136 {"}'M' greentint -9.5739 1.9817 -7.0111 {"}'M' greentint -9.0144 2.4735 -6.4253 {"}'M' greentint -9.1724 2.4651 -6.6273 {"}'M' greentint -9.331 2.3719 -6.8057 {"}'M' greentint -9.4702 2.204 -6.9389 {"}'M' greentint -9.5435 2.0757 -7.2559 {"}'M' greentint -8.8293 2.6436 -6.4913 {"}'M' greentint -8.9854 2.6542 -6.6952 {"}'M' greentint -9.1456 2.596 -6.8871 {"}'M' greentint -9.3004 2.4729 -7.0518 {"}'M' greentint -9.4361 2.2954 -7.178 {"}'M' greentint -9.4656 2.1559 -7.4942 {"}'M' greentint -8.7422 2.7976 -6.7372 {"}'M' greentint -8.9026 2.7742 -6.9393 {"}'M' greentint -9.0647 2.692 -7.1249 {"}'M' greentint -9.217 2.5561 -7.2849 {"}'M' greentint -9.3536 2.3745 -7.4097 {"}'M' greentint -8.8078 2.837 -7.1982 {"}'M' greentint -8.9636 2.7383 -7.3716 {"}'M' greentint -9.1098 2.5947 -7.5214 {"}'M' greentint -9.2406 2.4127 -7.6399 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 139 A}'M' greentint -9.5204 1.7648 -6.7979 {"}'M' greentint -9.3622 1.8285 -6.6116 {"}'M' greentint -9.212 1.953 -6.4518 {"}'M' greentint -9.0789 2.1286 -6.3287 {"}'M' greentint -9.4698 1.8238 -7.1489 {"}'M' greentint -9.3116 1.826 -6.9452 {"}'M' greentint -9.151 1.902 -6.7583 {"}'M' greentint -9.0014 2.0474 -6.6059 {"}'M' greentint -8.8769 2.2473 -6.5001 {"}'M' greentint -8.7883 2.4849 -6.4521 {"}'M' greentint -9.3667 1.9865 -7.404 {"}'M' greentint -9.2179 1.9369 -7.1979 {"}'M' greentint -9.0556 1.9818 -6.9999 {"}'M' greentint -8.9014 2.1144 -6.8382 {"}'M' greentint -8.7772 2.3177 -6.7336 {"}'M' greentint -8.6989 2.5634 -6.7015 {"}'M' greentint -8.6779 2.8188 -6.7448 {"}'M' greentint -9.2387 2.2221 -7.5665 {"}'M' greentint -9.107 2.1203 -7.3683 {"}'M' greentint -8.946 2.1484 -7.1683 {"}'M' greentint -8.7979 2.3004 -7.0195 {"}'M' greentint -8.7031 2.5345 -6.9621 {"}'M' greentint -8.6868 2.7882 -7.0115 {"}'M' greentint -9.0777 2.4934 -7.5997 {"}'M' greentint -8.9735 2.3382 -7.4218 {"}'M' greentint -8.8135 2.4351 -7.2424 {"}'M' greentint -8.7585 2.6884 -7.2422 {"}'M' greentint -8.8918 2.5848 -7.4417 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 128 A}'M' green -10.1877 0.5116 -4.7905 {"}'M' green -9.9727 0.8618 -4.6108 {"}'M' green -10.3636 0.567 -5.1991 {"}'M' green -9.8117 1.1331 -4.644 {"}'M' green -10.3694 0.6635 -5.4974 {"}'M' green -9.755 1.4047 -4.9088 {"}'M' green -10.2222 0.9924 -5.742 {"}'M' green -9.8195 1.5002 -5.3622 {"}'M' green -9.9761 1.3882 -5.5336 {"}'M' green -10.1147 1.2135 -5.6643 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 128 A}'M' greentint -10.1586 0.7704 -4.7688 {"}'M' greentint -10.2919 0.6668 -4.9683 {"}'M' greentint -10.0769 1.017 -4.7887 {"}'M' greentint -10.2369 0.9201 -4.9681 {"}'M' greentint -10.3473 0.8207 -5.2484 {"}'M' greentint -9.9434 1.2348 -4.8422 {"}'M' greentint -10.1044 1.2068 -5.0422 {"}'M' greentint -10.2525 1.0548 -5.191 {"}'M' greentint -10.319 0.9181 -5.502 {"}'M' greentint -9.9139 1.4079 -5.1148 {"}'M' greentint -10.0742 1.3168 -5.2976 {"}'M' greentint -10.2156 1.1463 -5.4332 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 139 A}'M' sea -10.302 0.5419 -4.6666 {"}'M' green -10.3889 0.5338 -5.0928 {"}'M' green -9.8669 1.2059 -4.6062 {"}'M' green -10.4294 0.6933 -5.4478 {"}'M' green -9.8178 1.444 -4.8668 {"}'M' green -9.8706 1.5769 -5.1624 {"}'M' green -9.9685 1.4796 -5.38 {"}'M' green -10.1088 1.3789 -5.5728 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 139 A}'M' greentint -10.2292 0.6224 -4.9118 {"}'M' greentint -10.0825 0.772 -4.7642 {"}'M' greentint -9.9587 0.9717 -4.6595 {"}'M' greentint -10.2706 0.7043 -5.2469 {"}'M' greentint -10.1136 0.8002 -5.0695 {"}'M' greentint -9.9751 0.9707 -4.938 {"}'M' greentint -9.8722 1.1942 -4.8672 {"}'M' greentint -10.2951 0.9011 -5.5236 {"}'M' greentint -10.132 0.9304 -5.3209 {"}'M' greentint -9.9822 1.0841 -5.1701 {"}'M' greentint -9.8869 1.3204 -5.1126 {"}'M' greentint -10.1825 1.131 -5.5588 {"}'M' greentint -10.0238 1.2283 -5.3811 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 71 1nxmA_129F_73R}P -8.2929 5.2684 -12.7091 {"}-8.2929 5.2684 -12.7091 { ca val A 71 1nxmA_129F_73R}-9.4418 5.2232 -11.8084 { c val A 71 1nxmA_129F_73R}-8.9614 4.6777 -10.4753 { o val A 71 1nxmA_129F_73R}-8.2433 3.6666 -10.4131 { c val A 71 1nxmA_129F_73R}P -8.9614 4.6777 -10.4753 { n leu A 72 1nxmA_129F_73R}-9.3695 5.3486 -9.4056 { ca leu A 72 1nxmA_129F_73R}-8.956 4.9897 -8.0664 { c leu A 72 1nxmA_129F_73R}-10.228 4.9987 -7.2335 { o leu A 72 1nxmA_129F_73R}-10.8968 6.0316 -7.1154 { c leu A 72 1nxmA_129F_73R}P -10.228 4.9987 -7.2335 { c aarg A 73 1nxmA_129F_73R}P -11.3493 3.2024 -4.4923 {"}P -11.3493 3.2024 -4.4923 {"}P -11.3493 3.2024 -4.4923 { n gly A 74 1nxmA_129F_73R}-12.0328 3.7383 -3.4777 { ca gly A 74 1nxmA_129F_73R}-11.8208 3.2998 -2.1189 { c gly A 74 1nxmA_129F_73R}-11.6908 4.4683 -1.1639 { o gly A 74 1nxmA_129F_73R}-11.8508 5.6129 -1.5772 { c barg A 73 1nxmA_129F_73R}P -11.4638 3.1286 -4.5157 { n gly A 74 1nxmA_129F_73R}-12.0328 3.7383 -3.4777 { c gly A 74 1nxmA_129F_73R}P -11.6908 4.4683 -1.1639 { n leu A 75 1nxmA_129F_73R}-11.4031 4.2295 0.1058 { ca leu A 75 1nxmA_129F_73R}-11.2019 2.9116 0.7022 { c leu A 75 1nxmA_129F_73R}-12.4442 2.5836 1.5124 { o leu A 75 1nxmA_129F_73R}-12.8187 3.3296 2.4059 { n asn A 127 1nxmA_129F_73R}P -11.2485 -1.7257 1.4475 {"}-11.2485 -1.7257 1.4475 { ca asn A 127 1nxmA_129F_73R}-10.7805 -2.176 0.1478 { c asn A 127 1nxmA_129F_73R}-10.748 -1.0277 -0.8423 { o asn A 127 1nxmA_129F_73R}-11.6381 -0.1586 -0.8594 { c asn A 127 1nxmA_129F_73R}P -10.748 -1.0277 -0.8423 { n gly A 128 1nxmA_129F_73R}-9.7533 -1.0334 -1.7115 { ca gly A 128 1nxmA_129F_73R}-9.6539 -0.0755 -2.7923 { c gly A 128 1nxmA_129F_73R}-8.7005 -0.5539 -3.8612 { o gly A 128 1nxmA_129F_73R}-8.0318 -1.5785 -3.7181 { c gly A 128 1nxmA_129F_73R}P -8.7005 -0.5539 -3.8612 { n phe A 129 1nxmA_129F_73R}-8.6294 0.1973 -4.9506 { ca phe A 129 1nxmA_129F_73R}-7.7347 -0.1162 -6.04 { c phe A 129 1nxmA_129F_73R}-7.5134 1.0921 -6.9157 { o phe A 129 1nxmA_129F_73R}-8.3319 2.0091 -6.9809 { c phe A 129 1nxmA_129F_73R}P -7.5134 1.0921 -6.9157 { n gln A 130 1nxmA_129F_73R}-6.3668 1.0911 -7.5885 { ca gln A 130 1nxmA_129F_73R}-6.1223 1.9979 -8.7002 { c gln A 130 1nxmA_129F_73R}-5.8165 1.1791 -9.9478 { o gln A 130 1nxmA_129F_73R}-5.0027 0.2651 -9.9136 { c gln A 130 1nxmA_129F_73R}P -5.8165 1.1791 -9.9478 { n val A 131 1nxmA_129F_73R}-6.4586 1.5183 -11.0601 { ca val A 131 1nxmA_129F_73R}-6.3033 0.7525 -12.2981 { c val A 131 1nxmA_129F_73R}-4.9662 1.0799 -12.9292 { o val A 131 1nxmA_129F_73R}-4.663 2.2508 -13.1631 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 71 1nxmA_129F_73R}P -8.2929 5.2684 -12.7091 { ca val A 71 1nxmA_129F_73R}P -9.4418 5.2232 -11.8084 { n leu A 72 1nxmA_129F_73R}P -9.3695 5.3486 -9.4056 { ca leu A 72 1nxmA_129F_73R}P -8.956 4.9897 -8.0664 { n gly A 74 1nxmA_129F_73R}P -12.0328 3.7383 -3.4777 { ca gly A 74 1nxmA_129F_73R}P -11.8208 3.2998 -2.1189 {"}P -11.8208 3.2998 -2.1189 { n leu A 75 1nxmA_129F_73R}P -11.4031 4.2295 0.1058 { ca leu A 75 1nxmA_129F_73R}P -11.2019 2.9116 0.7022 { n asn A 127 1nxmA_129F_73R}P -11.2485 -1.7257 1.4475 { ca asn A 127 1nxmA_129F_73R}P -10.7805 -2.176 0.1478 { n gly A 128 1nxmA_129F_73R}P -9.7533 -1.0334 -1.7115 { ca gly A 128 1nxmA_129F_73R}P -9.6539 -0.0755 -2.7923 {"}P -9.6539 -0.0755 -2.7923 { n phe A 129 1nxmA_129F_73R}P -8.6294 0.1973 -4.9506 { ca phe A 129 1nxmA_129F_73R}P -7.7347 -0.1162 -6.04 { n gln A 130 1nxmA_129F_73R}P -6.3668 1.0911 -7.5885 { ca gln A 130 1nxmA_129F_73R}P -6.1223 1.9979 -8.7002 { n val A 131 1nxmA_129F_73R}P -6.4586 1.5183 -11.0601 { ca val A 131 1nxmA_129F_73R}P -6.3033 0.7525 -12.2981 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 71 1nxmA_129F_73R}P -9.4418 5.2232 -11.8084 {"}-9.4418 5.2232 -11.8084 { ca leu A 72 1nxmA_129F_73R}-8.956 4.9897 -8.0664 {"}P -8.956 4.9897 -8.0664 { ca gly A 74 1nxmA_129F_73R}P -11.8208 3.2998 -2.1189 {"}P -11.8208 3.2998 -2.1189 { ca leu A 75 1nxmA_129F_73R}-11.2019 2.9116 0.7022 { ca asn A 127 1nxmA_129F_73R}P -10.7805 -2.176 0.1478 {"}-10.7805 -2.176 0.1478 { ca gly A 128 1nxmA_129F_73R}-9.6539 -0.0755 -2.7923 { ca phe A 129 1nxmA_129F_73R}-7.7347 -0.1162 -6.04 { ca gln A 130 1nxmA_129F_73R}-6.1223 1.9979 -8.7002 { ca val A 131 1nxmA_129F_73R}-6.3033 0.7525 -12.2981 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 129 1nxmA_129F_73R}P -7.7347 -0.1162 -6.04 { cb phe A 129 1nxmA_129F_73R}-8.2698 -1.2662 -6.8866 { cg phe A 129 1nxmA_129F_73R}-9.5548 -0.9909 -7.5966 { cd1 phe A 129 1nxmA_129F_73R}-9.5578 -0.4805 -8.8861 { ce1 phe A 129 1nxmA_129F_73R}-10.753 -0.2706 -9.5781 { cz phe A 129 1nxmA_129F_73R}-11.9529 -0.5743 -8.9718 { cg phe A 129 1nxmA_129F_73R}P -9.5548 -0.9909 -7.5966 { cd2 phe A 129 1nxmA_129F_73R}-10.7841 -1.319 -7.0248 { ce2 phe A 129 1nxmA_129F_73R}-11.9705 -1.0975 -7.7076 { cz phe A 129 1nxmA_129F_73R}ghost -11.9529 -0.5743 -8.9718 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 129 1nxmA_129F_73R}P -8.2698 -1.2662 -6.8866 {"}P -8.2698 -1.2662 -6.8866 { cd1 phe A 129 1nxmA_129F_73R}P -9.5578 -0.4805 -8.8861 { cd2 phe A 129 1nxmA_129F_73R}P -10.7841 -1.319 -7.0248 { ce1 phe A 129 1nxmA_129F_73R}P -10.753 -0.2706 -9.5781 { ce2 phe A 129 1nxmA_129F_73R}P -11.9705 -1.0975 -7.7076 { cz phe A 129 1nxmA_129F_73R}P -11.9529 -0.5743 -8.9718 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 129 A}'S' blue -11.6562 0.0689 -6.4112 {"}'S' sky -11.4218 0.2121 -6.4671 {"}'S' blue -11.1651 0.3134 -6.5204 {"}'S' sky -11.321 0.319 -6.7245 {"}'S' blue -11.0385 0.3942 -6.7707 {"}'S' blue -11.1961 0.3811 -6.9712 { CE2 PHE 129 A}'S' sky -12.4245 0.0803 -6.4951 {"}'S' sky -12.5461 0.2023 -6.6873 {"}'S' sky -12.6884 0.2727 -6.8893 {"}'S' blue -12.0943 0.0264 -6.3714 {"}'S' sky -11.853 0.1019 -6.4383 {"}'S' sky -12.5075 0.5404 -7.4072 {"}'S' blue -12.3826 0.6026 -7.654 {"}'S' sky -11.4813 0.3344 -6.8275 {"}'S' sky -12.0378 0.6503 -7.6345 {"}'S' sky -11.4149 0.4863 -7.214 {"}'S' sky -11.5529 0.5773 -7.4165 { CZ PHE 129 A}'S' blue -13.0155 0.431 -8.0117 {"}'S' sky -13.1785 0.4232 -8.219 {"}'S' sky -13.3418 0.3269 -8.4031 {"}'S' sky -13.3423 0.4402 -8.6536 {"}'S' sky -12.5285 0.7255 -7.9515 {"}'S' sky -13.2955 0.5457 -8.8922 {"}'S' blue -12.1756 0.7154 -7.8103 {"}'S' sky -12.2978 0.8417 -8.0028 {"}'S' blue -13.2225 0.6186 -9.1354 {"}'S' blue -11.9331 0.789 -7.8751 {"}'S' sky -12.0506 0.9181 -8.0635 {"}'S' sky -12.9661 0.8304 -9.2212 {"}'S' sky -11.913 1.0459 -8.3112 {"}'S' sky -12.365 1.1258 -8.9182 {"}'S' sky -12.5258 1.0732 -9.1106 {"}'S' blue -11.8635 1.1505 -8.6914 {"}'S' blue -12.0202 1.1735 -8.8987 {"}'S' blue -12.1817 1.156 -9.1036 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 129 A}'S' sea -12.1932 0.1921 -6.5461 {"}'S' green -12.3154 0.3184 -6.7386 {"}'S' green -12.4553 0.3994 -6.9414 {"}'S' sea -12.6083 0.4336 -7.1498 {"}'S' green -11.9507 0.2658 -6.6109 {"}'S' green -12.0683 0.3949 -6.7993 {"}'S' green -12.2037 0.4851 -6.9981 {"}'S' green -12.3516 0.5349 -7.2031 {"}'S' sea -11.6899 0.2819 -6.6683 {"}'S' green -11.8026 0.4197 -6.852 {"}'S' green -11.9306 0.5227 -7.047 {"}'S' green -12.073 0.5885 -7.2499 {"}'S' sea -12.2249 0.6157 -7.4535 {"}'S' sea -11.6 0.4681 -7.0185 {"}'S' green -11.7344 0.5665 -7.2195 {"}'S' sea -11.8812 0.6273 -7.4271 { CZ PHE 129 A}'S' sea -12.8706 0.6317 -8.097 {"}'S' sea -13.0283 0.6316 -8.3006 {"}'S' sea -13.1891 0.5674 -8.4902 {"}'S' sea -12.6707 0.7959 -8.1535 {"}'S' green -12.825 0.8136 -8.3581 {"}'S' green -12.9863 0.7758 -8.5563 {"}'S' green -13.1449 0.6851 -8.7369 {"}'S' sea -12.4377 0.9226 -8.2056 {"}'S' green -12.5907 0.9568 -8.414 {"}'S' green -12.7517 0.9418 -8.617 {"}'S' green -12.9145 0.8792 -8.8099 {"}'S' sea -13.0732 0.7702 -8.9847 {"}'S' sea -12.1861 1.0083 -8.2624 {"}'S' green -12.334 1.0581 -8.4673 {"}'S' sea -12.4899 1.0637 -8.6714 {"}'S' sea -12.6503 1.0275 -8.8687 {"}'S' sea -12.811 0.949 -9.0534 {"}'S' sea -12.0554 1.1118 -8.5141 {"}'S' sea -12.2073 1.1389 -8.7177 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG AARG 73 A}'S' sky -12.6845 1.012 -7.9874 {"}'S' sky -12.5241 1.0623 -7.7952 {"}'S' sky -12.3085 1.1473 -7.93 {"}'S' blue -12.8143 1.3579 -9.0008 {"}'S' blue -12.0553 1.3051 -8.0045 {"}'S' blue -12.5759 1.4639 -9.0393 {"}'S' sky -12.4431 1.3679 -8.841 {"}'S' blue -11.9732 1.4043 -8.2446 {"}'S' blue -12.1787 1.5075 -8.8089 {"}'S' blue -12.0215 1.5053 -8.6055 { HB2AARG 73 A}'S' sky -12.6994 0.672 -6.9493 {"}'S' sky -12.3126 0.3953 -6.3729 {"}'S' sky -12.549 0.7928 -7.2208 {"}'S' sky -11.8968 0.409 -6.2709 {"}'S' sky -12.342 0.9163 -7.3967 {"}'S' blue -11.5767 0.5172 -6.2973 {"}'S' blue -12.0992 1.0099 -7.4776 {"}'S' sky -11.4772 0.5721 -6.5514 {"}'S' blue -11.3199 0.6905 -6.3806 {"}'S' sky -11.7966 0.9079 -7.3653 {"}'S' sky -11.4005 0.6909 -6.7915 {"}'S' blue -11.2444 0.7863 -6.617 { HG3AARG 73 A}'S' blue -13.5597 0.6466 -8.3142 {"}'S' sky -13.4003 0.677 -8.117 {"}'S' blue -13.2423 0.7628 -7.936 {"}'S' sky -13.5434 0.7344 -8.7273 {"}'S' sky -12.9298 0.9166 -7.9849 {"}'S' sky -13.4346 0.9103 -9.0032 {"}'S' sky -13.1975 1.0232 -9.0364 {"}'S' blue -13.0426 1.2461 -9.1285 @dotlist {x} color= white width= 1 master= {vdw contact} { CG AARG 73 A}'S' green -12.629 1.0715 -8.3234 {"}'S' sea -12.47 1.0884 -8.1219 {"}'S' sea -12.683 1.2526 -8.8026 {"}'S' green -12.5366 1.1938 -8.5958 {"}'S' green -12.3788 1.1821 -8.3895 {"}'S' sea -12.2167 1.22 -8.1902 {"}'S' sea -12.2929 1.3259 -8.6364 {"}'S' sea -12.1344 1.3378 -8.4345 { HB2AARG 73 A}'S' sea -12.5906 0.5313 -6.7702 {"}'S' sea -12.4599 0.437 -6.5752 {"}'S' green -12.4613 0.6167 -7.0573 {"}'S' green -12.3451 0.4849 -6.8719 {"}'S' green -12.2086 0.4035 -6.6718 {"}'S' sea -12.0562 0.3786 -6.4681 {"}'S' green -12.2709 0.72 -7.2514 {"}'S' green -12.1684 0.5672 -7.0763 {"}'S' green -12.0399 0.4664 -6.8811 {"}'S' green -11.8926 0.4234 -6.6786 {"}'S' sea -11.7345 0.4411 -6.4801 {"}'S' sea -12.0348 0.801 -7.335 {"}'S' green -11.9311 0.6423 -7.157 {"}'S' green -11.7962 0.5474 -6.9562 {"}'S' sea -11.6404 0.5232 -6.748 {"}'S' sea -11.694 0.7551 -7.1902 {"}'S' sea -11.5568 0.6801 -6.9908 { HG3AARG 73 A}'S' sea -13.3962 0.6914 -8.5247 {"}'S' sea -13.238 0.7092 -8.3263 {"}'S' sea -13.0803 0.7852 -8.1434 {"}'S' sea -13.2997 0.8155 -8.8023 {"}'S' green -13.1439 0.7912 -8.5941 {"}'S' green -12.9807 0.8402 -8.3975 {"}'S' sea -12.8235 0.9586 -8.2268 {"}'S' green -13.0603 0.9481 -8.8369 {"}'S' green -12.904 0.9589 -8.6377 {"}'S' green -12.7479 1.0543 -8.4632 {"}'S' sea -12.9092 1.1433 -8.9278 {"}'S' sea -12.7457 1.1719 -8.7245 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 129 A}'M' green -9.1935 3.0492 -7.35 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 129 A}'M' greentint -9.5041 2.4015 -6.3245 {"}'M' greentint -9.6476 2.2938 -6.597 {"}'M' greentint -9.4054 2.6894 -6.3937 {"}'M' greentint -9.554 2.5325 -6.5422 {"}'M' greentint -9.6577 2.4362 -6.8397 {"}'M' greentint -9.7142 2.1867 -6.8429 {"}'M' greentint -9.2561 2.9196 -6.4559 {"}'M' greentint -9.4147 2.8264 -6.6343 {"}'M' greentint -9.5539 2.6584 -6.7675 {"}'M' greentint -9.6273 2.5302 -7.0845 {"}'M' greentint -9.6984 2.2851 -7.1087 {"}'M' greentint -9.2293 3.0504 -6.7157 {"}'M' greentint -9.3841 2.9274 -6.8804 {"}'M' greentint -9.5198 2.7498 -7.0066 {"}'M' greentint -9.5494 2.6104 -7.3227 {"}'M' greentint -9.6306 2.3672 -7.3611 {"}'M' greentint -9.1485 3.1465 -6.9535 {"}'M' greentint -9.3007 3.0105 -7.1135 {"}'M' greentint -9.4373 2.829 -7.2383 {"}'M' greentint -9.4349 2.6551 -7.5524 {"}'M' greentint -9.3243 2.8672 -7.4684 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H AARG 73 A}'M' greentint -9.6043 2.1822 -6.4644 {"}'M' greentint -9.4711 2.3578 -6.3413 {"}'M' greentint -9.3659 2.5725 -6.2635 {"}'M' greentint -9.7039 2.0553 -6.9578 {"}'M' greentint -9.5433 2.1312 -6.7709 {"}'M' greentint -9.3937 2.2766 -6.6185 {"}'M' greentint -9.2692 2.4766 -6.5127 {"}'M' greentint -9.1806 2.7142 -6.4647 {"}'M' greentint -9.1361 2.9689 -6.4774 {"}'M' greentint -9.6102 2.1661 -7.2105 {"}'M' greentint -9.4479 2.211 -7.0125 {"}'M' greentint -9.2937 2.3436 -6.8508 {"}'M' greentint -9.1694 2.547 -6.7462 {"}'M' greentint -9.0911 2.7926 -6.7141 {"}'M' greentint -9.0702 3.0481 -6.7574 {"}'M' greentint -9.4992 2.3496 -7.3809 {"}'M' greentint -9.3382 2.3776 -7.1809 {"}'M' greentint -9.1902 2.5296 -7.0321 {"}'M' greentint -9.0954 2.7637 -6.9747 {"}'M' greentint -9.0791 3.0174 -7.0241 {"}'M' greentint -9.3657 2.5674 -7.4344 {"}'M' greentint -9.2058 2.6643 -7.255 {"}'M' greentint -9.1508 2.9176 -7.2548 {"}'M' greentint -9.2841 2.814 -7.4543 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 129 A}'M' green -9.9879 0.9298 -4.5121 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 129 A}'M' greentint -9.9589 1.1886 -4.4905 {"}'M' greentint -10.0921 1.085 -4.69 {"}'M' greentint -9.773 1.28 -4.3325 {"}'M' greentint -9.8772 1.4352 -4.5103 {"}'M' greentint -10.0372 1.3383 -4.6898 {"}'M' greentint -10.1475 1.2389 -4.97 {"}'M' greentint -10.1638 0.9852 -4.9207 {"}'M' greentint -9.5453 1.346 -4.2226 {"}'M' greentint -9.612 1.5513 -4.3657 {"}'M' greentint -9.7437 1.6531 -4.5639 {"}'M' greentint -9.9047 1.625 -4.7638 {"}'M' greentint -10.0527 1.473 -4.9127 {"}'M' greentint -10.1193 1.3364 -5.2236 {"}'M' greentint -9.3272 1.5535 -4.2607 {"}'M' greentint -9.4204 1.7281 -4.4296 {"}'M' greentint -9.5553 1.8229 -4.6305 {"}'M' greentint -9.7142 1.8261 -4.8364 {"}'M' greentint -9.8744 1.735 -5.0193 {"}'M' greentint -10.0158 1.5645 -5.1548 {"}'M' greentint -9.1785 1.813 -4.4841 {"}'M' greentint -9.3067 1.9221 -4.6808 {"}'M' greentint -9.4584 1.9576 -4.886 {"}'M' greentint -9.6197 1.9185 -5.0839 {"}'M' greentint -9.7763 1.8064 -5.2552 {"}'M' greentint -9.9149 1.6317 -5.386 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O AARG 73 A}'M' green -9.2329 2.0272 -4.9748 { O BARG 73 A}'M' green -10.0182 0.9395 -4.5266 {"}'M' green -9.8603 1.0497 -4.3531 {"}'M' green -9.715 1.2115 -4.2102 {"}'M' green -10.1261 1.278 -5.3359 {"}'M' green -9.5268 1.9874 -5.0665 {"}'M' green -9.6671 1.8867 -5.2593 @dotlist {x} color= red width= 1 master= {H-bonds} { O AARG 73 A}'M' greentint -10.1351 1.2428 -5.0393 {"}'M' greentint -9.9888 1.1795 -4.8335 {"}'M' greentint -9.8316 1.1749 -4.6278 {"}'M' greentint -9.669 1.2306 -4.4337 {"}'M' greentint -9.5112 1.3408 -4.2602 {"}'M' greentint -10.0308 1.4698 -5.2853 {"}'M' greentint -9.9053 1.3573 -5.0914 {"}'M' greentint -9.7573 1.3103 -4.8869 {"}'M' greentint -9.5981 1.3327 -4.6864 {"}'M' greentint -9.4383 1.4213 -4.5054 {"}'M' greentint -9.2916 1.5709 -4.3579 {"}'M' greentint -9.777 1.569 -5.2429 {"}'M' greentint -9.6386 1.4922 -5.0414 {"}'M' greentint -9.4798 1.5032 -4.8405 {"}'M' greentint -9.3228 1.5991 -4.6632 {"}'M' greentint -9.1843 1.7697 -4.5316 {"}'M' greentint -9.6373 1.8036 -5.3174 {"}'M' greentint -9.5043 1.7001 -5.1172 {"}'M' greentint -9.3412 1.7293 -4.9145 {"}'M' greentint -9.1914 1.883 -4.7637 {"}'M' greentint -9.3917 1.9299 -5.1524 { O BARG 73 A}'M' greentint -10.1064 1.0192 -4.9798 {"}'M' greentint -9.9472 1.0416 -4.7793 {"}'M' greentint -9.7875 1.1302 -4.5984 {"}'M' greentint -9.6408 1.2798 -4.4508 {"}'M' greentint -9.5171 1.4796 -4.3461 {"}'M' greentint -9.9878 1.2011 -5.1343 {"}'M' greentint -9.8289 1.2121 -4.9335 {"}'M' greentint -9.6719 1.308 -4.7561 {"}'M' greentint -9.5334 1.4786 -4.6246 {"}'M' greentint -9.4305 1.7021 -4.5537 {"}'M' greentint -9.9864 1.5125 -5.4103 {"}'M' greentint -9.8535 1.409 -5.2101 {"}'M' greentint -9.6903 1.4382 -5.0075 {"}'M' greentint -9.5405 1.5919 -4.8566 {"}'M' greentint -9.4452 1.8282 -4.7991 {"}'M' greentint -9.7408 1.6388 -5.2453 {"}'M' greentint -9.5821 1.7361 -5.0677 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gln A 61 1nxmA_140Y_63N}P -7.0191 6.0422 -11.7822 {"}-7.0191 6.0422 -11.7822 { ca gln A 61 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-8.4791 {"}'S' green -13.1788 0.0613 -8.0804 {"}'S' green -13.0227 0.1567 -7.9059 {"}'S' sea -13.3174 0.3485 -8.5712 {"}'S' green -13.184 0.2457 -8.3706 {"}'S' sea -13.0205 0.2743 -8.1672 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB VAL 491 A}'S' P -12.2442 0.37 -7.7552 {"}'S' -12.2445 0.3737 -7.7547 { HB VAL 491 A}'S' P -12.0939 0.2059 -7.3466 {"}'S' -12.0823 0.2225 -7.3448 {"}'S' P -11.9566 0.1244 -7.1472 {"}'S' -11.9535 0.1321 -7.1481 {"}'S' P -11.8046 0.0986 -6.9439 {"}'S' -11.7975 0.1218 -6.9496 {"}'S' P -11.6453 0.1291 -6.7466 {"}'S' -11.6438 0.1378 -6.7501 {"}'S' P -12.0417 0.3053 -7.7388 {"}'S' -12.018 0.3416 -7.7181 {"}'S' P -11.9329 0.1646 -7.5597 {"}'S' -11.8958 0.2426 -7.5337 {"}'S' P -11.8022 0.0702 -7.3647 {"}'S' -11.7758 0.1559 -7.3533 {"}'S' P -11.6549 0.0286 -7.1624 {"}'S' -11.6482 0.0732 -7.1651 {"}'S' P -11.4994 0.0406 -6.9645 {"}'S' -11.4978 0.0799 -6.9731 {"}'S' P -11.8913 0.4261 -8.0102 {"}'S' -11.8854 0.4359 -7.9993 {"}'S' P -11.8036 0.25 -7.8468 {"}'S' -11.7769 0.3222 -7.7994 {"}'S' P -11.6874 0.1182 -7.6614 {"}'S' -11.663 0.2314 -7.6146 {"}'S' P -11.5509 0.0368 -7.4613 {"}'S' -11.5419 0.1457 -7.4397 {"}'S' P -11.3985 0.0118 -7.2575 {"}'S' -11.4017 0.0639 -7.2567 {"}'S' P -11.2391 0.0423 -7.0603 {"}'S' -11.2403 0.0444 -7.0607 {"}'S' P -11.6133 0.3532 -8.0408 {"}'S' -11.6075 0.3832 -8.0108 {"}'S' P -11.5107 0.2005 -7.8658 {"}'S' -11.506 0.2809 -7.8128 {"}'S' P -11.3822 0.0997 -7.6706 {"}'S' -11.3885 0.1928 -7.6321 {"}'S' P -11.235 0.0567 -7.4681 {"}'S' -11.2452 0.1109 -7.4568 {"}'S' P -11.2734 0.2756 -7.9465 {"}'S' -11.2786 0.3027 -7.9256 {"}'S' P -11.1385 0.1807 -7.7456 {"}'S' -11.146 0.2057 -7.7325 {"}'S' P -11.0363 0.3884 -7.9797 {"}'S' -11.0463 0.4072 -7.9618 {"}'S' P -10.8991 0.3134 -7.7803 {"}'S' -10.9018 0.3175 -7.778 {HG11 VAL 491 A}'S' P -13.8182 -0.1631 -8.17 {"}'S' -13.8188 -0.1568 -8.1671 {"}'S' P -13.671 -0.2062 -7.9675 {"}'S' -13.6715 -0.2002 -7.9662 {"}'S' P -13.5745 -0.0821 -8.245 {"}'S' -13.5833 -0.0507 -8.2284 {"}'S' P -13.4187 -0.1064 -8.0368 {"}'S' -13.4274 -0.087 -8.0308 {"}'S' P -13.3351 0.0506 -8.2797 {"}'S' -13.3393 0.058 -8.2751 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 153 A}'M' greentint -9.3077 2.1074 -6.2812 {"}'M' greentint -9.0654 2.5031 -6.078 {"}'M' greentint -9.214 2.3462 -6.2265 {"}'M' greentint -9.3178 2.2498 -6.524 {"}'M' greentint -9.3743 2.0003 -6.5272 {"}'M' greentint -8.9162 2.7332 -6.1401 {"}'M' greentint -9.0748 2.6401 -6.3186 {"}'M' greentint -9.214 2.4721 -6.4517 {"}'M' greentint -9.2874 2.3438 -6.7688 {"}'M' greentint -9.3585 2.0987 -6.793 {"}'M' greentint -9.3891 1.8449 -6.7615 {"}'M' greentint -8.7292 2.9223 -6.208 {"}'M' greentint -8.8894 2.8641 -6.4 {"}'M' greentint -9.0442 2.741 -6.5647 {"}'M' greentint -9.1799 2.5635 -6.6908 {"}'M' greentint -9.2095 2.424 -7.007 {"}'M' greentint -9.2907 2.1808 -7.0454 {"}'M' greentint -9.3381 1.9265 -7.035 {"}'M' greentint -8.6465 3.0423 -6.4521 {"}'M' greentint -8.8085 2.9601 -6.6378 {"}'M' greentint -8.9608 2.8242 -6.7977 {"}'M' greentint -9.0974 2.6426 -6.9225 {"}'M' greentint -9.095 2.4688 -7.2367 {"}'M' greentint -9.1805 2.2339 -7.2812 {"}'M' greentint -8.7074 3.0064 -6.8844 {"}'M' greentint -8.8536 2.8628 -7.0343 {"}'M' greentint -8.9844 2.6808 -7.1527 {"}'M' greentint -8.944 2.4905 -7.4454 {"}'M' greentint -8.6984 2.8866 -7.2394 {"}'M' greentint -8.8305 2.7036 -7.3594 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 491 A}'M' greentint -9.3244 1.9594 -6.2788 {"}'M' greentint -9.1831 2.1102 -6.1372 {"}'M' greentint -9.0625 2.3044 -6.0354 {"}'M' greentint -8.97 2.5304 -5.9795 {"}'M' greentint -9.3687 1.8221 -6.7266 {"}'M' greentint -9.2104 1.8858 -6.5403 {"}'M' greentint -9.0602 2.0103 -6.3805 {"}'M' greentint -8.9271 2.1859 -6.2574 {"}'M' greentint -8.8218 2.4005 -6.1796 {"}'M' greentint -8.7484 2.6403 -6.1527 {"}'M' greentint -8.7154 2.8894 -6.1781 {"}'M' greentint -9.3181 1.8811 -7.0776 {"}'M' greentint -9.1599 1.8833 -6.8739 {"}'M' greentint -8.9992 1.9593 -6.687 {"}'M' greentint -8.8497 2.1047 -6.5346 {"}'M' greentint -8.7251 2.3046 -6.4288 {"}'M' greentint -8.6365 2.5422 -6.3807 {"}'M' greentint -8.592 2.797 -6.3934 {"}'M' greentint -8.5952 3.0439 -6.4662 {"}'M' greentint -9.0662 1.9942 -7.1266 {"}'M' greentint -8.9038 2.0391 -6.9286 {"}'M' greentint -8.7496 2.1717 -6.7669 {"}'M' greentint -8.6254 2.375 -6.6623 {"}'M' greentint -8.5471 2.6207 -6.6301 {"}'M' greentint -8.5261 2.8761 -6.6735 {"}'M' greentint -8.9552 2.1776 -7.297 {"}'M' greentint -8.7942 2.2057 -7.097 {"}'M' greentint -8.6461 2.3577 -6.9482 {"}'M' greentint -8.5513 2.5918 -6.8908 {"}'M' greentint -8.535 2.8455 -6.9401 {"}'M' greentint -8.8217 2.3955 -7.3505 {"}'M' greentint -8.6617 2.4924 -7.1711 {"}'M' greentint -8.6068 2.7457 -7.1709 {"}'M' greentint -8.74 2.6421 -7.3704 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 153 A}'M' greentint -9.7621 1.0526 -4.2007 {"}'M' greentint -9.8953 0.949 -4.4002 {"}'M' greentint -9.6804 1.2992 -4.2206 {"}'M' greentint -9.8404 1.2023 -4.4 {"}'M' greentint -9.9508 1.1029 -4.6803 {"}'M' greentint -9.9671 0.8492 -4.631 {"}'M' greentint -9.5469 1.517 -4.2741 {"}'M' greentint -9.7079 1.489 -4.4741 {"}'M' greentint -9.856 1.337 -4.6229 {"}'M' greentint -9.9225 1.2004 -4.9339 {"}'M' greentint -9.9729 0.9457 -4.9293 {"}'M' greentint -9.9642 0.6979 -4.8488 {"}'M' greentint -9.3585 1.6869 -4.3407 {"}'M' greentint -9.5174 1.6901 -4.5466 {"}'M' greentint -9.6776 1.599 -4.7295 {"}'M' greentint -9.8191 1.4285 -4.8651 {"}'M' greentint -9.8256 1.2746 -5.1739 {"}'M' greentint -9.8939 1.0256 -5.1916 {"}'M' greentint -9.9144 0.7724 -5.1481 {"}'M' greentint -9.423 1.7825 -4.7941 {"}'M' greentint -9.5796 1.6704 -4.9655 {"}'M' greentint -9.7182 1.4957 -5.0962 {"}'M' greentint -9.6803 1.2942 -5.3915 {"}'M' greentint -9.4419 1.6844 -5.1906 {"}'M' greentint -9.575 1.5088 -5.3137 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 491 A}'M' greentint -9.7808 0.8275 -4.2484 {"}'M' greentint -9.6588 1.0241 -4.1454 {"}'M' greentint -9.5605 1.249 -4.0794 {"}'M' greentint -9.8077 0.7152 -4.615 {"}'M' greentint -9.6623 0.8769 -4.472 {"}'M' greentint -9.5377 1.0793 -4.3684 {"}'M' greentint -9.4413 1.3124 -4.3086 {"}'M' greentint -9.3775 1.5642 -4.296 {"}'M' greentint -9.8946 0.7071 -5.0412 {"}'M' greentint -9.7349 0.7956 -4.8602 {"}'M' greentint -9.5882 0.9452 -4.7126 {"}'M' greentint -9.4644 1.145 -4.6079 {"}'M' greentint -9.3726 1.3792 -4.5546 {"}'M' greentint -9.3206 1.63 -4.5562 {"}'M' greentint -9.7763 0.8776 -5.1953 {"}'M' greentint -9.6193 0.9734 -5.0179 {"}'M' greentint -9.4808 1.144 -4.8864 {"}'M' greentint -9.3779 1.3675 -4.8155 {"}'M' greentint -9.3235 1.6172 -4.8152 {"}'M' greentint -9.6377 1.1036 -5.2693 {"}'M' greentint -9.4879 1.2573 -5.1185 {"}'M' greentint -9.3926 1.4936 -5.061 {"}'M' greentint -9.3763 1.7501 -5.1108 {"}'M' greentint -9.5295 1.4016 -5.3295 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 64 1o26A_158F_66V}P -7.7707 5.4165 -12.5043 {"}-7.7707 5.4165 -12.5043 { ca phe A 64 1o26A_158F_66V}-8.7761 5.7045 -11.4869 { c phe A 64 1o26A_158F_66V}-8.3272 5.1754 -10.1254 { o phe A 64 1o26A_158F_66V}-7.5217 4.245 -10.0339 { c phe A 64 1o26A_158F_66V}P -8.3272 5.1754 -10.1254 { n his A 65 1o26A_158F_66V}-8.873 5.7745 -9.0754 { ca his A 65 1o26A_158F_66V}-8.6274 5.3538 -7.7004 { c his A 65 1o26A_158F_66V}-10.0401 5.0207 -7.2329 { o his A 65 1o26A_158F_66V}-10.9468 5.8699 -7.2664 { c his A 65 1o26A_158F_66V}P -10.0401 5.0207 -7.2329 { n val A 66 1o26A_158F_66V}-10.241 3.7753 -6.8063 { ca val A 66 1o26A_158F_66V}-11.5555 3.2991 -6.4299 { c val A 66 1o26A_158F_66V}-11.628 2.6663 -5.0448 { o val A 66 1o26A_158F_66V}-10.7232 1.9424 -4.634 { c val A 66 1o26A_158F_66V}P -11.628 2.6663 -5.0448 { n lys A 67 1o26A_158F_66V}-12.7057 2.9678 -4.3258 { ca lys A 67 1o26A_158F_66V}-12.9743 2.3635 -3.0187 { c lys A 67 1o26A_158F_66V}-14.3211 1.6685 -3.2073 { o lys A 67 1o26A_158F_66V}-15.3312 2.3214 -3.469 { c lys A 67 1o26A_158F_66V}P -14.3211 1.6685 -3.2073 { n ala A 68 1o26A_158F_66V}-14.3355 0.3382 -3.0874 { ca ala A 68 1o26A_158F_66V}-15.55 -0.4424 -3.3166 { c ala A 68 1o26A_158F_66V}-15.5313 -1.7155 -2.4843 { o ala A 68 1o26A_158F_66V}-14.4662 -2.1695 -2.087 { n thr A 156 1o26A_158F_66V}P -12.5701 -2.246 -0.0282 {"}-12.5701 -2.246 -0.0282 { ca thr A 156 1o26A_158F_66V}-11.1679 -2.3497 -0.3933 { c thr A 156 1o26A_158F_66V}-10.8743 -1.1001 -1.2377 { o thr A 156 1o26A_158F_66V}-11.7849 -0.3295 -1.5507 { c thr A 156 1o26A_158F_66V}P -10.8743 -1.1001 -1.2377 { n arg A 157 1o26A_158F_66V}-9.6114 -0.8695 -1.5618 { ca arg A 157 1o26A_158F_66V}-9.2318 0.2922 -2.3779 { c arg A 157 1o26A_158F_66V}-8.2553 -0.1696 -3.443 { o arg A 157 1o26A_158F_66V}-7.4022 -1.016 -3.174 { c arg A 157 1o26A_158F_66V}P -8.2553 -0.1696 -3.443 { n phe A 158 1o26A_158F_66V}-8.3451 0.3965 -4.6417 { ca phe A 158 1o26A_158F_66V}-7.4143 0.0092 -5.6889 { c phe A 158 1o26A_158F_66V}-7.2312 1.0685 -6.7535 { o phe A 158 1o26A_158F_66V}-8.0449 1.9824 -6.8764 { c phe A 158 1o26A_158F_66V}P -7.2312 1.0685 -6.7535 { n phe A 159 1o26A_158F_66V}-6.1278 0.9573 -7.4825 { ca phe A 159 1o26A_158F_66V}-5.8533 1.8318 -8.6126 { c phe A 159 1o26A_158F_66V}-6.1482 0.9698 -9.8374 { o phe A 159 1o26A_158F_66V}-5.8536 -0.233 -9.8453 { c phe A 159 1o26A_158F_66V}P -6.1482 0.9698 -9.8374 { n trp A 160 1o26A_158F_66V}-6.7575 1.5876 -10.8419 { ca trp A 160 1o26A_158F_66V}-7.1557 0.9102 -12.0773 { c trp A 160 1o26A_158F_66V}-6.6976 1.7321 -13.2708 { o trp A 160 1o26A_158F_66V}-7.1351 2.8784 -13.4316 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 64 1o26A_158F_66V}P -7.7707 5.4165 -12.5043 { ca phe A 64 1o26A_158F_66V}P -8.7761 5.7045 -11.4869 { n his A 65 1o26A_158F_66V}P -8.873 5.7745 -9.0754 { ca his A 65 1o26A_158F_66V}P -8.6274 5.3538 -7.7004 { n val A 66 1o26A_158F_66V}P -10.241 3.7753 -6.8063 { ca val A 66 1o26A_158F_66V}P -11.5555 3.2991 -6.4299 { n lys A 67 1o26A_158F_66V}P -12.7057 2.9678 -4.3258 { ca lys A 67 1o26A_158F_66V}P -12.9743 2.3635 -3.0187 { n ala A 68 1o26A_158F_66V}P -14.3355 0.3382 -3.0874 { ca ala A 68 1o26A_158F_66V}P -15.55 -0.4424 -3.3166 { n thr A 156 1o26A_158F_66V}P -12.5701 -2.246 -0.0282 { ca thr A 156 1o26A_158F_66V}P -11.1679 -2.3497 -0.3933 { n arg A 157 1o26A_158F_66V}P -9.6114 -0.8695 -1.5618 { ca arg A 157 1o26A_158F_66V}P -9.2318 0.2922 -2.3779 { n phe A 158 1o26A_158F_66V}P -8.3451 0.3965 -4.6417 { ca phe A 158 1o26A_158F_66V}P -7.4143 0.0092 -5.6889 { n phe A 159 1o26A_158F_66V}P -6.1278 0.9573 -7.4825 { ca phe A 159 1o26A_158F_66V}P -5.8533 1.8318 -8.6126 { n trp A 160 1o26A_158F_66V}P -6.7575 1.5876 -10.8419 { ca trp A 160 1o26A_158F_66V}P -7.1557 0.9102 -12.0773 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 64 1o26A_158F_66V}P -8.7761 5.7045 -11.4869 {"}-8.7761 5.7045 -11.4869 { ca his A 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{"}'M' greentint -9.0549 2.8152 -7.0696 {"}'M' greentint -9.1916 2.6336 -7.1944 {"}'M' greentint -9.1891 2.4598 -7.5085 {"}'M' greentint -8.4866 3.1473 -6.7908 {"}'M' greentint -8.6458 3.0962 -6.9829 {"}'M' greentint -8.8016 2.9974 -7.1563 {"}'M' greentint -8.9477 2.8538 -7.3061 {"}'M' greentint -9.0785 2.6718 -7.4246 {"}'M' greentint -8.6459 3.0247 -7.3615 {"}'M' greentint -8.7925 2.8776 -7.5113 {"}'M' greentint -8.9246 2.6946 -7.6313 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H MET 50 A}'M' P -8.8243 2.1093 -6.9676 {"}'M' -8.8251 2.1109 -6.9672 {"}'M' P -8.6701 2.242 -6.8058 {"}'M' -8.6952 2.2622 -6.8054 {"}'M' P -8.5666 2.4279 -6.9871 {"}'M' -8.5751 2.432 -6.9859 @dotlist {x} color= sky width= 1 master= {H-bonds} { H MET 50 A}'M' greentint -9.3998 1.9324 -6.4902 {"}'M' greentint -9.2449 2.0296 -6.3177 {"}'M' greentint -9.1036 2.1804 -6.1761 {"}'M' greentint -8.983 2.3747 -6.0744 {"}'M' greentint -9.4435 1.8931 -6.9647 {"}'M' greentint -9.2891 1.8924 -6.7656 {"}'M' greentint -9.1309 1.9561 -6.5792 {"}'M' greentint -8.9807 2.0806 -6.4194 {"}'M' greentint -8.8476 2.2562 -6.2963 {"}'M' greentint -8.7423 2.4708 -6.2186 {"}'M' greentint -8.6689 2.7106 -6.1917 {"}'M' greentint -9.3799 2.0244 -7.3196 {"}'M' greentint -9.2386 1.9514 -7.1166 {"}'M' greentint -9.0804 1.9536 -6.9128 {"}'M' greentint -8.9197 2.0296 -6.726 {"}'M' greentint -8.7702 2.1749 -6.5736 {"}'M' greentint -8.6456 2.3749 -6.4677 {"}'M' greentint -8.557 2.6125 -6.4197 {"}'M' greentint -8.5125 2.8672 -6.4324 {"}'M' greentint -9.2515 2.2511 -7.5598 {"}'M' greentint -9.1354 2.1141 -7.3716 {"}'M' greentint -8.9867 2.0644 -7.1655 {"}'M' greentint -8.5459 2.4453 -6.7012 {"}'M' greentint -8.4676 2.691 -6.6691 {"}'M' greentint -8.4466 2.9464 -6.7124 {"}'M' greentint -9.0074 2.3496 -7.5341 {"}'M' greentint -8.8757 2.2479 -7.3359 {"}'M' greentint -8.7147 2.276 -7.136 {"}'M' greentint -8.4718 2.662 -6.9298 {"}'M' greentint -8.4555 2.9157 -6.9791 {"}'M' 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greentint -9.4886 1.7813 -4.6769 {"}'M' greentint -9.6489 1.6902 -4.8597 {"}'M' greentint -9.7903 1.5197 -4.9953 {"}'M' greentint -9.2329 1.9128 -4.7264 {"}'M' greentint -9.3942 1.8737 -4.9243 {"}'M' greentint -9.5508 1.7616 -5.0957 {"}'M' greentint -9.6894 1.5869 -5.2264 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O MET 50 A}'M' green -9.9246 1.0648 -4.4358 {"}'M' green -9.7728 1.1854 -4.273 {"}'M' green -9.6324 1.3474 -4.137 {"}'M' green -9.9798 1.0692 -4.8712 {"}'M' green -9.3894 1.5992 -4.257 {"}'M' green -9.2242 1.8991 -4.4432 {"}'M' green -9.6525 1.5943 -5.3605 {"}'M' green -9.2443 2.0136 -4.9496 {"}'M' green -9.3811 1.9215 -5.2181 @dotlist {x} color= red width= 1 master= {H-bonds} { O MET 50 A}'M' greentint -9.8172 1.1249 -4.677 {"}'M' greentint -9.6594 1.2351 -4.5036 {"}'M' greentint -9.514 1.3968 -4.3606 {"}'M' greentint -9.9054 1.2046 -5.1303 {"}'M' greentint -9.7462 1.227 -4.9298 {"}'M' greentint -9.5865 1.3156 -4.7488 {"}'M' greentint 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master= {mainchain} { n ser A 28 1oa2A_30F_49Q}P -9.4581 -0.3684 1.4145 { ca ser A 28 1oa2A_30F_49Q}P -10.0725 -1.3604 0.5346 { n gly A 29 1oa2A_30F_49Q}P -10.0146 -1.3146 -1.8952 { ca gly A 29 1oa2A_30F_49Q}P -10.3052 -0.7384 -3.1894 {"}P -10.3052 -0.7384 -3.1894 { n phe A 30 1oa2A_30F_49Q}P -9.0748 -0.188 -5.1535 { ca phe A 30 1oa2A_30F_49Q}P -8.1951 -0.4754 -6.278 { n gly A 31 1oa2A_30F_49Q}P -6.7119 0.6025 -7.7966 { ca gly A 31 1oa2A_30F_49Q}P -6.1624 1.6788 -8.5968 {"}P -6.1624 1.6788 -8.5968 { n cys A 32 1oa2A_30F_49Q}P -6.0923 1.7591 -11.0211 { ca cys A 32 1oa2A_30F_49Q}P -5.728 1.2952 -12.3705 { n asp A 47 1oa2A_30F_49Q}P -7.5609 5.5496 -12.5487 { ca asp A 47 1oa2A_30F_49Q}P -8.9077 5.2039 -12.1266 { n trp A 48 1oa2A_30F_49Q}P -9.6869 4.9142 -9.841 { ca trp A 48 1oa2A_30F_49Q}P -9.5894 4.3128 -8.5383 { n gln A 49 1oa2A_30F_49Q}P -10.8549 3.5831 -6.6753 { ca gln A 49 1oa2A_30F_49Q}P -11.9167 3.5905 -5.6811 { n trp A 50 1oa2A_30F_49Q}P -11.4963 3.9301 -3.3214 { ca trp A 50 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{1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 30 A}'S' blue -12.1304 0.1866 -6.36 {"}'S' blue -11.8832 0.2562 -6.2772 {"}'S' blue -11.6716 0.4342 -6.3243 {"}'S' sky -11.5369 0.7132 -6.5456 {"}'S' blue -11.412 0.9159 -6.7988 {"}'S' blue -11.5474 1.0061 -6.9977 { CE2 PHE 30 A}'S' sky -13.3257 1.1657 -7.4123 {"}'S' blue -13.3385 1.3664 -7.7012 {"}'S' sky -13.1352 1.5483 -7.7587 {"}'S' sky -12.9009 1.6915 -7.8146 {"}'S' blue -13.0619 1.6766 -8.0176 {"}'S' sky -12.6441 1.7928 -7.8679 {"}'S' blue -12.8 1.7984 -8.072 {"}'S' sky -12.2231 1.7806 -7.7118 { CZ PHE 30 A}'S' blue -12.8147 1.8926 -8.2656 {"}'S' blue -12.5493 1.9811 -8.164 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 30 A}'S' sea -12.2357 0.3477 -6.5407 {"}'S' sea -11.9703 0.4363 -6.439 {"}'S' green -12.0892 0.563 -6.6287 {"}'S' sea -11.7683 0.6014 -6.4946 {"}'S' green -11.8898 0.7234 -6.6868 {"}'S' sea -11.6592 0.8395 -6.7381 { CE2 PHE 30 A}'S' green -13.024 0.7022 -6.8924 {"}'S' green -13.0792 0.9235 -7.0252 {"}'S' sea -13.1845 1.0847 -7.2059 {"}'S' green -12.7755 0.5279 -6.7403 {"}'S' green -13.038 1.2999 -7.294 {"}'S' sea -13.1808 1.3664 -7.4976 {"}'S' green -12.5229 0.4873 -6.6728 {"}'S' green -12.8387 1.4603 -7.3521 {"}'S' green -12.9809 1.5306 -7.5541 {"}'S' green -12.257 0.6126 -6.6815 {"}'S' green -12.608 1.5764 -7.4034 {"}'S' green -12.7479 1.6573 -7.6062 {"}'S' green -11.9975 0.7094 -6.7317 {"}'S' green -12.2433 1.5237 -7.2757 {"}'S' green -12.3608 1.6528 -7.4641 {"}'S' sea -12.4962 1.743 -7.6629 {"}'S' sea -11.7678 0.9563 -6.8945 {"}'S' green -11.8168 1.1755 -7.0184 {"}'S' sea -11.8892 1.3709 -7.1653 {"}'S' sea -11.9825 1.5399 -7.3331 {"}'S' sea -12.0952 1.6777 -7.5168 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 30 A}'S' P -12.7826 0.7734 -6.8179 {"}'S' -12.7771 0.7662 -6.8361 {"}'S' P -12.832 0.9932 -6.9425 {"}'S' -12.8179 0.9733 -6.9768 {"}'S' P -12.9191 1.1732 -7.1043 {"}'S' -12.9172 1.1703 -7.1079 {"}'S' P -12.5214 0.736 -6.7395 {"}'S' -12.5164 0.7245 -6.7728 {"}'S' P -12.5549 0.9679 -6.8468 {"}'S' -12.541 0.9303 -6.9183 {"}'S' P -12.6204 1.1711 -6.9895 {"}'S' -12.6056 1.1269 -7.0498 {"}'S' P -12.7171 1.3383 -7.1598 {"}'S' -12.7118 1.3245 -7.175 {"}'S' P -12.2704 0.8573 -6.7677 {"}'S' -12.2707 0.8402 -6.8085 {"}'S' P -12.315 1.0844 -6.8873 {"}'S' -12.3116 1.044 -6.952 {"}'S' P -12.3869 1.2844 -7.0362 {"}'S' -12.3823 1.2443 -7.0841 {"}'S' P -12.4857 1.4501 -7.2109 {"}'S' -12.4859 1.4467 -7.2138 {"}'S' P -12.0208 0.946 -6.8278 {"}'S' -12.0212 0.9466 -6.8285 {"}'S' P -12.0707 1.165 -6.9528 {"}'S' -12.073 1.1548 -6.969 {"}'S' P -12.1456 1.3598 -7.1031 {"}'S' -12.1461 1.3587 -7.1052 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB GLN 49 A}'S' sky -13.395 1.4228 -7.2547 {"}'S' sky -13.237 1.7222 -7.5241 {"}'S' sky -12.4999 2.0221 -7.6001 {"}'S' sky -12.2569 2.0777 -7.5199 { HB2 GLN 49 A}'S' blue -13.4458 1.8723 -7.6915 {"}'S' blue -13.2085 1.9474 -7.7723 {"}'S' blue -12.9714 2.0603 -7.8055 {"}'S' blue -12.8165 2.2832 -7.8976 { HB3 GLN 49 A}'S' sky -12.3995 0.4783 -6.309 {"}'S' blue -12.2413 0.496 -6.1106 {"}'S' sky -11.984 0.627 -6.1818 {"}'S' sky -11.7512 0.8412 -6.2475 @dotlist {x} color= white width= 1 master= {vdw contact} { CB GLN 49 A}'S' sea -13.3022 1.253 -7.0873 {"}'S' sea -13.1734 1.5156 -7.3848 {"}'S' green -13.0867 1.3365 -7.2219 {"}'S' sea -12.9943 1.8212 -7.596 {"}'S' green -12.9367 1.6066 -7.4615 {"}'S' green -12.8515 1.421 -7.2991 {"}'S' sea -12.7467 1.9262 -7.6233 {"}'S' green -12.6952 1.7075 -7.4961 {"}'S' green -12.4518 1.8013 -7.4771 {"}'S' green -12.3656 1.6197 -7.3161 {"}'S' sea -12.1999 1.8582 -7.385 {"}'S' sea -12.0933 1.6994 -7.203 { HB3 GLN 49 A}'S' green -13.1122 1.0594 -6.9817 {"}'S' green -13.0558 0.8477 -6.8512 {"}'S' green -12.9682 0.6716 -6.6878 {"}'S' green -12.6752 0.6221 -6.7067 {"}'S' sea -12.5468 0.5213 -6.5116 {"}'S' green -12.3031 0.6023 -6.5866 {"}'S' sea -12.1473 0.5781 -6.3784 {"}'S' green -12.0637 0.735 -6.6212 {"}'S' sea -11.9074 0.7458 -6.422 {"}'S' green -12.0974 1.4993 -7.1083 {"}'S' green -11.9126 0.9302 -6.7121 {"}'S' sea -11.749 0.9588 -6.5088 {"}'S' green -11.8926 1.312 -6.9361 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB GLN 49 A}'S' P -12.6124 1.5227 -7.3373 {"}'S' -12.6135 1.5238 -7.3357 { HB3 GLN 49 A}'S' P -12.8834 1.1988 -7.1348 {"}'S' -12.881 1.2026 -7.1256 {"}'S' P -12.8489 0.9712 -7.0272 {"}'S' -12.841 0.991 -6.9971 {"}'S' P -12.7778 0.7748 -6.8818 {"}'S' -12.7747 0.7951 -6.8616 {"}'S' P -12.6255 1.3072 -7.2001 {"}'S' -12.6252 1.3165 -7.166 {"}'S' P -12.6061 1.0648 -7.1081 {"}'S' -12.6071 1.1005 -7.0372 {"}'S' P -12.5416 0.8559 -6.9654 {"}'S' -12.5473 0.9055 -6.9058 {"}'S' P -12.438 0.6972 -6.7875 {"}'S' -12.4431 0.7243 -6.7666 {"}'S' P -12.3589 1.4182 -7.1926 {"}'S' -12.3615 1.4197 -7.1811 {"}'S' P -12.3585 1.1741 -7.1244 {"}'S' -12.3743 1.1994 -7.0612 {"}'S' P -12.3034 0.9628 -6.9958 {"}'S' -12.3244 1.0054 -6.9333 {"}'S' P -12.2009 0.81 -6.8207 {"}'S' -12.2127 0.8331 -6.7994 {"}'S' P -12.1138 1.2414 -7.0582 {"}'S' -12.1222 1.2479 -7.0404 {"}'S' P -12.046 1.0329 -6.9128 {"}'S' -12.0552 1.0414 -6.9 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 30 A}'M' sea -9.4843 2.0336 -6.1348 {"}'M' green -9.4243 2.2839 -6.1271 {"}'M' green -9.5817 1.9202 -6.3464 {"}'M' green -9.1624 2.6051 -5.9945 {"}'M' sea -8.9894 2.991 -6.3264 {"}'M' green -9.4697 2.4927 -7.1254 {"}'M' green -9.5509 2.2495 -7.1638 {"}'M' green -9.0687 3.0288 -6.7562 {"}'M' green -9.221 2.8929 -6.9161 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 30 A}'M' greentint -9.5679 2.1761 -6.3996 {"}'M' greentint -9.3256 2.5718 -6.1964 {"}'M' greentint -9.4742 2.4148 -6.3449 {"}'M' greentint -9.578 2.3185 -6.6424 {"}'M' greentint -9.6345 2.069 -6.6456 {"}'M' greentint -9.1764 2.8019 -6.2585 {"}'M' greentint -9.335 2.7087 -6.437 {"}'M' greentint -9.4742 2.5408 -6.5701 {"}'M' greentint -9.5476 2.4125 -6.8871 {"}'M' greentint -9.6187 2.1674 -6.9114 {"}'M' greentint -9.1496 2.9328 -6.5184 {"}'M' greentint -9.3044 2.8097 -6.683 {"}'M' greentint -9.4401 2.6322 -6.8092 {"}'M' greentint -9.3576 2.7113 -7.0409 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLN 49 A}'M' green -9.7714 1.991 -6.603 {"}'M' green -9.6107 2.067 -6.4161 {"}'M' green -9.248 2.6499 -6.1098 {"}'M' green -9.6777 2.1019 -6.8556 {"}'M' green -9.1376 2.9838 -6.4025 {"}'M' green -9.3515 2.7497 -7.0995 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLN 49 A}'M' greentint -9.4612 2.2124 -6.2637 {"}'M' greentint -9.3366 2.4123 -6.1579 {"}'M' greentint -9.5153 2.1468 -6.6577 {"}'M' greentint -9.3611 2.2794 -6.496 {"}'M' greentint -9.2369 2.4827 -6.3914 {"}'M' greentint -9.1586 2.7284 -6.3592 {"}'M' greentint -9.5667 2.2853 -7.0261 {"}'M' greentint -9.4057 2.3134 -6.8261 {"}'M' greentint -9.2576 2.4653 -6.6772 {"}'M' greentint -9.1628 2.6995 -6.6199 {"}'M' greentint -9.1465 2.9532 -6.6692 {"}'M' greentint -9.4332 2.5032 -7.0796 {"}'M' greentint -9.2732 2.6001 -6.9002 {"}'M' greentint -9.2183 2.8534 -6.9 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 30 A}'M' greentint -10.2799 0.8849 -4.566 {"}'M' greentint -10.094 0.9763 -4.408 {"}'M' greentint -10.1982 1.1315 -4.5858 {"}'M' greentint -10.3582 1.0346 -4.7652 {"}'M' greentint -9.8663 1.0423 -4.2981 {"}'M' greentint -9.9329 1.2476 -4.4412 {"}'M' greentint -10.0647 1.3493 -4.6393 {"}'M' greentint -10.2257 1.3213 -4.8393 {"}'M' greentint -10.3737 1.1693 -4.9882 {"}'M' greentint -9.6482 1.2498 -4.3362 {"}'M' greentint -9.7414 1.4244 -4.5051 {"}'M' greentint -9.8763 1.5192 -4.706 {"}'M' greentint -10.0352 1.5224 -4.9119 {"}'M' greentint -10.1954 1.4313 -5.0947 {"}'M' greentint -10.3368 1.2608 -5.2303 {"}'M' greentint -9.4995 1.5093 -4.5596 {"}'M' greentint -9.6277 1.6184 -4.7563 {"}'M' greentint -9.7794 1.6539 -4.9615 {"}'M' greentint -9.9407 1.6147 -5.1593 {"}'M' greentint -10.0973 1.5027 -5.3307 {"}'M' greentint -9.4969 1.7041 -5.0106 {"}'M' greentint -9.6512 1.7048 -5.2097 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLN 49 A}'M' green -10.4399 0.8309 -4.7964 {"}'M' green -10.1309 0.8289 -4.3974 {"}'M' green -9.3807 1.5021 -4.5528 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLN 49 A}'M' greentint -10.2888 0.805 -4.5942 {"}'M' greentint -10.3315 0.9752 -5.0604 {"}'M' greentint -10.1852 0.9119 -4.8546 {"}'M' greentint -10.028 0.9073 -4.649 {"}'M' greentint -9.8654 0.963 -4.4548 {"}'M' greentint -9.7076 1.0733 -4.2814 {"}'M' greentint -10.2273 1.2022 -5.3064 {"}'M' greentint -10.1017 1.0898 -5.1125 {"}'M' greentint -9.9537 1.0427 -4.9081 {"}'M' greentint -9.7945 1.0652 -4.7076 {"}'M' greentint -9.6348 1.1537 -4.5266 {"}'M' greentint -9.4881 1.3033 -4.379 {"}'M' greentint -10.0768 1.4555 -5.4406 {"}'M' greentint -9.9734 1.3015 -5.2641 {"}'M' greentint -9.8351 1.2247 -5.0626 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-7.0083 {"}'S' green -11.2215 0.2527 -7.2091 { CZ PHE 86 A}'S' green -12.8242 0.1958 -7.2642 {"}'S' green -12.9855 0.158 -7.4623 {"}'S' sea -13.144 0.0673 -7.6429 {"}'S' sea -12.4368 0.3048 -7.1117 {"}'S' green -12.5898 0.339 -7.32 {"}'S' green -12.7509 0.3241 -7.5231 {"}'S' green -12.9137 0.2614 -7.7159 {"}'S' green -13.0723 0.1524 -7.8907 {"}'S' sea -13.2216 0.0008 -8.0414 {"}'S' green -12.3331 0.4403 -7.3734 {"}'S' green -12.489 0.4459 -7.5775 {"}'S' green -12.6494 0.4097 -7.7747 {"}'S' green -12.8101 0.3312 -7.9594 {"}'S' green -12.9652 0.2126 -8.1272 {"}'S' sea -13.1108 0.0584 -8.2722 {"}'S' green -11.9121 0.4281 -7.2172 {"}'S' green -12.0546 0.494 -7.4201 {"}'S' green -12.2065 0.5211 -7.6237 {"}'S' green -12.3641 0.508 -7.8242 {"}'S' green -12.525 0.4554 -8.0166 {"}'S' green -12.6822 0.3657 -8.1957 {"}'S' sea -12.8354 0.2402 -8.3576 {"}'S' sea -12.979 0.0817 -8.4989 {"}'S' green -11.5815 0.3735 -7.1887 {"}'S' green -12.1809 0.5382 -8.0096 {"}'S' sea -12.3448 0.4816 -8.2053 {"}'S' 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-7.943 {"}'S' P -11.6319 0.5069 -8.1526 {"}'S' -11.633 0.4984 -8.1522 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 101 A}'S' blue -12.1045 0.8924 -6.7966 {"}'S' sky -12.2725 0.7704 -8.2699 {"}'S' sky -12.0148 0.7754 -8.3527 {"}'S' blue -11.8029 0.847 -8.4897 { CG1 VAL 101 A}'S' blue -13.3708 0.2449 -7.2056 {"}'S' blue -13.2084 0.3057 -7.0113 {"}'S' sky -13.0472 0.4022 -6.83 {"}'S' sky -13.4236 0.2236 -7.6967 {"}'S' sky -12.628 0.5977 -6.7717 {"}'S' blue -12.4885 0.7754 -6.6403 {"}'S' sky -12.3949 0.6853 -6.9087 {"}'S' blue -12.2644 0.872 -6.7918 {"}'S' sky -12.5035 0.7605 -8.4072 {"}'S' sky -12.3462 0.7583 -8.2038 { HB VAL 101 A}'S' sky -12.0134 0.7096 -7.0457 {"}'S' sky -11.851 0.7587 -6.8486 {"}'S' blue -11.6934 0.8761 -6.6788 {"}'S' sky -11.4539 0.76 -6.7043 {"}'S' sky -11.2313 0.6597 -6.7975 {"}'S' blue -10.9421 0.6899 -6.8637 {"}'S' blue -10.8248 0.572 -7.1122 {"}'S' sky -10.8128 0.4585 -7.475 {"}'S' blue -10.5561 0.6319 -7.5583 {"}'S' sky -11.0327 0.8493 -8.543 {"}'S' blue -10.4805 0.7276 -7.7947 {"}'S' blue -10.7752 0.9194 -8.4601 {"}'S' sky -10.6418 0.8166 -8.2594 {HG11 VAL 101 A}'S' blue -13.5704 0.2006 -7.8904 {"}'S' blue -13.6282 0.1074 -8.3702 {"}'S' sky -13.4688 0.1379 -8.173 {"}'S' blue -13.4647 0.1522 -8.5807 {"}'S' sky -13.2124 0.2521 -8.6501 {"}'S' sky -12.9725 0.4198 -8.6937 {"}'S' sky -12.8164 0.5151 -8.5192 {HG12 VAL 101 A}'S' blue -13.3274 0.3225 -6.3916 {"}'S' blue -13.1694 0.4082 -6.2106 {"}'S' sky -13.1651 0.3546 -6.6009 {"}'S' sky -13.0074 0.4306 -6.4181 {"}'S' sky -12.8569 0.562 -6.2595 {"}'S' sky -12.9078 0.4856 -6.6722 {"}'S' sky -12.7506 0.604 -6.5014 {"}'S' blue -12.6115 0.7809 -6.3705 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 101 A}'S' green -12.2447 0.6667 -7.7775 {"}'S' sea -12.1305 0.692 -8.0646 { CG1 VAL 101 A}'S' sea -13.2642 0.2229 -7.489 {"}'S' sea -13.1004 0.261 -7.2892 {"}'S' sea -12.9377 0.3367 -7.0994 {"}'S' sea -12.7793 0.4505 -6.926 {"}'S' green -13.1668 0.2532 -7.7865 {"}'S' green -13.0092 0.265 -7.5858 {"}'S' green -12.8488 0.3153 -7.3935 {"}'S' green -12.6908 0.4039 -7.213 {"}'S' sea -12.5384 0.5281 -7.0502 {"}'S' green -12.9533 0.3253 -7.9213 {"}'S' green -12.7947 0.3414 -7.7202 {"}'S' green -12.6333 0.4003 -7.5284 {"}'S' green -12.4753 0.5002 -7.3524 {"}'S' sea -12.3243 0.6376 -7.1962 {"}'S' sea -12.8613 0.4468 -8.1942 {"}'S' green -12.7035 0.4351 -7.9878 {"}'S' green -12.5414 0.4731 -7.7885 {"}'S' green -12.3801 0.5582 -7.6028 {"}'S' sea -12.6176 0.5789 -8.2347 {"}'S' green -12.4591 0.5909 -8.0328 {"}'S' green -12.2979 0.6573 -7.843 { HB VAL 101 A}'S' green -12.0675 0.5779 -7.4467 {"}'S' green -11.9202 0.5348 -7.2441 {"}'S' green -11.7628 0.5527 -7.0451 {"}'S' sea -11.6047 0.6295 -6.8618 {"}'S' green -12.1031 0.6456 -7.9209 {"}'S' green -11.539 0.4372 -7.1349 {"}'S' green -11.3806 0.5237 -6.9534 {"}'S' green -11.9355 0.6134 -8.127 {"}'S' green -11.2345 0.4131 -7.166 {"}'S' sea -11.0816 0.5292 -7.0005 {"}'S' green -11.6974 0.558 -8.235 {"}'S' green -11.1329 0.3504 -7.4486 {"}'S' green -11.4045 0.5085 -8.254 {"}'S' green -11.1287 0.3647 -7.8563 {"}'S' green -10.9706 0.3825 -7.6578 {"}'S' sea -11.2709 0.7424 -8.5127 {"}'S' green -11.1672 0.5836 -8.3348 {"}'S' green -11.0323 0.4888 -8.1339 {"}'S' green -10.8765 0.4645 -7.9257 {"}'S' sea -10.7133 0.5135 -7.7291 {"}'S' sea -10.9301 0.6965 -8.368 {"}'S' green -10.7929 0.6215 -8.1685 {"}'S' sea -10.6366 0.6322 -7.9693 {HG11 VAL 101 A}'S' sea -13.3108 0.2236 -7.992 {"}'S' sea -13.3065 0.17 -8.3823 {"}'S' green -13.1488 0.246 -8.1994 {"}'S' sea -13.0492 0.301 -8.4535 {"}'S' sea -12.892 0.4194 -8.2828 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 101 A}'S' P -11.9877 0.514 -7.7349 {"}'S' -11.9778 0.5291 -7.7333 {"}'S' P -11.8504 0.4325 -7.5354 {"}'S' -11.832 0.4718 -7.538 {"}'S' P -11.6984 0.4067 -7.3321 {"}'S' -11.6926 0.4265 -7.3371 {"}'S' P -11.8267 0.4727 -7.9479 {"}'S' -11.811 0.5069 -7.936 {"}'S' P -11.696 0.3783 -7.7529 {"}'S' -11.6729 0.4515 -7.7432 {"}'S' P -11.5487 0.3367 -7.5506 {"}'S' -11.5375 0.4033 -7.554 {"}'S' P -11.3931 0.3486 -7.3527 {"}'S' -11.3927 0.3625 -7.3553 {"}'S' P -11.5812 0.4263 -8.0496 {"}'S' -11.5739 0.4635 -8.0345 {"}'S' P -11.4447 0.3449 -7.8495 {"}'S' -11.4394 0.4098 -7.8366 {"}'S' P -11.2923 0.3199 -7.6458 {"}'S' -11.295 0.3618 -7.6454 {"}'S' P -11.276 0.4078 -8.0589 {"}'S' -11.2763 0.4101 -8.0581 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 86 A}'M' greentint -9.1863 2.5731 -6.0113 {"}'M' greentint -9.29 2.4768 -6.3088 {"}'M' greentint -8.8884 2.9602 -5.925 {"}'M' greentint -9.047 2.867 -6.1034 {"}'M' greentint -9.1863 2.6991 -6.2366 {"}'M' greentint -9.2596 2.5708 -6.5536 {"}'M' greentint -9.3307 2.3257 -6.5778 {"}'M' greentint -8.8616 3.0911 -6.1849 {"}'M' greentint -9.0164 2.968 -6.3495 {"}'M' greentint -9.1521 2.7904 -6.4757 {"}'M' greentint -9.1817 2.651 -6.7919 {"}'M' greentint -9.2629 2.4078 -6.8303 {"}'M' greentint -8.6187 3.2693 -6.237 {"}'M' greentint -8.7808 3.1871 -6.4226 {"}'M' greentint -8.933 3.0512 -6.5826 {"}'M' greentint -9.0697 2.8696 -6.7074 {"}'M' greentint -9.0672 2.6958 -7.0215 {"}'M' greentint -9.1528 2.4609 -7.0661 {"}'M' greentint -8.5239 3.3321 -6.4959 {"}'M' greentint -8.6797 3.2334 -6.6693 {"}'M' greentint -8.8258 3.0898 -6.8191 {"}'M' greentint -8.9566 2.9078 -6.9376 {"}'M' greentint -8.9162 2.7175 -7.2303 {"}'M' greentint -8.524 3.2607 -6.8745 {"}'M' greentint -8.6706 3.1136 -7.0243 {"}'M' greentint -8.8027 2.9306 -7.1443 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 101 A}'M' greentint -9.2838 2.3722 -6.1295 {"}'M' greentint -9.1425 2.523 -5.9879 {"}'M' greentint -9.0219 2.7173 -5.8862 {"}'M' greentint -9.328 2.235 -6.5773 {"}'M' greentint -9.1698 2.2987 -6.391 {"}'M' greentint -9.0196 2.4232 -6.2312 {"}'M' greentint -8.8864 2.5988 -6.1081 {"}'M' greentint -8.7812 2.8134 -6.0303 {"}'M' greentint -8.7077 3.0532 -6.0034 {"}'M' greentint -9.1192 2.2962 -6.7246 {"}'M' greentint -8.9586 2.3722 -6.5377 {"}'M' greentint -8.809 2.5176 -6.3853 {"}'M' greentint -8.6845 2.7175 -6.2795 {"}'M' greentint -8.5959 2.9551 -6.2315 {"}'M' greentint -8.5514 3.2098 -6.2442 {"}'M' greentint -9.0255 2.407 -6.9773 {"}'M' greentint -8.8632 2.452 -6.7793 {"}'M' greentint -8.709 2.5846 -6.6176 {"}'M' greentint -8.5847 2.7879 -6.513 {"}'M' greentint -8.5064 3.0336 -6.4809 {"}'M' greentint -8.4855 3.289 -6.5242 {"}'M' greentint -8.9145 2.5905 -7.1477 {"}'M' greentint -8.7535 2.6186 -6.9477 {"}'M' greentint -8.6055 2.7705 -6.7989 {"}'M' greentint -8.5107 3.0046 -6.7415 {"}'M' greentint -8.4944 3.2583 -6.7908 {"}'M' greentint -8.781 2.8084 -7.2012 {"}'M' greentint -8.6211 2.9053 -7.0218 {"}'M' greentint -8.5661 3.1586 -7.0216 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 86 A}'M' greentint -9.8842 1.1266 -4.2359 {"}'M' greentint -9.6693 1.4768 -4.0562 {"}'M' greentint -9.8293 1.3798 -4.2356 {"}'M' greentint -9.9396 1.2805 -4.5159 {"}'M' greentint -9.9559 1.0268 -4.4666 {"}'M' greentint -9.5358 1.6946 -4.1097 {"}'M' greentint -9.6968 1.6665 -4.3097 {"}'M' greentint -9.8448 1.5146 -4.4586 {"}'M' greentint -9.9114 1.3779 -4.7695 {"}'M' greentint -9.9618 1.1233 -4.7649 {"}'M' greentint -9.9531 0.8754 -4.6845 {"}'M' greentint -9.5063 1.8676 -4.3823 {"}'M' greentint -9.6665 1.7766 -4.5652 {"}'M' greentint -9.8079 1.606 -4.7007 {"}'M' greentint -9.8145 1.4522 -5.0095 {"}'M' greentint -9.8828 1.2032 -5.0272 {"}'M' greentint -9.9033 0.95 -4.9837 {"}'M' greentint -9.4118 1.96 -4.6297 {"}'M' greentint -9.5684 1.848 -4.8011 {"}'M' greentint -9.707 1.6732 -4.9319 {"}'M' greentint -9.6691 1.4717 -5.2271 {"}'M' greentint -9.7426 1.2319 -5.254 {"}'M' greentint -9.2805 1.9864 -4.8664 {"}'M' greentint -9.4308 1.862 -5.0263 {"}'M' greentint -9.5639 1.6864 -5.1494 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 101 A}'M' greentint -9.8331 0.9691 -4.4598 {"}'M' greentint -9.6927 1.1311 -4.3238 {"}'M' greentint -9.5708 1.3277 -4.2208 {"}'M' greentint -9.4724 1.5525 -4.1548 {"}'M' greentint -9.3998 1.7935 -4.1292 {"}'M' greentint -9.8775 0.9085 -4.8638 {"}'M' greentint -9.7197 1.0187 -4.6904 {"}'M' greentint -9.5743 1.1805 -4.5474 {"}'M' greentint -9.4497 1.3829 -4.4438 {"}'M' greentint -9.3532 1.616 -4.384 {"}'M' greentint -9.2895 1.8677 -4.3714 {"}'M' greentint -9.8065 1.0106 -5.1166 {"}'M' greentint -9.6468 1.0992 -4.9356 {"}'M' greentint -9.5001 1.2488 -4.788 {"}'M' greentint -9.3764 1.4486 -4.6833 {"}'M' greentint -9.2845 1.6827 -4.63 {"}'M' greentint -9.2326 1.9336 -4.6316 {"}'M' greentint -9.6883 1.1811 -5.2707 {"}'M' greentint -9.5312 1.277 -5.0933 {"}'M' greentint -9.3928 1.4476 -4.9618 {"}'M' greentint -9.2899 1.6711 -4.8909 {"}'M' greentint -9.2354 1.9208 -4.8906 {"}'M' greentint -9.5496 1.4072 -5.3447 {"}'M' greentint -9.3999 1.5609 -5.1939 {"}'M' greentint -9.3046 1.7972 -5.1364 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 58 1oi6A_122F_60R}P -8.0287 5.6895 -12.3673 {"}-8.0287 5.6895 -12.3673 { ca val A 58 1oi6A_122F_60R}-9.1188 5.655 -11.4279 { c val A 58 1oi6A_122F_60R}-8.6523 5.0227 -10.1146 { o val A 58 1oi6A_122F_60R}-7.9521 3.9865 -10.1001 { c val A 58 1oi6A_122F_60R}P -8.6523 5.0227 -10.1146 { n val A 59 1oi6A_122F_60R}-9.0722 5.6395 -9.0127 { ca val A 59 1oi6A_122F_60R}-8.8933 5.1134 -7.6877 { c val A 59 1oi6A_122F_60R}-10.2476 4.9626 -7.0692 { o val A 59 1oi6A_122F_60R}-10.943 5.9622 -6.9371 { c val A 59 1oi6A_122F_60R}P -10.2476 4.9626 -7.0692 { n arg A 60 1oi6A_122F_60R}-10.6224 3.7468 -6.7179 { ca arg A 60 1oi6A_122F_60R}-11.8693 3.4992 -6.0467 { c arg A 60 1oi6A_122F_60R}-11.5551 3.0881 -4.6296 { o arg A 60 1oi6A_122F_60R}-10.7226 2.2032 -4.4039 { c arg A 60 1oi6A_122F_60R}P -11.5551 3.0881 -4.6296 { n gly A 61 1oi6A_122F_60R}-12.2026 3.7061 -3.6819 { ca gly A 61 1oi6A_122F_60R}-12.0679 3.3281 -2.2889 { c gly A 61 1oi6A_122F_60R}-11.6851 4.5148 -1.4196 { o gly A 61 1oi6A_122F_60R}-11.6647 5.6336 -1.8931 { c gly A 61 1oi6A_122F_60R}P -11.6851 4.5148 -1.4196 { n ile A 62 1oi6A_122F_60R}-11.4398 4.3098 -0.1421 { ca ile A 62 1oi6A_122F_60R}-11.5285 3.0207 0.5129 { c ile A 62 1oi6A_122F_60R}-12.9818 2.7491 0.8271 { o ile A 62 1oi6A_122F_60R}-13.6962 3.5947 1.3989 { n his A 120 1oi6A_122F_60R}P -11.4116 -1.8058 1.2685 {"}-11.4116 -1.8058 1.2685 { ca his A 120 1oi6A_122F_60R}-10.9008 -2.1829 -0.0561 { c his A 120 1oi6A_122F_60R}-10.7114 -0.9302 -0.8846 { o his A 120 1oi6A_122F_60R}-11.5761 -0.0636 -0.8955 { c his A 120 1oi6A_122F_60R}P -10.7114 -0.9302 -0.8846 { n ala A 121 1oi6A_122F_60R}-9.5987 -0.8715 -1.597 { ca ala A 121 1oi6A_122F_60R}-9.369 0.1566 -2.5754 { c ala A 121 1oi6A_122F_60R}-8.5925 -0.4693 -3.7245 { o ala A 121 1oi6A_122F_60R}-7.9738 -1.4927 -3.5902 { c ala A 121 1oi6A_122F_60R}P -8.5925 -0.4693 -3.7245 { n phe A 122 1oi6A_122F_60R}-8.6203 0.1672 -4.8647 { ca phe A 122 1oi6A_122F_60R}-7.7327 -0.208 -5.9617 { c phe A 122 1oi6A_122F_60R}-7.5016 0.9661 -6.8759 { o phe A 122 1oi6A_122F_60R}-8.2596 1.9309 -6.9377 { c phe A 122 1oi6A_122F_60R}P -7.5016 0.9661 -6.8759 { n val A 123 1oi6A_122F_60R}-6.3911 0.8445 -7.5979 { ca val A 123 1oi6A_122F_60R}-6.039 1.759 -8.6412 { c val A 123 1oi6A_122F_60R}-5.921 1.0112 -9.9345 { o val A 123 1oi6A_122F_60R}-5.2623 -0.0093 -9.9923 { c val A 123 1oi6A_122F_60R}P -5.921 1.0112 -9.9345 { n ala A 124 1oi6A_122F_60R}-6.5751 1.5252 -10.9611 { ca ala A 124 1oi6A_122F_60R}-6.4686 0.9658 -12.2994 { c ala A 124 1oi6A_122F_60R}-5.2007 1.457 -12.9735 { o ala A 124 1oi6A_122F_60R}-4.9774 2.6602 -13.1207 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 58 1oi6A_122F_60R}P -8.0287 5.6895 -12.3673 { ca val A 58 1oi6A_122F_60R}P -9.1188 5.655 -11.4279 { n val A 59 1oi6A_122F_60R}P -9.0722 5.6395 -9.0127 { ca val A 59 1oi6A_122F_60R}P -8.8933 5.1134 -7.6877 { n arg A 60 1oi6A_122F_60R}P -10.6224 3.7468 -6.7179 { ca arg A 60 1oi6A_122F_60R}P -11.8693 3.4992 -6.0467 { n gly A 61 1oi6A_122F_60R}P -12.2026 3.7061 -3.6819 { ca gly A 61 1oi6A_122F_60R}P -12.0679 3.3281 -2.2889 {"}P -12.0679 3.3281 -2.2889 { n ile A 62 1oi6A_122F_60R}P -11.4398 4.3098 -0.1421 { ca ile A 62 1oi6A_122F_60R}P -11.5285 3.0207 0.5129 { n his A 120 1oi6A_122F_60R}P -11.4116 -1.8058 1.2685 { ca his A 120 1oi6A_122F_60R}P -10.9008 -2.1829 -0.0561 { n ala A 121 1oi6A_122F_60R}P -9.5987 -0.8715 -1.597 { ca ala A 121 1oi6A_122F_60R}P -9.369 0.1566 -2.5754 { n phe A 122 1oi6A_122F_60R}P -8.6203 0.1672 -4.8647 { ca phe A 122 1oi6A_122F_60R}P -7.7327 -0.208 -5.9617 { n val A 123 1oi6A_122F_60R}P -6.3911 0.8445 -7.5979 { ca val A 123 1oi6A_122F_60R}P -6.039 1.759 -8.6412 { n ala A 124 1oi6A_122F_60R}P -6.5751 1.5252 -10.9611 { ca ala A 124 1oi6A_122F_60R}P -6.4686 0.9658 -12.2994 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 58 1oi6A_122F_60R}P -9.1188 5.655 -11.4279 {"}-9.1188 5.655 -11.4279 { ca val A 59 1oi6A_122F_60R}-8.8933 5.1134 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{"}'S' blue -12.295 0.5128 -8.5511 {"}'S' sky -11.8773 0.629 -8.4014 {"}'S' sky -12.0332 0.6346 -8.6055 {"}'S' sky -12.1935 0.5984 -8.8028 {"}'S' sky -11.5987 0.6827 -8.4481 {"}'S' blue -11.007 0.4286 -8.0257 {"}'S' sky -11.1257 0.5622 -8.2167 {"}'S' sky -12.2055 0.4468 -9.5808 {"}'S' sky -10.8697 0.6246 -8.7664 {"}'S' sky -11.2255 0.3435 -9.9899 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 225 A}'S' sea -11.2947 0.3199 -6.5897 {"}'S' sea -11.0094 0.4182 -6.6391 {"}'S' green -11.1703 0.3657 -6.8316 {"}'S' sea -10.8262 0.4485 -6.8245 {"}'S' green -10.9901 0.3918 -7.0202 {"}'S' sea -10.8115 0.3754 -7.2132 { CE1 TYR 225 A}'S' green -12.1834 0.34 -6.7869 {"}'S' green -12.3364 0.3742 -6.9953 {"}'S' green -11.7963 0.3355 -6.6448 {"}'S' green -12.396 0.4449 -7.45 {"}'S' green -11.5307 0.3604 -6.6975 {"}'S' green -12.2715 0.4907 -7.6919 {"}'S' green -12.0913 0.5168 -7.8806 {"}'S' green -11.143 0.427 -7.0595 {"}'S' green -11.0722 0.4711 -7.4136 {"}'S' green -11.3784 0.5421 -7.8279 {"}'S' green -11.5402 0.5191 -8.0318 { CE2 TYR 225 A}'S' sea -10.5817 0.6696 -8.9263 {"}'S' green -10.7376 0.6751 -9.1304 {"}'S' green -10.898 0.6389 -9.3277 {"}'S' green -10.3031 0.7232 -8.9731 {"}'S' green -10.455 0.7504 -9.1767 {"}'S' green -10.6127 0.7373 -9.3772 {"}'S' green -10.7735 0.6847 -9.5696 {"}'S' green -10.9308 0.595 -9.7487 {"}'S' sea -11.084 0.4695 -9.9106 {"}'S' green -10.1113 0.762 -9.1504 {"}'S' green -10.2679 0.785 -9.3577 {"}'S' green -10.4295 0.7675 -9.5626 {"}'S' green -10.5934 0.7108 -9.7583 {"}'S' green -10.7545 0.6171 -9.9401 {"}'S' sea -10.9099 0.4874 -10.1058 {"}'S' sea -9.9321 0.765 -9.347 {"}'S' sea -10.089 0.7794 -9.5545 {"}'S' sea -10.2511 0.7559 -9.757 {"}'S' sea -10.4147 0.6945 -9.9513 { CZ TYR 225 A}'S' sea -11.981 0.4935 -8.1397 {"}'S' sea -11.7293 0.5792 -8.1964 {"}'S' sea -11.3283 0.5138 -8.0503 {"}'S' sea -11.4562 0.6168 -8.2453 {"}'S' sea -11.7506 0.7098 -8.6517 {"}'S' green -11.9082 0.6967 -8.8522 {"}'S' green -12.0691 0.6442 -9.0447 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-7.5903 { cd1 tyr A 432 1orvA_417Y_432}P -10.7797 3.1008 -9.7109 { cd2 tyr A 432 1orvA_417Y_432}P -13.1708 3.1023 -9.6112 { ce1 tyr A 432 1orvA_417Y_432}P -10.8246 3.6146 -11.0003 { ce2 tyr A 432 1orvA_417Y_432}P -13.2244 3.6147 -10.9172 { oh tyr A 432 1orvA_417Y_432}P -12.0567 4.4153 -12.8585 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 417 A}'S' blue -10.2698 0.1306 -7.2219 { CD1 TYR 417 A}'S' blue -10.1614 0.289 -7.4533 {"}'S' sky -10.3191 0.289 -7.6569 {"}'S' blue -9.9615 0.4532 -7.5098 {"}'S' sky -10.1158 0.4709 -7.7145 {"}'S' blue -9.8815 0.6141 -7.7703 {"}'S' sky -10.0425 0.5992 -7.9734 {"}'S' blue -9.941 0.6848 -8.2251 { CD2 TYR 417 A}'S' blue -10.8787 0.1347 -6.6947 {"}'S' blue -10.7 0.1183 -6.8877 {"}'S' blue -10.4907 0.0764 -7.0397 {"}'S' blue -10.6519 -0.0201 -7.2209 { CE1 TYR 417 A}'S' blue -11.3887 0.6142 -8.9008 {"}'S' blue -11.1244 0.7625 -8.9596 {"}'S' sky -10.6814 0.8739 -8.8085 { CE2 TYR 417 A}'S' blue -11.9296 0.2517 -6.8386 {"}'S' blue -12.0873 0.2386 -7.0391 {"}'S' blue -12.2481 0.186 -7.2316 {"}'S' sky -11.5859 0.2633 -6.8123 {"}'S' sky -11.7425 0.2863 -7.0197 {"}'S' sky -11.9041 0.2688 -7.2246 {"}'S' sky -11.2576 0.2133 -6.8016 {"}'S' sky -11.0488 0.1664 -6.9533 {"}'S' blue -10.8365 0.0742 -7.0812 {"}'S' blue -10.7762 0.0082 -7.399 { CZ TYR 417 A}'S' blue -12.2131 0.1809 -7.4132 {"}'S' sky -12.3553 0.2513 -7.6152 {"}'S' blue -12.5096 0.269 -7.8198 {"}'S' sky -11.9824 0.2971 -7.4645 {"}'S' sky -12.4363 0.3972 -8.0787 {"}'S' sky -12.3349 0.4829 -8.3304 {"}'S' sky -12.2104 0.5286 -8.5723 {"}'S' sky -12.0302 0.5548 -8.761 {"}'S' sky -11.688 0.5998 -8.7597 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 417 A}'S' sea -10.5508 0.2847 -7.7265 {"}'S' green -10.6497 0.4504 -7.9012 {"}'S' green -11.0648 0.6918 -8.5049 {"}'S' sea -11.2259 0.6769 -8.7079 {"}'S' green -10.4072 0.524 -7.966 {"}'S' green -10.5248 0.6531 -8.1544 {"}'S' green -10.6602 0.7433 -8.3532 {"}'S' green -10.8081 0.7931 -8.5582 {"}'S' sea -10.964 0.7987 -8.7623 {"}'S' sea -10.2591 0.6779 -8.2071 {"}'S' green -10.3871 0.7809 -8.4021 {"}'S' sea -10.5295 0.8468 -8.605 { CE2 TYR 417 A}'S' sea -11.4067 0.2663 -7.009 {"}'S' sea -11.5636 0.2807 -7.2164 {"}'S' sea -11.1974 0.2202 -7.1602 {"}'S' sea -10.9841 0.1338 -7.2881 { CZ TYR 417 A}'S' sea -12.1223 0.378 -7.6673 {"}'S' sea -12.2753 0.4122 -7.8757 {"}'S' green -11.7352 0.3735 -7.5252 {"}'S' green -11.8706 0.4637 -7.724 {"}'S' green -12.0186 0.5135 -7.929 {"}'S' green -12.1745 0.5191 -8.1331 {"}'S' green -11.3569 0.2606 -7.3942 {"}'S' green -11.74 0.5672 -7.9758 {"}'S' green -11.8919 0.5943 -8.1794 {"}'S' green -12.0496 0.5812 -8.3799 {"}'S' green -11.1483 0.313 -7.5534 {"}'S' green -11.7048 0.6289 -8.3604 {"}'S' sea -11.8663 0.6114 -8.5653 {"}'S' sea -10.8546 0.184 -7.5668 {"}'S' green -10.9596 0.3403 -7.746 {"}'S' green -11.3689 0.609 -8.3497 {"}'S' sea -11.5258 0.6233 -8.5572 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 417 A}'S' P -10.7719 0.5767 -8.0937 {"}'S' -10.7658 0.5518 -8.1103 {"}'S' P -10.9118 0.6576 -8.2965 {"}'S' -10.9057 0.6391 -8.3061 { CZ TYR 417 A}'S' P -11.4696 0.3983 -7.5779 {"}'S' -11.4696 0.3895 -7.5827 {"}'S' P -11.5976 0.5013 -7.7729 {"}'S' -11.5981 0.4787 -7.7822 {"}'S' P -11.267 0.4467 -7.7444 {"}'S' -11.2775 0.4023 -7.7639 {"}'S' P -11.4013 0.5451 -7.9454 {"}'S' -11.4092 0.492 -7.961 {"}'S' P -11.5481 0.6059 -8.153 {"}'S' -11.5486 0.5941 -8.1544 {"}'S' P -11.0819 0.4649 -7.9399 {"}'S' -11.0948 0.43 -7.9512 {"}'S' P -11.2198 0.556 -8.1424 {"}'S' -11.2276 0.5236 -8.1472 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 432 A}'S' sky -12.4884 0.6603 -7.723 {"}'S' sky -12.3393 0.6073 -7.5156 {"}'S' blue -12.1816 0.5928 -7.3087 {"}'S' blue -12.0195 0.6163 -7.1062 {"}'S' blue -11.8567 0.6779 -6.9114 {"}'S' sky -12.4262 0.7101 -8.0902 {"}'S' sky -11.8207 0.5702 -7.27 {"}'S' sky -12.2947 0.7838 -8.3699 {"}'S' blue -12.1503 0.916 -8.6351 {"}'S' sky -11.5889 0.9362 -8.6635 {"}'S' blue -11.3505 1.0423 -8.702 { CG TYR 432 A}'S' blue -11.3155 1.2142 -9.189 {"}'S' blue -11.1541 1.2731 -8.9972 { HB2 TYR 432 A}'S' sky -11.6817 0.5378 -7.1956 {"}'S' sky -11.5243 0.5557 -6.9965 {"}'S' blue -11.3661 0.6325 -6.8133 {"}'S' sky -11.142 0.5267 -6.9049 {"}'S' blue -10.843 0.5322 -6.952 {"}'S' blue -10.7363 0.4391 -7.219 {"}'S' sky -11.3396 0.8606 -8.5259 {"}'S' blue -10.4239 0.5929 -7.2679 {"}'S' sky -10.3175 0.6349 -7.5098 {"}'S' sky -10.2419 0.7306 -7.7462 {"}'S' blue -10.1048 0.8988 -7.616 {"}'S' sky -10.6045 1.1308 -8.5569 {"}'S' blue -10.0891 1.0021 -7.8556 {"}'S' sky -10.2783 1.0451 -8.2556 { HB3 TYR 432 A}'S' blue -12.6119 0.7056 -7.5893 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 432 A}'S' sea -12.2888 0.6183 -7.8882 {"}'S' sea -12.1401 0.5645 -7.6813 {"}'S' sea -11.9828 0.5482 -7.4729 {"}'S' green -12.168 0.6682 -8.1737 {"}'S' green -12.0259 0.5898 -7.9684 {"}'S' green -11.8736 0.5489 -7.7611 {"}'S' sea -12.0386 0.7767 -8.4522 {"}'S' green -11.9102 0.6731 -8.2565 {"}'S' green -11.769 0.6063 -8.0552 {"}'S' sea -11.8257 0.8541 -8.5891 {"}'S' green -11.6984 0.7448 -8.3935 { HB2 TYR 432 A}'S' green -11.7492 0.517 -7.6864 {"}'S' green -11.6118 0.4355 -7.4869 {"}'S' green -11.4599 0.4097 -7.2836 {"}'S' sea -11.3005 0.4401 -7.0863 {"}'S' green -11.6969 0.6164 -8.0785 {"}'S' green -11.3101 0.3396 -7.5021 {"}'S' green -11.1546 0.3516 -7.3042 {"}'S' sea -10.9959 0.4161 -7.1175 {"}'S' green -11.5465 0.7371 -8.3499 {"}'S' green -11.0537 0.3229 -7.5973 {"}'S' sea -10.8943 0.3534 -7.4 {"}'S' green -11.2685 0.6643 -8.3806 {"}'S' green -10.8902 0.3677 -7.8078 {"}'S' sea -10.732 0.3855 -7.6093 {"}'S' sea -11.0968 0.9543 -8.6068 {"}'S' green -11.0323 0.7454 -8.4642 {"}'S' green -10.638 0.4675 -7.8771 {"}'S' sea -10.4747 0.5165 -7.6806 {"}'S' sea -10.8492 1.0635 -8.6232 {"}'S' green -10.7941 0.8522 -8.4945 {"}'S' green -10.3981 0.6352 -7.9207 {"}'S' green -10.5367 0.9224 -8.4115 {"}'S' green -10.4033 0.8196 -8.2109 {"}'S' sea -10.2397 0.8482 -8.0075 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 432 A}'S' P -11.5881 0.4757 -7.8994 {"}'S' -11.5747 0.5045 -7.8894 {"}'S' P -11.4574 0.3813 -7.7044 {"}'S' -11.4468 0.4158 -7.6994 {"}'S' P -11.4588 0.561 -8.1865 {"}'S' -11.4519 0.578 -8.1758 {"}'S' P -11.3427 0.4292 -8.0011 {"}'S' -11.3314 0.482 -7.979 {"}'S' P -11.2061 0.3479 -7.801 {"}'S' -11.2023 0.395 -7.7911 {"}'S' P -11.1659 0.5115 -8.2055 {"}'S' -11.1656 0.5272 -8.1949 {"}'S' P -11.0375 0.4108 -8.0103 {"}'S' -11.0389 0.4356 -8.0009 {"}'S' P -10.9286 0.5866 -8.2862 {"}'S' -10.9325 0.607 -8.2706 {"}'S' P -10.7937 0.4918 -8.0853 {"}'S' -10.8012 0.5168 -8.0722 {"}'S' P -10.6915 0.6995 -8.3194 {"}'S' -10.6952 0.7067 -8.3124 {"}'S' P -10.5544 0.6245 -8.12 {"}'S' -10.5551 0.626 -8.1197 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 417 A}'M' greentint -9.1191 2.4363 -5.9481 {"}'M' greentint 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{"}'S' green -11.3366 0.4698 -8.6206 {"}'S' green -10.7222 0.6207 -7.8683 {"}'S' green -11.2218 0.5177 -8.9173 {"}'S' sea -10.4654 0.6634 -7.98 {"}'S' sea -11.0451 0.6 -9.1217 {"}'S' green -10.9166 0.4992 -8.9266 {"}'S' green -10.7694 0.4562 -8.724 {"}'S' green -10.6112 0.474 -8.5256 {"}'S' green -10.4535 0.55 -8.3427 {"}'S' sea -10.8078 0.6751 -9.2025 {"}'S' sea -10.6729 0.5803 -9.0016 {"}'S' sea -10.5172 0.556 -8.7934 {"}'S' sea -10.3539 0.605 -8.5968 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 ARG 20 I}'S' P -11.3391 0.4982 -8.1998 {"}'S' -11.3319 0.5213 -8.2056 {"}'S' P -11.1797 0.5286 -8.0026 {"}'S' -11.1763 0.5492 -8.0113 {"}'S' P -11.1893 0.4281 -8.4183 {"}'S' -11.1802 0.4819 -8.4217 {"}'S' P -11.0338 0.4401 -8.2205 {"}'S' -11.0311 0.5063 -8.2353 {"}'S' P -10.8751 0.5046 -8.0337 {"}'S' -10.8792 0.5368 -8.0467 {"}'S' P -11.0853 0.4364 -8.7172 {"}'S' -11.0845 0.4475 -8.7153 {"}'S' P -10.9329 0.4114 -8.5135 {"}'S' -10.9356 0.4656 -8.5125 {"}'S' P -10.7735 0.4418 -8.3163 {"}'S' -10.7835 0.491 -8.3241 {"}'S' P -10.6155 0.5276 -8.1353 {"}'S' -10.6159 0.5282 -8.136 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 33 I}'M' green -8.988 1.9373 -6.3864 {"}'M' green -8.7457 2.3329 -6.1832 {"}'M' green -9.0546 1.8301 -6.6324 {"}'M' green -8.5965 2.563 -6.2453 {"}'M' green -8.8608 2.0637 -7.3864 {"}'M' green -8.3877 2.8362 -6.9896 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 33 I}'M' greentint -8.8943 2.176 -6.3317 {"}'M' greentint -8.998 2.0796 -6.6291 {"}'M' greentint -8.7551 2.4699 -6.4237 {"}'M' greentint -8.8943 2.3019 -6.5569 {"}'M' greentint -8.9676 2.1736 -6.8739 {"}'M' greentint -9.0388 1.9285 -6.8981 {"}'M' greentint -8.5697 2.6939 -6.5052 {"}'M' greentint -8.7245 2.5708 -6.6698 {"}'M' greentint -8.8602 2.3933 -6.796 {"}'M' greentint -8.8898 2.2538 -7.1122 {"}'M' greentint -8.971 2.0107 -7.1506 {"}'M' greentint -8.4888 2.7899 -6.7429 {"}'M' greentint -8.6411 2.654 -6.9029 {"}'M' greentint -8.7777 2.4724 -7.0277 {"}'M' greentint -8.7753 2.2986 -7.3418 {"}'M' greentint -8.5339 2.6926 -7.1395 {"}'M' greentint -8.6647 2.5107 -7.2579 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ARG 20 I}'M' green -9.084 1.8276 -6.6463 {"}'M' green -8.6219 2.5821 -6.2588 {"}'M' green -8.6952 2.3373 -7.4566 {"}'M' green -8.4803 2.6875 -7.2769 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 20 I}'M' greentint -8.9337 1.9521 -6.4865 {"}'M' greentint -8.8006 2.1277 -6.3634 {"}'M' greentint -8.6954 2.3423 -6.2857 {"}'M' greentint -9.0334 1.8251 -6.9799 {"}'M' greentint -8.8727 1.9011 -6.7931 {"}'M' greentint -8.7232 2.0465 -6.6407 {"}'M' greentint -8.5986 2.2464 -6.5348 {"}'M' greentint -8.51 2.484 -6.4868 {"}'M' greentint -8.4655 2.7388 -6.4995 {"}'M' greentint -8.9397 1.936 -7.2326 {"}'M' greentint -8.7774 1.9809 -7.0347 {"}'M' greentint -8.6231 2.1135 -6.8729 {"}'M' greentint -8.4989 2.3168 -6.7683 {"}'M' greentint -8.4206 2.5625 -6.7362 {"}'M' greentint -8.3996 2.8179 -6.7795 {"}'M' greentint -8.8287 2.1194 -7.403 {"}'M' greentint -8.6677 2.1475 -7.2031 {"}'M' greentint -8.5197 2.2994 -7.0542 {"}'M' greentint -8.4249 2.5336 -6.9969 {"}'M' greentint -8.4086 2.7873 -7.0462 {"}'M' greentint -8.5352 2.4342 -7.2771 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 33 I}'M' greentint -9.5746 1.0017 -4.4421 {"}'M' greentint -9.7079 0.898 -4.6416 {"}'M' greentint -9.4929 1.2482 -4.462 {"}'M' greentint -9.6529 1.1513 -4.6414 {"}'M' greentint -9.7633 1.0519 -4.9216 {"}'M' greentint -9.7796 0.7982 -4.8723 {"}'M' greentint -9.7129 0.5929 -4.7293 {"}'M' greentint -9.5205 1.438 -4.7155 {"}'M' greentint -9.6685 1.2861 -4.8643 {"}'M' greentint -9.735 1.1494 -5.1753 {"}'M' greentint -9.7854 0.8947 -5.1706 {"}'M' greentint -9.7767 0.6469 -5.0902 {"}'M' greentint -9.3299 1.6391 -4.788 {"}'M' greentint -9.4902 1.548 -4.9709 {"}'M' greentint -9.6316 1.3775 -5.1064 {"}'M' greentint -9.6382 1.2237 -5.4153 {"}'M' greentint -9.7064 0.9747 -5.433 {"}'M' greentint -9.7269 0.7214 -5.3895 {"}'M' greentint -9.3921 1.6194 -5.2069 {"}'M' greentint -9.5307 1.4447 -5.3376 {"}'M' greentint -9.4928 1.2432 -5.6329 {"}'M' greentint -9.5663 1.0034 -5.6598 {"}'M' greentint -9.5993 0.7543 -5.6343 {"}'M' greentint -9.3876 1.4578 -5.5551 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 20 I}'M' green -9.7067 0.5908 -4.7014 {"}'M' green -9.7336 0.4785 -5.068 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 20 I}'M' greentint -9.5847 0.7874 -4.5984 {"}'M' greentint -9.4864 1.0123 -4.5324 {"}'M' greentint -9.4137 1.2533 -4.5069 {"}'M' greentint -9.5882 0.6402 -4.925 {"}'M' greentint -9.4636 0.8426 -4.8214 {"}'M' greentint -9.3672 1.0757 -4.7616 {"}'M' greentint -9.3034 1.3275 -4.749 {"}'M' greentint -9.2761 1.5822 -4.7836 {"}'M' greentint -9.6608 0.559 -5.3132 {"}'M' greentint -9.5141 0.7086 -5.1656 {"}'M' greentint -9.3903 0.9083 -5.0609 {"}'M' greentint -9.2985 1.1425 -5.0076 {"}'M' greentint -9.2465 1.3934 -5.0092 {"}'M' greentint -9.2366 1.6436 -5.0665 {"}'M' greentint -9.5452 0.7368 -5.471 {"}'M' greentint -9.4067 0.9073 -5.3394 {"}'M' greentint -9.3038 1.1308 -5.2686 {"}'M' greentint -9.2494 1.3805 -5.2683 {"}'M' greentint -9.2497 1.6275 -5.337 {"}'M' greentint -9.4138 1.0207 -5.5715 {"}'M' greentint -9.3185 1.257 -5.514 {"}'M' greentint -9.3021 1.5135 -5.5639 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 419 1pamA_421Y_432}P -11.8553 -2.1649 0.4347 {"}-11.8553 -2.1649 0.4347 { ca ile A 419 1pamA_421Y_432}-10.8043 -2.3124 -0.5405 { c ile A 419 1pamA_421Y_432}-10.6426 -0.9629 -1.2377 { o ile A 419 1pamA_421Y_432}-11.6136 -0.2006 -1.3905 { c ile A 419 1pamA_421Y_432}P -10.6426 -0.9629 -1.2377 { n ile A 420 1pamA_421Y_432}-9.4112 -0.5664 -1.5727 { ca ile A 420 1pamA_421Y_432}-9.1809 0.6284 -2.3697 { c ile A 420 1pamA_421Y_432}-8.2857 0.1062 -3.4775 { o ile A 420 1pamA_421Y_432}-7.2089 -0.4398 -3.1849 { c ile A 420 1pamA_421Y_432}P -8.2857 0.1062 -3.4775 { n tyr A 421 1pamA_421Y_432}-8.7001 0.1725 -4.7306 { ca tyr A 421 1pamA_421Y_432}-7.8591 -0.3266 -5.7895 { c tyr A 421 1pamA_421Y_432}-7.6482 0.7706 -6.7821 { o tyr A 421 1pamA_421Y_432}-8.4243 1.7187 -6.8784 { c tyr A 421 1pamA_421Y_432}P -7.6482 0.7706 -6.7821 { n glu A 422 1pamA_421Y_432}-6.5712 0.6028 -7.5103 { ca glu A 422 1pamA_421Y_432}-6.1721 1.5365 -8.5093 { c glu A 422 1pamA_421Y_432}-6.1433 0.8397 -9.8436 { o glu A 422 1pamA_421Y_432}-5.6952 -0.3094 -9.9395 { c glu A 422 1pamA_421Y_432}P -6.1433 0.8397 -9.8436 { n arg A 423 1pamA_421Y_432}-6.5692 1.5239 -10.8758 { ca arg A 423 1pamA_421Y_432}-6.5336 1.0388 -12.2237 { c arg A 423 1pamA_421Y_432}-5.5199 1.9607 -12.8634 { o arg A 423 1pamA_421Y_432}-5.6249 3.1792 -12.7092 { n ala A 430 1pamA_421Y_432}P -7.2163 5.6493 -12.0936 {"}-7.2163 5.6493 -12.0936 { ca ala A 430 1pamA_421Y_432}-8.4765 5.7859 -11.3796 { c ala A 430 1pamA_421Y_432}-8.2785 5.0459 -10.0566 { o ala A 430 1pamA_421Y_432}-7.6448 3.9863 -9.9859 { c ala A 430 1pamA_421Y_432}P -8.2785 5.0459 -10.0566 { n val A 431 1pamA_421Y_432}-8.7567 5.5788 -8.9385 { ca val A 431 1pamA_421Y_432}-8.6631 4.947 -7.6341 { c val A 431 1pamA_421Y_432}-10.1009 4.84 -7.1244 { o val A 431 1pamA_421Y_432}-10.8867 5.7996 -7.2367 { c val A 431 1pamA_421Y_432}P -10.1009 4.84 -7.1244 { n val A 432 1pamA_421Y_432}-10.4739 3.6813 -6.5734 { ca val A 432 1pamA_421Y_432}-11.8294 3.4278 -6.1484 { c val A 432 1pamA_421Y_432}-11.7387 2.9038 -4.7496 { o val A 432 1pamA_421Y_432}-10.9621 1.9808 -4.4823 { c val A 432 1pamA_421Y_432}P -11.7387 2.9038 -4.7496 { n ala A 433 1pamA_421Y_432}-12.5224 3.4825 -3.8594 { ca ala A 433 1pamA_421Y_432}-12.5278 3.0519 -2.4955 { c ala A 433 1pamA_421Y_432}-13.9123 2.5765 -2.1672 { o ala A 433 1pamA_421Y_432}-14.867 3.321 -2.4423 { c ala A 433 1pamA_421Y_432}P -13.9123 2.5765 -2.1672 { n ile A 434 1pamA_421Y_432}-14.0905 1.3956 -1.5858 { ca ile A 434 1pamA_421Y_432}-15.417 1.0041 -1.2126 { c ile A 434 1pamA_421Y_432}-15.3673 0.3504 0.1682 { o ile A 434 1pamA_421Y_432}-14.4928 -0.4643 0.4899 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 419 1pamA_421Y_432}P -11.8553 -2.1649 0.4347 { ca ile A 419 1pamA_421Y_432}P -10.8043 -2.3124 -0.5405 { n ile A 420 1pamA_421Y_432}P -9.4112 -0.5664 -1.5727 { ca ile A 420 1pamA_421Y_432}P -9.1809 0.6284 -2.3697 { n tyr A 421 1pamA_421Y_432}P -8.7001 0.1725 -4.7306 { ca tyr A 421 1pamA_421Y_432}P -7.8591 -0.3266 -5.7895 { n glu A 422 1pamA_421Y_432}P -6.5712 0.6028 -7.5103 { ca glu A 422 1pamA_421Y_432}P -6.1721 1.5365 -8.5093 { n arg A 423 1pamA_421Y_432}P -6.5692 1.5239 -10.8758 { ca arg A 423 1pamA_421Y_432}P -6.5336 1.0388 -12.2237 { n ala A 430 1pamA_421Y_432}P -7.2163 5.6493 -12.0936 { ca ala A 430 1pamA_421Y_432}P -8.4765 5.7859 -11.3796 { n val A 431 1pamA_421Y_432}P -8.7567 5.5788 -8.9385 { ca val A 431 1pamA_421Y_432}P -8.6631 4.947 -7.6341 { n val A 432 1pamA_421Y_432}P -10.4739 3.6813 -6.5734 { ca val A 432 1pamA_421Y_432}P -11.8294 3.4278 -6.1484 { n ala A 433 1pamA_421Y_432}P -12.5224 3.4825 -3.8594 { ca ala A 433 1pamA_421Y_432}P -12.5278 3.0519 -2.4955 { n ile A 434 1pamA_421Y_432}P -14.0905 1.3956 -1.5858 { ca ile A 434 1pamA_421Y_432}P -15.417 1.0041 -1.2126 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 419 1pamA_421Y_432}P -10.8043 -2.3124 -0.5405 {"}-10.8043 -2.3124 -0.5405 { ca ile A 420 1pamA_421Y_432}-9.1809 0.6284 -2.3697 { ca tyr A 421 1pamA_421Y_432}-7.8591 -0.3266 -5.7895 { ca glu A 422 1pamA_421Y_432}-6.1721 1.5365 -8.5093 { ca arg A 423 1pamA_421Y_432}-6.5336 1.0388 -12.2237 { ca ala A 430 1pamA_421Y_432}P -8.4765 5.7859 -11.3796 {"}-8.4765 5.7859 -11.3796 { ca val A 431 1pamA_421Y_432}-8.6631 4.947 -7.6341 { ca val A 432 1pamA_421Y_432}-11.8294 3.4278 -6.1484 { ca ala A 433 1pamA_421Y_432}-12.5278 3.0519 -2.4955 { ca ile A 434 1pamA_421Y_432}-15.417 1.0041 -1.2126 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 421 1pamA_421Y_432}P -7.8591 -0.3266 -5.7895 { cb tyr A 421 1pamA_421Y_432}-8.4792 -1.5505 -6.5028 { cg tyr A 421 1pamA_421Y_432}-9.8984 -1.4075 -7.0262 { cd1 tyr A 421 1pamA_421Y_432}-10.9525 -1.7043 -6.1554 { ce1 tyr A 421 1pamA_421Y_432}-12.2745 -1.5562 -6.5761 { cz tyr A 421 1pamA_421Y_432}-12.5195 -1.1079 -7.8693 { oh tyr A 421 1pamA_421Y_432}-13.8379 -0.9292 -8.2306 { cg tyr A 421 1pamA_421Y_432}P -9.8984 -1.4075 -7.0262 { cd2 tyr A 421 1pamA_421Y_432}-10.1501 -0.9628 -8.3244 { ce2 tyr A 421 1pamA_421Y_432}-11.4733 -0.8125 -8.7643 { cz tyr A 421 1pamA_421Y_432}ghost -12.5195 -1.1079 -7.8693 { ca val A 432 1pamA_421Y_432}P -11.8294 3.4278 -6.1484 { cb val A 432 1pamA_421Y_432}-12.4927 2.3774 -7.0476 { cg1 val A 432 1pamA_421Y_432}-13.9367 2.2256 -6.6198 { cb val A 432 1pamA_421Y_432}P -12.4927 2.3774 -7.0476 { cg2 val A 432 1pamA_421Y_432}-12.4074 2.7679 -8.5051 @vectorlist {sc H} off 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{"}'S' sky -12.1852 0.1686 -6.2957 {"}'S' sky -11.8569 0.1187 -6.285 {"}'S' sky -11.6481 0.0718 -6.4366 {"}'S' sky -11.5834 0.0391 -6.7714 { CE2 TYR 421 A}'S' sky -12.1111 0.7186 -8.2065 {"}'S' sky -12.2721 0.7037 -8.4095 {"}'S' blue -12.4349 0.641 -8.6024 {"}'S' blue -12.5935 0.532 -8.7772 {"}'S' sky -11.2809 0.1921 -7.3447 {"}'S' sky -11.8543 0.8199 -8.2598 {"}'S' sky -12.3313 0.7109 -8.8459 {"}'S' sky -12.4864 0.5922 -9.0137 {"}'S' blue -12.632 0.4381 -9.1587 {"}'S' sky -11.0994 0.398 -7.5572 {"}'S' sky -11.5758 0.8736 -8.3066 {"}'S' sky -12.0462 0.8351 -8.9031 {"}'S' sky -12.2034 0.7453 -9.0822 {"}'S' sky -12.3566 0.6199 -9.2441 {"}'S' blue -12.5002 0.4613 -9.3854 {"}'S' blue -11.3839 0.9123 -8.4839 {"}'S' sky -11.5405 0.9353 -8.6912 {"}'S' sky -11.7021 0.9179 -8.8961 {"}'S' sky -11.866 0.8612 -9.0918 {"}'S' sky -12.0271 0.7675 -9.2735 {"}'S' blue -12.1826 0.6377 -9.4393 {"}'S' blue -11.3616 0.9297 -8.888 {"}'S' blue -11.5237 0.9063 -9.0905 { CZ TYR 421 A}'S' blue -13.5949 0.0981 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-9.6463 2.2421 -6.4398 {"}'M' greentint -9.75 2.1457 -6.7373 {"}'M' greentint -9.0527 2.5582 -5.9518 {"}'M' greentint -9.1905 2.6375 -6.1514 {"}'M' greentint -9.3484 2.6291 -6.3534 {"}'M' greentint -9.507 2.536 -6.5319 {"}'M' greentint -9.6463 2.368 -6.665 {"}'M' greentint -9.7196 2.2398 -6.982 {"}'M' greentint -9.0053 2.8076 -6.2174 {"}'M' greentint -9.1615 2.8183 -6.4213 {"}'M' greentint -9.3217 2.76 -6.6133 {"}'M' greentint -9.4764 2.637 -6.7779 {"}'M' greentint -9.6122 2.4594 -6.9041 {"}'M' greentint -8.9182 2.9617 -6.4634 {"}'M' greentint -9.0783 2.9376 -6.6647 {"}'M' greentint -9.2408 2.8561 -6.8511 {"}'M' greentint -9.393 2.7201 -7.011 {"}'M' greentint -9.5297 2.5385 -7.1358 {"}'M' greentint -9.1397 2.9023 -7.0977 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 432 A}'M' greentint -9.6982 1.9292 -6.3777 {"}'M' greentint -9.54 1.9929 -6.1914 {"}'M' greentint -9.3897 2.1173 -6.0316 {"}'M' greentint -9.6476 1.9882 -6.7288 {"}'M' greentint 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green -10.1701 0.8137 -4.263 {"}'M' green -9.7274 1.5422 -5.0648 {"}'M' green -9.8856 1.4785 -5.2511 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 421 A}'M' greentint -10.356 0.7223 -4.421 {"}'M' greentint -10.2743 0.9688 -4.4408 {"}'M' greentint -10.4343 0.8719 -4.6203 {"}'M' greentint -10.5447 0.7726 -4.9005 {"}'M' greentint -10.0091 1.0849 -4.2962 {"}'M' greentint -10.1408 1.1867 -4.4944 {"}'M' greentint -10.3018 1.1586 -4.6943 {"}'M' greentint -10.4499 1.0067 -4.8432 {"}'M' greentint -10.5164 0.87 -5.1541 {"}'M' greentint -9.8175 1.2617 -4.3601 {"}'M' greentint -9.9524 1.3566 -4.561 {"}'M' greentint -10.1113 1.3597 -4.7669 {"}'M' greentint -10.2716 1.2686 -4.9498 {"}'M' greentint -10.413 1.0981 -5.0853 {"}'M' greentint -9.7039 1.4558 -4.6114 {"}'M' greentint -9.8555 1.4913 -4.8165 {"}'M' greentint -10.0169 1.4521 -5.0144 {"}'M' greentint -10.1735 1.34 -5.1858 {"}'M' greentint -10.3121 1.1653 -5.3165 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 432 A}'M' green -10.4867 0.6646 -4.5369 {"}'M' green -10.3286 0.7386 -4.3531 {"}'M' green -10.1768 0.8593 -4.1903 {"}'M' green -9.7201 1.3388 -4.4138 {"}'M' green -10.3292 1.1371 -5.4036 {"}'M' green -9.9439 1.498 -5.313 {"}'M' green -9.7852 1.5953 -5.1354 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 432 A}'M' greentint -10.541 0.7476 -4.9941 {"}'M' greentint -10.3838 0.743 -4.7885 {"}'M' greentint -10.2212 0.7987 -4.5943 {"}'M' greentint -10.0634 0.9089 -4.4208 {"}'M' greentint -9.918 1.0707 -4.2779 {"}'M' greentint -10.4575 0.9254 -5.252 {"}'M' greentint -10.3095 0.8784 -5.0476 {"}'M' greentint -10.1503 0.9008 -4.8471 {"}'M' greentint -9.9906 0.9894 -4.6661 {"}'M' greentint -9.8439 1.139 -4.5185 {"}'M' greentint -10.1908 1.0603 -5.202 {"}'M' greentint -10.032 1.0713 -5.0012 {"}'M' greentint -9.875 1.1672 -4.8238 {"}'M' greentint -9.7365 1.3378 -4.6923 {"}'M' greentint -10.0565 1.2682 -5.2778 {"}'M' greentint -9.8934 1.2974 -5.0752 {"}'M' greentint -9.7436 1.4511 -4.9244 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 85 1pfzA_102F_87S}P -6.0714 5.7396 -11.2261 {"}-6.0714 5.7396 -11.2261 { ca phe A 85 1pfzA_102F_87S}-6.7276 6.417 -10.1142 { c phe A 85 1pfzA_102F_87S}-7.3251 5.3809 -9.1768 { o phe A 85 1pfzA_102F_87S}-7.5859 4.2446 -9.573 { c phe A 85 1pfzA_102F_87S}P -7.3251 5.3809 -9.1768 { n phe A 86 1pfzA_102F_87S}-7.5398 5.776 -7.9286 { ca phe A 86 1pfzA_102F_87S}-8.1033 4.8781 -6.937 { c phe A 86 1pfzA_102F_87S}-9.6063 4.693 -7.0796 { o phe A 86 1pfzA_102F_87S}-10.3238 5.606 -7.4671 { c phe A 86 1pfzA_102F_87S}P -9.6063 4.693 -7.0796 { n ser A 87 1pfzA_102F_87S}-10.0652 3.4846 -6.7901 { ca ser A 87 1pfzA_102F_87S}-11.4822 3.1616 -6.8263 { c ser A 87 1pfzA_102F_87S}-11.6993 2.2119 -5.6708 { o ser A 87 1pfzA_102F_87S}-10.76 1.5674 -5.2037 { c ser A 87 1pfzA_102F_87S}P -11.6993 2.2119 -5.6708 { n lys A 88 1pfzA_102F_87S}-12.9318 2.1354 -5.1967 { ca lys A 88 1pfzA_102F_87S}-13.2397 1.2479 -4.0992 { c lys A 88 1pfzA_102F_87S}-14.2937 0.254 -4.549 { o lys A 88 1pfzA_102F_87S}-15.2595 0.6124 -5.2126 { c lys A 88 1pfzA_102F_87S}P -14.2937 0.254 -4.549 { n asp A 89 1pfzA_102F_87S}-14.0895 -1.0092 -4.2157 { ca asp A 89 1pfzA_102F_87S}-15.0625 -2.0146 -4.5881 { c asp A 89 1pfzA_102F_87S}-14.7873 -3.2441 -3.7331 { o asp A 89 1pfzA_102F_87S}-13.7867 -3.2953 -3.0048 { n tyr A 100 1pfzA_102F_87S}P -12.366 -2.6486 -0.6383 {"}-12.366 -2.6486 -0.6383 { ca tyr A 100 1pfzA_102F_87S}-10.9608 -2.278 -0.6683 { c tyr A 100 1pfzA_102F_87S}-10.6608 -1.218 -1.7152 { o tyr A 100 1pfzA_102F_87S}-11.2975 -1.1695 -2.7606 { c tyr A 100 1pfzA_102F_87S}P -10.6608 -1.218 -1.7152 { n lys A 101 1pfzA_102F_87S}-9.6943 -0.3547 -1.4252 { ca lys A 101 1pfzA_102F_87S}-9.31 0.6713 -2.38 { c lys A 101 1pfzA_102F_87S}-8.1306 0.1992 -3.2132 { o lys A 101 1pfzA_102F_87S}-7.0539 -0.087 -2.6879 { c lys A 101 1pfzA_102F_87S}P -8.1306 0.1992 -3.2132 { n phe A 102 1pfzA_102F_87S}-8.3506 0.1137 -4.5196 { ca phe A 102 1pfzA_102F_87S}-7.3282 -0.3404 -5.4452 { c phe A 102 1pfzA_102F_87S}-7.1025 0.6906 -6.5392 { o phe A 102 1pfzA_102F_87S}-7.8375 1.6729 -6.6572 { c phe A 102 1pfzA_102F_87S}P -7.1025 0.6906 -6.5392 { n ile A 103 1pfzA_102F_87S}-6.0987 0.4341 -7.3627 { ca ile A 103 1pfzA_102F_87S}-5.7507 1.3402 -8.4473 { c ile A 103 1pfzA_102F_87S}-6.2443 0.8953 -9.8201 { o ile A 103 1pfzA_102F_87S}-5.885 -0.1884 -10.2813 { c ile A 103 1pfzA_102F_87S}P -6.2443 0.8953 -9.8201 { n glu A 104 1pfzA_102F_87S}-7.0809 1.7191 -10.4578 { ca glu A 104 1pfzA_102F_87S}-7.5468 1.4362 -11.8143 { c glu A 104 1pfzA_102F_87S}-6.5039 2.0544 -12.7157 { o glu A 104 1pfzA_102F_87S}-6.2968 3.2621 -12.6741 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 85 1pfzA_102F_87S}P -6.0714 5.7396 -11.2261 { ca phe A 85 1pfzA_102F_87S}P -6.7276 6.417 -10.1142 { n phe A 86 1pfzA_102F_87S}P -7.5398 5.776 -7.9286 { ca phe A 86 1pfzA_102F_87S}P -8.1033 4.8781 -6.937 { n ser A 87 1pfzA_102F_87S}P -10.0652 3.4846 -6.7901 { ca ser A 87 1pfzA_102F_87S}P -11.4822 3.1616 -6.8263 { n lys A 88 1pfzA_102F_87S}P -12.9318 2.1354 -5.1967 { ca lys A 88 1pfzA_102F_87S}P -13.2397 1.2479 -4.0992 { n asp A 89 1pfzA_102F_87S}P -14.0895 -1.0092 -4.2157 { ca asp A 89 1pfzA_102F_87S}P -15.0625 -2.0146 -4.5881 { n tyr A 100 1pfzA_102F_87S}P -12.366 -2.6486 -0.6383 { ca tyr A 100 1pfzA_102F_87S}P -10.9608 -2.278 -0.6683 { n lys A 101 1pfzA_102F_87S}P -9.6943 -0.3547 -1.4252 { ca lys A 101 1pfzA_102F_87S}P -9.31 0.6713 -2.38 { n phe A 102 1pfzA_102F_87S}P -8.3506 0.1137 -4.5196 { ca phe A 102 1pfzA_102F_87S}P -7.3282 -0.3404 -5.4452 { n ile A 103 1pfzA_102F_87S}P -6.0987 0.4341 -7.3627 { ca ile A 103 1pfzA_102F_87S}P -5.7507 1.3402 -8.4473 { n glu A 104 1pfzA_102F_87S}P -7.0809 1.7191 -10.4578 { ca glu A 104 1pfzA_102F_87S}P -7.5468 1.4362 -11.8143 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 85 1pfzA_102F_87S}P -6.7276 6.417 -10.1142 {"}-6.7276 6.417 -10.1142 { ca phe A 86 1pfzA_102F_87S}-8.1033 4.8781 -6.937 { ca ser A 87 1pfzA_102F_87S}-11.4822 3.1616 -6.8263 { ca lys A 88 1pfzA_102F_87S}-13.2397 1.2479 -4.0992 { ca asp A 89 1pfzA_102F_87S}-15.0625 -2.0146 -4.5881 { ca tyr A 100 1pfzA_102F_87S}P -10.9608 -2.278 -0.6683 {"}-10.9608 -2.278 -0.6683 { ca lys A 101 1pfzA_102F_87S}-9.31 0.6713 -2.38 { ca phe A 102 1pfzA_102F_87S}-7.3282 -0.3404 -5.4452 { ca ile A 103 1pfzA_102F_87S}-5.7507 1.3402 -8.4473 { ca glu A 104 1pfzA_102F_87S}-7.5468 1.4362 -11.8143 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser A 87 1pfzA_102F_87S}P -11.4822 3.1616 -6.8263 { cb ser A 87 1pfzA_102F_87S}-11.876 2.4839 -8.1429 { og ser A 87 1pfzA_102F_87S}-11.8264 3.397 -9.2251 { ca phe A 102 1pfzA_102F_87S}P -7.3282 -0.3404 -5.4452 { cb phe A 102 1pfzA_102F_87S}-7.7449 -1.6606 -6.0962 { cg phe A 102 1pfzA_102F_87S}-9.0791 -1.5917 -6.782 { cd1 phe A 102 1pfzA_102F_87S}-10.259 -1.7609 -6.0627 { ce1 phe A 102 1pfzA_102F_87S}-11.505 -1.6258 -6.6858 { cz phe A 102 1pfzA_102F_87S}-11.5689 -1.3172 -8.0432 { cg phe A 102 1pfzA_102F_87S}P -9.0791 -1.5917 -6.782 { cd2 phe A 102 1pfzA_102F_87S}-9.1569 -1.2865 -8.1371 { ce2 phe A 102 1pfzA_102F_87S}-10.3941 -1.148 -8.7711 { cz phe A 102 1pfzA_102F_87S}ghost -11.5689 -1.3172 -8.0432 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser A 87 1pfzA_102F_87S}P -11.876 2.4839 -8.1429 {"}P -11.876 2.4839 -8.1429 { og ser A 87 1pfzA_102F_87S}P -11.8264 3.397 -9.2251 { cb phe A 102 1pfzA_102F_87S}P -7.7449 -1.6606 -6.0962 {"}P -7.7449 -1.6606 -6.0962 { cd1 phe A 102 1pfzA_102F_87S}P -10.259 -1.7609 -6.0627 { cd2 phe A 102 1pfzA_102F_87S}P -9.1569 -1.2865 -8.1371 { ce1 phe A 102 1pfzA_102F_87S}P -11.505 -1.6258 -6.6858 { ce2 phe A 102 1pfzA_102F_87S}P -10.3941 -1.148 -8.7711 { cz phe A 102 1pfzA_102F_87S}P -11.5689 -1.3172 -8.0432 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 102 A}'S' blue -10.7389 0.2679 -7.8021 {"}'S' sky -10.3541 0.4722 -8.1105 {"}'S' sky -11.1242 0.4098 -9.089 {"}'S' blue -10.1579 0.516 -8.283 {"}'S' blue -10.1255 0.5798 -8.6873 {"}'S' sky -10.2824 0.5942 -8.8948 {"}'S' sky -10.4445 0.5707 -9.0974 { CZ PHE 102 A}'S' blue -11.6713 0.3689 -7.5855 {"}'S' sky -11.8232 0.396 -7.7891 {"}'S' blue -11.9809 0.3829 -7.9896 {"}'S' blue -12.1417 0.3304 -8.182 {"}'S' sky -11.3327 0.3468 -7.5551 {"}'S' sky -11.9616 0.3565 -8.3707 {"}'S' sky -11.7829 0.3401 -8.5637 {"}'S' sky -10.9424 0.3108 -7.9037 {"}'S' sky -11.5736 0.2982 -8.7157 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 102 A}'S' sea -10.8788 0.3489 -8.0049 {"}'S' green -11.0318 0.3831 -8.2133 {"}'S' green -11.1929 0.3681 -8.4164 {"}'S' sea -10.6272 0.4346 -8.0617 {"}'S' green -10.7751 0.4844 -8.2667 {"}'S' green -10.931 0.4899 -8.4707 {"}'S' green -11.0914 0.4537 -8.668 {"}'S' sea -11.2521 0.3753 -8.8527 {"}'S' green -10.4965 0.538 -8.3134 {"}'S' green -10.6484 0.5652 -8.517 {"}'S' green -10.8061 0.5521 -8.7175 {"}'S' green -10.9669 0.4995 -8.9099 {"}'S' sea -10.3047 0.5768 -8.4907 {"}'S' sea -10.4613 0.5998 -8.698 {"}'S' sea -10.6229 0.5823 -8.9029 {"}'S' sea -10.7868 0.5256 -9.0986 { CZ PHE 102 A}'S' sea -11.4795 0.4076 -7.7628 {"}'S' sea -11.6361 0.4306 -7.9701 {"}'S' sea -11.7977 0.4132 -8.175 {"}'S' sea -11.1512 0.3577 -7.7521 {"}'S' green -11.3003 0.4107 -7.9594 {"}'S' green -11.4572 0.425 -8.1669 {"}'S' green -11.6193 0.4015 -8.3694 {"}'S' green -11.091 0.3646 -8.1106 {"}'S' green -11.2487 0.3818 -8.318 {"}'S' green -11.4104 0.3588 -8.5219 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 87 A}'S' blue -12.1911 0.7861 -7.8614 {"}'S' blue -12.1496 0.7578 -8.2339 {"}'S' blue -11.9923 0.7414 -8.0255 {"}'S' blue -11.8302 0.7635 -7.8227 {"}'S' blue -11.6678 0.8243 -7.6283 {"}'S' blue -12.0354 0.783 -8.5211 { HB2 SER 87 A}'S' sky -11.9163 0.7296 -8.1718 {"}'S' sky -11.769 0.6866 -7.9692 {"}'S' sky -11.6116 0.7045 -7.7702 {"}'S' sky -11.8365 0.6657 -8.46 {"}'S' sky -11.2294 0.6755 -7.6785 {"}'S' sky -11.6754 0.6245 -8.673 {"}'S' blue -10.9303 0.681 -7.7256 {"}'S' sky -11.43 0.578 -8.7747 {"}'S' blue -10.6736 0.7237 -7.8373 {"}'S' sky -11.2532 0.6603 -8.9791 {"}'S' sky -10.5112 0.7417 -8.0416 {"}'S' sky -11.016 0.7354 -9.0598 {"}'S' sky -10.7788 0.8482 -9.093 {"}'S' sky -10.3292 0.8794 -8.5198 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 SER 87 A}'S' sea -11.6991 0.5842 -8.2605 {"}'S' green -11.5472 0.5585 -8.0572 {"}'S' sea -11.3878 0.5889 -7.86 {"}'S' green -11.5447 0.5301 -8.478 {"}'S' green -11.3974 0.4884 -8.2757 {"}'S' green -11.2419 0.5004 -8.0778 {"}'S' sea -11.0833 0.5649 -7.8911 {"}'S' green -11.2934 0.4967 -8.5746 {"}'S' green -11.141 0.4717 -8.3709 {"}'S' green -10.9817 0.5021 -8.1736 {"}'S' sea -10.8237 0.5879 -7.9927 {"}'S' green -11.1248 0.5595 -8.7839 {"}'S' green -10.9775 0.5165 -8.5814 {"}'S' green -10.8193 0.5342 -8.3829 {"}'S' green -10.6616 0.6103 -8.2001 {"}'S' green -10.8811 0.6406 -8.8589 {"}'S' green -10.7253 0.6163 -8.6508 {"}'S' green -10.562 0.6653 -8.4542 {"}'S' sea -10.4048 0.7837 -8.2834 {"}'S' sea -10.6417 0.7732 -8.8936 {"}'S' sea -10.4854 0.784 -8.6943 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 102 A}'M' greentint -9.0096 2.0654 -6.0008 {"}'M' greentint -9.1532 1.9576 -6.2733 {"}'M' greentint -8.9109 2.3532 -6.0701 {"}'M' greentint -9.0595 2.1963 -6.2186 {"}'M' greentint -9.1632 2.1 -6.516 {"}'M' greentint -9.2197 1.8505 -6.5193 {"}'M' greentint -8.7616 2.5834 -6.1322 {"}'M' greentint -8.9202 2.4902 -6.3106 {"}'M' greentint -9.0595 2.3223 -6.4438 {"}'M' greentint -9.1328 2.194 -6.7608 {"}'M' greentint -9.204 1.9489 -6.785 {"}'M' greentint -8.5747 2.7725 -6.2001 {"}'M' greentint -8.7348 2.7143 -6.3921 {"}'M' greentint -8.8896 2.5912 -6.5567 {"}'M' greentint -9.0254 2.4136 -6.6829 {"}'M' greentint -9.0549 2.2742 -6.9991 {"}'M' greentint -9.1361 2.031 -7.0375 {"}'M' greentint -8.654 2.8103 -6.6298 {"}'M' greentint -8.8062 2.6744 -6.7898 {"}'M' greentint -8.9429 2.4928 -6.9146 {"}'M' greentint -8.9404 2.319 -7.2288 {"}'M' greentint -8.5529 2.8566 -6.8765 {"}'M' greentint -8.699 2.713 -7.0264 {"}'M' greentint -8.8298 2.531 -7.1448 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 87 A}'M' greentint -9.1694 1.7935 -6.3025 {"}'M' greentint -9.0192 1.9179 -6.1427 {"}'M' greentint -8.8861 2.0935 -6.0196 {"}'M' greentint -8.7808 2.3082 -5.9419 {"}'M' greentint -9.1189 1.791 -6.6361 {"}'M' greentint -8.9582 1.8669 -6.4492 {"}'M' greentint -8.8087 2.0123 -6.2969 {"}'M' greentint -8.6841 2.2123 -6.191 {"}'M' greentint -8.5955 2.4499 -6.143 {"}'M' greentint -8.551 2.7046 -6.1557 {"}'M' greentint -9.0252 1.9018 -6.8888 {"}'M' greentint -8.8628 1.9467 -6.6908 {"}'M' greentint -8.7086 2.0793 -6.5291 {"}'M' greentint -8.5844 2.2827 -6.4245 {"}'M' greentint -8.5061 2.5283 -6.3924 {"}'M' greentint -8.4851 2.7838 -6.4357 {"}'M' greentint -8.9142 2.0853 -7.0592 {"}'M' greentint -8.7532 2.1133 -6.8593 {"}'M' greentint -8.6051 2.2653 -6.7104 {"}'M' greentint -8.5103 2.4994 -6.6531 {"}'M' greentint -8.494 2.7531 -6.7024 {"}'M' greentint -8.7807 2.3031 -7.1128 {"}'M' greentint -8.6207 2.4 -6.9333 {"}'M' greentint -8.5658 2.6533 -6.9331 {"}'M' greentint -8.699 2.5497 -7.1326 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 102 A}'M' greentint -10.077 0.6699 -4.5489 {"}'M' greentint -10.1874 0.5705 -4.8292 {"}'M' greentint -9.7835 0.9847 -4.423 {"}'M' greentint -9.9445 0.9566 -4.623 {"}'M' greentint -10.0926 0.8047 -4.7718 {"}'M' greentint -10.1591 0.668 -5.0828 {"}'M' greentint -10.2095 0.4133 -5.0782 {"}'M' greentint -9.754 1.1577 -4.6955 {"}'M' greentint -9.9143 1.0666 -4.8784 {"}'M' greentint -10.0557 0.8961 -5.014 {"}'M' greentint -10.0623 0.7423 -5.3228 {"}'M' greentint -10.1305 0.4933 -5.3405 {"}'M' greentint -9.4982 1.2892 -4.7451 {"}'M' greentint -9.6596 1.2501 -4.943 {"}'M' greentint -9.8162 1.138 -5.1144 {"}'M' greentint -9.9548 0.9633 -5.2451 {"}'M' greentint -9.9169 0.7618 -5.5404 {"}'M' greentint -9.9904 0.522 -5.5673 {"}'M' greentint -9.5283 1.2765 -5.1797 {"}'M' greentint -9.6785 1.152 -5.3395 {"}'M' greentint -9.8116 0.9764 -5.4626 {"}'M' greentint -9.4873 1.1339 -5.5167 {"}'M' greentint -9.6195 0.9599 -5.6389 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 87 A}'M' greentint -10.1213 0.4295 -4.6964 {"}'M' greentint -9.9817 0.5969 -4.5626 {"}'M' greentint -9.8592 0.7971 -4.4597 {"}'M' greentint -10.1265 0.3252 -5.0745 {"}'M' greentint -9.9747 0.4459 -4.9117 {"}'M' greentint -9.8344 0.6079 -4.7757 {"}'M' greentint -9.7125 0.8045 -4.6727 {"}'M' greentint -9.6141 1.0293 -4.6066 {"}'M' greentint -10.0192 0.3853 -5.3157 {"}'M' greentint -9.8613 0.4955 -5.1422 {"}'M' greentint -9.716 0.6573 -4.9993 {"}'M' greentint -9.5914 0.8597 -4.8957 {"}'M' greentint -9.4949 1.0928 -4.8358 {"}'M' greentint -9.9482 0.4874 -5.5684 {"}'M' greentint -9.7885 0.576 -5.3874 {"}'M' greentint -9.6418 0.7256 -5.2399 {"}'M' greentint -9.5181 0.9254 -5.1352 {"}'M' greentint -9.4262 1.1595 -5.0819 {"}'M' greentint -9.6729 0.7538 -5.5452 {"}'M' greentint -9.5344 0.9244 -5.4137 {"}'M' greentint -9.4315 1.1479 -5.3428 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 38 1pkoA_40Y_97T}P -12.4336 -1.7311 0.4441 {"}-12.4336 -1.7311 0.4441 { ca gly A 38 1pkoA_40Y_97T}-11.1287 -1.7793 -0.1913 { c gly A 38 1pkoA_40Y_97T}-10.8763 -0.6745 -1.1683 { o gly A 38 1pkoA_40Y_97T}-11.7708 0.0562 -1.5836 { c gly A 38 1pkoA_40Y_97T}P -10.8763 -0.6745 -1.1683 { n trp A 39 1pkoA_40Y_97T}-9.599 -0.5692 -1.5057 { ca trp A 39 1pkoA_40Y_97T}-9.1431 0.4155 -2.4659 { c trp A 39 1pkoA_40Y_97T}-8.2452 -0.2902 -3.47 { o trp A 39 1pkoA_40Y_97T}-7.3956 -1.093 -3.0928 { c trp A 39 1pkoA_40Y_97T}P -8.2452 -0.2902 -3.47 { n tyr A 40 1pkoA_40Y_97T}-8.4395 -0.0127 -4.749 { ca tyr A 40 1pkoA_40Y_97T}-7.5265 -0.6097 -5.7163 { c tyr A 40 1pkoA_40Y_97T}-7.1939 0.3934 -6.7928 { o tyr A 40 1pkoA_40Y_97T}-7.8408 1.4251 -6.8991 { c tyr A 40 1pkoA_40Y_97T}P -7.1939 0.3934 -6.7928 { n arg A 41 1pkoA_40Y_97T}-6.1141 0.1355 -7.5359 { ca arg A 41 1pkoA_40Y_97T}-5.6829 1.1005 -8.5511 { c arg A 41 1pkoA_40Y_97T}-6.3887 0.9418 -9.8588 { o arg A 41 1pkoA_40Y_97T}-6.5229 -0.1719 -10.3674 { c arg A 41 1pkoA_40Y_97T}P -6.3887 0.9418 -9.8588 { n ser A 42 1pkoA_40Y_97T}-6.8118 2.0715 -10.4183 { ca ser A 42 1pkoA_40Y_97T}-7.5008 2.0939 -11.6982 { c ser A 42 1pkoA_40Y_97T}-6.5029 2.5431 -12.7541 { o ser A 42 1pkoA_40Y_97T}-5.7582 3.5034 -12.5296 { n gly A 95 1pkoA_40Y_97T}P -5.9765 7.4276 -11.0101 {"}-5.9765 7.4276 -11.0101 { ca gly A 95 1pkoA_40Y_97T}-7.2211 6.8742 -10.5171 { c gly A 95 1pkoA_40Y_97T}-7.1243 5.7748 -9.4846 { o gly A 95 1pkoA_40Y_97T}-6.2079 4.9459 -9.4987 { c gly A 95 1pkoA_40Y_97T}P -7.1243 5.7748 -9.4846 { n tyr A 96 1pkoA_40Y_97T}-8.1208 5.7875 -8.5937 { ca tyr A 96 1pkoA_40Y_97T}-8.2884 4.7996 -7.5412 { c tyr A 96 1pkoA_40Y_97T}-9.751 4.4338 -7.5445 { o tyr A 96 1pkoA_40Y_97T}-10.5959 5.2148 -7.9754 { c tyr A 96 1pkoA_40Y_97T}P -9.751 4.4338 -7.5445 { n thr A 97 1pkoA_40Y_97T}-10.0307 3.2219 -7.0932 { ca thr A 97 1pkoA_40Y_97T}-11.3975 2.7701 -6.9579 { c thr A 97 1pkoA_40Y_97T}-11.5835 2.3167 -5.5022 { o thr A 97 1pkoA_40Y_97T}-10.7949 1.5331 -4.9753 { c thr A 97 1pkoA_40Y_97T}P -11.5835 2.3167 -5.5022 { c acys A 98 1pkoA_40Y_97T}P -14.2456 1.6551 -3.5607 {"}P -14.2456 1.6551 -3.5607 {"}P -14.2456 1.6551 -3.5607 { n phe A 99 1pkoA_40Y_97T}-14.3011 0.5768 -2.7906 { ca phe A 99 1pkoA_40Y_97T}-15.5109 -0.2513 -2.8129 { c phe A 99 1pkoA_40Y_97T}-15.9088 -0.6582 -1.4217 { o phe A 99 1pkoA_40Y_97T}-15.0887 -0.6856 -0.503 { c bcys A 98 1pkoA_40Y_97T}P -14.1787 1.5931 -3.6192 { n phe A 99 1pkoA_40Y_97T}-14.3011 0.5768 -2.7906 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 38 1pkoA_40Y_97T}P -12.4336 -1.7311 0.4441 { ca gly A 38 1pkoA_40Y_97T}P -11.1287 -1.7793 -0.1913 {"}P -11.1287 -1.7793 -0.1913 { n trp A 39 1pkoA_40Y_97T}P -9.599 -0.5692 -1.5057 { ca trp A 39 1pkoA_40Y_97T}P -9.1431 0.4155 -2.4659 { n tyr A 40 1pkoA_40Y_97T}P -8.4395 -0.0127 -4.749 { ca tyr A 40 1pkoA_40Y_97T}P -7.5265 -0.6097 -5.7163 { n arg A 41 1pkoA_40Y_97T}P -6.1141 0.1355 -7.5359 { ca arg A 41 1pkoA_40Y_97T}P -5.6829 1.1005 -8.5511 { n ser A 42 1pkoA_40Y_97T}P -6.8118 2.0715 -10.4183 { ca ser A 42 1pkoA_40Y_97T}P -7.5008 2.0939 -11.6982 { n gly A 95 1pkoA_40Y_97T}P -5.9765 7.4276 -11.0101 { ca gly A 95 1pkoA_40Y_97T}P -7.2211 6.8742 -10.5171 {"}P -7.2211 6.8742 -10.5171 { n tyr A 96 1pkoA_40Y_97T}P -8.1208 5.7875 -8.5937 { ca tyr A 96 1pkoA_40Y_97T}P -8.2884 4.7996 -7.5412 { n thr A 97 1pkoA_40Y_97T}P -10.0307 3.2219 -7.0932 { ca thr A 97 1pkoA_40Y_97T}P -11.3975 2.7701 -6.9579 { n phe A 99 1pkoA_40Y_97T}P -14.3011 0.5768 -2.7906 { ca phe A 99 1pkoA_40Y_97T}P -15.5109 -0.2513 -2.8129 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 38 1pkoA_40Y_97T}P -11.1287 -1.7793 -0.1913 {"}-11.1287 -1.7793 -0.1913 { ca trp A 39 1pkoA_40Y_97T}-9.1431 0.4155 -2.4659 { ca tyr A 40 1pkoA_40Y_97T}-7.5265 -0.6097 -5.7163 { ca arg A 41 1pkoA_40Y_97T}-5.6829 1.1005 -8.5511 { ca ser A 42 1pkoA_40Y_97T}-7.5008 2.0939 -11.6982 { ca gly A 95 1pkoA_40Y_97T}-7.2211 6.8742 -10.5171 { ca tyr A 96 1pkoA_40Y_97T}-8.2884 4.7996 -7.5412 { ca thr A 97 1pkoA_40Y_97T}-11.3975 2.7701 -6.9579 {"}P -11.3975 2.7701 -6.9579 { ca phe A 99 1pkoA_40Y_97T}P -15.5109 -0.2513 -2.8129 {"}P -15.5109 -0.2513 -2.8129 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 40 1pkoA_40Y_97T}P -7.5265 -0.6097 -5.7163 { cb tyr A 40 1pkoA_40Y_97T}-8.0216 -1.9715 -6.2257 { cg tyr A 40 1pkoA_40Y_97T}-9.3684 -2.0221 -6.8604 { cd1 tyr A 40 1pkoA_40Y_97T}-9.5259 -1.7764 -8.2221 { ce1 tyr A 40 1pkoA_40Y_97T}-10.7726 -1.8924 -8.8332 { cz tyr A 40 1pkoA_40Y_97T}-11.8734 -2.2503 -8.0755 { oh tyr A 40 1pkoA_40Y_97T}-13.1131 -2.3614 -8.6748 { cg tyr A 40 1pkoA_40Y_97T}P -9.3684 -2.0221 -6.8604 { cd2 tyr A 40 1pkoA_40Y_97T}-10.4907 -2.377 -6.1208 { ce2 tyr A 40 1pkoA_40Y_97T}-11.7413 -2.4953 -6.7214 { cz tyr A 40 1pkoA_40Y_97T}ghost -11.8734 -2.2503 -8.0755 { ca thr A 97 1pkoA_40Y_97T}P -11.3975 2.7701 -6.9579 { cb thr A 97 1pkoA_40Y_97T}-11.7183 1.5594 -7.8684 { og1 thr A 97 1pkoA_40Y_97T}-11.5967 1.9484 -9.2367 { cb thr A 97 1pkoA_40Y_97T}P -11.7183 1.5594 -7.8684 { cg2 thr A 97 1pkoA_40Y_97T}-13.1325 1.0563 -7.6035 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 40 1pkoA_40Y_97T}P -8.0216 -1.9715 -6.2257 {"}P -8.0216 -1.9715 -6.2257 { cd1 tyr A 40 1pkoA_40Y_97T}P -9.5259 -1.7764 -8.2221 { cd2 tyr A 40 1pkoA_40Y_97T}P -10.4907 -2.377 -6.1208 { ce1 tyr A 40 1pkoA_40Y_97T}P -10.7726 -1.8924 -8.8332 { ce2 tyr A 40 1pkoA_40Y_97T}P -11.7413 -2.4953 -6.7214 { oh tyr A 40 1pkoA_40Y_97T}P -13.1131 -2.3614 -8.6748 { cb thr A 97 1pkoA_40Y_97T}P -11.7183 1.5594 -7.8684 { og1 thr A 97 1pkoA_40Y_97T}P -11.5967 1.9484 -9.2367 { cg2 thr A 97 1pkoA_40Y_97T}P -13.1325 1.0563 -7.6035 {"}P -13.1325 1.0563 -7.6035 {"}P -13.1325 1.0563 -7.6035 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 40 A}'S' blue -10.2264 -0.4988 -6.942 {"}'S' blue -10.3815 -0.6174 -7.1099 {"}'S' blue -10.0985 -0.4643 -7.1784 { CD1 TYR 40 A}'S' blue -10.7515 -0.7789 -7.4693 {"}'S' sky -10.4437 -0.5704 -7.3473 {"}'S' sky -10.0107 -0.2795 -7.4559 {"}'S' sky -9.7803 -0.0632 -7.968 {"}'S' sky -9.938 -0.0763 -8.1685 {"}'S' sky -10.0988 -0.1289 -8.3609 {"}'S' sky -10.2561 -0.2186 -8.54 { CE1 TYR 40 A}'S' sky -11.6448 -0.5046 -8.2196 {"}'S' blue -10.8964 -0.7685 -7.4971 {"}'S' sky -11.5715 -0.3763 -8.4785 {"}'S' blue -11.7343 -0.4389 -8.6713 {"}'S' sky -11.47 -0.2907 -8.7302 {"}'S' sky -11.1847 -0.1924 -8.7796 {"}'S' blue -11.3455 -0.2449 -8.9721 {"}'S' sky -10.8399 -0.1447 -8.7602 {"}'S' blue -11.0015 -0.1621 -8.965 {"}'S' sky -10.355 -0.2176 -8.5421 {"}'S' sky -10.5041 -0.1646 -8.7494 { CE2 TYR 40 A}'S' blue -12.3142 -0.8478 -6.8603 {"}'S' blue -12.4714 -0.9375 -7.0394 {"}'S' blue -12.134 -0.8216 -7.049 { CZ TYR 40 A}'S' blue -12.9488 -1.0444 -7.4043 {"}'S' sky -13.1095 -1.1086 -7.5939 {"}'S' sky -12.5912 -0.8801 -7.2572 {"}'S' sky -12.1065 -0.6677 -7.3661 {"}'S' blue -11.8334 -0.6301 -7.4149 {"}'S' blue -11.5028 -0.6847 -7.3864 {"}'S' sky -11.6372 -0.5863 -7.5874 {"}'S' sky -11.784 -0.5255 -7.7951 {"}'S' sky -11.9406 -0.5025 -8.0024 {"}'S' sky -12.7289 -0.962 -8.8946 {"}'S' blue -11.1955 -0.7911 -7.388 {"}'S' sky -11.3178 -0.6665 -7.5819 {"}'S' sky -11.6048 -0.5225 -7.9917 {"}'S' sky -11.7617 -0.5081 -8.1992 {"}'S' blue -11.9238 -0.5316 -8.4017 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 40 A}'S' sea -10.6014 -0.5705 -7.5509 {"}'S' sea -10.2438 -0.4062 -7.4038 {"}'S' green -10.3981 -0.3885 -7.6084 {"}'S' green -10.5593 -0.4263 -7.8066 {"}'S' green -10.1637 -0.2453 -7.6643 {"}'S' green -10.3247 -0.2603 -7.8673 {"}'S' green -10.4876 -0.3229 -8.0602 {"}'S' sea -9.907 -0.144 -7.7176 {"}'S' sea -10.0629 -0.1385 -7.9217 {"}'S' green -10.2233 -0.1747 -8.119 {"}'S' sea -10.384 -0.2531 -8.3037 { CE1 TYR 40 A}'S' sea -11.3482 -0.5926 -7.813 {"}'S' sea -11.4905 -0.5222 -8.0149 {"}'S' sea -10.9953 -0.6028 -7.6718 {"}'S' green -11.1175 -0.4765 -7.8642 {"}'S' green -11.2574 -0.3956 -8.0671 {"}'S' sea -11.4104 -0.3614 -8.2755 {"}'S' green -10.7528 -0.5292 -7.7365 {"}'S' green -10.8704 -0.4001 -7.925 {"}'S' green -11.1537 -0.2601 -8.3288 {"}'S' sea -11.3096 -0.2545 -8.5329 {"}'S' green -10.6047 -0.3752 -7.9777 {"}'S' green -10.7327 -0.2723 -8.1727 {"}'S' green -10.8751 -0.2064 -8.3755 {"}'S' green -11.027 -0.1792 -8.5791 {"}'S' green -10.5365 -0.2284 -8.3451 {"}'S' sea -10.6833 -0.1676 -8.5528 { CZ TYR 40 A}'S' sea -12.7455 -0.8624 -7.4618 {"}'S' sea -12.9068 -0.9002 -7.66 {"}'S' green -13.0653 -0.9909 -7.8406 {"}'S' sea -13.2159 -1.1303 -7.9959 {"}'S' sea -12.3581 -0.7534 -7.3093 {"}'S' green -12.5111 -0.7192 -7.5177 {"}'S' green -12.6722 -0.7342 -7.7207 {"}'S' green -12.9936 -0.9059 -8.0884 {"}'S' green -12.2544 -0.6179 -7.571 {"}'S' green -12.4103 -0.6123 -7.7751 {"}'S' green -12.5707 -0.6485 -7.9724 {"}'S' sea -11.9758 -0.5643 -7.6178 {"}'S' green -12.1277 -0.5371 -7.8214 {"}'S' green -12.2854 -0.5502 -8.0219 {"}'S' green -12.4462 -0.6028 -8.2143 {"}'S' green -12.7567 -0.818 -8.5553 {"}'S' sea -12.9003 -0.9766 -8.6966 {"}'S' sea -12.1022 -0.52 -8.2073 {"}'S' sea -12.2661 -0.5767 -8.403 {"}'S' green -12.4272 -0.6704 -8.5847 {"}'S' sea -12.5827 -0.8001 -8.7505 {"}'S' sea -11.4557 -0.5755 -7.7844 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 40 A}'S' P -11.0058 -0.3099 -8.1238 {"}'S' -11.0051 -0.3131 -8.1256 { CZ TYR 40 A}'S' P -12.835 -0.7968 -7.9136 {"}'S' -12.8354 -0.7976 -7.914 {"}'S' P -12.7314 -0.727 -8.1571 {"}'S' -12.7175 -0.7517 -8.1563 {"}'S' P -12.8865 -0.8456 -8.3249 {"}'S' -12.8778 -0.8569 -8.3224 {"}'S' P -12.6035 -0.6925 -8.3934 {"}'S' -12.6035 -0.6939 -8.3932 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 40 A}'S' blue -13.6942 -1.2725 -8.0138 {"}'S' sky -13.3192 -1.2478 -7.8522 {"}'S' sky -13.5159 -1.0446 -8.9262 {"}'S' sky -13.3411 -1.0537 -9.1192 {"}'S' sky -12.8142 -1.0085 -8.8793 {"}'S' blue -12.9742 -1.028 -9.0798 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 40 A}'S' sea -13.4541 -1.1543 -8.0528 {"}'S' sea -13.6071 -1.1184 -8.2597 {"}'S' sea -13.7675 -1.1419 -8.4618 {"}'S' green -13.213 -1.0774 -8.127 {"}'S' green -13.3584 -1.027 -8.3286 {"}'S' green -13.5136 -1.0279 -8.5286 {"}'S' sea -13.6727 -1.079 -8.7207 {"}'S' green -13.1977 -0.9713 -8.5352 {"}'S' green -13.3557 -0.9839 -8.7364 {"}'S' green -13.0212 -0.9656 -8.7293 {"}'S' sea -13.1803 -0.9866 -8.9301 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB THR 97 A}'S' sky -11.8346 -0.1832 -7.751 {"}'S' blue -11.8777 -0.1415 -8.2466 {"}'S' sky -11.7253 -0.1824 -8.0393 {"}'S' blue -11.762 -0.0582 -8.5347 {"}'S' sky -11.6208 -0.125 -8.3333 {"}'S' sky -11.5502 0.0135 -8.6717 {"}'S' sky -11.3095 0.0996 -8.7434 {"}'S' blue -11.0695 0.2149 -8.7819 { CG2 THR 97 A}'S' blue -13.0868 -0.6641 -7.2832 {"}'S' sky -12.6536 -0.5723 -7.1769 {"}'S' blue -12.4953 -0.4585 -7.0036 {"}'S' blue -12.2544 -0.3809 -7.1278 {"}'S' blue -12.0403 -0.2714 -7.2737 {"}'S' blue -11.9411 -0.2222 -7.5167 {"}'S' sky -12.0139 -0.2517 -7.9205 {"}'S' blue -12.0622 -0.1507 -8.2814 { HB THR 97 A}'S' blue -11.7241 -0.1608 -7.4786 {"}'S' sky -11.6443 -0.2247 -7.7668 {"}'S' sky -11.507 -0.3062 -7.5673 {"}'S' blue -11.355 -0.332 -7.364 {"}'S' blue -11.0497 -0.3901 -7.3846 {"}'S' sky -10.7895 -0.3883 -7.4805 {"}'S' sky -10.6315 -0.3026 -7.2995 {"}'S' blue -10.4814 -0.1667 -7.1441 {"}'S' sky -10.319 -0.1488 -7.3484 {"}'S' sky -10.0736 0.0701 -7.4593 {"}'S' sky -10.6893 0.1105 -8.5749 {"}'S' sky -9.9999 0.1571 -7.6964 {"}'S' sky -10.2984 0.0779 -8.2913 {"}'S' blue -9.9842 0.2604 -7.936 {HG21 THR 97 A}'S' sky -13.8438 -0.8579 -8.178 {"}'S' sky -13.6919 -0.8837 -7.9747 {"}'S' sky -13.8201 -0.8177 -8.5906 {"}'S' sky -13.6909 -0.7323 -8.8777 {"}'S' sky -13.1607 -0.7067 -8.9774 {"}'S' sky -12.4717 -0.4451 -8.6987 {"}'S' sky -12.3211 -0.2912 -8.5468 @dotlist {x} color= white width= 1 master= {vdw contact} { CB THR 97 A}'S' sea -11.4082 -0.0546 -8.4689 { CG2 THR 97 A}'S' sea -12.9801 -0.6861 -7.5665 {"}'S' sea -12.8164 -0.6481 -7.3667 {"}'S' green -12.7251 -0.6441 -7.6633 {"}'S' green -12.5648 -0.5937 -7.471 {"}'S' sea -12.4067 -0.5052 -7.2906 {"}'S' green -12.5106 -0.5676 -7.7977 {"}'S' green -12.3492 -0.5087 -7.6059 {"}'S' sea -12.1913 -0.4088 -7.4299 {"}'S' green -12.2574 -0.436 -7.8661 {"}'S' sea -12.096 -0.3509 -7.6804 {"}'S' sea -12.1751 -0.3182 -8.1103 { HB THR 97 A}'S' sea -11.4833 -0.266 -7.9799 {"}'S' sea -11.3526 -0.3604 -7.7848 {"}'S' sea -11.2053 -0.4021 -7.5825 {"}'S' green -11.354 -0.1807 -8.2669 {"}'S' green -11.2378 -0.3125 -8.0815 {"}'S' green -11.1013 -0.3938 -7.8814 {"}'S' green -10.9489 -0.4188 -7.6777 {"}'S' green -11.1636 -0.0774 -8.461 {"}'S' green -11.0611 -0.2302 -8.2859 {"}'S' green -10.7853 -0.374 -7.8882 {"}'S' green -10.6272 -0.3562 -7.6897 {"}'S' sea -10.4694 -0.2802 -7.5069 {"}'S' sea -10.9275 0.0037 -8.5446 {"}'S' green -10.8238 -0.1551 -8.3667 {"}'S' green -10.6889 -0.2499 -8.1658 {"}'S' green -10.5331 -0.2742 -7.9576 {"}'S' green -10.3699 -0.2252 -7.761 {"}'S' sea -10.2126 -0.1068 -7.5902 {"}'S' sea -10.5867 -0.0422 -8.3999 {"}'S' green -10.4495 -0.1172 -8.2004 {"}'S' green -10.2932 -0.1065 -8.0012 {"}'S' sea -10.1371 -0.0111 -7.8266 {"}'S' sea -10.1349 0.1065 -8.088 {HG21 THR 97 A}'S' sea -13.6894 -0.912 -8.3955 {"}'S' green -13.5421 -0.9537 -8.1932 {"}'S' sea -13.3866 -0.9417 -7.9953 {"}'S' sea -13.228 -0.8772 -7.8086 {"}'S' sea -13.075 -0.7612 -7.6432 {"}'S' sea -13.5747 -0.8641 -8.6922 {"}'S' green -13.4381 -0.9455 -8.4921 {"}'S' green -13.2857 -0.9704 -8.2884 {"}'S' green -13.1264 -0.94 -8.0912 {"}'S' green -12.9684 -0.8542 -7.9102 {"}'S' green -12.8183 -0.7184 -7.7548 {"}'S' sea -13.3979 -0.7818 -8.8966 {"}'S' green -13.2695 -0.8826 -8.7015 {"}'S' green -13.1222 -0.9256 -8.4989 {"}'S' sea -13.0258 -0.8016 -8.7765 {"}'S' green -12.87 -0.8258 -8.5683 {"}'S' green -12.4104 -0.4816 -8.07 {"}'S' sea -12.7864 -0.6689 -8.8111 {"}'S' green -12.6301 -0.6581 -8.6119 {"}'S' green -12.4739 -0.5627 -8.4373 {"}'S' sea -12.3368 -0.3945 -8.3071 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB THR 97 A}'S' P -10.9326 -0.3309 -8.0908 {"}'S' -10.9332 -0.3246 -8.0878 {HG21 THR 97 A}'S' P -12.964 -0.9079 -8.3004 {"}'S' -12.966 -0.9056 -8.3002 {"}'S' P -12.8063 -0.8318 -8.1176 {"}'S' -12.8179 -0.8089 -8.1198 {"}'S' P -12.6559 -0.7004 -7.9591 {"}'S' -12.6591 -0.6964 -7.9609 {"}'S' P -12.7067 -0.7769 -8.3717 {"}'S' -12.7157 -0.764 -8.3698 {"}'S' P -12.5495 -0.6585 -8.2009 {"}'S' -12.555 -0.6526 -8.2013 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 40 A}'M' greentint -9.0129 1.8175 -6.2427 {"}'M' greentint -9.1565 1.7098 -6.5152 {"}'M' greentint -8.9142 2.1054 -6.3119 {"}'M' greentint -9.0628 1.9485 -6.4604 {"}'M' greentint -9.1665 1.8521 -6.7579 {"}'M' greentint -9.223 1.6026 -6.7612 {"}'M' greentint -8.765 2.3355 -6.3741 {"}'M' greentint -8.9235 2.2424 -6.5525 {"}'M' greentint -9.0628 2.0744 -6.6857 {"}'M' greentint -9.1361 1.9461 -7.0027 {"}'M' greentint -9.2073 1.701 -7.0269 {"}'M' greentint -8.578 2.5247 -6.442 {"}'M' greentint -8.7382 2.4664 -6.634 {"}'M' greentint -8.893 2.3433 -6.7986 {"}'M' greentint -9.0287 2.1658 -6.9248 {"}'M' greentint -9.0582 2.0264 -7.241 {"}'M' greentint -9.1394 1.7832 -7.2793 {"}'M' greentint -8.4952 2.6446 -6.6861 {"}'M' greentint -8.6573 2.5625 -6.8717 {"}'M' greentint -8.8095 2.4265 -7.0317 {"}'M' greentint -8.9462 2.2449 -7.1565 {"}'M' greentint -8.9437 2.0711 -7.4706 {"}'M' greentint -8.4004 2.7075 -6.945 {"}'M' greentint -8.5562 2.6087 -7.1184 {"}'M' greentint -8.7023 2.4652 -7.2682 {"}'M' greentint -8.8331 2.2832 -7.3867 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 97 A}'M' greentint -9.1913 1.5635 -6.7806 {"}'M' greentint -9.0331 1.6272 -6.5943 {"}'M' greentint -8.8828 1.7517 -6.4344 {"}'M' greentint -8.7497 1.9273 -6.3113 {"}'M' greentint -8.6445 2.1419 -6.2336 {"}'M' greentint -8.571 2.3817 -6.2067 {"}'M' greentint -9.1407 1.6225 -7.1316 {"}'M' greentint -8.9825 1.6247 -6.9278 {"}'M' greentint -8.8218 1.7007 -6.741 {"}'M' greentint -8.6723 1.8461 -6.5886 {"}'M' greentint -8.5477 2.046 -6.4827 {"}'M' greentint -8.4591 2.2836 -6.4347 {"}'M' greentint -8.4146 2.5383 -6.4474 {"}'M' greentint -9.0375 1.7852 -7.3866 {"}'M' greentint -8.8888 1.7356 -7.1805 {"}'M' greentint -8.7265 1.7805 -6.9826 {"}'M' greentint -8.5722 1.9131 -6.8209 {"}'M' greentint -8.448 2.1164 -6.7162 {"}'M' greentint -8.3697 2.3621 -6.6841 {"}'M' greentint -8.3487 2.6175 -6.7274 {"}'M' greentint -8.9095 2.0208 -7.5491 {"}'M' greentint -8.7778 1.919 -7.3509 {"}'M' greentint -8.6168 1.9471 -7.151 {"}'M' greentint -8.4688 2.099 -7.0021 {"}'M' greentint -8.3739 2.3332 -6.9448 {"}'M' greentint -8.3577 2.5868 -6.9941 {"}'M' greentint -8.6443 2.1369 -7.4045 {"}'M' greentint -8.4843 2.2338 -7.225 {"}'M' greentint -8.4294 2.4871 -7.2248 {"}'M' greentint -8.5626 2.3834 -7.4243 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 40 A}'M' greentint -9.9395 0.7417 -4.5175 {"}'M' greentint -10.0728 0.6381 -4.717 {"}'M' greentint -9.7536 0.8331 -4.3595 {"}'M' greentint -9.8578 0.9883 -4.5374 {"}'M' greentint -10.0178 0.8914 -4.7168 {"}'M' greentint -10.1282 0.792 -4.9971 {"}'M' greentint -10.1445 0.5383 -4.9477 {"}'M' greentint -9.7243 1.2061 -4.5909 {"}'M' greentint -9.8854 1.1781 -4.7909 {"}'M' greentint -10.0334 1.0261 -4.9397 {"}'M' greentint -10.0999 0.8894 -5.2507 {"}'M' greentint -10.1503 0.6348 -5.246 {"}'M' greentint -10.1416 0.3869 -5.1656 {"}'M' greentint -9.5359 1.376 -4.6575 {"}'M' greentint -9.6948 1.3791 -4.8634 {"}'M' greentint -9.8551 1.2881 -5.0463 {"}'M' greentint -9.9965 1.1175 -5.1819 {"}'M' greentint -10.0031 0.9637 -5.4907 {"}'M' greentint -10.0713 0.7147 -5.5084 {"}'M' greentint -10.0918 0.4615 -5.4649 {"}'M' greentint -9.4391 1.5107 -4.913 {"}'M' greentint -9.6004 1.4715 -5.1109 {"}'M' greentint -9.757 1.3595 -5.2823 {"}'M' greentint -9.8956 1.1847 -5.413 {"}'M' greentint -9.8577 0.9832 -5.7083 {"}'M' greentint -9.9312 0.7434 -5.7352 {"}'M' greentint -9.4691 1.4979 -5.3476 {"}'M' greentint -9.6193 1.3735 -5.5074 {"}'M' greentint -9.7524 1.1979 -5.6305 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 97 A}'M' greentint -10.0097 0.4115 -4.6833 {"}'M' greentint -9.8693 0.5735 -4.5472 {"}'M' greentint -9.7474 0.7701 -4.4442 {"}'M' greentint -9.649 0.995 -4.3782 {"}'M' greentint -10.0541 0.3509 -5.0873 {"}'M' greentint -9.8962 0.4612 -4.9138 {"}'M' greentint -9.7509 0.6229 -4.7709 {"}'M' greentint -9.6263 0.8253 -4.6673 {"}'M' greentint -9.5298 1.0584 -4.6074 {"}'M' greentint -9.466 1.3102 -4.5948 {"}'M' greentint -9.9831 0.4531 -5.34 {"}'M' greentint -9.8234 0.5417 -5.159 {"}'M' greentint -9.6767 0.6913 -5.0115 {"}'M' greentint -9.553 0.891 -4.9068 {"}'M' greentint -9.4611 1.1252 -4.8535 {"}'M' greentint -9.4091 1.3761 -4.8551 {"}'M' greentint -9.8649 0.6236 -5.4941 {"}'M' greentint -9.7078 0.7195 -5.3168 {"}'M' greentint -9.5694 0.89 -5.1853 {"}'M' greentint -9.4664 1.1135 -5.1144 {"}'M' greentint -9.412 1.3632 -5.1141 {"}'M' greentint -9.7262 0.8496 -5.5682 {"}'M' greentint -9.5764 1.0034 -5.4173 {"}'M' greentint -9.4812 1.2397 -5.3598 {"}'M' greentint -9.618 1.1476 -5.6284 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 139 1pl3A_169F_141}P -6.3586 6.4042 -11.3687 {"}-6.3586 6.4042 -11.3687 { ca gly A 139 1pl3A_169F_141}-7.012 6.805 -10.1386 { c gly A 139 1pl3A_169F_141}-7.248 5.6542 -9.1851 { o gly A 139 1pl3A_169F_141}-6.7329 4.584 -9.3835 { c gly A 139 1pl3A_169F_141}P -7.248 5.6542 -9.1851 { n val A 140 1pl3A_169F_141}-8.0425 5.9078 -8.1502 { ca val A 140 1pl3A_169F_141}-8.3369 4.9119 -7.129 { c val A 140 1pl3A_169F_141}-9.8418 4.742 -7.0281 { o val A 140 1pl3A_169F_141}-10.5894 5.7045 -7.005 { c val A 140 1pl3A_169F_141}P -9.8418 4.742 -7.0281 { n leu A 141 1pl3A_169F_141}-10.2858 3.4919 -7.0027 { ca leu A 141 1pl3A_169F_141}-11.6738 3.1569 -6.7283 { c leu A 141 1pl3A_169F_141}-11.7155 2.4587 -5.3648 { o leu A 141 1pl3A_169F_141}-10.6935 1.9857 -4.8922 { c leu A 141 1pl3A_169F_141}P -11.7155 2.4587 -5.3648 { n ala A 142 1pl3A_169F_141}-12.8659 2.4455 -4.7109 { ca ala A 142 1pl3A_169F_141}-13.0422 1.6632 -3.5087 { c ala A 142 1pl3A_169F_141}-14.3717 0.9704 -3.546 { o ala A 142 1pl3A_169F_141}-15.2532 1.3214 -4.3235 { c ala A 142 1pl3A_169F_141}P -14.3717 0.9704 -3.546 { n trp A 143 1pl3A_169F_141}-14.4597 -0.0909 -2.7594 { ca trp A 143 1pl3A_169F_141}-15.6708 -0.8773 -2.5997 { c trp A 143 1pl3A_169F_141}-15.9687 -0.9685 -1.1337 { o trp A 143 1pl3A_169F_141}-15.0806 -0.827 -0.2786 { n gly A 167 1pl3A_169F_141}P -12.3072 -1.714 0.7941 {"}-12.3072 -1.714 0.7941 { ca gly A 167 1pl3A_169F_141}-10.9956 -1.8741 0.1659 { c gly A 167 1pl3A_169F_141}-10.8878 -0.9507 -1.0356 { o gly A 167 1pl3A_169F_141}-11.865 -0.2942 -1.4599 { c gly A 167 1pl3A_169F_141}P -10.8878 -0.9507 -1.0356 { n phe A 168 1pl3A_169F_141}-9.6703 -0.8898 -1.5522 { ca phe A 168 1pl3A_169F_141}-9.2202 0.0708 -2.5576 { c phe A 168 1pl3A_169F_141}-8.5918 -0.6626 -3.7152 { o phe A 168 1pl3A_169F_141}-8.1058 -1.7883 -3.5749 { c phe A 168 1pl3A_169F_141}P -8.5918 -0.6626 -3.7152 { n phe A 169 1pl3A_169F_141}-8.6147 -0.0241 -4.8782 { ca phe A 169 1pl3A_169F_141}-7.7466 -0.4861 -5.9496 { c phe A 169 1pl3A_169F_141}-7.4165 0.6031 -6.9364 { o phe A 169 1pl3A_169F_141}-8.256 1.4561 -7.2481 { c phe A 169 1pl3A_169F_141}P -7.4165 0.6031 -6.9364 { n gly A 170 1pl3A_169F_141}-6.1606 0.5829 -7.3925 { ca gly A 170 1pl3A_169F_141}-5.6917 1.4219 -8.486 { c gly A 170 1pl3A_169F_141}-6.2314 0.9796 -9.8439 { o gly A 170 1pl3A_169F_141}-6.3312 -0.2074 -10.1452 { c gly A 170 1pl3A_169F_141}P -6.2314 0.9796 -9.8439 { n ile A 171 1pl3A_169F_141}-6.5758 1.9591 -10.6647 { ca ile A 171 1pl3A_169F_141}-7.0511 1.7025 -12.0247 { c ile A 171 1pl3A_169F_141}-6.4436 2.7053 -12.9955 { o ile A 171 1pl3A_169F_141}-6.374 3.9021 -12.7275 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 139 1pl3A_169F_141}P -6.3586 6.4042 -11.3687 { ca gly A 139 1pl3A_169F_141}P -7.012 6.805 -10.1386 {"}P -7.012 6.805 -10.1386 { n val A 140 1pl3A_169F_141}P -8.0425 5.9078 -8.1502 { ca val A 140 1pl3A_169F_141}P -8.3369 4.9119 -7.129 { n leu A 141 1pl3A_169F_141}P -10.2858 3.4919 -7.0027 { ca leu A 141 1pl3A_169F_141}P -11.6738 3.1569 -6.7283 { n ala A 142 1pl3A_169F_141}P -12.8659 2.4455 -4.7109 { ca ala A 142 1pl3A_169F_141}P -13.0422 1.6632 -3.5087 { n trp A 143 1pl3A_169F_141}P -14.4597 -0.0909 -2.7594 { ca trp A 143 1pl3A_169F_141}P -15.6708 -0.8773 -2.5997 { n gly A 167 1pl3A_169F_141}P -12.3072 -1.714 0.7941 { ca gly A 167 1pl3A_169F_141}P -10.9956 -1.8741 0.1659 {"}P -10.9956 -1.8741 0.1659 { n phe A 168 1pl3A_169F_141}P -9.6703 -0.8898 -1.5522 { ca phe A 168 1pl3A_169F_141}P -9.2202 0.0708 -2.5576 { n phe A 169 1pl3A_169F_141}P -8.6147 -0.0241 -4.8782 { ca phe A 169 1pl3A_169F_141}P -7.7466 -0.4861 -5.9496 { n gly A 170 1pl3A_169F_141}P -6.1606 0.5829 -7.3925 { ca gly A 170 1pl3A_169F_141}P -5.6917 1.4219 -8.486 {"}P -5.6917 1.4219 -8.486 { n ile A 171 1pl3A_169F_141}P -6.5758 1.9591 -10.6647 { ca ile A 171 1pl3A_169F_141}P -7.0511 1.7025 -12.0247 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 139 1pl3A_169F_141}P -7.012 6.805 -10.1386 {"}-7.012 6.805 -10.1386 { ca val A 140 1pl3A_169F_141}-8.3369 4.9119 -7.129 { ca leu A 141 1pl3A_169F_141}-11.6738 3.1569 -6.7283 { ca ala A 142 1pl3A_169F_141}-13.0422 1.6632 -3.5087 { ca trp A 143 1pl3A_169F_141}-15.6708 -0.8773 -2.5997 { ca gly A 167 1pl3A_169F_141}P -10.9956 -1.8741 0.1659 {"}-10.9956 -1.8741 0.1659 { ca phe A 168 1pl3A_169F_141}-9.2202 0.0708 -2.5576 { ca phe A 169 1pl3A_169F_141}-7.7466 -0.4861 -5.9496 { ca gly A 170 1pl3A_169F_141}-5.6917 1.4219 -8.486 { ca ile A 171 1pl3A_169F_141}-7.0511 1.7025 -12.0247 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca leu A 141 1pl3A_169F_141}P -11.6738 3.1569 -6.7283 { cb leu A 141 1pl3A_169F_141}-12.1799 2.2381 -7.8443 { cg leu A 141 1pl3A_169F_141}-12.4509 2.9741 -9.1773 { cd1 leu A 141 1pl3A_169F_141}-12.6428 1.9797 -10.2909 { cg leu A 141 1pl3A_169F_141}P -12.4509 2.9741 -9.1773 { cd2 leu A 141 1pl3A_169F_141}-13.6859 3.8096 -9.055 { ca phe A 169 1pl3A_169F_141}P -7.7466 -0.4861 -5.9496 { cb phe A 169 1pl3A_169F_141}-8.3391 -1.7346 -6.6367 { cg phe A 169 1pl3A_169F_141}-9.6833 -1.5503 -7.2464 { cd1 phe A 169 1pl3A_169F_141}-10.8377 -1.6013 -6.4578 { ce1 phe A 169 1pl3A_169F_141}-12.0901 -1.5097 -7.0455 { cz phe A 169 1pl3A_169F_141}-12.1865 -1.2995 -8.4334 { cg phe A 169 1pl3A_169F_141}P -9.6833 -1.5503 -7.2464 { cd2 phe A 169 1pl3A_169F_141}-9.8159 -1.3646 -8.6098 { ce2 phe A 169 1pl3A_169F_141}-11.0786 -1.2667 -9.196 { cz phe A 169 1pl3A_169F_141}ghost -12.1865 -1.2995 -8.4334 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb leu A 141 1pl3A_169F_141}P -12.1799 2.2381 -7.8443 {"}P -12.1799 2.2381 -7.8443 { cg leu A 141 1pl3A_169F_141}P -12.4509 2.9741 -9.1773 { cd1 leu A 141 1pl3A_169F_141}P -12.6428 1.9797 -10.2909 {"}P -12.6428 1.9797 -10.2909 {"}P -12.6428 1.9797 -10.2909 { cd2 leu A 141 1pl3A_169F_141}P -13.6859 3.8096 -9.055 {"}P -13.6859 3.8096 -9.055 {"}P -13.6859 3.8096 -9.055 { cb phe A 169 1pl3A_169F_141}P -8.3391 -1.7346 -6.6367 {"}P -8.3391 -1.7346 -6.6367 { cd1 phe A 169 1pl3A_169F_141}P -10.8377 -1.6013 -6.4578 { cd2 phe A 169 1pl3A_169F_141}P -9.8159 -1.3646 -8.6098 { ce1 phe A 169 1pl3A_169F_141}P -12.0901 -1.5097 -7.0455 { ce2 phe A 169 1pl3A_169F_141}P -11.0786 -1.2667 -9.196 { cz phe A 169 1pl3A_169F_141}P -12.1865 -1.2995 -8.4334 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 169 A}'S' blue -10.688 0.0232 -7.9962 {"}'S' blue -10.4536 0.1664 -8.052 {"}'S' blue -10.6147 0.1515 -8.2551 {"}'S' blue -10.3528 0.2733 -8.3094 { CE1 PHE 169 A}'S' blue -12.1573 0.2381 -6.9724 {"}'S' blue -12.3189 0.2206 -7.1773 {"}'S' blue -12.4828 0.1639 -7.373 {"}'S' blue -11.9784 0.2325 -7.1692 {"}'S' sky -12.1406 0.209 -7.3718 {"}'S' blue -11.6123 0.172 -7.1129 {"}'S' sky -11.7699 0.1893 -7.3204 {"}'S' blue -11.399 0.0856 -7.2408 {"}'S' sky -11.5548 0.107 -7.4485 {"}'S' blue -11.3429 -0.0115 -7.5556 { CE2 PHE 169 A}'S' blue -11.9367 0.2566 -9.2776 {"}'S' sky -12.0918 0.1379 -9.4455 {"}'S' sky -10.7981 0.1127 -8.1568 {"}'S' sky -11.4907 0.4333 -9.1425 {"}'S' sky -11.6515 0.3808 -9.3349 {"}'S' sky -12.1055 0.007 -9.8172 {"}'S' sky -10.7081 0.2989 -8.507 {"}'S' sky -11.1459 0.481 -9.123 {"}'S' sky -11.3075 0.4636 -9.3279 {"}'S' sky -10.9202 0.4092 -9.6747 {"}'S' sky -11.545 -0.0424 -10.3556 {"}'S' sky -10.8685 0.2739 -9.9987 {"}'S' sky -11.1863 0.0484 -10.3458 {"}'S' blue -11.3317 -0.1147 -10.4885 { CZ PHE 169 A}'S' blue -12.6712 0.1974 -7.6672 {"}'S' blue -12.8242 0.2315 -7.8756 {"}'S' blue -12.9853 0.2166 -8.0786 {"}'S' sky -12.2842 0.1928 -7.5251 {"}'S' blue -12.8838 0.3022 -8.3303 {"}'S' sky -12.0186 0.2177 -7.5778 {"}'S' blue -12.7593 0.348 -8.5722 {"}'S' blue -12.5792 0.3741 -8.7609 {"}'S' blue -12.7403 0.2804 -8.9426 {"}'S' blue -12.8958 0.1507 -9.1084 {"}'S' blue -13.042 -0.0112 -9.2525 {"}'S' sky -12.2369 0.4192 -8.7596 {"}'S' blue -12.4005 0.3577 -8.9538 {"}'S' sky -12.5614 0.2592 -9.1341 {"}'S' blue -12.7156 0.1277 -9.2978 {"}'S' blue -12.8606 -0.036 -9.4398 {"}'S' sky -12.1912 0.3158 -9.1059 {"}'S' sky -12.3524 0.2193 -9.2871 {"}'S' sky -12.5074 0.0879 -9.4502 {"}'S' blue -12.6528 -0.0752 -9.5929 {"}'S' blue -11.9763 0.2411 -9.236 {"}'S' sky -12.1383 0.1458 -9.4186 {"}'S' blue -12.2942 0.0156 -9.5831 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 169 A}'S' sea -11.0588 0.0965 -8.0994 {"}'S' green -11.1764 0.2256 -8.2878 {"}'S' green -11.3118 0.3158 -8.4866 {"}'S' green -11.4597 0.3656 -8.6916 {"}'S' sea -11.6156 0.3712 -8.8957 {"}'S' sea -10.9107 0.2505 -8.3405 {"}'S' green -11.0387 0.3534 -8.5355 {"}'S' green -11.1811 0.4193 -8.7384 {"}'S' sea -11.333 0.4465 -8.9419 {"}'S' sea -11.8088 0.2911 -9.514 {"}'S' sea -11.962 0.1656 -9.6759 {"}'S' sea -10.8425 0.3973 -8.7079 {"}'S' sea -10.9893 0.458 -8.9156 {"}'S' sea -11.4714 0.4069 -9.5236 {"}'S' green -11.6325 0.3132 -9.7053 {"}'S' green -11.7879 0.1835 -9.8711 {"}'S' sea -11.9342 0.0215 -10.0152 {"}'S' sea -11.1291 0.452 -9.5223 {"}'S' green -11.2927 0.3905 -9.7165 {"}'S' green -11.4536 0.292 -9.8968 {"}'S' green -11.6078 0.1605 -10.0605 {"}'S' sea -11.7528 -0.0032 -10.2025 {"}'S' green -11.0834 0.3486 -9.8685 {"}'S' green -11.2446 0.2521 -10.0498 {"}'S' green -11.3996 0.1207 -10.2129 {"}'S' sea -11.0305 0.1786 -10.1813 { CZ PHE 169 A}'S' sea -12.4196 0.283 -7.7239 {"}'S' sea -12.5675 0.3328 -7.9289 {"}'S' sea -12.7234 0.3384 -8.133 {"}'S' sea -12.1465 0.3206 -7.7728 {"}'S' green -12.289 0.3865 -7.9757 {"}'S' green -12.4409 0.4137 -8.1793 {"}'S' sea -12.5985 0.4005 -8.3798 {"}'S' sea -11.6972 0.1324 -7.5533 {"}'S' green -11.8159 0.2661 -7.7443 {"}'S' green -11.9503 0.3645 -7.9453 {"}'S' green -12.0971 0.4253 -8.1529 {"}'S' green -12.2537 0.4482 -8.3603 {"}'S' sea -12.4153 0.4308 -8.5652 {"}'S' green -11.5086 0.1597 -7.7459 {"}'S' green -11.6309 0.2843 -7.9398 {"}'S' green -11.9179 0.4283 -8.3496 {"}'S' green -12.0748 0.4426 -8.5571 {"}'S' sea -11.3007 0.1112 -7.8984 {"}'S' green -11.4229 0.2375 -8.0909 {"}'S' green -11.7087 0.3822 -8.5008 {"}'S' sea -11.8663 0.3994 -8.7082 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 169 A}'S' P -11.7688 0.3753 -8.1423 {"}'S' -11.7737 0.3532 -8.1456 {"}'S' P -11.56 0.3284 -8.2939 {"}'S' -11.5627 0.3212 -8.2942 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LEU 141 A}'S' blue -12.4768 0.662 -7.1436 {"}'S' blue -12.9393 0.6978 -8.1804 {"}'S' sky -12.8018 0.6077 -7.9769 {"}'S' sky -12.6527 0.5547 -7.7696 {"}'S' sky -12.495 0.5403 -7.5627 {"}'S' blue -12.3328 0.5637 -7.3601 {"}'S' blue -12.17 0.6253 -7.1653 {"}'S' sky -12.7396 0.6575 -8.3442 {"}'S' sky -12.1341 0.5177 -7.524 {"}'S' blue -11.9717 0.5785 -7.3296 {"}'S' blue -11.8105 0.675 -7.1484 {"}'S' sky -12.6081 0.7313 -8.6238 {"}'S' sky -12.3519 0.7241 -8.7061 {"}'S' blue -12.1387 0.801 -8.8424 { CD1 LEU 141 A}'S' blue -12.9091 0.6366 -9.2017 {"}'S' blue -12.9397 0.4037 -9.5902 {"}'S' blue -12.7761 0.4793 -9.401 {"}'S' sky -12.6174 0.5911 -9.2266 {"}'S' blue -12.4658 0.7376 -9.0716 {"}'S' blue -12.7957 0.3054 -9.8067 {"}'S' sky -12.6329 0.3669 -9.6119 {"}'S' sky -12.4725 0.4646 -9.4321 {"}'S' sky -12.317 0.5968 -9.2685 {"}'S' blue -12.172 0.7605 -9.1265 {"}'S' blue -12.4346 0.3201 -9.7762 {"}'S' sky -12.2734 0.4166 -9.595 {"}'S' blue -12.1184 0.548 -9.4319 {"}'S' blue -11.973 0.7111 -9.2892 {"}'S' blue -12.3266 0.2753 -10.0541 {"}'S' sky -12.1638 0.3511 -9.8643 {"}'S' sky -12.0055 0.4649 -9.691 { HB2 LEU 141 A}'S' sky -11.85 0.508 -7.4479 {"}'S' blue -11.6919 0.5848 -7.2647 {"}'S' blue -11.4678 0.479 -7.3563 {"}'S' sky -11.3217 0.3684 -7.5689 {"}'S' sky -11.8722 0.6894 -8.8013 {"}'S' blue -10.9 0.4138 -7.8779 {"}'S' sky -11.358 0.6976 -8.9156 {"}'S' sky -10.8004 0.4688 -8.132 {"}'S' blue -10.6432 0.5872 -7.9612 {"}'S' sky -11.1198 0.8045 -8.9459 {"}'S' sky -10.7238 0.5875 -8.3721 {"}'S' blue -10.729 0.7719 -8.6623 { HB3 LEU 141 A}'S' blue -13.031 0.6667 -7.9551 {"}'S' blue -12.8837 0.6237 -7.7525 {HD12 LEU 141 A}'S' sky -11.8387 0.6392 -9.4857 {"}'S' sky -12.0833 0.2859 -10.1135 {"}'S' sky -11.4817 0.7179 -9.4565 {"}'S' sky -11.9335 0.2158 -10.332 {"}'S' sky -11.2054 0.766 -9.5445 {"}'S' sky -11.6771 0.1991 -10.4272 {"}'S' blue -11.5136 0.2439 -10.6377 {"}'S' sky -10.9144 0.6481 -9.976 {"}'S' blue -11.0981 0.3927 -10.5105 {"}'S' blue -10.9409 0.5111 -10.3398 {HD13 LEU 141 A}'S' blue -13.2301 0.3704 -9.4447 {"}'S' blue -13.0906 0.5312 -9.3078 {"}'S' blue -12.9734 0.4132 -9.5563 @dotlist {x} color= white width= 1 master= {vdw contact} { CB LEU 141 A}'S' sea -12.6021 0.5657 -8.1421 {"}'S' green -12.4535 0.5119 -7.9353 {"}'S' sea -12.2962 0.4956 -7.7268 {"}'S' sea -12.4813 0.6156 -8.4276 {"}'S' green -12.3393 0.5372 -8.2224 {"}'S' green -12.1869 0.4964 -8.0151 {"}'S' sea -12.2235 0.6206 -8.5105 { HB2 LEU 141 A}'S' sea -12.0074 0.4901 -7.647 {"}'S' green -12.0749 0.4692 -8.1377 {"}'S' green -11.9375 0.3877 -7.9382 {"}'S' green -11.7856 0.362 -7.735 {"}'S' sea -11.6262 0.3924 -7.5377 {"}'S' green -12.0226 0.5686 -8.5299 {"}'S' green -11.9138 0.428 -8.3508 {"}'S' green -11.6358 0.2919 -7.9535 {"}'S' green -11.4803 0.3039 -7.7556 {"}'S' green -11.7846 0.5133 -8.6379 {"}'S' green -11.6684 0.3815 -8.4524 {"}'S' green -11.3795 0.2752 -8.0486 {"}'S' sea -11.2201 0.3056 -7.8514 {"}'S' sea -11.5942 0.6166 -8.8319 {"}'S' green -11.4916 0.4638 -8.6569 {"}'S' green -11.3632 0.363 -8.4617 {"}'S' green -11.2159 0.32 -8.2591 {"}'S' sea -11.0577 0.3378 -8.0607 {"}'S' green -11.2544 0.5389 -8.7376 {"}'S' green -11.1195 0.4441 -8.5367 {"}'S' sea -10.9637 0.4198 -8.3285 {"}'S' sea -11.0173 0.6518 -8.7708 {"}'S' sea -10.8801 0.5767 -8.5714 {HD12 LEU 141 A}'S' sea -11.9239 0.3163 -9.9163 {"}'S' green -11.7654 0.4029 -9.7349 {"}'S' sea -11.6161 0.5389 -9.5789 {"}'S' green -11.778 0.2278 -10.1342 {"}'S' green -11.6193 0.2923 -9.9474 {"}'S' green -11.4664 0.4084 -9.782 {"}'S' sea -11.3269 0.5691 -9.6451 {"}'S' green -11.5177 0.2296 -10.23 {"}'S' green -11.3597 0.3153 -10.049 {"}'S' green -11.2096 0.4511 -9.8936 {"}'S' sea -11.0755 0.6311 -9.7702 {"}'S' sea -11.3554 0.2617 -10.4392 {"}'S' sea -11.1977 0.3377 -10.2564 {"}'S' sea -11.0472 0.4691 -10.0979 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 LEU 141 A}'S' P -11.7831 0.3336 -8.1558 {"}'S' -11.7763 0.3548 -8.1529 {"}'S' P -11.5318 0.3002 -8.2524 {"}'S' -11.5312 0.3068 -8.2513 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 169 A}'M' greentint -9.3294 2.1365 -6.661 {"}'M' greentint -9.478 1.9795 -6.8095 {"}'M' greentint -9.5818 1.8832 -7.107 {"}'M' greentint -9.0223 2.375 -6.5212 {"}'M' greentint -9.1802 2.3666 -6.7232 {"}'M' greentint -9.3388 2.2735 -6.9016 {"}'M' greentint -9.478 2.1055 -7.0347 {"}'M' greentint -9.5514 1.9772 -7.3518 {"}'M' greentint -9.6225 1.7321 -7.376 {"}'M' greentint -8.9932 2.5557 -6.791 {"}'M' greentint -9.1534 2.4975 -6.983 {"}'M' greentint -9.3082 2.3744 -7.1477 {"}'M' greentint -9.4439 2.1969 -7.2739 {"}'M' greentint -9.4735 2.0574 -7.59 {"}'M' greentint -8.9101 2.6751 -7.0344 {"}'M' greentint -9.0725 2.5935 -7.2208 {"}'M' greentint -9.2248 2.4576 -7.3808 {"}'M' greentint -9.3614 2.276 -7.5056 {"}'M' greentint -9.359 2.1022 -7.8197 {"}'M' greentint -8.8156 2.7386 -7.2941 {"}'M' greentint -8.9714 2.6398 -7.4674 {"}'M' greentint -9.1176 2.4962 -7.6173 {"}'M' greentint -9.2484 2.3142 -7.7357 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LEU 141 A}'M' greentint -9.5516 1.7091 -7.1286 {"}'M' greentint -9.3934 1.7728 -6.9423 {"}'M' greentint -9.2432 1.8972 -6.7825 {"}'M' greentint -9.1101 2.0728 -6.6594 {"}'M' greentint -9.0048 2.2875 -6.5816 {"}'M' greentint -9.501 1.7681 -7.4796 {"}'M' greentint -9.3428 1.7703 -7.2759 {"}'M' greentint -9.1822 1.8462 -7.089 {"}'M' greentint -9.0326 1.9916 -6.9366 {"}'M' greentint -8.9081 2.1916 -6.8308 {"}'M' greentint -8.8195 2.4292 -6.7827 {"}'M' greentint -9.3979 1.9307 -7.7347 {"}'M' greentint -9.2491 1.8811 -7.5286 {"}'M' greentint -9.0868 1.926 -7.3306 {"}'M' greentint -8.9326 2.0586 -7.1689 {"}'M' greentint -8.8083 2.262 -7.0643 {"}'M' greentint -8.7301 2.5076 -7.0322 {"}'M' greentint -8.7091 2.7631 -7.0755 {"}'M' greentint -9.2699 2.1663 -7.8972 {"}'M' greentint -9.1382 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-9.882 1.4818 -5.0196 {"}'M' greentint -10.0234 1.3112 -5.1552 {"}'M' greentint -10.03 1.1574 -5.464 {"}'M' greentint -10.0983 0.9084 -5.4817 {"}'M' greentint -9.466 1.7044 -4.8864 {"}'M' greentint -9.6273 1.6652 -5.0842 {"}'M' greentint -9.7839 1.5532 -5.2556 {"}'M' greentint -9.9225 1.3784 -5.3864 {"}'M' greentint -9.8846 1.1769 -5.6816 {"}'M' greentint -9.3378 1.7553 -5.1346 {"}'M' greentint -9.496 1.6916 -5.3209 {"}'M' greentint -9.6462 1.5672 -5.4808 {"}'M' greentint -9.7794 1.3916 -5.6039 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O LEU 141 A}'M' greentint -10.0601 0.7435 -4.763 {"}'M' greentint -9.9083 0.8641 -4.6002 {"}'M' greentint -9.768 1.0261 -4.4642 {"}'M' greentint -9.646 1.2227 -4.3612 {"}'M' greentint -10.1153 0.7478 -5.1983 {"}'M' greentint -9.9527 0.8035 -5.0042 {"}'M' greentint -9.7949 0.9138 -4.8307 {"}'M' greentint -9.6495 1.0755 -4.6878 {"}'M' greentint -9.5249 1.2779 -4.5842 {"}'M' greentint -9.4284 1.511 -4.5243 {"}'M' 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-12.1703 0.9917 -7.4475 {"}'S' -12.1988 1.036 -7.4198 {"}'S' P -12.0139 1.0025 -7.2483 {"}'S' -12.0431 1.0369 -7.2345 {"}'S' P -11.8578 1.0979 -7.0737 {"}'S' -11.8665 1.1057 -7.072 {"}'S' P -12.1525 1.2897 -7.7391 {"}'S' -12.1625 1.2999 -7.7243 {"}'S' P -12.0191 1.1869 -7.5384 {"}'S' -12.0397 1.2061 -7.5197 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 87 X}'M' sky -9.4475 2.0294 -6.369 {"}'M' sky -9.5016 1.9309 -6.6016 {"}'M' sky -9.0421 2.9111 -6.2811 {"}'M' sky -9.3065 2.4118 -7.4222 {"}'M' sky -9.1103 2.8587 -7.2937 @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 87 X}'M' sea -9.2901 2.3931 -6.1497 {"}'M' green -9.4336 2.2853 -6.4222 {"}'M' sea -9.1914 2.6809 -6.2189 {"}'M' green -9.34 2.524 -6.3674 {"}'M' green -9.5002 2.1782 -6.6681 {"}'M' green -9.2007 2.8179 -6.4595 {"}'M' green -9.4844 2.2766 -6.9339 {"}'M' sea -9.515 2.0228 -6.9024 {"}'M' sea -9.0153 3.042 -6.5409 {"}'M' green -9.1701 2.9189 -6.7056 {"}'M' green -9.3354 2.6019 -7.1479 {"}'M' green -9.4166 2.3587 -7.1863 {"}'M' sea -9.464 2.1043 -7.176 {"}'M' sea -9.0867 3.0021 -6.9387 {"}'M' green -9.2234 2.8205 -7.0635 {"}'M' sea -9.2209 2.6467 -7.3776 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 87 X}'M' greentint -9.4437 2.4277 -6.6649 {"}'M' greentint -9.34 2.65 -6.5927 {"}'M' greentint -9.4133 2.5217 -6.9097 {"}'M' greentint -9.3058 2.7414 -6.8318 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H LYS 142 X}'M' -9.6305 2.345 -6.2127 {"}'M' -9.5253 2.5596 -6.135 @dotlist {x} color= sky width= 1 master= {vdw contact} { H LYS 142 X}'M' sea -9.7026 2.1184 -6.6424 {"}'M' green -9.5531 2.2638 -6.49 {"}'M' green -9.4285 2.4637 -6.3841 {"}'M' green -9.34 2.7013 -6.3361 {"}'M' sea -9.2954 2.956 -6.3488 {"}'M' green -9.6073 2.1981 -6.884 {"}'M' green -9.2295 3.0352 -6.6288 {"}'M' sea -9.6586 2.3367 -7.2523 {"}'M' green -9.4976 2.3648 -7.0524 {"}'M' green -9.2385 3.0045 -6.8955 {"}'M' sea -9.5251 2.5545 -7.3059 {"}'M' green -9.3652 2.6515 -7.1264 {"}'M' green -9.3102 2.9047 -7.1262 {"}'M' sea -9.4435 2.8011 -7.3257 @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 142 X}'M' greentint -9.4531 2.3308 -6.7222 {"}'M' greentint -9.3288 2.5341 -6.6176 {"}'M' greentint -9.2505 2.7798 -6.5855 {"}'M' greentint -9.3496 2.5167 -6.9035 {"}'M' greentint -9.2548 2.7508 -6.8462 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 87 X}'M' green -9.6967 1.2846 -4.3079 {"}'M' green -9.8285 1.2576 -5.2987 {"}'M' green -9.3576 2.0145 -4.9013 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 87 X}'M' greentint -9.83 1.181 -4.5074 {"}'M' greentint -9.615 1.5312 -4.3277 {"}'M' greentint -9.775 1.4343 -4.5072 {"}'M' greentint -9.8854 1.3349 -4.7874 {"}'M' greentint -9.9017 1.0812 -4.7381 {"}'M' greentint -9.4816 1.749 -4.3813 {"}'M' greentint -9.6426 1.721 -4.5812 {"}'M' greentint -9.7906 1.569 -4.7301 {"}'M' greentint -9.8571 1.4324 -5.041 {"}'M' greentint -9.9075 1.1777 -5.0364 {"}'M' greentint -9.452 1.9221 -4.6538 {"}'M' greentint -9.6123 1.831 -4.8367 {"}'M' greentint -9.7537 1.6605 -4.9722 {"}'M' greentint -9.7603 1.5066 -5.2811 {"}'M' greentint -9.5142 1.9024 -5.0727 {"}'M' greentint -9.6528 1.7277 -5.2034 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LYS 142 X}'M' green -9.8975 1.061 -4.574 {"}'M' green -9.5311 1.6582 -4.2676 {"}'M' green -9.9844 1.0529 -5.0002 {"}'M' green -9.4104 1.9758 -4.5152 {"}'M' green -9.8906 1.4202 -5.431 {"}'M' green -9.4661 2.0959 -5.0698 {"}'M' green -9.6193 1.7473 -5.2886 @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 142 X}'M' greentint -9.7521 1.2227 -4.431 {"}'M' greentint -9.6275 1.4251 -4.3274 {"}'M' greentint -9.8247 1.1414 -4.8192 {"}'M' greentint -9.678 1.291 -4.6716 {"}'M' greentint -9.5542 1.4908 -4.5669 {"}'M' greentint -9.4624 1.725 -4.5136 {"}'M' greentint -9.8661 1.2234 -5.1543 {"}'M' greentint -9.7091 1.3192 -4.9769 {"}'M' greentint -9.5706 1.4898 -4.8454 {"}'M' greentint -9.4677 1.7133 -4.7746 {"}'M' greentint -9.4133 1.963 -4.7743 {"}'M' greentint -9.7275 1.4494 -5.2283 {"}'M' greentint -9.5777 1.6031 -5.0775 {"}'M' greentint -9.4824 1.8394 -5.02 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 252 1pn2A_254F_269}P -11.9464 -2.5206 0.2067 {"}-11.9464 -2.5206 0.2067 { ca ile A 252 1pn2A_254F_269}-10.7364 -2.6978 -0.6075 { c ile A 252 1pn2A_254F_269}-10.6059 -1.4735 -1.5118 { o ile A 252 1pn2A_254F_269}-11.4466 -1.2433 -2.3852 { c ile A 252 1pn2A_254F_269}P -10.6059 -1.4735 -1.5118 { n val A 253 1pn2A_254F_269}-9.5287 -0.7175 -1.3194 { ca val A 253 1pn2A_254F_269}-9.2167 0.4502 -2.1489 { c val A 253 1pn2A_254F_269}-8.3938 -0.033 -3.3166 { o val A 253 1pn2A_254F_269}-7.5848 -0.9423 -3.1927 { c val A 253 1pn2A_254F_269}P -8.3938 -0.033 -3.3166 { n phe A 254 1pn2A_254F_269}-8.6249 0.5513 -4.4819 { ca phe A 254 1pn2A_254F_269}-7.9194 0.1362 -5.6767 { c phe A 254 1pn2A_254F_269}-7.6673 1.2769 -6.6658 { o phe A 254 1pn2A_254F_269}-8.2155 2.3807 -6.558 { c phe A 254 1pn2A_254F_269}P -7.6673 1.2769 -6.6658 { n gln A 255 1pn2A_254F_269}-6.736 0.9875 -7.5568 { ca gln A 255 1pn2A_254F_269}-6.4328 1.7838 -8.7341 { c gln A 255 1pn2A_254F_269}-6.2855 0.8196 -9.907 { o gln A 255 1pn2A_254F_269}-5.9227 -0.3455 -9.7347 { c gln A 255 1pn2A_254F_269}P -6.2855 0.8196 -9.907 { n thr A 256 1pn2A_254F_269}-6.5492 1.3074 -11.1084 { ca thr A 256 1pn2A_254F_269}-6.2595 0.5181 -12.2976 { c thr A 256 1pn2A_254F_269}-5.3527 1.2822 -13.2284 { o thr A 256 1pn2A_254F_269}-5.6995 2.3797 -13.707 { n asn A 267 1pn2A_254F_269}P -8.837 5.6101 -10.6617 {"}-8.837 5.6101 -10.6617 { ca asn A 267 1pn2A_254F_269}-8.3117 6.066 -9.3864 { c asn A 267 1pn2A_254F_269}-9.4864 6.3975 -8.4394 { o asn A 267 1pn2A_254F_269}-10.6613 6.3094 -8.8186 { c asn A 267 1pn2A_254F_269}P -9.4864 6.3975 -8.4394 { n asn A 268 1pn2A_254F_269}-9.1491 6.7577 -7.2114 { ca asn A 268 1pn2A_254F_269}-10.128 7.1893 -6.2076 { c asn A 268 1pn2A_254F_269}-11.2658 6.1862 -6.0897 { o asn A 268 1pn2A_254F_269}-12.4342 6.5533 -6.1163 { c asn A 268 1pn2A_254F_269}P -11.2658 6.1862 -6.0897 { n ala A 269 1pn2A_254F_269}-10.8955 4.9265 -5.9334 { ca ala A 269 1pn2A_254F_269}-11.8139 3.8008 -6.1149 { c ala A 269 1pn2A_254F_269}-11.7881 2.7964 -4.9754 { o ala A 269 1pn2A_254F_269}-10.7423 2.5303 -4.3826 { c ala A 269 1pn2A_254F_269}P -11.7881 2.7964 -4.9754 { n ala A 270 1pn2A_254F_269}-12.9424 2.2029 -4.7037 { ca ala A 270 1pn2A_254F_269}-13.043 1.1343 -3.6984 { c ala A 270 1pn2A_254F_269}-14.2528 0.2264 -3.9109 { o ala A 270 1pn2A_254F_269}-15.1875 0.5953 -4.6096 { c ala A 270 1pn2A_254F_269}P -14.2528 0.2264 -3.9109 { n ile A 271 1pn2A_254F_269}-14.202 -0.9615 -3.3088 { ca ile A 271 1pn2A_254F_269}-15.352 -1.8727 -3.1791 { c ile A 271 1pn2A_254F_269}-15.6273 -2.1597 -1.7058 { o ile A 271 1pn2A_254F_269}-14.7208 -2.146 -0.8613 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 252 1pn2A_254F_269}P -11.9464 -2.5206 0.2067 { ca ile A 252 1pn2A_254F_269}P -10.7364 -2.6978 -0.6075 { n val A 253 1pn2A_254F_269}P -9.5287 -0.7175 -1.3194 { ca val A 253 1pn2A_254F_269}P -9.2167 0.4502 -2.1489 { n phe A 254 1pn2A_254F_269}P -8.6249 0.5513 -4.4819 { ca phe A 254 1pn2A_254F_269}P -7.9194 0.1362 -5.6767 { n gln A 255 1pn2A_254F_269}P -6.736 0.9875 -7.5568 { ca gln A 255 1pn2A_254F_269}P -6.4328 1.7838 -8.7341 { n thr A 256 1pn2A_254F_269}P -6.5492 1.3074 -11.1084 { ca thr A 256 1pn2A_254F_269}P -6.2595 0.5181 -12.2976 { n asn A 267 1pn2A_254F_269}P -8.837 5.6101 -10.6617 { ca asn A 267 1pn2A_254F_269}P -8.3117 6.066 -9.3864 { n asn A 268 1pn2A_254F_269}P -9.1491 6.7577 -7.2114 { ca asn A 268 1pn2A_254F_269}P -10.128 7.1893 -6.2076 { n ala A 269 1pn2A_254F_269}P -10.8955 4.9265 -5.9334 { ca ala A 269 1pn2A_254F_269}P -11.8139 3.8008 -6.1149 { n ala A 270 1pn2A_254F_269}P -12.9424 2.2029 -4.7037 { ca ala A 270 1pn2A_254F_269}P -13.043 1.1343 -3.6984 { n ile A 271 1pn2A_254F_269}P -14.202 -0.9615 -3.3088 { ca ile A 271 1pn2A_254F_269}P -15.352 -1.8727 -3.1791 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 252 1pn2A_254F_269}P -10.7364 -2.6978 -0.6075 {"}-10.7364 -2.6978 -0.6075 { ca val A 253 1pn2A_254F_269}-9.2167 0.4502 -2.1489 { ca phe A 254 1pn2A_254F_269}-7.9194 0.1362 -5.6767 { ca gln A 255 1pn2A_254F_269}-6.4328 1.7838 -8.7341 { ca thr A 256 1pn2A_254F_269}-6.2595 0.5181 -12.2976 { ca asn A 267 1pn2A_254F_269}P -8.3117 6.066 -9.3864 {"}-8.3117 6.066 -9.3864 { ca asn A 268 1pn2A_254F_269}-10.128 7.1893 -6.2076 { ca ala A 269 1pn2A_254F_269}-11.8139 3.8008 -6.1149 { ca ala A 270 1pn2A_254F_269}-13.043 1.1343 -3.6984 { ca ile A 271 1pn2A_254F_269}-15.352 -1.8727 -3.1791 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 254 1pn2A_254F_269}P -7.9194 0.1362 -5.6767 { cb phe A 254 1pn2A_254F_269}-8.5838 -1.0935 -6.3401 { cg phe A 254 1pn2A_254F_269}-9.8727 -0.8008 -7.1227 { cd1 phe A 254 1pn2A_254F_269}-11.0982 -0.7382 -6.4863 { ce1 phe A 254 1pn2A_254F_269}-12.2771 -0.5074 -7.2103 { cz phe A 254 1pn2A_254F_269}-12.212 -0.3683 -8.6141 { cg phe A 254 1pn2A_254F_269}P -9.8727 -0.8008 -7.1227 { cd2 phe A 254 1pn2A_254F_269}-9.8364 -0.6628 -8.499 { ce2 phe A 254 1pn2A_254F_269}-10.9927 -0.4395 -9.247 { cz phe A 254 1pn2A_254F_269}ghost -12.212 -0.3683 -8.6141 { ca ala A 269 1pn2A_254F_269}P -11.8139 3.8008 -6.1149 { cb ala A 269 1pn2A_254F_269}-11.497 3.0957 -7.38 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 254 1pn2A_254F_269}P -8.5838 -1.0935 -6.3401 {"}P -8.5838 -1.0935 -6.3401 { cd1 phe A 254 1pn2A_254F_269}P -11.0982 -0.7382 -6.4863 { cd2 phe A 254 1pn2A_254F_269}P -9.8364 -0.6628 -8.499 { ce1 phe A 254 1pn2A_254F_269}P -12.2771 -0.5074 -7.2103 { ce2 phe A 254 1pn2A_254F_269}P -10.9927 -0.4395 -9.247 { cz phe A 254 1pn2A_254F_269}P -12.212 -0.3683 -8.6141 { cb ala A 269 1pn2A_254F_269}P -11.497 3.0957 -7.38 {"}P -11.497 3.0957 -7.38 {"}P -11.497 3.0957 -7.38 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 254 A}'S' blue -11.1487 0.9806 -6.8126 { CE1 PHE 254 A}'S' blue -11.5136 1.0296 -6.8679 {"}'S' blue -11.3781 0.9623 -7.5167 { CZ PHE 254 A}'S' sky -12.624 1.3318 -8.5605 {"}'S' blue -11.429 0.9346 -7.7474 {"}'S' blue -11.3262 1.0425 -8.0792 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 254 A}'S' sea -12.8141 1.1305 -6.91 {"}'S' sea -12.3796 1.1786 -6.7527 {"}'S' green -12.5315 1.2058 -6.9562 {"}'S' green -12.6892 1.1926 -7.1568 {"}'S' green -12.85 1.1401 -7.3492 {"}'S' sea -12.041 1.1566 -6.7223 {"}'S' green -12.1878 1.2174 -6.9299 {"}'S' green -12.6698 1.1662 -7.5379 {"}'S' sea -12.831 1.0725 -7.7196 {"}'S' green -11.8595 1.1674 -6.9193 {"}'S' sea -11.6507 1.1205 -7.0709 {"}'S' green -11.586 1.0878 -7.4057 {"}'S' green -11.7419 1.1093 -7.6134 { CZ PHE 254 A}'S' green -12.6967 1.1286 -7.848 {"}'S' sea -12.8497 1.1628 -8.0564 {"}'S' green -12.593 1.2641 -8.1097 {"}'S' sea -12.7489 1.2697 -8.3138 {"}'S' green -12.4663 1.3449 -8.36 {"}'S' green -11.8414 1.1973 -7.925 {"}'S' green -12.1226 1.3565 -8.3337 {"}'S' sea -12.2792 1.3795 -8.541 {"}'S' sea -11.5341 1.091 -7.9267 {"}'S' green -11.6564 1.2155 -8.1206 {"}'S' green -11.7943 1.3066 -8.323 {"}'S' sea -11.9434 1.3596 -8.5303 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 254 A}'S' P -12.3444 1.2403 -7.1373 {"}'S' -12.3425 1.1996 -7.1391 {"}'S' P -12.506 1.2229 -7.3422 {"}'S' -12.5007 1.1829 -7.3395 {"}'S' P -12.0085 1.2204 -7.1266 {"}'S' -12.0127 1.193 -7.1278 {"}'S' P -12.1654 1.2347 -7.3341 {"}'S' -12.1697 1.1659 -7.3292 {"}'S' P -12.3276 1.2113 -7.5366 {"}'S' -12.3256 1.1521 -7.5256 {"}'S' P -12.4912 1.1498 -7.7308 {"}'S' -12.4909 1.1464 -7.7296 {"}'S' P -11.7993 1.1743 -7.2778 {"}'S' -11.7993 1.1743 -7.2778 {"}'S' P -11.9569 1.1915 -7.4852 {"}'S' -11.9643 1.1504 -7.479 {"}'S' P -12.1187 1.1685 -7.6891 {"}'S' -12.122 1.1345 -7.679 { CZ PHE 254 A}'S' P -12.4451 1.2143 -7.9047 {"}'S' -12.4425 1.2 -7.9115 {"}'S' P -12.044 1.1489 -7.7586 {"}'S' -12.0447 1.1359 -7.7667 {"}'S' P -12.172 1.2519 -7.9536 {"}'S' -12.1735 1.2161 -7.968 {"}'S' P -12.3144 1.3178 -8.1564 {"}'S' -12.3137 1.3036 -8.1591 {"}'S' P -11.9758 1.2957 -8.126 {"}'S' -11.9769 1.2883 -8.1275 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 269 A}'S' blue -11.7939 1.5196 -6.6794 {"}'S' sky -11.4512 1.3753 -7.0598 {"}'S' blue -11.2888 1.4361 -6.8654 {"}'S' sky -11.3446 1.3533 -7.3431 {"}'S' blue -11.1808 1.3913 -7.1433 {"}'S' blue -11.3995 1.4113 -7.8449 {"}'S' blue -11.4558 1.6586 -8.3782 {"}'S' blue -11.3288 1.5499 -8.1833 { HB1 ALA 269 A}'S' sky -12.416 1.6211 -8.4721 {"}'S' sky -11.8705 1.6127 -8.4407 @dotlist {x} color= white width= 1 master= {vdw contact} { HB1 ALA 269 A}'S' sea -12.9053 1.3413 -7.3443 {"}'S' green -12.7581 1.2982 -7.1418 {"}'S' green -12.6007 1.3161 -6.9427 {"}'S' sea -12.4425 1.393 -6.7595 {"}'S' sea -12.8256 1.2774 -7.6325 {"}'S' green -12.6882 1.1959 -7.433 {"}'S' green -12.2184 1.2871 -6.8511 {"}'S' sea -12.7733 1.3768 -8.0247 {"}'S' green -12.6645 1.2361 -7.8456 {"}'S' green -11.9194 1.2926 -6.8982 {"}'S' sea -12.6229 1.4976 -8.2961 {"}'S' green -12.5352 1.3215 -8.1327 {"}'S' green -11.8127 1.1995 -7.1652 {"}'S' sea -11.6626 1.3354 -7.0099 {"}'S' green -12.3449 1.4247 -8.3267 {"}'S' green -11.8089 1.1451 -7.5559 {"}'S' green -11.6507 1.2219 -7.3726 {"}'S' green -12.1087 1.5058 -8.4103 {"}'S' green -12.005 1.3471 -8.2324 {"}'S' green -11.8701 1.2522 -8.0315 {"}'S' green -11.7144 1.228 -7.8233 {"}'S' sea -11.5511 1.2769 -7.6267 {"}'S' sea -11.7679 1.4599 -8.2656 {"}'S' sea -11.6308 1.3849 -8.0661 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB1 ALA 269 A}'S' P -12.5363 1.1701 -7.2297 {"}'S' -12.5291 1.1947 -7.2357 {"}'S' P -12.3769 1.2006 -7.0325 {"}'S' -12.3749 1.2139 -7.038 {"}'S' P -12.5338 1.1417 -7.6505 {"}'S' -12.5305 1.1528 -7.6486 {"}'S' P -12.3865 1.1001 -7.4482 {"}'S' -12.3764 1.1596 -7.4515 {"}'S' P -12.231 1.1121 -7.2504 {"}'S' -12.2284 1.1755 -7.2647 {"}'S' P -12.0723 1.1765 -7.0636 {"}'S' -12.0751 1.198 -7.0723 {"}'S' P -12.4191 1.1897 -7.9472 {"}'S' -12.4154 1.209 -7.9398 {"}'S' P -12.2825 1.1083 -7.7472 {"}'S' -12.2804 1.1314 -7.7427 {"}'S' P -12.1301 1.0833 -7.5434 {"}'S' -12.1335 1.1419 -7.5426 {"}'S' P -11.9707 1.1138 -7.3462 {"}'S' -11.9796 1.1595 -7.3534 {"}'S' P -12.2423 1.272 -8.1516 {"}'S' -12.241 1.2909 -8.1388 {"}'S' P -12.1139 1.1712 -7.9565 {"}'S' -12.1157 1.2055 -7.9429 {"}'S' P -11.9666 1.1281 -7.7539 {"}'S' -11.9669 1.1318 -7.7534 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 254 A}'M' greentint -10.059 1.4634 -4.0151 {"}'M' greentint -10.1923 1.3598 -4.2146 {"}'M' greentint -9.9773 1.71 -4.0349 {"}'M' greentint -10.1373 1.6131 -4.2143 {"}'M' greentint -10.2477 1.5137 -4.4946 {"}'M' greentint -10.264 1.26 -4.4453 {"}'M' greentint -9.7121 1.8261 -3.8903 {"}'M' greentint -9.8438 1.9278 -4.0884 {"}'M' greentint -10.0048 1.8998 -4.2884 {"}'M' greentint -10.1529 1.7478 -4.4373 {"}'M' greentint -10.2194 1.6111 -4.7482 {"}'M' greentint -10.2698 1.3565 -4.7436 {"}'M' greentint -9.5205 2.0028 -3.9542 {"}'M' greentint -9.6554 2.0977 -4.1551 {"}'M' greentint -9.8143 2.1008 -4.361 {"}'M' greentint -9.9746 2.0098 -4.5439 {"}'M' greentint -10.116 1.8392 -4.6794 {"}'M' greentint -10.1226 1.6854 -4.9882 {"}'M' greentint -10.1908 1.4364 -5.0059 {"}'M' greentint -9.4069 2.1969 -4.2054 {"}'M' greentint -9.5586 2.2324 -4.4106 {"}'M' greentint -9.7199 2.1932 -4.6084 {"}'M' greentint -9.8765 2.0812 -4.7798 {"}'M' greentint -10.0151 1.9064 -4.9106 {"}'M' greentint -9.9772 1.7049 -5.2058 {"}'M' greentint -9.4304 2.2833 -4.6588 {"}'M' greentint -9.5886 2.2196 -4.8451 {"}'M' greentint -9.7388 2.0952 -5.005 {"}'M' greentint -9.8719 1.9196 -5.1281 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 269 A}'M' greentint -10.1089 1.2881 -4.2534 {"}'M' greentint -9.9571 1.4088 -4.0905 {"}'M' greentint -9.8167 1.5708 -3.9545 {"}'M' greentint -9.6948 1.7674 -3.8515 {"}'M' greentint -10.1641 1.2925 -4.6887 {"}'M' greentint -10.0015 1.3482 -4.4946 {"}'M' greentint -9.8437 1.4584 -4.3211 {"}'M' greentint -9.6983 1.6202 -4.1781 {"}'M' greentint -9.5737 1.8226 -4.0745 {"}'M' greentint -9.4772 2.0557 -4.0147 {"}'M' greentint -10.0897 1.4279 -4.9478 {"}'M' greentint -9.9305 1.4503 -4.7473 {"}'M' greentint -9.7708 1.5389 -4.5663 {"}'M' greentint -9.6241 1.6885 -4.4187 {"}'M' greentint -9.5004 1.8883 -4.314 {"}'M' greentint -9.4085 2.1224 -4.2607 {"}'M' greentint -9.9711 1.6098 -5.1023 {"}'M' greentint -9.8123 1.6208 -4.9014 {"}'M' greentint -9.6552 1.7167 -4.7241 {"}'M' greentint -9.5168 1.8873 -4.5925 {"}'M' greentint -9.4139 2.1108 -4.5217 {"}'M' greentint -9.8368 1.8177 -5.1781 {"}'M' greentint -9.6736 1.8469 -4.9754 {"}'M' greentint -9.5239 2.0006 -4.8246 {"}'M' greentint -9.4286 2.2369 -4.7671 {"}'M' greentint -9.5654 2.1448 -5.0357 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 20 1pv5A_22Y_149S}P -12.3262 -2.8342 -0.8149 {"}-12.3262 -2.8342 -0.8149 { ca lys A 20 1pv5A_22Y_149S}-10.8981 -2.5277 -0.7836 { c lys A 20 1pv5A_22Y_149S}-10.6116 -1.4129 -1.7675 { o lys A 20 1pv5A_22Y_149S}-11.146 -1.4104 -2.8813 { c lys A 20 1pv5A_22Y_149S}P -10.6116 -1.4129 -1.7675 { n glu A 21 1pv5A_22Y_149S}-9.7908 -0.4557 -1.3495 { ca glu A 21 1pv5A_22Y_149S}-9.3918 0.6308 -2.2296 { c glu A 21 1pv5A_22Y_149S}-8.3519 0.036 -3.1692 { o glu A 21 1pv5A_22Y_149S}-7.5429 -0.7951 -2.7538 { c glu A 21 1pv5A_22Y_149S}P -8.3519 0.036 -3.1692 { n tyr A 22 1pv5A_22Y_149S}-8.3839 0.4415 -4.4316 { ca tyr A 22 1pv5A_22Y_149S}-7.4151 -0.0585 -5.3993 { c tyr A 22 1pv5A_22Y_149S}-7.1503 0.9965 -6.459 { o tyr A 22 1pv5A_22Y_149S}-7.7572 2.0682 -6.4464 { c tyr A 22 1pv5A_22Y_149S}P -7.1503 0.9965 -6.459 { n val A 23 1pv5A_22Y_149S}-6.2374 0.694 -7.3724 { ca val A 23 1pv5A_22Y_149S}-5.9017 1.6256 -8.442 { c val A 23 1pv5A_22Y_149S}-6.2248 1.0087 -9.792 { o val A 23 1pv5A_22Y_149S}-5.6055 0.0269 -10.1962 { c val A 23 1pv5A_22Y_149S}P -6.2248 1.0087 -9.792 { n lys A 24 1pv5A_22Y_149S}-7.2066 1.5694 -10.4843 { ca lys A 24 1pv5A_22Y_149S}-7.5516 1.0696 -11.8005 { c lys A 24 1pv5A_22Y_149S}-6.5137 1.6383 -12.7554 { o lys A 24 1pv5A_22Y_149S}-6.1325 2.8092 -12.6418 { n val A 147 1pv5A_22Y_149S}P -6.2043 5.4871 -11.5775 {"}-6.2043 5.4871 -11.5775 { ca val A 147 1pv5A_22Y_149S}-7.3789 6.1353 -11.0084 { c val A 147 1pv5A_22Y_149S}-7.7901 5.3489 -9.7607 { o val A 147 1pv5A_22Y_149S}-8.1435 4.1635 -9.8552 { c val A 147 1pv5A_22Y_149S}P -7.7901 5.3489 -9.7607 { n lys A 148 1pv5A_22Y_149S}-7.7293 5.9915 -8.5973 { ca lys A 148 1pv5A_22Y_149S}-8.0815 5.3144 -7.364 { c lys A 148 1pv5A_22Y_149S}-9.5547 4.9586 -7.3772 { o lys A 148 1pv5A_22Y_149S}-10.4016 5.7624 -7.787 { c lys A 148 1pv5A_22Y_149S}P -9.5547 4.9586 -7.3772 { c aser A 149 1pv5A_22Y_149S}P -11.4337 2.3448 -5.7192 {"}P -11.4337 2.3448 -5.7192 {"}P -11.4337 2.3448 -5.7192 { n ser A 150 1pv5A_22Y_149S}-12.6237 1.7597 -5.6297 { ca ser A 150 1pv5A_22Y_149S}-12.936 0.852 -4.537 { c ser A 150 1pv5A_22Y_149S}-13.8369 -0.2567 -5.0607 { o ser A 150 1pv5A_22Y_149S}-14.6021 -0.0304 -5.989 { c bser A 149 1pv5A_22Y_149S}P -11.4527 2.3814 -5.692 { n ser A 150 1pv5A_22Y_149S}-12.6237 1.7597 -5.6297 { c ser A 150 1pv5A_22Y_149S}P -13.8369 -0.2567 -5.0607 { n glu A 151 1pv5A_22Y_149S}-13.7582 -1.4479 -4.4676 { ca glu A 151 1pv5A_22Y_149S}-14.6091 -2.5393 -4.9184 { c glu A 151 1pv5A_22Y_149S}-14.8185 -3.6126 -3.8522 { o glu A 151 1pv5A_22Y_149S}-13.9513 -3.8516 -3.002 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 20 1pv5A_22Y_149S}P -12.3262 -2.8342 -0.8149 { ca lys A 20 1pv5A_22Y_149S}P -10.8981 -2.5277 -0.7836 { n glu A 21 1pv5A_22Y_149S}P -9.7908 -0.4557 -1.3495 { ca glu A 21 1pv5A_22Y_149S}P -9.3918 0.6308 -2.2296 { n tyr A 22 1pv5A_22Y_149S}P -8.3839 0.4415 -4.4316 { ca tyr A 22 1pv5A_22Y_149S}P -7.4151 -0.0585 -5.3993 { n val A 23 1pv5A_22Y_149S}P -6.2374 0.694 -7.3724 { ca val A 23 1pv5A_22Y_149S}P -5.9017 1.6256 -8.442 { n lys A 24 1pv5A_22Y_149S}P -7.2066 1.5694 -10.4843 { ca lys A 24 1pv5A_22Y_149S}P -7.5516 1.0696 -11.8005 { n val A 147 1pv5A_22Y_149S}P -6.2043 5.4871 -11.5775 { ca val A 147 1pv5A_22Y_149S}P -7.3789 6.1353 -11.0084 { n lys A 148 1pv5A_22Y_149S}P -7.7293 5.9915 -8.5973 { ca lys A 148 1pv5A_22Y_149S}P -8.0815 5.3144 -7.364 { n ser A 150 1pv5A_22Y_149S}P -12.6237 1.7597 -5.6297 { ca ser A 150 1pv5A_22Y_149S}P -12.936 0.852 -4.537 { n glu A 151 1pv5A_22Y_149S}P -13.7582 -1.4479 -4.4676 { ca glu A 151 1pv5A_22Y_149S}P -14.6091 -2.5393 -4.9184 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 20 1pv5A_22Y_149S}P -10.8981 -2.5277 -0.7836 {"}-10.8981 -2.5277 -0.7836 { ca glu A 21 1pv5A_22Y_149S}-9.3918 0.6308 -2.2296 { ca tyr A 22 1pv5A_22Y_149S}-7.4151 -0.0585 -5.3993 { ca val A 23 1pv5A_22Y_149S}-5.9017 1.6256 -8.442 { ca lys A 24 1pv5A_22Y_149S}-7.5516 1.0696 -11.8005 { ca val A 147 1pv5A_22Y_149S}P -7.3789 6.1353 -11.0084 {"}-7.3789 6.1353 -11.0084 { ca lys A 148 1pv5A_22Y_149S}-8.0815 5.3144 -7.364 {"}P -8.0815 5.3144 -7.364 { ca ser A 150 1pv5A_22Y_149S}P -12.936 0.852 -4.537 {"}P -12.936 0.852 -4.537 { ca glu A 151 1pv5A_22Y_149S}-14.6091 -2.5393 -4.9184 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 22 1pv5A_22Y_149S}P -7.4151 -0.0585 -5.3993 { cb tyr A 22 1pv5A_22Y_149S}-7.9216 -1.3504 -6.0514 { cg tyr A 22 1pv5A_22Y_149S}-9.0424 -1.1793 -7.0515 { cd1 tyr A 22 1pv5A_22Y_149S}-8.773 -1.1034 -8.4198 { ce1 tyr A 22 1pv5A_22Y_149S}-9.7924 -0.9777 -9.3478 { cz tyr A 22 1pv5A_22Y_149S}-11.1135 -0.9197 -8.9076 { oh tyr A 22 1pv5A_22Y_149S}-12.127 -0.8224 -9.8247 { cg tyr A 22 1pv5A_22Y_149S}P -9.0424 -1.1793 -7.0515 { cd2 tyr A 22 1pv5A_22Y_149S}-10.3778 -1.1168 -6.6353 { ce2 tyr A 22 1pv5A_22Y_149S}-11.4075 -0.9859 -7.5599 { cz tyr A 22 1pv5A_22Y_149S}ghost -11.1135 -0.9197 -8.9076 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 22 1pv5A_22Y_149S}P -7.9216 -1.3504 -6.0514 {"}P -7.9216 -1.3504 -6.0514 { cd1 tyr A 22 1pv5A_22Y_149S}P -8.773 -1.1034 -8.4198 { cd2 tyr A 22 1pv5A_22Y_149S}P -10.3778 -1.1168 -6.6353 { ce1 tyr A 22 1pv5A_22Y_149S}P -9.7924 -0.9777 -9.3478 { ce2 tyr A 22 1pv5A_22Y_149S}P -11.4075 -0.9859 -7.5599 { oh tyr A 22 1pv5A_22Y_149S}P -12.127 -0.8224 -9.8247 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 22 A}'S' sky -10.7705 0.5568 -6.9628 {"}'S' blue -10.4283 0.6019 -6.9616 {"}'S' sky -10.3825 0.4985 -7.3078 {"}'S' blue -10.1676 0.4238 -7.4379 { CE1 TYR 22 A}'S' sky -10.1372 0.4383 -8.3789 {"}'S' sky -10.0255 0.6049 -8.6384 {"}'S' sky -10.1734 0.6547 -8.8434 {"}'S' sky -10.3293 0.6603 -9.0475 { CZ TYR 22 A}'S' sky -12.0751 0.5337 -8.7458 {"}'S' sky -11.9715 0.6036 -8.9893 {"}'S' blue -11.8437 0.638 -9.2256 {"}'S' blue -11.3276 0.7375 -9.4281 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 22 A}'S' sea -10.5919 0.5404 -7.1558 { CE2 TYR 22 A}'S' green -11.6619 0.7274 -7.3058 {"}'S' green -11.9614 0.5941 -8.0692 {"}'S' green -10.5688 0.5499 -7.5484 { CZ TYR 22 A}'S' green -10.487 0.7082 -8.7682 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 22 A}'S' P -11.8196 0.7142 -7.5063 {"}'S' -11.8175 0.7027 -7.506 {"}'S' P -11.3181 0.7389 -7.2795 {"}'S' -11.3201 0.6953 -7.2859 {"}'S' P -11.4748 0.7619 -7.4869 {"}'S' -11.4706 0.6566 -7.4913 {"}'S' P -11.6363 0.7445 -7.6918 {"}'S' -11.6216 0.6284 -7.6827 {"}'S' P -11.8002 0.6878 -7.8874 {"}'S' -11.782 0.6123 -7.8726 {"}'S' P -10.9898 0.689 -7.2688 {"}'S' -10.9961 0.6632 -7.2732 {"}'S' P -11.1389 0.742 -7.4762 {"}'S' -11.1574 0.6198 -7.482 {"}'S' P -11.2958 0.7563 -7.6836 {"}'S' -11.3081 0.5734 -7.6706 {"}'S' P -11.458 0.7328 -7.8862 {"}'S' -11.4523 0.547 -7.8514 {"}'S' P -11.6216 0.6714 -8.0804 {"}'S' -11.6049 0.5425 -8.0402 {"}'S' P -11.7824 0.5729 -8.2607 {"}'S' -11.7727 0.5341 -8.2437 {"}'S' P -10.7811 0.6421 -7.4205 {"}'S' -10.7945 0.6076 -7.4224 {"}'S' P -10.9297 0.6959 -7.6274 {"}'S' -10.9679 0.5634 -7.622 {"}'S' P -10.7164 0.6094 -7.7553 {"}'S' -10.7529 0.5239 -7.7446 {"}'S' P -10.8722 0.6309 -7.9629 {"}'S' -10.9204 0.4836 -7.9268 {"}'S' P -10.5085 0.4838 -7.8662 {"}'S' -10.5115 0.479 -7.8658 { CZ TYR 22 A}'S' P -11.7513 0.6113 -8.3499 {"}'S' -11.7305 0.5598 -8.3678 {"}'S' P -11.3466 0.6628 -8.1982 {"}'S' -11.3219 0.4967 -8.2735 {"}'S' P -11.4946 0.7126 -8.4032 {"}'S' -11.4607 0.567 -8.4485 {"}'S' P -11.6505 0.7182 -8.6073 {"}'S' -11.627 0.646 -8.6203 {"}'S' P -11.3679 0.7935 -8.6535 {"}'S' -11.3469 0.6507 -8.6743 {"}'S' P -11.5256 0.7803 -8.8541 {"}'S' -11.5145 0.7329 -8.8555 {"}'S' P -10.6243 0.5122 -8.0276 {"}'S' -10.64 0.4646 -8.057 {"}'S' P -10.743 0.6458 -8.2186 {"}'S' -10.7721 0.5196 -8.274 {"}'S' P -10.8773 0.7443 -8.4196 {"}'S' -10.9022 0.5699 -8.4701 {"}'S' P -11.0241 0.805 -8.6272 {"}'S' -11.0327 0.6376 -8.6537 {"}'S' P -11.1808 0.828 -8.8346 {"}'S' -11.1766 0.7213 -8.8387 {"}'S' P -11.3423 0.8106 -9.0395 {"}'S' -11.3406 0.8 -9.0381 {"}'S' P -10.4356 0.5395 -8.2202 {"}'S' -10.4406 0.5277 -8.2261 {"}'S' P -10.5579 0.6641 -8.4141 {"}'S' -10.5832 0.5937 -8.436 {"}'S' P -10.6958 0.7551 -8.6166 {"}'S' -10.7199 0.6561 -8.6337 {"}'S' P -10.8449 0.8081 -8.8239 {"}'S' -10.8579 0.7263 -8.8281 {"}'S' P -11.0018 0.8224 -9.0313 {"}'S' -11.0033 0.8011 -9.0302 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { CE2 TYR 22 A}'S' P -11.0873 0.7131 -7.8348 {"}'S' -11.1246 0.515 -7.803 {"}'S' P -11.2491 0.6901 -8.0386 {"}'S' -11.2675 0.4886 -7.9803 { CZ TYR 22 A}'S' P -11.0736 0.7004 -8.2471 {"}'S' -11.0785 0.5055 -8.3273 {"}'S' P -11.216 0.7663 -8.45 {"}'S' -11.2041 0.5674 -8.5028 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ASER 149 A}'S' blue 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val A 119 1pz7A_117Y_124}-5.9557 2.1623 -13.2692 { o val A 119 1pz7A_117Y_124}-6.804 3.0111 -13.5476 { n glu A 122 1pz7A_117Y_124}P -7.521 5.7489 -12.5926 {"}-7.521 5.7489 -12.5926 { ca glu A 122 1pz7A_117Y_124}-8.7841 5.5895 -11.8799 { c glu A 122 1pz7A_117Y_124}-8.6504 4.8848 -10.5436 { o glu A 122 1pz7A_117Y_124}-8.0772 3.7999 -10.4523 { c glu A 122 1pz7A_117Y_124}P -8.6504 4.8848 -10.5436 { n gly A 123 1pz7A_117Y_124}-9.2176 5.4913 -9.5108 { ca gly A 123 1pz7A_117Y_124}-9.1632 4.9282 -8.18 { c gly A 123 1pz7A_117Y_124}-10.5347 4.6294 -7.6197 { o gly A 123 1pz7A_117Y_124}-11.5368 5.2136 -8.0461 { c gly A 123 1pz7A_117Y_124}P -10.5347 4.6294 -7.6197 { n ser A 124 1pz7A_117Y_124}-10.5698 3.7167 -6.6561 { ca ser A 124 1pz7A_117Y_124}-11.7981 3.3532 -5.9707 { c ser A 124 1pz7A_117Y_124}-11.4745 3.056 -4.5206 { o ser A 124 1pz7A_117Y_124}-10.489 2.3859 -4.2204 { c ser A 124 1pz7A_117Y_124}P -11.4745 3.056 -4.5206 { n leu A 125 1pz7A_117Y_124}-12.3001 3.5737 -3.6243 { ca leu A 125 1pz7A_117Y_124}-12.1318 3.3401 -2.2047 { c leu A 125 1pz7A_117Y_124}-13.4849 3.013 -1.5972 { o leu A 125 1pz7A_117Y_124}-14.4559 3.7485 -1.785 { c leu A 125 1pz7A_117Y_124}P -13.4849 3.013 -1.5972 { n gln A 126 1pz7A_117Y_124}-13.5527 1.8957 -0.8828 { ca gln A 126 1pz7A_117Y_124}-14.7817 1.4977 -0.2126 { c gln A 126 1pz7A_117Y_124}-14.4813 1.0047 1.1803 { o gln A 126 1pz7A_117Y_124}-13.8224 -0.0172 1.3519 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 115 1pz7A_117Y_124}P -11.5231 -1.6839 1.0472 { ca lys A 115 1pz7A_117Y_124}P -11.1693 -2.158 -0.2818 { n ala A 116 1pz7A_117Y_124}P -9.5074 -0.9338 -1.5468 { ca ala A 116 1pz7A_117Y_124}P -8.9861 0.1991 -2.2839 { n tyr A 117 1pz7A_117Y_124}P -8.5094 0.2587 -4.657 { ca tyr A 117 1pz7A_117Y_124}P -7.7782 -0.1265 -5.8494 { n arg A 118 1pz7A_117Y_124}P -6.639 0.8256 -7.7172 { ca arg A 118 1pz7A_117Y_124}P -6.3087 1.7872 -8.7429 { n val A 119 1pz7A_117Y_124}P -6.6112 1.4809 -11.1251 { ca val A 119 1pz7A_117Y_124}P -6.3389 0.9364 -12.4503 { n glu A 122 1pz7A_117Y_124}P -7.521 5.7489 -12.5926 { ca glu A 122 1pz7A_117Y_124}P -8.7841 5.5895 -11.8799 { n gly A 123 1pz7A_117Y_124}P -9.2176 5.4913 -9.5108 { ca gly A 123 1pz7A_117Y_124}P -9.1632 4.9282 -8.18 {"}P -9.1632 4.9282 -8.18 { n ser A 124 1pz7A_117Y_124}P -10.5698 3.7167 -6.6561 { ca ser A 124 1pz7A_117Y_124}P -11.7981 3.3532 -5.9707 { n leu A 125 1pz7A_117Y_124}P -12.3001 3.5737 -3.6243 { ca leu A 125 1pz7A_117Y_124}P -12.1318 3.3401 -2.2047 { n gln A 126 1pz7A_117Y_124}P -13.5527 1.8957 -0.8828 { ca gln A 126 1pz7A_117Y_124}P -14.7817 1.4977 -0.2126 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 115 1pz7A_117Y_124}P -11.1693 -2.158 -0.2818 {"}-11.1693 -2.158 -0.2818 { ca ala A 116 1pz7A_117Y_124}-8.9861 0.1991 -2.2839 { ca tyr A 117 1pz7A_117Y_124}-7.7782 -0.1265 -5.8494 { ca arg A 118 1pz7A_117Y_124}-6.3087 1.7872 -8.7429 { ca val A 119 1pz7A_117Y_124}-6.3389 0.9364 -12.4503 { ca glu A 122 1pz7A_117Y_124}P -8.7841 5.5895 -11.8799 {"}-8.7841 5.5895 -11.8799 { ca gly A 123 1pz7A_117Y_124}-9.1632 4.9282 -8.18 { ca ser A 124 1pz7A_117Y_124}-11.7981 3.3532 -5.9707 { ca leu A 125 1pz7A_117Y_124}-12.1318 3.3401 -2.2047 { ca gln A 126 1pz7A_117Y_124}-14.7817 1.4977 -0.2126 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 117 1pz7A_117Y_124}P -7.7782 -0.1265 -5.8494 { cb tyr A 117 1pz7A_117Y_124}-8.4041 -1.3498 -6.5298 { cg tyr A 117 1pz7A_117Y_124}-9.7856 -1.1628 -7.1124 { cd1 tyr A 117 1pz7A_117Y_124}-10.9156 -1.5267 -6.395 { ce1 tyr A 117 1pz7A_117Y_124}-12.1805 -1.3817 -6.9301 { cz tyr A 117 1pz7A_117Y_124}-12.326 -0.8779 -8.2042 { oh tyr A 117 1pz7A_117Y_124}-13.5836 -0.7271 -8.7459 { cg tyr A 117 1pz7A_117Y_124}P -9.7856 -1.1628 -7.1124 { cd2 tyr A 117 1pz7A_117Y_124}-9.9594 -0.6682 -8.401 { ce2 tyr A 117 1pz7A_117Y_124}-11.2253 -0.519 -8.9451 { cz tyr A 117 1pz7A_117Y_124}ghost -12.326 -0.8779 -8.2042 { ca ser A 124 1pz7A_117Y_124}P -11.7981 3.3532 -5.9707 { cb ser A 124 1pz7A_117Y_124}-12.4372 2.1223 -6.6093 { og ser A 124 1pz7A_117Y_124}-13.6157 1.7375 -5.9107 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 117 1pz7A_117Y_124}P -8.4041 -1.3498 -6.5298 {"}P -8.4041 -1.3498 -6.5298 { cd1 tyr A 117 1pz7A_117Y_124}P -10.9156 -1.5267 -6.395 { cd2 tyr A 117 1pz7A_117Y_124}P -9.9594 -0.6682 -8.401 { ce1 tyr A 117 1pz7A_117Y_124}P -12.1805 -1.3817 -6.9301 { ce2 tyr A 117 1pz7A_117Y_124}P -11.2253 -0.519 -8.9451 { oh tyr A 117 1pz7A_117Y_124}P -13.5836 -0.7271 -8.7459 { cb ser A 124 1pz7A_117Y_124}P -12.4372 2.1223 -6.6093 {"}P -12.4372 2.1223 -6.6093 { og ser A 124 1pz7A_117Y_124}P -13.6157 1.7375 -5.9107 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 117 A}'S' sky -10.6577 0.2251 -6.4987 {"}'S' blue -10.4233 0.3683 -6.5546 {"}'S' sky -10.5844 0.3533 -6.7576 {"}'S' sky -10.7472 0.2907 -6.9505 {"}'S' sky -10.9058 0.1817 -7.1253 {"}'S' blue -10.4829 0.439 -7.0093 { CD1 TYR 117 A}'S' sky -11.5533 0.0044 -5.8372 {"}'S' sky -11.2966 0.1057 -5.8905 {"}'S' sky -11.018 0.1593 -5.9373 {"}'S' sky -10.8262 0.1981 -6.1145 { CD2 TYR 117 A}'S' sky -10.8808 0.2561 -7.2346 {"}'S' sky -10.7343 0.4713 -7.3227 {"}'S' sky -10.8771 0.5378 -7.5263 {"}'S' blue -10.535 0.6317 -7.3808 {"}'S' blue -10.6772 0.702 -7.5828 { CE1 TYR 117 A}'S' blue -12.7561 -0.0818 -5.9098 {"}'S' blue -13.0527 0.0062 -6.3165 {"}'S' sky -12.6653 0.1152 -6.1639 {"}'S' sky -12.8183 0.1494 -6.3723 {"}'S' sky -12.9794 0.1345 -6.5754 { CE2 TYR 117 A}'S' sky -11.9431 0.8512 -8.1269 {"}'S' blue -12.0974 0.8689 -8.3315 {"}'S' sky -11.5702 0.8969 -7.9762 {"}'S' sky -11.7101 0.9779 -8.179 {"}'S' blue -11.8631 1.0121 -8.3874 {"}'S' sky -11.323 0.9733 -8.0369 {"}'S' blue -11.4584 1.0635 -8.2357 {"}'S' blue -10.8514 0.6914 -7.7381 { CZ TYR 117 A}'S' sky -13.1009 0.2616 -7.1259 {"}'S' sky -13.1981 0.51 -7.5906 {"}'S' sky -12.738 0.8222 -8.1507 {"}'S' sky -12.0574 0.8499 -8.1205 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 117 A}'S' green -11.4525 0.1112 -6.0946 {"}'S' green -11.1699 0.1865 -6.1409 {"}'S' green -11.3276 0.1734 -6.3414 {"}'S' sea -10.9828 0.2211 -6.3219 {"}'S' green -11.1444 0.2036 -6.5268 {"}'S' green -11.3083 0.1469 -6.7225 {"}'S' sea -10.8039 0.2155 -6.5187 {"}'S' sea -10.966 0.192 -6.7212 {"}'S' sea -11.1296 0.1306 -6.9155 { CE1 TYR 117 A}'S' sea -12.4137 0.2009 -6.2207 {"}'S' green -12.5616 0.2507 -6.4257 {"}'S' green -12.7175 0.2563 -6.6297 {"}'S' sea -12.8779 0.2201 -6.827 {"}'S' green -12.0126 0.1355 -6.0746 {"}'S' green -12.1406 0.2385 -6.2695 {"}'S' green -12.4349 0.3315 -6.676 {"}'S' green -12.5926 0.3184 -6.8765 {"}'S' sea -11.6913 0.0503 -6.05 {"}'S' green -11.417 0.1554 -6.5876 {"}'S' green -11.3418 0.1541 -6.9186 { CE2 TYR 117 A}'S' sea -11.8009 0.7808 -7.9249 {"}'S' green -11.2772 0.4049 -7.46 {"}'S' green -11.349 0.6049 -7.609 {"}'S' green -11.4479 0.7706 -7.7837 {"}'S' sea -11.0329 0.4856 -7.5256 {"}'S' sea -11.1078 0.6804 -7.6758 {"}'S' sea -11.2055 0.8443 -7.8485 { CZ TYR 117 A}'S' green -12.78 0.2999 -6.9917 {"}'S' green -12.9016 0.4219 -7.184 {"}'S' sea -13.0438 0.4923 -7.386 {"}'S' green -12.5486 0.4117 -7.0428 {"}'S' green -12.8108 0.619 -7.4381 {"}'S' green -12.9638 0.6532 -7.6465 {"}'S' green -12.7071 0.7545 -7.6998 {"}'S' sea -12.863 0.76 -7.9039 {"}'S' green -12.5804 0.8353 -7.9501 {"}'S' green -12.0898 0.7861 -7.7161 {"}'S' green -12.2366 0.8469 -7.9238 {"}'S' sea -12.3932 0.8699 -8.1312 {"}'S' green -11.457 0.2392 -7.1758 {"}'S' green -11.7704 0.7059 -7.7107 {"}'S' sea -11.9083 0.7969 -7.9131 {"}'S' sea -11.2508 0.1893 -7.3286 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 117 A}'S' P -12.283 0.3044 -6.4724 {"}'S' -12.2823 0.2916 -6.4753 {"}'S' P -11.81 0.1839 -6.241 {"}'S' -11.81 0.1839 -6.241 {"}'S' P -11.9444 0.2823 -6.442 {"}'S' -11.9533 0.2232 -6.4594 {"}'S' P -12.0912 0.3431 -6.6497 {"}'S' -12.0952 0.2682 -6.6619 {"}'S' P -12.2478 0.3661 -6.857 {"}'S' -12.2459 0.3268 -6.8591 {"}'S' P -11.625 0.2022 -6.4365 {"}'S' -11.6355 0.1726 -6.446 {"}'S' P -11.7629 0.2932 -6.639 {"}'S' -11.7831 0.2105 -6.6528 {"}'S' P -11.912 0.3462 -6.8463 {"}'S' -11.9248 0.2579 -6.8505 {"}'S' P -11.5541 0.2463 -6.7906 {"}'S' -11.5716 0.2008 -6.7939 {"}'S' P -11.7027 0.3001 -6.9975 {"}'S' -11.7175 0.249 -6.9957 { CZ TYR 117 A}'S' P -12.6709 0.538 -7.2353 {"}'S' -12.6678 0.5256 -7.2436 {"}'S' P -12.3062 0.4854 -7.1076 {"}'S' -12.3065 0.4633 -7.1252 {"}'S' P -12.4237 0.6145 -7.296 {"}'S' -12.4219 0.5745 -7.3203 {"}'S' P -12.5591 0.7047 -7.4948 {"}'S' -12.5541 0.6712 -7.511 {"}'S' P -12.0454 0.5015 -7.165 {"}'S' -12.0574 0.4415 -7.2104 {"}'S' P -12.1581 0.6393 -7.3487 {"}'S' -12.1624 0.5992 -7.371 {"}'S' P -12.286 0.7423 -7.5437 {"}'S' -12.2876 0.7065 -7.5581 {"}'S' P -12.4285 0.8081 -7.7466 {"}'S' -12.4279 0.8021 -7.7478 {"}'S' P -11.7367 0.3876 -7.1494 {"}'S' -11.7565 0.3446 -7.1854 {"}'S' P -11.8368 0.554 -7.3241 {"}'S' -11.8558 0.4975 -7.3594 {"}'S' P -11.9555 0.6877 -7.5151 {"}'S' -11.9615 0.6614 -7.5259 {"}'S' P -11.5431 0.4249 -7.3376 {"}'S' -11.5485 0.4152 -7.3444 {"}'S' P -11.6481 0.5813 -7.5168 {"}'S' -11.6509 0.5749 -7.5208 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 124 A}'S' sky -13.0591 0.4919 -6.7419 {"}'S' sky -12.91 0.4389 -6.5346 {"}'S' sky -12.5901 0.4479 -6.1252 {"}'S' sky -13.0661 0.9444 -7.74 {"}'S' blue -11.8706 1.296 -8.0438 {"}'S' sky -11.7844 1.1144 -7.8829 {"}'S' blue -11.6187 1.3529 -7.9517 {"}'S' sky -11.5121 1.1941 -7.7698 { HB3 SER 124 A}'S' blue -11.3097 0.4916 -5.8581 {"}'S' blue -11.0583 0.5535 -5.9832 {"}'S' blue -10.8972 0.5705 -6.189 {"}'S' blue -10.7846 0.6104 -6.4218 {"}'S' sky -11.4558 1.1063 -7.7343 {"}'S' sky -11.1606 0.4231 -7.1629 {"}'S' sky -11.0042 0.4339 -6.9637 {"}'S' sky -10.8481 0.5292 -6.7891 {"}'S' blue -10.711 0.6974 -6.6589 {"}'S' sky -11.0094 0.6182 -7.2538 {"}'S' sky -10.8459 0.6469 -7.0505 {"}'S' blue -10.6953 0.8008 -6.8985 {"}'S' blue -10.9895 1.0001 -7.4778 {"}'S' sky -10.8845 0.8438 -7.2985 @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 124 A}'S' sea -12.7523 0.4244 -6.3277 {"}'S' sea -13.1187 0.6671 -7.3027 {"}'S' sea -12.9969 0.5417 -7.1092 {"}'S' sea -12.8594 0.4499 -6.9072 {"}'S' green -12.7108 0.3961 -6.7003 {"}'S' green -12.5535 0.3798 -6.4919 {"}'S' green -12.9752 0.7645 -7.5731 {"}'S' green -12.8654 0.6154 -7.3889 {"}'S' green -12.7386 0.4998 -7.1927 {"}'S' green -12.5965 0.4214 -6.9874 {"}'S' green -12.4442 0.3805 -6.7801 {"}'S' green -12.8138 0.9174 -7.8214 {"}'S' green -12.721 0.7477 -7.6541 {"}'S' sea -12.5922 1.0103 -7.9515 {"}'S' green -12.5055 0.8312 -7.7887 {"}'S' sea -12.3555 1.1013 -8.0282 {"}'S' green -12.2703 0.9157 -7.8659 {"}'S' sea -12.0312 1.0174 -7.9041 {"}'S' green -11.9212 0.8739 -7.721 { HB3 SER 124 A}'S' green -12.4351 0.3795 -6.4411 {"}'S' green -12.2879 0.3364 -6.2385 {"}'S' green -11.9067 0.2388 -6.1293 {"}'S' green -11.6021 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-7.8929 {HG11 VAL 148 A}'S' sea -13.5995 -0.1162 -7.6972 {"}'S' green -13.4415 -0.0305 -7.5162 {"}'S' sea -13.5954 -0.1019 -8.105 {"}'S' green -13.4372 -0.0841 -7.9065 {"}'S' green -13.2795 -0.0081 -7.7237 {"}'S' green -13.129 0.1233 -7.5651 {"}'S' green -13.4989 0.0222 -8.3825 {"}'S' green -13.3431 -0.002 -8.1744 {"}'S' green -13.3967 0.2299 -8.6166 {"}'S' sea -13.2418 0.4528 -8.7087 {"}'S' green -13.1084 0.35 -8.5081 {"}'S' green -12.7942 0.5325 -8.1528 {"}'S' green -12.9835 0.5755 -8.5528 {"}'S' green -12.8231 0.6732 -8.373 {HG21 VAL 148 A}'S' sea -12.5833 0.7685 -9.2615 {"}'S' green -12.4239 0.799 -9.0643 {"}'S' green -12.2655 0.8855 -8.8829 {"}'S' sea -12.4336 0.6985 -9.4801 {"}'S' green -12.278 0.7105 -9.2822 {"}'S' green -12.1194 0.775 -9.0954 {"}'S' green -11.9665 0.891 -8.93 {"}'S' sea -12.1772 0.6818 -9.5752 {"}'S' green -12.0178 0.7122 -9.378 {"}'S' green -11.8598 0.798 -9.197 {"}'S' sea -11.7097 0.9338 -9.0417 {"}'S' sea -11.8555 0.7443 -9.5873 {"}'S' sea -11.6978 0.8204 -9.4045 {"}'S' sea -11.5473 0.9517 -9.2459 {"}'S' sea -11.5982 0.8753 -9.6586 {"}'S' sea -11.441 0.9937 -9.4878 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB VAL 148 A}'S' P -12.3822 0.6188 -8.0144 {"}'S' -12.3787 0.6363 -8.0084 {"}'S' P -12.2402 0.5404 -7.8091 {"}'S' -12.237 0.5695 -7.8029 {"}'S' P -12.2528 0.7273 -8.2929 {"}'S' -12.2513 0.7433 -8.2842 {"}'S' P -12.1244 0.6237 -8.0972 {"}'S' -12.1231 0.6752 -8.0763 {"}'S' P -11.9833 0.5569 -7.8959 {"}'S' -11.9864 0.6125 -7.8804 {"}'S' P -12.0396 0.8041 -8.4291 {"}'S' -12.0398 0.8081 -8.4269 {"}'S' P -11.9126 0.6954 -8.2342 {"}'S' -11.917 0.7362 -8.2135 {"}'S' P -11.672 0.7815 -8.306 {"}'S' -11.6731 0.7839 -8.3046 { CG1 VAL 148 A}'S' P -13.1245 0.1183 -7.2211 {"}'S' -13.1244 0.1197 -7.2214 {"}'S' P -12.9641 0.1687 -7.0288 {"}'S' -12.9716 0.1902 -7.0303 {"}'S' P -12.806 0.2572 -6.8484 {"}'S' -12.8099 0.2655 -6.8504 {"}'S' P -12.91 0.1947 -7.3556 {"}'S' -12.9204 0.223 -7.3523 {"}'S' P -12.7486 0.2536 -7.1637 {"}'S' -12.7685 0.2944 -7.1644 {"}'S' P -12.5906 0.3535 -6.9878 {"}'S' -12.6019 0.3714 -6.9902 {"}'S' P -12.6567 0.3264 -7.4239 {"}'S' -12.6697 0.3492 -7.4196 {"}'S' P -12.4954 0.4115 -7.2382 {"}'S' -12.5059 0.4257 -7.237 {"}'S' P -12.7329 0.4322 -7.8701 {"}'S' -12.7348 0.4348 -7.8681 { HB VAL 148 A}'S' P -12.1486 0.4629 -7.0802 {"}'S' -12.1363 0.4787 -7.0823 {"}'S' P -12.0013 0.4199 -6.8776 {"}'S' -11.9877 0.4423 -6.8863 {"}'S' P -12.0688 0.399 -7.3684 {"}'S' -12.039 0.4444 -7.3636 {"}'S' P -11.9315 0.3175 -7.1689 {"}'S' -11.8907 0.405 -7.1759 {"}'S' P -11.7795 0.2918 -6.9656 {"}'S' -11.7527 0.3747 -6.9872 {"}'S' P -11.6201 0.3222 -6.7684 {"}'S' -11.614 0.356 -6.7831 {"}'S' P -12.0166 0.4984 -7.7605 {"}'S' -11.9915 0.5371 -7.7385 {"}'S' P -11.9078 0.3578 -7.5814 {"}'S' -11.8831 0.4116 -7.5634 {"}'S' P -11.7771 0.2634 -7.3864 {"}'S' -11.7447 0.37 -7.3733 {"}'S' P -11.6298 0.2217 -7.1841 {"}'S' -11.6101 0.3401 -7.191 {"}'S' P -11.4742 0.2337 -6.9862 {"}'S' -11.4716 0.313 -7.0041 {"}'S' P -11.3156 0.2982 -6.7995 {"}'S' -11.3159 0.3016 -6.8007 {"}'S' P -11.7785 0.4431 -7.8685 {"}'S' -11.7481 0.5237 -7.8146 {"}'S' P -11.6623 0.3113 -7.6831 {"}'S' -11.6425 0.4037 -7.6446 {"}'S' P -11.5258 0.23 -7.483 {"}'S' -11.5187 0.3203 -7.4649 {"}'S' P -11.3734 0.205 -7.2793 {"}'S' -11.3779 0.2904 -7.2776 {"}'S' P -11.214 0.2354 -7.0821 {"}'S' -11.2208 0.2672 -7.0866 {"}'S' P -11.5882 0.5464 -8.0626 {"}'S' -11.5777 0.6027 -8.0065 {"}'S' P -11.4856 0.3936 -7.8875 {"}'S' -11.4807 0.4788 -7.8319 {"}'S' P -11.3571 0.2928 -7.6923 {"}'S' -11.362 0.3608 -7.665 {"}'S' P -11.2099 0.2498 -7.4898 {"}'S' -11.2136 0.2687 -7.4856 {"}'S' P -11.352 0.6274 -8.1462 {"}'S' -11.3536 0.6422 -8.1295 {"}'S' P -11.2483 0.4687 -7.9682 {"}'S' -11.2555 0.5045 -7.9401 {"}'S' P -11.1134 0.3739 -7.7674 {"}'S' -11.1162 0.3851 -7.7617 {HG11 VAL 148 A}'S' P -13.1799 0.0469 -7.9778 {"}'S' -13.19 0.0619 -7.9762 {"}'S' P -13.0227 0.1653 -7.807 {"}'S' -13.0246 0.1676 -7.8068 {"}'S' P -13.2595 0.1549 -8.4172 {"}'S' -13.2619 0.1581 -8.4159 {"}'S' P -13.1032 0.1656 -8.2179 {"}'S' -13.1297 0.1977 -8.205 {"}'S' P -12.9471 0.261 -8.0434 {"}'S' -12.9767 0.2869 -8.0368 {"}'S' P -12.9449 0.3786 -8.3048 {"}'S' -12.9662 0.3944 -8.293 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 103 A}'M' greentint -9.3199 2.589 -6.0352 {"}'M' greentint -9.4685 2.4321 -6.1837 {"}'M' greentint -9.5722 2.3358 -6.4812 {"}'M' greentint -9.0127 2.8276 -5.8954 {"}'M' greentint -9.1706 2.8192 -6.0974 {"}'M' greentint -9.3292 2.726 -6.2758 {"}'M' greentint -9.4685 2.5581 -6.409 {"}'M' greentint -9.5418 2.4298 -6.726 {"}'M' greentint -8.8275 2.9976 -5.9614 {"}'M' greentint -8.9837 3.0083 -6.1653 {"}'M' greentint -9.1438 2.9501 -6.3572 {"}'M' greentint -9.2986 2.827 -6.5219 {"}'M' greentint -9.4343 2.6494 -6.6481 {"}'M' greentint -9.4639 2.51 -6.9642 {"}'M' greentint -8.7404 3.1517 -6.2073 {"}'M' greentint -8.9009 3.1283 -6.4094 {"}'M' greentint -9.063 3.0461 -6.595 {"}'M' greentint -9.2152 2.9102 -6.755 {"}'M' greentint -9.3519 2.7286 -6.8798 {"}'M' greentint -9.3494 2.5548 -7.1939 {"}'M' greentint -8.6469 3.2422 -6.4761 {"}'M' greentint -8.8061 3.1911 -6.6683 {"}'M' greentint -8.9619 3.0924 -6.8416 {"}'M' greentint -9.108 2.9488 -6.9915 {"}'M' greentint -9.2388 2.7668 -7.11 {"}'M' greentint -8.6493 3.2256 -6.8737 {"}'M' greentint -8.8062 3.1197 -7.0469 {"}'M' greentint -8.9528 2.9726 -7.1967 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 148 A}'M' greentint -9.5146 2.3386 -6.263 {"}'M' greentint -9.3597 2.4358 -6.0905 {"}'M' greentint -9.2184 2.5866 -5.9489 {"}'M' greentint -9.5582 2.2993 -6.7374 {"}'M' greentint -9.4039 2.2985 -6.5383 {"}'M' greentint -9.2457 2.3623 -6.352 {"}'M' greentint -9.0955 2.4867 -6.1922 {"}'M' greentint -8.9623 2.6623 -6.0691 {"}'M' greentint -8.8571 2.8769 -5.9914 {"}'M' greentint -9.3533 2.3575 -6.8894 {"}'M' greentint -9.1951 2.3597 -6.6856 {"}'M' greentint -9.0345 2.4357 -6.4987 {"}'M' greentint -8.8849 2.5811 -6.3463 {"}'M' greentint -8.7604 2.781 -6.2405 {"}'M' greentint -8.6718 3.0186 -6.1925 {"}'M' greentint -9.2502 2.5202 -7.1444 {"}'M' greentint -9.1014 2.4706 -6.9383 {"}'M' greentint -8.9391 2.5155 -6.7403 {"}'M' greentint -8.7849 2.6481 -6.5786 {"}'M' greentint -8.6606 2.8514 -6.474 {"}'M' greentint -8.5823 3.0971 -6.4419 {"}'M' greentint -9.1222 2.7558 -7.3069 {"}'M' greentint -8.9904 2.6541 -7.1087 {"}'M' greentint -8.8294 2.6821 -6.9087 {"}'M' greentint -8.6814 2.8341 -6.7599 {"}'M' greentint -8.5866 3.0682 -6.7025 {"}'M' greentint -8.8569 2.8719 -7.1623 {"}'M' greentint -8.697 2.9688 -6.9828 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 103 A}'M' greentint -10.2508 0.8024 -4.2357 {"}'M' greentint -10.0359 1.1526 -4.0561 {"}'M' greentint -10.1958 1.0557 -4.2355 {"}'M' greentint -10.3062 0.9563 -4.5158 {"}'M' greentint -10.3225 0.7027 -4.4664 {"}'M' greentint -9.9024 1.3705 -4.1096 {"}'M' greentint -10.0634 1.3424 -4.3096 {"}'M' greentint -10.2114 1.1905 -4.4584 {"}'M' greentint -10.2779 1.0538 -4.7694 {"}'M' greentint -10.3283 0.7991 -4.7647 {"}'M' greentint -9.714 1.5404 -4.1762 {"}'M' greentint -9.8728 1.5435 -4.3821 {"}'M' greentint -10.0331 1.4524 -4.565 {"}'M' greentint -10.1745 1.2819 -4.7005 {"}'M' greentint -10.1811 1.1281 -5.0094 {"}'M' greentint -10.2494 0.8791 -5.0271 {"}'M' greentint -9.4654 1.6396 -4.2266 {"}'M' greentint -9.6171 1.6751 -4.4317 {"}'M' greentint -9.7784 1.6359 -4.6296 {"}'M' greentint -9.935 1.5238 -4.801 {"}'M' greentint -10.0736 1.3491 -4.9317 {"}'M' greentint -10.0357 1.1476 -5.227 {"}'M' greentint -10.1092 0.9078 -5.2539 {"}'M' greentint -9.4889 1.726 -4.68 {"}'M' greentint -9.6471 1.6623 -4.8663 {"}'M' greentint -9.7973 1.5378 -5.0261 {"}'M' greentint -9.9305 1.3622 -5.1492 {"}'M' greentint -9.4568 1.644 -5.0445 {"}'M' greentint -9.6061 1.5198 -5.2032 {"}'M' greentint -9.7384 1.3457 -5.3255 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 148 A}'M' greentint -10.2381 0.7533 -4.3455 {"}'M' greentint -10.0865 0.8815 -4.1847 {"}'M' greentint -9.9468 1.0488 -4.0508 {"}'M' greentint -9.8244 1.249 -3.9479 {"}'M' greentint -10.2498 0.7031 -4.7466 {"}'M' greentint -10.0917 0.7771 -4.5628 {"}'M' greentint -9.9399 0.8978 -4.3999 {"}'M' greentint -9.7996 1.0598 -4.2639 {"}'M' greentint -9.6777 1.2564 -4.1609 {"}'M' greentint -9.5793 1.4813 -4.0949 {"}'M' greentint -10.1469 0.7815 -4.9981 {"}'M' greentint -9.9843 0.8372 -4.8039 {"}'M' greentint -9.8265 0.9475 -4.6305 {"}'M' greentint -9.6811 1.1092 -4.4875 {"}'M' greentint -9.5565 1.3116 -4.3839 {"}'M' greentint -9.4601 1.5447 -4.3241 {"}'M' greentint -10.0726 0.9169 -5.2572 {"}'M' greentint -9.9134 0.9394 -5.0567 {"}'M' greentint -9.7537 1.0279 -4.8757 {"}'M' greentint -9.607 1.1775 -4.7281 {"}'M' greentint -9.4833 1.3773 -4.6234 {"}'M' greentint -9.3914 1.6115 -4.5701 {"}'M' greentint -9.7951 1.1099 -5.2108 {"}'M' greentint -9.6381 1.2057 -5.0334 {"}'M' greentint -9.4996 1.3763 -4.9019 {"}'M' greentint -9.3967 1.5998 -4.831 {"}'M' greentint -9.6565 1.3359 -5.2848 {"}'M' greentint -9.5067 1.4896 -5.134 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 359 1q7eA_369Y_361}P -6.4674 6.1544 -11.0572 {"}-6.4674 6.1544 -11.0572 { ca val A 359 1q7eA_369Y_361}-7.667 6.4354 -10.2557 { c val A 359 1q7eA_369Y_361}-7.8403 5.4141 -9.1521 { o val A 359 1q7eA_369Y_361}-7.8189 4.2147 -9.3857 { c val A 359 1q7eA_369Y_361}P -7.8403 5.4141 -9.1521 { n glu A 360 1q7eA_369Y_361}-8.029 5.9107 -7.9307 { ca glu A 360 1q7eA_369Y_361}-8.3577 5.069 -6.7883 { c glu A 360 1q7eA_369Y_361}-9.8667 4.7794 -6.7341 { o glu A 360 1q7eA_369Y_361}-10.7115 5.671 -6.9148 { c glu A 360 1q7eA_369Y_361}P -9.8667 4.7794 -6.7341 { n val A 361 1q7eA_369Y_361}-10.1946 3.5132 -6.5515 { ca val A 361 1q7eA_369Y_361}-11.5881 3.0754 -6.5174 { c val A 361 1q7eA_369Y_361}-11.7885 2.2071 -5.279 { o val A 361 1q7eA_369Y_361}-10.9571 1.3431 -4.9691 { c val A 361 1q7eA_369Y_361}P -11.7885 2.2071 -5.279 { n glu A 362 1q7eA_369Y_361}-12.9123 2.3983 -4.5944 { ca glu A 362 1q7eA_369Y_361}-13.3034 1.5082 -3.504 { c glu A 362 1q7eA_369Y_361}-14.1361 0.3197 -3.9864 { o glu A 362 1q7eA_369Y_361}-15.2354 0.4749 -4.5416 { c glu A 362 1q7eA_369Y_361}P -14.1361 0.3197 -3.9864 { n gln A 363 1q7eA_369Y_361}-13.6031 -0.8809 -3.7664 { ca gln A 363 1q7eA_369Y_361}-14.2659 -2.1069 -4.2113 { c gln A 363 1q7eA_369Y_361}-14.8516 -2.8727 -3.0189 { o gln A 363 1q7eA_369Y_361}-14.1237 -3.1406 -2.0688 { n gly A 367 1q7eA_369Y_361}P -11.6562 -3.3288 -0.6322 {"}-11.6562 -3.3288 -0.6322 { ca gly A 367 1q7eA_369Y_361}-11.1711 -2.0047 -0.2747 { c gly A 367 1q7eA_369Y_361}-10.6167 -1.2868 -1.5008 { o gly A 367 1q7eA_369Y_361}-11.1338 -1.468 -2.6122 { c gly A 367 1q7eA_369Y_361}P -10.6167 -1.2868 -1.5008 { n lys A 368 1q7eA_369Y_361}-9.5919 -0.4716 -1.2927 { ca lys A 368 1q7eA_369Y_361}-9.0924 0.3915 -2.3758 { c lys A 368 1q7eA_369Y_361}-8.2808 -0.4032 -3.4142 { o lys A 368 1q7eA_369Y_361}-7.512 -1.3326 -3.045 { c lys A 368 1q7eA_369Y_361}P -8.2808 -0.4032 -3.4142 { n tyr A 369 1q7eA_369Y_361}-8.4824 -0.0739 -4.6946 { ca tyr A 369 1q7eA_369Y_361}-7.5393 -0.48 -5.748 { c tyr A 369 1q7eA_369Y_361}-7.2871 0.6645 -6.7019 { o tyr A 369 1q7eA_369Y_361}-8.0067 1.6682 -6.6739 { c tyr A 369 1q7eA_369Y_361}P -7.2871 0.6645 -6.7019 { n leu A 370 1q7eA_369Y_361}-6.2217 0.5342 -7.4921 { ca leu A 370 1q7eA_369Y_361}-5.9337 1.5224 -8.5322 { c leu A 370 1q7eA_369Y_361}-6.3102 0.9614 -9.8877 { o leu A 370 1q7eA_369Y_361}-6.1581 -0.2456 -10.1494 { c leu A 370 1q7eA_369Y_361}P -6.3102 0.9614 -9.8877 { n thr A 371 1q7eA_369Y_361}-6.7996 1.855 -10.7435 { ca thr A 371 1q7eA_369Y_361}-7.056 1.4875 -12.1311 { c thr A 371 1q7eA_369Y_361}-6.5368 2.567 -13.0485 { o thr A 371 1q7eA_369Y_361}-6.2426 3.6633 -12.5806 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 359 1q7eA_369Y_361}P -6.4674 6.1544 -11.0572 { ca val A 359 1q7eA_369Y_361}P -7.667 6.4354 -10.2557 { n glu A 360 1q7eA_369Y_361}P -8.029 5.9107 -7.9307 { ca glu A 360 1q7eA_369Y_361}P -8.3577 5.069 -6.7883 { n val A 361 1q7eA_369Y_361}P -10.1946 3.5132 -6.5515 { ca val A 361 1q7eA_369Y_361}P -11.5881 3.0754 -6.5174 { n glu A 362 1q7eA_369Y_361}P -12.9123 2.3983 -4.5944 { ca glu A 362 1q7eA_369Y_361}P -13.3034 1.5082 -3.504 { n gln A 363 1q7eA_369Y_361}P -13.6031 -0.8809 -3.7664 { ca gln A 363 1q7eA_369Y_361}P -14.2659 -2.1069 -4.2113 { n gly A 367 1q7eA_369Y_361}P -11.6562 -3.3288 -0.6322 { ca gly A 367 1q7eA_369Y_361}P -11.1711 -2.0047 -0.2747 {"}P -11.1711 -2.0047 -0.2747 { n lys A 368 1q7eA_369Y_361}P -9.5919 -0.4716 -1.2927 { ca lys A 368 1q7eA_369Y_361}P -9.0924 0.3915 -2.3758 { n tyr A 369 1q7eA_369Y_361}P -8.4824 -0.0739 -4.6946 { ca tyr A 369 1q7eA_369Y_361}P -7.5393 -0.48 -5.748 { n leu A 370 1q7eA_369Y_361}P -6.2217 0.5342 -7.4921 { ca leu A 370 1q7eA_369Y_361}P -5.9337 1.5224 -8.5322 { n thr A 371 1q7eA_369Y_361}P -6.7996 1.855 -10.7435 { ca thr A 371 1q7eA_369Y_361}P -7.056 1.4875 -12.1311 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 359 1q7eA_369Y_361}P -7.667 6.4354 -10.2557 {"}-7.667 6.4354 -10.2557 { ca glu A 360 1q7eA_369Y_361}-8.3577 5.069 -6.7883 { ca val A 361 1q7eA_369Y_361}-11.5881 3.0754 -6.5174 { ca glu A 362 1q7eA_369Y_361}-13.3034 1.5082 -3.504 { ca gln A 363 1q7eA_369Y_361}-14.2659 -2.1069 -4.2113 { ca gly A 367 1q7eA_369Y_361}P -11.1711 -2.0047 -0.2747 {"}-11.1711 -2.0047 -0.2747 { ca lys A 368 1q7eA_369Y_361}-9.0924 0.3915 -2.3758 { ca tyr A 369 1q7eA_369Y_361}-7.5393 -0.48 -5.748 { ca leu A 370 1q7eA_369Y_361}-5.9337 1.5224 -8.5322 { ca thr A 371 1q7eA_369Y_361}-7.056 1.4875 -12.1311 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 361 1q7eA_369Y_361}P -11.5881 3.0754 -6.5174 { cb val A 361 1q7eA_369Y_361}-11.9219 2.1825 -7.7524 { cg1 val A 361 1q7eA_369Y_361}-13.4173 1.8029 -7.7616 { cb val A 361 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-12.0307 0.344 -7.6882 {"}'S' P -11.3842 0.3189 -7.2534 {"}'S' -11.3929 0.2529 -7.2724 {"}'S' P -11.531 0.3797 -7.461 {"}'S' -11.5374 0.2604 -7.4802 {"}'S' P -11.6876 0.4027 -7.6684 {"}'S' -11.6827 0.2821 -7.6735 {"}'S' P -11.8492 0.3852 -7.8733 {"}'S' -11.841 0.3205 -7.8678 {"}'S' P -11.0647 0.2387 -7.2479 {"}'S' -11.0706 0.2243 -7.2527 {"}'S' P -11.2027 0.3297 -7.4504 {"}'S' -11.2267 0.2307 -7.4675 {"}'S' P -11.3517 0.3827 -7.6577 {"}'S' -11.3739 0.238 -7.6651 {"}'S' P -11.5087 0.3971 -7.8651 {"}'S' -11.5178 0.2638 -7.8557 {"}'S' P -11.6708 0.3736 -8.0677 {"}'S' -11.6691 0.3047 -8.0548 {"}'S' P -10.9939 0.2828 -7.602 {"}'S' -11.0177 0.22 -7.6066 {"}'S' P -11.1425 0.3366 -7.8089 {"}'S' -11.1728 0.2318 -7.8042 {"}'S' P -11.3001 0.3539 -8.0163 {"}'S' -11.3177 0.2565 -8.001 {"}'S' P -11.4619 0.3309 -8.2202 {"}'S' -11.4658 0.2908 -8.2078 {"}'S' P -10.9292 0.2502 -7.9368 {"}'S' -10.9389 0.2264 -7.9344 {"}'S' P -11.0851 0.2716 -8.1445 {"}'S' -11.0922 0.2498 -8.139 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 369 A}'S' blue -13.1704 -0.2888 -9.0075 {"}'S' blue -13.3082 -0.2095 -9.2071 {"}'S' blue -13.4662 -0.2179 -9.4091 {"}'S' sky -12.9839 -0.1178 -9.0719 {"}'S' sky -13.123 -0.0394 -9.2731 {"}'S' sky -13.2792 -0.0288 -9.477 {"}'S' blue -12.7481 -0.0147 -9.1115 {"}'S' sky -12.883 0.0787 -9.3121 {"}'S' sky -13.0359 0.1146 -9.519 {"}'S' blue -13.196 0.0906 -9.7204 {"}'S' blue -12.6419 0.1557 -9.3863 {"}'S' blue -12.7873 0.206 -9.5879 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 361 A}'S' sky -12.2233 0.56 -8.3357 {"}'S' blue -12.0939 0.6685 -8.6142 {"}'S' sky -11.9656 0.565 -8.4186 {"}'S' sky -11.8811 0.746 -8.7512 {"}'S' blue -11.6443 0.828 -8.8256 { CG1 VAL 361 A}'S' blue -13.265 0.0604 -7.7246 {"}'S' sky -13.1012 0.0984 -7.5248 {"}'S' sky -12.9384 0.1742 -7.335 {"}'S' sky -12.7801 0.288 -7.1617 {"}'S' blue -13.1676 0.0907 -8.0222 {"}'S' sky -13.0099 0.1025 -7.8214 {"}'S' blue -12.3956 0.5228 -7.1444 {"}'S' sky -12.9545 0.162 -8.1574 {"}'S' blue -12.8621 0.2843 -8.4298 {"}'S' sky -12.7043 0.2726 -8.2234 {"}'S' blue -12.6184 0.4164 -8.4704 {"}'S' sky -12.4599 0.4283 -8.2684 {"}'S' blue -12.5042 0.598 -8.6429 {"}'S' blue -12.347 0.5958 -8.4395 { HB VAL 361 A}'S' sky -10.9186 0.462 -6.9197 {"}'S' sky -10.6672 0.524 -7.0448 {"}'S' sky -10.5061 0.541 -7.2506 {"}'S' sky -11.3118 0.7233 -8.7113 {"}'S' sky -10.5325 0.404 -7.6143 {"}'S' sky -11.0092 0.6213 -8.599 {HG11 VAL 361 A}'S' blue -13.5561 0.0948 -9.0822 {"}'S' blue -13.4088 0.0517 -8.8796 {"}'S' blue -13.0929 0.1455 -8.4983 {"}'S' blue -13.4472 0.2707 -9.3581 {"}'S' sky -13.3124 0.1758 -9.1572 {"}'S' sky -13.1566 0.1516 -8.949 {"}'S' blue -12.9933 0.2005 -8.7524 {"}'S' blue -12.8361 0.3189 -8.5816 {"}'S' sky -13.2101 0.3835 -9.3913 {"}'S' sky -13.073 0.3085 -9.1918 {"}'S' blue -12.9167 0.3193 -8.9926 {"}'S' blue -12.7605 0.4147 -8.818 {"}'S' blue -12.9219 0.5037 -9.2827 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 361 A}'S' sea -12.237 0.4846 -7.4708 {"}'S' green -12.1955 0.4563 -7.8434 {"}'S' sea -12.0813 0.4816 -8.1305 { CG1 VAL 361 A}'S' sea -12.8496 0.1528 -7.6291 {"}'S' sea -12.6915 0.2414 -7.4487 {"}'S' sea -12.5392 0.3656 -7.2859 {"}'S' sea -12.7955 0.1789 -7.9558 {"}'S' green -12.634 0.2378 -7.764 {"}'S' green -12.4761 0.3377 -7.588 {"}'S' sea -12.3251 0.4751 -7.4318 {"}'S' sea -12.5422 0.3105 -8.0242 {"}'S' sea -12.3808 0.3956 -7.8385 {"}'S' sea -12.2987 0.4948 -8.0786 { HB VAL 361 A}'S' green -12.044 0.3499 -7.5027 {"}'S' green -11.7393 0.3248 -7.101 {"}'S' green -12.0796 0.4177 -7.9769 {"}'S' green -11.3571 0.2958 -7.0094 {"}'S' green -11.912 0.3854 -8.183 {"}'S' sea -11.7616 0.5062 -8.4544 {"}'S' green -11.6739 0.3301 -8.291 {"}'S' green -10.8013 0.344 -7.1682 {"}'S' sea -11.5546 0.6297 -8.6304 {"}'S' green -11.4835 0.4334 -8.4851 {"}'S' green -10.7893 0.2306 -7.531 {"}'S' sea -10.6389 0.362 -7.3724 {"}'S' green -11.2474 0.5144 -8.5687 {"}'S' green -11.1437 0.3557 -8.3907 {"}'S' green -11.0088 0.2609 -8.1898 {"}'S' green -10.853 0.2366 -7.9816 {"}'S' sea -10.9066 0.4686 -8.4239 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 361 A}'S' P -11.8967 0.3069 -7.3001 {"}'S' -11.8924 0.3149 -7.3029 {"}'S' P -11.9642 0.286 -7.7909 {"}'S' -11.9422 0.3199 -7.7873 {"}'S' P -11.8269 0.2045 -7.5914 {"}'S' -11.7892 0.2858 -7.5977 {"}'S' P -11.6749 0.1788 -7.3881 {"}'S' -11.6481 0.2645 -7.4102 {"}'S' P -11.5155 0.2092 -7.1908 {"}'S' -11.5076 0.2535 -7.2106 {"}'S' P -11.8032 0.2448 -8.0039 {"}'S' -11.7776 0.3001 -7.9851 {"}'S' P -11.6725 0.1504 -7.8089 {"}'S' -11.6355 0.2701 -7.7942 {"}'S' P -11.5252 0.1087 -7.6066 {"}'S' -11.5015 0.2497 -7.6149 {"}'S' P -11.3696 0.1207 -7.4087 {"}'S' -11.3657 0.2311 -7.4337 {"}'S' P -11.211 0.1852 -7.222 {"}'S' -11.215 0.224 -7.238 {"}'S' P -11.5577 0.1983 -8.1056 {"}'S' -11.5419 0.272 -8.0752 {"}'S' P -11.4212 0.117 -7.9055 {"}'S' -11.4106 0.2468 -7.8796 {"}'S' P -11.2688 0.092 -7.7018 {"}'S' -11.2765 0.2267 -7.6986 {"}'S' P -11.1094 0.1224 -7.5045 {"}'S' -11.1268 0.2091 -7.5174 {"}'S' P -10.9514 0.2082 -7.3235 {"}'S' -10.9525 0.2117 -7.3242 {"}'S' P -11.381 0.2806 -8.31 {"}'S' -11.3815 0.2856 -8.3068 {"}'S' P -11.2525 0.1798 -8.1148 {"}'S' -11.2568 0.2432 -8.089 {"}'S' P -11.1052 0.1368 -7.9123 {"}'S' -11.1213 0.219 -7.8949 {"}'S' P -10.9471 0.1546 -7.7138 {"}'S' -10.965 0.2044 -7.7121 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 369 A}'M' greentint -9.1788 2.0606 -6.0175 {"}'M' greentint -9.3224 1.9529 -6.29 {"}'M' greentint -8.9169 2.3819 -5.8849 {"}'M' greentint -9.0801 2.3485 -6.0867 {"}'M' greentint -9.2287 2.1916 -6.2352 {"}'M' greentint -9.3325 2.0953 -6.5327 {"}'M' greentint -9.389 1.8458 -6.5359 {"}'M' greentint -8.773 2.587 -5.9469 {"}'M' greentint -8.9309 2.5787 -6.1489 {"}'M' greentint -9.0895 2.4855 -6.3273 {"}'M' greentint -9.2287 2.3175 -6.4605 {"}'M' greentint -9.3021 2.1893 -6.7775 {"}'M' greentint -9.3732 1.9442 -6.8017 {"}'M' greentint -8.7439 2.7678 -6.2167 {"}'M' greentint -8.9041 2.7095 -6.4087 {"}'M' greentint -9.0589 2.5865 -6.5734 {"}'M' greentint -9.1946 2.4089 -6.6996 {"}'M' greentint -9.2242 2.2695 -7.0157 {"}'M' greentint -8.6608 2.8872 -6.4602 {"}'M' greentint -8.8232 2.8056 -6.6465 {"}'M' greentint -8.9755 2.6696 -6.8065 {"}'M' greentint -9.1121 2.4881 -6.9313 {"}'M' greentint -8.7221 2.8518 -6.8931 {"}'M' greentint -8.8683 2.7083 -7.043 {"}'M' greentint -8.9991 2.5263 -7.1615 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 361 A}'M' greentint -9.2211 1.8541 -6.199 {"}'M' greentint -9.0709 1.9786 -6.0392 {"}'M' greentint -8.9378 2.1542 -5.9161 {"}'M' greentint -8.8325 2.3688 -5.8384 {"}'M' greentint -9.3287 1.8494 -6.7364 {"}'M' greentint -9.1706 1.8516 -6.5326 {"}'M' greentint -9.0099 1.9276 -6.3458 {"}'M' greentint -8.8604 2.0729 -6.1934 {"}'M' greentint -8.7358 2.2729 -6.0875 {"}'M' greentint -8.6472 2.5105 -6.0395 {"}'M' greentint -8.6027 2.7652 -6.0522 {"}'M' greentint -9.2256 2.0121 -6.9914 {"}'M' greentint -9.0769 1.9624 -6.7853 {"}'M' greentint -8.9145 2.0073 -6.5874 {"}'M' greentint -8.7603 2.14 -6.4256 {"}'M' greentint -8.6361 2.3433 -6.321 {"}'M' greentint -8.5578 2.589 -6.2889 {"}'M' greentint -8.5368 2.8444 -6.3322 {"}'M' greentint -9.0976 2.2476 -7.1539 {"}'M' greentint -8.9659 2.1459 -6.9557 {"}'M' greentint -8.8049 2.174 -6.7558 {"}'M' greentint -8.6568 2.3259 -6.6069 {"}'M' greentint -8.562 2.56 -6.5496 {"}'M' greentint -8.5457 2.8137 -6.5989 {"}'M' greentint -8.9366 2.5189 -7.1871 {"}'M' greentint -8.8324 2.3637 -7.0093 {"}'M' greentint -8.6724 2.4607 -6.8298 {"}'M' greentint -8.6174 2.7139 -6.8296 {"}'M' greentint -8.7507 2.6103 -7.0291 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 369 A}'M' greentint -10.0446 0.6233 -4.4171 {"}'M' greentint -10.1778 0.5197 -4.6166 {"}'M' greentint -9.9629 0.8699 -4.4369 {"}'M' greentint -10.1229 0.773 -4.6163 {"}'M' greentint -10.2333 0.6736 -4.8966 {"}'M' greentint -10.2496 0.4199 -4.8473 {"}'M' greentint -10.1829 0.2146 -4.7042 {"}'M' greentint -9.8294 1.0877 -4.4904 {"}'M' greentint -9.9904 1.0597 -4.6904 {"}'M' greentint -10.1385 0.9077 -4.8393 {"}'M' greentint -10.205 0.771 -5.1502 {"}'M' greentint -10.2554 0.5164 -5.1456 {"}'M' greentint -10.2467 0.2685 -5.0652 {"}'M' greentint -9.641 1.2576 -4.5571 {"}'M' greentint -9.7999 1.2607 -4.763 {"}'M' greentint -9.9601 1.1697 -4.9459 {"}'M' greentint -10.1016 0.9992 -5.0814 {"}'M' greentint -10.1081 0.8453 -5.3902 {"}'M' greentint -10.1764 0.5963 -5.4079 {"}'M' greentint -10.1969 0.3431 -5.3644 {"}'M' greentint -9.7054 1.3531 -5.0105 {"}'M' greentint -9.8621 1.2411 -5.1818 {"}'M' greentint -10.0006 1.0664 -5.3126 {"}'M' greentint -9.9628 0.8648 -5.6078 {"}'M' greentint -10.0362 0.625 -5.6347 {"}'M' greentint -9.7244 1.2551 -5.407 {"}'M' greentint -9.8575 1.0795 -5.5301 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 361 A}'M' greentint -10.1719 0.2216 -4.6771 {"}'M' greentint -10.0315 0.3836 -4.541 {"}'M' greentint -9.9096 0.5802 -4.438 {"}'M' greentint -9.8112 0.805 -4.372 {"}'M' greentint -10.2163 0.161 -5.0811 {"}'M' greentint -10.0585 0.2712 -4.9076 {"}'M' greentint -9.9131 0.433 -4.7647 {"}'M' greentint -9.7885 0.6354 -4.6611 {"}'M' greentint -9.692 0.8685 -4.6012 {"}'M' greentint -9.6283 1.1202 -4.5886 {"}'M' greentint -10.1453 0.2631 -5.3338 {"}'M' greentint -9.9856 0.3517 -5.1528 {"}'M' greentint -9.8389 0.5013 -5.0053 {"}'M' greentint -9.7152 0.7011 -4.9006 {"}'M' greentint -9.6233 0.9352 -4.8473 {"}'M' greentint -9.5714 1.1861 -4.8489 {"}'M' greentint -10.0271 0.4336 -5.4879 {"}'M' greentint -9.87 0.5295 -5.3106 {"}'M' greentint -9.7316 0.7001 -5.1791 {"}'M' greentint -9.6287 0.9236 -5.1082 {"}'M' greentint -9.5742 1.1733 -5.1079 {"}'M' greentint -9.8884 0.6597 -5.562 {"}'M' greentint -9.7387 0.8134 -5.4111 {"}'M' greentint -9.6434 1.0497 -5.3536 {"}'M' greentint -9.7802 0.9576 -5.6222 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n cys A 25 1qddA_27Y_140C}P -12.0788 -1.437 0.973 {"}-12.0788 -1.437 0.973 { ca cys A 25 1qddA_27Y_140C}-11.1514 -2.0079 -0.0061 { c cys A 25 1qddA_27Y_140C}-10.8939 -0.967 -1.0999 { o cys A 25 1qddA_27Y_140C}-11.7965 -0.224 -1.4779 { c cys A 25 1qddA_27Y_140C}P -10.8939 -0.967 -1.0999 { n tyr A 26 1qddA_27Y_140C}-9.6381 -0.9119 -1.5425 { ca tyr A 26 1qddA_27Y_140C}-9.193 0.0929 -2.5049 { c tyr A 26 1qddA_27Y_140C}-8.4014 -0.4985 -3.6632 { o tyr A 26 1qddA_27Y_140C}-7.6851 -1.4873 -3.4412 { c tyr A 26 1qddA_27Y_140C}P -8.4014 -0.4985 -3.6632 { n tyr A 27 1qddA_27Y_140C}-8.4323 0.1255 -4.8357 { ca tyr A 27 1qddA_27Y_140C}-7.568 -0.3267 -5.9282 { c tyr A 27 1qddA_27Y_140C}-7.3144 0.8074 -6.9137 { o tyr A 27 1qddA_27Y_140C}-8.1392 1.6968 -7.111 { c tyr A 27 1qddA_27Y_140C}P -7.3144 0.8074 -6.9137 { n phe A 28 1qddA_27Y_140C}-6.1463 0.7759 -7.5502 { ca phe A 28 1qddA_27Y_140C}-5.7167 1.7034 -8.5811 { c phe A 28 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CE1 TYR 27 A}'S' blue -11.009 0.3071 -7.8418 {"}'S' blue -11.1079 0.4728 -8.0165 {"}'S' blue -11.2301 0.5991 -8.2089 {"}'S' sky -11.523 0.7143 -8.6202 {"}'S' sky -12.0055 0.5276 -9.1909 {"}'S' blue -11.2663 0.8155 -8.6735 {"}'S' sky -11.4222 0.8211 -8.8776 {"}'S' sky -11.8984 0.5879 -9.4274 {"}'S' blue -12.044 0.4337 -9.5724 {"}'S' blue -11.1396 0.8964 -8.9238 {"}'S' sky -11.2973 0.8832 -9.1243 {"}'S' sky -11.4581 0.8307 -9.3168 {"}'S' sky -11.6154 0.741 -9.4959 {"}'S' blue -11.7685 0.6155 -9.6578 { CZ TYR 27 A}'S' blue -12.9194 0.1091 -7.5437 {"}'S' sky -12.8738 0.291 -7.8049 {"}'S' blue -12.9633 0.3566 -8.2566 {"}'S' sky -12.1677 0.4219 -9.2722 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 27 A}'S' sea -11.684 0.6993 -8.8232 {"}'S' sea -11.8468 0.6367 -9.016 {"}'S' sea -11.5826 0.7849 -9.0749 {"}'S' sea -11.7433 0.7065 -9.2595 { CE2 TYR 27 A}'S' green -12.1089 0.087 -6.4 {"}'S' green -12.2568 0.1368 -6.605 {"}'S' green -12.4127 0.1424 -6.8091 {"}'S' green -12.5731 0.1062 -7.0064 {"}'S' green -11.8358 0.1246 -6.4489 {"}'S' green -12.4486 0.1519 -7.2483 {"}'S' sea -11.5052 0.07 -6.4204 {"}'S' green -11.6396 0.1684 -6.6214 {"}'S' sea -11.3201 0.0882 -6.6159 {"}'S' green -11.458 0.1793 -6.8184 {"}'S' green -11.2493 0.1324 -6.97 {"}'S' green -11.3979 0.1861 -7.1769 { CZ TYR 27 A}'S' green -12.5773 0.2029 -7.3982 {"}'S' sea -12.7195 0.2733 -7.6002 {"}'S' green -12.4865 0.4 -7.6523 {"}'S' green -12.6395 0.4342 -7.8607 {"}'S' sea -12.8005 0.4192 -8.0638 {"}'S' green -12.3828 0.5355 -7.9141 {"}'S' green -12.5387 0.5411 -8.1182 {"}'S' sea -12.6991 0.5049 -8.3154 {"}'S' green -12.2561 0.6163 -8.1644 {"}'S' green -12.4138 0.6032 -8.3649 {"}'S' green -12.5746 0.5506 -8.5573 {"}'S' green -11.9123 0.6279 -8.1381 {"}'S' sea -12.069 0.6509 -8.3454 {"}'S' green -12.2305 0.6334 -8.5503 {"}'S' green -12.3944 0.5768 -8.746 {"}'S' sea -12.5556 0.483 -8.9278 {"}'S' sea -11.2188 0.2059 -7.5518 {"}'S' green -11.3238 0.3623 -7.731 {"}'S' green -11.4461 0.4869 -7.9249 {"}'S' sea -11.584 0.5779 -8.1274 {"}'S' sea -11.89 0.6453 -8.5422 {"}'S' green -12.0522 0.6218 -8.7447 {"}'S' green -12.2158 0.5604 -8.939 {"}'S' sea -12.3766 0.4619 -9.1193 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 27 A}'S' P -11.9782 0.1905 -6.6518 {"}'S' -11.9769 0.1617 -6.6588 {"}'S' P -12.1301 0.2176 -6.8553 {"}'S' -12.1212 0.1575 -6.8637 {"}'S' P -12.2878 0.2045 -7.0559 {"}'S' -12.2789 0.1644 -7.0568 {"}'S' P -11.7863 0.2292 -6.829 {"}'S' -11.7903 0.1656 -6.8387 {"}'S' P -11.943 0.2522 -7.0364 {"}'S' -11.9387 0.1606 -7.0404 {"}'S' P -12.1045 0.2347 -7.2413 {"}'S' -12.0963 0.17 -7.2358 {"}'S' P -11.6071 0.2323 -7.0257 {"}'S' -11.615 0.1809 -7.0281 {"}'S' P -11.764 0.2466 -7.2331 {"}'S' -11.7682 0.1792 -7.2286 { CZ TYR 27 A}'S' P -12.3466 0.319 -7.4495 {"}'S' -12.3384 0.2858 -7.4717 {"}'S' P -11.9819 0.2664 -7.3218 {"}'S' -11.9824 0.2085 -7.3691 {"}'S' P -12.0994 0.3955 -7.5102 {"}'S' -12.0945 0.318 -7.5575 {"}'S' P -12.2348 0.4857 -7.7091 {"}'S' -12.2272 0.4365 -7.7318 {"}'S' P -11.7211 0.2826 -7.3792 {"}'S' -11.73 0.2358 -7.4149 {"}'S' P -11.8338 0.4203 -7.563 {"}'S' -11.8418 0.344 -7.606 {"}'S' P -11.9618 0.5233 -7.7579 {"}'S' -11.964 0.4601 -7.7842 {"}'S' P -12.1042 0.5892 -7.9608 {"}'S' -12.104 0.5824 -7.9625 {"}'S' P -11.5125 0.335 -7.5384 {"}'S' -11.5172 0.3206 -7.5467 {"}'S' P -11.6312 0.4687 -7.7294 {"}'S' -11.6386 0.4369 -7.7426 {"}'S' P -11.7655 0.5671 -7.9304 {"}'S' -11.7667 0.5579 -7.9333 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 27 A}'S' blue -13.0626 0.4201 -8.2939 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 27 A}'S' green -13.4553 0.8063 -8.5088 {"}'S' green -13.1108 0.6353 -8.4159 {"}'S' green -13.7652 0.9381 -9.3452 {"}'S' green -13.5749 0.9198 -9.5235 {"}'S' green -12.7071 0.5489 -8.7278 {"}'S' green -13.3611 0.8508 -9.6582 {"}'S' green -13.117 0.7436 -9.7119 @dotlist {x} color= red width= 1 master= {H-bonds} { HH TYR 27 A}'S' greentint -13.5835 0.9154 -8.7055 {"}'S' greentint -13.7352 0.9509 -8.9106 {"}'S' greentint -13.1956 0.8114 -8.5753 {"}'S' greentint -13.3128 0.936 -8.7605 {"}'S' greentint -13.4527 1.0011 -8.9598 {"}'S' greentint -13.607 1.0018 -9.1589 {"}'S' greentint -12.9079 0.6627 -8.5907 {"}'S' greentint -13 0.8271 -8.7559 {"}'S' greentint -13.121 0.9398 -8.9436 {"}'S' greentint -13.2637 0.9949 -9.1426 {"}'S' greentint -13.4178 0.9881 -9.3398 {"}'S' greentint -12.7918 0.725 -8.8872 {"}'S' greentint -12.909 0.8496 -9.0725 {"}'S' greentint -13.0494 0.9139 -9.2722 {"}'S' greentint -13.2037 0.9146 -9.4713 {"}'S' greentint -12.6754 0.6389 -9.1118 {"}'S' greentint -12.8036 0.7481 -9.3085 {"}'S' greentint -12.9553 0.7835 -9.5136 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 140 A}'S' blue -13.3141 0.8729 -8.0199 {"}'S' blue -13.0872 0.5897 -7.6469 {"}'S' sky -12.9497 0.4979 -7.4449 {"}'S' sky -12.8011 0.4441 -7.238 {"}'S' sky -13.0656 0.8125 -8.1108 {"}'S' sky -12.9557 0.6634 -7.9266 {"}'S' sky -12.0115 0.9219 -8.2587 { HB2 CYS 140 A}'S' blue -11.4496 0.8792 -8.0056 @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 140 A}'S' sea -12.829 0.5478 -7.7304 {"}'S' sea -12.6869 0.4694 -7.5251 {"}'S' sea -12.6995 0.6563 -8.0089 {"}'S' green -12.5712 0.5528 -7.8132 {"}'S' sea -12.4867 0.7337 -8.1458 {"}'S' green -12.3594 0.6244 -7.9502 {"}'S' sea -12.2499 0.8158 -8.2203 { HB2 CYS 140 A}'S' sea -12.5943 0.2653 -7.135 {"}'S' green -12.457 0.1838 -6.9356 {"}'S' green -12.305 0.1581 -6.7323 {"}'S' green -12.1457 0.1885 -6.535 {"}'S' sea -11.9872 0.2751 -6.3536 {"}'S' green -12.5421 0.3647 -7.5272 {"}'S' green -12.4333 0.2241 -7.3481 {"}'S' sea -11.6882 0.2806 -6.4007 {"}'S' green -11.5815 0.1875 -6.6677 {"}'S' green -12.1847 0.609 -7.9746 {"}'S' green -11.4195 0.2099 -6.8752 {"}'S' green -11.942 0.7027 -8.0555 {"}'S' green -11.4831 0.2159 -7.3258 {"}'S' green -11.3199 0.2649 -7.1293 {"}'S' green -11.6393 0.6006 -7.9432 {"}'S' green -11.3996 0.3728 -7.5687 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 CYS 140 A}'S' P -12.3026 0.1297 -7.1531 {"}'S' -12.2928 0.1626 -7.1489 {"}'S' P -12.1553 0.088 -6.9508 {"}'S' -12.1446 0.1539 -6.9546 {"}'S' P -11.9998 0.1 -6.7529 {"}'S' -11.9974 0.1537 -6.7654 {"}'S' P -11.8411 0.1645 -6.5662 {"}'S' -11.8411 0.1659 -6.5664 {"}'S' P -12.3917 0.4855 -7.7986 {"}'S' -12.3907 0.4874 -7.7961 {"}'S' P -12.304 0.3094 -7.6352 {"}'S' -12.2876 0.3541 -7.6059 {"}'S' P -12.1878 0.1776 -7.4498 {"}'S' -12.175 0.2404 -7.4243 {"}'S' P -12.0513 0.0963 -7.2497 {"}'S' -12.0454 0.1665 -7.2354 {"}'S' P -11.8989 0.0713 -7.0459 {"}'S' -11.9036 0.1618 -7.044 {"}'S' P -11.7395 0.1017 -6.8487 {"}'S' -11.752 0.1631 -6.8575 {"}'S' P -12.1137 0.4127 -7.8292 {"}'S' -12.1055 0.4567 -7.7854 {"}'S' P -12.0111 0.2599 -7.6542 {"}'S' -12.0064 0.3403 -7.6012 {"}'S' P -11.8826 0.1591 -7.459 {"}'S' -11.8884 0.2357 -7.428 {"}'S' P -11.7354 0.1161 -7.2564 {"}'S' -11.747 0.1765 -7.2434 {"}'S' P -11.5772 0.1339 -7.058 {"}'S' -11.5925 0.1771 -7.0563 {"}'S' P -11.8775 0.4937 -7.9129 {"}'S' -11.8801 0.5179 -7.8844 {"}'S' P -11.7738 0.335 -7.7349 {"}'S' -11.7852 0.392 -7.6901 {"}'S' P -11.6389 0.2402 -7.534 {"}'S' -11.6524 0.2854 -7.5098 {"}'S' P -11.5367 0.4479 -7.7681 {"}'S' -11.5385 0.4521 -7.7648 @dotlist {x} color= yellow width= 1 master= {vdw contact} { SG CYS 140 A}'S' sky -11.7995 0.9598 -8.5022 {"}'S' sky -12.2255 0.7662 -9.3717 {"}'S' sky -11.5969 1.0791 -8.6473 {"}'S' sky -12.0394 0.8833 -9.5048 {"}'S' sky -11.5733 1.0729 -8.9553 {"}'S' blue -11.43 1.2192 -8.81 {"}'S' blue -11.9046 1.0341 -9.6727 {"}'S' sky -11.7461 1.0458 -9.4725 {"}'S' sky -11.5866 1.1118 -9.2849 {"}'S' blue -11.4328 1.2281 -9.1183 @dotlist {x} color= yellow width= 1 master= {vdw contact} { SG CYS 140 A}'S' green -13.8466 0.9913 -9.0755 {"}'S' green -13.4266 0.8056 -8.4813 {"}'S' green -12.8405 0.6666 -8.5252 {"}'S' sea -12.683 0.7198 -8.3375 {"}'S' green -12.5847 0.6562 -8.6175 {"}'S' green -12.4255 0.7229 -8.4306 {"}'S' sea -12.2701 0.8225 -8.2562 {"}'S' green -13.0551 0.8212 -9.6877 {"}'S' green -12.6359 0.6356 -9.0929 {"}'S' green -12.4804 0.6448 -8.8945 {"}'S' green -12.3224 0.6899 -8.7041 {"}'S' green -12.1658 0.7705 -8.5238 {"}'S' sea -12.0129 0.8851 -8.3581 {"}'S' sea -12.2736 0.6948 -9.0402 {"}'S' green -12.1124 0.7454 -8.8468 {"}'S' sea -11.9539 0.8347 -8.6659 {"}'S' sea -12.0656 0.783 -9.1708 {"}'S' sea -11.9054 0.8412 -8.9788 {"}'S' sea -11.7475 0.9411 -8.8028 {"}'S' sea -11.8837 0.9022 -9.3082 {"}'S' sea -11.7268 0.9663 -9.1237 @dotlist {x} color= yellow width= 1 master= {H-bonds} { SG CYS 140 A}'S' greentint -13.7172 0.8946 -8.8818 {"}'S' greentint -13.5764 0.8325 -8.6819 {"}'S' greentint -13.7099 0.9385 -9.3004 {"}'S' greentint -13.5846 0.8308 -9.108 {"}'S' greentint -13.4458 0.7558 -8.908 {"}'S' greentint -13.2976 0.7154 -8.7066 {"}'S' greentint -13.1426 0.711 -8.5039 {"}'S' greentint -13.5453 0.9109 -9.505 {"}'S' greentint -13.4249 0.796 -9.3176 {"}'S' greentint -13.2913 0.7133 -9.1212 {"}'S' greentint -13.1472 0.6633 -8.9214 {"}'S' greentint -12.9962 0.6477 -8.7218 {"}'S' greentint -13.3101 0.8527 -9.6094 {"}'S' greentint -13.1849 0.7451 -9.417 {"}'S' greentint -13.0465 0.6693 -9.2175 {"}'S' greentint -12.8987 0.6298 -9.015 {"}'S' greentint -12.7433 0.6245 -8.8133 {"}'S' greentint -12.9265 0.7246 -9.4934 {"}'S' greentint -12.7853 0.6616 -9.2945 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 27 A}'M' green -9.3113 2.0892 -6.4546 {"}'M' green -9.0634 2.6072 -6.586 {"}'M' green -9.2422 2.3428 -7.6825 {"}'M' green -9.0008 2.7369 -7.4801 {"}'M' green -9.1316 2.5549 -7.5986 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 27 A}'M' greentint -9.4549 1.9815 -6.7271 {"}'M' greentint -9.2126 2.3771 -6.5238 {"}'M' greentint -9.3612 2.2202 -6.6723 {"}'M' greentint -9.465 2.1238 -6.9698 {"}'M' greentint -9.5215 1.8743 -6.973 {"}'M' greentint -9.222 2.5141 -6.7644 {"}'M' greentint -9.3612 2.3461 -6.8976 {"}'M' greentint -9.4346 2.2179 -7.2146 {"}'M' greentint -9.5057 1.9727 -7.2388 {"}'M' greentint -9.0366 2.7381 -6.8458 {"}'M' greentint -9.1914 2.615 -7.0105 {"}'M' greentint -9.3271 2.4375 -7.1367 {"}'M' greentint -9.3567 2.2981 -7.4528 {"}'M' greentint -9.4379 2.0549 -7.4912 {"}'M' greentint -8.9557 2.8342 -7.0836 {"}'M' greentint -9.108 2.6982 -7.2436 {"}'M' greentint -9.2446 2.5166 -7.3684 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H CYS 140 A}'M' green -9.4857 1.9623 -6.6503 {"}'M' green -9.3526 2.1379 -6.5272 {"}'M' green -9.2473 2.3525 -6.4495 {"}'M' green -9.5854 1.8353 -7.1437 {"}'M' green -9.0175 2.749 -6.6633 {"}'M' green -9.4917 1.9462 -7.3964 {"}'M' green -8.9516 2.8281 -6.9433 {"}'M' green -9.1655 2.5941 -7.6402 @dotlist {x} color= sky width= 1 master= {H-bonds} { H CYS 140 A}'M' greentint -9.4247 1.9113 -6.9569 {"}'M' greentint -9.2752 2.0567 -6.8045 {"}'M' greentint -9.1506 2.2566 -6.6986 {"}'M' greentint -9.062 2.4942 -6.6506 {"}'M' greentint -9.3293 1.9911 -7.1985 {"}'M' greentint -9.1751 2.1237 -7.0367 {"}'M' greentint -9.0509 2.327 -6.9321 {"}'M' greentint -8.9726 2.5727 -6.9 {"}'M' greentint -9.3807 2.1297 -7.5668 {"}'M' greentint -9.2197 2.1577 -7.3669 {"}'M' greentint -9.0716 2.3097 -7.218 {"}'M' greentint -8.9768 2.5438 -7.1607 {"}'M' greentint -8.9605 2.7975 -7.21 {"}'M' greentint -9.2472 2.3475 -7.6204 {"}'M' greentint -9.0872 2.4444 -7.4409 {"}'M' greentint -9.0323 2.6977 -7.4407 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 27 A}'M' -9.9999 0.8734 -4.8779 {"}'M' -9.8585 1.2988 -5.4208 @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 27 A}'M' green -9.7949 1.0768 -4.4476 {"}'M' sea -9.9282 0.9732 -4.6471 {"}'M' sea -9.6091 1.1682 -4.2897 {"}'M' green -9.7133 1.3234 -4.4675 {"}'M' green -9.9836 1.1271 -4.9272 {"}'M' sea -9.448 1.4395 -4.3229 {"}'M' green -9.9553 1.2245 -5.1808 {"}'M' sea -9.2564 1.6162 -4.3868 {"}'M' green -9.3913 1.7111 -4.5877 {"}'M' green -9.8519 1.4527 -5.112 {"}'M' sea -9.2945 1.8458 -4.8431 {"}'M' green -9.4558 1.8066 -5.041 {"}'M' green -9.6124 1.6946 -5.2124 {"}'M' sea -9.751 1.5199 -5.3432 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 27 A}'M' greentint -9.8732 1.2265 -4.6469 {"}'M' greentint -9.5798 1.5412 -4.521 {"}'M' greentint -9.7408 1.5132 -4.721 {"}'M' greentint -9.8888 1.3612 -4.8699 {"}'M' greentint -9.5502 1.7142 -4.7936 {"}'M' greentint -9.7105 1.6232 -4.9764 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O CYS 140 A}'M' sky -10.1411 1.4192 -5.3373 @dotlist {x} color= red width= 1 master= {vdw contact} { O CYS 140 A}'M' sea -10.1957 1.0251 -4.7222 {"}'M' sea -10.0331 1.0808 -4.528 {"}'M' green -9.8753 1.191 -4.3546 {"}'M' sea -9.7299 1.3527 -4.2116 {"}'M' green -10.1214 1.1605 -4.9813 {"}'M' green -9.9622 1.1829 -4.7808 {"}'M' green -9.6558 1.4211 -4.4522 {"}'M' green -9.532 1.6208 -4.3475 {"}'M' green -10.0027 1.3424 -5.1358 {"}'M' green -9.4455 1.8433 -4.5552 {"}'M' green -9.8684 1.5502 -5.2116 {"}'M' green -9.5555 1.7332 -4.8581 {"}'M' sea -9.4602 1.9695 -4.8006 {"}'M' sea -9.7558 1.7801 -5.2468 {"}'M' green -9.5971 1.8774 -5.0691 @dotlist {x} color= red width= 1 master= {H-bonds} { O CYS 140 A}'M' greentint -9.8025 1.2715 -4.5998 {"}'M' greentint -9.8439 1.3534 -4.9349 {"}'M' greentint -9.6869 1.4493 -4.7575 {"}'M' greentint -9.5484 1.6198 -4.626 {"}'M' greentint -9.7053 1.5795 -5.0089 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 139 1qfmA_141Y_154}P -11.9982 -2.0083 0.6667 {"}-11.9982 -2.0083 0.6667 { ca phe A 139 1qfmA_141Y_154}-10.9491 -2.2299 -0.3198 { c phe A 139 1qfmA_141Y_154}-10.7539 -1.0591 -1.2652 { o phe A 139 1qfmA_141Y_154}-11.7161 -0.5563 -1.8338 { c phe A 139 1qfmA_141Y_154}P -10.7539 -1.0591 -1.2652 { n ala A 140 1qfmA_141Y_154}-9.5029 -0.6323 -1.4096 { ca ala A 140 1qfmA_141Y_154}-9.1393 0.4447 -2.3222 { c ala A 140 1qfmA_141Y_154}-8.2939 -0.197 -3.4109 { o ala A 140 1qfmA_141Y_154}-7.446 -1.043 -3.1372 { c ala A 140 1qfmA_141Y_154}P -8.2939 -0.197 -3.4109 { n tyr A 141 1qfmA_141Y_154}-8.5132 0.2112 -4.6497 { ca tyr A 141 1qfmA_141Y_154}-7.7475 -0.3482 -5.7533 { c tyr A 141 1qfmA_141Y_154}-7.4873 0.6733 -6.8424 { o tyr A 141 1qfmA_141Y_154}-8.3138 1.55 -7.099 { c tyr A 141 1qfmA_141Y_154}P -7.4873 0.6733 -6.8424 { n gly A 142 1qfmA_141Y_154}-6.3009 0.5991 -7.4238 { ca gly A 142 1qfmA_141Y_154}-5.9523 1.5093 -8.4863 { c gly A 142 1qfmA_141Y_154}-6.219 0.9025 -9.8504 { o gly A 142 1qfmA_141Y_154}-6.0782 -0.2989 -10.0382 { c gly A 142 1qfmA_141Y_154}P -6.219 0.9025 -9.8504 { n leu A 143 1qfmA_141Y_154}-6.6555 1.7336 -10.7888 { ca leu A 143 1qfmA_141Y_154}-6.8918 1.2968 -12.1586 { c leu A 143 1qfmA_141Y_154}-6.0735 2.1547 -13.114 { o leu A 143 1qfmA_141Y_154}-6.0699 3.3833 -13.0001 { n thr A 152 1qfmA_141Y_154}P -6.305 5.7449 -11.1006 {"}-6.305 5.7449 -11.1006 { ca thr A 152 1qfmA_141Y_154}-7.5563 6.2739 -10.5717 { c thr A 152 1qfmA_141Y_154}-7.859 5.267 -9.4653 { o thr A 152 1qfmA_141Y_154}-7.8963 4.0657 -9.7257 { c thr A 152 1qfmA_141Y_154}P -7.859 5.267 -9.4653 { n ile A 153 1qfmA_141Y_154}-7.9693 5.7358 -8.2227 { ca ile A 153 1qfmA_141Y_154}-8.2658 4.8378 -7.1106 { c ile A 153 1qfmA_141Y_154}-9.767 4.7811 -6.8665 { o ile A 153 1qfmA_141Y_154}-10.4336 5.8229 -6.7696 { c ile A 153 1qfmA_141Y_154}P -9.767 4.7811 -6.8665 { n lys A 154 1qfmA_141Y_154}-10.2868 3.5633 -6.8034 { ca lys A 154 1qfmA_141Y_154}-11.6994 3.3187 -6.5388 { c lys A 154 1qfmA_141Y_154}-11.8228 2.4834 -5.2659 { o lys A 154 1qfmA_141Y_154}-10.8246 1.9488 -4.7605 { c lys A 154 1qfmA_141Y_154}P -11.8228 2.4834 -5.2659 { n phe A 155 1qfmA_141Y_154}-13.0443 2.399 -4.7442 { ca phe A 155 1qfmA_141Y_154}-13.2941 1.7042 -3.4864 { c phe A 155 1qfmA_141Y_154}-14.4802 0.7543 -3.51 { o phe A 155 1qfmA_141Y_154}-15.4385 0.9532 -4.2431 { c phe A 155 1qfmA_141Y_154}P -14.4802 0.7543 -3.51 { n met A 156 1qfmA_141Y_154}-14.4252 -0.2476 -2.6422 { ca met A 156 1qfmA_141Y_154}-15.4761 -1.238 -2.5162 { c met A 156 1qfmA_141Y_154}-15.6181 -1.6931 -1.0821 { o met A 156 1qfmA_141Y_154}-14.6522 -1.6742 -0.3113 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 139 1qfmA_141Y_154}P -11.9982 -2.0083 0.6667 { ca phe A 139 1qfmA_141Y_154}P -10.9491 -2.2299 -0.3198 { n ala A 140 1qfmA_141Y_154}P -9.5029 -0.6323 -1.4096 { ca ala A 140 1qfmA_141Y_154}P -9.1393 0.4447 -2.3222 { n tyr A 141 1qfmA_141Y_154}P -8.5132 0.2112 -4.6497 { ca tyr A 141 1qfmA_141Y_154}P -7.7475 -0.3482 -5.7533 { n gly A 142 1qfmA_141Y_154}P -6.3009 0.5991 -7.4238 { ca gly A 142 1qfmA_141Y_154}P -5.9523 1.5093 -8.4863 {"}P -5.9523 1.5093 -8.4863 { n leu A 143 1qfmA_141Y_154}P -6.6555 1.7336 -10.7888 { ca leu A 143 1qfmA_141Y_154}P -6.8918 1.2968 -12.1586 { n thr A 152 1qfmA_141Y_154}P -6.305 5.7449 -11.1006 { ca thr A 152 1qfmA_141Y_154}P -7.5563 6.2739 -10.5717 { n ile A 153 1qfmA_141Y_154}P -7.9693 5.7358 -8.2227 { ca ile A 153 1qfmA_141Y_154}P -8.2658 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1qfmA_141Y_154}-15.4761 -1.238 -2.5162 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 141 1qfmA_141Y_154}P -7.7475 -0.3482 -5.7533 { cb tyr A 141 1qfmA_141Y_154}-8.4563 -1.5868 -6.3215 { cg tyr A 141 1qfmA_141Y_154}-9.8287 -1.3196 -6.9048 { cd1 tyr A 141 1qfmA_141Y_154}-10.0185 -1.2587 -8.2855 { ce1 tyr A 141 1qfmA_141Y_154}-11.2746 -1.0244 -8.8305 { cz tyr A 141 1qfmA_141Y_154}-12.3577 -0.8439 -7.9905 { oh tyr A 141 1qfmA_141Y_154}-13.5996 -0.608 -8.5369 { cg tyr A 141 1qfmA_141Y_154}P -9.8287 -1.3196 -6.9048 { cd2 tyr A 141 1qfmA_141Y_154}-10.9394 -1.136 -6.0793 { ce2 tyr A 141 1qfmA_141Y_154}-12.1956 -0.8991 -6.6148 { cz tyr A 141 1qfmA_141Y_154}ghost -12.3577 -0.8439 -7.9905 { ca lys A 154 1qfmA_141Y_154}P -11.6994 3.3187 -6.5388 { cb lys A 154 1qfmA_141Y_154}-12.3787 2.6577 -7.7418 { cg lys A 154 1qfmA_141Y_154}-12.474 3.6065 -8.9311 { cd lys A 154 1qfmA_141Y_154}-13.1838 3.0161 -10.1271 { ce lys A 154 1qfmA_141Y_154}-13.2172 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{"}'S' green -11.529 0.6888 -8.5764 {"}'S' green -11.6867 0.6757 -8.777 {"}'S' sea -11.0384 0.6396 -8.3425 {"}'S' sea -11.1852 0.7004 -8.5501 {"}'S' sea -11.3419 0.7234 -8.7575 { CE2 TYR 141 A}'S' sea -12.4097 0.7581 -7.1353 {"}'S' sea -12.0372 0.7768 -7.0935 {"}'S' sea -11.822 0.6988 -7.2225 { CZ TYR 141 A}'S' sea -12.5909 0.7387 -7.2811 {"}'S' sea -12.7388 0.7885 -7.4861 {"}'S' sea -12.8947 0.7941 -7.6902 {"}'S' green -12.3178 0.7763 -7.33 {"}'S' green -12.4602 0.8422 -7.5329 {"}'S' green -12.6121 0.8694 -7.7364 {"}'S' green -12.7698 0.8562 -7.9369 {"}'S' sea -12.9306 0.8037 -8.1294 {"}'S' green -11.9872 0.7217 -7.3014 {"}'S' green -12.5718 0.8134 -8.511 {"}'S' green -12.3625 0.7715 -8.663 {"}'S' green -11.3842 0.5943 -7.7776 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 141 A}'S' P -12.1216 0.8201 -7.5024 {"}'S' -12.1249 0.7975 -7.5087 {"}'S' P -12.2684 0.8809 -7.7101 {"}'S' -12.2723 0.8173 -7.7198 {"}'S' P -12.425 0.9039 -7.9175 {"}'S' -12.4224 0.8479 -7.9199 {"}'S' P -12.5866 0.8865 -8.1224 {"}'S' -12.5862 0.8859 -8.1217 {"}'S' P -11.8022 0.74 -7.497 {"}'S' -11.8049 0.7325 -7.499 {"}'S' P -11.9401 0.831 -7.6994 {"}'S' -11.9607 0.7475 -7.7137 {"}'S' P -12.0892 0.884 -7.9068 {"}'S' -12.1076 0.7631 -7.9129 {"}'S' P -12.2461 0.8983 -8.1142 {"}'S' -12.253 0.7969 -8.1073 {"}'S' P -12.4082 0.8749 -8.3168 {"}'S' -12.4071 0.842 -8.3112 {"}'S' P -11.5942 0.6932 -7.648 {"}'S' -11.5977 0.6872 -7.6498 {"}'S' P -11.7313 0.7841 -7.8511 {"}'S' -11.7623 0.7038 -7.858 {"}'S' P -11.8799 0.8379 -8.058 {"}'S' -11.9136 0.7196 -8.053 {"}'S' P -12.0376 0.8551 -8.2654 {"}'S' -12.0565 0.7529 -8.2492 {"}'S' P -12.1993 0.8321 -8.4692 {"}'S' -12.2027 0.7953 -8.4587 {"}'S' P -11.519 0.6919 -7.979 {"}'S' -11.5333 0.6657 -7.979 {"}'S' P -11.6666 0.7514 -8.1859 {"}'S' -11.6939 0.6875 -8.1778 {"}'S' P -11.8225 0.7729 -8.3935 {"}'S' -11.8408 0.7176 -8.3803 {"}'S' P -11.9841 0.7541 -8.5982 {"}'S' -11.985 0.7514 -8.5971 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 141 A}'S' blue -13.213 0.69 -8.1835 {"}'S' blue -13.3544 0.7617 -8.3863 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 154 A}'S' blue -13.1502 1.0892 -7.6573 {"}'S' sky -12.9982 1.0478 -7.4488 {"}'S' sky -12.8385 1.0449 -7.2417 {"}'S' sky -12.6756 1.0816 -7.0411 {"}'S' sky -12.512 1.1572 -6.8519 {"}'S' blue -12.3533 1.2691 -6.6776 {"}'S' blue -13.1381 1.1174 -8.0779 {"}'S' sky -12.3688 1.0449 -7.0628 {"}'S' sky -12.2084 1.1426 -6.883 {"}'S' blue -12.0529 1.2748 -6.7195 {"}'S' sky -12.9384 1.0771 -8.2417 {"}'S' sky -12.0093 1.0946 -7.0459 {"}'S' blue -11.8543 1.226 -6.8828 {"}'S' blue -12.8069 1.1508 -8.5214 { HB2 LYS 154 A}'S' sky -11.9171 1.0318 -7.1243 {"}'S' blue -11.4053 0.9617 -7.2837 {"}'S' sky -11.7341 1.0141 -8.9327 {"}'S' blue -11.0192 0.9036 -7.9783 {"}'S' blue -11.105 1.0884 -8.6794 @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 154 A}'S' sea -13.0005 1.0273 -7.8744 {"}'S' sea -12.8515 0.9743 -7.6671 {"}'S' sea -12.6938 0.9598 -7.4602 {"}'S' sea -12.5316 0.9833 -7.2576 {"}'S' green -12.8009 0.9853 -8.0397 {"}'S' green -12.6522 0.9315 -7.8328 { HB2 LYS 154 A}'S' green -12.6595 0.9513 -8.0608 {"}'S' green -12.226 0.8245 -7.465 {"}'S' green -12.5663 0.9173 -8.3409 {"}'S' green -11.8438 0.7954 -7.3734 {"}'S' sea -11.6945 0.9314 -7.2175 {"}'S' green -12.3986 0.8851 -8.547 {"}'S' green -12.1606 0.8298 -8.655 {"}'S' green -11.4381 0.7079 -7.6875 {"}'S' green -11.8676 0.7803 -8.674 {"}'S' green -11.4342 0.6534 -8.0782 {"}'S' sea -11.6304 0.8554 -8.7547 {"}'S' green -11.4955 0.7605 -8.5538 {"}'S' green -11.3397 0.7363 -8.3456 {"}'S' sea -11.1765 0.7852 -8.1491 {"}'S' sea -11.3933 0.9682 -8.7879 {"}'S' sea -11.2561 0.8932 -8.5885 {"}'S' sea -11.0998 0.904 -8.3892 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 LYS 154 A}'S' P -12.5307 0.8496 -7.8667 {"}'S' -12.5175 0.8667 -7.8696 {"}'S' P -12.3834 0.8066 -7.6641 {"}'S' -12.3664 0.8343 -7.6745 {"}'S' P -12.4509 0.7857 -8.1549 {"}'S' -12.4211 0.8311 -8.1501 {"}'S' P -12.3135 0.7042 -7.9554 {"}'S' -12.2711 0.7945 -7.9624 {"}'S' P -12.1616 0.6784 -7.7521 {"}'S' -12.1321 0.7697 -7.7753 {"}'S' P -12.0022 0.7089 -7.5548 {"}'S' -11.9942 0.7532 -7.5746 {"}'S' P -12.2899 0.7444 -8.3679 {"}'S' -12.2666 0.7945 -8.3509 {"}'S' P -12.1592 0.6501 -8.1729 {"}'S' -12.1254 0.7605 -8.1587 {"}'S' P -12.0118 0.6084 -7.9706 {"}'S' -11.9911 0.7353 -7.978 {"}'S' P -11.8563 0.6204 -7.7727 {"}'S' -11.8526 0.7107 -7.7933 {"}'S' P -11.6977 0.6849 -7.586 {"}'S' -11.6997 0.7024 -7.5927 {"}'S' P -12.0444 0.698 -8.4696 {"}'S' -12.0346 0.7453 -8.4499 {"}'S' P -11.9079 0.6166 -8.2695 {"}'S' -11.8997 0.713 -8.2496 {"}'S' P -11.7555 0.5917 -8.0658 {"}'S' -11.7604 0.6872 -8.0636 {"}'S' P -11.5961 0.6221 -7.8685 {"}'S' -11.6049 0.6678 -7.8757 {"}'S' P -11.7392 0.6795 -8.4788 {"}'S' -11.7406 0.6959 -8.4725 {"}'S' P -11.5919 0.6365 -8.2763 {"}'S' -11.597 0.6643 -8.2708 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 141 A}'M' greentint -9.4859 1.9425 -6.4427 {"}'M' greentint -9.6295 1.8347 -6.7151 {"}'M' greentint -9.2239 2.2637 -6.31 {"}'M' greentint -9.3872 2.2303 -6.5119 {"}'M' greentint -9.5358 2.0734 -6.6604 {"}'M' greentint -9.6395 1.9771 -6.9579 {"}'M' greentint -9.08 2.4689 -6.372 {"}'M' greentint -9.2379 2.4605 -6.574 {"}'M' greentint -9.3965 2.3673 -6.7525 {"}'M' greentint -9.5358 2.1994 -6.8856 {"}'M' greentint -9.6091 2.0711 -7.2027 {"}'M' greentint -9.6803 1.826 -7.2269 {"}'M' greentint -8.8948 2.6389 -6.438 {"}'M' greentint -9.051 2.6496 -6.6419 {"}'M' greentint -9.2112 2.5914 -6.8339 {"}'M' greentint -9.3659 2.4683 -6.9986 {"}'M' greentint -9.5017 2.2908 -7.1247 {"}'M' greentint -9.5312 2.1513 -7.4409 {"}'M' greentint -9.6124 1.9081 -7.4793 {"}'M' greentint -8.8077 2.793 -6.684 {"}'M' greentint -8.9682 2.7696 -6.886 {"}'M' greentint -9.1303 2.6874 -7.0717 {"}'M' greentint -9.2825 2.5515 -7.2316 {"}'M' greentint -9.4192 2.3699 -7.3564 {"}'M' greentint -9.4167 2.1961 -7.6706 {"}'M' greentint -8.8734 2.8324 -7.145 {"}'M' greentint -9.0292 2.7337 -7.3183 {"}'M' greentint -9.1753 2.5901 -7.4682 {"}'M' greentint -9.3061 2.4081 -7.5866 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 154 A}'M' greentint -9.5988 1.7416 -6.8912 {"}'M' greentint -9.4406 1.8053 -6.7049 {"}'M' greentint -9.2904 1.9297 -6.5451 {"}'M' greentint -9.1573 2.1053 -6.422 {"}'M' greentint -9.052 2.32 -6.3443 {"}'M' greentint -9.5482 1.8006 -7.2423 {"}'M' greentint -9.3901 1.8028 -7.0385 {"}'M' greentint -9.2294 1.8787 -6.8517 {"}'M' greentint -9.0799 2.0241 -6.6993 {"}'M' greentint -8.9553 2.2241 -6.5934 {"}'M' greentint -8.8667 2.4617 -6.5454 {"}'M' greentint -8.8222 2.7164 -6.5581 {"}'M' greentint -9.4451 1.9632 -7.4973 {"}'M' greentint -9.2964 1.9136 -7.2912 {"}'M' greentint -9.134 1.9585 -7.0933 {"}'M' greentint -8.9798 2.0911 -6.9315 {"}'M' greentint -8.8556 2.2945 -6.8269 {"}'M' greentint -8.7773 2.5401 -6.7948 {"}'M' greentint -8.7563 2.7955 -6.8381 {"}'M' greentint -9.3171 2.1988 -7.6598 {"}'M' greentint -9.1854 2.0971 -7.4616 {"}'M' greentint -9.0244 2.1251 -7.2617 {"}'M' greentint -8.8763 2.2771 -7.1128 {"}'M' greentint -8.7815 2.5112 -7.0555 {"}'M' greentint -8.7652 2.7649 -7.1048 {"}'M' greentint -9.1561 2.4701 -7.693 {"}'M' greentint -9.0519 2.3149 -7.5152 {"}'M' greentint -8.8919 2.4118 -7.3357 {"}'M' greentint -8.837 2.6651 -7.3355 {"}'M' greentint -8.9702 2.5615 -7.535 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 141 A}'M' greentint -9.9681 1.0702 -4.3069 {"}'M' greentint -10.1014 0.9666 -4.5064 {"}'M' greentint -9.8865 1.3168 -4.3268 {"}'M' greentint -10.0464 1.2199 -4.5062 {"}'M' greentint -10.1568 1.1205 -4.7865 {"}'M' greentint -10.1731 0.8668 -4.7372 {"}'M' greentint -9.753 1.5346 -4.3803 {"}'M' greentint -9.914 1.5066 -4.5803 {"}'M' greentint -10.062 1.3546 -4.7291 {"}'M' greentint -10.1285 1.2179 -5.0401 {"}'M' greentint -10.1789 0.9633 -5.0355 {"}'M' greentint -9.5646 1.7045 -4.4469 {"}'M' greentint -9.7234 1.7077 -4.6529 {"}'M' greentint -9.8837 1.6166 -4.8357 {"}'M' greentint -10.0251 1.4461 -4.9713 {"}'M' greentint -10.0317 1.2922 -5.2801 {"}'M' greentint -10.1 1.0432 -5.2978 {"}'M' greentint -9.4677 1.8392 -4.7024 {"}'M' greentint -9.629 1.8 -4.9003 {"}'M' greentint -9.7856 1.688 -5.0717 {"}'M' greentint -9.9242 1.5133 -5.2024 {"}'M' greentint -9.8863 1.3117 -5.4977 {"}'M' greentint -9.4977 1.8264 -5.137 {"}'M' greentint -9.6479 1.702 -5.2968 {"}'M' greentint -9.7811 1.5264 -5.4199 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 154 A}'M' greentint -10.0394 0.8273 -4.4685 {"}'M' greentint -9.8991 0.9893 -4.3325 {"}'M' greentint -9.7771 1.1859 -4.2295 {"}'M' greentint -10.0838 0.7667 -4.8725 {"}'M' greentint -9.926 0.8769 -4.699 {"}'M' greentint -9.7806 1.0387 -4.5561 {"}'M' greentint -9.656 1.2411 -4.4525 {"}'M' greentint -9.5595 1.4742 -4.3926 {"}'M' greentint 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-12.4519 0.6104 -6.2689 {"}'S' blue -13.2011 0.6953 -7.6882 {"}'S' sky -13.0001 0.6557 -7.8522 {"}'S' sky -12.7467 0.604 -7.9384 {"}'S' sky -12.4905 0.5969 -8.0207 { CG TYR 408 A}'S' blue -12.9112 0.765 -8.1368 {"}'S' blue -12.7665 0.68 -8.3553 {"}'S' blue -12.725 0.6517 -8.7278 {"}'S' sky -12.5677 0.6353 -8.5194 {"}'S' blue -12.6107 0.6769 -9.015 {"}'S' sky -12.4584 0.6361 -8.8077 { CD1 TYR 408 A}'S' sky -12.3163 0.5758 -9.2047 {"}'S' sky -11.5363 0.8296 -8.2665 {"}'S' sky -12.1939 0.4786 -9.4337 {"}'S' sky -11.2453 0.805 -8.2989 {"}'S' sky -12.0442 0.4167 -9.6508 {"}'S' sky -11.0966 0.6642 -8.4959 {"}'S' blue -11.8445 0.3747 -9.8161 {"}'S' sky -10.8979 0.6154 -8.6592 {"}'S' blue -10.7525 0.7785 -8.5165 {"}'S' sky -10.785 0.5323 -8.9183 {"}'S' sky -10.6338 0.6794 -8.7639 {"}'S' sky -11.0149 0.3467 -9.578 {"}'S' sky -10.8546 0.3971 -9.3858 {"}'S' blue -10.6965 0.4856 -9.2053 {"}'S' blue -10.5442 0.6098 -9.0425 { HB2 TYR 408 A}'S' sky -12.3557 0.4388 -6.4504 {"}'S' sky -12.1933 0.4879 -6.2532 {"}'S' blue -11.7962 0.4892 -6.1089 {"}'S' blue -11.5736 0.3889 -6.2022 {"}'S' sky -11.4238 0.2584 -6.4052 {"}'S' blue -11.2844 0.4191 -6.2683 {"}'S' sky -11.3172 0.1653 -6.6722 {"}'S' sky -11.1671 0.3012 -6.5169 {"}'S' sky -11.1551 0.1877 -6.8796 {"}'S' sky -11.0047 0.3191 -6.7211 {"}'S' blue -10.8719 0.4981 -6.5992 {"}'S' sky -10.8983 0.3611 -6.963 {"}'S' blue -10.7593 0.538 -6.8321 {"}'S' sky -10.8228 0.4568 -7.1994 {"}'S' sky -10.8205 0.5745 -7.4607 { HD1 TYR 408 A}'S' blue -10.5812 0.7899 -8.5823 {"}'S' blue -10.446 0.679 -8.8062 {"}'S' blue -10.291 0.7761 -8.6337 {"}'S' blue -10.3353 0.6389 -9.0815 {"}'S' blue -10.1771 0.7026 -8.8952 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 408 A}'S' sea -13.0901 0.5424 -7.0744 {"}'S' sea -12.9381 0.501 -6.8658 {"}'S' sea -13.078 0.5706 -7.4949 {"}'S' green -12.9404 0.4805 -7.2915 {"}'S' green -12.7913 0.4275 -7.0841 {"}'S' green -12.6336 0.413 -6.8773 {"}'S' green -12.8782 0.5303 -7.6587 {"}'S' green -12.7407 0.4385 -7.4567 {"}'S' green -12.5921 0.3847 -7.2498 {"}'S' green -12.62 0.4884 -7.7422 {"}'S' green -12.4779 0.41 -7.5369 {"}'S' sea -12.3622 0.4934 -7.825 {"}'S' sea -12.2773 0.6738 -8.1569 {"}'S' green -12.1504 0.5651 -7.962 {"}'S' sea -11.9097 0.6511 -8.0338 { CG TYR 408 A}'S' sea -12.4056 0.6574 -8.3166 {"}'S' sea -12.299 0.6354 -8.5999 {"}'S' sea -12.1352 0.6734 -8.4001 {"}'S' sea -11.9724 0.7492 -8.2103 { CD1 TYR 408 A}'S' green -12.1644 0.5486 -9.0011 {"}'S' green -12.0068 0.5617 -8.8006 {"}'S' green -11.8472 0.6136 -8.608 {"}'S' sea -11.6887 0.704 -8.429 {"}'S' green -12.0419 0.4373 -9.2252 {"}'S' green -11.8822 0.4343 -9.0181 {"}'S' green -11.5557 0.5467 -8.6283 {"}'S' sea -11.397 0.6585 -8.454 {"}'S' green -11.8951 0.3637 -9.4435 {"}'S' green -11.7374 0.3493 -9.2366 {"}'S' green -11.2521 0.532 -8.6594 {"}'S' sea -11.6959 0.3209 -9.6092 {"}'S' green -11.5386 0.3046 -9.4008 {"}'S' green -11.3765 0.3267 -9.1979 {"}'S' green -11.2142 0.3875 -9.0036 {"}'S' green -11.0529 0.484 -8.8223 {"}'S' sea -11.4293 0.3054 -9.689 {"}'S' sea -11.2699 0.3047 -9.4812 {"}'S' green -11.1062 0.3427 -9.2815 {"}'S' sea -10.9434 0.4185 -9.0917 { HB2 TYR 408 A}'S' green -12.4098 0.3071 -6.8513 {"}'S' green -12.2625 0.264 -6.6488 {"}'S' green -12.1051 0.2819 -6.4497 {"}'S' sea -11.947 0.3587 -6.2665 {"}'S' green -12.0407 0.1359 -6.7367 {"}'S' green -11.8813 0.1664 -6.5395 {"}'S' sea -11.7229 0.2529 -6.3581 {"}'S' green -12.2778 0.3426 -7.5317 {"}'S' green -11.7354 0.0778 -6.7574 {"}'S' sea -11.5768 0.1423 -6.5706 {"}'S' green -12.1274 0.4634 -7.8031 {"}'S' green -11.6346 0.0491 -7.0504 {"}'S' sea -11.4752 0.0796 -6.8532 {"}'S' green -11.9204 0.5869 -7.9791 {"}'S' green -11.471 0.0939 -7.2609 {"}'S' sea -11.3129 0.1117 -7.0625 {"}'S' sea -11.6776 0.6805 -8.06 {"}'S' green -11.6132 0.4716 -7.9173 {"}'S' green -11.2188 0.1938 -7.3303 {"}'S' sea -11.0556 0.2427 -7.1337 {"}'S' sea -11.375 0.5785 -7.9477 {"}'S' green -11.2724 0.4257 -7.7726 {"}'S' green -11.1352 0.3507 -7.5731 {"}'S' sea -10.9789 0.3615 -7.3739 {"}'S' sea -10.9841 0.5458 -7.664 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD1 TYR 408 A}'S' P -11.7192 0.471 -8.8175 {"}'S' -11.7178 0.4783 -8.8207 {"}'S' P -11.5753 0.3727 -9.0341 {"}'S' -11.5735 0.3925 -9.0396 {"}'S' P -11.4125 0.4343 -8.8393 {"}'S' -11.4123 0.4395 -8.842 { HB2 TYR 408 A}'S' P -12.33 0.2432 -7.1395 {"}'S' -12.308 0.2757 -7.1357 {"}'S' P -12.1927 0.1617 -6.94 {"}'S' -12.1782 0.1917 -6.9426 {"}'S' P -12.169 0.2019 -7.3526 {"}'S' -12.1493 0.2443 -7.3388 {"}'S' P -12.0383 0.1075 -7.1575 {"}'S' -12.0221 0.1595 -7.1507 {"}'S' P -11.891 0.0659 -6.9552 {"}'S' -11.8888 0.0815 -6.9559 {"}'S' P -12.0397 0.2872 -7.6397 {"}'S' -12.0369 0.2937 -7.6357 {"}'S' P -11.9235 0.1555 -7.4542 {"}'S' -11.9194 0.1756 -7.4464 {"}'S' P -11.787 0.0741 -7.2542 {"}'S' -11.786 0.0897 -7.2512 {"}'S' P -11.8493 0.3905 -7.8337 {"}'S' -11.8485 0.3985 -7.8258 {"}'S' P -11.7468 0.2378 -7.6586 {"}'S' -11.745 0.2755 -7.634 {"}'S' P -11.6183 0.137 -7.4635 {"}'S' -11.6207 0.1674 -7.4515 {"}'S' P -11.5095 0.3128 -7.7394 {"}'S' -11.512 0.3281 -7.7275 {"}'S' P -11.3746 0.218 -7.5385 {"}'S' -11.3741 0.2188 -7.5381 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 396 A}'M' greentint -9.5886 1.9522 -6.4451 {"}'M' greentint -9.7322 1.8444 -6.7176 {"}'M' greentint -9.3266 2.2734 -6.3125 {"}'M' greentint -9.4899 2.24 -6.5143 {"}'M' greentint -9.6385 2.0831 -6.6628 {"}'M' greentint -9.7422 1.9868 -6.9603 {"}'M' greentint -9.1827 2.4786 -6.3745 {"}'M' greentint -9.3406 2.4702 -6.5765 {"}'M' greentint -9.4992 2.377 -6.7549 {"}'M' greentint -9.6385 2.2091 -6.8881 {"}'M' greentint -9.7118 2.0808 -7.2051 {"}'M' greentint -9.783 1.8357 -7.2293 {"}'M' greentint -8.9975 2.6486 -6.4405 {"}'M' greentint -9.1537 2.6593 -6.6444 {"}'M' greentint -9.3138 2.6011 -6.8363 {"}'M' greentint -9.4686 2.478 -7.001 {"}'M' greentint -9.6044 2.3005 -7.1272 {"}'M' greentint -9.6339 2.161 -7.4433 {"}'M' greentint -9.7151 1.9178 -7.4817 {"}'M' greentint -8.9104 2.8027 -6.6864 {"}'M' greentint -9.0705 2.7787 -6.8878 {"}'M' greentint -9.233 2.6971 -7.0741 {"}'M' greentint -9.3852 2.5612 -7.2341 {"}'M' greentint -9.5219 2.3796 -7.3589 {"}'M' greentint -9.5194 2.2058 -7.673 {"}'M' greentint -8.8169 2.8933 -6.9552 {"}'M' greentint -8.9761 2.8421 -7.1474 {"}'M' greentint -9.1319 2.7434 -7.3207 {"}'M' greentint -9.278 2.5998 -7.4706 {"}'M' greentint -9.4088 2.4178 -7.5891 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 408 A}'M' greentint -9.6118 1.9025 -6.4604 {"}'M' greentint -9.656 1.7652 -6.9082 {"}'M' greentint -9.4978 1.8289 -6.7219 {"}'M' greentint -9.3476 1.9534 -6.562 {"}'M' greentint -9.2145 2.129 -6.4389 {"}'M' greentint -9.1092 2.3436 -6.3612 {"}'M' greentint -9.6054 1.8242 -7.2592 {"}'M' greentint -9.4473 1.8264 -7.0555 {"}'M' greentint -9.2866 1.9024 -6.8686 {"}'M' greentint -9.1371 2.0478 -6.7162 {"}'M' greentint -9.0125 2.2477 -6.6104 {"}'M' greentint -8.9239 2.4853 -6.5623 {"}'M' greentint -8.8794 2.7401 -6.575 {"}'M' greentint -9.5023 1.9869 -7.5142 {"}'M' greentint -9.3536 1.9373 -7.3081 {"}'M' greentint -9.1912 1.9822 -7.1102 {"}'M' greentint -9.037 2.1148 -6.9485 {"}'M' greentint -8.9128 2.3181 -6.8439 {"}'M' greentint -8.8345 2.5638 -6.8117 {"}'M' greentint -8.8135 2.8192 -6.855 {"}'M' greentint -9.3743 2.2225 -7.6767 {"}'M' greentint -9.2426 2.1207 -7.4786 {"}'M' greentint -9.0816 2.1488 -7.2786 {"}'M' greentint -8.9335 2.3007 -7.1297 {"}'M' greentint -8.8387 2.5349 -7.0724 {"}'M' greentint -8.8224 2.7886 -7.1217 {"}'M' greentint -9.2133 2.4937 -7.7099 {"}'M' greentint -9.1091 2.3386 -7.5321 {"}'M' greentint -8.9491 2.4355 -7.3527 {"}'M' greentint -8.8941 2.6888 -7.3525 {"}'M' greentint -9.0274 2.5851 -7.5519 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 396 A}'M' green -9.9606 1.1304 -4.3719 {"}'M' green -10.0939 1.0268 -4.5714 {"}'M' green -9.7748 1.2218 -4.214 {"}'M' green -10.1493 1.1807 -4.8515 {"}'M' green -10.121 1.2782 -5.1051 {"}'M' green -9.4222 1.6699 -4.3111 {"}'M' green -9.3085 1.8639 -4.5623 {"}'M' green -9.9167 1.5735 -5.2675 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 396 A}'M' greentint -9.879 1.377 -4.3918 {"}'M' greentint -10.0389 1.2801 -4.5712 {"}'M' greentint -9.6137 1.4931 -4.2472 {"}'M' greentint -9.7455 1.5949 -4.4453 {"}'M' greentint -9.9065 1.5668 -4.6453 {"}'M' greentint -10.0545 1.4148 -4.7942 {"}'M' greentint -9.5571 1.7647 -4.512 {"}'M' greentint -9.7159 1.7679 -4.7179 {"}'M' greentint -9.8762 1.6768 -4.9007 {"}'M' greentint -10.0176 1.5063 -5.0363 {"}'M' greentint -9.4602 1.8994 -4.7674 {"}'M' greentint -9.6215 1.8603 -4.9653 {"}'M' greentint -9.7781 1.7482 -5.1367 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 408 A}'M' green -10.0445 1.1506 -4.24 {"}'M' green -10.2569 1.1596 -4.8809 {"}'M' green -9.6339 1.4826 -4.1647 {"}'M' green -10.1733 1.3374 -5.1388 {"}'M' green -9.436 1.7507 -4.3006 {"}'M' green -10.0451 1.5491 -5.2904 {"}'M' green -9.3495 1.9732 -4.5082 {"}'M' green -9.6598 1.91 -5.1998 {"}'M' green -9.501 2.0073 -5.0222 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 408 A}'M' greentint -10.0997 1.155 -4.6753 {"}'M' greentint -9.9371 1.2107 -4.4811 {"}'M' greentint -9.7793 1.3209 -4.3077 {"}'M' greentint -10.0254 1.2903 -4.9344 {"}'M' greentint -9.8662 1.3128 -4.7339 {"}'M' greentint -9.7064 1.4014 -4.5529 {"}'M' greentint -9.5597 1.551 -4.4053 {"}'M' greentint -9.9067 1.4723 -5.0889 {"}'M' greentint -9.7479 1.4833 -4.888 {"}'M' greentint -9.5909 1.5792 -4.7106 {"}'M' greentint -9.4524 1.7497 -4.5791 {"}'M' greentint -9.7724 1.6801 -5.1646 {"}'M' greentint -9.6093 1.7094 -4.962 {"}'M' greentint -9.4595 1.8631 -4.8112 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 420 1qhoA_422Y_433}P -11.7867 -2.0342 0.4969 {"}-11.7867 -2.0342 0.4969 { ca tyr A 420 1qhoA_422Y_433}-10.9004 -2.3246 -0.6195 { c tyr A 420 1qhoA_422Y_433}-10.7105 -1.0446 -1.4332 { o tyr A 420 1qhoA_422Y_433}-11.6808 -0.4867 -1.9519 { c tyr A 420 1qhoA_422Y_433}P -10.7105 -1.0446 -1.4332 { n ile A 421 1qhoA_422Y_433}-9.4837 -0.5229 -1.4066 { ca ile A 421 1qhoA_422Y_433}-9.1664 0.6454 -2.2358 { c ile A 421 1qhoA_422Y_433}-8.1684 0.1387 -3.2801 { o ile A 421 1qhoA_422Y_433}-7.1152 -0.3843 -2.9259 { c ile A 421 1qhoA_422Y_433}P -8.1684 0.1387 -3.2801 { n tyr A 422 1qhoA_422Y_433}-8.5809 0.1668 -4.556 { ca tyr A 422 1qhoA_422Y_433}-7.719 -0.3423 -5.6183 { c tyr A 422 1qhoA_422Y_433}-7.5898 0.7126 -6.7147 { o tyr A 422 1qhoA_422Y_433}-8.4081 1.6323 -6.8109 { c tyr A 422 1qhoA_422Y_433}P -7.5898 0.7126 -6.7147 { n glu A 423 1qhoA_422Y_433}-6.563 0.5459 -7.5357 { ca glu A 423 1qhoA_422Y_433}-6.274 1.5406 -8.5606 { c glu A 423 1qhoA_422Y_433}-6.0979 0.928 -9.9368 { o glu A 423 1qhoA_422Y_433}-5.3987 -0.0792 -10.0705 { c glu A 423 1qhoA_422Y_433}P -6.0979 0.928 -9.9368 { n arg A 424 1qhoA_422Y_433}-6.7732 1.5101 -10.9192 { ca arg A 424 1qhoA_422Y_433}-6.6089 1.0927 -12.3081 { c arg A 424 1qhoA_422Y_433}-5.6647 2.1096 -12.962 { o arg A 424 1qhoA_422Y_433}-5.8273 3.2923 -12.6631 { n val A 431 1qhoA_422Y_433}P -7.5346 5.6502 -12.1717 {"}-7.5346 5.6502 -12.1717 { ca val A 431 1qhoA_422Y_433}-8.8151 5.7014 -11.4711 { c val A 431 1qhoA_422Y_433}-8.5973 5.01 -10.1202 { o val A 431 1qhoA_422Y_433}-8.1208 3.8805 -10.1083 { c val A 431 1qhoA_422Y_433}P -8.5973 5.01 -10.1202 { n leu A 432 1qhoA_422Y_433}-8.8103 5.7354 -9.0287 { ca leu A 432 1qhoA_422Y_433}-8.6598 5.1634 -7.6807 { c leu A 432 1qhoA_422Y_433}-10.0585 4.9532 -7.1128 { o leu A 432 1qhoA_422Y_433}-10.8909 5.8666 -7.1381 { c leu A 432 1qhoA_422Y_433}P -10.0585 4.9532 -7.1128 { n val A 433 1qhoA_422Y_433}-10.3664 3.7254 -6.6894 { ca val A 433 1qhoA_422Y_433}-11.7116 3.3808 -6.2381 { c val A 433 1qhoA_422Y_433}-11.6868 2.9068 -4.7904 { o val A 433 1qhoA_422Y_433}-10.9157 1.9929 -4.5105 { c val A 433 1qhoA_422Y_433}P -11.6868 2.9068 -4.7904 { n ala A 434 1qhoA_422Y_433}-12.4917 3.5105 -3.9196 { ca ala A 434 1qhoA_422Y_433}-12.5771 3.0464 -2.5395 { c ala A 434 1qhoA_422Y_433}-13.9695 2.4768 -2.2773 { o ala A 434 1qhoA_422Y_433}-14.9791 3.1087 -2.5967 { c ala A 434 1qhoA_422Y_433}P -13.9695 2.4768 -2.2773 { n ile A 435 1qhoA_422Y_433}-14.0166 1.2769 -1.7037 { ca ile A 435 1qhoA_422Y_433}-15.2736 0.6125 -1.3888 { c ile A 435 1qhoA_422Y_433}-15.236 0.1109 0.052 { o ile A 435 1qhoA_422Y_433}-14.332 -0.635 0.4223 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 420 1qhoA_422Y_433}P -11.7867 -2.0342 0.4969 { ca tyr A 420 1qhoA_422Y_433}P -10.9004 -2.3246 -0.6195 { n ile A 421 1qhoA_422Y_433}P -9.4837 -0.5229 -1.4066 { ca ile A 421 1qhoA_422Y_433}P -9.1664 0.6454 -2.2358 { n tyr A 422 1qhoA_422Y_433}P -8.5809 0.1668 -4.556 { ca tyr A 422 1qhoA_422Y_433}P -7.719 -0.3423 -5.6183 { n glu A 423 1qhoA_422Y_433}P -6.563 0.5459 -7.5357 { ca glu A 423 1qhoA_422Y_433}P -6.274 1.5406 -8.5606 { n arg A 424 1qhoA_422Y_433}P -6.7732 1.5101 -10.9192 { ca arg A 424 1qhoA_422Y_433}P -6.6089 1.0927 -12.3081 { n val A 431 1qhoA_422Y_433}P -7.5346 5.6502 -12.1717 { ca val A 431 1qhoA_422Y_433}P -8.8151 5.7014 -11.4711 { n leu A 432 1qhoA_422Y_433}P -8.8103 5.7354 -9.0287 { ca leu A 432 1qhoA_422Y_433}P -8.6598 5.1634 -7.6807 { n val A 433 1qhoA_422Y_433}P -10.3664 3.7254 -6.6894 { ca val A 433 1qhoA_422Y_433}P -11.7116 3.3808 -6.2381 { n ala A 434 1qhoA_422Y_433}P -12.4917 3.5105 -3.9196 { ca ala A 434 1qhoA_422Y_433}P -12.5771 3.0464 -2.5395 { n ile A 435 1qhoA_422Y_433}P -14.0166 1.2769 -1.7037 { ca ile A 435 1qhoA_422Y_433}P -15.2736 0.6125 -1.3888 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 420 1qhoA_422Y_433}P -10.9004 -2.3246 -0.6195 {"}-10.9004 -2.3246 -0.6195 { ca ile A 421 1qhoA_422Y_433}-9.1664 0.6454 -2.2358 { ca tyr A 422 1qhoA_422Y_433}-7.719 -0.3423 -5.6183 { ca glu A 423 1qhoA_422Y_433}-6.274 1.5406 -8.5606 { ca arg A 424 1qhoA_422Y_433}-6.6089 1.0927 -12.3081 { ca val A 431 1qhoA_422Y_433}P -8.8151 5.7014 -11.4711 {"}-8.8151 5.7014 -11.4711 { ca leu A 432 1qhoA_422Y_433}-8.6598 5.1634 -7.6807 { ca val A 433 1qhoA_422Y_433}-11.7116 3.3808 -6.2381 { ca ala A 434 1qhoA_422Y_433}-12.5771 3.0464 -2.5395 { ca ile A 435 1qhoA_422Y_433}-15.2736 0.6125 -1.3888 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 422 1qhoA_422Y_433}P -7.719 -0.3423 -5.6183 { cb tyr A 422 1qhoA_422Y_433}-8.2358 -1.6691 -6.1859 { cg tyr A 422 1qhoA_422Y_433}-9.6653 -1.6145 -6.6877 { cd1 tyr A 422 1qhoA_422Y_433}-10.7077 -1.8832 -5.8108 { ce1 tyr A 422 1qhoA_422Y_433}-12.0322 -1.8364 -6.227 { cz tyr A 422 1qhoA_422Y_433}-12.3058 -1.5238 -7.5422 { oh tyr A 422 1qhoA_422Y_433}-13.6095 -1.4843 -7.9711 { cg tyr A 422 1qhoA_422Y_433}P -9.6653 -1.6145 -6.6877 { cd2 tyr A 422 1qhoA_422Y_433}-9.9685 -1.2937 -8.0058 { ce2 tyr A 422 1qhoA_422Y_433}-11.2858 -1.2527 -8.44 { cz tyr A 422 1qhoA_422Y_433}ghost -12.3058 -1.5238 -7.5422 { ca val A 433 1qhoA_422Y_433}P -11.7116 3.3808 -6.2381 { cb val A 433 1qhoA_422Y_433}-12.2896 2.2294 -7.0985 { cg1 val A 433 1qhoA_422Y_433}-13.6958 1.838 -6.6378 { cb val A 433 1qhoA_422Y_433}P -12.2896 2.2294 -7.0985 { cg2 val A 433 1qhoA_422Y_433}-12.3254 2.6056 -8.5815 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 422 1qhoA_422Y_433}P -8.2358 -1.6691 -6.1859 {"}P -8.2358 -1.6691 -6.1859 { cd1 tyr A 422 1qhoA_422Y_433}P -10.7077 -1.8832 -5.8108 { cd2 tyr A 422 1qhoA_422Y_433}P -9.9685 -1.2937 -8.0058 { ce1 tyr A 422 1qhoA_422Y_433}P -12.0322 -1.8364 -6.227 { ce2 tyr A 422 1qhoA_422Y_433}P -11.2858 -1.2527 -8.44 { oh tyr A 422 1qhoA_422Y_433}P -13.6095 -1.4843 -7.9711 { cb val A 433 1qhoA_422Y_433}P -12.2896 2.2294 -7.0985 { cg1 val A 433 1qhoA_422Y_433}P -13.6958 1.838 -6.6378 {"}P -13.6958 1.838 -6.6378 {"}P -13.6958 1.838 -6.6378 { cg2 val A 433 1qhoA_422Y_433}P -12.3254 2.6056 -8.5815 {"}P -12.3254 2.6056 -8.5815 {"}P -12.3254 2.6056 -8.5815 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 422 A}'S' blue -10.8863 -0.0878 -7.1311 {"}'S' blue -10.6864 0.0765 -7.1876 {"}'S' blue -10.8406 0.0941 -7.3922 {"}'S' blue -10.6063 0.2373 -7.4481 {"}'S' blue -10.7673 0.2224 -7.6511 { CE1 TYR 422 A}'S' blue -11.9205 -0.0942 -6.3507 {"}'S' blue -11.712 -0.1374 -6.5019 {"}'S' blue -11.4969 -0.2196 -6.63 { CE2 TYR 422 A}'S' sky -11.9236 0.2784 -7.8823 {"}'S' blue -12.0846 0.2635 -8.0853 {"}'S' sky -11.1683 -0.0533 -7.1707 {"}'S' blue -11.8228 0.3853 -8.1397 {"}'S' sky -11.0052 0.1268 -7.4007 {"}'S' blue -11.5402 0.4605 -8.1859 {"}'S' sky -10.9153 0.3129 -7.7509 {"}'S' sky -11.0496 0.4113 -7.9519 {"}'S' blue -11.1964 0.4721 -8.1596 { CZ TYR 422 A}'S' blue -13.3812 -0.3179 -6.871 {"}'S' sky -13.542 -0.3821 -7.0606 {"}'S' blue -13.0236 -0.1536 -6.7239 {"}'S' sky -13.1779 -0.1359 -6.9285 {"}'S' sky -12.7906 -0.0269 -6.776 {"}'S' sky -12.9436 0.0073 -6.9844 {"}'S' blue -12.5389 0.0588 -6.8327 {"}'S' sky -12.6868 0.1086 -7.0377 {"}'S' sky -12.8427 0.1142 -7.2418 {"}'S' sky -13.0031 0.0779 -7.4391 {"}'S' sky -13.319 -0.1191 -7.7916 {"}'S' sky -12.1379 -0.0066 -6.6866 {"}'S' sky -12.2658 0.0964 -6.8816 {"}'S' sky -12.4083 0.1622 -7.0845 {"}'S' sky -12.5602 0.1894 -7.2881 {"}'S' blue -12.7178 0.1763 -7.4886 {"}'S' blue -12.8787 0.1237 -7.681 {"}'S' blue -13.0359 0.034 -7.8601 {"}'S' sky -11.8166 -0.0919 -6.6621 {"}'S' sky -12.373 0.224 -7.4691 {"}'S' blue -12.5346 0.2065 -7.674 {"}'S' sky -11.6279 -0.0646 -6.8547 {"}'S' sky -12.1941 0.2184 -7.6659 {"}'S' blue -12.3562 0.1949 -7.8684 {"}'S' sky -11.42 -0.1131 -7.0072 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 422 A}'S' sea -11.5084 0.037 -7.2786 {"}'S' green -11.6307 0.1633 -7.471 {"}'S' sea -11.7706 0.2442 -7.6739 {"}'S' sea -11.266 0.1106 -7.3433 {"}'S' green -11.3835 0.2397 -7.5317 {"}'S' green -11.5189 0.3299 -7.7306 {"}'S' sea -11.6669 0.3797 -7.9356 {"}'S' sea -11.1179 0.2645 -7.5845 {"}'S' sea -11.2458 0.3675 -7.7795 {"}'S' sea -11.3883 0.4334 -7.9823 { CZ TYR 422 A}'S' sea -13.3392 -0.1737 -7.1267 {"}'S' sea -13.1046 -0.0077 -7.1874 {"}'S' sea -13.2674 -0.0703 -7.3803 {"}'S' sea -13.1638 -0.0005 -7.6238 {"}'S' sea -11.9353 0.0418 -6.8531 {"}'S' green -12.0696 0.1402 -7.0541 {"}'S' sea -12.2164 0.201 -7.2617 {"}'S' green -11.7502 0.06 -7.0486 {"}'S' green -11.8881 0.151 -7.2511 {"}'S' sea -12.0372 0.204 -7.4584 {"}'S' sea -11.5422 0.0132 -7.1997 {"}'S' sea -11.6793 0.1041 -7.4027 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 422 A}'S' sky -14.0515 -0.4737 -7.1089 {"}'S' sky -14.1906 -0.3954 -7.3101 {"}'S' sky -14.3467 -0.3847 -7.514 {"}'S' sky -13.8156 -0.3707 -7.1485 {"}'S' sky -14.1691 -0.2019 -8.0171 {"}'S' sky -13.3644 -0.1146 -7.8206 {"}'S' sky -13.5176 -0.0884 -8.0257 { HH TYR 422 A}'S' sky -14.0565 -0.0856 -8.3066 {"}'S' sky -13.6797 -0.0955 -8.1602 {"}'S' sky -13.8079 0.0136 -8.3569 {"}'S' blue -13.5372 0.0343 -8.4119 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 422 A}'S' green -13.9506 -0.2772 -7.3491 {"}'S' green -14.1035 -0.2413 -7.5561 {"}'S' sea -14.264 -0.2647 -7.7581 {"}'S' sea -13.5797 -0.2976 -7.2288 {"}'S' green -13.7094 -0.2003 -7.4233 {"}'S' green -13.8548 -0.1499 -7.6249 {"}'S' green -14.01 -0.1508 -7.8249 {"}'S' green -13.5432 -0.1285 -7.6278 {"}'S' green -13.6941 -0.0942 -7.8315 {"}'S' sea -13.8521 -0.1067 -8.0327 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 433 A}'S' blue -12.7118 0.557 -7.3963 {"}'S' sky -12.5632 0.5033 -7.1895 {"}'S' sky -12.4059 0.4869 -6.981 {"}'S' blue -12.591 0.6069 -7.6818 {"}'S' sky -12.4489 0.5285 -7.4766 {"}'S' blue -12.3332 0.6119 -7.7647 {"}'S' blue -12.1214 0.6836 -7.9017 {"}'S' blue -11.8807 0.7696 -7.9734 { CG1 VAL 433 A}'S' blue -13.2884 0.1376 -6.6977 {"}'S' blue -13.128 0.188 -6.5054 {"}'S' sky -13.2325 0.1979 -7.0332 {"}'S' sky -13.0739 0.214 -6.8321 {"}'S' sky -12.9125 0.2729 -6.6403 {"}'S' sky -13.1405 0.3194 -7.3061 {"}'S' sky -12.9827 0.3077 -7.0997 {"}'S' sky -12.8206 0.3457 -6.9004 {"}'S' blue -12.6593 0.4308 -6.7147 {"}'S' blue -13.047 0.4936 -7.5513 {"}'S' sky -12.8968 0.4516 -7.3466 {"}'S' sky -12.7383 0.4635 -7.1447 { HB VAL 433 A}'S' blue -12.3363 0.4567 -6.7987 {"}'S' sky -11.9672 0.2855 -6.6841 {"}'S' blue -11.8078 0.316 -6.4868 {"}'S' sky -12.2042 0.4922 -7.479 {"}'S' sky -11.6619 0.2275 -6.7047 {"}'S' blue -11.5033 0.292 -6.518 {"}'S' blue -12.0538 0.613 -7.7504 {"}'S' blue -11.4017 0.2292 -6.8005 {"}'S' blue -11.8469 0.7365 -7.9264 {"}'S' sky -11.2393 0.2613 -7.0098 {"}'S' blue -10.982 0.3923 -7.0811 {"}'S' sky -11.3014 0.7281 -7.895 {"}'S' blue -10.9054 0.5111 -7.3212 {HG11 VAL 433 A}'S' sky -14.4207 -0.0879 -7.4061 {"}'S' sky -14.2734 -0.1296 -7.2038 {"}'S' sky -14.1179 -0.1176 -7.0059 {"}'S' blue -14.4222 0.0918 -7.8882 {"}'S' blue -13.6997 -0.0301 -6.9207 {"}'S' blue -14.2318 0.1951 -8.0823 {"}'S' sky -13.3872 0.1237 -6.9696 {"}'S' sky -13.9956 0.2761 -8.1659 {"}'S' blue -13.7574 0.383 -8.1962 {"}'S' sky -13.6548 0.2303 -8.0211 {"}'S' sky -13.2052 0.2614 -7.4479 {"}'S' blue -13.203 0.379 -7.7093 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 433 A}'S' sea -12.2565 0.3928 -7.0869 {"}'S' sea -12.1191 0.3113 -6.8874 {"}'S' sea -12.0954 0.3515 -7.2999 {"}'S' green -11.9647 0.2572 -7.1049 {"}'S' sea -11.8174 0.2155 -6.9026 {"}'S' sea -11.9662 0.4369 -7.587 {"}'S' green -11.85 0.3051 -7.4016 {"}'S' green -11.7134 0.2237 -7.2015 {"}'S' sea -11.561 0.1988 -6.9978 {"}'S' sea -11.7758 0.5402 -7.7811 {"}'S' green -11.6732 0.3874 -7.606 {"}'S' green -11.5448 0.2866 -7.4108 {"}'S' sea -11.3975 0.2436 -7.2083 {"}'S' sea -11.5396 0.6212 -7.8647 {"}'S' green -11.436 0.4625 -7.6867 {"}'S' green -11.3011 0.3676 -7.4858 {"}'S' sea -11.1453 0.3434 -7.2776 {"}'S' sea -11.1989 0.5753 -7.7199 {"}'S' sea -11.0617 0.5003 -7.5205 {HG11 VAL 433 A}'S' sea -14.306 -0.04 -7.7028 {"}'S' green -14.1694 -0.1213 -7.5027 {"}'S' sea -14.017 -0.1463 -7.299 {"}'S' sea -13.8577 -0.1159 -7.1017 {"}'S' sea -14.1292 0.0423 -7.9072 {"}'S' green -14.0008 -0.0585 -7.712 {"}'S' green -13.8535 -0.1015 -7.5095 {"}'S' sea -13.6953 -0.0837 -7.311 {"}'S' sea -13.5376 -0.0077 -7.1282 {"}'S' sea -13.892 0.1174 -7.9879 {"}'S' green -13.7571 0.0226 -7.787 {"}'S' green -13.6013 -0.0017 -7.5789 {"}'S' sea -13.438 0.0473 -7.3823 {"}'S' sea -13.2808 0.1657 -7.2115 {"}'S' sea -13.5177 0.1552 -7.8217 {"}'S' sea -13.3614 0.166 -7.6224 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 422 A}'M' greentint -9.3182 2.346 -6.0219 {"}'M' greentint -9.4815 2.3126 -6.2238 {"}'M' greentint -9.6301 2.1557 -6.3723 {"}'M' greentint -9.7338 2.0594 -6.6698 {"}'M' greentint -9.1743 2.5512 -6.0839 {"}'M' greentint -9.3322 2.5428 -6.286 {"}'M' greentint -9.4908 2.4496 -6.4644 {"}'M' greentint -9.6301 2.2817 -6.5975 {"}'M' greentint -9.7034 2.1534 -6.9146 {"}'M' greentint -8.9891 2.7212 -6.1499 {"}'M' greentint -9.1453 2.7319 -6.3538 {"}'M' greentint -9.3055 2.6737 -6.5458 {"}'M' greentint -9.4602 2.5506 -6.7105 {"}'M' greentint -9.596 2.373 -6.8366 {"}'M' greentint -9.6255 2.2336 -7.1528 {"}'M' greentint -8.902 2.8753 -6.3959 {"}'M' greentint -9.0625 2.8519 -6.5979 {"}'M' greentint -9.2246 2.7697 -6.7836 {"}'M' greentint -9.3768 2.6338 -6.9435 {"}'M' greentint -9.5135 2.4522 -7.0683 {"}'M' greentint -8.8085 2.9658 -6.6647 {"}'M' greentint -8.9677 2.9147 -6.8569 {"}'M' greentint -9.1235 2.816 -7.0302 {"}'M' greentint -9.2696 2.6724 -7.1801 {"}'M' greentint -9.4004 2.4904 -7.2985 {"}'M' greentint -8.8109 2.9492 -7.0623 {"}'M' greentint -8.9678 2.8433 -7.2354 {"}'M' greentint -9.1144 2.6962 -7.3852 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 433 A}'M' greentint -9.5176 2.118 -6.1621 {"}'M' greentint -9.7162 1.9815 -6.809 {"}'M' greentint -9.5618 1.9808 -6.6099 {"}'M' greentint -9.4036 2.0445 -6.4236 {"}'M' greentint -9.2534 2.1689 -6.2638 {"}'M' greentint -9.1203 2.3445 -6.1407 {"}'M' greentint -9.015 2.5592 -6.0629 {"}'M' greentint -9.6526 2.1128 -7.164 {"}'M' greentint -9.5113 2.0397 -6.9609 {"}'M' greentint -9.3531 2.042 -6.7572 {"}'M' greentint -9.1924 2.1179 -6.5703 {"}'M' greentint -9.0429 2.2633 -6.4179 {"}'M' greentint -8.9183 2.4633 -6.3121 {"}'M' greentint -8.8297 2.7009 -6.264 {"}'M' greentint -9.4081 2.2024 -7.216 {"}'M' greentint -9.2594 2.1528 -7.0099 {"}'M' greentint -9.097 2.1977 -6.8119 {"}'M' greentint -8.9428 2.3303 -6.6502 {"}'M' greentint -8.8186 2.5337 -6.5456 {"}'M' greentint -8.7403 2.7793 -6.5135 {"}'M' greentint -9.2801 2.438 -7.3785 {"}'M' greentint -9.1484 2.3363 -7.1803 {"}'M' greentint -8.9874 2.3643 -6.9803 {"}'M' greentint -8.8393 2.5163 -6.8315 {"}'M' greentint -8.7445 2.7504 -6.7741 {"}'M' greentint -9.0149 2.5541 -7.2338 {"}'M' greentint -8.8549 2.651 -7.0544 {"}'M' greentint -8.8 2.9043 -7.0542 {"}'M' greentint -8.9332 2.8007 -7.2537 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 422 A}'M' green -9.8967 1.0513 -4.1332 {"}'M' green -9.7051 1.228 -4.1971 {"}'M' green -10.3072 0.9106 -5.2312 {"}'M' green -9.5915 1.4221 -4.4484 {"}'M' green -9.615 1.5085 -4.9018 {"}'M' green -9.9234 1.3204 -5.2479 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 422 A}'M' greentint -10.1619 0.9352 -4.2778 {"}'M' greentint -10.3219 0.8383 -4.4573 {"}'M' greentint -10.4323 0.7389 -4.7375 {"}'M' greentint -10.0284 1.153 -4.3314 {"}'M' greentint -10.1894 1.125 -4.5313 {"}'M' greentint -10.3375 0.973 -4.6802 {"}'M' greentint -10.404 0.8363 -4.9911 {"}'M' greentint -9.84 1.3229 -4.398 {"}'M' greentint -9.9989 1.326 -4.6039 {"}'M' greentint -10.1592 1.235 -4.7868 {"}'M' greentint -10.3006 1.0645 -4.9223 {"}'M' greentint -9.7432 1.4576 -4.6535 {"}'M' greentint -9.9045 1.4184 -4.8514 {"}'M' greentint -10.0611 1.3064 -5.0228 {"}'M' greentint -10.1997 1.1316 -5.1535 {"}'M' greentint -9.7732 1.4448 -5.0881 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 433 A}'M' green -10.4404 0.6766 -4.5652 {"}'M' green -9.9901 1.0333 -4.0825 {"}'M' green -10.4947 0.7596 -5.0223 {"}'M' green -9.7471 1.2851 -4.2025 {"}'M' green -9.5873 1.5733 -4.6497 {"}'M' green -10.0102 1.2802 -5.3061 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 433 A}'M' greentint -10.2823 0.7507 -4.3814 {"}'M' greentint -10.1305 0.8713 -4.2185 {"}'M' greentint -10.3375 0.755 -4.8167 {"}'M' greentint -10.1749 0.8107 -4.6226 {"}'M' greentint -10.0171 0.921 -4.4491 {"}'M' greentint -9.8717 1.0827 -4.3061 {"}'M' greentint -10.2631 0.8904 -5.0758 {"}'M' greentint -10.1039 0.9129 -4.8753 {"}'M' greentint -9.9442 1.0015 -4.6943 {"}'M' greentint -9.7975 1.151 -4.5467 {"}'M' greentint -9.6738 1.3508 -4.442 {"}'M' greentint -10.1445 1.0724 -5.2303 {"}'M' greentint -9.9857 1.0834 -5.0294 {"}'M' greentint -9.8286 1.1793 -4.8521 {"}'M' greentint -9.6902 1.3498 -4.7205 {"}'M' greentint -9.847 1.3094 -5.1034 {"}'M' greentint -9.6973 1.4632 -4.9526 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 599 1qhoA_652F_601}P -6.3336 6.0675 -11.5465 {"}-6.3336 6.0675 -11.5465 { ca lys A 599 1qhoA_652F_601}-7.282 6.5961 -10.5659 { c lys A 599 1qhoA_652F_601}-7.6008 5.5042 -9.546 { o lys A 599 1qhoA_652F_601}-7.4943 4.3144 -9.8414 { c lys A 599 1qhoA_652F_601}P -7.6008 5.5042 -9.546 { n ile A 600 1qhoA_652F_601}-7.929 5.9202 -8.3379 { ca ile A 600 1qhoA_652F_601}-8.2605 4.9804 -7.2692 { c ile A 600 1qhoA_652F_601}-9.7683 4.8905 -7.1068 { o ile A 600 1qhoA_652F_601}-10.5026 5.8697 -7.2642 { c ile A 600 1qhoA_652F_601}P -9.7683 4.8905 -7.1068 { n tyr A 601 1qhoA_652F_601}-10.2384 3.6686 -6.898 { ca tyr A 601 1qhoA_652F_601}-11.6462 3.3759 -6.7115 { c tyr A 601 1qhoA_652F_601}-11.8479 2.6174 -5.4026 { o tyr A 601 1qhoA_652F_601}-10.9247 2.0369 -4.8353 { c tyr A 601 1qhoA_652F_601}P -11.8479 2.6174 -5.4026 { n leu A 602 1qhoA_652F_601}-13.0815 2.6108 -4.9322 { ca leu A 602 1qhoA_652F_601}-13.4895 1.9247 -3.7133 { c leu A 602 1qhoA_652F_601}-14.4316 0.7715 -4.0559 { o leu A 602 1qhoA_652F_601}-15.323 0.934 -4.8875 { c leu A 602 1qhoA_652F_601}P -14.4316 0.7715 -4.0559 { n thr A 603 1qhoA_652F_601}-14.262 -0.3789 -3.4008 { ca thr A 603 1qhoA_652F_601}-15.1713 -1.5046 -3.6877 { c thr A 603 1qhoA_652F_601}-15.3689 -2.2942 -2.4054 { o thr A 603 1qhoA_652F_601}-14.5076 -2.2336 -1.5138 { n lys A 650 1qhoA_652F_601}P -12.1927 -2.4637 0.2759 {"}-12.1927 -2.4637 0.2759 { ca lys A 650 1qhoA_652F_601}-10.8122 -2.2119 -0.1043 { c lys A 650 1qhoA_652F_601}-10.8 -1.1745 -1.2387 { o lys A 650 1qhoA_652F_601}-11.8143 -0.9282 -1.8934 { c lys A 650 1qhoA_652F_601}P -10.8 -1.1745 -1.2387 { n phe A 651 1qhoA_652F_601}-9.6239 -0.6036 -1.4515 { ca phe A 651 1qhoA_652F_601}-9.3918 0.3312 -2.5388 { c phe A 651 1qhoA_652F_601}-8.4858 -0.3532 -3.5624 { o phe A 651 1qhoA_652F_601}-7.7753 -1.3148 -3.2466 { c phe A 651 1qhoA_652F_601}P -8.4858 -0.3532 -3.5624 { n phe A 652 1qhoA_652F_601}-8.5558 0.1217 -4.7986 { ca phe A 652 1qhoA_652F_601}-7.6823 -0.4073 -5.8387 { c phe A 652 1qhoA_652F_601}-7.3141 0.7313 -6.783 { o phe A 652 1qhoA_652F_601}-8.0492 1.7113 -6.9247 { c phe A 652 1qhoA_652F_601}P -7.3141 0.7313 -6.783 { n ile A 653 1qhoA_652F_601}-6.1533 0.5841 -7.4117 { ca ile A 653 1qhoA_652F_601}-5.7508 1.5543 -8.4229 { c ile A 653 1qhoA_652F_601}-6.1295 0.9721 -9.7884 { o ile A 653 1qhoA_652F_601}-5.8277 -0.1989 -10.057 { c ile A 653 1qhoA_652F_601}P -6.1295 0.9721 -9.7884 { n lys A 654 1qhoA_652F_601}-6.7785 1.7842 -10.6044 { ca lys A 654 1qhoA_652F_601}-7.0961 1.3504 -11.9631 { c lys A 654 1qhoA_652F_601}-6.0893 2.1523 -12.8123 { o lys A 654 1qhoA_652F_601}-6.2109 3.3695 -12.8701 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 599 1qhoA_652F_601}P -6.3336 6.0675 -11.5465 { ca lys A 599 1qhoA_652F_601}P -7.282 6.5961 -10.5659 { n ile A 600 1qhoA_652F_601}P -7.929 5.9202 -8.3379 { ca ile A 600 1qhoA_652F_601}P -8.2605 4.9804 -7.2692 { n tyr A 601 1qhoA_652F_601}P -10.2384 3.6686 -6.898 { ca tyr A 601 1qhoA_652F_601}P -11.6462 3.3759 -6.7115 { n leu A 602 1qhoA_652F_601}P -13.0815 2.6108 -4.9322 { ca leu A 602 1qhoA_652F_601}P -13.4895 1.9247 -3.7133 { n thr A 603 1qhoA_652F_601}P -14.262 -0.3789 -3.4008 { ca thr A 603 1qhoA_652F_601}P -15.1713 -1.5046 -3.6877 { n lys A 650 1qhoA_652F_601}P -12.1927 -2.4637 0.2759 { ca lys A 650 1qhoA_652F_601}P -10.8122 -2.2119 -0.1043 { n phe A 651 1qhoA_652F_601}P -9.6239 -0.6036 -1.4515 { ca phe A 651 1qhoA_652F_601}P -9.3918 0.3312 -2.5388 { n phe A 652 1qhoA_652F_601}P -8.5558 0.1217 -4.7986 { ca phe A 652 1qhoA_652F_601}P -7.6823 -0.4073 -5.8387 { n ile A 653 1qhoA_652F_601}P -6.1533 0.5841 -7.4117 { ca ile A 653 1qhoA_652F_601}P -5.7508 1.5543 -8.4229 { n lys A 654 1qhoA_652F_601}P -6.7785 1.7842 -10.6044 { ca lys A 654 1qhoA_652F_601}P -7.0961 1.3504 -11.9631 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 599 1qhoA_652F_601}P -7.282 6.5961 -10.5659 {"}-7.282 6.5961 -10.5659 { ca ile A 600 1qhoA_652F_601}-8.2605 4.9804 -7.2692 { ca tyr A 601 1qhoA_652F_601}-11.6462 3.3759 -6.7115 { ca leu A 602 1qhoA_652F_601}-13.4895 1.9247 -3.7133 { ca thr A 603 1qhoA_652F_601}-15.1713 -1.5046 -3.6877 { ca lys A 650 1qhoA_652F_601}P -10.8122 -2.2119 -0.1043 {"}-10.8122 -2.2119 -0.1043 { ca phe A 651 1qhoA_652F_601}-9.3918 0.3312 -2.5388 { ca phe A 652 1qhoA_652F_601}-7.6823 -0.4073 -5.8387 { ca ile A 653 1qhoA_652F_601}-5.7508 1.5543 -8.4229 { ca lys A 654 1qhoA_652F_601}-7.0961 1.3504 -11.9631 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 601 1qhoA_652F_601}P -11.6462 3.3759 -6.7115 { cb tyr A 601 1qhoA_652F_601}-12.2117 2.5154 -7.852 { cg tyr A 601 1qhoA_652F_601}-12.3437 3.2548 -9.1649 { cd1 tyr A 601 1qhoA_652F_601}-11.2517 3.4278 -10.0035 { ce1 tyr A 601 1qhoA_652F_601}-11.3607 4.1355 -11.1906 { cz tyr A 601 1qhoA_652F_601}-12.5814 4.6534 -11.5555 { oh tyr A 601 1qhoA_652F_601}-12.7308 5.3229 -12.7567 { cg tyr A 601 1qhoA_652F_601}P -12.3437 3.2548 -9.1649 { cd2 tyr A 601 1qhoA_652F_601}-13.564 3.7979 -9.5487 { ce2 tyr A 601 1qhoA_652F_601}-13.6829 4.475 -10.751 { cz tyr A 601 1qhoA_652F_601}ghost -12.5814 4.6534 -11.5555 { ca phe A 652 1qhoA_652F_601}P -7.6823 -0.4073 -5.8387 { cb phe A 652 1qhoA_652F_601}-8.2998 -1.5739 -6.5993 { cg phe A 652 1qhoA_652F_601}-9.5101 -1.2877 -7.4422 { cd1 phe A 652 1qhoA_652F_601}-9.3871 -0.798 -8.7307 { ce1 phe A 652 1qhoA_652F_601}-10.5095 -0.5554 -9.5051 { cz phe A 652 1qhoA_652F_601}-11.7757 -0.8152 -9.0044 { cg phe A 652 1qhoA_652F_601}P -9.5101 -1.2877 -7.4422 { cd2 phe A 652 1qhoA_652F_601}-10.7769 -1.5581 -6.9519 { ce2 phe A 652 1qhoA_652F_601}-11.8997 -1.3307 -7.7233 { cz phe A 652 1qhoA_652F_601}ghost -11.7757 -0.8152 -9.0044 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 601 1qhoA_652F_601}P -12.2117 2.5154 -7.852 {"}P -12.2117 2.5154 -7.852 { cd1 tyr A 601 1qhoA_652F_601}P -11.2517 3.4278 -10.0035 { cd2 tyr A 601 1qhoA_652F_601}P -13.564 3.7979 -9.5487 { ce1 tyr A 601 1qhoA_652F_601}P -11.3607 4.1355 -11.1906 { ce2 tyr A 601 1qhoA_652F_601}P -13.6829 4.475 -10.751 { oh tyr A 601 1qhoA_652F_601}P -12.7308 5.3229 -12.7567 { cb phe A 652 1qhoA_652F_601}P -8.2998 -1.5739 -6.5993 {"}P -8.2998 -1.5739 -6.5993 { cd1 phe A 652 1qhoA_652F_601}P -9.3871 -0.798 -8.7307 { cd2 phe A 652 1qhoA_652F_601}P -10.7769 -1.5581 -6.9519 { ce1 phe A 652 1qhoA_652F_601}P -10.5095 -0.5554 -9.5051 { ce2 phe A 652 1qhoA_652F_601}P -11.8997 -1.3307 -7.7233 { cz phe A 652 1qhoA_652F_601}P -11.7757 -0.8152 -9.0044 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 652 A}'S' sky -10.6333 0.5685 -8.1689 {"}'S' sky -11.0465 1.0825 -9.2047 {"}'S' sky -10.4696 1.0647 -8.8445 { CE2 PHE 652 A}'S' blue -12.0022 0.3553 -7.2657 {"}'S' sky -12.1541 0.3825 -7.4692 {"}'S' sky -12.3118 0.3693 -7.6697 {"}'S' blue -12.4726 0.3168 -7.8622 {"}'S' sky -11.6636 0.3333 -7.2352 {"}'S' sky -11.2733 0.2972 -7.5839 {"}'S' blue -11.061 0.205 -7.7118 { CZ PHE 652 A}'S' sky -12.4935 0.555 -8.1861 {"}'S' sky -12.6478 0.5727 -8.3908 {"}'S' sky -12.5745 0.7009 -8.6497 {"}'S' sky -12.473 0.7866 -8.9013 {"}'S' blue -12.3486 0.8323 -9.1432 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 652 A}'S' sea -10.8669 0.4552 -8.1222 {"}'S' green -10.9636 0.6224 -8.2926 {"}'S' green -10.7322 0.7342 -8.3436 {"}'S' green -10.8544 0.8605 -8.5361 {"}'S' green -11.1473 0.9757 -8.9473 {"}'S' sea -11.3084 0.9607 -9.1503 {"}'S' sea -10.4897 0.8079 -8.4084 {"}'S' sea -10.6073 0.937 -8.5968 {"}'S' green -10.7427 1.0272 -8.7956 {"}'S' sea -10.8906 1.077 -9.0006 { CE2 PHE 652 A}'S' sea -11.8104 0.3941 -7.4429 {"}'S' sea -11.967 0.417 -7.6503 {"}'S' sea -11.4821 0.3441 -7.4322 {"}'S' green -11.6312 0.3971 -7.6396 { CZ PHE 652 A}'S' green -11.9983 0.4744 -7.8429 {"}'S' green -12.1206 0.6007 -8.0354 {"}'S' green -12.2605 0.6817 -8.2382 {"}'S' sea -12.4135 0.7159 -8.4466 {"}'S' green -12.3126 0.8228 -8.704 {"}'S' green -11.4018 0.3953 -7.7973 {"}'S' green -11.1864 0.4503 -7.9495 {"}'S' green -11.8429 0.9326 -8.9313 {"}'S' green -10.9928 0.4876 -8.1377 {"}'S' green -11.5071 0.9126 -8.9206 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 652 A}'S' P -11.0851 0.7444 -8.4848 {"}'S' -11.0782 0.7282 -8.4973 {"}'S' P -10.9943 0.9415 -8.7389 {"}'S' -10.9939 0.9406 -8.7399 { CZ PHE 652 A}'S' P -11.7559 0.5481 -7.9077 {"}'S' -11.7562 0.526 -7.9253 {"}'S' P -11.8734 0.6772 -8.0961 {"}'S' -11.8695 0.6127 -8.1358 {"}'S' P -12.0088 0.7674 -8.295 {"}'S' -11.999 0.7031 -8.3249 {"}'S' P -12.1568 0.8172 -8.4999 {"}'S' -12.1529 0.8011 -8.5047 {"}'S' P -11.4951 0.5643 -7.9651 {"}'S' -11.5022 0.5284 -7.9923 {"}'S' P -11.6078 0.702 -8.1488 {"}'S' -11.6174 0.608 -8.202 {"}'S' P -11.7358 0.805 -8.3438 {"}'S' -11.7394 0.6903 -8.3909 {"}'S' P -11.8782 0.8708 -8.5467 {"}'S' -11.8728 0.7881 -8.5683 {"}'S' P -12.0301 0.898 -8.7503 {"}'S' -12.0291 0.8914 -8.7508 {"}'S' P -11.2865 0.6167 -8.1243 {"}'S' -11.3007 0.5749 -8.1495 {"}'S' P -11.4052 0.7504 -8.3153 {"}'S' -11.4276 0.6561 -8.3569 {"}'S' P -11.5395 0.8488 -8.5163 {"}'S' -11.5547 0.7433 -8.5472 {"}'S' P -11.6863 0.9096 -8.724 {"}'S' -11.6895 0.8444 -8.734 {"}'S' P -11.0978 0.644 -8.3169 {"}'S' -11.1019 0.6338 -8.3219 {"}'S' P -11.2201 0.7686 -8.5108 {"}'S' -11.2366 0.7233 -8.5248 {"}'S' P -11.358 0.8596 -8.7133 {"}'S' -11.3682 0.8161 -8.7207 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 601 A}'S' blue -12.7714 0.9349 -8.3519 {"}'S' sky -12.634 0.8431 -8.1499 {"}'S' sky -12.4853 0.7893 -7.943 {"}'S' blue -12.3281 0.7729 -7.7346 {"}'S' sky -12.6399 1.0086 -8.6316 {"}'S' sky -12.4956 1.1408 -8.8968 {"}'S' blue -12.28 1.2244 -9.0314 {"}'S' blue -12.0448 1.3088 -9.1086 { HB2 TYR 601 A}'S' sky -12.1291 0.6883 -7.6261 {"}'S' sky -11.9717 0.7062 -7.4271 {"}'S' sky -11.5894 0.6772 -7.3355 {"}'S' blue -11.2904 0.6827 -7.3826 {"}'S' sky -10.8307 1.352 -8.8654 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 601 A}'S' sea -12.5132 0.8929 -8.4354 {"}'S' green -12.3711 0.8146 -8.2301 {"}'S' sea -12.3838 1.0015 -8.7139 {"}'S' sea -12.1706 1.0783 -8.8501 { HB2 TYR 601 A}'S' green -12.3119 0.7991 -8.3029 {"}'S' green -12.1966 0.6675 -8.1169 {"}'S' green -12.0592 0.586 -7.9174 {"}'S' sea -11.7479 0.5907 -7.5169 {"}'S' green -12.2255 0.9493 -8.665 {"}'S' green -11.602 0.5021 -7.7347 {"}'S' sea -11.4433 0.5666 -7.548 {"}'S' green -11.3418 0.5039 -7.8306 {"}'S' green -11.787 1.0112 -8.9565 {"}'S' green -11.1794 0.536 -8.0398 {"}'S' green -10.9221 0.667 -8.1111 {"}'S' sea -11.2966 1.214 -9.0537 {"}'S' green -11.2415 1.0027 -8.9251 {"}'S' green -10.8455 0.7857 -8.3513 {"}'S' sea -10.6893 0.8811 -8.1767 {"}'S' sea -11.0519 1.2814 -8.9875 {"}'S' green -10.9841 1.0729 -8.8421 {"}'S' green -10.8507 0.9701 -8.6414 {"}'S' green -10.6871 0.9987 -8.4381 {"}'S' sea -10.7257 1.1956 -8.6862 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 601 A}'S' P -12.1443 0.7669 -8.5091 {"}'S' -12.1316 0.7866 -8.4979 {"}'S' P -12.0355 0.6262 -8.33 {"}'S' -12.0078 0.6852 -8.3107 {"}'S' P -11.9048 0.5318 -8.1349 {"}'S' -11.8844 0.5992 -8.1258 {"}'S' P -11.7575 0.4901 -7.9326 {"}'S' -11.7529 0.5205 -7.9349 {"}'S' P -11.9939 0.8877 -8.7805 {"}'S' -11.9907 0.8938 -8.7741 {"}'S' P -11.9062 0.7115 -8.6171 {"}'S' -11.8814 0.7789 -8.5728 {"}'S' P -11.7901 0.5798 -8.4316 {"}'S' -11.7667 0.6897 -8.3871 {"}'S' P -11.6535 0.4984 -8.2315 {"}'S' -11.6441 0.6067 -8.2093 {"}'S' P -11.5011 0.4734 -8.0278 {"}'S' -11.5038 0.5277 -8.0268 {"}'S' P -11.7159 0.8148 -8.8111 {"}'S' -11.7093 0.8527 -8.7732 {"}'S' P -11.6133 0.662 -8.636 {"}'S' -11.6089 0.7539 -8.5758 {"}'S' P -11.4849 0.5613 -8.4409 {"}'S' -11.4922 0.6698 -8.397 {"}'S' P -11.3376 0.5182 -8.2383 {"}'S' -11.352 0.5906 -8.2233 {"}'S' P -11.4797 0.8959 -8.8947 {"}'S' -11.4804 0.8994 -8.8912 {"}'S' P -11.376 0.7371 -8.7168 {"}'S' -11.3847 0.784 -8.6795 {"}'S' P -11.2412 0.6423 -8.5159 {"}'S' -11.2572 0.6948 -8.4883 {"}'S' P -11.0854 0.6181 -8.3077 {"}'S' -11.0884 0.6241 -8.3064 {"}'S' P -11.1389 0.85 -8.75 {"}'S' -11.1453 0.8616 -8.7391 {"}'S' P -11.0018 0.775 -8.5505 {"}'S' -11.0113 0.7906 -8.5414 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 652 A}'M' greentint -9.3649 1.996 -6.5408 {"}'M' greentint -9.1226 2.3917 -6.3375 {"}'M' greentint -9.2713 2.2348 -6.486 {"}'M' greentint -9.375 2.1384 -6.7835 {"}'M' greentint -9.4315 1.8889 -6.7867 {"}'M' greentint -8.9734 2.6218 -6.3997 {"}'M' greentint -9.132 2.5287 -6.5781 {"}'M' greentint -9.2712 2.3607 -6.7113 {"}'M' greentint -9.3446 2.2324 -7.0283 {"}'M' greentint -9.4157 1.9873 -7.0525 {"}'M' greentint -8.7864 2.8109 -6.4675 {"}'M' greentint -8.9466 2.7527 -6.6595 {"}'M' greentint -9.1014 2.6296 -6.8242 {"}'M' greentint -9.2371 2.4521 -6.9504 {"}'M' greentint -9.2667 2.3126 -7.2665 {"}'M' greentint -9.3479 2.0694 -7.3049 {"}'M' greentint -8.7033 2.9303 -6.711 {"}'M' greentint -8.8658 2.8487 -6.8973 {"}'M' greentint -9.018 2.7128 -7.0573 {"}'M' greentint -9.1546 2.5312 -7.1821 {"}'M' greentint -9.1522 2.3574 -7.4962 {"}'M' greentint -8.7647 2.895 -7.1439 {"}'M' greentint -8.9108 2.7514 -7.2938 {"}'M' greentint -9.0416 2.5694 -7.4123 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 601 A}'M' greentint -9.3431 1.9352 -6.6269 {"}'M' greentint -9.1929 2.0597 -6.4671 {"}'M' greentint -9.0597 2.2353 -6.344 {"}'M' greentint -8.9545 2.4499 -6.2663 {"}'M' greentint -9.2925 1.9327 -6.9605 {"}'M' greentint -9.1319 2.0087 -6.7736 {"}'M' greentint -8.9823 2.1541 -6.6212 {"}'M' greentint -8.8578 2.354 -6.5154 {"}'M' greentint -8.7692 2.5916 -6.4674 {"}'M' greentint -8.7247 2.8464 -6.4801 {"}'M' greentint -9.1988 2.0436 -7.2132 {"}'M' greentint -9.0365 2.0885 -7.0152 {"}'M' greentint -8.8823 2.2211 -6.8535 {"}'M' greentint -8.758 2.4244 -6.7489 {"}'M' greentint -8.6797 2.6701 -6.7168 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{"}'M' greentint -9.7464 1.4756 -4.5663 {"}'M' greentint -9.9074 1.4475 -4.7663 {"}'M' greentint -10.0554 1.2956 -4.9151 {"}'M' greentint -10.1219 1.1589 -5.226 {"}'M' greentint -9.7168 1.6486 -4.8388 {"}'M' greentint -9.8771 1.5575 -5.0217 {"}'M' greentint -10.0185 1.387 -5.1572 {"}'M' greentint -10.0251 1.2332 -5.4661 {"}'M' greentint -9.6224 1.741 -5.0863 {"}'M' greentint -9.779 1.6289 -5.2577 {"}'M' greentint -9.9176 1.4542 -5.3884 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 601 A}'M' green -10.1394 0.9154 -4.5433 {"}'M' green -9.9991 1.0774 -4.4073 {"}'M' green -10.1839 0.8548 -4.9474 {"}'M' green -9.6596 1.5623 -4.4675 {"}'M' green -10.1535 1.1164 -5.5551 {"}'M' green -9.5418 1.8671 -4.9742 {"}'M' green -10.0192 1.3243 -5.6309 {"}'M' green -9.6109 1.7435 -5.2199 {"}'M' green -9.7478 1.6514 -5.4884 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 601 A}'M' greentint -10.026 0.965 -4.7739 {"}'M' greentint -9.8807 1.1268 -4.6309 {"}'M' greentint -9.7561 1.3292 -4.5273 {"}'M' greentint -10.1129 0.9569 -5.2001 {"}'M' greentint -9.9532 1.0455 -5.0191 {"}'M' greentint -9.8065 1.1951 -4.8715 {"}'M' greentint -9.6828 1.3949 -4.7668 {"}'M' greentint -9.5909 1.629 -4.7135 {"}'M' greentint -9.9946 1.1274 -5.3542 {"}'M' greentint -9.8376 1.2233 -5.1768 {"}'M' greentint -9.6992 1.3939 -5.0453 {"}'M' greentint -9.5962 1.6174 -4.9745 {"}'M' greentint -9.856 1.3535 -5.4282 {"}'M' greentint -9.7062 1.5072 -5.2774 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 432 1qhvA_576F_434}P -7.6785 5.7786 -12.1089 {"}-7.6785 5.7786 -12.1089 { ca val A 432 1qhvA_576F_434}-8.8799 5.9067 -11.328 { c val A 432 1qhvA_576F_434}-8.5828 5.2776 -9.9358 { o val A 432 1qhvA_576F_434}-8.0321 4.1596 -9.9123 { c val A 432 1qhvA_576F_434}P -8.5828 5.2776 -9.9358 { n leu A 433 1qhvA_576F_434}-8.8257 6.025 -8.9005 { ca leu A 433 1qhvA_576F_434}-8.7105 5.5249 -7.5198 { c leu A 433 1qhvA_576F_434}-10.1081 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-3.0403 { ca phe A 122 1qouA_169F_120}-15.3688 0.5286 -1.3903 { ca val A 167 1qouA_169F_120}P -10.8423 -1.6788 0.4916 {"}-10.8423 -1.6788 0.4916 { ca phe A 168 1qouA_169F_120}-9.4962 -0.0737 -2.7395 { ca phe A 169 1qouA_169F_120}-7.7885 -0.7732 -6.0696 { ca asn A 170 1qouA_169F_120}-5.7685 1.4709 -8.4519 { ca cys A 171 1qouA_169F_120}-6.857 1.8799 -12.1229 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 120 1qouA_169F_120}P -11.6272 3.1669 -6.6874 { cb phe A 120 1qouA_169F_120}-11.9364 2.2125 -7.8816 { cg phe A 120 1qouA_169F_120}-11.9917 3.072 -9.1564 { cd1 phe A 120 1qouA_169F_120}-13.1621 3.6554 -9.582 { ce1 phe A 120 1qouA_169F_120}-13.176 4.5105 -10.695 { cz phe A 120 1qouA_169F_120}-11.9995 4.715 -11.4219 { cg phe A 120 1qouA_169F_120}P -11.9917 3.072 -9.1564 { cd2 phe A 120 1qouA_169F_120}-10.8312 3.2966 -9.8943 { ce2 phe A 120 1qouA_169F_120}-10.8058 4.1065 -11.0304 { cz phe A 120 1qouA_169F_120}ghost -11.9995 4.715 -11.4219 { ca phe A 169 1qouA_169F_120}P -7.7885 -0.7732 -6.0696 { cb phe A 169 1qouA_169F_120}-8.2656 -1.8233 -7.0647 { cg phe A 169 1qouA_169F_120}-9.4809 -1.574 -7.9094 { cd1 phe A 169 1qouA_169F_120}-10.7443 -1.9664 -7.4549 { ce1 phe A 169 1qouA_169F_120}-11.8763 -1.7634 -8.2539 { cz phe A 169 1qouA_169F_120}-11.7871 -1.1515 -9.4986 { cg phe A 169 1qouA_169F_120}P -9.4809 -1.574 -7.9094 { cd2 phe A 169 1qouA_169F_120}-9.3971 -0.9852 -9.1595 { ce2 phe A 169 1qouA_169F_120}-10.5327 -0.7681 -9.9222 { cz phe A 169 1qouA_169F_120}ghost -11.7871 -1.1515 -9.4986 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 120 1qouA_169F_120}P -11.9364 2.2125 -7.8816 {"}P -11.9364 2.2125 -7.8816 { cd1 phe A 120 1qouA_169F_120}P -13.1621 3.6554 -9.582 { cd2 phe A 120 1qouA_169F_120}P -10.8312 3.2966 -9.8943 { ce1 phe A 120 1qouA_169F_120}P -13.176 4.5105 -10.695 { ce2 phe A 120 1qouA_169F_120}P -10.8058 4.1065 -11.0304 { cz phe A 120 1qouA_169F_120}P -11.9995 4.715 -11.4219 { cb phe A 169 1qouA_169F_120}P -8.2656 -1.8233 -7.0647 {"}P -8.2656 -1.8233 -7.0647 { cd1 phe A 169 1qouA_169F_120}P -10.7443 -1.9664 -7.4549 { cd2 phe A 169 1qouA_169F_120}P -9.3971 -0.9852 -9.1595 { ce1 phe A 169 1qouA_169F_120}P -11.8763 -1.7634 -8.2539 { ce2 phe A 169 1qouA_169F_120}P -10.5327 -0.7681 -9.9222 { cz phe A 169 1qouA_169F_120}P -11.7871 -1.1515 -9.4986 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 169 A}'S' blue -10.4597 0.02 -8.1995 {"}'S' sky -10.3148 0.2207 -8.2848 {"}'S' blue -10.1149 0.385 -8.3413 {"}'S' sky -10.2692 0.4026 -8.5459 {"}'S' blue -10.0348 0.5458 -8.6018 { CE1 PHE 169 A}'S' blue -11.6401 -0.0994 -7.7658 {"}'S' blue -11.7869 -0.0386 -7.9735 {"}'S' blue -11.4586 -0.0886 -7.9628 {"}'S' blue -11.2498 -0.1355 -8.1144 { CE2 PHE 169 A}'S' sky -10.8246 0.0394 -8.3967 {"}'S' blue -11.4048 0.6198 -9.3086 {"}'S' sky -10.5846 0.1558 -8.4371 {"}'S' blue -11.1705 0.763 -9.3645 {"}'S' sky -10.4152 0.4313 -8.653 {"}'S' sky -10.7659 0.8145 -9.2128 {"}'S' blue -10.2521 0.6114 -8.883 {"}'S' blue -10.3648 0.7491 -9.0667 {"}'S' blue -10.4928 0.8521 -9.2617 { CZ PHE 169 A}'S' blue -12.3627 0.1484 -8.4783 {"}'S' blue -12.0097 0.1382 -8.3371 {"}'S' sky -12.132 0.2645 -8.5296 {"}'S' sky -12.2719 0.3454 -8.7324 {"}'S' blue -12.4249 0.3796 -8.9408 {"}'S' sky -11.6696 0.0479 -8.2293 {"}'S' sky -11.7673 0.2118 -8.4019 {"}'S' sky -11.8848 0.3409 -8.5903 {"}'S' sky -12.0202 0.4311 -8.7892 {"}'S' sky -12.1681 0.4809 -8.9941 {"}'S' sky -11.4132 0.059 -8.2915 {"}'S' sky -11.8896 0.5346 -9.0409 {"}'S' blue -12.0415 0.5617 -9.2445 {"}'S' blue -11.1186 -0.0798 -8.2878 {"}'S' sky -11.5509 0.5125 -9.0105 {"}'S' blue -11.6977 0.5733 -9.2182 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 169 A}'S' sea -10.89 0.2426 -8.5394 {"}'S' green -10.9867 0.4097 -8.7097 {"}'S' green -11.1083 0.5317 -8.902 {"}'S' sea -11.2506 0.6021 -9.104 {"}'S' sea -10.6565 0.3558 -8.5861 {"}'S' green -10.7554 0.5215 -8.7608 {"}'S' green -10.8776 0.6478 -8.9533 {"}'S' sea -11.0175 0.7288 -9.1561 {"}'S' sea -10.5129 0.5952 -8.8256 {"}'S' sea -10.6304 0.7243 -9.014 { CZ PHE 169 A}'S' sea -11.5065 0.228 -8.4593 {"}'S' sea -11.6192 0.3657 -8.643 {"}'S' sea -11.7471 0.4687 -8.838 {"}'S' sea -11.1978 0.114 -8.4437 {"}'S' sea -11.2979 0.2805 -8.6185 {"}'S' sea -11.4166 0.4141 -8.8095 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 120 A}'S' blue -12.3646 0.7056 -8.6612 {"}'S' sky -12.2379 0.59 -8.465 {"}'S' sky -12.0958 0.5116 -8.2597 {"}'S' blue -11.9434 0.4708 -8.0524 {"}'S' blue -12.2202 0.8379 -8.9264 {"}'S' sky -12.1084 0.6985 -8.7435 {"}'S' sky -11.8389 0.5281 -8.3465 {"}'S' blue -12.0047 0.9214 -9.061 {"}'S' sky -11.8952 0.7754 -8.8797 {"}'S' blue -11.7695 1.0059 -9.1382 {"}'S' sky -11.6588 0.858 -8.9548 { HB2 PHE 120 A}'S' blue -11.797 0.4645 -8.09 {"}'S' blue -11.6596 0.383 -7.8906 {"}'S' sky -11.5052 0.3288 -8.1081 {"}'S' blue -11.3579 0.2871 -7.9058 {"}'S' sky -11.2539 0.2954 -8.2047 {"}'S' blue -11.1015 0.2704 -8.0009 {"}'S' sky -11.3874 0.8081 -8.9296 {"}'S' sky -10.938 0.3152 -8.2115 {"}'S' sky -10.6858 0.415 -8.2808 {"}'S' blue -10.5225 0.464 -8.0843 {"}'S' sky -10.897 1.011 -9.0269 {"}'S' sky -10.4459 0.5827 -8.3244 {"}'S' blue -10.2897 0.6781 -8.1499 {"}'S' sky -10.6523 1.0784 -8.9606 {"}'S' sky -10.4511 0.7671 -8.6146 {"}'S' blue -10.2875 0.7957 -8.4112 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 120 A}'S' sea -11.9801 0.595 -8.5478 {"}'S' sea -11.7683 0.6667 -8.6848 { HB2 PHE 120 A}'S' sea -11.7447 0.5639 -8.4822 {"}'S' sea -11.6359 0.4232 -8.3031 {"}'S' sea -11.5943 0.6846 -8.7536 {"}'S' sea -11.5067 0.5085 -8.5902 {"}'S' sea -11.3905 0.3767 -8.4048 {"}'S' sea -11.3163 0.6118 -8.7842 {"}'S' sea -11.2137 0.459 -8.6092 {"}'S' sea -11.0853 0.3583 -8.414 {"}'S' sea -11.1446 0.9018 -9.0105 {"}'S' green -11.0801 0.6929 -8.8679 {"}'S' green -10.9765 0.5341 -8.6899 {"}'S' green -10.8416 0.4393 -8.489 {"}'S' green -10.8419 0.7997 -8.8982 {"}'S' green -10.7393 0.647 -8.7231 {"}'S' sea -10.6022 0.572 -8.5237 {"}'S' sea -10.5845 0.8699 -8.8152 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 169 A}'M' green -9.3941 1.7509 -6.4939 {"}'M' green -8.8446 2.385 -6.1508 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 169 A}'M' greentint -9.1518 2.1465 -6.2906 {"}'M' greentint -9.3004 1.9896 -6.4391 {"}'M' greentint -9.4041 1.8933 -6.7366 {"}'M' greentint -9.0025 2.3767 -6.3528 {"}'M' greentint -9.1611 2.2835 -6.5312 {"}'M' greentint -9.3004 2.1155 -6.6644 {"}'M' greentint -9.3737 1.9873 -6.9814 {"}'M' greentint -8.8156 2.5658 -6.4207 {"}'M' greentint -8.9758 2.5075 -6.6126 {"}'M' greentint -9.1305 2.3845 -6.7773 {"}'M' greentint -9.2663 2.2069 -6.9035 {"}'M' greentint -9.2958 2.0675 -7.2196 {"}'M' greentint -8.7324 2.6852 -6.6641 {"}'M' greentint -8.8949 2.6036 -6.8504 {"}'M' greentint -9.0471 2.4676 -7.0104 {"}'M' greentint -9.1838 2.2861 -7.1352 {"}'M' greentint -8.638 2.7486 -6.9237 {"}'M' greentint -8.7938 2.6499 -7.097 {"}'M' greentint -8.9399 2.5063 -7.2469 {"}'M' greentint -9.0707 2.3243 -7.3654 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 120 A}'M' greentint -9.2971 1.797 -6.4829 {"}'M' greentint -9.1469 1.9214 -6.3231 {"}'M' greentint -9.0137 2.097 -6.2 {"}'M' greentint -9.4047 1.7922 -7.0203 {"}'M' greentint -9.2465 1.7944 -6.8165 {"}'M' greentint -9.0859 1.8704 -6.6297 {"}'M' greentint -8.9363 2.0158 -6.4773 {"}'M' greentint -8.8118 2.2157 -6.3714 {"}'M' greentint -8.7232 2.4533 -6.3234 {"}'M' greentint -9.3016 1.9549 -7.2753 {"}'M' greentint -9.1528 1.9053 -7.0692 {"}'M' greentint -8.9905 1.9502 -6.8712 {"}'M' greentint -8.8363 2.0828 -6.7095 {"}'M' greentint -8.712 2.2861 -6.6049 {"}'M' greentint -8.6337 2.5318 -6.5728 {"}'M' greentint -9.0418 2.0888 -7.2396 {"}'M' greentint -8.8808 2.1168 -7.0397 {"}'M' greentint -8.7328 2.2688 -6.8908 {"}'M' greentint -8.638 2.5029 -6.8335 {"}'M' greentint -8.6217 2.7566 -6.8828 {"}'M' greentint -8.9083 2.3066 -7.2932 {"}'M' greentint -8.7484 2.4035 -7.1137 {"}'M' greentint -8.6934 2.6568 -7.1135 {"}'M' greentint -8.8267 2.5532 -7.313 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 169 A}'M' green -10.2925 0.3605 -4.7797 {"}'M' green -10.4258 0.2568 -4.9792 {"}'M' green -10.2109 0.607 -4.7995 {"}'M' sea -10.4975 0.157 -5.2099 {"}'M' sea -9.9456 0.7231 -4.6549 {"}'M' green -10.0774 0.8249 -4.8531 {"}'M' green -10.4529 0.5082 -5.5128 {"}'M' sea -10.5033 0.2535 -5.5082 {"}'M' green -9.8889 0.9947 -4.9197 {"}'M' green -10.3561 0.5825 -5.7528 {"}'M' sea -9.7921 1.1294 -5.1752 {"}'M' green -9.9534 1.0903 -5.3731 {"}'M' green -10.11 0.9782 -5.5445 {"}'M' green -10.2486 0.8035 -5.6752 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 169 A}'M' greentint -10.3708 0.5101 -4.979 {"}'M' greentint -10.4812 0.4107 -5.2592 {"}'M' greentint -10.2384 0.7968 -5.053 {"}'M' greentint -10.3864 0.6449 -5.2019 {"}'M' greentint -10.0478 0.9979 -5.1256 {"}'M' greentint -10.2081 0.9068 -5.3085 {"}'M' greentint -10.3495 0.7363 -5.444 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 120 A}'M' green -10.6025 0.2842 -5.1245 {"}'M' green -10.4447 0.3944 -4.951 {"}'M' green -10.2993 0.5562 -4.808 {"}'M' green -10.1747 0.7586 -4.7044 {"}'M' sea -10.0783 0.9917 -4.6446 {"}'M' sea -10.6908 0.3639 -5.5777 {"}'M' green -10.5316 0.3863 -5.3772 {"}'M' green -10.0096 1.0584 -4.8906 {"}'M' sea -10.5722 0.5458 -5.7322 {"}'M' green -10.0149 1.0468 -5.1516 {"}'M' sea -9.9605 1.2965 -5.1513 {"}'M' sea -10.4378 0.7537 -5.808 {"}'M' green -10.0296 1.1729 -5.397 {"}'M' sea -10.3252 0.9835 -5.8432 {"}'M' green -10.1665 1.0808 -5.6656 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 120 A}'M' greentint -10.3719 0.4749 -5.1962 {"}'M' greentint -10.2252 0.6245 -5.0487 {"}'M' greentint -10.1014 0.8243 -4.9439 {"}'M' greentint -10.4133 0.5568 -5.5313 {"}'M' greentint -10.2563 0.6527 -5.354 {"}'M' greentint -10.1178 0.8233 -5.2224 {"}'M' greentint -10.2747 0.7829 -5.6053 {"}'M' greentint -10.1249 0.9366 -5.4545 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 190 1qupA_211F_192}P -6.5084 6.303 -11.1762 {"}-6.5084 6.303 -11.1762 { ca phe A 190 1qupA_211F_192}-7.9256 6.364 -10.8526 { c phe A 190 1qupA_211F_192}-8.0626 5.3784 -9.6956 { o phe A 190 1qupA_211F_192}-7.6607 4.2149 -9.8104 { c phe A 190 1qupA_211F_192}P -8.0626 5.3784 -9.6956 { n val A 191 1qupA_211F_192}-8.6379 5.8393 -8.5894 { ca val A 191 1qupA_211F_192}-8.7696 5.0156 -7.3972 { c val A 191 1qupA_211F_192}-10.1937 4.9469 -6.8621 { o val A 191 1qupA_211F_192}-10.8744 5.9651 -6.7586 { c val A 191 1qupA_211F_192}P -10.1937 4.9469 -6.8621 { n ile A 192 1qupA_211F_192}-10.6446 3.7426 -6.5302 { ca ile A 192 1qupA_211F_192}-11.9751 3.5791 -5.9411 { c ile A 192 1qupA_211F_192}-11.737 2.8565 -4.622 { o ile A 192 1qupA_211F_192}-10.9909 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{"}'S' green -14.5067 0.7376 -6.7413 {"}'S' sea -14.5684 0.8439 -7.2174 {"}'S' green -14.4126 0.8197 -7.0092 {"}'S' sea -14.1727 0.9873 -7.0528 {HD12 ILE 192 A}'S' sea -13.9167 0.7503 -8.8719 {"}'S' sea -13.7582 0.8369 -8.6905 {"}'S' sea -13.6089 0.9728 -8.5346 {"}'S' sea -13.7708 0.6618 -9.0898 {"}'S' sea -13.6121 0.7263 -8.9031 {"}'S' green -13.4592 0.8424 -8.7376 {"}'S' sea -13.3197 1.0031 -8.6007 {"}'S' sea -13.5105 0.6635 -9.1856 {"}'S' sea -13.3525 0.7493 -9.0046 {"}'S' sea -13.2024 0.8851 -8.8493 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 ILE 192 A}'S' P -14.3781 0.7442 -6.4424 {"}'S' -14.3777 0.745 -6.4419 {"}'S' P -14.2257 0.7034 -6.2351 {"}'S' -14.2257 0.727 -6.2319 {"}'S' P -14.0663 0.7027 -6.0273 {"}'S' -14.0669 0.7112 -6.0283 {"}'S' P -14.1212 0.7608 -6.5291 {"}'S' -14.1216 0.7829 -6.5227 {"}'S' P -13.9689 0.733 -6.3249 {"}'S' -13.9739 0.7664 -6.3204 {"}'S' P -13.8113 0.7447 -6.1241 {"}'S' -13.8127 0.752 -6.1242 {"}'S' P -13.7559 0.8043 -6.4601 {"}'S' -13.7565 0.8089 -6.4586 { HB ILE 192 A}'S' P -13.0564 0.811 -7.1905 {"}'S' -13.0486 0.8225 -7.1893 {"}'S' P -13.0041 0.9104 -7.5826 {"}'S' -12.9984 0.919 -7.5785 {"}'S' P -12.8953 0.7698 -7.4035 {"}'S' -12.8739 0.8153 -7.388 {"}'S' P -12.7646 0.6754 -7.2085 {"}'S' -12.7498 0.7236 -7.2027 {"}'S' P -12.6173 0.6337 -7.0062 {"}'S' -12.6172 0.6365 -7.0067 {"}'S' P -12.766 0.8551 -7.6906 {"}'S' -12.76 0.8705 -7.6807 {"}'S' P -12.6499 0.7233 -7.5052 {"}'S' -12.6405 0.7699 -7.486 {"}'S' P -12.5133 0.642 -7.3051 {"}'S' -12.51 0.677 -7.2982 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 211 A}'M' green -9.2668 2.6313 -7.1002 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 211 A}'M' greentint -10.0924 1.9549 -6.4508 {"}'M' greentint -10.2556 1.9215 -6.6526 {"}'M' greentint -9.8106 2.0807 -6.3131 {"}'M' greentint -9.9485 2.16 -6.5128 {"}'M' greentint -10.1064 2.1516 -6.7148 {"}'M' greentint -10.265 2.0585 -6.8932 {"}'M' greentint -9.6242 2.2517 -6.3776 {"}'M' greentint -9.7633 2.3301 -6.5788 {"}'M' greentint -9.9194 2.3408 -6.7826 {"}'M' greentint -10.0796 2.2825 -6.9746 {"}'M' greentint -10.2344 2.1594 -7.1393 {"}'M' greentint -9.3883 2.3548 -6.4171 {"}'M' greentint -9.5233 2.4483 -6.6177 {"}'M' greentint -9.6762 2.4842 -6.8247 {"}'M' greentint -9.8367 2.4607 -7.0267 {"}'M' greentint -9.9987 2.3786 -7.2124 {"}'M' greentint -10.151 2.2426 -7.3724 {"}'M' greentint -9.2821 2.5252 -6.6919 {"}'M' greentint -9.4275 2.5756 -6.8936 {"}'M' greentint -9.5827 2.5747 -7.0935 {"}'M' greentint -9.7418 2.5236 -7.2857 {"}'M' greentint -9.8976 2.4248 -7.459 {"}'M' greentint -9.4248 2.6187 -7.3014 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 192 A}'M' greentint -10.2745 1.9706 -7.0092 {"}'M' greentint -10.1346 1.9056 -6.81 {"}'M' greentint -9.9803 1.9049 -6.6108 {"}'M' greentint -9.8221 1.9686 -6.4245 {"}'M' greentint -9.6719 2.093 -6.2647 {"}'M' greentint -10.1836 2.1788 -7.3495 {"}'M' greentint -10.0711 2.0369 -7.1649 {"}'M' greentint -9.9297 1.9638 -6.9619 {"}'M' greentint -9.7715 1.9661 -6.7581 {"}'M' greentint -9.6109 2.042 -6.5713 {"}'M' greentint -9.4613 2.1874 -6.4189 {"}'M' greentint -9.9426 2.2635 -7.4051 {"}'M' greentint -9.8266 2.1265 -7.2169 {"}'M' greentint -9.6778 2.0769 -7.0108 {"}'M' greentint -9.5155 2.1218 -6.8129 {"}'M' greentint -9.3613 2.2544 -6.6511 {"}'M' greentint -9.6986 2.3621 -7.3794 {"}'M' greentint -9.5668 2.2604 -7.1812 {"}'M' greentint -9.4058 2.2884 -6.9813 {"}'M' greentint -9.2578 2.4404 -6.8324 {"}'M' greentint -9.4333 2.4782 -7.2348 {"}'M' greentint -9.2734 2.5751 -7.0553 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 211 A}'M' green -9.7578 1.1873 -4.5964 {"}'M' green -9.7551 1.3821 -5.0474 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 211 A}'M' greentint -10.5381 0.5629 -4.6028 {"}'M' greentint -10.3522 0.6543 -4.4448 {"}'M' greentint -10.4564 0.8095 -4.6226 {"}'M' greentint -10.6164 0.7126 -4.802 {"}'M' greentint -10.7268 0.6132 -5.0823 {"}'M' greentint -10.1912 0.9256 -4.478 {"}'M' greentint -10.3229 1.0273 -4.6761 {"}'M' greentint -10.4839 0.9993 -4.8761 {"}'M' greentint -10.632 0.8473 -5.025 {"}'M' greentint -9.9996 1.1024 -4.5419 {"}'M' greentint -10.1345 1.1972 -4.7428 {"}'M' greentint -10.2934 1.2004 -4.9487 {"}'M' greentint -10.4537 1.1093 -5.1315 {"}'M' greentint -10.5951 0.9388 -5.2671 {"}'M' greentint -9.886 1.2964 -4.7931 {"}'M' greentint -10.0376 1.3319 -4.9983 {"}'M' greentint -10.199 1.2928 -5.1961 {"}'M' greentint -10.3556 1.1807 -5.3675 {"}'M' greentint -10.4942 1.006 -5.4983 {"}'M' greentint -9.9095 1.3829 -5.2465 {"}'M' greentint -10.0677 1.3191 -5.4328 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 192 A}'M' green -10.6734 0.538 -4.8281 {"}'M' green -10.7161 0.7082 -5.2944 {"}'M' green -9.9468 0.968 -4.3724 {"}'M' green -10.2183 1.2691 -5.5725 {"}'M' green -9.9727 1.3953 -5.4075 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 192 A}'M' greentint -10.5155 0.5619 -4.6314 {"}'M' greentint -10.3574 0.6359 -4.4476 {"}'M' greentint -10.5698 0.6449 -5.0886 {"}'M' greentint -10.4126 0.6403 -4.8829 {"}'M' greentint -10.25 0.696 -4.6888 {"}'M' greentint -10.0922 0.8063 -4.5153 {"}'M' greentint -10.4863 0.8227 -5.3465 {"}'M' greentint -10.3383 0.7757 -5.142 {"}'M' greentint -10.1791 0.7982 -4.9415 {"}'M' greentint -10.0193 0.8867 -4.7605 {"}'M' greentint -9.8726 1.0363 -4.613 {"}'M' greentint -10.358 1.0345 -5.4981 {"}'M' greentint -10.2196 0.9577 -5.2965 {"}'M' greentint -10.0608 0.9687 -5.0956 {"}'M' greentint -9.9038 1.0645 -4.9183 {"}'M' greentint -9.7653 1.2351 -4.7868 {"}'M' greentint -10.0853 1.1655 -5.3723 {"}'M' greentint -9.9222 1.1947 -5.1697 {"}'M' greentint -9.7724 1.3484 -5.0188 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gln A 34 1qw2A_47F_36F}P -8.1661 5.0913 -12.5143 {"}-8.1661 5.0913 -12.5143 { ca gln A 34 1qw2A_47F_36F}-9.3805 5.1277 -11.7216 { c gln A 34 1qw2A_47F_36F}-9.0498 4.6525 -10.3135 { o gln A 34 1qw2A_47F_36F}-8.556 3.5372 -10.1325 { c gln A 34 1qw2A_47F_36F}P -9.0498 4.6525 -10.3135 { n phe A 35 1qw2A_47F_36F}-9.2787 5.5112 -9.3271 { ca phe A 35 1qw2A_47F_36F}-9.0423 5.1495 -7.9388 { c phe A 35 1qw2A_47F_36F}-10.3971 4.8468 -7.3206 { o phe A 35 1qw2A_47F_36F}-11.3438 5.6214 -7.4653 { c phe A 35 1qw2A_47F_36F}P -10.3971 4.8468 -7.3206 { n phe A 36 1qw2A_47F_36F}-10.4861 3.715 -6.637 { ca phe A 36 1qw2A_47F_36F}-11.7252 3.3154 -5.9956 { c phe A 36 1qw2A_47F_36F}-11.4657 2.9116 -4.556 { o phe A 36 1qw2A_47F_36F}-10.4612 2.2715 -4.2537 { c phe A 36 1qw2A_47F_36F}P -11.4657 2.9116 -4.556 { n lys A 37 1qw2A_47F_36F}-12.3657 3.3118 -3.6678 { ca lys A 37 1qw2A_47F_36F}-12.2764 2.9597 -2.259 { c lys A 37 1qw2A_47F_36F}-13.6897 2.754 -1.7496 { o lys A 37 1qw2A_47F_36F}-14.5751 3.5702 -1.9926 { c lys A 37 1qw2A_47F_36F}P -13.6897 2.754 -1.7496 { n ser A 38 1qw2A_47F_36F}-13.8995 1.6564 -1.0408 { ca ser A 38 1qw2A_47F_36F}-15.2121 1.3447 -0.5132 { c ser A 38 1qw2A_47F_36F}-15.0654 0.609 0.7987 { o ser A 38 1qw2A_47F_36F}-14.0408 -0.0301 1.0479 { n leu A 45 1qw2A_47F_36F}P -11.6741 -1.5721 0.9981 {"}-11.6741 -1.5721 0.9981 { ca leu A 45 1qw2A_47F_36F}-11.1958 -2.1242 -0.2557 { c leu A 45 1qw2A_47F_36F}-10.7943 -0.931 -1.1036 { o leu A 45 1qw2A_47F_36F}-11.5508 0.0295 -1.2222 { c leu A 45 1qw2A_47F_36F}P -10.7943 -0.931 -1.1036 { n leu A 46 1qw2A_47F_36F}-9.596 -0.9642 -1.6678 { ca leu A 46 1qw2A_47F_36F}-9.1841 0.1211 -2.5334 { c leu A 46 1qw2A_47F_36F}-8.2406 -0.37 -3.6061 { o leu A 46 1qw2A_47F_36F}-7.449 -1.2875 -3.3879 { c leu A 46 1qw2A_47F_36F}P -8.2406 -0.37 -3.6061 { n phe A 47 1qw2A_47F_36F}-8.3719 0.2249 -4.7844 { ca phe A 47 1qw2A_47F_36F}-7.5244 -0.1202 -5.9071 { c phe A 47 1qw2A_47F_36F}-7.347 1.0687 -6.8349 { o phe A 47 1qw2A_47F_36F}-8.0818 2.0565 -6.7524 { c phe A 47 1qw2A_47F_36F}P -7.347 1.0687 -6.8349 { n ile A 48 1qw2A_47F_36F}-6.3237 0.982 -7.6756 { ca ile A 48 1qw2A_47F_36F}-6.0272 1.9921 -8.6783 { c ile A 48 1qw2A_47F_36F}-5.9273 1.1906 -9.9686 { o ile A 48 1qw2A_47F_36F}-5.1292 0.2572 -10.0626 { c ile A 48 1qw2A_47F_36F}P -5.9273 1.1906 -9.9686 { n lys A 49 1qw2A_47F_36F}-6.7357 1.5445 -10.9561 { ca lys A 49 1qw2A_47F_36F}-6.7219 0.8086 -12.2098 { c lys A 49 1qw2A_47F_36F}-6.377 1.6564 -13.4203 { o lys A 49 1qw2A_47F_36F}-6.9023 2.7544 -13.5994 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gln A 34 1qw2A_47F_36F}P -8.1661 5.0913 -12.5143 { ca gln A 34 1qw2A_47F_36F}P -9.3805 5.1277 -11.7216 { n phe A 35 1qw2A_47F_36F}P -9.2787 5.5112 -9.3271 { ca phe A 35 1qw2A_47F_36F}P -9.0423 5.1495 -7.9388 { n phe A 36 1qw2A_47F_36F}P -10.4861 3.715 -6.637 { ca phe A 36 1qw2A_47F_36F}P -11.7252 3.3154 -5.9956 { n lys A 37 1qw2A_47F_36F}P -12.3657 3.3118 -3.6678 { ca lys A 37 1qw2A_47F_36F}P -12.2764 2.9597 -2.259 { n ser A 38 1qw2A_47F_36F}P -13.8995 1.6564 -1.0408 { ca ser A 38 1qw2A_47F_36F}P -15.2121 1.3447 -0.5132 { n leu A 45 1qw2A_47F_36F}P -11.6741 -1.5721 0.9981 { ca leu A 45 1qw2A_47F_36F}P -11.1958 -2.1242 -0.2557 { n leu A 46 1qw2A_47F_36F}P -9.596 -0.9642 -1.6678 { ca leu A 46 1qw2A_47F_36F}P -9.1841 0.1211 -2.5334 { n phe A 47 1qw2A_47F_36F}P -8.3719 0.2249 -4.7844 { ca phe A 47 1qw2A_47F_36F}P -7.5244 -0.1202 -5.9071 { n ile A 48 1qw2A_47F_36F}P -6.3237 0.982 -7.6756 { ca ile A 48 1qw2A_47F_36F}P -6.0272 1.9921 -8.6783 { n lys A 49 1qw2A_47F_36F}P -6.7357 1.5445 -10.9561 { ca lys A 49 1qw2A_47F_36F}P -6.7219 0.8086 -12.2098 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gln A 34 1qw2A_47F_36F}P -9.3805 5.1277 -11.7216 {"}-9.3805 5.1277 -11.7216 { ca phe A 35 1qw2A_47F_36F}-9.0423 5.1495 -7.9388 { ca phe A 36 1qw2A_47F_36F}-11.7252 3.3154 -5.9956 { ca lys A 37 1qw2A_47F_36F}-12.2764 2.9597 -2.259 { ca ser A 38 1qw2A_47F_36F}-15.2121 1.3447 -0.5132 { ca leu A 45 1qw2A_47F_36F}P -11.1958 -2.1242 -0.2557 {"}-11.1958 -2.1242 -0.2557 { ca leu A 46 1qw2A_47F_36F}-9.1841 0.1211 -2.5334 { ca phe A 47 1qw2A_47F_36F}-7.5244 -0.1202 -5.9071 { ca ile A 48 1qw2A_47F_36F}-6.0272 1.9921 -8.6783 { ca lys A 49 1qw2A_47F_36F}-6.7219 0.8086 -12.2098 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 36 1qw2A_47F_36F}P -11.7252 3.3154 -5.9956 { cb phe A 36 1qw2A_47F_36F}-12.3577 2.1405 -6.756 { cg phe A 36 1qw2A_47F_36F}-13.5831 1.5715 -6.0949 { cd1 phe A 36 1qw2A_47F_36F}-13.4848 0.4895 -5.2179 { ce1 phe A 36 1qw2A_47F_36F}-14.6254 -0.0386 -4.6057 { cz phe A 36 1qw2A_47F_36F}-15.87 0.5172 -4.8683 { cg phe A 36 1qw2A_47F_36F}P -13.5831 1.5715 -6.0949 { cd2 phe A 36 1qw2A_47F_36F}-14.8372 2.1172 -6.3477 { ce2 phe A 36 1qw2A_47F_36F}-15.9753 1.5978 -5.7425 { cz phe A 36 1qw2A_47F_36F}ghost -15.87 0.5172 -4.8683 { ca phe A 47 1qw2A_47F_36F}P -7.5244 -0.1202 -5.9071 { cb phe A 47 1qw2A_47F_36F}-8.1052 -1.3305 -6.6794 { cg phe A 47 1qw2A_47F_36F}-9.4093 -1.058 -7.3995 { cd1 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-9.6404 1.1964 -4.2177 {"}'M' greentint -9.7447 1.3516 -4.3955 {"}'M' greentint -9.9046 1.2546 -4.5749 {"}'M' greentint -10.015 1.1553 -4.8552 {"}'M' greentint -9.4794 1.4676 -4.2509 {"}'M' greentint -9.6112 1.5694 -4.449 {"}'M' greentint -9.7722 1.5413 -4.649 {"}'M' greentint -9.9202 1.3894 -4.7979 {"}'M' greentint -9.2878 1.6444 -4.3148 {"}'M' greentint -9.4227 1.7393 -4.5157 {"}'M' greentint -9.5816 1.7424 -4.7216 {"}'M' greentint -9.7419 1.6513 -4.9044 {"}'M' greentint -9.8833 1.4808 -5.04 {"}'M' greentint -9.1742 1.8385 -4.566 {"}'M' greentint -9.3259 1.874 -4.7712 {"}'M' greentint -9.4872 1.8348 -4.969 {"}'M' greentint -9.6438 1.7227 -5.1404 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 36 A}'M' green -10.0402 1.0383 -4.7655 {"}'M' green -9.4172 1.3614 -4.0493 {"}'M' green -9.2193 1.6295 -4.1852 {"}'M' green -9.1328 1.852 -4.3928 {"}'M' green -9.6886 1.6624 -5.2495 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 36 A}'M' greentint -9.883 1.0337 -4.5599 {"}'M' greentint -9.7204 1.0894 -4.3657 {"}'M' greentint -9.5626 1.1996 -4.1923 {"}'M' greentint -9.9566 1.2161 -5.0234 {"}'M' greentint -9.8086 1.1691 -4.819 {"}'M' greentint -9.6494 1.1915 -4.6185 {"}'M' greentint -9.4897 1.2801 -4.4375 {"}'M' greentint -9.343 1.4297 -4.2899 {"}'M' greentint -9.8284 1.4278 -5.175 {"}'M' greentint -9.69 1.351 -4.9735 {"}'M' greentint -9.5312 1.362 -4.7726 {"}'M' greentint -9.3741 1.4579 -4.5952 {"}'M' greentint -9.2357 1.6285 -4.4637 {"}'M' greentint -9.5557 1.5589 -5.0492 {"}'M' greentint -9.3925 1.5881 -4.8466 {"}'M' greentint -9.2428 1.7418 -4.6958 {"}'M' greentint -9.443 1.7887 -5.0844 {"}'M' greentint -9.2843 1.886 -4.9068 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 67 1qwhA_95F_69Y}P -8.0355 5.5514 -12.2459 {"}-8.0355 5.5514 -12.2459 { ca gly A 67 1qwhA_95F_69Y}-8.343 6.2381 -11.027 { c gly A 67 1qwhA_95F_69Y}-8.1157 5.3493 -9.8162 { o gly A 67 1qwhA_95F_69Y}-7.7793 4.173 -9.9936 { c gly A 67 1qwhA_95F_69Y}P -8.1157 5.3493 -9.8162 { n ile A 68 1qwhA_95F_69Y}-8.2862 5.9197 -8.6397 { ca ile A 68 1qwhA_95F_69Y}-8.3079 5.1577 -7.3899 { c ile A 68 1qwhA_95F_69Y}-9.7712 4.9744 -7.0291 { o ile A 68 1qwhA_95F_69Y}-10.5422 5.9401 -6.9243 { c ile A 68 1qwhA_95F_69Y}P -9.7712 4.9744 -7.0291 { n tyr A 69 1qwhA_95F_69Y}-10.137 3.7136 -6.85 { ca tyr A 69 1qwhA_95F_69Y}-11.4926 3.3178 -6.5345 { c tyr A 69 1qwhA_95F_69Y}-11.5827 2.6874 -5.1705 { o tyr A 69 1qwhA_95F_69Y}-10.6223 2.048 -4.6808 { c tyr A 69 1qwhA_95F_69Y}P -11.5827 2.6874 -5.1705 { n lys A 70 1qwhA_95F_69Y}-12.7303 2.8575 -4.5324 { ca lys A 70 1qwhA_95F_69Y}-13.0114 2.2072 -3.261 { c lys A 70 1qwhA_95F_69Y}-14.2787 1.4417 -3.3881 { o lys A 70 1qwhA_95F_69Y}-15.3277 1.9788 -3.7773 { c lys A 70 1qwhA_95F_69Y}P -14.2787 1.4417 -3.3881 { n val A 71 1qwhA_95F_69Y}-14.2295 0.1582 -3.0483 { ca val A 71 1qwhA_95F_69Y}-15.4021 -0.7023 -3.0192 { c val A 71 1qwhA_95F_69Y}-15.7572 -0.9556 -1.567 { o val A 71 1qwhA_95F_69Y}-14.9731 -1.6052 -0.8494 { n val A 93 1qwhA_95F_69Y}P -12.2745 -1.9888 -0.0162 {"}-12.2745 -1.9888 -0.0162 { ca val A 93 1qwhA_95F_69Y}-11.2287 -2.4672 -0.8955 { c val A 93 1qwhA_95F_69Y}-10.8132 -1.2652 -1.7555 { o val A 93 1qwhA_95F_69Y}-11.673 -0.7075 -2.4684 { c val A 93 1qwhA_95F_69Y}P -10.8132 -1.2652 -1.7555 { n val A 94 1qwhA_95F_69Y}-9.5919 -0.7876 -1.6512 { ca val A 94 1qwhA_95F_69Y}-9.1345 0.4417 -2.303 { c val A 94 1qwhA_95F_69Y}-7.9946 0.1149 -3.2576 { o val A 94 1qwhA_95F_69Y}-7.0268 -0.563 -2.8754 { c val A 94 1qwhA_95F_69Y}P -7.9946 0.1149 -3.2576 { n phe A 95 1qwhA_95F_69Y}-8.053 0.5873 -4.5013 { ca phe A 95 1qwhA_95F_69Y}-7.1268 0.1098 -5.5273 { c phe A 95 1qwhA_95F_69Y}-7.0798 1.101 -6.6804 { o phe A 95 1qwhA_95F_69Y}-8.071 1.7678 -6.957 { c phe A 95 1qwhA_95F_69Y}P -7.0798 1.101 -6.6804 { n thr A 96 1qwhA_95F_69Y}-5.9459 1.1723 -7.3377 { ca thr A 96 1qwhA_95F_69Y}-5.8371 1.8984 -8.5885 { c thr A 96 1qwhA_95F_69Y}-6.2583 0.9759 -9.7038 { o thr A 96 1qwhA_95F_69Y}-5.8641 -0.1798 -9.771 { c thr A 96 1qwhA_95F_69Y}P -6.2583 0.9759 -9.7038 { n ala A 97 1qwhA_95F_69Y}-7.0572 1.4969 -10.6207 { ca ala A 97 1qwhA_95F_69Y}-7.5585 0.6914 -11.7304 { c ala A 97 1qwhA_95F_69Y}-7.1817 1.3162 -13.0309 { o ala A 97 1qwhA_95F_69Y}-7.1218 2.5502 -13.147 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 67 1qwhA_95F_69Y}P -8.0355 5.5514 -12.2459 { ca gly A 67 1qwhA_95F_69Y}P -8.343 6.2381 -11.027 {"}P -8.343 6.2381 -11.027 { n ile A 68 1qwhA_95F_69Y}P -8.2862 5.9197 -8.6397 { ca ile A 68 1qwhA_95F_69Y}P -8.3079 5.1577 -7.3899 { n tyr A 69 1qwhA_95F_69Y}P -10.137 3.7136 -6.85 { ca tyr A 69 1qwhA_95F_69Y}P -11.4926 3.3178 -6.5345 { n lys A 70 1qwhA_95F_69Y}P -12.7303 2.8575 -4.5324 { ca lys A 70 1qwhA_95F_69Y}P -13.0114 2.2072 -3.261 { n val A 71 1qwhA_95F_69Y}P -14.2295 0.1582 -3.0483 { ca val A 71 1qwhA_95F_69Y}P -15.4021 -0.7023 -3.0192 { n val A 93 1qwhA_95F_69Y}P -12.2745 -1.9888 -0.0162 { ca val A 93 1qwhA_95F_69Y}P -11.2287 -2.4672 -0.8955 { n val A 94 1qwhA_95F_69Y}P -9.5919 -0.7876 -1.6512 { ca val A 94 1qwhA_95F_69Y}P -9.1345 0.4417 -2.303 { n phe A 95 1qwhA_95F_69Y}P -8.053 0.5873 -4.5013 { ca phe A 95 1qwhA_95F_69Y}P -7.1268 0.1098 -5.5273 { n thr A 96 1qwhA_95F_69Y}P -5.9459 1.1723 -7.3377 { ca thr A 96 1qwhA_95F_69Y}P -5.8371 1.8984 -8.5885 { n ala A 97 1qwhA_95F_69Y}P -7.0572 1.4969 -10.6207 { ca ala A 97 1qwhA_95F_69Y}P -7.5585 0.6914 -11.7304 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 67 1qwhA_95F_69Y}P -8.343 6.2381 -11.027 {"}-8.343 6.2381 -11.027 { ca ile A 68 1qwhA_95F_69Y}-8.3079 5.1577 -7.3899 { ca tyr A 69 1qwhA_95F_69Y}-11.4926 3.3178 -6.5345 { ca lys A 70 1qwhA_95F_69Y}-13.0114 2.2072 -3.261 { ca val A 71 1qwhA_95F_69Y}-15.4021 -0.7023 -3.0192 { ca val A 93 1qwhA_95F_69Y}P -11.2287 -2.4672 -0.8955 {"}-11.2287 -2.4672 -0.8955 { ca val A 94 1qwhA_95F_69Y}-9.1345 0.4417 -2.303 { ca phe A 95 1qwhA_95F_69Y}-7.1268 0.1098 -5.5273 { ca thr A 96 1qwhA_95F_69Y}-5.8371 1.8984 -8.5885 { ca ala A 97 1qwhA_95F_69Y}-7.5585 0.6914 -11.7304 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 69 1qwhA_95F_69Y}P -11.4926 3.3178 -6.5345 { cb tyr A 69 1qwhA_95F_69Y}-12.0138 2.3371 -7.5955 { cg tyr A 69 1qwhA_95F_69Y}-12.1992 3.0043 -8.9445 { cd1 tyr A 69 1qwhA_95F_69Y}-11.1522 3.1257 -9.8378 { ce1 tyr A 69 1qwhA_95F_69Y}-11.3303 3.7698 -11.0793 { cz tyr A 69 1qwhA_95F_69Y}-12.5853 4.2272 -11.4071 { oh tyr A 69 1qwhA_95F_69Y}-12.7743 4.8638 -12.6327 { cg tyr A 69 1qwhA_95F_69Y}P -12.1992 3.0043 -8.9445 { cd2 tyr A 69 1qwhA_95F_69Y}-13.4595 3.5117 -9.3098 { ce2 tyr A 69 1qwhA_95F_69Y}-13.6609 4.1455 -10.5363 { cz tyr A 69 1qwhA_95F_69Y}ghost -12.5853 4.2272 -11.4071 { ca phe A 95 1qwhA_95F_69Y}P -7.1268 0.1098 -5.5273 { cb phe A 95 1qwhA_95F_69Y}-7.4966 -1.2831 -6.0719 { cg phe A 95 1qwhA_95F_69Y}-8.8408 -1.3676 -6.668 { cd1 phe A 95 1qwhA_95F_69Y}-9.9474 -1.5482 -5.8494 { ce1 phe A 95 1qwhA_95F_69Y}-11.2143 -1.6563 -6.391 { cz phe A 95 1qwhA_95F_69Y}-11.3844 -1.6051 -7.7134 { cg phe A 95 1qwhA_95F_69Y}P -8.8408 -1.3676 -6.668 { cd2 phe A 95 1qwhA_95F_69Y}-9.0041 -1.337 -8.0414 { ce2 phe A 95 1qwhA_95F_69Y}-10.3135 -1.464 -8.5717 { cz phe A 95 1qwhA_95F_69Y}ghost -11.3844 -1.6051 -7.7134 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 69 1qwhA_95F_69Y}P -12.0138 2.3371 -7.5955 {"}P -12.0138 2.3371 -7.5955 { cd1 tyr A 69 1qwhA_95F_69Y}P -11.1522 3.1257 -9.8378 { cd2 tyr A 69 1qwhA_95F_69Y}P -13.4595 3.5117 -9.3098 { ce1 tyr A 69 1qwhA_95F_69Y}P -11.3303 3.7698 -11.0793 { ce2 tyr A 69 1qwhA_95F_69Y}P -13.6609 4.1455 -10.5363 { oh tyr A 69 1qwhA_95F_69Y}P -12.7743 4.8638 -12.6327 { cb phe A 95 1qwhA_95F_69Y}P -7.4966 -1.2831 -6.0719 {"}P -7.4966 -1.2831 -6.0719 { cd1 phe A 95 1qwhA_95F_69Y}P -9.9474 -1.5482 -5.8494 { cd2 phe A 95 1qwhA_95F_69Y}P -9.0041 -1.337 -8.0414 { ce1 phe A 95 1qwhA_95F_69Y}P -11.2143 -1.6563 -6.391 { ce2 phe A 95 1qwhA_95F_69Y}P -10.3135 -1.464 -8.5717 { cz phe A 95 1qwhA_95F_69Y}P -11.3844 -1.6051 -7.7134 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 95 A}'S' sky -10.9513 0.0671 -8.014 {"}'S' blue -11.1123 0.0521 -8.217 {"}'S' blue -10.5466 0.1185 -7.8623 {"}'S' sky -10.6945 0.1684 -8.0673 {"}'S' sky -10.8504 0.1739 -8.2714 {"}'S' blue -11.0108 0.1377 -8.4687 {"}'S' blue -10.416 0.222 -8.1141 {"}'S' blue -10.5679 0.2492 -8.3176 {"}'S' blue -10.7255 0.2361 -8.5182 { CZ PHE 95 A}'S' sky -11.4869 0.081 -7.2557 {"}'S' sky -11.6388 0.1081 -7.4593 {"}'S' sky -11.7964 0.095 -7.6598 {"}'S' blue -11.1482 0.0589 -7.2253 {"}'S' blue -11.7771 0.0686 -8.0409 {"}'S' sky -10.9667 0.0698 -7.4223 {"}'S' sky -11.4349 0.1136 -8.0396 {"}'S' blue -11.5985 0.0522 -8.2339 {"}'S' blue -10.7579 0.0229 -7.5739 {"}'S' sky -10.9066 0.0767 -7.7808 {"}'S' sky -11.0642 0.0939 -7.9882 {"}'S' sky -11.2259 0.0709 -8.1921 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 95 A}'S' sea -11.295 0.1197 -7.433 {"}'S' sea -11.4516 0.1427 -7.6403 {"}'S' sea -11.6132 0.1253 -7.8452 {"}'S' sea -11.1158 0.1228 -7.6296 {"}'S' sea -11.2727 0.1371 -7.8371 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 69 A}'S' sky -11.8077 0.4433 -7.6162 {"}'S' sky -11.6557 0.4176 -7.4129 {"}'S' blue -11.4963 0.448 -7.2157 {"}'S' blue -11.784 0.4836 -8.0288 {"}'S' sky -11.6533 0.3892 -7.8337 {"}'S' sky -11.1918 0.424 -7.2468 {"}'S' sky -11.5385 0.4371 -8.1304 {"}'S' blue -10.9322 0.447 -7.3484 {"}'S' sky -11.2333 0.4186 -8.1397 {"}'S' sky -11.086 0.3756 -7.9371 {"}'S' sky -10.9279 0.3934 -7.7386 {"}'S' blue -10.9896 0.4997 -8.2147 {"}'S' sky -10.8338 0.4754 -8.0065 {"}'S' blue -10.6706 0.5244 -7.8099 {"}'S' blue -10.7502 0.6323 -8.2493 {"}'S' blue -10.5939 0.6431 -8.0501 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 69 A}'S' sea -11.506 0.3475 -7.6314 {"}'S' sea -11.3504 0.3595 -7.4336 {"}'S' sea -11.402 0.3558 -7.9303 {"}'S' sea -11.2496 0.3308 -7.7266 {"}'S' sea -11.0902 0.3612 -7.5294 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 95 A}'M' greentint -9.3867 2.0525 -6.5731 {"}'M' greentint -9.1444 2.4481 -6.3698 {"}'M' greentint -9.293 2.2912 -6.5183 {"}'M' greentint -9.3967 2.1948 -6.8158 {"}'M' greentint -8.8372 2.6866 -6.23 {"}'M' greentint -8.9951 2.6783 -6.432 {"}'M' greentint -9.1537 2.5851 -6.6104 {"}'M' greentint -9.293 2.4171 -6.7436 {"}'M' greentint -9.3663 2.2889 -7.0606 {"}'M' greentint -9.4375 2.0437 -7.0848 {"}'M' greentint -8.8082 2.8674 -6.4999 {"}'M' greentint -8.9684 2.8091 -6.6919 {"}'M' greentint -9.1231 2.6861 -6.8565 {"}'M' greentint -9.2589 2.5085 -6.9827 {"}'M' greentint -9.2884 2.3691 -7.2989 {"}'M' greentint -9.3696 2.1259 -7.3372 {"}'M' greentint -8.7254 2.9874 -6.744 {"}'M' greentint -8.8875 2.9052 -6.9296 {"}'M' greentint -9.0397 2.7692 -7.0896 {"}'M' greentint -9.1764 2.5876 -7.2144 {"}'M' greentint -9.1739 2.4138 -7.5285 {"}'M' greentint -8.6306 3.0502 -7.0029 {"}'M' greentint -8.7864 2.9514 -7.1763 {"}'M' greentint -8.9325 2.8079 -7.3262 {"}'M' greentint -9.0633 2.6259 -7.4446 {"}'M' greentint -8.6307 2.9787 -7.3815 {"}'M' greentint -8.7773 2.8316 -7.5313 {"}'M' greentint -8.9094 2.6487 -7.6513 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 69 A}'M' greentint -9.3062 2.0938 -6.4333 {"}'M' greentint -9.1649 2.2446 -6.2917 {"}'M' greentint -9.3504 1.9566 -6.8811 {"}'M' greentint -9.1922 2.0203 -6.6948 {"}'M' greentint -9.042 2.1447 -6.5349 {"}'M' greentint -8.9089 2.3203 -6.4119 {"}'M' greentint -8.8036 2.535 -6.3341 {"}'M' greentint -8.7302 2.7748 -6.3072 {"}'M' greentint -9.2999 2.0156 -7.2321 {"}'M' greentint -9.1417 2.0178 -7.0284 {"}'M' greentint -8.981 2.0938 -6.8415 {"}'M' greentint -8.8315 2.2391 -6.6891 {"}'M' greentint -8.7069 2.4391 -6.5833 {"}'M' greentint -8.6183 2.6767 -6.5352 {"}'M' greentint -8.5738 2.9314 -6.5479 {"}'M' greentint -9.1967 2.1783 -7.4871 {"}'M' greentint -9.048 2.1286 -7.281 {"}'M' greentint -8.8856 2.1735 -7.0831 {"}'M' greentint -8.7314 2.3061 -6.9214 {"}'M' greentint -8.6072 2.5095 -6.8168 {"}'M' greentint -8.5289 2.7552 -6.7846 {"}'M' greentint -8.5079 3.0106 -6.8279 {"}'M' greentint -9.0687 2.4138 -7.6496 {"}'M' greentint -8.937 2.3121 -7.4515 {"}'M' greentint -8.776 2.3402 -7.2515 {"}'M' greentint -8.6279 2.4921 -7.1026 {"}'M' greentint -8.5331 2.7262 -7.0453 {"}'M' greentint -8.5168 2.9799 -7.0946 {"}'M' greentint -8.8035 2.5299 -7.505 {"}'M' greentint -8.6435 2.6269 -7.3256 {"}'M' greentint -8.5886 2.8801 -7.3254 {"}'M' greentint -8.7218 2.7765 -7.5248 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 95 A}'M' green -9.6246 1.0358 -4.4977 {"}'M' green -9.2711 1.9089 -4.2839 {"}'M' green -9.6385 1.1643 -5.1579 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 95 A}'M' greentint -9.4862 1.4445 -4.2105 {"}'M' greentint -9.6195 1.3409 -4.41 {"}'M' greentint -9.4046 1.6911 -4.2303 {"}'M' greentint -9.5645 1.5942 -4.4098 {"}'M' greentint -9.6749 1.4948 -4.69 {"}'M' greentint -9.6912 1.2411 -4.6407 {"}'M' greentint -9.4321 1.8809 -4.4838 {"}'M' greentint -9.5801 1.7289 -4.6327 {"}'M' greentint -9.6466 1.5922 -4.9436 {"}'M' greentint -9.697 1.3376 -4.939 {"}'M' greentint -9.6883 1.0897 -4.8586 {"}'M' greentint -9.2415 2.082 -4.5564 {"}'M' greentint -9.4018 1.9909 -4.7393 {"}'M' greentint -9.5432 1.8204 -4.8748 {"}'M' greentint -9.5498 1.6665 -5.1836 {"}'M' greentint -9.6181 1.4175 -5.2013 {"}'M' greentint -9.3037 2.0623 -4.9752 {"}'M' greentint -9.4423 1.8876 -5.106 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 69 A}'M' green -9.4764 1.5099 -4.0838 {"}'M' green -9.7236 0.9761 -4.6194 {"}'M' green -9.2266 2.1412 -4.6179 {"}'M' green -9.6922 1.1385 -5.1997 {"}'M' green -9.2397 2.1251 -4.8884 {"}'M' green -9.39 1.9138 -5.3328 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 69 A}'M' greentint -9.5782 1.1378 -4.4764 {"}'M' greentint -9.4536 1.3402 -4.3728 {"}'M' greentint -9.3572 1.5733 -4.313 {"}'M' greentint -9.2934 1.8251 -4.3004 {"}'M' greentint -9.6508 1.0566 -4.8646 {"}'M' greentint -9.504 1.2062 -4.717 {"}'M' greentint -9.3803 1.4059 -4.6123 {"}'M' greentint -9.2885 1.6401 -4.559 {"}'M' greentint -9.2365 1.891 -4.5606 {"}'M' greentint -9.5352 1.2344 -5.0223 {"}'M' greentint -9.3967 1.4049 -4.8908 {"}'M' greentint -9.2938 1.6284 -4.8199 {"}'M' greentint -9.2394 1.8781 -4.8196 {"}'M' greentint -9.5536 1.3646 -5.2737 {"}'M' greentint -9.4038 1.5183 -5.1229 {"}'M' greentint -9.3085 1.7546 -5.0654 {"}'M' greentint -9.2921 2.0111 -5.1152 {"}'M' greentint -9.4454 1.6625 -5.3339 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 9 1r0uA_26F_11V}P -7.5069 6.0928 -11.9701 {"}-7.5069 6.0928 -11.9701 { ca leu A 9 1r0uA_26F_11V}-8.6371 5.9366 -11.0525 { c leu A 9 1r0uA_26F_11V}-8.2527 5.3123 -9.7319 { o leu A 9 1r0uA_26F_11V}-7.3615 4.4675 -9.6812 { c leu A 9 1r0uA_26F_11V}P -8.2527 5.3123 -9.7319 { n his A 10 1r0uA_26F_11V}-8.9507 5.7249 -8.6713 { ca his A 10 1r0uA_26F_11V}-8.789 5.1729 -7.3298 { c his A 10 1r0uA_26F_11V}-10.1967 4.9316 -6.8098 { o his A 10 1r0uA_26F_11V}-11.0025 5.8631 -6.7464 { c his A 10 1r0uA_26F_11V}P -10.1967 4.9316 -6.8098 { n val A 11 1r0uA_26F_11V}-10.5205 3.69 -6.4733 { ca val A 11 1r0uA_26F_11V}-11.8717 3.3727 -6.0005 { c val A 11 1r0uA_26F_11V}-11.7291 2.8322 -4.5971 { o val A 11 1r0uA_26F_11V}-11.0347 1.8547 -4.3989 { c val A 11 1r0uA_26F_11V}P -11.7291 2.8322 -4.5971 { n lys A 12 1r0uA_26F_11V}-12.3709 3.4612 -3.6288 { ca lys A 12 1r0uA_26F_11V}-12.1445 3.0981 -2.2299 { c lys A 12 1r0uA_26F_11V}-13.4647 2.8526 -1.5706 { o lys A 12 1r0uA_26F_11V}-14.3622 3.6741 -1.7031 { c lys A 12 1r0uA_26F_11V}P -13.4647 2.8526 -1.5706 { n ser A 13 1r0uA_26F_11V}-13.6033 1.7263 -0.869 { ca ser A 13 1r0uA_26F_11V}-14.8491 1.4271 -0.1622 { c ser A 13 1r0uA_26F_11V}-14.5599 1.122 1.2939 { o ser A 13 1r0uA_26F_11V}-13.6811 0.3163 1.6109 { n ile A 24 1r0uA_26F_11V}P -11.3581 -1.3492 1.3963 {"}-11.3581 -1.3492 1.3963 { ca ile A 24 1r0uA_26F_11V}-10.8413 -1.9549 0.1732 { c ile A 24 1r0uA_26F_11V}-10.6724 -0.8713 -0.8909 { o ile A 24 1r0uA_26F_11V}-11.5269 0.0223 -1.0511 { c ile A 24 1r0uA_26F_11V}P -10.6724 -0.8713 -0.8909 { n glu A 25 1r0uA_26F_11V}-9.5319 -0.8874 -1.5601 { ca glu A 25 1r0uA_26F_11V}-9.2901 0.0831 -2.5944 { c glu A 25 1r0uA_26F_11V}-8.5338 -0.517 -3.7512 { o glu A 25 1r0uA_26F_11V}-7.7593 -1.4858 -3.601 { c glu A 25 1r0uA_26F_11V}P -8.5338 -0.517 -3.7512 { n phe A 26 1r0uA_26F_11V}-8.811 0.0216 -4.9177 { ca phe A 26 1r0uA_26F_11V}-8.0584 -0.3774 -6.0811 { c phe A 26 1r0uA_26F_11V}-7.7146 0.8052 -6.9525 { o phe A 26 1r0uA_26F_11V}-8.3261 1.8756 -6.8672 { c phe A 26 1r0uA_26F_11V}P -7.7146 0.8052 -6.9525 { n arg A 27 1r0uA_26F_11V}-6.691 0.5914 -7.7605 { ca arg A 27 1r0uA_26F_11V}-6.1894 1.5884 -8.6643 { c arg A 27 1r0uA_26F_11V}-5.9679 0.9637 -10.0253 { o arg A 27 1r0uA_26F_11V}-5.5045 -0.186 -10.1685 { c arg A 27 1r0uA_26F_11V}P -5.9679 0.9637 -10.0253 { n thr A 28 1r0uA_26F_11V}-6.3366 1.7169 -11.0497 { ca thr A 28 1r0uA_26F_11V}-6.129 1.2801 -12.4127 { c thr A 28 1r0uA_26F_11V}-6.2632 2.4928 -13.3156 { o thr A 28 1r0uA_26F_11V}-6.4306 3.5992 -12.8195 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 9 1r0uA_26F_11V}P -7.5069 6.0928 -11.9701 { ca leu A 9 1r0uA_26F_11V}P -8.6371 5.9366 -11.0525 { n his A 10 1r0uA_26F_11V}P -8.9507 5.7249 -8.6713 { ca his A 10 1r0uA_26F_11V}P -8.789 5.1729 -7.3298 { n val A 11 1r0uA_26F_11V}P -10.5205 3.69 -6.4733 { ca val A 11 1r0uA_26F_11V}P -11.8717 3.3727 -6.0005 { n lys A 12 1r0uA_26F_11V}P -12.3709 3.4612 -3.6288 { ca lys A 12 1r0uA_26F_11V}P -12.1445 3.0981 -2.2299 { n ser A 13 1r0uA_26F_11V}P -13.6033 1.7263 -0.869 { ca ser A 13 1r0uA_26F_11V}P -14.8491 1.4271 -0.1622 { n ile A 24 1r0uA_26F_11V}P -11.3581 -1.3492 1.3963 { ca ile A 24 1r0uA_26F_11V}P -10.8413 -1.9549 0.1732 { n glu A 25 1r0uA_26F_11V}P -9.5319 -0.8874 -1.5601 { ca glu A 25 1r0uA_26F_11V}P -9.2901 0.0831 -2.5944 { n phe A 26 1r0uA_26F_11V}P -8.811 0.0216 -4.9177 { ca phe A 26 1r0uA_26F_11V}P -8.0584 -0.3774 -6.0811 { n arg A 27 1r0uA_26F_11V}P -6.691 0.5914 -7.7605 { ca arg A 27 1r0uA_26F_11V}P -6.1894 1.5884 -8.6643 { n thr A 28 1r0uA_26F_11V}P -6.3366 1.7169 -11.0497 { ca thr A 28 1r0uA_26F_11V}P -6.129 1.2801 -12.4127 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 9 1r0uA_26F_11V}P -8.6371 5.9366 -11.0525 {"}-8.6371 5.9366 -11.0525 { ca his A 10 1r0uA_26F_11V}-8.789 5.1729 -7.3298 { ca val A 11 1r0uA_26F_11V}-11.8717 3.3727 -6.0005 { ca lys A 12 1r0uA_26F_11V}-12.1445 3.0981 -2.2299 { ca ser A 13 1r0uA_26F_11V}-14.8491 1.4271 -0.1622 { ca ile A 24 1r0uA_26F_11V}P -10.8413 -1.9549 0.1732 {"}-10.8413 -1.9549 0.1732 { ca glu A 25 1r0uA_26F_11V}-9.2901 0.0831 -2.5944 { ca phe A 26 1r0uA_26F_11V}-8.0584 -0.3774 -6.0811 { ca arg A 27 1r0uA_26F_11V}-6.1894 1.5884 -8.6643 { ca thr A 28 1r0uA_26F_11V}-6.129 1.2801 -12.4127 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 11 1r0uA_26F_11V}P -11.8717 3.3727 -6.0005 { cb val A 11 1r0uA_26F_11V}-12.5344 2.3307 -6.8667 { cg1 val A 11 1r0uA_26F_11V}-13.8992 1.9864 -6.3021 { cb val A 11 1r0uA_26F_11V}P -12.5344 2.3307 -6.8667 { cg2 val A 11 1r0uA_26F_11V}-12.6462 2.809 -8.3351 { ca phe A 26 1r0uA_26F_11V}P -8.0584 -0.3774 -6.0811 { cb phe A 26 1r0uA_26F_11V}-8.6998 -1.5457 -6.8466 { cg phe A 26 1r0uA_26F_11V}-9.9376 -1.2023 -7.6119 { cd1 phe A 26 1r0uA_26F_11V}-9.862 -0.6068 -8.8543 { ce1 phe A 26 1r0uA_26F_11V}-10.9903 -0.3147 -9.5661 { cz phe A 26 1r0uA_26F_11V}-12.2376 -0.6479 -9.0621 { cg phe A 26 1r0uA_26F_11V}P -9.9376 -1.2023 -7.6119 { cd2 phe A 26 1r0uA_26F_11V}-11.1858 -1.5395 -7.1066 { ce2 phe A 26 1r0uA_26F_11V}-12.3413 -1.2513 -7.8204 { cz phe A 26 1r0uA_26F_11V}ghost -12.2376 -0.6479 -9.0621 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A 11 1r0uA_26F_11V}P -12.5344 2.3307 -6.8667 { cg1 val A 11 1r0uA_26F_11V}P -13.8992 1.9864 -6.3021 {"}P -13.8992 1.9864 -6.3021 {"}P -13.8992 1.9864 -6.3021 { cg2 val A 11 1r0uA_26F_11V}P -12.6462 2.809 -8.3351 {"}P -12.6462 2.809 -8.3351 {"}P -12.6462 2.809 -8.3351 { cb phe A 26 1r0uA_26F_11V}P -8.6998 -1.5457 -6.8466 {"}P -8.6998 -1.5457 -6.8466 { cd1 phe A 26 1r0uA_26F_11V}P -9.862 -0.6068 -8.8543 { cd2 phe A 26 1r0uA_26F_11V}P -11.1858 -1.5395 -7.1066 { ce1 phe A 26 1r0uA_26F_11V}P -10.9903 -0.3147 -9.5661 { ce2 phe A 26 1r0uA_26F_11V}P -12.3413 -1.2513 -7.8204 { cz phe A 26 1r0uA_26F_11V}P -12.2376 -0.6479 -9.0621 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 26 A}'S' blue -10.8992 0.2512 -7.45 { CD2 PHE 26 A}'S' blue -11.6706 -0.0426 -6.3405 {"}'S' sky -11.8236 -0.0084 -6.5489 {"}'S' blue -11.4189 0.0431 -6.3972 {"}'S' sky -11.2883 0.1466 -6.6489 {"}'S' sky -11.0964 0.1853 -6.8262 {"}'S' blue -11.0741 0.2027 -7.2303 {"}'S' blue -11.2363 0.1792 -7.4329 { CE1 PHE 26 A}'S' blue -11.2822 0.4927 -8.0406 {"}'S' blue -11.3477 0.6959 -8.1833 {"}'S' blue -11.5659 0.9851 -8.5459 {"}'S' sky -11.7082 1.0555 -8.7478 {"}'S' sky -11.8625 1.0731 -8.9525 {"}'S' blue -11.3352 1.1012 -8.5971 {"}'S' sky -11.4751 1.1821 -8.8 {"}'S' sky -11.6281 1.2163 -9.0083 {"}'S' sky -11.7892 1.2014 -9.2114 {"}'S' blue -11.952 1.1387 -9.4042 {"}'S' blue -12.1106 1.0297 -9.579 {"}'S' blue -11.2235 1.2678 -8.8567 {"}'S' sky -11.3714 1.3176 -9.0617 {"}'S' sky -11.5273 1.3232 -9.2658 {"}'S' blue -11.6877 1.287 -9.463 { CE2 PHE 26 A}'S' blue -13.2591 -0.0454 -6.9456 {"}'S' blue -13.4168 -0.0454 -7.1492 {"}'S' blue -13.5775 -0.1097 -7.3388 {"}'S' blue -13.0592 0.1189 -7.0021 {"}'S' blue -13.2134 0.1365 -7.2068 {"}'S' blue -13.3747 0.0988 -7.4049 {"}'S' blue -13.5333 0.008 -7.5855 {"}'S' sky -12.6862 0.1646 -6.8514 {"}'S' sky -12.8261 0.2455 -7.0543 {"}'S' blue -12.9791 0.2797 -7.2626 {"}'S' blue -13.1401 0.2648 -7.4657 {"}'S' sky -12.8783 0.3866 -7.5201 {"}'S' sky -11.9674 -0.0409 -6.6133 {"}'S' sky -12.7534 0.4487 -7.7668 { CZ PHE 26 A}'S' sky -12.6916 0.5299 -7.8496 {"}'S' sky -12.8132 0.6519 -8.0419 {"}'S' sky -13.4296 0.6115 -8.8273 {"}'S' sky -12.0697 0.8693 -8.2066 {"}'S' sky -11.5692 0.4237 -7.8514 {"}'S' sky -11.6483 0.6176 -8.0073 {"}'S' sky -11.7484 0.784 -8.182 {"}'S' sky -11.8671 0.9177 -8.3731 {"}'S' sky -11.82 1.0269 -8.771 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 26 A}'S' sea -11.5669 0.0929 -6.6022 {"}'S' sea -11.7228 0.0985 -6.8063 {"}'S' sea -11.4402 0.1737 -6.8525 {"}'S' green -11.5978 0.1606 -7.053 {"}'S' sea -11.2531 0.2083 -7.0335 {"}'S' sea -11.4146 0.1909 -7.2384 { CE2 PHE 26 A}'S' sea -12.3215 0.1119 -6.7237 {"}'S' green -12.439 0.241 -6.9121 {"}'S' green -12.5745 0.3312 -7.111 {"}'S' sea -12.7224 0.381 -7.316 {"}'S' green -12.0607 0.1281 -6.7811 {"}'S' green -12.1734 0.2659 -6.9649 {"}'S' green -12.4438 0.4347 -7.3627 {"}'S' sea -12.5957 0.4619 -7.5663 {"}'S' green -11.8521 0.1806 -6.9403 {"}'S' green -12.252 0.4735 -7.54 {"}'S' sea -12.4086 0.4964 -7.7473 {"}'S' green -11.6634 0.2079 -7.1329 {"}'S' green -11.7857 0.3325 -7.3268 {"}'S' green -11.9237 0.4235 -7.5293 {"}'S' sea -11.5777 0.2857 -7.4779 {"}'S' sea -11.7149 0.3766 -7.6809 { CZ PHE 26 A}'S' sea -13.1097 0.74 -8.4485 {"}'S' sea -13.271 0.7022 -8.6467 {"}'S' sea -12.4603 0.6417 -7.9007 {"}'S' sea -12.5825 0.768 -8.0932 {"}'S' sea -12.7224 0.849 -8.296 {"}'S' green -12.8754 0.8832 -8.5044 {"}'S' green -13.0364 0.8682 -8.7074 {"}'S' green -13.1992 0.8056 -8.9003 {"}'S' sea -13.3579 0.6965 -9.0751 {"}'S' green -12.1201 0.5515 -7.7928 {"}'S' sea -12.2178 0.7154 -7.9655 {"}'S' sea -12.3353 0.8445 -8.1539 {"}'S' green -12.4708 0.9347 -8.3527 {"}'S' green -12.6187 0.9845 -8.5577 {"}'S' green -13.0957 0.8754 -9.1437 {"}'S' sea -13.2508 0.7568 -9.3116 {"}'S' green -11.8637 0.5626 -7.8551 {"}'S' sea -11.957 0.7316 -8.0229 {"}'S' green -12.1977 0.9723 -8.4016 {"}'S' green -12.3401 1.0381 -8.6045 {"}'S' green -12.9678 0.9099 -9.3801 {"}'S' sea -13.1209 0.7844 -9.542 {"}'S' sea -12.0015 1.0161 -8.574 {"}'S' green -12.1483 1.0769 -8.7817 {"}'S' green -12.3049 1.0999 -8.9891 {"}'S' green -12.4664 1.0824 -9.194 {"}'S' green -12.6303 1.0258 -9.3897 {"}'S' green -12.7915 0.932 -9.5714 {"}'S' sea -11.969 1.0799 -8.9784 {"}'S' sea -12.1259 1.0943 -9.1858 {"}'S' sea -12.2881 1.0708 -9.3884 {"}'S' sea -12.4517 1.0094 -9.5826 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 26 A}'S' P -12.3014 0.3688 -7.1598 {"}'S' -12.3019 0.3663 -7.1617 {"}'S' P -11.9708 0.3143 -7.1313 {"}'S' -11.9738 0.3019 -7.136 {"}'S' P -12.1052 0.4127 -7.3323 {"}'S' -12.1075 0.3943 -7.3382 { CZ PHE 26 A}'S' P -12.7746 0.9901 -8.7618 {"}'S' -12.7662 0.9637 -8.7665 {"}'S' P -12.935 0.9539 -8.9591 {"}'S' -12.9198 0.9185 -8.9611 {"}'S' P -12.492 1.0653 -8.808 {"}'S' -12.4913 1.0624 -8.8081 {"}'S' P -12.6497 1.0522 -9.0086 {"}'S' -12.6408 1.0135 -9.0098 {"}'S' P -12.8105 0.9996 -9.201 {"}'S' -12.8003 0.9719 -9.1978 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 11 A}'S' blue -13.0941 0.7501 -7.3666 {"}'S' blue -12.9567 0.6583 -7.1646 {"}'S' sky -12.808 0.6045 -6.9577 {"}'S' blue -12.9626 0.8238 -7.6463 {"}'S' sky -12.8359 0.7081 -7.45 {"}'S' sky -12.8182 0.956 -7.9114 {"}'S' sky -12.7065 0.8167 -7.7286 {"}'S' sky -12.6027 1.0396 -8.0461 {"}'S' sky -12.0184 1.0822 -7.9783 { CG1 VAL 11 A}'S' blue -13.3439 0.4678 -6.9703 {"}'S' blue -13.1862 0.4562 -6.764 {"}'S' blue -13.2504 0.642 -7.2155 {"}'S' blue -13.1002 0.6 -7.0109 {"}'S' blue -12.9418 0.6119 -6.809 { CG2 VAL 11 A}'S' blue -12.9613 1.1111 -8.0535 {"}'S' sky -12.33 1.1046 -8.0983 {"}'S' sky -12.0784 1.159 -8.2026 {"}'S' sky -11.8629 1.2439 -8.3375 {"}'S' sky -11.771 1.3167 -8.5977 {"}'S' blue -11.6097 1.4018 -8.412 {"}'S' sky -11.9974 1.4646 -9.2485 {"}'S' sky -11.8472 1.4226 -9.0438 {"}'S' sky -11.6887 1.4345 -8.8419 {"}'S' blue -11.5275 1.5009 -8.6521 {"}'S' blue -11.8754 1.6728 -9.4198 {"}'S' sky -11.7331 1.6041 -9.2164 {"}'S' sky -11.5758 1.602 -9.0129 {"}'S' blue -11.4147 1.6642 -8.8223 { HB VAL 11 A}'S' sky -12.2568 0.3441 -6.5823 {"}'S' blue -11.7928 0.3505 -6.4162 {"}'S' sky -11.5332 0.3735 -6.5178 {"}'S' blue -11.2208 0.5273 -6.5667 {"}'S' sky -11.913 1.131 -7.9975 {"}'S' blue -11.1144 0.5693 -6.8085 {"}'S' sky -11.6461 0.9979 -7.9219 {"}'S' sky -11.591 0.7866 -7.7932 {"}'S' sky -11.4884 0.6339 -7.6181 {"}'S' blue -11.195 0.5696 -7.2194 {"}'S' blue -11.3336 0.8568 -7.7102 {HG11 VAL 11 A}'S' blue -13.9034 0.2035 -7.2474 {"}'S' blue -13.7402 0.2524 -7.0509 {"}'S' blue -13.8198 0.3604 -7.4903 {"}'S' blue -13.6635 0.3712 -7.291 {"}'S' blue -13.5074 0.4666 -7.1165 {"}'S' blue -13.5052 0.5842 -7.3778 {HG21 VAL 11 A}'S' sky -13.1857 1.0501 -9.5783 {"}'S' sky -12.9484 1.1252 -9.6591 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 11 A}'S' sea -12.6938 0.6298 -7.2448 {"}'S' sea -12.5781 0.7131 -7.5329 {"}'S' sea -12.4932 0.8935 -7.8648 {"}'S' sea -12.2568 0.9762 -7.9399 { CG2 VAL 11 A}'S' sea -12.7625 1.0665 -8.2176 {"}'S' green -12.4938 1.0666 -8.2981 {"}'S' green -12.3964 1.0969 -8.5957 {"}'S' green -12.2388 1.1086 -8.3949 {"}'S' green -12.1833 1.1681 -8.7309 {"}'S' sea -12.0243 1.185 -8.5293 {"}'S' sea -12.0909 1.2904 -9.0033 {"}'S' sea -11.9331 1.2787 -8.7969 { HB VAL 11 A}'S' sea -12.6614 0.583 -7.1711 {"}'S' sea -12.5461 0.4514 -6.9851 {"}'S' sea -12.4087 0.3699 -6.7856 {"}'S' green -12.4938 0.5507 -7.3772 {"}'S' green -12.385 0.4101 -7.1981 {"}'S' green -12.2543 0.3157 -7.0031 {"}'S' green -12.107 0.274 -6.8008 {"}'S' sea -11.9515 0.286 -6.6029 {"}'S' sea -12.3434 0.6715 -7.6487 {"}'S' green -12.2557 0.4954 -7.4852 {"}'S' green -11.8506 0.2573 -6.896 {"}'S' sea -11.6912 0.2878 -6.6987 {"}'S' sea -12.1365 0.795 -7.8246 {"}'S' green -12.0654 0.5987 -7.6793 {"}'S' green -11.9628 0.4459 -7.5042 {"}'S' green -11.8344 0.3452 -7.309 {"}'S' green -11.6871 0.3021 -7.1065 {"}'S' sea -11.5294 0.3191 -6.9084 {"}'S' sea -11.3712 0.3959 -6.7252 {"}'S' sea -11.8937 0.8887 -7.9055 {"}'S' sea -11.8292 0.6798 -7.7629 {"}'S' green -11.7255 0.521 -7.5849 {"}'S' green -11.5906 0.4262 -7.384 {"}'S' sea -11.4349 0.4019 -7.1759 {"}'S' sea -11.2716 0.4509 -6.9793 {HG21 VAL 11 A}'S' sea -13.4772 0.9199 -9.0772 {"}'S' green -13.3299 0.8782 -8.8749 {"}'S' green -13.1744 0.8902 -8.6771 {"}'S' green -13.0157 0.9547 -8.4903 {"}'S' sea -12.8628 1.0708 -8.3249 {"}'S' sea -13.3624 0.9678 -9.3739 {"}'S' green -13.2259 0.8865 -9.1739 {"}'S' green -12.7561 0.9777 -8.5919 {"}'S' green -13.0572 0.9493 -9.3832 {"}'S' green -12.8135 1.0303 -9.4582 {"}'S' green -12.3373 1.1734 -8.8827 {"}'S' green -12.5741 1.163 -9.4929 {"}'S' green -12.4178 1.1738 -9.2936 {"}'S' sea -12.2617 1.2692 -9.1191 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 11 A}'S' P -12.1396 0.3636 -7.2998 {"}'S' -12.1355 0.3823 -7.2917 {"}'S' P -12.003 0.2823 -7.0997 {"}'S' -12.0022 0.2934 -7.0977 {HG21 VAL 11 A}'S' P -13.0735 0.8615 -8.9701 {"}'S' -13.0744 0.8722 -8.9704 {"}'S' P -12.9141 0.8919 -8.7729 {"}'S' -12.9184 0.9129 -8.7767 {"}'S' P -12.91 0.9063 -9.1806 {"}'S' -12.9147 0.9318 -9.1759 {"}'S' P -12.7518 0.924 -8.9822 {"}'S' -12.7678 0.9688 -8.9801 {"}'S' P -12.5941 1.0001 -8.7993 {"}'S' -12.6037 1.0194 -8.8015 {"}'S' P -12.6577 1.0061 -9.25 {"}'S' -12.6641 1.0206 -9.2467 {"}'S' P -12.4945 1.055 -9.0534 {"}'S' -12.5019 1.0663 -9.0524 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 26 A}'M' greentint -9.5581 2.0178 -6.2185 {"}'M' greentint -9.3393 2.3568 -6.0292 {"}'M' greentint -9.4982 2.2681 -6.2108 {"}'M' greentint -9.6418 2.1603 -6.4833 {"}'M' greentint -9.2362 2.5893 -6.0782 {"}'M' greentint -9.3995 2.5559 -6.2801 {"}'M' greentint -9.5481 2.399 -6.4285 {"}'M' greentint -9.6518 2.3027 -6.726 {"}'M' greentint -9.7084 2.0532 -6.7293 {"}'M' greentint -9.0923 2.7944 -6.1402 {"}'M' greentint -9.2503 2.7861 -6.3422 {"}'M' greentint -9.4089 2.6929 -6.5206 {"}'M' greentint -9.5481 2.525 -6.6538 {"}'M' greentint -9.6214 2.3967 -6.9708 {"}'M' greentint -9.6926 2.1516 -6.995 {"}'M' greentint -9.0633 2.9752 -6.4101 {"}'M' greentint -9.2235 2.917 -6.6021 {"}'M' greentint -9.3783 2.7939 -6.7667 {"}'M' greentint -9.514 2.6163 -6.8929 {"}'M' greentint -9.5435 2.4769 -7.2091 {"}'M' greentint -8.9805 3.0952 -6.6542 {"}'M' greentint -9.1426 3.013 -6.8398 {"}'M' greentint -9.2948 2.8771 -6.9998 {"}'M' greentint -9.4315 2.6955 -7.1246 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 11 A}'M' greentint -9.5852 1.9868 -6.2877 {"}'M' greentint -9.435 2.1113 -6.1279 {"}'M' greentint -9.3018 2.2869 -6.0048 {"}'M' greentint -9.6928 1.9821 -6.8251 {"}'M' greentint -9.5346 1.9843 -6.6213 {"}'M' greentint -9.3739 2.0603 -6.4345 {"}'M' greentint -9.2244 2.2057 -6.2821 {"}'M' greentint -9.0998 2.4056 -6.1762 {"}'M' greentint -9.0113 2.6432 -6.1282 {"}'M' greentint -9.5897 2.1448 -7.0801 {"}'M' greentint -9.4409 2.0952 -6.874 {"}'M' greentint -9.2786 2.1401 -6.6761 {"}'M' greentint -9.1244 2.2727 -6.5143 {"}'M' greentint -9.0001 2.476 -6.4097 {"}'M' greentint -8.9218 2.7217 -6.3776 {"}'M' greentint -8.9008 2.9771 -6.4209 {"}'M' greentint -9.4617 2.3804 -7.2426 {"}'M' greentint -9.3299 2.2786 -7.0444 {"}'M' greentint -9.1689 2.3067 -6.8445 {"}'M' greentint -9.0209 2.4586 -6.6956 {"}'M' greentint -8.9261 2.6928 -6.6383 {"}'M' greentint -8.9098 2.9465 -6.6876 {"}'M' greentint -9.3006 2.6516 -7.2758 {"}'M' greentint -9.1964 2.4965 -7.098 {"}'M' greentint -9.0365 2.5934 -6.9185 {"}'M' greentint -8.9815 2.8467 -6.9183 {"}'M' greentint -9.0857 3.0018 -7.0962 {"}'M' greentint -9.1148 2.743 -7.1178 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 26 A}'M' greentint -10.2999 0.8757 -4.4767 {"}'M' greentint -10.4331 0.7721 -4.6762 {"}'M' greentint -10.114 0.9671 -4.3187 {"}'M' greentint -10.2182 1.1223 -4.4965 {"}'M' greentint -10.3782 1.0254 -4.676 {"}'M' greentint -10.4885 0.926 -4.9562 {"}'M' greentint -10.5048 0.6723 -4.9069 {"}'M' greentint -9.9529 1.2384 -4.3519 {"}'M' greentint -10.0847 1.3401 -4.5501 {"}'M' greentint -10.2457 1.3121 -4.75 {"}'M' greentint -10.3937 1.1601 -4.8989 {"}'M' greentint -10.4603 1.0234 -5.2098 {"}'M' greentint -9.7614 1.4152 -4.4158 {"}'M' greentint -9.8963 1.51 -4.6167 {"}'M' greentint -10.0551 1.5132 -4.8226 {"}'M' greentint -10.2154 1.4221 -5.0055 {"}'M' greentint -10.3568 1.2516 -5.141 {"}'M' greentint -9.7994 1.6447 -4.8722 {"}'M' greentint -9.9607 1.6055 -5.0701 {"}'M' greentint -10.1173 1.4935 -5.2415 {"}'M' greentint -10.2559 1.3188 -5.3722 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 11 A}'M' green -10.4564 0.6168 -4.7051 {"}'M' green -9.9906 0.9445 -4.1945 {"}'M' green -10.5301 0.7993 -5.1687 {"}'M' green -9.9428 1.6198 -5.2437 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 11 A}'M' greentint -10.2938 0.6725 -4.511 {"}'M' greentint -10.136 0.7828 -4.3375 {"}'M' greentint -10.3821 0.7522 -4.9642 {"}'M' greentint -10.2229 0.7747 -4.7637 {"}'M' greentint -10.0632 0.8633 -4.5827 {"}'M' greentint -9.9165 1.0129 -4.4351 {"}'M' greentint -9.7927 1.2126 -4.3304 {"}'M' greentint -10.4018 1.011 -5.3202 {"}'M' greentint -10.2635 0.9342 -5.1187 {"}'M' greentint -10.1046 0.9452 -4.9178 {"}'M' greentint -9.9476 1.0411 -4.7404 {"}'M' greentint -9.8091 1.2116 -4.6089 {"}'M' greentint -9.7062 1.4351 -4.5381 {"}'M' greentint -10.2621 1.2456 -5.3947 {"}'M' greentint -10.1291 1.142 -5.1945 {"}'M' greentint -9.966 1.1712 -4.9918 {"}'M' greentint -9.8162 1.325 -4.841 {"}'M' greentint -9.7209 1.5613 -4.7835 {"}'M' greentint -10.0165 1.3719 -5.2297 {"}'M' greentint -9.8578 1.4692 -5.0521 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 313 1r17A_315F_385}P -12.1954 -2.2051 0.3566 {"}-12.1954 -2.2051 0.3566 { ca val A 313 1r17A_315F_385}-11.0376 -2.3471 -0.508 { c val A 313 1r17A_315F_385}-10.8308 -1.0971 -1.3447 { o val A 313 1r17A_315F_385}-11.7864 -0.4858 -1.8298 { c val A 313 1r17A_315F_385}P -10.8308 -1.0971 -1.3447 { n thr A 314 1r17A_315F_385}-9.5671 -0.717 -1.4865 { ca thr A 314 1r17A_315F_385}-9.1846 0.4398 -2.2753 { c thr A 314 1r17A_315F_385}-8.228 -0.0791 -3.3409 { o thr A 314 1r17A_315F_385}-7.3322 -0.8761 -3.0436 { c thr A 314 1r17A_315F_385}P -8.228 -0.0791 -3.3409 { n phe A 315 1r17A_315F_385}-8.4165 0.3565 -4.5781 { ca phe A 315 1r17A_315F_385}-7.5428 -0.0973 -5.647 { c phe A 315 1r17A_315F_385}-7.3059 0.936 -6.7383 { o phe A 315 1r17A_315F_385}-8.0659 1.8966 -6.8838 { c phe A 315 1r17A_315F_385}P -7.3059 0.936 -6.7383 { n glu A 316 1r17A_315F_385}-6.2215 0.7294 -7.48 { ca glu A 316 1r17A_315F_385}-5.8356 1.5839 -8.5882 { c glu A 316 1r17A_315F_385}-6.1457 0.8614 -9.8929 { o glu A 316 1r17A_315F_385}-5.914 -0.342 -10.0124 { c glu A 316 1r17A_315F_385}P -6.1457 0.8614 -9.8929 { n val A 317 1r17A_315F_385}-6.6727 1.5977 -10.8668 { ca val A 317 1r17A_315F_385}-7.0036 1.0426 -12.18 { c val A 317 1r17A_315F_385}-5.968 1.5585 -13.1824 { o val A 317 1r17A_315F_385}-5.8625 2.7677 -13.3962 { n ile A 383 1r17A_315F_385}P -7.1192 6.6086 -12.2825 {"}-7.1192 6.6086 -12.2825 { ca ile A 383 1r17A_315F_385}-8.3635 6.2126 -11.6422 { c ile A 383 1r17A_315F_385}-8.1228 5.2888 -10.4581 { o ile A 383 1r17A_315F_385}-7.3268 4.3534 -10.5322 { c ile A 383 1r17A_315F_385}P -8.1228 5.2888 -10.4581 { n lys A 384 1r17A_315F_385}-8.8122 5.5794 -9.3596 { ca lys A 384 1r17A_315F_385}-8.7312 4.7824 -8.1425 { c lys A 384 1r17A_315F_385}-10.1672 4.6225 -7.6728 { o lys A 384 1r17A_315F_385}-11.0332 5.4229 -8.0309 { c lys A 384 1r17A_315F_385}P -10.1672 4.6225 -7.6728 { n ala A 385 1r17A_315F_385}-10.4249 3.5966 -6.8733 { ca ala A 385 1r17A_315F_385}-11.7739 3.3712 -6.3826 { c ala A 385 1r17A_315F_385}-11.7696 2.6701 -5.0427 { o ala A 385 1r17A_315F_385}-10.7902 2.0318 -4.6589 { c ala A 385 1r17A_315F_385}P -11.7696 2.6701 -5.0427 { n his A 386 1r17A_315F_385}-12.8731 2.7976 -4.3226 { ca his A 386 1r17A_315F_385}-13.0009 2.1424 -3.0422 { c his A 386 1r17A_315F_385}-14.3839 1.5472 -2.9254 { o his A 386 1r17A_315F_385}-15.3804 2.1937 -3.2455 { c his A 386 1r17A_315F_385}P -14.3839 1.5472 -2.9254 { n leu A 387 1r17A_315F_385}-14.4285 0.303 -2.4717 { ca leu A 387 1r17A_315F_385}-15.6844 -0.4038 -2.2975 { c leu A 387 1r17A_315F_385}-15.8629 -0.7421 -0.8255 { o leu A 387 1r17A_315F_385}-14.8978 -1.0774 -0.1356 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 313 1r17A_315F_385}P -12.1954 -2.2051 0.3566 { ca val A 313 1r17A_315F_385}P -11.0376 -2.3471 -0.508 { n thr A 314 1r17A_315F_385}P -9.5671 -0.717 -1.4865 { ca thr A 314 1r17A_315F_385}P -9.1846 0.4398 -2.2753 { n phe A 315 1r17A_315F_385}P -8.4165 0.3565 -4.5781 { ca phe A 315 1r17A_315F_385}P -7.5428 -0.0973 -5.647 { n glu A 316 1r17A_315F_385}P -6.2215 0.7294 -7.48 { ca glu A 316 1r17A_315F_385}P -5.8356 1.5839 -8.5882 { n val A 317 1r17A_315F_385}P -6.6727 1.5977 -10.8668 { ca val A 317 1r17A_315F_385}P -7.0036 1.0426 -12.18 { n ile A 383 1r17A_315F_385}P -7.1192 6.6086 -12.2825 { ca ile A 383 1r17A_315F_385}P -8.3635 6.2126 -11.6422 { n lys A 384 1r17A_315F_385}P -8.8122 5.5794 -9.3596 { ca lys A 384 1r17A_315F_385}P -8.7312 4.7824 -8.1425 { n ala A 385 1r17A_315F_385}P -10.4249 3.5966 -6.8733 { ca ala A 385 1r17A_315F_385}P -11.7739 3.3712 -6.3826 { n his A 386 1r17A_315F_385}P -12.8731 2.7976 -4.3226 { ca his A 386 1r17A_315F_385}P -13.0009 2.1424 -3.0422 { n leu A 387 1r17A_315F_385}P -14.4285 0.303 -2.4717 { ca leu A 387 1r17A_315F_385}P -15.6844 -0.4038 -2.2975 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 313 1r17A_315F_385}P -11.0376 -2.3471 -0.508 {"}-11.0376 -2.3471 -0.508 { ca thr A 314 1r17A_315F_385}-9.1846 0.4398 -2.2753 { ca phe A 315 1r17A_315F_385}-7.5428 -0.0973 -5.647 { ca glu A 316 1r17A_315F_385}-5.8356 1.5839 -8.5882 { ca val A 317 1r17A_315F_385}-7.0036 1.0426 -12.18 { ca ile A 383 1r17A_315F_385}P -8.3635 6.2126 -11.6422 {"}-8.3635 6.2126 -11.6422 { ca lys A 384 1r17A_315F_385}-8.7312 4.7824 -8.1425 { ca ala A 385 1r17A_315F_385}-11.7739 3.3712 -6.3826 { ca his A 386 1r17A_315F_385}-13.0009 2.1424 -3.0422 { ca leu A 387 1r17A_315F_385}-15.6844 -0.4038 -2.2975 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 315 1r17A_315F_385}P -7.5428 -0.0973 -5.647 { cb phe A 315 1r17A_315F_385}-8.0904 -1.3999 -6.2553 { cg phe A 315 1r17A_315F_385}-9.4782 -1.2804 -6.838 { cd1 phe A 315 1r17A_315F_385}-9.6673 -0.858 -8.1532 { ce1 phe A 315 1r17A_315F_385}-10.9498 -0.7743 -8.7069 { cz phe A 315 1r17A_315F_385}-12.0627 -1.1159 -7.9336 { cg phe A 315 1r17A_315F_385}P -9.4782 -1.2804 -6.838 { cd2 phe A 315 1r17A_315F_385}-10.5957 -1.6175 -6.0755 { ce2 phe A 315 1r17A_315F_385}-11.8859 -1.54 -6.6142 { cz phe A 315 1r17A_315F_385}ghost -12.0627 -1.1159 -7.9336 { ca ala A 385 1r17A_315F_385}P -11.7739 3.3712 -6.3826 { cb ala A 385 1r17A_315F_385}-12.5595 2.5479 -7.3863 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 315 1r17A_315F_385}P -8.0904 -1.3999 -6.2553 {"}P -8.0904 -1.3999 -6.2553 { cd1 phe A 315 1r17A_315F_385}P -9.6673 -0.858 -8.1532 { cd2 phe A 315 1r17A_315F_385}P -10.5957 -1.6175 -6.0755 { ce1 phe A 315 1r17A_315F_385}P -10.9498 -0.7743 -8.7069 { ce2 phe A 315 1r17A_315F_385}P -11.8859 -1.54 -6.6142 { cz phe A 315 1r17A_315F_385}P -12.0627 -1.1159 -7.9336 { cb ala A 385 1r17A_315F_385}P -12.5595 2.5479 -7.3863 {"}P -12.5595 2.5479 -7.3863 {"}P -12.5595 2.5479 -7.3863 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 315 A}'S' sky -10.9099 0.8459 -8.0463 {"}'S' sky -11.3619 0.9258 -8.6533 { CE2 PHE 315 A}'S' blue -12.1147 0.1903 -6.746 {"}'S' blue -11.7742 0.2021 -6.7379 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 315 A}'S' sea -11.1725 0.5154 -7.5455 {"}'S' green -11.2947 0.6417 -7.7379 {"}'S' green -11.7486 0.7418 -8.3522 {"}'S' sea -11.9114 0.6792 -8.545 {"}'S' sea -11.0476 0.7181 -7.7986 {"}'S' green -11.183 0.8083 -7.9975 {"}'S' green -11.3309 0.8581 -8.2025 {"}'S' green -11.4868 0.8637 -8.4066 {"}'S' sea -11.6472 0.8275 -8.6039 {"}'S' sea -11.0523 0.9118 -8.2492 {"}'S' sea -11.2042 0.9389 -8.4528 { CZ PHE 315 A}'S' sea -12.5475 0.381 -7.1675 {"}'S' sea -12.7005 0.4152 -7.3759 {"}'S' green -12.1605 0.3764 -7.0254 {"}'S' green -12.2959 0.4667 -7.2242 {"}'S' green -12.5997 0.522 -7.6333 {"}'S' sea -12.7601 0.4858 -7.8306 {"}'S' green -11.8948 0.4013 -7.0781 {"}'S' green -12.6356 0.5316 -8.0725 {"}'S' green -11.6922 0.4497 -7.2446 {"}'S' green -12.4555 0.5577 -8.2612 {"}'S' green -11.5072 0.4679 -7.4401 {"}'S' green -12.1132 0.6028 -8.2599 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 315 A}'S' P -11.6677 0.5959 -7.8886 {"}'S' -11.656 0.575 -7.9021 {"}'S' P -11.8219 0.6136 -8.0933 {"}'S' -11.8147 0.6014 -8.0994 {"}'S' P -11.4346 0.7226 -7.9408 {"}'S' -11.4296 0.7079 -7.9493 {"}'S' P -11.5876 0.7568 -8.1491 {"}'S' -11.5802 0.7382 -8.1553 { CZ PHE 315 A}'S' P -12.4438 0.5165 -7.4292 {"}'S' -12.4392 0.4988 -7.4343 {"}'S' P -12.0228 0.5042 -7.2731 {"}'S' -12.024 0.4747 -7.2851 {"}'S' P -12.1652 0.5701 -7.476 {"}'S' -12.1612 0.495 -7.496 {"}'S' P -12.3171 0.5973 -7.6795 {"}'S' -12.3067 0.5245 -7.6897 {"}'S' P -12.4748 0.5842 -7.8801 {"}'S' -12.471 0.5645 -7.8806 {"}'S' P -11.8266 0.5481 -7.4455 {"}'S' -11.834 0.4958 -7.4608 {"}'S' P -11.9734 0.6089 -7.6532 {"}'S' -11.9784 0.5156 -7.6679 {"}'S' P -12.13 0.6319 -7.8606 {"}'S' -12.1267 0.5483 -7.8643 {"}'S' P -12.2916 0.6144 -8.0655 {"}'S' -12.2886 0.591 -8.0629 {"}'S' P -11.6451 0.5589 -7.6425 {"}'S' -11.6527 0.5279 -7.6477 {"}'S' P -11.7942 0.6119 -7.8499 {"}'S' -11.8035 0.5527 -7.8526 {"}'S' P -11.9511 0.6263 -8.0573 {"}'S' -11.9539 0.5867 -8.0539 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 385 A}'S' green -12.6984 0.6035 -7.6552 {"}'S' green -12.561 0.522 -7.4557 {"}'S' green -12.4091 0.4963 -7.2524 {"}'S' green -12.2497 0.5267 -7.0552 {"}'S' sea -12.6462 0.7029 -8.0474 {"}'S' green -11.9452 0.5027 -7.0863 {"}'S' green -12.4081 0.6476 -8.1554 {"}'S' green -11.6856 0.5257 -7.1879 {"}'S' sea -12.2177 0.7509 -8.3494 {"}'S' green -11.5235 0.5481 -7.3953 {"}'S' sea -11.9816 0.8319 -8.433 {"}'S' green -11.8779 0.6732 -8.2551 {"}'S' green -11.424 0.6031 -7.6494 {"}'S' sea -11.2667 0.7215 -7.4787 {"}'S' sea -11.7434 0.9388 -8.4634 {"}'S' green -11.6408 0.7861 -8.2883 {"}'S' green -11.3473 0.7218 -7.8896 {"}'S' green -11.1912 0.8172 -7.7151 {"}'S' green -11.4859 1.009 -8.3804 {"}'S' green -11.3525 0.9062 -8.1798 {"}'S' green -11.1889 0.9348 -7.9764 {"}'S' sea -11.2275 1.1317 -8.2245 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 385 A}'S' P -12.5374 0.5623 -7.8683 {"}'S' -12.5365 0.5638 -7.8674 {"}'S' P -12.4067 0.4679 -7.6732 {"}'S' -12.3909 0.519 -7.6668 {"}'S' P -12.2593 0.4262 -7.4709 {"}'S' -12.2492 0.4886 -7.4747 {"}'S' P -12.1038 0.4382 -7.2731 {"}'S' -12.1026 0.4678 -7.2799 {"}'S' P -12.2919 0.5158 -7.9699 {"}'S' -12.2826 0.5624 -7.9507 {"}'S' P -12.1554 0.4345 -7.7699 {"}'S' -12.1478 0.527 -7.7516 {"}'S' P -12.003 0.4095 -7.5661 {"}'S' -12.0077 0.4986 -7.5639 {"}'S' P -11.8436 0.4399 -7.3689 {"}'S' -11.8514 0.4793 -7.3749 {"}'S' P -12.1151 0.5981 -8.1743 {"}'S' -12.1148 0.6063 -8.1688 {"}'S' P -11.9867 0.4973 -7.9792 {"}'S' -11.9906 0.5597 -7.9544 {"}'S' P -11.8394 0.4543 -7.7766 {"}'S' -11.8542 0.529 -7.7609 {"}'S' P -11.6813 0.4721 -7.5782 {"}'S' -11.6943 0.5093 -7.5772 {"}'S' P -11.743 0.5784 -8.0542 {"}'S' -11.7493 0.6009 -8.0424 {"}'S' P -11.5872 0.5541 -7.846 {"}'S' -11.5958 0.5735 -7.84 {"}'S' P -11.5036 0.711 -8.0888 {"}'S' -11.515 0.7293 -8.0779 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 315 A}'M' green -9.0791 2.3778 -6.0458 {"}'M' green -8.8321 2.8155 -6.1568 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 315 A}'M' greentint -9.238 2.2891 -6.2274 {"}'M' greentint -9.3816 2.1813 -6.4999 {"}'M' greentint -8.9761 2.6103 -6.0948 {"}'M' greentint -9.1393 2.577 -6.2966 {"}'M' greentint -9.2879 2.42 -6.4451 {"}'M' greentint -9.3916 2.3237 -6.7426 {"}'M' greentint -9.4482 2.0742 -6.7459 {"}'M' greentint -8.9901 2.8071 -6.3588 {"}'M' greentint -9.1487 2.7139 -6.5372 {"}'M' greentint -9.2879 2.546 -6.6704 {"}'M' greentint -9.3612 2.4177 -6.9874 {"}'M' greentint -9.4324 2.1726 -7.0116 {"}'M' greentint -8.8031 2.9962 -6.4267 {"}'M' greentint -8.9633 2.938 -6.6187 {"}'M' greentint -9.1181 2.8149 -6.7833 {"}'M' greentint -9.2538 2.6374 -6.9095 {"}'M' greentint -9.2834 2.4979 -7.2257 {"}'M' greentint -8.8824 3.034 -6.8564 {"}'M' greentint -9.0347 2.8981 -7.0164 {"}'M' greentint -9.1713 2.7165 -7.1412 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 385 A}'M' greentint -9.3854 2.0053 -6.67 {"}'M' greentint -9.2248 2.0813 -6.4832 {"}'M' greentint -9.0753 2.2267 -6.3308 {"}'M' greentint -8.9507 2.4267 -6.225 {"}'M' greentint -8.8621 2.6642 -6.1769 {"}'M' greentint -9.2917 2.1162 -6.9227 {"}'M' greentint -9.1294 2.1611 -6.7248 {"}'M' greentint -8.9752 2.2937 -6.5631 {"}'M' greentint -8.851 2.497 -6.4584 {"}'M' greentint -8.7727 2.7427 -6.4263 {"}'M' greentint -8.7517 2.9981 -6.4696 {"}'M' greentint -9.1808 2.2997 -7.0932 {"}'M' greentint -9.0198 2.3277 -6.8932 {"}'M' greentint -8.8717 2.4797 -6.7443 {"}'M' greentint -8.7769 2.7138 -6.687 {"}'M' greentint -8.7606 2.9675 -6.7363 {"}'M' greentint -9.0473 2.5175 -7.1467 {"}'M' greentint -8.8873 2.6144 -6.9673 {"}'M' greentint -8.8323 2.8677 -6.967 {"}'M' greentint -8.9656 2.7641 -7.1665 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 315 A}'M' greentint -9.9144 1.1631 -4.253 {"}'M' greentint -10.0477 1.0594 -4.4525 {"}'M' greentint -9.8328 1.4096 -4.2729 {"}'M' greentint -9.9927 1.3127 -4.4523 {"}'M' greentint -10.1031 1.2133 -4.7326 {"}'M' greentint -10.1194 0.9596 -4.6833 {"}'M' greentint -9.6993 1.6275 -4.3264 {"}'M' greentint -9.8603 1.5994 -4.5264 {"}'M' greentint -10.0083 1.4475 -4.6752 {"}'M' greentint -10.0748 1.3108 -4.9862 {"}'M' greentint -10.1252 1.0561 -4.9816 {"}'M' greentint -9.5109 1.7973 -4.393 {"}'M' greentint -9.6697 1.8005 -4.5989 {"}'M' greentint -9.83 1.7094 -4.7818 {"}'M' greentint -9.9714 1.5389 -4.9174 {"}'M' greentint -9.978 1.3851 -5.2262 {"}'M' greentint -10.0463 1.1361 -5.2439 {"}'M' greentint -9.414 1.9321 -4.6485 {"}'M' greentint -9.5753 1.8929 -4.8464 {"}'M' greentint -9.7319 1.7808 -5.0178 {"}'M' greentint -9.8705 1.6061 -5.1485 {"}'M' greentint -9.8326 1.4046 -5.4438 {"}'M' greentint -9.5942 1.7948 -5.2429 {"}'M' greentint -9.7274 1.6192 -5.366 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 385 A}'M' green -10.005 0.9102 -4.3669 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 385 A}'M' greentint -9.8647 1.0722 -4.2309 {"}'M' greentint -9.7427 1.2688 -4.1279 {"}'M' greentint -10.0494 0.8497 -4.7709 {"}'M' greentint -9.8916 0.9599 -4.5975 {"}'M' greentint -9.7462 1.1216 -4.4545 {"}'M' greentint -9.6216 1.324 -4.3509 {"}'M' greentint -9.5251 1.5571 -4.2911 {"}'M' greentint -9.9785 0.9518 -5.0237 {"}'M' greentint -9.8187 1.0404 -4.8427 {"}'M' greentint -9.672 1.19 -4.6951 {"}'M' greentint -9.5483 1.3897 -4.5904 {"}'M' greentint -9.4564 1.6239 -4.5371 {"}'M' greentint -9.4045 1.8748 -4.5387 {"}'M' greentint -9.8602 1.1223 -5.1778 {"}'M' greentint -9.7032 1.2182 -5.0004 {"}'M' greentint -9.5647 1.3887 -4.8689 {"}'M' greentint -9.4618 1.6122 -4.798 {"}'M' greentint -9.4073 1.8619 -4.7977 {"}'M' greentint -9.7216 1.3484 -5.2518 {"}'M' greentint -9.5718 1.5021 -5.101 {"}'M' greentint -9.4765 1.7384 -5.0435 {"}'M' greentint -9.6133 1.6463 -5.312 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 173 1r5mA_175Y_183}P -12.0926 -2.0092 0.4644 {"}-12.0926 -2.0092 0.4644 { ca leu A 173 1r5mA_175Y_183}-10.9409 -2.2106 -0.4036 { c leu A 173 1r5mA_175Y_183}-10.6967 -0.987 -1.2822 { o leu A 173 1r5mA_175Y_183}-11.6364 -0.3817 -1.8007 { c leu A 173 1r5mA_175Y_183}P -10.6967 -0.987 -1.2822 { n ala A 174 1r5mA_175Y_183}-9.431 -0.6154 -1.4313 { ca ala A 174 1r5mA_175Y_183}-9.0642 0.4931 -2.3023 { c ala A 174 1r5mA_175Y_183}-8.2579 -0.1327 -3.431 { o ala A 174 1r5mA_175Y_183}-7.3612 -0.9333 -3.1796 { c ala A 174 1r5mA_175Y_183}P -8.2579 -0.1327 -3.431 { n tyr A 175 1r5mA_175Y_183}-8.5771 0.1997 -4.6745 { ca tyr A 175 1r5mA_175Y_183}-7.8018 -0.3642 -5.7659 { c tyr A 175 1r5mA_175Y_183}-7.5107 0.6523 -6.8543 { o tyr A 175 1r5mA_175Y_183}-8.32 1.5359 -7.1367 { c tyr A 175 1r5mA_175Y_183}P -7.5107 0.6523 -6.8543 { n gly A 176 1r5mA_175Y_183}-6.3253 0.5408 -7.4387 { ca gly A 176 1r5mA_175Y_183}-5.9373 1.4595 -8.492 { c gly A 176 1r5mA_175Y_183}-6.1959 0.8799 -9.8632 { o gly A 176 1r5mA_175Y_183}-6.0717 -0.3304 -10.0665 { c gly A 176 1r5mA_175Y_183}P -6.1959 0.8799 -9.8632 { n glu A 177 1r5mA_175Y_183}-6.5545 1.738 -10.8107 { ca glu A 177 1r5mA_175Y_183}-6.8297 1.2886 -12.1659 { c glu A 177 1r5mA_175Y_183}-5.918 2.009 -13.1451 { o glu A 177 1r5mA_175Y_183}-5.2076 2.9454 -12.7776 { n val A 181 1r5mA_175Y_183}P -7.32 6.5929 -12.3585 {"}-7.32 6.5929 -12.3585 { ca val A 181 1r5mA_175Y_183}-8.3753 6.5596 -11.3615 { c val A 181 1r5mA_175Y_183}-8.2449 5.3527 -10.4396 { o val A 181 1r5mA_175Y_183}-7.7676 4.2919 -10.8455 { c val A 181 1r5mA_175Y_183}P -8.2449 5.3527 -10.4396 { n ala A 182 1r5mA_175Y_183}-8.6495 5.5422 -9.1885 { ca ala A 182 1r5mA_175Y_183}-8.6484 4.4794 -8.1943 { c ala A 182 1r5mA_175Y_183}-10.0734 4.473 -7.6609 { o ala A 182 1r5mA_175Y_183}-10.8172 5.4277 -7.8616 { c ala A 182 1r5mA_175Y_183}P -10.0734 4.473 -7.6609 { n arg A 183 1r5mA_175Y_183}-10.4616 3.3968 -6.9957 { ca arg A 183 1r5mA_175Y_183}-11.8051 3.3254 -6.4507 { c arg A 183 1r5mA_175Y_183}-11.8113 2.738 -5.0519 { o arg A 183 1r5mA_175Y_183}-10.9362 1.9493 -4.6875 { c arg A 183 1r5mA_175Y_183}P -11.8113 2.738 -5.0519 { n leu A 184 1r5mA_175Y_183}-12.7869 3.1624 -4.2608 { ca leu A 184 1r5mA_175Y_183}-12.965 2.6402 -2.9205 { c leu A 184 1r5mA_175Y_183}-14.2152 1.7837 -3.0616 { o leu A 184 1r5mA_175Y_183}-15.2084 2.2207 -3.6404 { c leu A 184 1r5mA_175Y_183}P -14.2152 1.7837 -3.0616 { n ala A 185 1r5mA_175Y_183}-14.1566 0.5559 -2.5627 { ca ala A 185 1r5mA_175Y_183}-15.2962 -0.3389 -2.6685 { c ala A 185 1r5mA_175Y_183}-15.5383 -1.096 -1.3811 { o ala A 185 1r5mA_175Y_183}-14.6363 -1.2844 -0.5666 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 173 1r5mA_175Y_183}P -12.0926 -2.0092 0.4644 { ca leu A 173 1r5mA_175Y_183}P -10.9409 -2.2106 -0.4036 { n ala A 174 1r5mA_175Y_183}P -9.431 -0.6154 -1.4313 { ca ala A 174 1r5mA_175Y_183}P -9.0642 0.4931 -2.3023 { n tyr A 175 1r5mA_175Y_183}P -8.5771 0.1997 -4.6745 { ca tyr A 175 1r5mA_175Y_183}P -7.8018 -0.3642 -5.7659 { n gly A 176 1r5mA_175Y_183}P -6.3253 0.5408 -7.4387 { ca gly A 176 1r5mA_175Y_183}P -5.9373 1.4595 -8.492 {"}P -5.9373 1.4595 -8.492 { n glu A 177 1r5mA_175Y_183}P -6.5545 1.738 -10.8107 { ca glu A 177 1r5mA_175Y_183}P -6.8297 1.2886 -12.1659 { n val A 181 1r5mA_175Y_183}P -7.32 6.5929 -12.3585 { ca val A 181 1r5mA_175Y_183}P -8.3753 6.5596 -11.3615 { n ala A 182 1r5mA_175Y_183}P -8.6495 5.5422 -9.1885 { ca ala A 182 1r5mA_175Y_183}P -8.6484 4.4794 -8.1943 { n arg A 183 1r5mA_175Y_183}P -10.4616 3.3968 -6.9957 { ca arg A 183 1r5mA_175Y_183}P -11.8051 3.3254 -6.4507 { n leu A 184 1r5mA_175Y_183}P -12.7869 3.1624 -4.2608 { ca leu A 184 1r5mA_175Y_183}P -12.965 2.6402 -2.9205 { n ala A 185 1r5mA_175Y_183}P -14.1566 0.5559 -2.5627 { ca ala A 185 1r5mA_175Y_183}P -15.2962 -0.3389 -2.6685 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 173 1r5mA_175Y_183}P -10.9409 -2.2106 -0.4036 {"}-10.9409 -2.2106 -0.4036 { ca ala A 174 1r5mA_175Y_183}-9.0642 0.4931 -2.3023 { ca tyr A 175 1r5mA_175Y_183}-7.8018 -0.3642 -5.7659 { ca gly A 176 1r5mA_175Y_183}-5.9373 1.4595 -8.492 { ca glu A 177 1r5mA_175Y_183}-6.8297 1.2886 -12.1659 { ca val A 181 1r5mA_175Y_183}P -8.3753 6.5596 -11.3615 {"}-8.3753 6.5596 -11.3615 { ca ala A 182 1r5mA_175Y_183}-8.6484 4.4794 -8.1943 { ca arg A 183 1r5mA_175Y_183}-11.8051 3.3254 -6.4507 { ca leu A 184 1r5mA_175Y_183}-12.965 2.6402 -2.9205 { ca ala A 185 1r5mA_175Y_183}-15.2962 -0.3389 -2.6685 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 175 1r5mA_175Y_183}P -7.8018 -0.3642 -5.7659 { cb tyr A 175 1r5mA_175Y_183}-8.4907 -1.6156 -6.3381 { cg tyr A 175 1r5mA_175Y_183}-9.8623 -1.4198 -6.9449 { cd1 tyr A 175 1r5mA_175Y_183}-10.012 -0.8361 -8.2005 { ce1 tyr A 175 1r5mA_175Y_183}-11.2635 -0.7228 -8.7988 { cz tyr A 175 1r5mA_175Y_183}-12.3823 -1.192 -8.1377 { oh tyr A 175 1r5mA_175Y_183}-13.6145 -1.107 -8.7459 { cg tyr A 175 1r5mA_175Y_183}P -9.8623 -1.4198 -6.9449 { cd2 tyr A 175 1r5mA_175Y_183}-11.0054 -1.878 -6.2905 { ce2 tyr A 175 1r5mA_175Y_183}-12.267 -1.7681 -6.8815 { cz tyr A 175 1r5mA_175Y_183}ghost -12.3823 -1.192 -8.1377 { ca arg A 183 1r5mA_175Y_183}P -11.8051 3.3254 -6.4507 { cb arg A 183 1r5mA_175Y_183}-12.7111 2.4828 -7.3616 { cg arg A 183 1r5mA_175Y_183}-13.2117 3.2206 -8.6021 { cd arg A 183 1r5mA_175Y_183}-14.1666 2.3571 -9.4213 { ne arg A 183 1r5mA_175Y_183}-14.9665 3.1518 -10.3526 { cz arg A 183 1r5mA_175Y_183}-14.5261 3.6396 -11.511 { nh1 arg A 183 1r5mA_175Y_183}-13.2793 3.416 -11.9056 { cz arg A 183 1r5mA_175Y_183}P -14.5261 3.6396 -11.511 { nh2 arg A 183 1r5mA_175Y_183}-15.331 4.3673 -12.2715 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 175 1r5mA_175Y_183}P -8.4907 -1.6156 -6.3381 {"}P -8.4907 -1.6156 -6.3381 { cd1 tyr A 175 1r5mA_175Y_183}P -10.012 -0.8361 -8.2005 { cd2 tyr A 175 1r5mA_175Y_183}P -11.0054 -1.878 -6.2905 { ce1 tyr A 175 1r5mA_175Y_183}P -11.2635 -0.7228 -8.7988 { ce2 tyr A 175 1r5mA_175Y_183}P -12.267 -1.7681 -6.8815 { oh tyr A 175 1r5mA_175Y_183}P -13.6145 -1.107 -8.7459 { cb arg A 183 1r5mA_175Y_183}P -12.7111 2.4828 -7.3616 {"}P -12.7111 2.4828 -7.3616 { cg arg A 183 1r5mA_175Y_183}P -13.2117 3.2206 -8.6021 {"}P -13.2117 3.2206 -8.6021 { cd arg A 183 1r5mA_175Y_183}P -14.1666 2.3571 -9.4213 {"}P -14.1666 2.3571 -9.4213 { ne arg A 183 1r5mA_175Y_183}P -14.9665 3.1518 -10.3526 { nh1 arg A 183 1r5mA_175Y_183}P -13.2793 3.416 -11.9056 {"}P -13.2793 3.416 -11.9056 { nh2 arg A 183 1r5mA_175Y_183}P -15.331 4.3673 -12.2715 {"}P -15.331 4.3673 -12.2715 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 175 A}'S' blue -10.8108 0.68 -7.8458 { CZ TYR 175 A}'S' sky -11.8931 0.2399 -7.2576 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 175 A}'S' green -11.7175 0.455 -7.5863 {"}'S' green -12.2969 0.6273 -8.3833 {"}'S' green -11.4862 0.5668 -7.6373 {"}'S' green -12.2251 0.7307 -8.6369 {"}'S' green -11.2437 0.6405 -7.7021 {"}'S' green -11.9609 0.8789 -8.6957 {"}'S' sea -11.0956 0.7944 -7.9433 {"}'S' green -11.2236 0.8973 -8.1382 {"}'S' green -11.366 0.9632 -8.3411 {"}'S' green -11.5179 0.9904 -8.5447 {"}'S' green -11.6756 0.9773 -8.7452 { CZ TYR 175 A}'S' sea -12.48 0.3004 -7.2295 {"}'S' green -12.6155 0.3906 -7.4283 {"}'S' green -12.7634 0.4404 -7.6333 {"}'S' sea -12.9193 0.446 -7.8374 {"}'S' sea -12.2144 0.3252 -7.2822 {"}'S' green -12.3424 0.4282 -7.4772 {"}'S' green -12.6367 0.5212 -7.8836 {"}'S' green -12.7944 0.5081 -8.0842 {"}'S' green -12.0118 0.3736 -7.4487 {"}'S' green -12.6111 0.5383 -8.2696 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 175 A}'S' P -11.8391 0.577 -7.7786 {"}'S' -11.8219 0.5369 -7.8091 {"}'S' P -11.9814 0.6474 -7.9805 {"}'S' -11.9464 0.582 -8.0203 {"}'S' P -12.1356 0.6651 -8.1852 {"}'S' -12.1054 0.6177 -8.2065 {"}'S' P -11.6084 0.6931 -7.8298 {"}'S' -11.5975 0.6484 -7.8593 {"}'S' P -11.7483 0.7741 -8.0327 {"}'S' -11.7214 0.691 -8.076 {"}'S' P -11.9013 0.8083 -8.241 {"}'S' -11.8693 0.7302 -8.2684 {"}'S' P -12.0623 0.7933 -8.4441 {"}'S' -12.0471 0.7656 -8.451 {"}'S' P -11.3613 0.7695 -7.8905 {"}'S' -11.361 0.7655 -7.8927 {"}'S' P -11.4967 0.8598 -8.0894 {"}'S' -11.4893 0.8129 -8.1113 {"}'S' P -11.6446 0.9096 -8.2944 {"}'S' -11.6305 0.8526 -8.3117 {"}'S' P -11.8005 0.9151 -8.4985 {"}'S' -11.7928 0.8903 -8.5028 { CZ TYR 175 A}'S' P -12.4848 0.494 -7.6801 {"}'S' -12.4837 0.4789 -7.6837 {"}'S' P -12.1461 0.472 -7.6496 {"}'S' -12.1501 0.4454 -7.6575 {"}'S' P -12.2929 0.5328 -7.8573 {"}'S' -12.2959 0.4862 -7.8644 {"}'S' P -12.4496 0.5558 -8.0647 {"}'S' -12.4489 0.5391 -8.0651 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 175 A}'S' blue -13.8572 0.2705 -8.8075 {"}'S' blue -14.0174 0.2098 -8.9973 {"}'S' blue -13.6818 0.2678 -9.0012 {"}'S' blue -13.8426 0.2007 -9.1904 {"}'S' blue -13.4756 0.2264 -9.1509 {"}'S' blue -13.6368 0.1599 -9.3407 {"}'S' blue -13.7934 0.0506 -9.5126 {"}'S' blue -13.4245 0.079 -9.4661 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ARG 183 A}'S' blue -13.1333 0.8104 -7.6595 {"}'S' blue -12.9847 0.7566 -7.4526 { CD ARG 183 A}'S' blue -14.1208 0.6367 -9.101 {"}'S' blue -13.9584 0.6975 -8.9067 {"}'S' blue -14.0142 0.6147 -9.3844 {"}'S' blue -13.8504 0.6527 -9.1846 {"}'S' blue -13.6876 0.7284 -8.9948 { HB2 ARG 183 A}'S' sky -12.8763 0.6754 -7.5115 {"}'S' sky -12.9119 0.7431 -7.9857 { HD2 ARG 183 A}'S' blue -13.7781 0.556 -9.5028 {"}'S' blue -13.6196 0.6425 -9.3214 {"}'S' blue -13.6322 0.4674 -9.7207 {"}'S' blue -13.4735 0.5319 -9.534 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ARG 183 A}'S' green -12.7965 0.6115 -7.7997 {"}'S' green -12.6592 0.53 -7.6002 {"}'S' green -12.5072 0.5042 -7.3969 {"}'S' sea -12.3478 0.5347 -7.1997 {"}'S' sea -12.7443 0.7109 -8.1919 {"}'S' green -12.6355 0.5702 -8.0128 {"}'S' green -12.2019 0.4462 -7.4175 {"}'S' sea -12.0433 0.5107 -7.2308 {"}'S' green -12.5062 0.6556 -8.2998 {"}'S' green -11.9417 0.4479 -7.5134 {"}'S' sea -11.7837 0.5337 -7.3324 {"}'S' green -12.3158 0.7589 -8.4939 {"}'S' green -11.6217 0.556 -7.5398 {"}'S' green -12.0797 0.8399 -8.5775 {"}'S' green -11.3649 0.7294 -7.6231 {"}'S' green -11.8415 0.9468 -8.6079 {"}'S' green -11.2893 0.8252 -7.8595 {"}'S' green -11.584 1.0169 -8.5249 {"}'S' green -11.2871 0.9428 -8.1209 {"}'S' sea -11.3257 1.1397 -8.369 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 ARG 183 A}'S' P -12.5048 0.4758 -7.8177 {"}'S' -12.4978 0.4985 -7.8151 {"}'S' P -12.3575 0.4342 -7.6154 {"}'S' -12.354 0.4547 -7.617 {"}'S' P -12.39 0.5238 -8.1144 {"}'S' -12.3877 0.5393 -8.108 {"}'S' P -12.2535 0.4424 -7.9143 {"}'S' -12.2497 0.4895 -7.9045 {"}'S' P -12.1011 0.4174 -7.7106 {"}'S' -12.1033 0.4478 -7.7104 {"}'S' P -12.2133 0.6061 -8.3188 {"}'S' -12.2123 0.6259 -8.3049 {"}'S' P -12.0848 0.5053 -8.1237 {"}'S' -12.0889 0.5632 -8.0998 {"}'S' P -11.9376 0.4622 -7.9211 {"}'S' -11.9491 0.524 -7.9083 {"}'S' P -11.7798 0.4792 -7.7231 {"}'S' -11.7891 0.5064 -7.7215 {"}'S' P -11.976 0.6812 -8.3996 {"}'S' -11.9858 0.7305 -8.361 {"}'S' P -11.8411 0.5863 -8.1987 {"}'S' -11.8672 0.671 -8.1545 {"}'S' P -11.6853 0.5621 -7.9905 {"}'S' -11.7211 0.6386 -7.968 {"}'S' P -11.5221 0.611 -7.7939 {"}'S' -11.5383 0.6365 -7.7912 {"}'S' P -11.7389 0.794 -8.4328 {"}'S' -11.7604 0.835 -8.3946 {"}'S' P -11.6017 0.719 -8.2333 {"}'S' -11.641 0.7799 -8.1949 {"}'S' P -11.4454 0.7298 -8.0341 {"}'S' -11.4754 0.7657 -8.02 {"}'S' P -11.4506 0.9142 -8.3242 {"}'S' -11.4615 0.9236 -8.3139 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 175 A}'M' greentint -9.3332 2.017 -6.2988 {"}'M' greentint -9.4921 1.9283 -6.4804 {"}'M' greentint -9.6357 1.8206 -6.7528 {"}'M' greentint -9.2301 2.2496 -6.3477 {"}'M' greentint -9.3934 2.2162 -6.5496 {"}'M' greentint -9.542 2.0593 -6.6981 {"}'M' greentint -9.6457 1.9629 -6.9956 {"}'M' greentint -9.7022 1.7135 -6.9988 {"}'M' greentint -9.0862 2.4547 -6.4098 {"}'M' greentint -9.2442 2.4464 -6.6118 {"}'M' greentint -9.4027 2.3532 -6.7902 {"}'M' greentint -9.542 2.1852 -6.9233 {"}'M' greentint -9.6153 2.057 -7.2404 {"}'M' greentint -9.6865 1.8118 -7.2646 {"}'M' greentint -9.0572 2.6355 -6.6796 {"}'M' greentint -9.2174 2.5772 -6.8716 {"}'M' greentint -9.3721 2.4542 -7.0363 {"}'M' greentint -9.5079 2.2766 -7.1624 {"}'M' greentint -9.5374 2.1372 -7.4786 {"}'M' greentint -8.9744 2.7555 -6.9237 {"}'M' greentint -9.1365 2.6733 -7.1094 {"}'M' greentint -9.2887 2.5373 -7.2694 {"}'M' greentint -9.4254 2.3557 -7.3942 {"}'M' greentint -9.1815 2.576 -7.5059 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 183 A}'M' greentint -9.5809 1.6695 -6.5991 {"}'M' greentint -9.4307 1.794 -6.4392 {"}'M' greentint -9.2975 1.9695 -6.3161 {"}'M' greentint -9.6885 1.6648 -7.1364 {"}'M' greentint -9.5303 1.667 -6.9326 {"}'M' greentint -9.3696 1.743 -6.7458 {"}'M' greentint -9.2201 1.8883 -6.5934 {"}'M' greentint -9.0955 2.0883 -6.4875 {"}'M' greentint -9.007 2.3259 -6.4395 {"}'M' greentint -9.5854 1.8275 -7.3914 {"}'M' greentint -9.4366 1.7778 -7.1853 {"}'M' greentint -9.2743 1.8227 -6.9874 {"}'M' greentint -9.1201 1.9554 -6.8257 {"}'M' greentint -8.9958 2.1587 -6.721 {"}'M' greentint -8.9175 2.4044 -6.6889 {"}'M' greentint -8.8965 2.6598 -6.7322 {"}'M' greentint -9.4574 2.063 -7.5539 {"}'M' greentint -9.3256 1.9613 -7.3558 {"}'M' greentint -9.1646 1.9894 -7.1558 {"}'M' greentint -9.0166 2.1413 -7.0069 {"}'M' greentint -8.9218 2.3754 -6.9496 {"}'M' greentint -8.9055 2.6291 -6.9989 {"}'M' greentint -9.2963 2.3343 -7.5871 {"}'M' greentint -9.1921 2.1791 -7.4093 {"}'M' greentint -9.0322 2.276 -7.2299 {"}'M' greentint -8.9772 2.5293 -7.2296 {"}'M' greentint -9.1105 2.4257 -7.4291 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 175 A}'M' greentint -10.097 0.9844 -4.3353 {"}'M' greentint -10.2303 0.8807 -4.5348 {"}'M' greentint -10.0154 1.2309 -4.3552 {"}'M' greentint -10.1753 1.134 -4.5346 {"}'M' greentint -10.2857 1.0346 -4.8149 {"}'M' greentint -10.302 0.7809 -4.7656 {"}'M' greentint -9.8819 1.4488 -4.4087 {"}'M' greentint -10.0429 1.4207 -4.6087 {"}'M' greentint -10.1909 1.2688 -4.7576 {"}'M' greentint -10.2574 1.1321 -5.0685 {"}'M' greentint -10.3078 0.8774 -5.0639 {"}'M' greentint -9.6934 1.6186 -4.4754 {"}'M' greentint -9.8523 1.6218 -4.6813 {"}'M' greentint -10.0126 1.5307 -4.8641 {"}'M' greentint -10.154 1.3602 -4.9997 {"}'M' greentint -10.1606 1.2064 -5.3085 {"}'M' greentint -10.2289 0.9574 -5.3262 {"}'M' greentint -9.5966 1.7533 -4.7308 {"}'M' greentint -9.7579 1.7142 -4.9287 {"}'M' greentint -9.9145 1.6021 -5.1001 {"}'M' greentint -10.0531 1.4274 -5.2309 {"}'M' greentint -9.7768 1.6161 -5.3253 {"}'M' greentint -9.91 1.4405 -5.4483 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 183 A}'M' green -10.2836 0.8468 -5.2527 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 183 A}'M' greentint -10.1509 0.8277 -4.3955 {"}'M' greentint -10.0106 0.9897 -4.2594 {"}'M' greentint -10.1953 0.7671 -4.7995 {"}'M' greentint -10.0375 0.8774 -4.626 {"}'M' greentint -9.8921 1.0391 -4.4831 {"}'M' greentint -9.7675 1.2415 -4.3795 {"}'M' greentint -9.6711 1.4746 -4.3196 {"}'M' greentint -10.1244 0.8693 -5.0522 {"}'M' greentint -9.9647 0.9578 -4.8712 {"}'M' greentint -9.818 1.1074 -4.7237 {"}'M' greentint -9.6942 1.3072 -4.619 {"}'M' greentint -9.6024 1.5414 -4.5657 {"}'M' greentint -10.165 1.0288 -5.4072 {"}'M' greentint -10.0061 1.0398 -5.2063 {"}'M' greentint -9.8491 1.1357 -5.029 {"}'M' greentint -9.7106 1.3062 -4.8975 {"}'M' greentint -9.6077 1.5297 -4.8266 {"}'M' greentint -9.5533 1.7794 -4.8263 {"}'M' greentint -10.0306 1.2366 -5.483 {"}'M' greentint -9.8675 1.2658 -5.2804 {"}'M' greentint -9.7177 1.4196 -5.1295 {"}'M' greentint -9.6224 1.6559 -5.072 {"}'M' greentint -9.7593 1.5638 -5.3406 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 277 1r89A_279F_331}P -12.1104 -1.9014 0.4035 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{ ca ala A 280 1r89A_279F_331}-6.451 1.6056 -8.7542 { ca val A 281 1r89A_279F_331}-6.5443 0.9661 -12.4883 { ca leu A 329 1r89A_279F_331}P -8.3897 5.58 -11.6754 {"}-8.3897 5.58 -11.6754 { ca leu A 330 1r89A_279F_331}-8.8685 5.1617 -7.9502 { ca phe A 331 1r89A_279F_331}-11.7444 3.4264 -6.1617 { ca glu A 332 1r89A_279F_331}-12.8074 2.6383 -2.6243 { ca cys A 333 1r89A_279F_331}-15.5737 0.0047 -2.1147 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 279 1r89A_279F_331}P -7.4656 -0.067 -5.4903 { cb phe A 279 1r89A_279F_331}-7.9565 -1.452 -5.9426 { cg phe A 279 1r89A_279F_331}-9.3597 -1.4706 -6.4583 { cd1 phe A 279 1r89A_279F_331}-9.6072 -1.2958 -7.8088 { ce1 phe A 279 1r89A_279F_331}-10.8925 -1.3041 -8.2975 { cz phe A 279 1r89A_279F_331}-11.9866 -1.4536 -7.4227 { cg phe A 279 1r89A_279F_331}P -9.3597 -1.4706 -6.4583 { cd2 phe A 279 1r89A_279F_331}-10.4497 -1.6223 -5.5792 { ce2 phe A 279 1r89A_279F_331}-11.7602 -1.6185 -6.0571 { cz phe A 279 1r89A_279F_331}ghost -11.9866 -1.4536 -7.4227 { ca phe A 331 1r89A_279F_331}P -11.7444 3.4264 -6.1617 { cb phe A 331 1r89A_279F_331}-12.3383 2.2958 -7.0367 { cg phe A 331 1r89A_279F_331}-12.4953 2.6826 -8.4742 { cd1 phe A 331 1r89A_279F_331}-13.5927 3.4192 -8.8931 { ce1 phe A 331 1r89A_279F_331}-13.6909 3.8452 -10.2063 { cz phe A 331 1r89A_279F_331}-12.6968 3.5725 -11.0905 { cg phe A 331 1r89A_279F_331}P -12.4953 2.6826 -8.4742 { cd2 phe A 331 1r89A_279F_331}-11.4586 2.4395 -9.3823 { ce2 phe A 331 1r89A_279F_331}-11.5709 2.8817 -10.6875 { cz phe A 331 1r89A_279F_331}ghost -12.6968 3.5725 -11.0905 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 279 1r89A_279F_331}P -7.9565 -1.452 -5.9426 {"}P -7.9565 -1.452 -5.9426 { cd1 phe A 279 1r89A_279F_331}P -9.6072 -1.2958 -7.8088 { cd2 phe A 279 1r89A_279F_331}P -10.4497 -1.6223 -5.5792 { ce1 phe A 279 1r89A_279F_331}P -10.8925 -1.3041 -8.2975 { ce2 phe A 279 1r89A_279F_331}P -11.7602 -1.6185 -6.0571 { cz phe A 279 1r89A_279F_331}P -11.9866 -1.4536 -7.4227 { cb phe A 331 1r89A_279F_331}P -12.3383 2.2958 -7.0367 {"}P -12.3383 2.2958 -7.0367 { cd1 phe A 331 1r89A_279F_331}P -13.5927 3.4192 -8.8931 { cd2 phe A 331 1r89A_279F_331}P -11.4586 2.4395 -9.3823 { ce1 phe A 331 1r89A_279F_331}P -13.6909 3.8452 -10.2063 { ce2 phe A 331 1r89A_279F_331}P -11.5709 2.8817 -10.6875 { cz phe A 331 1r89A_279F_331}P -12.6968 3.5725 -11.0905 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 279 A}'S' blue -11.6914 0.212 -7.9428 {"}'S' blue -10.8727 0.0592 -7.2008 {"}'S' sky -10.9903 0.1883 -7.3892 {"}'S' sky -11.2736 0.3283 -7.793 {"}'S' sky -11.4295 0.3339 -7.9971 {"}'S' blue -10.8526 0.3161 -7.6369 {"}'S' sky -10.995 0.382 -7.8398 {"}'S' blue -11.1469 0.4091 -8.0434 {"}'S' blue -11.2853 0.3696 -8.625 {"}'S' blue -10.943 0.4146 -8.6237 {"}'S' blue -11.1066 0.3532 -8.818 {"}'S' blue -11.2675 0.2547 -8.9982 { CE2 PHE 279 A}'S' blue -11.989 0.1118 -6.1889 {"}'S' blue -12.1529 0.0552 -6.3846 {"}'S' sky -11.6485 0.1237 -6.1808 {"}'S' sky -11.8106 0.1002 -6.3833 {"}'S' sky -11.44 0.0805 -6.3319 {"}'S' sky -11.6017 0.0575 -6.5358 {"}'S' blue -11.2249 -0.0017 -6.4601 { CZ PHE 279 A}'S' sky -12.5236 0.1843 -7.1224 {"}'S' blue -12.684 0.1481 -7.3197 {"}'S' sky -12.3987 0.2465 -7.3692 {"}'S' blue -12.5595 0.1939 -7.5616 {"}'S' blue -12.3794 0.22 -7.7503 {"}'S' sky -11.3087 0.0056 -6.7353 {"}'S' sky -12.0371 0.2651 -7.749 {"}'S' sky -11.8282 0.2224 -7.9014 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 279 A}'S' sea -11.3773 0.1928 -7.5313 {"}'S' sea -11.5303 0.227 -7.7397 {"}'S' sea -11.1257 0.2785 -7.5881 { CZ PHE 279 A}'S' sea -12.2198 0.129 -6.7133 {"}'S' sea -12.3677 0.1788 -6.9183 {"}'S' sea -11.8187 0.0636 -6.5672 {"}'S' green -11.9467 0.1665 -6.7622 {"}'S' green -12.0891 0.2324 -6.9651 {"}'S' green -12.241 0.2596 -7.1686 {"}'S' sea -11.6161 0.112 -6.7337 {"}'S' green -11.7505 0.2104 -6.9347 {"}'S' green -11.8973 0.2712 -7.1423 {"}'S' green -12.0539 0.2942 -7.3497 {"}'S' sea -12.2155 0.2767 -7.5546 {"}'S' green -11.4311 0.1302 -6.9292 {"}'S' green -11.569 0.2212 -7.1316 {"}'S' green -11.7181 0.2742 -7.339 {"}'S' green -11.875 0.2886 -7.5464 {"}'S' sea -11.2231 0.0834 -7.0803 {"}'S' green -11.3602 0.1743 -7.2833 {"}'S' green -11.5088 0.2281 -7.4902 {"}'S' sea -11.6665 0.2454 -7.6976 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 331 A}'S' blue -12.6119 0.5696 -7.1277 {"}'S' blue -12.4977 0.5949 -7.4148 {"}'S' blue -12.382 0.6783 -7.7029 { CD2 PHE 331 A}'S' blue -11.4129 0.7191 -9.062 {"}'S' blue -11.2505 0.7799 -8.8676 {"}'S' blue -11.0893 0.8764 -8.6864 {"}'S' blue -11.1425 0.7351 -9.1455 {"}'S' blue -10.9797 0.8109 -8.9558 { HB2 PHE 331 A}'S' sky -12.4048 0.5003 -6.8032 {"}'S' sky -12.2575 0.4573 -6.6006 {"}'S' blue -12.1001 0.4752 -6.4015 {"}'S' sky -11.8763 0.3596 -6.4913 {"}'S' sky -11.7179 0.4461 -6.3099 {"}'S' sky -12.2728 0.5358 -7.4835 {"}'S' sky -11.5718 0.3356 -6.5225 {"}'S' blue -11.4188 0.4516 -6.357 {"}'S' sky -11.3122 0.3586 -6.624 {"}'S' sky -11.8443 0.5838 -7.7856 {"}'S' blue -11.1501 0.381 -6.8315 {"}'S' blue -11.6082 0.6648 -7.8692 {"}'S' sky -11.5045 0.5061 -7.6912 {"}'S' blue -11.0506 0.4359 -7.0856 {"}'S' blue -11.37 0.7717 -7.8995 {"}'S' sky -11.2674 0.6189 -7.7244 {"}'S' sky -11.1302 0.5439 -7.525 {"}'S' sky -10.9739 0.5547 -7.3257 {"}'S' blue -10.9791 0.7391 -7.6159 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 PHE 331 A}'S' sea -12.325 0.4364 -7.0914 {"}'S' green -12.1877 0.3549 -6.8919 {"}'S' sea -12.0357 0.3292 -6.6886 {"}'S' green -12.164 0.3951 -7.3044 {"}'S' green -12.0333 0.3008 -7.1094 {"}'S' green -11.886 0.2591 -6.9071 {"}'S' green -11.7304 0.2711 -6.7092 {"}'S' sea -12.0347 0.4805 -7.5915 {"}'S' green -11.9185 0.3487 -7.4061 {"}'S' green -11.6296 0.2424 -7.0023 {"}'S' sea -11.4702 0.2728 -6.805 {"}'S' sea -11.7418 0.431 -7.6105 {"}'S' green -11.6133 0.3302 -7.4153 {"}'S' green -11.466 0.2872 -7.2128 {"}'S' sea -11.3083 0.3041 -7.0147 {"}'S' sea -11.3696 0.4112 -7.4903 {"}'S' sea -11.2138 0.387 -7.2821 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 PHE 331 A}'S' P -11.782 0.2673 -7.206 {"}'S' -11.7815 0.2695 -7.2058 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 279 A}'M' green -9.6261 2.2781 -6.5623 {"}'M' green -9.5957 2.3721 -6.8071 {"}'M' green -8.7009 3.1846 -6.5572 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 279 A}'M' greentint -9.2106 2.5648 -5.9145 {"}'M' greentint -9.3738 2.5314 -6.1163 {"}'M' greentint -9.5224 2.3745 -6.2648 {"}'M' greentint -9.0666 2.7699 -5.9765 {"}'M' greentint -9.2246 2.7615 -6.1785 {"}'M' greentint -9.3832 2.6684 -6.3569 {"}'M' greentint -9.5224 2.5004 -6.4901 {"}'M' greentint -8.8815 2.94 -6.0425 {"}'M' greentint -9.0376 2.9506 -6.2463 {"}'M' greentint -9.1978 2.8924 -6.4383 {"}'M' greentint -9.3526 2.7693 -6.603 {"}'M' greentint -9.4883 2.5918 -6.7292 {"}'M' greentint -8.7944 3.094 -6.2884 {"}'M' greentint -8.9544 3.07 -6.4897 {"}'M' greentint -9.1169 2.9884 -6.6761 {"}'M' greentint -9.2692 2.8525 -6.8361 {"}'M' greentint -9.4058 2.6709 -6.9609 {"}'M' greentint -8.86 3.1335 -6.7494 {"}'M' greentint -9.0158 3.0347 -6.9227 {"}'M' greentint -9.162 2.8911 -7.0726 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 331 A}'M' greentint -9.5257 2.2967 -6.3148 {"}'M' greentint -9.3675 2.3605 -6.1285 {"}'M' greentint -9.2173 2.4849 -5.9686 {"}'M' greentint -9.4751 2.3557 -6.6658 {"}'M' greentint -9.3169 2.3579 -6.462 {"}'M' greentint -9.1562 2.4339 -6.2752 {"}'M' greentint -9.0067 2.5793 -6.1228 {"}'M' greentint -8.8821 2.7792 -6.0169 {"}'M' greentint -9.372 2.5184 -6.9208 {"}'M' greentint -9.2232 2.4688 -6.7147 {"}'M' greentint -9.0609 2.5137 -6.5168 {"}'M' greentint -8.9067 2.6463 -6.3551 {"}'M' greentint -8.7824 2.8496 -6.2504 {"}'M' greentint -8.7041 3.0953 -6.2183 {"}'M' greentint -9.244 2.754 -7.0833 {"}'M' greentint -9.1122 2.6523 -6.8851 {"}'M' greentint -8.9512 2.6803 -6.6852 {"}'M' greentint -8.8032 2.8323 -6.5363 {"}'M' greentint -8.7084 3.0664 -6.479 {"}'M' greentint -8.9787 2.8701 -6.9387 {"}'M' greentint -8.8188 2.967 -6.7592 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 279 A}'M' green -9.7462 1.219 -3.9692 {"}'M' green -9.8794 1.1154 -4.1686 {"}'M' green -9.9511 1.0156 -4.3994 {"}'M' green -9.957 1.112 -4.6977 {"}'M' green -9.3426 1.8533 -4.1092 {"}'M' green -9.2457 1.988 -4.3647 {"}'M' green -9.2757 1.9752 -4.7992 {"}'M' green -9.426 1.8507 -4.9591 {"}'M' green -9.5591 1.6752 -5.0822 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 279 A}'M' greentint -9.6645 1.4656 -3.989 {"}'M' greentint -9.8245 1.3686 -4.1684 {"}'M' greentint -9.9348 1.2693 -4.4487 {"}'M' greentint -9.531 1.6834 -4.0425 {"}'M' greentint -9.692 1.6553 -4.2425 {"}'M' greentint -9.84 1.5034 -4.3914 {"}'M' greentint -9.9066 1.3667 -4.7023 {"}'M' greentint -9.5015 1.8564 -4.3151 {"}'M' greentint -9.6617 1.7653 -4.4979 {"}'M' greentint -9.8031 1.5948 -4.6335 {"}'M' greentint -9.8097 1.441 -4.9423 {"}'M' greentint -9.407 1.9488 -4.5625 {"}'M' greentint -9.5637 1.8368 -4.7339 {"}'M' greentint -9.7022 1.662 -4.8647 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 331 A}'M' green -10.0121 1.0951 -4.2087 {"}'M' green -9.8603 1.2157 -4.0458 {"}'M' green -9.72 1.3777 -3.9098 {"}'M' green -9.5981 1.5743 -3.8068 {"}'M' green -10.0673 1.0994 -4.644 {"}'M' green -9.3805 1.8626 -3.97 {"}'M' green -9.993 1.2348 -4.9031 {"}'M' green -9.3118 1.9294 -4.216 {"}'M' green -9.8743 1.4168 -5.0576 {"}'M' green -9.74 1.6246 -5.1334 {"}'M' green -9.3318 2.0439 -4.7224 {"}'M' green -9.4687 1.9518 -4.991 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 331 A}'M' greentint -9.9047 1.1551 -4.4499 {"}'M' greentint -9.7469 1.2654 -4.2764 {"}'M' greentint -9.6015 1.4271 -4.1334 {"}'M' greentint -9.4769 1.6295 -4.0298 {"}'M' greentint -9.8338 1.2573 -4.7026 {"}'M' greentint -9.6741 1.3459 -4.5216 {"}'M' greentint -9.5274 1.4955 -4.374 {"}'M' greentint -9.4036 1.6952 -4.2693 {"}'M' greentint -9.7155 1.4278 -4.8567 {"}'M' greentint -9.5585 1.5237 -4.6794 {"}'M' greentint -9.42 1.6942 -4.5478 {"}'M' greentint -9.3171 1.9177 -4.477 {"}'M' greentint -9.5769 1.6538 -4.9307 {"}'M' greentint -9.4271 1.8076 -4.7799 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 35 1rjcA_37F_95Y}P -12.2146 -2.2845 0.4785 {"}-12.2146 -2.2845 0.4785 { ca gly A 35 1rjcA_37F_95Y}-10.8522 -1.9841 0.0932 { c gly A 35 1rjcA_37F_95Y}-10.7189 -0.9106 -0.9574 { o gly A 35 1rjcA_37F_95Y}-11.6921 -0.2525 -1.3304 { c gly A 35 1rjcA_37F_95Y}P -10.7189 -0.9106 -0.9574 { n trp A 36 1rjcA_37F_95Y}-9.4913 -0.7256 -1.4253 { ca trp A 36 1rjcA_37F_95Y}-9.1876 0.2484 -2.4579 { c trp A 36 1rjcA_37F_95Y}-8.3903 -0.4239 -3.5524 { o trp A 36 1rjcA_37F_95Y}-7.4928 -1.218 -3.274 { c trp A 36 1rjcA_37F_95Y}P -8.3903 -0.4239 -3.5524 { n phe A 37 1rjcA_37F_95Y}-8.7345 -0.1302 -4.7991 { ca phe A 37 1rjcA_37F_95Y}-7.9832 -0.6536 -5.9238 { c phe A 37 1rjcA_37F_95Y}-7.7364 0.529 -6.8441 { o phe A 37 1rjcA_37F_95Y}-8.4348 1.5443 -6.759 { c phe A 37 1rjcA_37F_95Y}P -7.7364 0.529 -6.8441 { n arg A 38 1rjcA_37F_95Y}-6.719 0.4243 -7.6854 { ca arg A 38 1rjcA_37F_95Y}-6.4028 1.5136 -8.5972 { c arg A 38 1rjcA_37F_95Y}-6.2682 0.9944 -10.0155 { o arg A 38 1rjcA_37F_95Y}-6.1003 -0.2055 -10.2367 { c arg A 38 1rjcA_37F_95Y}P -6.2682 0.9944 -10.0155 { n gln A 39 1rjcA_37F_95Y}-6.3404 1.8999 -10.9806 { ca gln A 39 1rjcA_37F_95Y}-6.24 1.5042 -12.3712 { c gln A 39 1rjcA_37F_95Y}-5.6782 2.623 -13.2344 { o gln A 39 1rjcA_37F_95Y}-6.1025 3.7726 -13.1317 { n met A 93 1rjcA_37F_95Y}P -6.1903 6.0002 -11.2482 {"}-6.1903 6.0002 -11.2482 { ca met A 93 1rjcA_37F_95Y}-7.5265 6.2925 -10.747 { c met A 93 1rjcA_37F_95Y}-7.7627 5.3621 -9.5606 { o met A 93 1rjcA_37F_95Y}-7.5261 4.1589 -9.6597 { c met A 93 1rjcA_37F_95Y}P -7.7627 5.3621 -9.5606 { n tyr A 94 1rjcA_37F_95Y}-8.2229 5.9109 -8.4436 { ca tyr A 94 1rjcA_37F_95Y}-8.4707 5.1006 -7.2559 { c tyr A 94 1rjcA_37F_95Y}-9.9554 4.9176 -6.9809 { o tyr A 94 1rjcA_37F_95Y}-10.7455 5.8544 -7.1005 { c tyr A 94 1rjcA_37F_95Y}P -9.9554 4.9176 -6.9809 { n tyr A 95 1rjcA_37F_95Y}-10.3253 3.6984 -6.6049 { ca tyr A 95 1rjcA_37F_95Y}-11.7136 3.3639 -6.3242 { c tyr A 95 1rjcA_37F_95Y}-11.8329 2.6066 -5.019 { o tyr A 95 1rjcA_37F_95Y}-10.9329 1.8623 -4.6289 { c tyr A 95 1rjcA_37F_95Y}P -11.8329 2.6066 -5.019 { n cys A 96 1rjcA_37F_95Y}-12.934 2.7949 -4.3198 { ca acys A 96 1rjcA_37F_95Y}-13.1375 2.0857 -3.1118 {"}P -13.1375 2.0857 -3.1118 { c cys A 96 1rjcA_37F_95Y}-14.1219 0.9547 -3.4232 { o cys A 96 1rjcA_37F_95Y}-15.0802 1.1713 -4.1656 { ca bcys A 96 1rjcA_37F_95Y}P -13.1403 2.03 -3.0601 { c cys A 96 1rjcA_37F_95Y}ghost -14.1219 0.9547 -3.4232 {"}P -14.1219 0.9547 -3.4232 { n ala A 97 1rjcA_37F_95Y}-13.8745 -0.226 -2.8822 { ca ala A 97 1rjcA_37F_95Y}-14.72 -1.3652 -3.166 { c ala A 97 1rjcA_37F_95Y}-15.245 -2.094 -1.9435 { o ala A 97 1rjcA_37F_95Y}-14.7473 -1.9183 -0.8299 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 35 1rjcA_37F_95Y}P -12.2146 -2.2845 0.4785 { ca gly A 35 1rjcA_37F_95Y}P -10.8522 -1.9841 0.0932 {"}P -10.8522 -1.9841 0.0932 { n trp A 36 1rjcA_37F_95Y}P -9.4913 -0.7256 -1.4253 { ca trp A 36 1rjcA_37F_95Y}P -9.1876 0.2484 -2.4579 { n phe A 37 1rjcA_37F_95Y}P -8.7345 -0.1302 -4.7991 { ca phe A 37 1rjcA_37F_95Y}P -7.9832 -0.6536 -5.9238 { n arg A 38 1rjcA_37F_95Y}P -6.719 0.4243 -7.6854 { ca arg A 38 1rjcA_37F_95Y}P -6.4028 1.5136 -8.5972 { n gln A 39 1rjcA_37F_95Y}P -6.3404 1.8999 -10.9806 { ca gln A 39 1rjcA_37F_95Y}P -6.24 1.5042 -12.3712 { n met A 93 1rjcA_37F_95Y}P -6.1903 6.0002 -11.2482 { ca met A 93 1rjcA_37F_95Y}P -7.5265 6.2925 -10.747 { n tyr A 94 1rjcA_37F_95Y}P -8.2229 5.9109 -8.4436 { ca tyr A 94 1rjcA_37F_95Y}P -8.4707 5.1006 -7.2559 { n tyr A 95 1rjcA_37F_95Y}P -10.3253 3.6984 -6.6049 { ca tyr A 95 1rjcA_37F_95Y}P -11.7136 3.3639 -6.3242 { n cys A 96 1rjcA_37F_95Y}P -12.934 2.7949 -4.3198 { ca acys A 96 1rjcA_37F_95Y}P -13.1375 2.0857 -3.1118 { n ala A 97 1rjcA_37F_95Y}P -13.8745 -0.226 -2.8822 { ca ala A 97 1rjcA_37F_95Y}P -14.72 -1.3652 -3.166 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 35 1rjcA_37F_95Y}P -10.8522 -1.9841 0.0932 {"}-10.8522 -1.9841 0.0932 { ca trp A 36 1rjcA_37F_95Y}-9.1876 0.2484 -2.4579 { ca phe A 37 1rjcA_37F_95Y}-7.9832 -0.6536 -5.9238 { ca arg A 38 1rjcA_37F_95Y}-6.4028 1.5136 -8.5972 { ca gln A 39 1rjcA_37F_95Y}-6.24 1.5042 -12.3712 { ca met A 93 1rjcA_37F_95Y}P -7.5265 6.2925 -10.747 {"}-7.5265 6.2925 -10.747 { ca tyr A 94 1rjcA_37F_95Y}-8.4707 5.1006 -7.2559 { ca tyr A 95 1rjcA_37F_95Y}-11.7136 3.3639 -6.3242 { ca acys A 96 1rjcA_37F_95Y}-13.1375 2.0857 -3.1118 { ca tyr A 95 1rjcA_37F_95Y}P -11.7136 3.3639 -6.3242 { ca bcys A 96 1rjcA_37F_95Y}-13.1403 2.03 -3.0601 { ca acys A 96 1rjcA_37F_95Y}P -13.1375 2.0857 -3.1118 { ca ala A 97 1rjcA_37F_95Y}-14.72 -1.3652 -3.166 { ca bcys A 96 1rjcA_37F_95Y}P -13.1403 2.03 -3.0601 { ca ala A 97 1rjcA_37F_95Y}-14.72 -1.3652 -3.166 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 37 1rjcA_37F_95Y}P -7.9832 -0.6536 -5.9238 { cb phe A 37 1rjcA_37F_95Y}-8.722 -1.8153 -6.6307 { cg phe A 37 1rjcA_37F_95Y}-9.9857 -1.4268 -7.3633 { cd1 phe A 37 1rjcA_37F_95Y}-9.9363 -0.7701 -8.5906 { ce1 phe A 37 1rjcA_37F_95Y}-11.1119 -0.486 -9.3019 { cz phe A 37 1rjcA_37F_95Y}-12.3443 -0.8629 -8.7795 { cg phe A 37 1rjcA_37F_95Y}P -9.9857 -1.4268 -7.3633 { cd2 phe A 37 1rjcA_37F_95Y}-11.2262 -1.7931 -6.8545 { ce2 phe A 37 1rjcA_37F_95Y}-12.4055 -1.5148 -7.5557 { cz phe A 37 1rjcA_37F_95Y}ghost -12.3443 -0.8629 -8.7795 { ca tyr A 95 1rjcA_37F_95Y}P -11.7136 3.3639 -6.3242 { cb tyr A 95 1rjcA_37F_95Y}-12.2795 2.4487 -7.415 { cg tyr A 95 1rjcA_37F_95Y}-12.1721 2.9789 -8.8229 { cd1 tyr A 95 1rjcA_37F_95Y}-13.2686 3.5721 -9.4488 { ce1 tyr A 95 1rjcA_37F_95Y}-13.1805 4.0506 -10.7483 { cz tyr A 95 1rjcA_37F_95Y}-11.9855 3.941 -11.4397 { oh tyr A 95 1rjcA_37F_95Y}-11.8982 4.4129 -12.7285 { cg tyr A 95 1rjcA_37F_95Y}P -12.1721 2.9789 -8.8229 { cd2 tyr A 95 1rjcA_37F_95Y}-10.9784 2.8801 -9.5374 { ce2 tyr A 95 1rjcA_37F_95Y}-10.8782 3.3576 -10.8406 { cz tyr A 95 1rjcA_37F_95Y}ghost -11.9855 3.941 -11.4397 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 37 1rjcA_37F_95Y}P -8.722 -1.8153 -6.6307 {"}P -8.722 -1.8153 -6.6307 { cd1 phe A 37 1rjcA_37F_95Y}P -9.9363 -0.7701 -8.5906 { cd2 phe A 37 1rjcA_37F_95Y}P -11.2262 -1.7931 -6.8545 { ce1 phe A 37 1rjcA_37F_95Y}P -11.1119 -0.486 -9.3019 { ce2 phe A 37 1rjcA_37F_95Y}P -12.4055 -1.5148 -7.5557 { cz phe A 37 1rjcA_37F_95Y}P -12.3443 -0.8629 -8.7795 { cb tyr A 95 1rjcA_37F_95Y}P -12.2795 2.4487 -7.415 {"}P -12.2795 2.4487 -7.415 { cd1 tyr A 95 1rjcA_37F_95Y}P -13.2686 3.5721 -9.4488 { cd2 tyr A 95 1rjcA_37F_95Y}P -10.9784 2.8801 -9.5374 { ce1 tyr A 95 1rjcA_37F_95Y}P -13.1805 4.0506 -10.7483 { ce2 tyr A 95 1rjcA_37F_95Y}P -10.8782 3.3576 -10.8406 { oh tyr A 95 1rjcA_37F_95Y}P -11.8982 4.4129 -12.7285 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 37 A}'S' sky -10.9989 0.2351 -7.6305 {"}'S' blue -10.7112 0.3694 -7.5122 {"}'S' sky -10.854 0.4358 -7.7158 {"}'S' blue -10.5119 0.5297 -7.5703 {"}'S' sky -10.6542 0.6001 -7.7723 {"}'S' sky -10.8084 0.6178 -7.977 {"}'S' blue -10.5741 0.761 -8.0328 {"}'S' blue -9.9868 0.9486 -8.9168 { CD2 PHE 37 A}'S' blue -11.455 -0.0627 -6.9863 {"}'S' blue -11.2767 -0.0744 -7.1807 { CE1 PHE 37 A}'S' sky -11.9841 0.9019 -8.6882 {"}'S' sky -11.1193 0.2109 -7.6972 {"}'S' sky -12.0736 0.9675 -9.14 {"}'S' sky -11.97 1.0373 -9.3835 {"}'S' sky -10.738 0.7245 -8.0948 {"}'S' sky -10.944 1.0312 -8.4463 {"}'S' sky -11.8421 1.0718 -9.6198 {"}'S' sky -10.3484 1.0511 -8.9594 { CE2 PHE 37 A}'S' blue -12.3655 0.1053 -6.8952 {"}'S' blue -12.508 0.1712 -7.0981 {"}'S' blue -12.6599 0.1984 -7.3016 {"}'S' blue -12.035 0.0508 -6.8666 {"}'S' sky -12.1693 0.1492 -7.0676 {"}'S' sky -11.8499 0.069 -7.0622 {"}'S' sky -11.6419 0.0222 -7.2132 { CZ PHE 37 A}'S' blue -12.9199 0.437 -7.7593 {"}'S' sky -12.9821 0.6682 -8.2218 {"}'S' sky -12.8813 0.7751 -8.4792 {"}'S' blue -12.7564 0.8372 -8.726 {"}'S' sky -12.4116 0.8849 -8.7065 {"}'S' blue -12.5731 0.8675 -8.9114 {"}'S' sky -12.0757 0.865 -8.6958 {"}'S' blue -12.2326 0.8793 -8.9032 {"}'S' blue -12.3948 0.8558 -9.1058 { HE1 PHE 37 A}'S' blue -11.4997 0.9311 -10.2595 {"}'S' sky -11.2102 1.0212 -10.3099 {"}'S' sky -10.8668 1.0144 -10.2936 {"}'S' blue -11.0209 1.0075 -10.4907 {"}'S' blue -10.6526 0.9333 -10.4231 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 37 A}'S' green -11.4038 0.3215 -7.7763 {"}'S' green -11.8298 0.8842 -8.4836 {"}'S' green -11.1639 0.438 -7.8168 {"}'S' green -11.5967 1.0109 -8.5357 {"}'S' sea -11.7497 1.0451 -8.7441 {"}'S' sea -11.9108 1.0302 -8.9471 {"}'S' sea -10.9195 0.5186 -7.8823 {"}'S' green -10.9944 0.7134 -8.0326 {"}'S' green -11.0921 0.8773 -8.2052 {"}'S' green -11.2097 1.0064 -8.3936 {"}'S' sea -11.3451 1.0966 -8.5924 {"}'S' sea -11.493 1.1464 -8.7974 {"}'S' sea -11.6489 1.152 -9.0015 {"}'S' sea -11.8093 1.1158 -9.1988 {"}'S' sea -10.8314 0.8935 -8.2626 {"}'S' sea -11.072 1.1342 -8.6413 {"}'S' green -11.2144 1.2001 -8.8442 {"}'S' green -11.3663 1.2272 -9.0478 {"}'S' green -11.524 1.2141 -9.2483 {"}'S' green -11.6848 1.1616 -9.4407 {"}'S' green -10.8758 1.178 -8.8138 {"}'S' green -11.5047 1.1877 -9.6294 {"}'S' sea -11.6658 1.094 -9.8111 {"}'S' sea -10.5564 1.0978 -8.8083 {"}'S' green -10.6943 1.1889 -9.0108 {"}'S' green -11.326 1.1713 -9.8224 {"}'S' sea -11.4869 1.0728 -10.0026 {"}'S' green -10.4855 1.142 -9.1624 {"}'S' green -11.1167 1.1294 -9.9744 {"}'S' sea -11.2779 1.0329 -10.1556 {"}'S' sea -10.2732 1.0498 -9.2904 {"}'S' green -10.4208 1.1093 -9.4972 {"}'S' green -10.5767 1.1308 -9.7049 {"}'S' green -10.7383 1.1119 -9.9095 {"}'S' sea -10.9018 1.0547 -10.1045 {"}'S' sea -10.3648 1.0123 -9.812 {"}'S' sea -10.5224 1.0005 -10.0128 { CE2 PHE 37 A}'S' sea -12.3161 0.21 -7.2753 {"}'S' sea -11.9878 0.16 -7.2646 {"}'S' sea -11.779 0.1131 -7.4163 { CZ PHE 37 A}'S' sea -12.4681 0.2611 -7.4434 {"}'S' sea -12.567 0.4268 -7.6181 {"}'S' sea -12.6892 0.5531 -7.8106 {"}'S' sea -12.8291 0.634 -8.0134 {"}'S' green -12.2268 0.3365 -7.5102 {"}'S' green -12.3245 0.5004 -7.6829 {"}'S' green -12.442 0.6295 -7.8713 {"}'S' green -12.5775 0.7197 -8.0701 {"}'S' sea -12.7254 0.7695 -8.2751 {"}'S' green -11.9704 0.3476 -7.5725 {"}'S' green -12.3044 0.7573 -8.119 {"}'S' green -12.4468 0.8232 -8.3219 {"}'S' sea -12.5987 0.8503 -8.5254 {"}'S' green -11.6759 0.2088 -7.5688 {"}'S' green -12.1082 0.8011 -8.2914 {"}'S' sea -12.2549 0.8619 -8.4991 {"}'S' green -11.4753 0.2542 -7.7511 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 37 A}'S' P -11.4693 0.5247 -7.919 {"}'S' -11.4673 0.5168 -7.93 {"}'S' P -11.566 0.6919 -8.0894 {"}'S' -11.5552 0.6645 -8.118 {"}'S' P -11.6875 0.8139 -8.2816 {"}'S' -11.6816 0.8004 -8.291 {"}'S' P -11.2357 0.638 -7.9657 {"}'S' -11.2359 0.6342 -7.9703 {"}'S' P -11.3346 0.8037 -8.1404 {"}'S' -11.3316 0.7828 -8.1589 {"}'S' P -11.4568 0.93 -8.3329 {"}'S' -11.4551 0.9226 -8.3374 {"}'S' P -11.0226 1.2388 -9.0215 {"}'S' -11.0235 1.2249 -9.0229 {"}'S' P -11.1792 1.2618 -9.2288 {"}'S' -11.1771 1.216 -9.2308 {"}'S' P -11.3408 1.2444 -9.4337 {"}'S' -11.3362 1.2087 -9.4312 {"}'S' P -10.8434 1.2419 -9.2181 {"}'S' -10.8487 1.2042 -9.2203 {"}'S' P -11.0003 1.2562 -9.4256 {"}'S' -11.0046 1.1953 -9.421 {"}'S' P -11.1624 1.2327 -9.6281 {"}'S' -11.1612 1.1882 -9.6198 {"}'S' P -10.6341 1.1958 -9.3693 {"}'S' -10.6381 1.1852 -9.369 {"}'S' P -10.7918 1.213 -9.5767 {"}'S' -10.7977 1.1781 -9.5718 {"}'S' P -10.9535 1.19 -9.7806 {"}'S' -10.9556 1.1698 -9.7738 { CZ PHE 37 A}'S' P -12.0637 0.5166 -7.7403 {"}'S' -12.0708 0.4807 -7.7674 {"}'S' P -12.1764 0.6543 -7.924 {"}'S' -12.1798 0.6158 -7.9455 {"}'S' P -11.755 0.4026 -7.7247 {"}'S' -11.7605 0.3908 -7.7346 {"}'S' P -11.8551 0.5691 -7.8994 {"}'S' -11.8703 0.524 -7.927 {"}'S' P -11.9738 0.7027 -8.0905 {"}'S' -11.9824 0.6646 -8.1071 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 95 A}'S' blue -12.9014 0.8183 -7.5476 {"}'S' sky -12.9611 0.9935 -8.1084 {"}'S' sky -12.8175 1.091 -8.3787 {"}'S' blue -12.6562 1.2439 -8.6271 {"}'S' sky -12.3478 1.1576 -8.5944 {"}'S' sky -11.5087 1.3125 -8.4997 { CG TYR 95 A}'S' blue -12.6449 1.2955 -8.7482 {"}'S' blue -12.5943 1.3065 -9.1208 {"}'S' blue -12.4456 1.2528 -8.9139 {"}'S' blue -12.2884 1.2364 -8.7055 {"}'S' blue -12.3314 1.278 -9.201 {"}'S' sky -12.1791 1.2372 -8.9937 {"}'S' sky -12.0197 1.2365 -8.786 {"}'S' blue -12.2157 1.3614 -9.4891 {"}'S' sky -12.0746 1.2945 -9.2878 {"}'S' blue -12.0039 1.4331 -9.6261 {"}'S' sky -11.862 1.365 -9.4234 { CD2 TYR 95 A}'S' sky -11.7379 1.3398 -9.8735 {"}'S' blue -11.4066 1.3732 -10.317 {"}'S' sky -11.1505 1.3662 -10.3993 {"}'S' sky -10.2526 1.3186 -9.2245 {"}'S' sky -10.8103 1.3343 -10.3406 { HB2 TYR 95 A}'S' blue -12.4753 0.5712 -7.1976 {"}'S' blue -12.328 0.5281 -6.9951 {"}'S' blue -11.9468 0.4304 -6.8858 {"}'S' sky -11.8009 0.3419 -7.1037 {"}'S' sky -11.5407 0.3437 -7.1995 {"}'S' sky -11.1211 0.5068 -7.4801 {"}'S' blue -10.9638 0.6252 -7.3093 {"}'S' sky -10.8883 0.7209 -7.5457 {"}'S' sky -10.8861 0.8385 -7.807 {"}'S' blue -10.7354 0.9924 -7.6551 { HD2 TYR 95 A}'S' blue -9.9499 1.4294 -9.0224 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 95 A}'S' sea -12.8392 0.8681 -7.9149 {"}'S' sea -12.7017 0.7763 -7.7129 {"}'S' sea -12.7077 0.9419 -8.1946 {"}'S' green -12.5809 0.8262 -7.9984 {"}'S' sea -12.5633 1.0741 -8.4598 {"}'S' green -12.4515 0.9347 -8.2769 {"}'S' sea -12.2383 1.0116 -8.4131 {"}'S' sea -12.0019 1.0942 -8.4882 {"}'S' sea -11.7635 1.2003 -8.5267 { CG TYR 95 A}'S' sea -11.9223 1.2668 -9.0836 {"}'S' sea -11.7647 1.2785 -8.8828 {"}'S' sea -11.6043 1.3289 -8.6905 { CD2 TYR 95 A}'S' sea -11.75 1.3116 -9.453 {"}'S' green -11.598 1.2702 -9.2444 {"}'S' green -11.4383 1.2673 -9.0374 {"}'S' green -11.2754 1.304 -8.8367 {"}'S' sea -11.1118 1.3797 -8.6475 {"}'S' green -11.6003 1.2497 -9.6701 {"}'S' green -10.9686 1.2673 -8.8585 {"}'S' sea -10.8082 1.365 -8.6786 {"}'S' sea -11.5382 1.2995 -10.0373 {"}'S' green -11.4007 1.2077 -9.8353 {"}'S' green -10.7703 1.2205 -9.0228 {"}'S' sea -10.6091 1.317 -8.8416 {"}'S' sea -11.2799 1.2576 -10.1208 {"}'S' green -11.1378 1.1792 -9.9156 {"}'S' green -10.4995 1.2515 -9.1109 {"}'S' sea -11.0221 1.2626 -10.2037 {"}'S' green -10.881 1.1957 -10.0023 {"}'S' green -10.7287 1.168 -9.7981 {"}'S' green -10.571 1.1797 -9.5973 {"}'S' green -10.4107 1.2301 -9.405 {"}'S' sea -10.6684 1.2662 -10.1379 {"}'S' sea -10.5152 1.24 -9.9328 {"}'S' sea -10.3566 1.2561 -9.7317 { HB2 TYR 95 A}'S' green -12.5109 0.6389 -7.6719 {"}'S' green -12.3955 0.5073 -7.4858 {"}'S' sea -12.2582 0.4258 -7.2864 {"}'S' sea -12.1062 0.4 -7.0831 {"}'S' green -12.4244 0.789 -8.034 {"}'S' green -12.1038 0.3716 -7.5039 {"}'S' sea -11.9565 0.3299 -7.3016 {"}'S' green -11.8525 0.3382 -7.6005 {"}'S' sea -11.7001 0.3132 -7.3967 {"}'S' green -11.9859 0.8509 -8.3254 {"}'S' green -11.5365 0.358 -7.6073 {"}'S' green -11.7431 0.9446 -8.4063 {"}'S' green -11.2843 0.4578 -7.6766 {"}'S' sea -11.4959 1.2979 -8.4909 {"}'S' green -11.4956 1.0538 -8.4227 {"}'S' green -11.2007 0.6148 -7.9195 {"}'S' sea -11.0444 0.6255 -7.7202 {"}'S' green -11.2508 1.1211 -8.3564 {"}'S' green -11.183 0.9127 -8.211 {"}'S' green -11.0496 0.8099 -8.0104 {"}'S' sea -11.0297 1.1918 -8.2343 {"}'S' sea -10.9246 1.0354 -8.0551 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD2 TYR 95 A}'S' P -11.4513 1.1967 -9.4628 {"}'S' -11.4476 1.2093 -9.4641 {"}'S' P -11.2935 1.1823 -9.2559 {"}'S' -11.2872 1.2162 -9.2618 {"}'S' P -11.1314 1.2057 -9.0533 {"}'S' -11.1297 1.2241 -9.0586 {"}'S' P -11.252 1.1539 -9.6284 {"}'S' -11.2463 1.1896 -9.6253 {"}'S' P -11.0948 1.1376 -9.42 {"}'S' -11.0912 1.1987 -9.4239 {"}'S' P -10.9327 1.1597 -9.2172 {"}'S' -10.9338 1.2056 -9.2258 {"}'S' P -10.9855 1.1384 -9.7083 {"}'S' -10.985 1.1737 -9.7038 {"}'S' P -10.8261 1.1377 -9.5005 {"}'S' -10.8295 1.1822 -9.5017 {"}'S' P -10.6623 1.1757 -9.3007 {"}'S' -10.6651 1.1898 -9.3027 { HB2 TYR 95 A}'S' P -12.3433 0.6067 -7.878 {"}'S' -12.3367 0.6168 -7.873 {"}'S' P -12.2345 0.466 -7.6989 {"}'S' -12.2282 0.4798 -7.6935 {"}'S' P -12.1929 0.7274 -8.1494 {"}'S' -12.1865 0.738 -8.1381 {"}'S' P -12.1052 0.5513 -7.986 {"}'S' -12.0888 0.596 -7.9567 {"}'S' P -11.989 0.4195 -7.8006 {"}'S' -11.9794 0.4638 -7.7821 {"}'S' P -11.9148 0.6546 -8.18 {"}'S' -11.9111 0.6774 -8.158 {"}'S' P -11.8123 0.5018 -8.005 {"}'S' -11.8104 0.5412 -7.9789 {"}'S' P -11.6838 0.4011 -7.8098 {"}'S' -11.6845 0.4128 -7.805 {"}'S' P -11.6787 0.7357 -8.2637 {"}'S' -11.6798 0.7515 -8.2449 {"}'S' P -11.575 0.5769 -8.0857 {"}'S' -11.5802 0.604 -8.0648 {"}'S' P -11.4401 0.4821 -7.8848 {"}'S' -11.4396 0.4829 -7.8844 {"}'S' P -11.4405 0.8425 -8.294 {"}'S' -11.4469 0.8567 -8.2736 {"}'S' P -11.3379 0.6898 -8.1189 {"}'S' -11.3497 0.7128 -8.0977 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 37 A}'M' greentint -9.3449 2.258 -5.97 {"}'M' greentint -9.5082 2.2246 -6.1718 {"}'M' greentint -9.6568 2.0677 -6.3203 {"}'M' greentint -9.7605 1.9713 -6.6178 {"}'M' greentint -9.201 2.4631 -6.032 {"}'M' greentint -9.3589 2.4548 -6.234 {"}'M' greentint -9.5175 2.3616 -6.4124 {"}'M' greentint -9.6568 2.1936 -6.5456 {"}'M' greentint -9.7301 2.0654 -6.8626 {"}'M' greentint -9.0158 2.6332 -6.098 {"}'M' greentint -9.172 2.6439 -6.3018 {"}'M' greentint -9.3321 2.5856 -6.4938 {"}'M' greentint -9.4869 2.4626 -6.6585 {"}'M' greentint -9.6226 2.285 -6.7847 {"}'M' greentint -9.6522 2.1456 -7.1008 {"}'M' greentint -8.7758 2.7514 -6.137 {"}'M' greentint -8.9287 2.7873 -6.3439 {"}'M' greentint -9.0892 2.7638 -6.5459 {"}'M' greentint -9.2513 2.6817 -6.7316 {"}'M' greentint -9.4035 2.5457 -6.8916 {"}'M' greentint -9.5402 2.3641 -7.0164 {"}'M' greentint -8.8352 2.8778 -6.6127 {"}'M' greentint -8.9944 2.8267 -6.8049 {"}'M' greentint -9.1502 2.7279 -6.9782 {"}'M' greentint -9.2963 2.5844 -7.1281 {"}'M' greentint -9.4271 2.4024 -7.2465 {"}'M' greentint -8.9945 2.7552 -7.1835 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 95 A}'M' greentint -9.6925 1.9479 -6.6476 {"}'M' greentint -9.5382 1.9472 -6.4485 {"}'M' greentint -9.38 2.0109 -6.2622 {"}'M' greentint -9.2297 2.1354 -6.1024 {"}'M' greentint -9.0966 2.311 -5.9793 {"}'M' greentint -9.6289 2.0792 -7.0026 {"}'M' greentint -9.4876 2.0062 -6.7995 {"}'M' greentint -9.3294 2.0084 -6.5958 {"}'M' greentint -9.1687 2.0844 -6.4089 {"}'M' greentint -9.0192 2.2297 -6.2565 {"}'M' greentint -8.8946 2.4297 -6.1507 {"}'M' greentint -8.806 2.6673 -6.1027 {"}'M' greentint -9.5005 2.3059 -7.2428 {"}'M' greentint -9.3844 2.1689 -7.0546 {"}'M' greentint -9.2357 2.1192 -6.8485 {"}'M' greentint -9.0733 2.1641 -6.6505 {"}'M' greentint -8.9191 2.2968 -6.4888 {"}'M' greentint -8.7949 2.5001 -6.3842 {"}'M' greentint -8.7166 2.7458 -6.3521 {"}'M' greentint -9.2564 2.4044 -7.2171 {"}'M' greentint -9.1247 2.3027 -7.0189 {"}'M' greentint -8.9637 2.3308 -6.8189 {"}'M' greentint -8.8156 2.4827 -6.6701 {"}'M' greentint -8.7208 2.7168 -6.6127 {"}'M' greentint -9.0954 2.6757 -7.2503 {"}'M' greentint -8.9912 2.5205 -7.0724 {"}'M' greentint -8.8312 2.6175 -6.893 {"}'M' greentint -8.7763 2.8707 -6.8928 {"}'M' greentint -8.9095 2.7671 -7.0923 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 37 A}'M' green -10.2879 0.6211 -4.4433 {"}'M' green -10.3515 0.8431 -5.4164 {"}'M' green -9.6593 1.441 -5.087 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 37 A}'M' greentint -10.2063 0.8677 -4.4631 {"}'M' greentint -10.3662 0.7707 -4.6425 {"}'M' greentint -10.4766 0.6714 -4.9228 {"}'M' greentint -9.941 0.9838 -4.3185 {"}'M' greentint -10.0728 1.0855 -4.5166 {"}'M' greentint -10.2338 1.0574 -4.7166 {"}'M' greentint -10.3818 0.9055 -4.8655 {"}'M' greentint -10.4483 0.7688 -5.1764 {"}'M' greentint -9.7495 1.1605 -4.3824 {"}'M' greentint -9.8843 1.2554 -4.5833 {"}'M' greentint -10.0432 1.2585 -4.7892 {"}'M' greentint -10.2035 1.1674 -4.9721 {"}'M' greentint -10.3449 0.9969 -5.1076 {"}'M' greentint -9.6358 1.3546 -4.6336 {"}'M' greentint -9.7875 1.3901 -4.8388 {"}'M' greentint -9.9488 1.3509 -5.0367 {"}'M' greentint -10.1054 1.2389 -5.208 {"}'M' greentint -10.244 1.0641 -5.3388 {"}'M' greentint -9.8175 1.3773 -5.2733 {"}'M' greentint -9.9677 1.2528 -5.4332 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 95 A}'M' green -10.4575 0.5461 -4.6835 {"}'M' green -10.5118 0.6291 -5.1407 {"}'M' green -9.7642 1.1546 -4.3209 {"}'M' green -10.4283 0.8069 -5.3987 {"}'M' green -9.6044 1.4428 -4.768 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 95 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{"}'S' green -13.5064 -0.642 -5.4266 {"}'S' sea -13.7384 -0.0435 -6.2119 {"}'S' sea -13.6556 -0.2283 -6.0532 {"}'S' green -13.5456 -0.3718 -5.87 {"}'S' green -13.4128 -0.4678 -5.6718 {"}'S' sea -13.4951 0.0502 -6.1929 {"}'S' green -13.4088 -0.1314 -6.0319 {"}'S' green -13.2909 -0.2597 -5.8431 {"}'S' sea -13.1365 -0.0517 -5.9189 { HB3 TYR 10 B}'S' green -13.0677 0.5945 -6.9361 {"}'S' green -12.815 0.3813 -6.5506 {"}'S' green -12.9813 0.7446 -7.2982 {"}'S' green -12.5133 0.2855 -6.5658 {"}'S' green -12.806 0.8947 -7.5441 {"}'S' green -12.2569 0.2688 -6.661 {"}'S' green -12.5772 1.0341 -7.6973 {"}'S' green -12.0934 0.3136 -6.8715 {"}'S' green -11.8411 0.4134 -6.9409 {"}'S' green -12.0528 1.2535 -7.7551 {"}'S' green -11.6012 0.5811 -6.9844 {"}'S' green -11.5865 1.1474 -7.4985 {"}'S' green -11.4815 0.991 -7.3193 { HD2 TYR 10 B}'S' sea -13.3818 -0.767 -5.2227 {"}'S' sea -13.2419 -0.832 -5.0235 {"}'S' green -13.1783 -0.7007 -5.3784 {"}'S' green -13.037 -0.7737 -5.1754 {"}'S' sea -12.8788 -0.7715 -4.9716 {"}'S' green -13.1169 -0.2682 -5.7624 {"}'S' green -12.7851 -0.6607 -5.2243 {"}'S' green -12.8725 -0.1702 -5.736 {"}'S' green -12.6741 -0.4772 -5.3947 {"}'S' sea -12.5131 -0.4492 -5.1948 {"}'S' sea -12.6448 -0.1042 -5.6261 {"}'S' sea -12.5406 -0.2594 -5.4483 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 TYR 10 B}'S' P -12.9523 0.4628 -6.7501 {"}'S' -12.9506 0.4656 -6.7501 {"}'S' P -12.9001 0.5622 -7.1422 {"}'S' -12.8703 0.6065 -7.1167 {"}'S' P -12.7913 0.4215 -6.9631 {"}'S' -12.76 0.4882 -6.9407 {"}'S' P -12.6606 0.3272 -6.7681 {"}'S' -12.6454 0.3761 -6.7619 {"}'S' P -12.7497 0.683 -7.4137 {"}'S' -12.7348 0.7085 -7.3871 {"}'S' P -12.662 0.5069 -7.2502 {"}'S' -12.6336 0.5809 -7.2009 {"}'S' P -12.5458 0.3751 -7.0648 {"}'S' -12.5264 0.4681 -7.027 {"}'S' P -12.4093 0.2937 -6.8647 {"}'S' -12.4041 0.3556 -6.853 {"}'S' P -12.5427 0.8065 -7.5896 {"}'S' -12.5318 0.8364 -7.5439 {"}'S' P -12.4717 0.6102 -7.4443 {"}'S' -12.4597 0.6726 -7.3823 {"}'S' P -12.3691 0.4574 -7.2692 {"}'S' -12.3649 0.5279 -7.2232 {"}'S' P -12.2406 0.3566 -7.074 {"}'S' -12.2444 0.4122 -7.0509 {"}'S' P -12.3193 1.1425 -7.7625 {"}'S' -12.3197 1.1434 -7.7615 {"}'S' P -12.3 0.9001 -7.6705 {"}'S' -12.3008 0.9379 -7.5965 {"}'S' P -12.2355 0.6912 -7.5279 {"}'S' -12.2446 0.7714 -7.4322 {"}'S' P -12.1318 0.5325 -7.3499 {"}'S' -12.1511 0.6271 -7.2749 {"}'S' P -11.9969 0.4376 -7.1491 {"}'S' -12.0166 0.4998 -7.1167 {"}'S' P -12.0524 1.0094 -7.6869 {"}'S' -12.0667 1.0321 -7.6296 {"}'S' P -11.9973 0.7981 -7.5582 {"}'S' -12.028 0.8601 -7.4673 {"}'S' P -11.8947 0.6453 -7.3831 {"}'S' -11.9336 0.7194 -7.3131 {"}'S' P -11.7576 0.5703 -7.1837 {"}'S' -11.7815 0.6079 -7.1601 {"}'S' P -11.8076 1.0767 -7.6206 {"}'S' -11.8161 1.0829 -7.6045 {"}'S' P -11.7398 0.8682 -7.4753 {"}'S' -11.7686 0.8963 -7.4339 {"}'S' P -11.6064 0.7655 -7.2746 {"}'S' -11.6162 0.7739 -7.2659 { HD2 TYR 10 B}'S' P -13.2909 -0.5588 -5.563 {"}'S' -13.2909 -0.5588 -5.563 {"}'S' P -13.0499 -0.474 -5.6186 {"}'S' -13.0554 -0.4573 -5.5993 {"}'S' P -12.9338 -0.6111 -5.4304 {"}'S' -12.9404 -0.5944 -5.4193 {"}'S' P -12.8058 -0.3755 -5.5929 {"}'S' -12.8066 -0.3753 -5.5923 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 25 B}'M' green -9.6583 2.0402 -6.2375 {"}'M' green -9.9608 1.8437 -6.6916 {"}'M' green -9.1391 2.802 -6.6604 {"}'M' green -9.3605 2.7427 -7.2947 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 25 B}'M' greentint -9.8172 1.9515 -6.4191 {"}'M' greentint -9.5553 2.2727 -6.2865 {"}'M' greentint -9.7185 2.2393 -6.4883 {"}'M' greentint -9.8671 2.0824 -6.6368 {"}'M' greentint -9.9709 1.9861 -6.9343 {"}'M' greentint -9.4114 2.4778 -6.3485 {"}'M' greentint -9.5693 2.4695 -6.5505 {"}'M' greentint -9.7279 2.3763 -6.7289 {"}'M' greentint -9.8671 2.2084 -6.8621 {"}'M' greentint -9.9405 2.0801 -7.1791 {"}'M' greentint -9.2262 2.6479 -6.4145 {"}'M' greentint -9.3823 2.6586 -6.6184 {"}'M' greentint -9.5425 2.6003 -6.8103 {"}'M' greentint -9.6973 2.4773 -6.975 {"}'M' greentint -9.833 2.2997 -7.1012 {"}'M' greentint -9.2996 2.7786 -6.8625 {"}'M' greentint -9.4616 2.6964 -7.0481 {"}'M' greentint -9.6139 2.5605 -7.2081 {"}'M' greentint -9.7505 2.3789 -7.3329 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 10 B}'M' greentint -9.9369 1.9204 -6.9071 {"}'M' greentint -9.7787 1.9226 -6.7033 {"}'M' greentint -9.618 1.9986 -6.5165 {"}'M' greentint -9.4685 2.144 -6.3641 {"}'M' greentint -9.3439 2.3439 -6.2582 {"}'M' greentint -9.8338 2.0831 -7.1621 {"}'M' greentint -9.685 2.0335 -6.956 {"}'M' greentint -9.5227 2.0784 -6.7581 {"}'M' greentint -9.3684 2.211 -6.5963 {"}'M' greentint -9.2442 2.4143 -6.4917 {"}'M' greentint -9.1659 2.66 -6.4596 {"}'M' greentint -9.7058 2.3187 -7.3246 {"}'M' greentint -9.574 2.2169 -7.1264 {"}'M' greentint -9.413 2.245 -6.9265 {"}'M' greentint -9.265 2.3969 -6.7776 {"}'M' greentint -9.1702 2.6311 -6.7203 {"}'M' greentint -9.5447 2.5899 -7.3578 {"}'M' greentint -9.4405 2.4348 -7.18 {"}'M' greentint -9.2805 2.5317 -7.0005 {"}'M' greentint -9.2256 2.785 -7.0003 {"}'M' greentint -9.3588 2.6813 -7.1998 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 25 B}'M' green -10.113 0.8378 -4.3973 {"}'M' green -9.9272 0.9292 -4.2393 {"}'M' green -10.3017 0.8881 -4.8768 {"}'M' green -10.2735 0.9855 -5.1304 {"}'M' green -9.5746 1.3772 -4.3364 {"}'M' green -9.4609 1.5713 -4.5876 {"}'M' green -10.0691 1.2808 -5.2928 {"}'M' sea -9.4844 1.6577 -5.041 {"}'M' sea -9.6426 1.594 -5.2273 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 25 B}'M' greentint -10.0314 1.0844 -4.4171 {"}'M' greentint -10.1913 0.9875 -4.5965 {"}'M' greentint -9.7661 1.2005 -4.2725 {"}'M' greentint -9.8979 1.3022 -4.4706 {"}'M' greentint -10.0589 1.2742 -4.6706 {"}'M' greentint -10.2069 1.1222 -4.8195 {"}'M' greentint -9.7095 1.4721 -4.5373 {"}'M' greentint -9.8683 1.4752 -4.7432 {"}'M' greentint -10.0286 1.3842 -4.926 {"}'M' greentint -10.17 1.2136 -5.0616 {"}'M' greentint -9.6126 1.6068 -4.7928 {"}'M' greentint -9.7739 1.5676 -4.9906 {"}'M' greentint -9.9305 1.4556 -5.162 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 10 B}'M' sea -10.2672 0.8809 -4.3563 {"}'M' sea -10.1091 0.955 -4.1726 {"}'M' green -10.3215 0.9639 -4.8135 {"}'M' green -9.8439 1.1253 -4.2403 {"}'M' sea -9.6985 1.287 -4.0973 {"}'M' green -10.238 1.1418 -5.0715 {"}'M' sea -9.5006 1.5551 -4.2332 {"}'M' green -10.1097 1.3535 -5.223 {"}'M' green -9.517 1.5541 -4.5117 {"}'M' sea -9.97 1.5881 -5.2975 {"}'M' green -9.5241 1.6675 -4.7438 {"}'M' green -9.7244 1.7143 -5.1325 {"}'M' sea -9.5657 1.8117 -4.9548 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 10 B}'M' greentint -10.1643 0.9593 -4.6079 {"}'M' greentint -10.0017 1.015 -4.4137 {"}'M' greentint -10.09 1.0947 -4.867 {"}'M' greentint -9.9308 1.1172 -4.6665 {"}'M' greentint -9.7711 1.2058 -4.4855 {"}'M' greentint -9.6244 1.3553 -4.3379 {"}'M' greentint -9.9713 1.2767 -5.0215 {"}'M' greentint -9.8125 1.2877 -4.8206 {"}'M' greentint -9.6555 1.3836 -4.6432 {"}'M' greentint -9.837 1.4845 -5.0972 {"}'M' greentint -9.6739 1.5137 -4.8946 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 26 1rocA_28F_70N}P -12.1988 -2.0685 0.3893 {"}-12.1988 -2.0685 0.3893 { ca ile A 26 1rocA_28F_70N}-11.0912 -2.3044 -0.538 { c ile A 26 1rocA_28F_70N}-10.8145 -1.0566 -1.3334 { o ile A 26 1rocA_28F_70N}-11.7377 -0.4821 -1.9059 { c ile A 26 1rocA_28F_70N}P -10.8145 -1.0566 -1.3334 { n thr A 27 1rocA_28F_70N}-9.5424 -0.663 -1.3916 { ca thr A 27 1rocA_28F_70N}-9.0709 0.4556 -2.2004 { c thr A 27 1rocA_28F_70N}-8.1107 -0.1001 -3.2321 { o thr A 27 1rocA_28F_70N}-7.1779 -0.8469 -2.8924 { c thr A 27 1rocA_28F_70N}P -8.1107 -0.1001 -3.2321 { n phe A 28 1rocA_28F_70N}-8.3761 0.2105 -4.4913 { ca phe A 28 1rocA_28F_70N}-7.5307 -0.2627 -5.5722 { c phe A 28 1rocA_28F_70N}-7.3826 0.8468 -6.5783 { o phe A 28 1rocA_28F_70N}-8.1386 1.8078 -6.5647 { c phe A 28 1rocA_28F_70N}P -7.3826 0.8468 -6.5783 { n glu A 29 1rocA_28F_70N}-6.4008 0.724 -7.4521 { ca glu A 29 1rocA_28F_70N}-6.3194 1.6745 -8.5405 { c glu A 29 1rocA_28F_70N}-6.3196 0.9463 -9.8663 { o glu A 29 1rocA_28F_70N}-5.9281 -0.2028 -9.9523 { c glu A 29 1rocA_28F_70N}P -6.3196 0.9463 -9.8663 { n cys A 30 1rocA_28F_70N}-6.7889 1.6443 -10.8857 { ca cys A 30 1rocA_28F_70N}-6.8739 1.1098 -12.2163 { c cys A 30 1rocA_28F_70N}-6.2219 2.1245 -13.1477 { o cys A 30 1rocA_28F_70N}-6.6501 3.2872 -13.2054 { n gly A 68 1rocA_28F_70N}P -8.08 5.5249 -12.1298 {"}-8.08 5.5249 -12.1298 { ca gly A 68 1rocA_28F_70N}-7.6544 6.188 -10.9083 { c gly A 68 1rocA_28F_70N}-7.9494 5.3122 -9.724 { o gly A 68 1rocA_28F_70N}-8.1022 4.0917 -9.8594 { c gly A 68 1rocA_28F_70N}P -7.9494 5.3122 -9.724 { n val A 69 1rocA_28F_70N}-8.0137 5.9371 -8.5549 { ca val A 69 1rocA_28F_70N}-8.2906 5.2328 -7.3099 { c val A 69 1rocA_28F_70N}-9.7885 4.9821 -7.1587 { o val A 69 1rocA_28F_70N}-10.6023 5.8646 -7.4438 { c val A 69 1rocA_28F_70N}P -9.7885 4.9821 -7.1587 { n asn A 70 1rocA_28F_70N}-10.1243 3.7684 -6.7255 { ca asn A 70 1rocA_28F_70N}-11.4917 3.3183 -6.5129 { c asn A 70 1rocA_28F_70N}-11.5822 2.6895 -5.1515 { o asn A 70 1rocA_28F_70N}-10.6033 2.1253 -4.6418 { c asn A 70 1rocA_28F_70N}P -11.5822 2.6895 -5.1515 { n lys A 71 1rocA_28F_70N}-12.756 2.7807 -4.5467 { ca lys A 71 1rocA_28F_70N}-12.9664 2.2221 -3.2251 { c lys A 71 1rocA_28F_70N}-14.374 1.6568 -3.1402 { o lys A 71 1rocA_28F_70N}-15.3248 2.2913 -3.5934 { c lys A 71 1rocA_28F_70N}P -14.374 1.6568 -3.1402 { n phe A 72 1rocA_28F_70N}-14.5006 0.4466 -2.603 { ca phe A 72 1rocA_28F_70N}-15.8319 -0.1211 -2.3705 { c phe A 72 1rocA_28F_70N}-15.8199 -1.1188 -1.236 { o phe A 72 1rocA_28F_70N}-14.759 -1.5626 -0.7853 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 26 1rocA_28F_70N}P -12.1988 -2.0685 0.3893 { ca ile A 26 1rocA_28F_70N}P -11.0912 -2.3044 -0.538 { n thr A 27 1rocA_28F_70N}P -9.5424 -0.663 -1.3916 { ca thr A 27 1rocA_28F_70N}P -9.0709 0.4556 -2.2004 { n phe A 28 1rocA_28F_70N}P -8.3761 0.2105 -4.4913 { ca phe A 28 1rocA_28F_70N}P -7.5307 -0.2627 -5.5722 { n glu A 29 1rocA_28F_70N}P -6.4008 0.724 -7.4521 { ca glu A 29 1rocA_28F_70N}P -6.3194 1.6745 -8.5405 { n cys A 30 1rocA_28F_70N}P -6.7889 1.6443 -10.8857 { ca cys A 30 1rocA_28F_70N}P -6.8739 1.1098 -12.2163 { n gly A 68 1rocA_28F_70N}P -8.08 5.5249 -12.1298 { ca gly A 68 1rocA_28F_70N}P -7.6544 6.188 -10.9083 {"}P -7.6544 6.188 -10.9083 { n val A 69 1rocA_28F_70N}P -8.0137 5.9371 -8.5549 { ca val A 69 1rocA_28F_70N}P -8.2906 5.2328 -7.3099 { n asn A 70 1rocA_28F_70N}P -10.1243 3.7684 -6.7255 { ca asn A 70 1rocA_28F_70N}P -11.4917 3.3183 -6.5129 { n lys A 71 1rocA_28F_70N}P -12.756 2.7807 -4.5467 { ca lys A 71 1rocA_28F_70N}P -12.9664 2.2221 -3.2251 { n phe A 72 1rocA_28F_70N}P -14.5006 0.4466 -2.603 { ca phe A 72 1rocA_28F_70N}P -15.8319 -0.1211 -2.3705 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 26 1rocA_28F_70N}P -11.0912 -2.3044 -0.538 {"}-11.0912 -2.3044 -0.538 { ca thr A 27 1rocA_28F_70N}-9.0709 0.4556 -2.2004 { ca phe A 28 1rocA_28F_70N}-7.5307 -0.2627 -5.5722 { ca glu A 29 1rocA_28F_70N}-6.3194 1.6745 -8.5405 { ca cys A 30 1rocA_28F_70N}-6.8739 1.1098 -12.2163 { ca gly A 68 1rocA_28F_70N}P -7.6544 6.188 -10.9083 {"}-7.6544 6.188 -10.9083 { ca val A 69 1rocA_28F_70N}-8.2906 5.2328 -7.3099 { ca asn A 70 1rocA_28F_70N}-11.4917 3.3183 -6.5129 { ca lys A 71 1rocA_28F_70N}-12.9664 2.2221 -3.2251 { ca phe A 72 1rocA_28F_70N}-15.8319 -0.1211 -2.3705 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 28 1rocA_28F_70N}P -7.5307 -0.2627 -5.5722 { cb phe A 28 1rocA_28F_70N}-8.0937 -1.5598 -6.2029 { cg phe A 28 1rocA_28F_70N}-9.3887 -1.3785 -6.9702 { cd1 phe A 28 1rocA_28F_70N}-9.3741 -1.1125 -8.3353 { ce1 phe A 28 1rocA_28F_70N}-10.5666 -0.9318 -9.0631 { cz phe A 28 1rocA_28F_70N}-11.7939 -1.0743 -8.4233 { cg phe A 28 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-8.9503 {"}'S' greentint -14.0077 0.6108 -9.1217 {"}'S' greentint -14.1463 0.4361 -9.2524 {"}'S' greentint -14.1084 0.2345 -9.5477 {"}'S' greentint -14.1819 -0.0053 -9.5746 {"}'S' greentint -14.2149 -0.2543 -9.5492 {"}'S' greentint -13.4073 0.8122 -8.8016 {"}'S' greentint -13.5616 0.8129 -9.0007 {"}'S' greentint -13.7198 0.7492 -9.187 {"}'S' greentint -13.87 0.6248 -9.3468 {"}'S' greentint -14.0031 0.4492 -9.4699 {"}'S' greentint -13.6788 0.6067 -9.524 {"}'S' greentint -13.8111 0.4327 -9.6462 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG GLU 258 A}'S' sky -13.271 0.45 -7.7671 {"}'S' sky -13.419 1.0797 -8.9385 {"}'S' blue -13.1823 1.1707 -9.0152 {"}'S' blue -12.9408 1.2716 -9.0498 {"}'S' sky -12.858 1.0869 -8.8911 {"}'S' blue -12.6112 1.1838 -8.8698 {"}'S' sky -12.4932 1.0555 -8.681 {"}'S' sky -12.0325 1.047 -8.0835 {"}'S' blue -11.8789 1.1722 -7.9192 {"}'S' sky -12.1955 1.1847 -8.5497 {"}'S' sky -12.0329 1.1962 -8.342 { HG2 GLU 258 A}'S' blue -12.7134 1.374 -9.1401 {"}'S' blue -12.585 1.2732 -8.945 {"}'S' blue -12.1855 1.33 -8.8118 {"}'S' blue -12.0222 1.379 -8.6152 @dotlist {x} color= white width= 1 master= {vdw contact} { CG GLU 258 A}'S' sea -13.4233 0.4908 -7.9744 {"}'S' green -13.3076 0.5742 -8.2625 {"}'S' sea -13.1665 0.5073 -8.0612 {"}'S' sea -13.0142 0.4796 -7.8569 {"}'S' green -13.3323 0.9006 -8.7757 {"}'S' green -13.2228 0.7546 -8.5944 {"}'S' green -13.0958 0.6459 -8.3995 {"}'S' sea -12.9539 0.5778 -8.1968 {"}'S' sea -12.8011 0.5508 -7.9921 {"}'S' sea -13.0971 0.9851 -8.8528 {"}'S' green -12.9864 0.8372 -8.6695 {"}'S' sea -12.8551 0.7319 -8.4712 {"}'S' sea -12.7087 0.6731 -8.2645 {"}'S' green -12.5509 0.6614 -8.0582 {"}'S' sea -12.748 0.9433 -8.7079 {"}'S' sea -12.6152 0.8473 -8.5097 {"}'S' green -12.465 0.8053 -8.3051 {"}'S' green -12.3065 0.8172 -8.1031 {"}'S' sea -12.1453 0.8837 -7.9133 {"}'S' sea -12.3509 0.9868 -8.4776 {"}'S' sea -12.1936 0.9847 -8.2742 { HG3 GLU 258 A}'S' sea -13.2723 0.3393 -6.9388 {"}'S' sea -13.1204 0.3135 -6.7355 {"}'S' green -11.9516 0.6757 -6.598 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HG3 GLU 258 A}'S' P -12.9706 0.2434 -6.954 {"}'S' -12.97 0.2512 -6.9549 {"}'S' P -12.8151 0.2554 -6.7561 {"}'S' -12.8135 0.2831 -6.7619 {"}'S' P -12.6565 0.3199 -6.5694 {"}'S' -12.6582 0.334 -6.5749 {"}'S' P -12.8666 0.2517 -7.2529 {"}'S' -12.8613 0.3166 -7.24 {"}'S' P -12.7142 0.2267 -7.0492 {"}'S' -12.7199 0.3389 -7.0466 {"}'S' P -12.5549 0.2572 -6.8519 {"}'S' -12.5783 0.3768 -6.8702 {"}'S' P -12.3969 0.3429 -6.671 {"}'S' -12.427 0.4271 -6.6988 {"}'S' P -12.2468 0.4788 -6.5156 {"}'S' -12.261 0.5026 -6.5285 {"}'S' P -12.8264 0.4153 -7.6574 {"}'S' -12.8265 0.4228 -7.6523 {"}'S' P -12.698 0.3146 -7.4622 {"}'S' -12.7039 0.4068 -7.4247 {"}'S' P -12.5507 0.2715 -7.2597 {"}'S' -12.5808 0.4269 -7.2269 {"}'S' P -12.393 0.2885 -7.0616 {"}'S' -12.4525 0.4615 -7.0543 {"}'S' P -12.2348 0.3653 -6.8784 {"}'S' -12.3075 0.5037 -6.8965 {"}'S' P -12.0844 0.4967 -6.7199 {"}'S' -12.139 0.5672 -6.7439 {"}'S' P -12.5892 0.4904 -7.7381 {"}'S' -12.5945 0.5219 -7.7133 {"}'S' P -12.4543 0.3956 -7.5372 {"}'S' -12.4901 0.5085 -7.4787 {"}'S' P -12.2985 0.3713 -7.3291 {"}'S' -12.3726 0.5316 -7.2807 {"}'S' P -12.1352 0.4203 -7.1325 {"}'S' -12.2332 0.5712 -7.1146 {"}'S' P -11.978 0.5387 -6.9617 {"}'S' -12.063 0.6301 -6.9671 {"}'S' P -11.8389 0.7156 -6.8308 {"}'S' -11.8626 0.7332 -6.8364 {"}'S' P -12.352 0.6033 -7.7713 {"}'S' -12.3669 0.6317 -7.7451 {"}'S' P -12.2149 0.5283 -7.5719 {"}'S' -12.2716 0.6161 -7.5157 {"}'S' P -12.0586 0.539 -7.3726 {"}'S' -12.1461 0.6439 -7.3299 {"}'S' P -11.9024 0.6344 -7.1981 {"}'S' -11.9815 0.7031 -7.1818 {"}'S' P -11.7653 0.8026 -7.0679 {"}'S' -11.7813 0.812 -7.0662 {"}'S' P -12.0638 0.7234 -7.6628 {"}'S' -12.0879 0.7455 -7.641 {"}'S' P -11.9002 0.752 -7.4595 {"}'S' -11.9377 0.7791 -7.44 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { OE2 GLU 258 A}'S' P -13.6246 -0.1988 -8.6918 {"}'S' -13.6469 -0.1821 -8.6902 {"}'S' P -13.6557 -0.1706 -8.9971 {"}'S' -13.7147 -0.1258 -8.9786 {"}'S' P -13.5172 -0.0001 -8.8656 {"}'S' -13.5937 0.0398 -8.8527 {"}'S' P -13.5243 0.1133 -9.0977 {"}'S' -13.5507 0.1244 -9.0885 @dotlist {x} color= red width= 1 master= {H-bonds} { OE2 GLU 258 A}'S' greentint -14.1093 -0.5992 -8.5265 {"}'S' greentint -13.9575 -0.4786 -8.3636 {"}'S' greentint -13.8172 -0.3166 -8.2276 {"}'S' greentint -13.6953 -0.12 -8.1246 {"}'S' greentint -13.5969 0.1049 -8.0586 {"}'S' greentint -14.1646 -0.5949 -8.9618 {"}'S' greentint -14.002 -0.5392 -8.7676 {"}'S' greentint -13.8441 -0.4289 -8.5942 {"}'S' greentint -13.6988 -0.2672 -8.4512 {"}'S' greentint -13.5742 -0.0648 -8.3476 {"}'S' greentint -13.4777 0.1683 -8.2878 {"}'S' greentint -13.4139 0.4201 -8.2752 {"}'S' greentint -14.2382 -0.4124 -9.4254 {"}'S' greentint -14.0902 -0.4595 -9.2209 {"}'S' greentint -13.931 -0.437 -9.0204 {"}'S' greentint -13.7713 -0.3484 -8.8394 {"}'S' greentint -13.5009 0.0009 -8.5871 {"}'S' greentint -13.409 0.2351 -8.5338 {"}'S' greentint -13.357 0.486 -8.5354 {"}'S' greentint -13.3472 0.7362 -8.5927 {"}'S' greentint -14.1099 -0.2007 -9.5769 {"}'S' greentint -13.9716 -0.2775 -9.3754 {"}'S' greentint -13.8127 -0.2665 -9.1745 {"}'S' greentint -13.4143 0.2234 -8.7948 {"}'S' greentint -13.3599 0.4731 -8.7944 {"}'S' greentint -13.3602 0.7201 -8.8632 {"}'S' greentint -13.9702 0.0339 -9.6514 {"}'S' greentint -13.8373 -0.0697 -9.4512 {"}'S' greentint -13.6741 -0.0405 -9.2485 {"}'S' greentint -13.429 0.3496 -9.0402 {"}'S' greentint -13.4127 0.606 -9.09 {"}'S' greentint -13.8288 0.3153 -9.6642 {"}'S' greentint -13.7246 0.1602 -9.4864 {"}'S' greentint -13.5659 0.2575 -9.3087 {"}'S' greentint -13.5106 0.5088 -9.3076 {"}'S' greentint -13.6509 0.4081 -9.5004 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 147 A}'M' green -9.4356 2.2675 -6.1508 {"}'M' green -9.5792 2.1598 -6.4233 {"}'M' sea -9.593 1.9038 -6.3701 {"}'M' green -9.3369 2.5554 -6.22 {"}'M' green -9.6458 2.0526 -6.6692 {"}'M' green -9.1877 2.7855 -6.2822 {"}'M' green -9.63 2.151 -6.935 {"}'M' sea -9.6606 1.8973 -6.9035 {"}'M' green -9.1609 2.9164 -6.542 {"}'M' green -9.4809 2.4763 -7.149 {"}'M' green -9.5622 2.2332 -7.1874 {"}'M' sea -9.08 3.0124 -6.7798 {"}'M' green -9.2323 2.8765 -6.9398 {"}'M' green -9.3689 2.6949 -7.0646 {"}'M' sea -9.3665 2.5211 -7.3787 {"}'M' sea -9.2559 2.7332 -7.2947 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 147 A}'M' greentint -9.4855 2.3985 -6.3685 {"}'M' greentint -9.5892 2.3021 -6.666 {"}'M' greentint -9.3463 2.6924 -6.4606 {"}'M' greentint -9.4855 2.5244 -6.5937 {"}'M' greentint -9.5588 2.3961 -6.9108 {"}'M' greentint -9.3157 2.7933 -6.7067 {"}'M' greentint -9.4514 2.6158 -6.8329 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLU 258 A}'M' sea -9.6566 2.2586 -6.1176 {"}'M' green -9.7287 2.032 -6.5472 {"}'M' green -9.5792 2.1774 -6.3948 {"}'M' green -9.366 2.6149 -6.241 {"}'M' sea -9.3215 2.8696 -6.2537 {"}'M' sea -9.7957 2.0669 -6.9868 {"}'M' green -9.2556 2.9488 -6.5337 {"}'M' green -9.6847 2.2503 -7.1572 {"}'M' green -9.2646 2.9182 -6.8003 {"}'M' green -9.5512 2.4682 -7.2107 {"}'M' green -9.3363 2.8184 -7.0311 {"}'M' green -9.4695 2.7147 -7.2306 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLU 258 A}'M' greentint -9.4546 2.3773 -6.289 {"}'M' greentint -9.6334 2.1118 -6.7888 {"}'M' greentint -9.4791 2.2444 -6.6271 {"}'M' greentint -9.3549 2.4477 -6.5225 {"}'M' greentint -9.2766 2.6934 -6.4904 {"}'M' greentint -9.5237 2.2784 -6.9572 {"}'M' greentint -9.3757 2.4303 -6.8084 {"}'M' greentint -9.2809 2.6644 -6.751 {"}'M' greentint -9.3913 2.5651 -7.0313 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 147 A}'M' green -10.1162 0.9165 -4.3238 {"}'M' green -10.2494 0.8129 -4.5233 {"}'M' green -10.3211 0.7131 -4.7541 {"}'M' green -10.327 0.8096 -5.0523 {"}'M' green -9.7126 1.5508 -4.4638 {"}'M' green -10.248 0.8895 -5.3147 {"}'M' green -9.6157 1.6855 -4.7193 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 147 A}'M' greentint -10.0345 1.1631 -4.3437 {"}'M' greentint -10.1945 1.0662 -4.5231 {"}'M' greentint -10.3049 0.9668 -4.8034 {"}'M' greentint -9.901 1.3809 -4.3972 {"}'M' greentint -10.062 1.3529 -4.5972 {"}'M' greentint -10.2101 1.2009 -4.746 {"}'M' greentint -10.2766 1.0643 -5.057 {"}'M' greentint -9.8715 1.554 -4.6697 {"}'M' greentint -10.0317 1.4629 -4.8526 {"}'M' greentint -10.1731 1.2924 -4.9882 {"}'M' greentint -10.1797 1.1385 -5.297 {"}'M' greentint -9.777 1.6464 -4.9172 {"}'M' greentint -9.9337 1.5343 -5.0886 {"}'M' greentint -10.0722 1.3596 -5.2193 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLU 258 A}'M' green -10.3155 0.8079 -4.3424 {"}'M' green -10.1752 0.9699 -4.2064 {"}'M' green -10.3599 0.7473 -4.7465 {"}'M' green -9.8356 1.4548 -4.2666 {"}'M' green -10.3295 1.009 -5.3542 {"}'M' green -9.7178 1.7596 -4.7733 {"}'M' green -10.1952 1.2168 -5.43 {"}'M' green -9.9238 1.544 -5.2876 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLU 258 A}'M' greentint -10.2021 0.8576 -4.573 {"}'M' greentint -10.0567 1.0193 -4.43 {"}'M' greentint -9.9321 1.2217 -4.3264 {"}'M' greentint -10.289 0.8495 -4.9992 {"}'M' greentint -10.1292 0.9381 -4.8182 {"}'M' greentint -9.9825 1.0876 -4.6706 {"}'M' greentint -9.8588 1.2874 -4.5659 {"}'M' greentint -9.7669 1.5216 -4.5126 {"}'M' greentint -10.1707 1.02 -5.1533 {"}'M' greentint -10.0137 1.1159 -4.976 {"}'M' greentint -9.8752 1.2864 -4.8444 {"}'M' greentint -9.7723 1.5099 -4.7736 {"}'M' greentint -10.0321 1.246 -5.2273 {"}'M' greentint -9.8823 1.3998 -5.0765 {"}'M' greentint -9.787 1.6361 -5.019 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg A 9 1rvkA_11F_35Q}P -12.3246 -2.04 0.0484 {"}-12.3246 -2.04 0.0484 { ca arg A 9 1rvkA_11F_35Q}-11.0231 -2.3209 -0.5386 { c arg A 9 1rvkA_11F_35Q}-10.7552 -1.2709 -1.6015 { o arg A 9 1rvkA_11F_35Q}-11.4987 -1.1588 -2.5783 { c arg A 9 1rvkA_11F_35Q}P -10.7552 -1.2709 -1.6015 { n val A 10 1rvkA_11F_35Q}-9.7038 -0.4882 -1.394 { ca val A 10 1rvkA_11F_35Q}-9.3353 0.5492 -2.344 { c val A 10 1rvkA_11F_35Q}-8.2052 0.0183 -3.2141 { o val A 10 1rvkA_11F_35Q}-7.2398 -0.5638 -2.7135 { c val A 10 1rvkA_11F_35Q}P -8.2052 0.0183 -3.2141 { n phe A 11 1rvkA_11F_35Q}-8.3355 0.2116 -4.5214 { ca phe A 11 1rvkA_11F_35Q}-7.3265 -0.2538 -5.4592 { c phe A 11 1rvkA_11F_35Q}-7.1377 0.7782 -6.5611 { o phe A 11 1rvkA_11F_35Q}-7.9086 1.7354 -6.6611 { c phe A 11 1rvkA_11F_35Q}P -7.1377 0.7782 -6.5611 { n arg A 12 1rvkA_11F_35Q}-6.1154 0.5772 -7.3891 { ca arg A 12 1rvkA_11F_35Q}-5.8267 1.4991 -8.4832 { c arg A 12 1rvkA_11F_35Q}-6.2827 0.9399 -9.8297 { o arg A 12 1rvkA_11F_35Q}-5.952 -0.1894 -10.1863 { c arg A 12 1rvkA_11F_35Q}P -6.2827 0.9399 -9.8297 { n thr A 13 1rvkA_11F_35Q}-7.0448 1.7379 -10.5699 { ca thr A 13 1rvkA_11F_35Q}-7.5069 1.346 -11.8931 { c thr A 13 1rvkA_11F_35Q}-6.7861 2.2529 -12.8937 { o thr A 13 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1rvkA_11F_35Q}-15.1785 0.8255 -4.9523 { c ala A 36 1rvkA_11F_35Q}P -14.2576 0.5875 -4.169 { n mse A 37 1rvkA_11F_35Q}-14.1392 -0.5651 -3.522 { ca mse A 37 1rvkA_11F_35Q}-15.142 -1.608 -3.6515 { c mse A 37 1rvkA_11F_35Q}-15.6634 -1.9106 -2.2564 { o mse A 37 1rvkA_11F_35Q}-14.8823 -2.19 -1.3403 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 9 1rvkA_11F_35Q}P -12.3246 -2.04 0.0484 { ca arg A 9 1rvkA_11F_35Q}P -11.0231 -2.3209 -0.5386 { n val A 10 1rvkA_11F_35Q}P -9.7038 -0.4882 -1.394 { ca val A 10 1rvkA_11F_35Q}P -9.3353 0.5492 -2.344 { n phe A 11 1rvkA_11F_35Q}P -8.3355 0.2116 -4.5214 { ca phe A 11 1rvkA_11F_35Q}P -7.3265 -0.2538 -5.4592 { n arg A 12 1rvkA_11F_35Q}P -6.1154 0.5772 -7.3891 { ca arg A 12 1rvkA_11F_35Q}P -5.8267 1.4991 -8.4832 { n thr A 13 1rvkA_11F_35Q}P -7.0448 1.7379 -10.5699 { ca thr A 13 1rvkA_11F_35Q}P -7.5069 1.346 -11.8931 { n val A 33 1rvkA_11F_35Q}P -6.0731 5.7418 -11.0854 { ca val A 33 1rvkA_11F_35Q}P -7.0608 6.3939 -10.238 { n glu A 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{"}'M' greentint -8.7985 1.9825 -6.6248 {"}'M' greentint -8.649 2.1279 -6.4724 {"}'M' greentint -8.5244 2.3279 -6.3665 {"}'M' greentint -8.4358 2.5655 -6.3185 {"}'M' greentint -8.3913 2.8202 -6.3312 {"}'M' greentint -9.0142 2.067 -7.2704 {"}'M' greentint -8.8655 2.0174 -7.0643 {"}'M' greentint -8.7031 2.0623 -6.8664 {"}'M' greentint -8.4247 2.3982 -6.6 {"}'M' greentint -8.3464 2.6439 -6.5679 {"}'M' greentint -8.3254 2.8993 -6.6112 {"}'M' greentint -8.8862 2.3026 -7.4329 {"}'M' greentint -8.7545 2.2009 -7.2347 {"}'M' greentint -8.5935 2.2289 -7.0348 {"}'M' greentint -8.4454 2.3809 -6.8859 {"}'M' greentint -8.3506 2.615 -6.8286 {"}'M' greentint -8.3343 2.8687 -6.8779 {"}'M' greentint -8.621 2.4187 -7.2883 {"}'M' greentint -8.461 2.5156 -7.1088 {"}'M' greentint -8.4061 2.7689 -7.1086 {"}'M' greentint -8.5393 2.6653 -7.3081 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 11 A}'M' greentint -10.0259 0.7411 -4.5414 {"}'M' greentint -9.8109 1.0913 -4.3618 {"}'M' greentint -9.9709 0.9944 -4.5412 {"}'M' greentint -10.0813 0.895 -4.8215 {"}'M' greentint -10.0976 0.6413 -4.7722 {"}'M' greentint -9.6774 1.3092 -4.4153 {"}'M' greentint -9.8384 1.2811 -4.6153 {"}'M' greentint -9.9865 1.1292 -4.7641 {"}'M' greentint -10.053 0.9925 -5.0751 {"}'M' greentint -10.1034 0.7378 -5.0704 {"}'M' greentint -10.0947 0.49 -4.99 {"}'M' greentint -9.6479 1.4822 -4.6878 {"}'M' greentint -9.8082 1.3911 -4.8707 {"}'M' greentint -9.9496 1.2206 -5.0063 {"}'M' greentint -9.9562 1.0668 -5.3151 {"}'M' greentint -10.0244 0.8177 -5.3328 {"}'M' greentint -10.0449 0.5645 -5.2893 {"}'M' greentint -9.5535 1.5746 -4.9353 {"}'M' greentint -9.7101 1.4625 -5.1067 {"}'M' greentint -9.8487 1.2878 -5.2374 {"}'M' greentint -9.8108 1.0863 -5.5327 {"}'M' greentint -9.8843 0.8465 -5.5596 {"}'M' greentint -9.9173 0.5974 -5.5342 {"}'M' greentint -9.4222 1.601 -5.172 {"}'M' greentint -9.5724 1.4765 -5.3318 {"}'M' greentint -9.7055 1.3009 -5.4549 {"}'M' greentint -9.6211 1.0723 -5.7111 {"}'M' greentint -9.5134 1.2844 -5.6312 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O GLN 35 A}'M' greentint -9.9618 0.6793 -4.4893 {"}'M' greentint -9.8393 0.8794 -4.3864 {"}'M' greentint -9.7385 1.1046 -4.3187 {"}'M' greentint -9.9549 0.5282 -4.8384 {"}'M' greentint -9.8145 0.6902 -4.7024 {"}'M' greentint -9.6926 0.8868 -4.5994 {"}'M' greentint -9.5942 1.1117 -4.5333 {"}'M' greentint -9.5216 1.3527 -4.5078 {"}'M' greentint -9.9993 0.4677 -5.2424 {"}'M' greentint -9.8415 0.5779 -5.069 {"}'M' greentint -9.6961 0.7396 -4.926 {"}'M' greentint -9.5715 0.942 -4.8224 {"}'M' greentint -9.475 1.1751 -4.7625 {"}'M' greentint -9.4113 1.4269 -4.75 {"}'M' greentint -9.9284 0.5698 -5.4952 {"}'M' greentint -9.7686 0.6584 -5.3142 {"}'M' greentint -9.6219 0.808 -5.1666 {"}'M' greentint -9.4982 1.0077 -5.0619 {"}'M' greentint -9.4063 1.2419 -5.0086 {"}'M' greentint -9.3544 1.4928 -5.0102 {"}'M' greentint -9.8101 0.7403 -5.6493 {"}'M' greentint -9.653 0.8362 -5.4719 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{"}'S' sky -10.9769 0.1405 -7.507 {"}'S' sky -11.4161 0.2861 -8.1149 {"}'S' blue -10.8392 0.2683 -7.7547 {"}'S' sky -10.9816 0.3342 -7.9575 {"}'S' blue -11.1335 0.3613 -8.1611 { CZ TYR 144 A}'S' blue -12.7845 -0.2469 -6.9106 {"}'S' blue -12.5501 -0.1036 -6.9665 {"}'S' blue -12.7112 -0.1186 -7.1695 {"}'S' sky -12.1455 -0.0522 -6.8148 {"}'S' sky -12.4493 0.0032 -7.2239 {"}'S' blue -12.7957 -0.2024 -8.0041 {"}'S' blue -12.4662 -0.0548 -8.0335 {"}'S' sky -12.6216 -0.1845 -8.1992 {"}'S' blue -12.7679 -0.3464 -8.3433 {"}'S' sky -11.9628 0.084 -7.8505 {"}'S' blue -12.1264 0.0225 -8.0447 {"}'S' sky -12.2873 -0.076 -8.225 {"}'S' sky -12.4415 -0.2075 -8.3887 {"}'S' sky -12.5865 -0.3712 -8.5307 {"}'S' blue -12.7192 -0.563 -8.6478 {"}'S' blue -11.1488 -0.0977 -7.1817 {"}'S' sky -12.3787 -0.4104 -8.6838 {"}'S' blue -12.511 -0.6003 -8.8024 { HE2 TYR 144 A}'S' sky -11.7004 -0.5296 -9.9817 {"}'S' sky -11.2267 -0.2478 -9.877 {"}'S' sky -11.376 -0.3721 -10.0357 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 144 A}'S' sea -11.224 0.064 -7.4462 {"}'S' sea -11.3639 0.145 -7.6491 {"}'S' sea -11.5169 0.1792 -7.8575 {"}'S' green -11.9994 -0.0075 -8.4282 {"}'S' green -12.1487 -0.159 -8.5788 {"}'S' sea -12.2821 -0.3457 -8.6998 {"}'S' sea -12.284 -0.4999 -9.0175 {"}'S' sea -11.1123 0.2307 -7.7058 {"}'S' sea -11.2602 0.2805 -7.9108 {"}'S' green -11.7372 0.1714 -8.4968 {"}'S' green -12.17 -0.2871 -8.9291 {"}'S' green -12.1497 -0.4761 -9.2409 {"}'S' green -11.452 0.2956 -8.5541 {"}'S' green -11.9848 -0.4689 -9.4444 {"}'S' green -11.2719 0.3218 -8.7427 {"}'S' green -11.0932 0.3054 -8.9357 {"}'S' green -11.686 -0.2801 -9.5388 {"}'S' green -11.0451 0.1669 -9.269 {"}'S' green -11.2001 0.0355 -9.432 {"}'S' green -11.3455 -0.1276 -9.5748 { CZ TYR 144 A}'S' sea -12.2934 -0.0024 -7.0198 {"}'S' sea -11.8724 -0.0146 -6.8637 {"}'S' green -12.0148 0.0513 -7.0665 {"}'S' green -12.1667 0.0785 -7.2701 {"}'S' sea -12.3244 0.0653 -7.4706 {"}'S' sea -11.5418 -0.0691 -6.8351 {"}'S' green -11.6762 0.0293 -7.0361 {"}'S' green -11.823 0.0901 -7.2438 {"}'S' green -11.9796 0.113 -7.4511 {"}'S' sea -12.1412 0.0956 -7.656 {"}'S' sea -11.3568 -0.0509 -7.0307 {"}'S' green -11.4947 0.0401 -7.2331 {"}'S' green -11.6438 0.0931 -7.4404 {"}'S' green -11.8007 0.1074 -7.6479 {"}'S' sea -12.2333 -0.2473 -8.541 { HE2 TYR 144 A}'S' green -11.7049 -0.368 -9.6334 {"}'S' sea -11.8435 -0.5427 -9.7642 {"}'S' green -11.417 -0.2296 -9.6987 {"}'S' sea -11.5672 -0.354 -9.8586 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 144 A}'S' P -11.8923 0.0528 -8.6647 {"}'S' -11.8794 0.035 -8.6617 {"}'S' P -12.0379 -0.1014 -8.8096 {"}'S' -12.0168 -0.1231 -8.8032 {"}'S' P -11.6093 0.2059 -8.7332 {"}'S' -11.5958 0.1758 -8.7267 {"}'S' P -11.7625 0.0804 -8.8951 {"}'S' -11.7197 0.0108 -8.872 {"}'S' P -11.9061 -0.0781 -9.0364 {"}'S' -11.8551 -0.14 -9.0056 {"}'S' P -12.0357 -0.2647 -9.1522 {"}'S' -12.0112 -0.2878 -9.1374 {"}'S' P -11.433 0.228 -8.9245 {"}'S' -11.4197 0.1902 -8.9131 {"}'S' P -11.5884 0.0983 -9.0902 {"}'S' -11.551 0.022 -9.054 {"}'S' P -11.7347 -0.0636 -9.2343 {"}'S' -11.689 -0.1322 -9.1904 {"}'S' P -11.8682 -0.2542 -9.3528 {"}'S' -11.8432 -0.2808 -9.3297 {"}'S' P -11.2541 0.2069 -9.116 {"}'S' -11.2522 0.2008 -9.1137 {"}'S' P -11.4083 0.0753 -9.2797 {"}'S' -11.3932 0.0343 -9.2547 {"}'S' P -11.5533 -0.0884 -9.4217 {"}'S' -11.5355 -0.1233 -9.3945 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 144 A}'S' blue -13.8778 -0.4779 -7.7148 {"}'S' blue -13.3233 -0.4135 -7.38 {"}'S' blue -13.4687 -0.3631 -7.5817 {"}'S' blue -13.6239 -0.364 -7.7816 {"}'S' blue -13.6262 -0.3806 -8.1792 {"}'S' blue -13.7831 -0.4865 -8.3524 {"}'S' blue -13.9298 -0.6337 -8.5022 {"}'S' blue -13.2906 -0.3227 -8.1832 {"}'S' sky -13.4514 -0.3897 -8.3723 {"}'S' sky -13.608 -0.5004 -8.5439 {"}'S' blue -13.7547 -0.6514 -8.6912 {"}'S' blue -13.0845 -0.3641 -8.3328 {"}'S' sky -13.2457 -0.4305 -8.5226 {"}'S' blue -13.4022 -0.5398 -8.6946 {"}'S' blue -13.549 -0.6897 -8.8438 {"}'S' blue -12.8739 -0.4492 -8.4579 {"}'S' sky -13.0334 -0.5115 -8.648 {"}'S' blue -13.1899 -0.6193 -8.8202 {"}'S' blue -12.8045 -0.6217 -8.7202 { HH TYR 144 A}'S' sky -14.1904 -0.5491 -6.7365 {"}'S' sky -14.3493 -0.546 -6.9424 {"}'S' blue -13.8136 -0.559 -6.5901 {"}'S' blue -14.4114 -0.5656 -7.3612 {"}'S' sky -13.6711 -0.4293 -6.8418 {"}'S' sky -13.4793 -0.4254 -7.0249 {"}'S' sky -13.7761 -0.3772 -7.4211 {"}'S' sky -13.9332 -0.4455 -7.6048 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 144 A}'S' sea -13.9418 -0.4499 -6.7868 {"}'S' green -14.0935 -0.4144 -6.992 {"}'S' sea -14.2548 -0.4536 -7.1898 {"}'S' green -13.811 -0.3642 -7.0411 {"}'S' green -13.9653 -0.3635 -7.2402 {"}'S' sea -14.1235 -0.4272 -7.4265 {"}'S' sea -13.622 -0.3703 -7.224 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ILE 215 A}'S' blue -12.6224 0.4471 -7.4199 { CG2 ILE 215 A}'S' blue -12.9871 0.173 -6.8186 {"}'S' blue -12.9012 0.3169 -7.0655 {"}'S' blue -12.7427 0.3288 -6.8636 { CD1 ILE 215 A}'S' blue -13.3448 0.0852 -8.3453 {"}'S' blue -13.3754 -0.1477 -8.7337 {"}'S' sky -13.2118 -0.0721 -8.5445 {"}'S' blue -13.0531 0.0397 -8.3702 {"}'S' blue -12.9015 0.1863 -8.2152 {"}'S' blue -13.2314 -0.246 -8.9503 {"}'S' sky -13.0686 -0.1845 -8.7555 {"}'S' blue -12.9082 -0.0868 -8.5756 {"}'S' sky -12.7527 0.0454 -8.4121 {"}'S' blue -12.6077 0.2091 -8.2701 {"}'S' blue -12.4758 0.401 -8.1524 {"}'S' blue -13.0327 -0.2921 -9.1142 {"}'S' blue -12.8703 -0.2313 -8.9198 {"}'S' sky -12.7091 -0.1348 -8.7386 {"}'S' sky -12.5541 -0.0034 -8.5755 {"}'S' sky -12.4087 0.1597 -8.4327 {"}'S' blue -12.2759 0.3504 -8.3137 { HB ILE 215 A}'S' sky -12.3958 0.3302 -7.2151 {"}'S' sky -11.9471 0.2533 -6.6151 {"}'S' blue -11.7887 0.3399 -6.4337 {"}'S' blue -12.3436 0.4296 -7.6073 {"}'S' sky -11.6426 0.2293 -6.6462 {"}'S' blue -11.4896 0.3454 -6.4808 {"}'S' sky -12.1055 0.3742 -7.7153 {"}'S' blue -11.383 0.2523 -6.7478 {"}'S' blue -11.9151 0.4775 -7.9093 {"}'S' blue -11.2209 0.2747 -6.9552 {"}'S' blue -11.679 0.5586 -7.9929 {"}'S' sky -11.1214 0.3297 -7.2093 {"}'S' blue -11.4408 0.6654 -8.0233 {"}'S' sky -11.3382 0.5127 -7.8482 {"}'S' sky -11.0447 0.4484 -7.4495 {"}'S' blue -11.1833 0.7356 -7.9403 {"}'S' blue -11.0499 0.6328 -7.7397 {HG21 ILE 215 A}'S' sky -14.5176 -0.2108 -7.0764 {"}'S' sky -14.3703 -0.2524 -6.8741 {"}'S' sky -14.2148 -0.2405 -6.6762 {"}'S' sky -14.4029 -0.1628 -7.3731 {"}'S' sky -13.7966 -0.153 -6.5911 {"}'S' sky -13.6345 -0.1306 -6.7985 {"}'S' sky -13.854 -0.1003 -7.4574 {"}'S' sky -13.5349 -0.0756 -7.0526 {"}'S' blue -13.6146 0.0324 -7.492 {HD12 ILE 215 A}'S' sky -12.4511 -0.0882 -8.7229 {"}'S' sky -11.8787 -0.2289 -9.9949 {"}'S' sky -11.6393 -0.0962 -10.0296 {HD13 ILE 215 A}'S' blue -13.9703 -0.1023 -8.3934 {"}'S' blue -13.9828 -0.2774 -8.7927 {"}'S' sky -13.8242 -0.2129 -8.606 {"}'S' sky -13.6712 -0.0968 -8.4405 {"}'S' blue -13.5317 0.0639 -8.3037 {"}'S' blue -13.7226 -0.2756 -8.8885 {"}'S' sky -13.5646 -0.1899 -8.7076 {"}'S' blue -13.4145 -0.054 -8.5522 @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 215 A}'S' sea -12.2584 0.2487 -7.0156 {"}'S' sea -12.1065 0.2229 -6.8123 {"}'S' sea -12.2348 0.2889 -7.4282 {"}'S' green -12.1041 0.1945 -7.2331 {"}'S' green -11.9567 0.1528 -7.0308 {"}'S' sea -11.8012 0.1648 -6.833 {"}'S' green -11.9893 0.2424 -7.5298 {"}'S' green -11.8528 0.1611 -7.3298 {"}'S' green -11.7004 0.1361 -7.126 {"}'S' sea -11.541 0.1666 -6.9288 {"}'S' sea -11.8125 0.3247 -7.7342 {"}'S' green -11.6841 0.224 -7.5391 {"}'S' green -11.5368 0.1809 -7.3365 {"}'S' sea -11.3787 0.1987 -7.1381 {"}'S' sea -11.5753 0.3998 -7.815 {"}'S' sea -11.4404 0.305 -7.6141 {"}'S' sea -11.2846 0.2807 -7.4059 {"}'S' sea -11.201 0.4377 -7.6487 {HG21 ILE 215 A}'S' sea -14.2663 -0.2442 -7.173 {"}'S' green -14.1139 -0.2692 -6.9693 {"}'S' sea -13.9546 -0.2387 -6.7721 {"}'S' sea -14.0977 -0.1813 -7.3824 {"}'S' green -13.9504 -0.2244 -7.1798 {"}'S' sea -13.7922 -0.2066 -6.9813 {"}'S' sea -13.6982 -0.1245 -7.2492 {HD12 ILE 215 A}'S' green -12.227 -0.194 -8.8145 {"}'S' green -12.0777 -0.058 -8.6586 {"}'S' green -11.9432 0.121 -8.5362 {"}'S' green -12.2395 -0.3691 -9.2138 {"}'S' green -11.5711 0.3948 -8.5617 {"}'S' sea -12.1386 -0.3978 -9.5069 {"}'S' sea -11.3449 0.4875 -8.7266 {"}'S' sea -11.9751 -0.353 -9.7174 {"}'S' green -11.8169 -0.3352 -9.5189 {"}'S' green -11.2674 0.2662 -8.9752 {"}'S' green -11.7229 -0.2532 -9.7867 {"}'S' green -11.5596 -0.2042 -9.5902 {"}'S' green -11.1533 0.3137 -9.2094 {"}'S' sea -11.483 -0.0855 -9.8303 {"}'S' green -11.3268 0.0099 -9.6558 {"}'S' sea -11.1897 0.1781 -9.5255 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} {HD12 ILE 215 A}'S' P -12.0809 -0.3046 -9.0271 {"}'S' -12.0832 -0.2851 -9.0348 {"}'S' P -11.9279 -0.1885 -8.8616 {"}'S' -11.9421 -0.1388 -8.8941 {"}'S' P -11.7884 -0.0278 -8.7247 {"}'S' -11.808 0.0111 -8.7621 {"}'S' P -11.6669 0.1691 -8.6241 {"}'S' -11.673 0.1757 -8.6323 {"}'S' P -11.9793 -0.3673 -9.3096 {"}'S' -11.9814 -0.3561 -9.3117 {"}'S' P -11.8213 -0.2816 -9.1286 {"}'S' -11.8464 -0.2118 -9.1516 {"}'S' P -11.6712 -0.1457 -8.9733 {"}'S' -11.7169 -0.0662 -9.0163 {"}'S' P -11.5371 0.0342 -8.8499 {"}'S' -11.5809 0.083 -8.8919 {"}'S' P -11.4268 0.2483 -8.7669 {"}'S' -11.4346 0.2537 -8.7735 {"}'S' P -11.6592 -0.2592 -9.3361 {"}'S' -11.6874 -0.2056 -9.3424 {"}'S' P -11.5088 -0.1278 -9.1775 {"}'S' -11.561 -0.0602 -9.2011 {"}'S' P -11.376 0.0512 -9.0557 {"}'S' -11.4214 0.0906 -9.0788 {"}'S' P -11.4024 -0.0858 -9.4194 {"}'S' -11.4202 -0.0675 -9.4206 {"}'S' P -11.2633 0.0911 -9.2885 {"}'S' -11.2714 0.0967 -9.2905 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 144 A}'M' greentint -9.3953 2.2318 -6.2345 {"}'M' greentint -9.5389 2.1241 -6.507 {"}'M' greentint -9.1334 2.5531 -6.1019 {"}'M' greentint -9.2966 2.5197 -6.3038 {"}'M' greentint -9.4452 2.3628 -6.4523 {"}'M' greentint -9.5489 2.2664 -6.7498 {"}'M' greentint -9.6055 2.0169 -6.753 {"}'M' greentint -8.9894 2.7582 -6.1639 {"}'M' greentint -9.1474 2.7498 -6.3659 {"}'M' greentint -9.306 2.6567 -6.5444 {"}'M' greentint -9.4452 2.4887 -6.6775 {"}'M' greentint -9.5186 2.3604 -6.9945 {"}'M' greentint -9.5897 2.1153 -7.0187 {"}'M' greentint -8.9604 2.939 -6.4338 {"}'M' greentint -9.1206 2.8807 -6.6258 {"}'M' greentint -9.2754 2.7576 -6.7904 {"}'M' greentint -9.4111 2.5801 -6.9166 {"}'M' greentint -9.4407 2.4406 -7.2328 {"}'M' greentint -9.5219 2.1975 -7.2712 {"}'M' greentint -8.8773 3.0583 -6.6772 {"}'M' greentint -9.0397 2.9767 -6.8636 {"}'M' greentint -9.192 2.8408 -7.0235 {"}'M' greentint -9.3286 2.6592 -7.1483 {"}'M' greentint -8.9386 3.023 -7.1102 {"}'M' greentint -9.0848 2.8794 -7.2601 {"}'M' greentint -9.2156 2.6975 -7.3785 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 215 A}'M' greentint -9.5124 1.9873 -6.4533 {"}'M' greentint -9.3622 2.1118 -6.2934 {"}'M' greentint -9.2291 2.2874 -6.1703 {"}'M' greentint -9.1238 2.502 -6.0926 {"}'M' greentint -9.4618 1.9848 -6.7869 {"}'M' greentint -9.3012 2.0608 -6.6 {"}'M' greentint -9.1516 2.2062 -6.4476 {"}'M' greentint -9.0271 2.4061 -6.3418 {"}'M' greentint -8.9385 2.6437 -6.2937 {"}'M' greentint -8.894 2.8984 -6.3064 {"}'M' greentint -9.5169 2.1453 -7.2456 {"}'M' greentint -9.3681 2.0956 -7.0395 {"}'M' greentint -9.2058 2.1406 -6.8416 {"}'M' greentint -9.0516 2.2732 -6.6799 {"}'M' greentint -8.9273 2.4765 -6.5753 {"}'M' greentint -8.8491 2.7222 -6.5431 {"}'M' greentint -8.8281 2.9776 -6.5864 {"}'M' greentint -9.3889 2.3809 -7.4081 {"}'M' greentint -9.2572 2.2791 -7.21 {"}'M' greentint -9.0961 2.3072 -7.01 {"}'M' greentint -8.9481 2.4591 -6.8611 {"}'M' greentint -8.8533 2.6932 -6.8038 {"}'M' greentint -8.837 2.9469 -6.8531 {"}'M' greentint -9.1237 2.497 -7.2635 {"}'M' greentint -8.9637 2.5939 -7.0841 {"}'M' greentint -8.9087 2.8472 -7.0839 {"}'M' greentint -9.042 2.7435 -7.2833 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 144 A}'M' green -9.807 1.0546 -4.1857 {"}'M' green -9.5919 1.519 -4.2591 {"}'M' green -10.0092 0.6998 -4.8338 {"}'M' green -9.9389 1.0276 -5.1766 {"}'M' green -9.4679 1.7844 -4.7791 {"}'M' green -9.6245 1.6724 -4.9505 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 144 A}'M' greentint -9.9403 0.951 -4.3852 {"}'M' greentint -9.7254 1.3012 -4.2056 {"}'M' greentint -9.8853 1.2043 -4.385 {"}'M' greentint -9.9957 1.1049 -4.6653 {"}'M' greentint -10.012 0.8512 -4.616 {"}'M' greentint -9.7529 1.491 -4.4591 {"}'M' greentint -9.9009 1.339 -4.6079 {"}'M' greentint -9.9675 1.2023 -4.9189 {"}'M' greentint -10.0179 0.9477 -4.9143 {"}'M' greentint -9.5623 1.692 -4.5316 {"}'M' greentint -9.7226 1.601 -4.7145 {"}'M' greentint -9.864 1.4305 -4.8501 {"}'M' greentint -9.8706 1.2766 -5.1589 {"}'M' greentint -9.7631 1.4977 -5.0812 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 215 A}'M' green -10.0427 0.7812 -4.4386 {"}'M' green -9.8973 0.9429 -4.2956 {"}'M' green -9.6763 1.3784 -4.1322 {"}'M' sea -9.6125 1.6302 -4.1196 {"}'M' green -10.1296 0.7731 -4.8648 {"}'M' green -9.5556 1.696 -4.3798 {"}'M' green -10.0113 0.9436 -5.0189 {"}'M' sea -10.0358 1.1404 -5.2955 {"}'M' green -9.6112 1.8161 -4.9344 {"}'M' sea -9.9232 1.3702 -5.3307 {"}'M' green -9.7645 1.4676 -5.1531 {"}'M' green -9.7091 1.7189 -5.152 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 215 A}'M' greentint -9.7727 1.1453 -4.192 {"}'M' greentint -9.9699 0.8616 -4.6838 {"}'M' greentint -9.8231 1.0112 -4.5362 {"}'M' greentint -9.6994 1.211 -4.4315 {"}'M' greentint -9.6076 1.4452 -4.3782 {"}'M' greentint -9.8543 1.0395 -4.8415 {"}'M' greentint -9.7158 1.21 -4.71 {"}'M' greentint -9.6129 1.4335 -4.6391 {"}'M' greentint -9.5585 1.6832 -4.6388 {"}'M' greentint -9.8727 1.1696 -5.0929 {"}'M' greentint -9.7229 1.3233 -4.9421 {"}'M' greentint -9.6276 1.5597 -4.8846 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 4 1rylA_6Y_164V}P -12.5045 -1.8543 0.2113 {"}-12.5045 -1.8543 0.2113 { ca ile A 4 1rylA_6Y_164V}-11.1832 -2.1565 -0.3217 { c ile A 4 1rylA_6Y_164V}-10.8101 -1.0484 -1.3086 { o ile A 4 1rylA_6Y_164V}-11.6844 -0.3774 -1.8689 { c ile A 4 1rylA_6Y_164V}P -10.8101 -1.0484 -1.3086 { n gly A 5 1rylA_6Y_164V}-9.5142 -0.8432 -1.5101 { ca gly A 5 1rylA_6Y_164V}-9.095 0.1968 -2.4238 { c gly A 5 1rylA_6Y_164V}-8.179 -0.3142 -3.5108 { o gly A 5 1rylA_6Y_164V}-7.3182 -1.1571 -3.268 { c gly A 5 1rylA_6Y_164V}P -8.179 -0.3142 -3.5108 { n tyr A 6 1rylA_6Y_164V}-8.385 0.1737 -4.7256 { ca tyr A 6 1rylA_6Y_164V}-7.5187 -0.2207 -5.8167 { c tyr A 6 1rylA_6Y_164V}-7.3482 0.9341 -6.8008 { o tyr A 6 1rylA_6Y_164V}-8.1704 1.8572 -6.857 { c tyr A 6 1rylA_6Y_164V}P -7.3482 0.9341 -6.8008 { n phe A 7 1rylA_6Y_164V}-6.2529 0.8763 -7.5496 { ca phe A 7 1rylA_6Y_164V}-5.9045 1.9037 -8.5212 { c phe A 7 1rylA_6Y_164V}-5.929 1.2703 -9.9054 { o phe A 7 1rylA_6Y_164V}-5.035 0.4962 -10.2618 { c phe A 7 1rylA_6Y_164V}P -5.929 1.2703 -9.9054 { n ala A 8 1rylA_6Y_164V}-6.9567 1.6084 -10.678 { ca ala A 8 1rylA_6Y_164V}-7.1357 1.0289 -11.9985 { c ala A 8 1rylA_6Y_164V}-6.6008 1.8458 -13.1645 { o ala A 8 1rylA_6Y_164V}-6.4992 3.0705 -13.0984 { n leu A 162 1rylA_6Y_164V}P -7.5507 5.6492 -12.214 {"}-7.5507 5.6492 -12.214 { ca leu A 162 1rylA_6Y_164V}-8.793 5.7314 -11.4579 { c leu A 162 1rylA_6Y_164V}-8.5725 5.1342 -10.0684 { o leu A 162 1rylA_6Y_164V}-8.1813 3.9714 -9.9485 { c leu A 162 1rylA_6Y_164V}P -8.5725 5.1342 -10.0684 { n thr A 163 1rylA_6Y_164V}-8.7875 5.9288 -9.0228 { ca thr A 163 1rylA_6Y_164V}-8.6593 5.4163 -7.6678 { c thr A 163 1rylA_6Y_164V}-10.0725 4.9933 -7.2915 { o thr A 163 1rylA_6Y_164V}-11.0082 5.7869 -7.3913 { c thr A 163 1rylA_6Y_164V}P -10.0725 4.9933 -7.2915 { n val A 164 1rylA_6Y_164V}-10.2312 3.7401 -6.8805 { ca val A 164 1rylA_6Y_164V}-11.5418 3.2396 -6.4984 { c val A 164 1rylA_6Y_164V}-11.5008 2.7208 -5.0645 { o val A 164 1rylA_6Y_164V}-10.7377 1.812 -4.7437 { c val A 164 1rylA_6Y_164V}P -11.5008 2.7208 -5.0645 { n ile A 165 1rylA_6Y_164V}-12.2983 3.3306 -4.1987 { ca ile A 165 1rylA_6Y_164V}-12.3705 2.9131 -2.8059 { c ile A 165 1rylA_6Y_164V}-13.8373 2.7141 -2.4755 { o ile A 165 1rylA_6Y_164V}-14.5825 3.6837 -2.3346 { c ile A 165 1rylA_6Y_164V}P -13.8373 2.7141 -2.4755 { n val A 166 1rylA_6Y_164V}-14.2579 1.458 -2.3603 { ca val A 166 1rylA_6Y_164V}-15.657 1.165 -2.0559 { c val A 166 1rylA_6Y_164V}-15.8836 -0.3119 -1.6885 { o val A 166 1rylA_6Y_164V}-14.8863 -1.0664 -1.6125 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 4 1rylA_6Y_164V}P -12.5045 -1.8543 0.2113 { ca ile A 4 1rylA_6Y_164V}P -11.1832 -2.1565 -0.3217 { n gly A 5 1rylA_6Y_164V}P -9.5142 -0.8432 -1.5101 { ca gly A 5 1rylA_6Y_164V}P -9.095 0.1968 -2.4238 {"}P -9.095 0.1968 -2.4238 { n tyr A 6 1rylA_6Y_164V}P -8.385 0.1737 -4.7256 { ca tyr A 6 1rylA_6Y_164V}P -7.5187 -0.2207 -5.8167 { n phe A 7 1rylA_6Y_164V}P -6.2529 0.8763 -7.5496 { ca phe A 7 1rylA_6Y_164V}P -5.9045 1.9037 -8.5212 { n ala A 8 1rylA_6Y_164V}P -6.9567 1.6084 -10.678 { ca ala A 8 1rylA_6Y_164V}P -7.1357 1.0289 -11.9985 { n leu A 162 1rylA_6Y_164V}P -7.5507 5.6492 -12.214 { ca leu A 162 1rylA_6Y_164V}P -8.793 5.7314 -11.4579 { n thr A 163 1rylA_6Y_164V}P -8.7875 5.9288 -9.0228 { ca thr A 163 1rylA_6Y_164V}P -8.6593 5.4163 -7.6678 { n val A 164 1rylA_6Y_164V}P -10.2312 3.7401 -6.8805 { ca val A 164 1rylA_6Y_164V}P -11.5418 3.2396 -6.4984 { n ile A 165 1rylA_6Y_164V}P -12.2983 3.3306 -4.1987 { ca ile A 165 1rylA_6Y_164V}P -12.3705 2.9131 -2.8059 { n val A 166 1rylA_6Y_164V}P -14.2579 1.458 -2.3603 { ca val A 166 1rylA_6Y_164V}P -15.657 1.165 -2.0559 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 4 1rylA_6Y_164V}P -11.1832 -2.1565 -0.3217 {"}-11.1832 -2.1565 -0.3217 { ca gly A 5 1rylA_6Y_164V}-9.095 0.1968 -2.4238 { ca tyr A 6 1rylA_6Y_164V}-7.5187 -0.2207 -5.8167 { ca phe A 7 1rylA_6Y_164V}-5.9045 1.9037 -8.5212 { ca ala A 8 1rylA_6Y_164V}-7.1357 1.0289 -11.9985 { ca leu A 162 1rylA_6Y_164V}P -8.793 5.7314 -11.4579 {"}-8.793 5.7314 -11.4579 { ca thr A 163 1rylA_6Y_164V}-8.6593 5.4163 -7.6678 { ca val A 164 1rylA_6Y_164V}-11.5418 3.2396 -6.4984 { ca ile A 165 1rylA_6Y_164V}-12.3705 2.9131 -2.8059 { ca val A 166 1rylA_6Y_164V}-15.657 1.165 -2.0559 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 6 1rylA_6Y_164V}P -7.5187 -0.2207 -5.8167 { cb tyr A 6 1rylA_6Y_164V}-8.0349 -1.4985 -6.4987 { cg tyr A 6 1rylA_6Y_164V}-9.4159 -1.4195 -7.1192 { cd1 tyr A 6 1rylA_6Y_164V}-9.5916 -0.9287 -8.413 { ce1 tyr A 6 1rylA_6Y_164V}-10.8474 -0.9336 -9.0278 { cz tyr A 6 1rylA_6Y_164V}-11.95 -1.4282 -8.3389 { oh tyr A 6 1rylA_6Y_164V}-13.1869 -1.4527 -8.9557 { cg tyr A 6 1rylA_6Y_164V}P -9.4159 -1.4195 -7.1192 { cd2 tyr A 6 1rylA_6Y_164V}-10.5373 -1.908 -6.4386 { ce2 tyr A 6 1rylA_6Y_164V}-11.8034 -1.9129 -7.0401 { cz tyr A 6 1rylA_6Y_164V}ghost -11.95 -1.4282 -8.3389 { ca val A 164 1rylA_6Y_164V}P -11.5418 3.2396 -6.4984 { cb val A 164 1rylA_6Y_164V}-11.9994 2.1044 -7.4458 { cg1 val A 164 1rylA_6Y_164V}-13.4321 1.6984 -7.1274 { cb val A 164 1rylA_6Y_164V}P -11.9994 2.1044 -7.4458 { cg2 val A 164 1rylA_6Y_164V}-11.8782 2.5627 -8.897 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 6 1rylA_6Y_164V}P -8.0349 -1.4985 -6.4987 {"}P -8.0349 -1.4985 -6.4987 { cd1 tyr A 6 1rylA_6Y_164V}P -9.5916 -0.9287 -8.413 { cd2 tyr A 6 1rylA_6Y_164V}P -10.5373 -1.908 -6.4386 { ce1 tyr A 6 1rylA_6Y_164V}P -10.8474 -0.9336 -9.0278 { ce2 tyr A 6 1rylA_6Y_164V}P -11.8034 -1.9129 -7.0401 { oh tyr A 6 1rylA_6Y_164V}P -13.1869 -1.4527 -8.9557 { cb val A 164 1rylA_6Y_164V}P -11.9994 2.1044 -7.4458 { cg1 val A 164 1rylA_6Y_164V}P -13.4321 1.6984 -7.1274 {"}P -13.4321 1.6984 -7.1274 {"}P -13.4321 1.6984 -7.1274 { cg2 val A 164 1rylA_6Y_164V}P -11.8782 2.5627 -8.897 {"}P -11.8782 2.5627 -8.897 {"}P -11.8782 2.5627 -8.897 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 6 A}'S' blue -10.6078 -0.1601 -6.8844 {"}'S' blue -10.3775 0.034 -6.9573 {"}'S' blue -10.5361 -0.0751 -7.1322 { CD1 TYR 6 A}'S' sky -10.7858 -0.1442 -7.403 {"}'S' sky -10.513 -0.0045 -7.2466 {"}'S' sky -10.1672 0.3711 -7.3928 {"}'S' sky -10.0764 0.5682 -7.6469 {"}'S' blue -10.1285 0.7093 -8.1127 { CD2 TYR 6 A}'S' blue -10.93 -0.2343 -6.7661 {"}'S' blue -10.7514 -0.2507 -6.9591 {"}'S' blue -10.9122 -0.3492 -7.1394 { CE1 TYR 6 A}'S' sky -11.8808 0.4165 -8.6123 {"}'S' sky -11.809 0.5199 -8.8659 {"}'S' sky -11.9676 0.4109 -9.0407 {"}'S' blue -12.1169 0.2593 -9.1914 {"}'S' sky -12.0061 0.317 -9.4222 {"}'S' sky -11.8743 0.3402 -9.6489 {"}'S' blue -10.758 0.7912 -8.7474 {"}'S' sky -11.7029 0.3547 -9.8469 {"}'S' blue -10.7357 0.8086 -9.1515 {"}'S' sky -10.8978 0.7851 -9.354 {"}'S' blue -11.0614 0.7237 -9.5483 {"}'S' sky -11.2223 0.6252 -9.7285 {"}'S' blue -11.3765 0.4937 -9.8922 { CE2 TYR 6 A}'S' blue -12.5008 -0.3112 -6.9371 {"}'S' blue -12.6615 -0.3896 -7.1217 {"}'S' blue -11.714 -0.1881 -6.7597 {"}'S' blue -11.8707 -0.1652 -6.967 {"}'S' blue -11.3857 -0.2381 -6.749 {"}'S' sky -11.5348 -0.1851 -6.9563 {"}'S' blue -11.177 -0.285 -6.9007 {"}'S' sky -11.3256 -0.2312 -7.1076 {"}'S' blue -11.1123 -0.3176 -7.2355 { CZ TYR 6 A}'S' blue -13.0127 -0.4229 -7.3788 {"}'S' sky -13.1756 -0.4307 -7.5861 {"}'S' sky -13.3389 -0.527 -7.7702 {"}'S' blue -12.7249 -0.2887 -7.2605 {"}'S' sky -12.8678 -0.2222 -7.4641 {"}'S' sky -12.5256 -0.1284 -7.3186 {"}'S' sky -12.2949 -0.0122 -7.3699 {"}'S' sky -12.9632 -0.0235 -8.5883 {"}'S' sky -12.3621 0.2719 -8.2853 {"}'S' blue -12.5229 0.2193 -8.4777 {"}'S' blue -12.6802 0.1296 -8.6568 {"}'S' sky -12.1789 0.3021 -8.4707 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 6 A}'S' sea -10.6542 0.0766 -7.4529 {"}'S' sea -10.3665 0.2108 -7.3347 {"}'S' green -10.5093 0.2773 -7.5383 {"}'S' green -10.667 0.2772 -7.7418 {"}'S' sea -10.3094 0.4415 -7.5948 {"}'S' green -10.4637 0.4592 -7.7994 {"}'S' sea -10.2294 0.6024 -7.8553 {"}'S' sea -10.3904 0.5874 -8.0583 { CE1 TYR 6 A}'S' green -11.2047 0.0771 -7.6449 {"}'S' green -11.5652 0.4366 -8.2095 {"}'S' sea -11.7195 0.4543 -8.4141 {"}'S' sea -10.8993 -0.0096 -7.5427 {"}'S' green -10.9711 0.1904 -7.6916 {"}'S' green -11.3321 0.5633 -8.2616 {"}'S' green -11.4851 0.5975 -8.47 {"}'S' sea -11.6462 0.5826 -8.673 {"}'S' green -10.7299 0.2658 -7.7585 {"}'S' green -11.0805 0.649 -8.3183 {"}'S' sea -11.2284 0.6988 -8.5233 {"}'S' sea -11.3843 0.7044 -8.7274 {"}'S' sea -11.5447 0.6682 -8.9247 {"}'S' sea -11.7054 0.5898 -9.1094 {"}'S' sea -11.8605 0.4711 -9.2772 {"}'S' green -10.6795 0.5836 -8.1722 {"}'S' green -10.8074 0.6866 -8.3672 {"}'S' sea -10.9498 0.7525 -8.5701 {"}'S' sea -11.1017 0.7797 -8.7737 {"}'S' sea -11.2594 0.7665 -8.9742 {"}'S' sea -11.4202 0.714 -9.1666 {"}'S' green -11.5775 0.6242 -9.3457 {"}'S' sea -11.7307 0.4988 -9.5076 {"}'S' sea -10.9146 0.8142 -8.9547 {"}'S' sea -11.0762 0.7968 -9.1596 {"}'S' sea -11.2401 0.7401 -9.3553 {"}'S' sea -11.4012 0.6464 -9.537 {"}'S' sea -11.5567 0.5166 -9.7028 { CZ TYR 6 A}'S' sea -13.0255 -0.2223 -7.6677 {"}'S' green -13.1862 -0.2865 -7.8573 {"}'S' sea -13.3395 -0.4137 -8.0207 {"}'S' sea -12.6679 -0.058 -7.5206 {"}'S' green -12.8222 -0.0403 -7.7253 {"}'S' green -12.9834 -0.0781 -7.9234 {"}'S' green -13.142 -0.1688 -8.104 {"}'S' sea -12.4348 0.0687 -7.5727 {"}'S' sea -12.5878 0.1029 -7.7811 {"}'S' green -12.7489 0.0879 -7.9842 {"}'S' green -12.9117 0.0253 -8.177 {"}'S' green -13.0703 -0.0837 -8.3518 {"}'S' sea -11.9302 -0.0649 -7.2422 {"}'S' sea -12.0478 0.0642 -7.4306 {"}'S' sea -12.1832 0.1544 -7.6295 {"}'S' sea -12.3311 0.2042 -7.8344 {"}'S' sea -12.487 0.2098 -8.0385 {"}'S' sea -12.6474 0.1736 -8.2358 {"}'S' sea -12.8081 0.0951 -8.4205 {"}'S' green -11.6695 -0.0487 -7.2996 {"}'S' green -11.7821 0.089 -7.4833 {"}'S' green -11.9101 0.192 -7.6783 {"}'S' green -12.0525 0.2579 -7.8812 {"}'S' sea -12.2044 0.285 -8.0848 {"}'S' sea -11.3607 -0.1627 -7.284 {"}'S' green -11.4608 0.0037 -7.4588 {"}'S' green -11.7139 0.2358 -7.8508 {"}'S' green -11.8607 0.2966 -8.0585 {"}'S' sea -12.0173 0.3196 -8.2658 {"}'S' sea -11.1671 -0.1253 -7.4722 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 6 A}'S' P -11.3014 0.2443 -7.8153 {"}'S' -11.2939 0.2252 -7.8348 {"}'S' P -11.4229 0.3663 -8.0075 {"}'S' -11.4145 0.3467 -8.0223 {"}'S' P -11.07 0.3561 -7.8663 {"}'S' -11.064 0.3221 -7.8965 {"}'S' P -11.1922 0.4824 -8.0588 {"}'S' -11.183 0.445 -8.0838 {"}'S' P -10.8275 0.4297 -7.9311 {"}'S' -10.8276 0.4203 -7.9393 {"}'S' P -10.9451 0.5588 -8.1195 {"}'S' -10.9441 0.5441 -8.1285 { CZ TYR 6 A}'S' P -11.5795 0.1374 -7.6498 {"}'S' -11.5795 0.1374 -7.6498 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 6 A}'S' blue -13.8153 -0.6132 -8.0291 {"}'S' sky -13.9531 -0.5339 -8.2288 {"}'S' sky -13.5179 -0.5827 -7.9098 {"}'S' sky -13.9241 -0.3531 -8.4986 {"}'S' sky -13.8413 -0.2331 -8.7427 {"}'S' sky -13.5874 -0.1192 -8.8095 {"}'S' sky -13.1206 -0.0969 -8.6124 {"}'S' sky 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{"}'S' sky -11.5116 1.0617 -9.9775 {"}'S' blue -10.534 0.9415 -9.1146 {"}'S' sky -10.6711 1.0324 -9.3176 {"}'S' sky -10.9773 1.1034 -9.7319 {"}'S' sky -10.4588 0.9402 -9.4455 {"}'S' sky -10.6064 0.9997 -9.6524 {"}'S' sky -10.7623 1.0212 -9.86 {"}'S' blue -10.3985 0.8741 -9.7633 { CE2 TYR 461 A}'S' blue -12.2846 -0.0719 -7.2191 {"}'S' blue -12.4314 -0.0111 -7.4268 {"}'S' blue -11.9651 -0.1521 -7.2137 {"}'S' blue -12.1031 -0.0611 -7.4161 {"}'S' blue -11.7572 -0.1989 -7.3647 {"}'S' blue -11.5472 -0.2978 -7.4943 { CZ TYR 461 A}'S' sky -12.9861 0.1879 -7.6665 {"}'S' sky -13.1077 0.3099 -7.8588 {"}'S' sky -13.25 0.3802 -8.0608 {"}'S' sky -13.1699 0.5411 -8.3213 {"}'S' blue -13.0691 0.648 -8.5787 {"}'S' sky -12.0859 0.0251 -7.5251 {"}'S' sky -11.807 -0.1359 -7.5344 {"}'S' sky -12.4204 0.7522 -9.0027 @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 461 A}'S' sea -10.8742 -0.1336 -7.2956 {"}'S' sea -10.6124 -0.0118 -7.35 { CD1 TYR 461 A}'S' green -11.0345 -0.0076 -7.675 {"}'S' 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-11.1859 1.1466 -9.5807 {"}'S' sea -11.348 1.1232 -9.7833 {"}'S' sea -10.8197 1.0862 -9.5245 { CZ TYR 461 A}'S' sea -12.7548 0.2997 -7.7176 {"}'S' sea -12.877 0.426 -7.9101 {"}'S' sea -13.0169 0.5069 -8.1129 {"}'S' sea -12.4146 0.2094 -7.6098 {"}'S' green -12.5123 0.3733 -7.7824 {"}'S' green -12.6298 0.5024 -7.9708 {"}'S' green -12.7653 0.5926 -8.1696 {"}'S' sea -12.9132 0.6424 -8.3746 {"}'S' green -12.1582 0.2205 -7.672 {"}'S' green -12.2515 0.3895 -7.8398 {"}'S' green -12.6346 0.6961 -8.4214 {"}'S' sea -12.7865 0.7232 -8.6249 {"}'S' sea -11.8637 0.0817 -7.6683 {"}'S' green -11.9428 0.2755 -7.8242 {"}'S' green -12.4427 0.7348 -8.5986 {"}'S' sea -12.5994 0.7578 -8.806 {"}'S' sea -11.5991 -0.0826 -7.7084 {"}'S' green -11.6631 0.1271 -7.8506 {"}'S' green -11.7492 0.3129 -8.0124 {"}'S' sea -12.2635 0.7379 -8.7953 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD1 TYR 461 A}'S' P -10.888 0.2076 -7.7631 {"}'S' -10.8773 0.193 -7.7777 {"}'S' P -10.6886 0.368 -7.8212 {"}'S' -10.6744 0.3346 -7.847 {"}'S' P -10.8309 0.4384 -8.0231 {"}'S' -10.8087 0.3977 -8.0484 {"}'S' P -10.458 0.4841 -7.8724 {"}'S' -10.4556 0.4735 -7.8787 {"}'S' P -10.5978 0.565 -8.0753 {"}'S' -10.5899 0.5408 -8.088 {"}'S' P -10.7508 0.5992 -8.2836 {"}'S' -10.7493 0.5962 -8.2843 { CE1 TYR 461 A}'S' P -11.6549 0.4151 -8.0742 {"}'S' -11.6525 0.408 -8.0847 {"}'S' P -11.7515 0.5823 -8.2445 {"}'S' -11.7426 0.5596 -8.2681 {"}'S' P -11.8731 0.7043 -8.4368 {"}'S' -11.8599 0.6737 -8.4596 {"}'S' P -12.0154 0.7747 -8.6388 {"}'S' -12.0131 0.7711 -8.6417 {"}'S' P -11.3494 0.3284 -7.9719 {"}'S' -11.3472 0.3017 -8.014 {"}'S' P -11.4213 0.5284 -8.1209 {"}'S' -11.4164 0.4807 -8.1785 {"}'S' P -11.5202 0.6941 -8.2956 {"}'S' -11.5141 0.6541 -8.3311 {"}'S' P -11.6424 0.8204 -8.4881 {"}'S' -11.6294 0.7687 -8.5234 {"}'S' P -11.7823 0.9013 -8.6909 {"}'S' -11.773 0.8724 -8.7057 {"}'S' P -11.1051 0.409 -8.0375 {"}'S' -11.1129 0.3708 -8.0924 {"}'S' P -11.18 0.6038 -8.1877 {"}'S' -11.1855 0.5437 -8.2515 {"}'S' P -11.2777 0.7677 -8.3604 {"}'S' -11.2783 0.7237 -8.3955 {"}'S' P -11.3953 0.8968 -8.5488 {"}'S' -11.393 0.8577 -8.5726 {"}'S' P -11.5307 0.987 -8.7476 {"}'S' -11.5272 0.9641 -8.7581 {"}'S' P -11.6786 1.0368 -8.9526 {"}'S' -11.6737 1.0169 -8.9584 {"}'S' P -11.8345 1.0424 -9.1567 {"}'S' -11.8322 1.0364 -9.1574 {"}'S' P -10.9236 0.6149 -8.25 {"}'S' -10.9337 0.5815 -8.2834 {"}'S' P -11.0169 0.7839 -8.4178 {"}'S' -11.0213 0.7622 -8.4342 {"}'S' P -11.4 1.0905 -8.9994 {"}'S' -11.3984 1.0595 -9.0071 {"}'S' P -11.5519 1.1177 -9.2029 {"}'S' -11.5472 1.0798 -9.2083 {"}'S' P -11.7096 1.1045 -9.4035 {"}'S' -11.7081 1.0987 -9.4036 {"}'S' P -11.2082 1.1292 -9.1766 {"}'S' -11.2095 1.1145 -9.1785 {"}'S' P -11.3648 1.1522 -9.384 {"}'S' -11.3641 1.1356 -9.3844 { CZ TYR 461 A}'S' P -12.3642 0.5272 -8.0235 {"}'S' -12.3654 0.5103 -8.0332 {"}'S' P -12.4922 0.6302 -8.2185 {"}'S' -12.4925 0.6223 -8.2223 {"}'S' P -12.0429 0.442 -7.9989 {"}'S' -12.0463 0.4313 -8.0062 {"}'S' P -12.1616 0.5756 -8.19 {"}'S' -12.169 0.5452 -8.2034 {"}'S' P -12.296 0.674 -8.391 {"}'S' -12.2982 0.6588 -8.3957 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB HIS 474 A}'S' sky -12.3552 0.4009 -7.4253 {"}'S' blue -12.1975 0.3864 -7.2184 {"}'S' sky -12.7534 0.9727 -8.5341 {"}'S' sky -11.9987 0.3418 -7.3825 { CG HIS 474 A}'S' blue -12.4506 1.1998 -9.153 {"}'S' sky -12.3131 1.1097 -8.9495 {"}'S' sky -12.2509 1.1596 -9.3168 {"}'S' sky -12.1194 1.2333 -9.5965 {"}'S' sky -11.4136 1.3856 -9.8901 {"}'S' sky -11.0424 1.3957 -9.7303 { HB2 HIS 474 A}'S' blue -11.9143 0.3186 -7.2448 {"}'S' blue -11.6972 0.1732 -7.3335 {"}'S' blue -11.5452 0.1474 -7.1302 {"}'S' blue -11.3955 0.0773 -7.3487 {"}'S' blue -11.24 0.0893 -7.1508 {"}'S' sky -10.9797 0.0911 -7.2467 {"}'S' sky -10.8217 0.1768 -7.0657 {"}'S' sky -10.5092 0.3306 -7.1146 { HB3 HIS 474 A}'S' sky -13.2521 0.756 -8.0537 {"}'S' sky -12.9994 0.5428 -7.6682 {"}'S' sky -12.847 0.5179 -7.4645 {"}'S' sky -13.0617 0.8593 -8.2478 @dotlist {x} color= white width= 1 master= {vdw contact} { CB HIS 474 A}'S' green -12.765 0.6687 -8.0294 {"}'S' green -12.6418 0.544 -7.8361 {"}'S' sea -12.5043 0.4539 -7.6326 {"}'S' green -12.6689 0.7869 -8.3728 {"}'S' green -12.564 0.6291 -8.1933 {"}'S' green -12.3046 0.4119 -7.7978 {"}'S' sea -12.156 0.3581 -7.5909 {"}'S' sea -12.5113 0.9064 -8.6307 {"}'S' green -12.4204 0.7265 -8.4637 {"}'S' green -12.0418 0.3834 -7.8781 {"}'S' green -12.2591 0.8794 -8.7121 {"}'S' green -12.1662 0.7097 -8.5447 {"}'S' green -12.0374 0.9723 -8.8422 {"}'S' green -11.1116 0.9481 -8.5846 {"}'S' sea -10.9573 1.1561 -8.6604 { CG HIS 474 A}'S' green -12.1134 1.0677 -9.1148 {"}'S' green -11.9648 1.0139 -8.9079 {"}'S' green -11.9926 1.1176 -9.4003 {"}'S' sea -11.8632 1.2262 -9.6788 {"}'S' green -11.7348 1.1226 -9.4831 {"}'S' sea -11.65 1.303 -9.815 {"}'S' green -11.523 1.1943 -9.6201 {"}'S' green -11.0693 1.1161 -9.0112 {"}'S' sea -10.9079 1.175 -8.8194 {"}'S' green -11.2824 1.2803 -9.6919 {"}'S' 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{"}'S' -11.4474 1.0652 -9.072 {"}'S' P -11.2838 1.0397 -8.8767 {"}'S' -11.2852 1.0469 -8.8769 {"}'S' P -11.3811 1.1262 -9.4174 {"}'S' -11.3835 1.1379 -9.4131 {"}'S' P -11.2283 1.0993 -9.2127 {"}'S' -11.2326 1.116 -9.2087 { HB2 HIS 474 A}'S' P -11.6319 0.4748 -8.1966 {"}'S' -11.6205 0.4951 -8.1754 {"}'S' P -11.5442 0.2987 -8.0331 {"}'S' -11.5363 0.3189 -8.0201 {"}'S' P -11.4249 0.5983 -8.3726 {"}'S' -11.4119 0.6341 -8.3185 {"}'S' P -11.3539 0.402 -8.2272 {"}'S' -11.3429 0.4609 -8.1692 {"}'S' P -11.2513 0.2492 -8.0521 {"}'S' -11.2491 0.2952 -8.022 {"}'S' P -11.1822 0.692 -8.4534 {"}'S' -11.183 0.7182 -8.4025 {"}'S' P -11.1177 0.4831 -8.3108 {"}'S' -11.1239 0.5362 -8.2477 {"}'S' P -11.014 0.3243 -8.1329 {"}'S' -11.0224 0.3686 -8.098 {"}'S' P -10.8791 0.2295 -7.932 {"}'S' -10.8909 0.2674 -7.9123 {"}'S' P -10.7233 0.2052 -7.7238 {"}'S' -10.7316 0.2237 -7.7188 {"}'S' P -10.9346 0.8012 -8.4698 {"}'S' -10.9342 0.8006 -8.4691 {"}'S' P -10.8795 0.5899 -8.3411 {"}'S' -10.8885 0.6091 -8.3133 {"}'S' P -10.7769 0.4372 -8.1661 {"}'S' -10.7921 0.4665 -8.1388 {"}'S' P -10.6398 0.3622 -7.9666 {"}'S' -10.6637 0.3997 -7.943 {"}'S' P -10.4834 0.3729 -7.7674 {"}'S' -10.4893 0.38 -7.765 {"}'S' P -10.4886 0.5573 -8.0575 {"}'S' -10.4968 0.5641 -8.0497 @dotlist {x} color= sky width= 1 master= {vdw contact} { ND1 HIS 474 A}'S' blue -10.6164 1.3412 -8.9887 {"}'S' blue -11.0042 1.4902 -9.956 {"}'S' -10.8748 1.3793 -9.7573 {"}'S' -10.573 1.2821 -9.3414 {"}'S' blue -10.4115 1.2995 -9.1365 {"}'S' -10.6264 1.3529 -9.8475 {"}'S' -10.4779 1.295 -9.6398 {"}'S' blue -10.3193 1.2821 -9.432 @dotlist {x} color= sky width= 1 master= {vdw contact} { ND1 HIS 474 A}'S' sea -10.7296 1.3089 -9.5512 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 461 A}'M' green -9.5963 1.7773 -6.2363 {"}'M' green -8.9509 2.0689 -5.7898 {"}'M' green -8.6303 2.4985 -6.07 {"}'M' green -8.8247 2.7184 -6.7464 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 461 A}'M' greentint -9.4374 1.866 -6.0547 {"}'M' greentint -9.2 1.9987 -5.9024 {"}'M' greentint -9.3343 2.0985 -6.1037 {"}'M' greentint -9.4976 2.0652 -6.3055 {"}'M' greentint -9.6462 1.9082 -6.454 {"}'M' greentint -9.0526 2.2244 -5.966 {"}'M' greentint -9.1904 2.3037 -6.1657 {"}'M' greentint -9.3484 2.2953 -6.3677 {"}'M' greentint -9.507 2.2021 -6.5461 {"}'M' greentint -9.6462 2.0342 -6.6793 {"}'M' greentint -8.8661 2.3954 -6.0305 {"}'M' greentint -9.0052 2.4738 -6.2317 {"}'M' greentint -9.1614 2.4844 -6.4355 {"}'M' greentint -9.3216 2.4262 -6.6275 {"}'M' greentint -9.4764 2.3031 -6.7922 {"}'M' greentint -8.7652 2.5919 -6.2707 {"}'M' greentint -8.9181 2.6278 -6.4776 {"}'M' greentint -9.0786 2.6044 -6.6796 {"}'M' greentint -9.2407 2.5222 -6.8653 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H HIS 474 A}'M' greentint -9.4541 1.8034 -6.0531 {"}'M' greentint -9.5449 1.9354 -6.6072 {"}'M' greentint -9.4035 1.8624 -6.4041 {"}'M' greentint -9.2453 1.8646 -6.2003 {"}'M' greentint -9.0847 1.9406 -6.0135 {"}'M' greentint -8.9351 2.086 -5.8611 {"}'M' greentint -9.4165 2.1621 -6.8473 {"}'M' greentint -9.3004 2.0251 -6.6591 {"}'M' greentint -9.1516 1.9755 -6.453 {"}'M' greentint -8.9893 2.0204 -6.2551 {"}'M' greentint -8.8351 2.153 -6.0933 {"}'M' greentint -8.7108 2.3563 -5.9887 {"}'M' greentint -9.239 2.466 -6.9647 {"}'M' greentint -9.1724 2.2607 -6.8216 {"}'M' greentint -9.0406 2.159 -6.6235 {"}'M' greentint -8.8796 2.187 -6.4235 {"}'M' greentint -8.7316 2.339 -6.2746 {"}'M' greentint -8.6368 2.5731 -6.2173 {"}'M' greentint -9.0113 2.532 -6.8548 {"}'M' greentint -8.9071 2.3768 -6.677 {"}'M' greentint -8.7472 2.4737 -6.4976 {"}'M' greentint -8.8255 2.6234 -6.6968 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 461 A}'M' green -10.4423 0.2289 -4.592 {"}'M' green -10.0897 0.6769 -4.6892 {"}'M' green -10.6917 0.3595 -5.7232 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 461 A}'M' greentint -10.6281 0.1375 -4.75 {"}'M' greentint -10.7614 0.0339 -4.9495 {"}'M' greentint -10.5465 0.3841 -4.7699 {"}'M' greentint -10.7064 0.2871 -4.9493 {"}'M' greentint -10.8168 0.1878 -5.2296 {"}'M' greentint -10.2812 0.5002 -4.6252 {"}'M' greentint -10.413 0.6019 -4.8234 {"}'M' greentint -10.574 0.5738 -5.0234 {"}'M' greentint -10.722 0.4219 -5.1722 {"}'M' greentint -10.7886 0.2852 -5.4832 {"}'M' greentint -10.2246 0.7718 -4.89 {"}'M' greentint -10.3834 0.7749 -5.096 {"}'M' greentint -10.5437 0.6838 -5.2788 {"}'M' greentint -10.6851 0.5133 -5.4144 {"}'M' greentint -10.1277 0.9065 -5.1455 {"}'M' greentint -10.289 0.8673 -5.3434 {"}'M' greentint -10.4456 0.7553 -5.5148 {"}'M' greentint -10.5842 0.5805 -5.6455 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O HIS 474 A}'M' green -10.2005 0.5514 -4.5437 {"}'M' green -10.0554 0.9657 -5.2363 {"}'M' green -10.351 0.7763 -5.6825 @dotlist {x} color= red width= 1 master= {H-bonds} { O HIS 474 A}'M' greentint -10.7909 0.0213 -5.1579 {"}'M' greentint -10.6283 0.077 -4.9637 {"}'M' greentint -10.4705 0.1872 -4.7903 {"}'M' greentint -10.3251 0.349 -4.6473 {"}'M' greentint -10.7166 0.1567 -5.417 {"}'M' greentint -10.5574 0.1791 -5.2165 {"}'M' greentint -10.3977 0.2677 -5.0355 {"}'M' greentint -10.2509 0.4173 -4.8879 {"}'M' greentint -10.1272 0.6171 -4.7832 {"}'M' greentint -10.5979 0.3386 -5.5715 {"}'M' greentint -10.4391 0.3496 -5.3706 {"}'M' greentint -10.2821 0.4455 -5.1932 {"}'M' greentint -10.1436 0.6161 -5.0617 {"}'M' greentint -10.0407 0.8396 -4.9908 {"}'M' greentint -10.4636 0.5465 -5.6473 {"}'M' greentint -10.3005 0.5757 -5.4446 {"}'M' greentint -10.1507 0.7294 -5.2938 {"}'M' greentint -10.1923 0.8736 -5.5048 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 78 1sdoA_80Y_114S}P -12.3991 -1.9814 0.3057 {"}-12.3991 -1.9814 0.3057 { ca thr A 78 1sdoA_80Y_114S}-11.1512 -2.3566 -0.3279 { c thr A 78 1sdoA_80Y_114S}-10.8389 -1.3012 -1.386 { o thr A 78 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-7.6451 {"}'S' sky -11.6239 0.2399 -7.8535 {"}'S' sky -11.785 0.225 -8.0565 {"}'S' sky -11.0839 0.2012 -7.503 {"}'S' sky -10.8182 0.226 -7.5557 {"}'S' sky -10.6156 0.2744 -7.7222 {"}'S' sky -11.2002 0.3661 -8.9318 {"}'S' sky -10.8277 0.3848 -8.89 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 80 A}'S' sea -10.3395 0.3924 -7.8826 { CE1 TYR 80 A}'S' sea -11.2193 0.2914 -7.7018 {"}'S' green -11.3672 0.3412 -7.9068 {"}'S' green -11.5231 0.3468 -8.1109 {"}'S' sea -11.6835 0.3106 -8.3082 {"}'S' green -10.9462 0.329 -7.7507 {"}'S' green -11.0886 0.3949 -7.9536 {"}'S' green -11.3982 0.4089 -8.3577 {"}'S' sea -11.559 0.3563 -8.5501 {"}'S' green -10.75 0.3728 -7.9232 {"}'S' green -11.215 0.4391 -8.5431 {"}'S' sea -11.3789 0.3825 -8.7388 {"}'S' green -10.5685 0.3837 -8.1202 {"}'S' green -10.7176 0.4367 -8.3275 {"}'S' green -10.8745 0.451 -8.535 {"}'S' green -11.0366 0.4275 -8.7375 {"}'S' sea -10.5083 0.3906 -8.4787 {"}'S' sea -10.666 0.4078 -8.6861 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 80 A}'S' P -11.2405 0.422 -8.1572 {"}'S' -11.2393 0.4117 -8.1582 {"}'S' P -10.8968 0.4336 -8.1308 {"}'S' -10.8972 0.4219 -8.1322 {"}'S' P -11.0534 0.4566 -8.3382 {"}'S' -11.0525 0.4362 -8.3391 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 SER 114 A}'S' sky -11.739 0.5873 -8.22 {"}'S' sky -11.4487 0.6313 -8.7201 {"}'S' blue -10.5761 0.6453 -7.5973 {"}'S' sky -10.4137 0.6632 -7.8015 {"}'S' blue -10.2809 0.8422 -7.6797 {"}'S' sky -10.3073 0.7052 -8.0434 {"}'S' blue -10.1683 0.8821 -7.9125 {"}'S' sky -10.5442 0.6948 -8.6536 {"}'S' blue -10.2317 0.8009 -8.2798 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 SER 114 A}'S' sea -11.6016 0.5058 -8.0205 {"}'S' sea -11.4497 0.48 -7.8172 {"}'S' sea -11.2903 0.5105 -7.6199 {"}'S' sea -11.5779 0.546 -8.433 {"}'S' green -11.4473 0.4516 -8.238 {"}'S' green -11.2999 0.41 -8.0357 {"}'S' green -11.1444 0.4219 -7.8378 {"}'S' sea -10.9858 0.4864 -7.6511 {"}'S' green -11.3325 0.4996 -8.5347 {"}'S' green -10.8842 0.4237 -7.9336 {"}'S' sea -10.7262 0.5094 -7.7526 {"}'S' sea -11.1557 0.5819 -8.7391 {"}'S' green -11.0273 0.4811 -8.5439 {"}'S' green -10.7218 0.4558 -8.1429 {"}'S' sea -10.5641 0.5318 -7.9601 {"}'S' sea -10.9185 0.6569 -8.8198 {"}'S' green -10.7836 0.5621 -8.6189 {"}'S' green -10.6278 0.5379 -8.4107 {"}'S' sea -10.4645 0.5868 -8.2142 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 SER 114 A}'S' P -11.1959 0.4182 -8.3346 {"}'S' -11.1946 0.4315 -8.3324 {"}'S' P -11.0436 0.3932 -8.1309 {"}'S' -11.0449 0.4142 -8.1306 {"}'S' P -10.88 0.438 -8.3414 {"}'S' -10.8814 0.4456 -8.3398 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 80 A}'M' green -9.2033 2.4557 -6.1633 {"}'M' green -8.7475 2.8511 -5.875 {"}'M' green -8.5624 3.0212 -5.941 {"}'M' green -8.3841 3.2491 -6.8533 {"}'M' green -8.6877 2.9961 -7.1763 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 80 A}'M' greentint -9.0547 2.6126 -6.0148 {"}'M' greentint -8.9055 2.8427 -6.077 {"}'M' greentint -9.0641 2.7496 -6.2554 {"}'M' greentint -9.2033 2.5816 -6.3886 {"}'M' greentint -9.2766 2.4533 -6.7056 {"}'M' greentint -8.7185 3.0318 -6.1449 {"}'M' greentint -8.8787 2.9736 -6.3368 {"}'M' greentint -9.0335 2.8505 -6.5015 {"}'M' greentint -9.1692 2.673 -6.6277 {"}'M' greentint -9.1987 2.5335 -6.9438 {"}'M' greentint -8.4753 3.1753 -6.1869 {"}'M' greentint -8.6353 3.1512 -6.3883 {"}'M' greentint -8.7978 3.0696 -6.5746 {"}'M' greentint -8.9501 2.9337 -6.7346 {"}'M' greentint -9.0867 2.7521 -6.8594 {"}'M' greentint -8.3818 3.2658 -6.4557 {"}'M' greentint -8.5409 3.2147 -6.6479 {"}'M' greentint -8.6967 3.1159 -6.8212 {"}'M' greentint -8.8429 2.9723 -6.9711 {"}'M' greentint -8.9737 2.7904 -7.0896 {"}'M' greentint -8.541 3.1432 -7.0265 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 114 A}'M' greentint -9.1756 2.4165 -6.4429 {"}'M' greentint -9.0174 2.4802 -6.2566 {"}'M' greentint -8.8672 2.6046 -6.0968 {"}'M' greentint -8.7341 2.7802 -5.9737 {"}'M' greentint -9.125 2.4755 -6.794 {"}'M' greentint -8.9669 2.4777 -6.5902 {"}'M' greentint -8.8062 2.5537 -6.4034 {"}'M' greentint -8.6567 2.699 -6.251 {"}'M' greentint -8.5321 2.899 -6.1451 {"}'M' greentint -8.4435 3.1366 -6.0971 {"}'M' greentint -9.0219 2.6382 -7.049 {"}'M' greentint -8.8732 2.5885 -6.8429 {"}'M' greentint -8.7108 2.6334 -6.645 {"}'M' greentint -8.5566 2.766 -6.4832 {"}'M' greentint -8.4324 2.9694 -6.3786 {"}'M' greentint -8.3541 3.2151 -6.3465 {"}'M' greentint -8.7622 2.772 -7.0133 {"}'M' greentint -8.6012 2.8001 -6.8134 {"}'M' greentint -8.4531 2.952 -6.6645 {"}'M' greentint -8.3583 3.1861 -6.6072 {"}'M' greentint -8.6287 2.9898 -7.0669 {"}'M' greentint -8.4687 3.0868 -6.8874 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 80 A}'M' green -9.5558 1.4699 -4.1592 {"}'M' green -9.4223 1.6877 -4.2127 {"}'M' green -9.137 1.9923 -4.5349 {"}'M' green -9.167 1.9795 -4.9694 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 80 A}'M' greentint -9.7157 1.373 -4.3386 {"}'M' greentint -9.8261 1.2736 -4.6189 {"}'M' greentint -9.5833 1.6597 -4.4127 {"}'M' greentint -9.7313 1.5077 -4.5616 {"}'M' greentint -9.7978 1.371 -4.8725 {"}'M' greentint -9.8482 1.1164 -4.8679 {"}'M' greentint -9.3927 1.8607 -4.4853 {"}'M' greentint -9.553 1.7697 -4.6681 {"}'M' greentint -9.6944 1.5992 -4.8037 {"}'M' greentint -9.701 1.4453 -5.1125 {"}'M' greentint -9.7692 1.1963 -5.1302 {"}'M' greentint -9.2983 1.9531 -4.7327 {"}'M' greentint -9.4549 1.8411 -4.9041 {"}'M' greentint -9.5935 1.6663 -5.0349 {"}'M' greentint -9.5556 1.4648 -5.3301 {"}'M' greentint -9.3172 1.8551 -5.1293 {"}'M' greentint -9.4504 1.6795 -5.2524 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 114 A}'M' green -9.7529 1.3427 -4.2185 {"}'M' green -9.8978 1.071 -4.7304 {"}'M' green -9.3853 1.7752 -4.2625 {"}'M' green -9.7194 1.2332 -5.2244 {"}'M' green -9.6012 1.4038 -5.3785 {"}'M' green -9.4625 1.6298 -5.4525 {"}'M' green -9.3128 1.7835 -5.3017 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 114 A}'M' greentint -9.746 1.1917 -4.5676 {"}'M' greentint -9.6056 1.3537 -4.4316 {"}'M' greentint -9.4837 1.5503 -4.3286 {"}'M' greentint -9.7904 1.1311 -4.9716 {"}'M' greentint -9.6326 1.2414 -4.7982 {"}'M' greentint -9.4872 1.4031 -4.6552 {"}'M' greentint -9.3626 1.6055 -4.5516 {"}'M' greentint -9.2661 1.8386 -4.4917 {"}'M' greentint -9.5597 1.3218 -5.0434 {"}'M' greentint -9.413 1.4714 -4.8958 {"}'M' greentint -9.2893 1.6712 -4.7911 {"}'M' greentint -9.1974 1.9053 -4.7378 {"}'M' greentint -9.4441 1.4996 -5.2011 {"}'M' greentint -9.3057 1.6702 -5.0696 {"}'M' greentint -9.2028 1.8937 -4.9987 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 119 1sh8A_121Y_142}P -12.2171 -1.591 0.6397 {"}-12.2171 -1.591 0.6397 { ca ala A 119 1sh8A_121Y_142}-10.9095 -1.9569 0.1026 { c ala A 119 1sh8A_121Y_142}-10.6719 -1.1021 -1.1331 { o ala A 119 1sh8A_121Y_142}-11.5846 -0.9019 -1.9324 { c ala A 119 1sh8A_121Y_142}P -10.6719 -1.1021 -1.1331 { n glu A 120 1sh8A_121Y_142}-9.4512 -0.6023 -1.2962 { ca glu A 120 1sh8A_121Y_142}-9.1357 0.2428 -2.4454 { c glu A 120 1sh8A_121Y_142}-8.4275 -0.5004 -3.5669 { o glu A 120 1sh8A_121Y_142}-7.6426 -1.4125 -3.3284 { c glu A 120 1sh8A_121Y_142}P -8.4275 -0.5004 -3.5669 { n tyr A 121 1sh8A_121Y_142}-8.7109 -0.0942 -4.7989 { ca tyr A 121 1sh8A_121Y_142}-8.0205 -0.6495 -5.9535 { c tyr A 121 1sh8A_121Y_142}-7.8151 0.5062 -6.9311 { o tyr A 121 1sh8A_121Y_142}-8.6512 1.4093 -7.0342 { c tyr A 121 1sh8A_121Y_142}P -7.8151 0.5062 -6.9311 { n ser A 122 1sh8A_121Y_142}-6.6744 0.511 -7.6083 { ca ser A 122 1sh8A_121Y_142}-6.3808 1.5729 -8.5584 { c ser A 122 1sh8A_121Y_142}-6.2398 1.0204 -9.9689 { o ser A 122 1sh8A_121Y_142}-5.9774 -0.1715 -10.1602 { c ser A 122 1sh8A_121Y_142}P -6.2398 1.0204 -9.9689 { n leu A 123 1sh8A_121Y_142}-6.4394 1.8928 -10.9535 { ca leu A 123 1sh8A_121Y_142}-6.312 1.5139 -12.3539 { c leu A 123 1sh8A_121Y_142}-5.5452 2.6255 -13.0635 { o leu A 123 1sh8A_121Y_142}-5.8155 3.8108 -12.8472 { n ala A 140 1sh8A_121Y_142}P -6.6101 6.2278 -11.5218 {"}-6.6101 6.2278 -11.5218 { ca ala A 140 1sh8A_121Y_142}-7.7455 6.4072 -10.6231 { c ala A 140 1sh8A_121Y_142}-7.7458 5.4902 -9.4094 { o ala A 140 1sh8A_121Y_142}-7.239 4.3682 -9.4638 { c ala A 140 1sh8A_121Y_142}P -7.7458 5.4902 -9.4094 { n leu A 141 1sh8A_121Y_142}-8.3339 5.9844 -8.3232 { ca leu A 141 1sh8A_121Y_142}-8.4441 5.2319 -7.0785 { c leu A 141 1sh8A_121Y_142}-9.9161 4.9694 -6.8107 { o leu A 141 1sh8A_121Y_142}-10.7217 5.9019 -6.761 { c leu A 141 1sh8A_121Y_142}P -9.9161 4.9694 -6.8107 { n tyr A 142 1sh8A_121Y_142}-10.2536 3.696 -6.6447 { ca tyr A 142 1sh8A_121Y_142}-11.6206 3.2687 -6.3718 { c tyr A 142 1sh8A_121Y_142}-11.6645 2.5865 -5.0235 { o tyr A 142 1sh8A_121Y_142}-10.6459 2.1372 -4.4977 { c tyr A 142 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1sh8A_121Y_142}-12.582 -1.4008 -6.7653 { cz tyr A 121 1sh8A_121Y_142}ghost -12.7794 -1.1673 -8.117 { ca tyr A 142 1sh8A_121Y_142}P -11.6206 3.2687 -6.3718 { cb tyr A 142 1sh8A_121Y_142}-12.0915 2.2531 -7.4159 { cg tyr A 142 1sh8A_121Y_142}-12.1523 2.792 -8.8148 { cd1 tyr A 142 1sh8A_121Y_142}-13.3124 3.4063 -9.2965 { ce1 tyr A 142 1sh8A_121Y_142}-13.3609 3.9378 -10.5915 { cz tyr A 142 1sh8A_121Y_142}-12.2418 3.854 -11.4061 { oh tyr A 142 1sh8A_121Y_142}-12.2745 4.397 -12.6685 { cg tyr A 142 1sh8A_121Y_142}P -12.1523 2.792 -8.8148 { cd2 tyr A 142 1sh8A_121Y_142}-11.04 2.7173 -9.6579 { ce2 tyr A 142 1sh8A_121Y_142}-11.0776 3.2454 -10.9508 { cz tyr A 142 1sh8A_121Y_142}ghost -12.2418 3.854 -11.4061 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 121 1sh8A_121Y_142}P -8.7857 -1.8263 -6.5957 {"}P -8.7857 -1.8263 -6.5957 { cd1 tyr A 121 1sh8A_121Y_142}P -10.3998 -1.3034 -8.4855 { cd2 tyr A 121 1sh8A_121Y_142}P -11.2844 -1.589 -6.2782 { ce1 tyr A 121 1sh8A_121Y_142}P -11.6949 -1.1157 -8.986 { ce2 tyr A 121 1sh8A_121Y_142}P -12.582 -1.4008 -6.7653 { oh tyr A 121 1sh8A_121Y_142}P -14.0652 -0.9934 -8.5829 { cb tyr A 142 1sh8A_121Y_142}P -12.0915 2.2531 -7.4159 {"}P -12.0915 2.2531 -7.4159 { cd1 tyr A 142 1sh8A_121Y_142}P -13.3124 3.4063 -9.2965 { cd2 tyr A 142 1sh8A_121Y_142}P -11.04 2.7173 -9.6579 { ce1 tyr A 142 1sh8A_121Y_142}P -13.3609 3.9378 -10.5915 { ce2 tyr A 142 1sh8A_121Y_142}P -11.0776 3.2454 -10.9508 { oh tyr A 142 1sh8A_121Y_142}P -12.2745 4.397 -12.6685 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 121 A}'S' blue -10.7155 0.0909 -6.8257 {"}'S' sky -10.8759 0.0547 -7.023 {"}'S' sky -11.0366 -0.0237 -7.2076 {"}'S' blue -11.1917 -0.1424 -7.3755 {"}'S' sky -10.5906 0.153 -7.0724 {"}'S' sky -10.7514 0.1005 -7.2649 {"}'S' sky -10.9087 0.0107 -7.444 {"}'S' blue -10.4074 0.1833 -7.2578 {"}'S' sky -10.5713 0.1266 -7.4535 { CD1 TYR 121 A}'S' sky -11.3176 -0.0975 -7.6107 {"}'S' sky -10.9754 -0.0036 -7.4652 {"}'S' sky -10.7447 0.1125 -7.5165 {"}'S' sky -10.4976 0.1889 -7.5772 {"}'S' blue -10.3599 0.3167 -7.8249 {"}'S' sky -10.5023 0.3826 -8.0278 {"}'S' sky -10.6542 0.4098 -8.2314 {"}'S' blue -10.8119 0.3966 -8.4319 { CD2 TYR 121 A}'S' blue -11.5132 0.1413 -6.41 {"}'S' blue -11.1727 0.1531 -6.4019 {"}'S' sky -11.3349 0.1297 -6.6045 {"}'S' sky -11.4985 0.0682 -6.7987 {"}'S' blue -10.9642 0.1099 -6.5531 {"}'S' sky -11.1259 0.0869 -6.7569 {"}'S' sky -11.2891 0.0263 -6.9507 {"}'S' sky -11.4503 -0.0702 -7.1319 {"}'S' blue -11.2363 -0.1437 -7.2635 { CE1 TYR 121 A}'S' sky -12.076 0.5167 -8.4816 {"}'S' blue -12.2319 0.5222 -8.6857 {"}'S' sky -11.7974 0.5703 -8.5284 {"}'S' blue -11.9493 0.5975 -8.7319 {"}'S' blue -12.107 0.5844 -8.9325 {"}'S' blue -11.6056 0.6091 -8.7056 {"}'S' blue -11.7622 0.6321 -8.913 {"}'S' blue -11.9238 0.6146 -9.1179 {"}'S' sky -11.017 0.3435 -8.2986 {"}'S' sky -11.1394 0.4681 -8.4925 {"}'S' blue -11.2773 0.5591 -8.6949 {"}'S' blue -11.5833 0.6265 -9.1097 {"}'S' blue -11.3748 0.5833 -9.2609 {"}'S' blue -11.5365 0.5603 -9.4647 {"}'S' blue -11.1597 0.501 -9.389 { CE2 TYR 121 A}'S' blue -12.9941 0.2992 -6.7117 {"}'S' blue -12.4927 0.3239 -6.4848 {"}'S' blue -12.6493 0.3469 -6.6922 {"}'S' blue -12.8109 0.3295 -6.8971 {"}'S' blue -12.9748 0.2728 -7.0928 {"}'S' blue -12.1644 0.274 -6.4742 {"}'S' sky -12.3135 0.327 -6.6815 {"}'S' sky -12.4704 0.3413 -6.889 {"}'S' sky -12.6325 0.3179 -7.0915 {"}'S' sky -11.9556 0.2271 -6.6258 {"}'S' sky -11.7433 0.1349 -6.7538 {"}'S' sky -11.6038 -0.0616 -7.3232 { CZ TYR 121 A}'S' blue -13.2642 0.3296 -7.3509 {"}'S' blue -13.4172 0.3638 -7.5593 {"}'S' sky -12.8771 0.3251 -7.2088 {"}'S' sky -13.0125 0.4153 -7.4076 {"}'S' sky -13.1605 0.4651 -7.6126 {"}'S' blue -13.3163 0.4707 -7.8167 {"}'S' sky -13.0338 0.5459 -7.8629 {"}'S' blue -13.1914 0.5328 -8.0635 {"}'S' sky -12.2902 0.2647 -7.237 {"}'S' sky -13.0082 0.5631 -8.2489 {"}'S' blue -12.8299 0.5514 -8.4433 {"}'S' sky -12.4592 0.5317 -8.3919 {"}'S' sky -11.5857 -0.0269 -7.5371 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 121 A}'S' sea -11.1177 0.0668 -7.6672 {"}'S' sea -10.8846 0.1935 -7.7193 {"}'S' sea -11.0376 0.2277 -7.9277 {"}'S' sea -10.633 0.2791 -7.7761 {"}'S' sea -10.7809 0.329 -7.9811 {"}'S' sea -10.9368 0.3345 -8.1851 { CE1 TYR 121 A}'S' sea -11.5774 0.0837 -7.7167 {"}'S' green -11.6751 0.2476 -7.8894 {"}'S' green -11.7927 0.3767 -8.0778 {"}'S' sea -11.9281 0.4669 -8.2766 {"}'S' sea -11.321 0.0948 -7.779 {"}'S' green -11.4144 0.2637 -7.9468 {"}'S' green -11.527 0.4015 -8.1305 {"}'S' green -11.655 0.5045 -8.3255 {"}'S' green -11.2057 0.3162 -8.1059 {"}'S' green -11.3244 0.4499 -8.297 {"}'S' sea -11.4588 0.5483 -8.4979 { CE2 TYR 121 A}'S' sea -12.1042 0.2809 -6.8327 {"}'S' sea -12.2618 0.2981 -7.0401 {"}'S' sea -11.8909 0.1944 -6.9606 {"}'S' sea -12.0468 0.2159 -7.1683 {"}'S' sea -11.683 0.0688 -7.0716 {"}'S' sea -11.8349 0.0974 -7.2754 { CZ TYR 121 A}'S' sea -12.6115 0.3499 -7.2615 {"}'S' sea -12.7394 0.4529 -7.4565 {"}'S' sea -12.8819 0.5188 -7.6594 {"}'S' green -12.4089 0.3983 -7.428 {"}'S' green -12.5432 0.4967 -7.629 {"}'S' green -12.69 0.5575 -7.8366 {"}'S' sea -12.8466 0.5805 -8.044 {"}'S' green -12.1015 0.292 -7.4296 {"}'S' green -12.2238 0.4166 -7.6235 {"}'S' green -12.3617 0.5076 -7.826 {"}'S' green -12.5108 0.5606 -8.0333 {"}'S' sea -12.6677 0.5749 -8.2408 {"}'S' sea -11.7886 0.0857 -7.4026 {"}'S' green -11.8936 0.2435 -7.5821 {"}'S' green -12.0158 0.3698 -7.7746 {"}'S' green -12.1529 0.4607 -7.9776 {"}'S' sea -12.3016 0.5145 -8.1845 {"}'S' green -11.6867 0.138 -7.7127 {"}'S' green -11.8058 0.2709 -7.9041 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 142 A}'S' blue -12.8336 0.7545 -6.8988 {"}'S' blue -12.676 0.7677 -6.6982 {"}'S' blue -13.1309 0.8815 -7.7323 {"}'S' sky -13.0042 0.7645 -7.5358 {"}'S' sky -12.863 0.6845 -7.3314 {"}'S' sky -12.7111 0.6432 -7.1228 {"}'S' sky -12.5514 0.6402 -6.9158 {"}'S' sky -12.3884 0.677 -6.7152 {"}'S' sky -12.9741 0.8375 -7.9453 {"}'S' sky -12.2445 0.5787 -6.9317 {"}'S' blue -12.0816 0.6403 -6.7369 {"}'S' blue -12.878 0.9556 -8.2887 {"}'S' sky -12.6295 0.8953 -8.3796 {"}'S' blue -12.3753 0.8784 -8.4606 {"}'S' blue -12.1598 0.962 -8.5952 {"}'S' sky -12.0503 0.8159 -8.414 {"}'S' sky -11.8139 0.8986 -8.4891 {"}'S' blue -11.5755 1.0047 -8.5275 { CG TYR 142 A}'S' blue -12.1593 1.0502 -8.9856 {"}'S' blue -11.9999 1.0496 -8.7778 {"}'S' blue -11.9025 1.0799 -9.0754 {"}'S' blue -11.7449 1.0916 -8.8746 { CD2 TYR 142 A}'S' blue -11.4999 1.1045 -9.1578 {"}'S' blue -11.3551 1.0195 -9.3763 {"}'S' blue -11.193 1.043 -9.1738 {"}'S' blue -11.1563 0.9748 -9.5405 { HB2 TYR 142 A}'S' sky -11.8272 0.4506 -6.8295 {"}'S' blue -11.6691 0.5274 -6.6463 {"}'S' sky -11.445 0.4215 -6.7379 {"}'S' blue -11.2957 0.5575 -6.582 {"}'S' sky -11.4575 0.2465 -7.1372 {"}'S' sky -11.2989 0.311 -6.9505 {"}'S' sky -11.146 0.427 -6.785 {"}'S' sky -11.3567 0.2178 -7.4302 {"}'S' sky -11.1973 0.2482 -7.233 {"}'S' sky -11.0393 0.334 -7.052 {"}'S' blue -10.8892 0.4698 -6.8967 {"}'S' sky -10.8773 0.3564 -7.2595 {"}'S' blue -10.7268 0.4878 -7.1009 {"}'S' sky -11.3997 0.8491 -8.4398 {"}'S' sky -10.7777 0.4113 -7.5136 {"}'S' blue -10.6205 0.5297 -7.3428 {"}'S' sky -11.0971 0.7471 -8.3275 {"}'S' sky -10.9945 0.5943 -8.1524 {"}'S' blue -10.5449 0.6255 -7.5792 {"}'S' sky -10.7062 0.7145 -8.0439 {"}'S' blue -10.5427 0.7431 -7.8405 { HB3 TYR 142 A}'S' blue -13.1327 0.7491 -6.8705 {"}'S' blue -13.3207 0.8267 -7.5673 {"}'S' sky -13.1842 0.7454 -7.3673 {"}'S' blue -13.0318 0.7204 -7.1635 {"}'S' blue -12.8724 0.7508 -6.9663 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 142 A}'S' sea -12.8509 0.7128 -7.752 {"}'S' green -12.7134 0.6227 -7.5485 {"}'S' sea -12.5643 0.5697 -7.3412 {"}'S' sea -12.4066 0.5552 -7.1343 {"}'S' sea -12.7731 0.7979 -8.1092 {"}'S' green -12.6512 0.6725 -7.9158 {"}'S' green -12.5137 0.5807 -7.7137 {"}'S' green -12.3651 0.5269 -7.5069 {"}'S' sea -12.2078 0.5106 -7.2984 {"}'S' sea -12.5197 0.7462 -8.1954 {"}'S' green -12.3929 0.6306 -7.9992 {"}'S' green -12.2509 0.5522 -7.794 {"}'S' sea -12.2643 0.7392 -8.2772 {"}'S' sea -12.1352 0.6355 -8.0821 {"}'S' sea -11.9234 0.7072 -8.2191 { HB2 TYR 142 A}'S' sea -12.1319 0.4757 -7.2311 {"}'S' sea -11.9846 0.4327 -7.0286 {"}'S' green -12.0521 0.4118 -7.5193 {"}'S' sea -11.9148 0.3303 -7.3199 {"}'S' sea -11.7628 0.3046 -7.1166 {"}'S' sea -11.6034 0.335 -6.9193 {"}'S' green -11.9999 0.5112 -7.9115 {"}'S' green -11.8911 0.3705 -7.7324 {"}'S' green -11.7604 0.2762 -7.5374 {"}'S' sea -11.6131 0.2345 -7.3351 {"}'S' sea -11.8495 0.632 -8.1829 {"}'S' green -11.7618 0.4559 -8.0195 {"}'S' green -11.6456 0.3241 -7.834 {"}'S' sea -11.5091 0.2427 -7.634 {"}'S' sea -11.6425 0.7555 -8.3589 {"}'S' green -11.5714 0.5592 -8.2135 {"}'S' green -11.4689 0.4064 -8.0385 {"}'S' green -11.3404 0.3056 -7.8433 {"}'S' sea -11.1931 0.2626 -7.6407 {"}'S' sea -11.035 0.2803 -7.4423 {"}'S' sea -11.3353 0.6402 -8.2972 {"}'S' green -11.2316 0.4815 -8.1192 {"}'S' sea -11.0967 0.3866 -7.9183 {"}'S' sea -10.9409 0.3624 -7.7101 {"}'S' sea -10.8573 0.5193 -7.953 {"}'S' sea -10.701 0.5301 -7.7537 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 121 A}'M' greentint -9.5614 2.123 -6.2453 {"}'M' greentint -9.7246 2.0896 -6.4471 {"}'M' greentint -9.2796 2.2488 -6.1076 {"}'M' greentint -9.4174 2.3281 -6.3073 {"}'M' greentint -9.5754 2.3198 -6.5093 {"}'M' greentint -9.734 2.2266 -6.6877 {"}'M' greentint -9.8732 2.0587 -6.8208 {"}'M' greentint -9.0931 2.4199 -6.1721 {"}'M' greentint -9.2323 2.4982 -6.3733 {"}'M' greentint -9.3884 2.5089 -6.5771 {"}'M' greentint -9.5486 2.4507 -6.7691 {"}'M' greentint -9.7034 2.3276 -6.9338 {"}'M' greentint -9.8391 2.15 -7.0599 {"}'M' greentint -8.8573 2.5229 -6.2116 {"}'M' greentint -8.9923 2.6164 -6.4122 {"}'M' greentint -9.1452 2.6523 -6.6192 {"}'M' greentint -9.3057 2.6289 -6.8212 {"}'M' greentint -9.4677 2.5467 -7.0069 {"}'M' greentint -9.62 2.4108 -7.1669 {"}'M' greentint -9.7566 2.2292 -7.2917 {"}'M' greentint -8.7511 2.6933 -6.4864 {"}'M' greentint -8.8965 2.7437 -6.6881 {"}'M' greentint -9.0517 2.7428 -6.888 {"}'M' greentint -9.2108 2.6917 -7.0802 {"}'M' greentint -9.3666 2.593 -7.2535 {"}'M' greentint -9.5128 2.4494 -7.4034 {"}'M' greentint -8.7358 2.7994 -6.8946 {"}'M' greentint -8.8938 2.7869 -7.0959 {"}'M' greentint -9.0541 2.7262 -7.2856 {"}'M' greentint -9.2109 2.6203 -7.4587 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 142 A}'M' greentint -9.8636 1.9824 -6.7698 {"}'M' greentint -9.7145 1.958 -6.5708 {"}'M' greentint -9.5579 1.9955 -6.3789 {"}'M' greentint -9.403 2.0927 -6.2064 {"}'M' greentint -9.7415 2.0212 -7.0526 {"}'M' greentint -9.6015 1.9561 -6.8533 {"}'M' greentint -9.4472 1.9554 -6.6542 {"}'M' greentint -9.289 2.0191 -6.4679 {"}'M' greentint -9.1388 2.1436 -6.3081 {"}'M' greentint -9.0056 2.3192 -6.185 {"}'M' greentint -9.6506 2.2293 -7.3928 {"}'M' greentint -9.538 2.0874 -7.2083 {"}'M' greentint -9.3966 2.0144 -7.0052 {"}'M' greentint -9.2384 2.0166 -6.8015 {"}'M' greentint -9.0778 2.0926 -6.6146 {"}'M' greentint -8.9282 2.238 -6.4622 {"}'M' greentint -8.8037 2.4379 -6.3564 {"}'M' greentint -9.4096 2.3141 -7.4485 {"}'M' greentint -9.2935 2.1771 -7.2603 {"}'M' greentint -9.1447 2.1275 -7.0542 {"}'M' greentint -8.9824 2.1724 -6.8562 {"}'M' greentint -8.8282 2.305 -6.6945 {"}'M' greentint -8.7039 2.5083 -6.5899 {"}'M' greentint -9.1655 2.4127 -7.4228 {"}'M' greentint -9.0337 2.3109 -7.2246 {"}'M' greentint -8.8728 2.339 -7.0246 {"}'M' greentint -8.7247 2.4909 -6.8758 {"}'M' greentint -8.6299 2.7251 -6.8184 {"}'M' greentint -9.0045 2.6839 -7.456 {"}'M' greentint -8.9003 2.5288 -7.2781 {"}'M' greentint -8.7403 2.6257 -7.0987 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 121 A}'M' green -10.3649 0.8175 -4.8941 {"}'M' green -10.3366 0.915 -5.1477 {"}'M' green -9.3933 1.5865 -4.8592 {"}'M' green -9.856 1.399 -5.4045 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 121 A}'M' greentint -10.0946 1.0138 -4.4344 {"}'M' greentint -10.2545 0.9169 -4.6138 {"}'M' greentint -9.8293 1.1299 -4.2898 {"}'M' greentint -9.9611 1.2317 -4.4879 {"}'M' greentint -10.1221 1.2036 -4.6879 {"}'M' greentint -10.2701 1.0517 -4.8368 {"}'M' greentint -9.6378 1.3067 -4.3537 {"}'M' greentint -9.7726 1.4015 -4.5546 {"}'M' greentint -9.9315 1.4047 -4.7605 {"}'M' greentint -10.0918 1.3136 -4.9433 {"}'M' greentint -10.2332 1.1431 -5.0789 {"}'M' greentint -9.5241 1.5007 -4.6049 {"}'M' greentint -9.6758 1.5362 -4.81 {"}'M' greentint -9.8371 1.4971 -5.0079 {"}'M' greentint -9.9937 1.385 -5.1793 {"}'M' greentint -10.1323 1.2103 -5.3101 {"}'M' greentint -9.5476 1.5872 -5.0583 {"}'M' greentint -9.7058 1.5235 -5.2446 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 142 A}'M' green -9.8607 1.0157 -4.2057 {"}'M' green -10.3711 0.9673 -5.2153 {"}'M' green -10.0131 1.2935 -5.419 {"}'M' green -9.4275 1.6075 -4.9398 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 142 A}'M' greentint -10.3285 0.7971 -4.7491 {"}'M' greentint -10.1705 0.821 -4.5523 {"}'M' greentint -10.0125 0.895 -4.3685 {"}'M' greentint -10.2249 0.904 -5.0095 {"}'M' greentint -10.0677 0.8994 -4.8039 {"}'M' greentint -9.9051 0.9551 -4.6097 {"}'M' greentint -9.7472 1.0653 -4.4363 {"}'M' greentint -9.6019 1.2271 -4.2933 {"}'M' greentint -10.1413 1.0818 -5.2674 {"}'M' greentint -9.9933 1.0348 -5.063 {"}'M' greentint -9.8341 1.0572 -4.8625 {"}'M' greentint -9.6744 1.1458 -4.6815 {"}'M' greentint -9.5277 1.2954 -4.5339 {"}'M' greentint -9.8747 1.2167 -5.2175 {"}'M' greentint -9.7159 1.2277 -5.0166 {"}'M' greentint -9.5588 1.3236 -4.8392 {"}'M' greentint -9.4204 1.4942 -4.7077 {"}'M' greentint -9.7404 1.4246 -5.2932 {"}'M' greentint -9.5772 1.4538 -5.0906 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 67 1sn2A_95F_69Y}P -7.9179 5.1848 -12.4766 {"}-7.9179 5.1848 -12.4766 { ca gly A 67 1sn2A_95F_69Y}-8.1123 6.0333 -11.3176 { c gly A 67 1sn2A_95F_69Y}-8.0988 5.1954 -10.0604 { o gly A 67 1sn2A_95F_69Y}-7.9186 3.9792 -10.1261 { c gly A 67 1sn2A_95F_69Y}P -8.0988 5.1954 -10.0604 { n val A 68 1sn2A_95F_69Y}-8.2743 5.8467 -8.9178 { ca val A 68 1sn2A_95F_69Y}-8.3269 5.1378 -7.6471 { c val A 68 1sn2A_95F_69Y}-9.7956 4.9278 -7.3064 { o val A 68 1sn2A_95F_69Y}-10.6028 5.8587 -7.3645 { c val A 68 1sn2A_95F_69Y}P -9.7956 4.9278 -7.3064 { n tyr A 69 1sn2A_95F_69Y}-10.1374 3.6954 -6.9541 { ca tyr A 69 1sn2A_95F_69Y}-11.5011 3.3609 -6.5935 { c tyr A 69 1sn2A_95F_69Y}-11.5218 2.7146 -5.2303 { o tyr A 69 1sn2A_95F_69Y}-10.5288 2.1353 -4.7798 { c tyr A 69 1sn2A_95F_69Y}P -11.5218 2.7146 -5.2303 { n arg A 70 1sn2A_95F_69Y}-12.6769 2.8181 -4.5923 { ca arg A 70 1sn2A_95F_69Y}-12.9265 2.2279 -3.2984 { c arg A 70 1sn2A_95F_69Y}-14.2495 1.4899 -3.3762 { o arg A 70 1sn2A_95F_69Y}-15.2566 2.0587 -3.7855 { c arg A 70 1sn2A_95F_69Y}P -14.2495 1.4899 -3.3762 { n val A 71 1sn2A_95F_69Y}-14.2405 0.2182 -3.007 { ca val A 71 1sn2A_95F_69Y}-15.4601 -0.5504 -2.9674 { c val A 71 1sn2A_95F_69Y}-15.658 -0.8581 -1.4964 { o val A 71 1sn2A_95F_69Y}-14.7902 -1.4551 -0.8575 { n val A 93 1sn2A_95F_69Y}P -12.1212 -2.0482 0.0206 {"}-12.1212 -2.0482 0.0206 { ca val A 93 1sn2A_95F_69Y}-11.1476 -2.4858 -0.9737 { c val A 93 1sn2A_95F_69Y}-10.8218 -1.2678 -1.8282 { o val A 93 1sn2A_95F_69Y}-11.6798 -0.7889 -2.5804 { c val A 93 1sn2A_95F_69Y}P -10.8218 -1.2678 -1.8282 { n val A 94 1sn2A_95F_69Y}-9.5922 -0.7876 -1.7046 { ca val A 94 1sn2A_95F_69Y}-9.1385 0.4482 -2.3458 { c val A 94 1sn2A_95F_69Y}-8.0012 0.1002 -3.2752 { o val A 94 1sn2A_95F_69Y}-7.0032 -0.4864 -2.8282 { c val A 94 1sn2A_95F_69Y}P -8.0012 0.1002 -3.2752 { n phe A 95 1sn2A_95F_69Y}-8.1608 0.4366 -4.5492 { ca phe A 95 1sn2A_95F_69Y}-7.1685 0.0973 -5.5661 { c phe A 95 1sn2A_95F_69Y}-7.0998 1.0889 -6.717 { o phe A 95 1sn2A_95F_69Y}-8.0685 1.765 -7.0247 { c phe A 95 1sn2A_95F_69Y}P -7.0998 1.0889 -6.717 { n asp A 96 1sn2A_95F_69Y}-5.9359 1.1525 -7.3536 { ca asp A 96 1sn2A_95F_69Y}-5.7735 1.9436 -8.553 { c asp A 96 1sn2A_95F_69Y}-6.1875 1.0365 -9.6808 { o asp A 96 1sn2A_95F_69Y}-5.6057 -0.0349 -9.8714 { c asp A 96 1sn2A_95F_69Y}P -6.1875 1.0365 -9.6808 { n ala A 97 1sn2A_95F_69Y}-7.1787 1.4502 -10.448 { ca ala A 97 1sn2A_95F_69Y}-7.6494 0.6271 -11.5477 { c ala A 97 1sn2A_95F_69Y}-6.9046 0.9594 -12.8271 { o ala A 97 1sn2A_95F_69Y}-6.6789 2.1255 -13.1402 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 67 1sn2A_95F_69Y}P -7.9179 5.1848 -12.4766 { ca gly A 67 1sn2A_95F_69Y}P -8.1123 6.0333 -11.3176 {"}P -8.1123 6.0333 -11.3176 { n val A 68 1sn2A_95F_69Y}P -8.2743 5.8467 -8.9178 { ca val A 68 1sn2A_95F_69Y}P -8.3269 5.1378 -7.6471 { n tyr A 69 1sn2A_95F_69Y}P -10.1374 3.6954 -6.9541 { ca tyr A 69 1sn2A_95F_69Y}P -11.5011 3.3609 -6.5935 { n arg A 70 1sn2A_95F_69Y}P -12.6769 2.8181 -4.5923 { ca arg A 70 1sn2A_95F_69Y}P -12.9265 2.2279 -3.2984 { n val A 71 1sn2A_95F_69Y}P -14.2405 0.2182 -3.007 { ca val A 71 1sn2A_95F_69Y}P -15.4601 -0.5504 -2.9674 { n val A 93 1sn2A_95F_69Y}P -12.1212 -2.0482 0.0206 { ca val A 93 1sn2A_95F_69Y}P -11.1476 -2.4858 -0.9737 { n val A 94 1sn2A_95F_69Y}P -9.5922 -0.7876 -1.7046 { ca val A 94 1sn2A_95F_69Y}P -9.1385 0.4482 -2.3458 { n phe A 95 1sn2A_95F_69Y}P -8.1608 0.4366 -4.5492 { ca phe A 95 1sn2A_95F_69Y}P -7.1685 0.0973 -5.5661 { n asp A 96 1sn2A_95F_69Y}P -5.9359 1.1525 -7.3536 { ca asp A 96 1sn2A_95F_69Y}P -5.7735 1.9436 -8.553 { n ala A 97 1sn2A_95F_69Y}P -7.1787 1.4502 -10.448 { ca ala A 97 1sn2A_95F_69Y}P -7.6494 0.6271 -11.5477 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 67 1sn2A_95F_69Y}P -8.1123 6.0333 -11.3176 {"}-8.1123 6.0333 -11.3176 { ca val A 68 1sn2A_95F_69Y}-8.3269 5.1378 -7.6471 { ca tyr A 69 1sn2A_95F_69Y}-11.5011 3.3609 -6.5935 { ca arg A 70 1sn2A_95F_69Y}-12.9265 2.2279 -3.2984 { ca val A 71 1sn2A_95F_69Y}-15.4601 -0.5504 -2.9674 { ca val A 93 1sn2A_95F_69Y}P -11.1476 -2.4858 -0.9737 {"}-11.1476 -2.4858 -0.9737 { ca val A 94 1sn2A_95F_69Y}-9.1385 0.4482 -2.3458 { ca phe A 95 1sn2A_95F_69Y}-7.1685 0.0973 -5.5661 { ca asp A 96 1sn2A_95F_69Y}-5.7735 1.9436 -8.553 { ca ala A 97 1sn2A_95F_69Y}-7.6494 0.6271 -11.5477 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 69 1sn2A_95F_69Y}P -11.5011 3.3609 -6.5935 { cb tyr A 69 1sn2A_95F_69Y}-12.0997 2.3998 -7.6007 { cg tyr A 69 1sn2A_95F_69Y}-12.262 3.0056 -8.9776 { cd1 tyr A 69 1sn2A_95F_69Y}-11.1777 3.1522 -9.8274 { ce1 tyr A 69 1sn2A_95F_69Y}-11.3257 3.7052 -11.089 { cz tyr A 69 1sn2A_95F_69Y}-12.5761 4.1331 -11.4961 { oh tyr A 69 1sn2A_95F_69Y}-12.7652 4.6998 -12.7332 { cg tyr A 69 1sn2A_95F_69Y}P -12.262 3.0056 -8.9776 { cd2 tyr A 69 1sn2A_95F_69Y}-13.4912 3.4574 -9.4039 { ce2 tyr A 69 1sn2A_95F_69Y}-13.6545 4.0211 -10.6529 { cz tyr A 69 1sn2A_95F_69Y}ghost -12.5761 4.1331 -11.4961 { ca phe A 95 1sn2A_95F_69Y}P -7.1685 0.0973 -5.5661 { cb phe A 95 1sn2A_95F_69Y}-7.4616 -1.2937 -6.1379 { cg phe A 95 1sn2A_95F_69Y}-8.7738 -1.3962 -6.8861 { cd1 phe A 95 1sn2A_95F_69Y}-8.7903 -1.5369 -8.2555 { ce1 phe A 95 1sn2A_95F_69Y}-9.9782 -1.6409 -8.9429 { cz phe A 95 1sn2A_95F_69Y}-11.1573 -1.6081 -8.2669 { cg phe A 95 1sn2A_95F_69Y}P -8.7738 -1.3962 -6.8861 { cd2 phe A 95 1sn2A_95F_69Y}-9.9805 -1.366 -6.2165 { ce2 phe A 95 1sn2A_95F_69Y}-11.1644 -1.4718 -6.9048 { cz phe A 95 1sn2A_95F_69Y}ghost -11.1573 -1.6081 -8.2669 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 69 1sn2A_95F_69Y}P -12.0997 2.3998 -7.6007 {"}P -12.0997 2.3998 -7.6007 { cd1 tyr A 69 1sn2A_95F_69Y}P -11.1777 3.1522 -9.8274 { cd2 tyr A 69 1sn2A_95F_69Y}P -13.4912 3.4574 -9.4039 { ce1 tyr A 69 1sn2A_95F_69Y}P -11.3257 3.7052 -11.089 { ce2 tyr A 69 1sn2A_95F_69Y}P -13.6545 4.0211 -10.6529 { oh tyr A 69 1sn2A_95F_69Y}P -12.7652 4.6998 -12.7332 { cb phe A 95 1sn2A_95F_69Y}P -7.4616 -1.2937 -6.1379 {"}P -7.4616 -1.2937 -6.1379 { cd1 phe A 95 1sn2A_95F_69Y}P -8.7903 -1.5369 -8.2555 { cd2 phe A 95 1sn2A_95F_69Y}P -9.9805 -1.366 -6.2165 { ce1 phe A 95 1sn2A_95F_69Y}P -9.9782 -1.6409 -8.9429 { ce2 phe A 95 1sn2A_95F_69Y}P -11.1644 -1.4718 -6.9048 { cz phe A 95 1sn2A_95F_69Y}P -11.1573 -1.6081 -8.2669 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 95 A}'S' blue -11.5765 0.2283 -6.8513 {"}'S' sky -11.7373 0.1757 -7.0437 {"}'S' blue -11.8946 0.086 -7.2228 {"}'S' sky -11.2317 0.276 -6.8318 {"}'S' sky -11.7183 0.1082 -7.4141 {"}'S' blue -11.8737 -0.0216 -7.5799 {"}'S' sky -11.0527 0.2704 -7.0285 {"}'S' sky -11.5393 0.087 -7.6056 {"}'S' sky -10.8442 0.2272 -7.1797 {"}'S' blue -10.7908 0.1261 -7.5125 {"}'S' blue -10.9542 0.0689 -7.7075 { CZ PHE 95 A}'S' sky -11.5383 0.0242 -7.7625 {"}'S' blue -11.6942 0.0298 -7.9666 {"}'S' sky -11.2598 0.0779 -7.8093 {"}'S' sky -11.4117 0.1051 -8.0128 {"}'S' sky -11.5693 0.0919 -8.2134 {"}'S' blue -10.9211 0.0559 -7.7788 {"}'S' sky -11.0679 0.1167 -7.9865 {"}'S' sky -11.2245 0.1396 -8.1939 {"}'S' blue -11.3861 0.1222 -8.3988 {"}'S' blue -10.8887 0.1197 -8.1832 {"}'S' blue -11.0456 0.134 -8.3906 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 95 A}'S' sea -11.3932 0.2586 -7.0367 {"}'S' sea -11.5571 0.2019 -7.2324 {"}'S' sea -11.2149 0.2469 -7.2311 {"}'S' sea -11.3785 0.1855 -7.4253 {"}'S' sea -11.006 0.2042 -7.3835 {"}'S' sea -11.1691 0.1435 -7.5773 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 69 A}'S' sky -11.8069 0.4264 -7.3892 {"}'S' sky -11.6475 0.4569 -7.1919 {"}'S' sky -11.4891 0.5434 -7.0105 {"}'S' blue -11.3398 0.6794 -6.8546 {"}'S' blue -11.8044 0.398 -7.81 {"}'S' sky -11.6571 0.3564 -7.6077 {"}'S' sky -11.19 0.5489 -7.0576 {"}'S' blue -11.6897 0.446 -8.1066 {"}'S' sky -11.5531 0.3646 -7.9066 {"}'S' sky -10.9333 0.5917 -7.1693 {"}'S' blue -11.5129 0.5283 -8.3111 {"}'S' sky -11.3845 0.4275 -8.1159 {"}'S' sky -11.2372 0.3844 -7.9133 {"}'S' sky -11.079 0.4022 -7.7149 {"}'S' sky -10.9213 0.4782 -7.5321 {"}'S' blue -11.1408 0.5085 -8.1909 {"}'S' blue -10.985 0.4843 -7.9827 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 69 A}'S' sea -11.5016 0.3684 -7.4098 {"}'S' sea -11.343 0.4328 -7.2231 {"}'S' sea -11.4008 0.3396 -7.7028 {"}'S' sea -11.2414 0.3701 -7.5056 {"}'S' sea -11.0834 0.4558 -7.3246 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 95 A}'M' greentint -9.2406 2.1575 -6.3683 {"}'M' greentint -9.3842 2.0497 -6.6408 {"}'M' greentint -8.9786 2.4787 -6.2357 {"}'M' greentint -9.1419 2.4453 -6.4376 {"}'M' greentint -9.2905 2.2884 -6.5861 {"}'M' greentint -9.3942 2.1921 -6.8835 {"}'M' greentint -9.4507 1.9426 -6.8868 {"}'M' greentint -8.8347 2.6838 -6.2977 {"}'M' greentint -8.9926 2.6755 -6.4997 {"}'M' greentint -9.1512 2.5823 -6.6781 {"}'M' greentint -9.2905 2.4144 -6.8113 {"}'M' greentint -9.3638 2.2861 -7.1283 {"}'M' greentint -9.435 2.041 -7.1525 {"}'M' greentint -8.8057 2.8646 -6.5676 {"}'M' greentint -8.9658 2.8063 -6.7596 {"}'M' greentint -9.1206 2.6833 -6.9242 {"}'M' greentint -9.2564 2.5057 -7.0504 {"}'M' greentint -9.2859 2.3663 -7.3666 {"}'M' greentint -9.3671 2.1231 -7.405 {"}'M' greentint -8.5624 3.008 -6.6096 {"}'M' greentint -8.7229 2.9846 -6.8117 {"}'M' greentint -8.885 2.9024 -6.9973 {"}'M' greentint -9.0372 2.7664 -7.1573 {"}'M' greentint -9.1739 2.5849 -7.2821 {"}'M' greentint -9.1714 2.411 -7.5963 {"}'M' greentint -8.6281 3.0474 -7.0707 {"}'M' greentint -8.7839 2.9487 -7.244 {"}'M' greentint -8.93 2.8051 -7.3939 {"}'M' greentint -9.0608 2.6231 -7.5123 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 69 A}'M' greentint -9.1608 2.228 -6.2839 {"}'M' greentint -9.3463 1.9399 -6.8734 {"}'M' greentint -9.1881 2.0036 -6.6871 {"}'M' greentint -9.0379 2.1281 -6.5272 {"}'M' greentint -8.9048 2.3037 -6.4041 {"}'M' greentint -8.7995 2.5183 -6.3264 {"}'M' greentint -8.726 2.7581 -6.2995 {"}'M' greentint -9.2957 1.9989 -7.2244 {"}'M' greentint -9.1376 2.0011 -7.0206 {"}'M' greentint -8.9769 2.0771 -6.8338 {"}'M' greentint -8.8274 2.2225 -6.6814 {"}'M' greentint -8.7028 2.4224 -6.5756 {"}'M' greentint -8.6142 2.66 -6.5275 {"}'M' greentint -8.5697 2.9148 -6.5402 {"}'M' greentint -9.1926 2.1616 -7.4794 {"}'M' greentint -9.0439 2.112 -7.2733 {"}'M' greentint -8.8815 2.1569 -7.0754 {"}'M' greentint -8.7273 2.2895 -6.9137 {"}'M' greentint -8.6031 2.4928 -6.809 {"}'M' greentint -8.5248 2.7385 -6.7769 {"}'M' greentint -8.5038 2.9939 -6.8202 {"}'M' greentint -9.0646 2.3972 -7.6419 {"}'M' greentint -8.9329 2.2954 -7.4438 {"}'M' greentint -8.7719 2.3235 -7.2438 {"}'M' greentint -8.6238 2.4754 -7.0949 {"}'M' greentint -8.529 2.7096 -7.0376 {"}'M' greentint -8.5127 2.9633 -7.0869 {"}'M' greentint -8.9036 2.6685 -7.6751 {"}'M' greentint -8.7994 2.5133 -7.4973 {"}'M' greentint -8.6394 2.6102 -7.3179 {"}'M' greentint -8.5844 2.8635 -7.3176 {"}'M' greentint -8.7177 2.7598 -7.5171 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 95 A}'M' greentint -9.7335 1.1039 -4.2946 {"}'M' greentint -9.8667 1.0003 -4.4941 {"}'M' greentint -9.6518 1.3505 -4.3145 {"}'M' greentint -9.8118 1.2536 -4.4939 {"}'M' greentint -9.9221 1.1542 -4.7742 {"}'M' greentint -9.9384 0.9005 -4.7249 {"}'M' greentint -9.5183 1.5683 -4.368 {"}'M' greentint -9.6793 1.5403 -4.568 {"}'M' greentint -9.8273 1.3883 -4.7168 {"}'M' greentint -9.8939 1.2516 -5.0278 {"}'M' greentint -9.9443 0.997 -5.0232 {"}'M' greentint -9.3299 1.7382 -4.4346 {"}'M' greentint -9.4888 1.7414 -4.6405 {"}'M' greentint -9.649 1.6503 -4.8234 {"}'M' greentint -9.7904 1.4798 -4.959 {"}'M' greentint -9.797 1.3259 -5.2678 {"}'M' greentint -9.8653 1.0769 -5.2855 {"}'M' greentint -9.233 1.8729 -4.6901 {"}'M' greentint -9.3943 1.8337 -4.888 {"}'M' greentint -9.5509 1.7217 -5.0594 {"}'M' greentint -9.6895 1.547 -5.1901 {"}'M' greentint -9.6516 1.3454 -5.4854 {"}'M' greentint -9.263 1.8601 -5.1247 {"}'M' greentint -9.4133 1.7357 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{"}'M' greentint -9.5783 1.114 -5.0949 {"}'M' greentint -9.4186 1.2025 -4.9139 {"}'M' greentint -9.2719 1.3521 -4.7663 {"}'M' greentint -9.1482 1.5519 -4.6616 {"}'M' greentint -9.0563 1.7861 -4.6083 {"}'M' greentint -9.0044 2.0369 -4.6099 {"}'M' greentint -9.4601 1.2845 -5.249 {"}'M' greentint -9.303 1.3803 -5.0716 {"}'M' greentint -9.1646 1.5509 -4.9401 {"}'M' greentint -9.0617 1.7744 -4.8692 {"}'M' greentint -9.0072 2.0241 -4.8689 {"}'M' greentint -9.3214 1.5105 -5.323 {"}'M' greentint -9.1717 1.6642 -5.1722 {"}'M' greentint -9.0764 1.9005 -5.1147 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n cys A 352 1so7A_354Y_363}P -12.2886 -2.0722 0.0281 {"}-12.2886 -2.0722 0.0281 { ca cys A 352 1so7A_354Y_363}-11.0848 -2.2635 -0.7745 { c cys A 352 1so7A_354Y_363}-10.8201 -1.0144 -1.595 { o cys A 352 1so7A_354Y_363}-11.7194 -0.4766 -2.2325 { c cys A 352 1so7A_354Y_363}P -10.8201 -1.0144 -1.595 { n leu A 353 1so7A_354Y_363}-9.5784 -0.5538 -1.558 { ca 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-7.4457 {"}'S' -11.6114 0.1493 -7.4278 {"}'S' P -11.7778 0.1868 -7.6399 {"}'S' -11.7708 0.1301 -7.6224 {"}'S' P -11.086 0.2112 -7.1869 {"}'S' -11.0933 0.1857 -7.186 {"}'S' P -11.2436 0.2285 -7.3943 {"}'S' -11.2593 0.1409 -7.3803 {"}'S' P -11.4053 0.2055 -7.5982 {"}'S' -11.4149 0.1067 -7.5699 {"}'S' P -11.0285 0.1462 -7.5225 {"}'S' -11.0397 0.1114 -7.5144 {"}'S' P -11.1901 0.1274 -7.7271 {"}'S' -11.202 0.0781 -7.7081 { CZ TYR 354 A}'S' P -11.7072 0.1624 -7.7925 {"}'S' -11.6993 0.1109 -7.816 {"}'S' P -11.8552 0.2122 -7.9975 {"}'S' -11.8478 0.1823 -8.0062 {"}'S' P -11.4342 0.2 -7.8414 {"}'S' -11.4362 0.1127 -7.8772 {"}'S' P -11.5766 0.2659 -8.0443 {"}'S' -11.5718 0.1793 -8.0675 {"}'S' P -11.7285 0.293 -8.2478 {"}'S' -11.7233 0.2573 -8.253 {"}'S' P -11.1036 0.1454 -7.8129 {"}'S' -11.1136 0.1018 -7.832 {"}'S' P -11.2379 0.2438 -8.0138 {"}'S' -11.2494 0.1618 -8.0381 {"}'S' P -11.3847 0.3046 -8.2215 {"}'S' -11.389 0.232 -8.233 {"}'S' P -11.5414 0.3276 -8.4289 {"}'S' -11.5407 0.3123 -8.4295 {"}'S' P -10.9185 0.1636 -8.0084 {"}'S' -10.9195 0.1607 -8.009 {"}'S' P -11.0564 0.2547 -8.2108 {"}'S' -11.0627 0.2274 -8.2149 {"}'S' P -11.2055 0.3077 -8.4182 {"}'S' -11.2062 0.2996 -8.419 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 354 A}'S' blue -13.3866 -0.4579 -8.5364 {"}'S' blue -13.5446 -0.4662 -8.7385 {"}'S' blue -13.0623 -0.3661 -8.4012 {"}'S' sky -13.2015 -0.2878 -8.6024 {"}'S' sky -13.3576 -0.2771 -8.8063 {"}'S' blue -13.5178 -0.3354 -8.9983 {"}'S' sky -12.9614 -0.1696 -8.6414 {"}'S' sky -13.1143 -0.1337 -8.8484 {"}'S' sky -13.2748 -0.1571 -9.0504 {"}'S' blue -13.4369 -0.2393 -9.2361 {"}'S' blue -12.7203 -0.0927 -8.7156 {"}'S' blue -12.8657 -0.0423 -8.9172 {"}'S' blue -13.0209 -0.0432 -9.1172 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 363 A}'S' blue -12.286 0.5174 -7.0377 {"}'S' blue -12.1224 0.593 -6.8485 {"}'S' sky -12.3042 0.3956 -7.4569 {"}'S' sky -12.2627 0.3673 -7.8294 {"}'S' sky -12.2905 0.471 -8.3218 {"}'S' blue -12.1619 0.5796 -8.5997 {"}'S' blue -11.9479 0.6563 -8.7366 { CG1 VAL 363 A}'S' blue -13.1412 0.0213 -7.2988 {"}'S' blue -12.9785 0.0971 -7.109 {"}'S' blue -12.8201 0.2109 -6.9357 {"}'S' blue -12.6689 0.358 -6.7813 {"}'S' blue -13.05 0.0253 -7.5954 {"}'S' sky -12.8897 0.0757 -7.4031 {"}'S' sky -12.7316 0.1642 -7.2226 {"}'S' sky -12.5792 0.2885 -7.0599 {"}'S' blue -12.4357 0.4456 -6.9184 {"}'S' blue -12.9946 0.0849 -7.9314 {"}'S' blue -12.8355 0.1017 -7.7298 {"}'S' sky -12.6741 0.1606 -7.538 {"}'S' sky -12.3652 0.398 -7.2058 {"}'S' blue -12.9021 0.2071 -8.2038 {"}'S' blue -12.7444 0.1955 -7.9974 {"}'S' sky -12.5822 0.2334 -7.7982 {"}'S' sky -12.4209 0.3185 -7.6124 {"}'S' blue -12.6584 0.3393 -8.2443 {"}'S' sky -12.5 0.3512 -8.0424 { HB VAL 363 A}'S' blue -10.87 0.5653 -6.8188 {"}'S' sky -10.7401 0.4304 -7.0445 {"}'S' blue -10.5791 0.4474 -7.2503 {"}'S' blue -10.8247 0.5979 -8.5158 {"}'S' blue -10.6913 0.4951 -8.3151 {HG11 VAL 363 A}'S' blue -13.6983 -0.0541 -8.7675 {"}'S' sky -13.551 -0.0971 -8.5649 {"}'S' blue -13.3933 -0.0801 -8.3669 {"}'S' blue -13.5895 0.1218 -9.0434 {"}'S' sky -13.4546 0.027 -8.8425 {"}'S' sky -13.2988 0.0027 -8.6343 {"}'S' sky -13.1355 0.0517 -8.4377 {"}'S' blue -12.9783 0.1701 -8.267 {"}'S' blue -13.3523 0.2347 -9.0766 {"}'S' sky -13.2152 0.1596 -8.8771 {"}'S' sky -13.0589 0.1704 -8.6779 {"}'S' blue -12.9027 0.2658 -8.5034 {"}'S' blue -13.0641 0.3548 -8.968 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 363 A}'S' sea -12.0327 0.476 -8.4047 { CG1 VAL 363 A}'S' sea -12.5161 0.2606 -7.362 { HB VAL 363 A}'S' green -12.1169 0.2564 -7.5024 {"}'S' green -11.6541 0.308 -6.9175 {"}'S' green -12.0372 0.1925 -7.7906 {"}'S' green -11.2807 0.3382 -6.8532 {"}'S' green -11.9849 0.2919 -8.1828 {"}'S' green -11.8345 0.4126 -8.4542 {"}'S' green -10.8742 0.2504 -7.1679 {"}'S' green -11.5565 0.3398 -8.4848 {"}'S' green -10.8623 0.137 -7.5307 {"}'S' green -11.3203 0.4209 -8.5684 {"}'S' sea -10.7627 0.192 -7.7848 {"}'S' green 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-8.1053 {"}'S' -11.6152 0.1807 -8.0742 {"}'S' P -11.4941 0.0234 -7.9052 {"}'S' -11.4862 0.1153 -7.8863 {"}'S' P -11.3417 -0.0016 -7.7015 {"}'S' -11.3461 0.0759 -7.6995 {"}'S' P -11.1823 0.0289 -7.5043 {"}'S' -11.1969 0.1042 -7.5157 {"}'S' P -11.0243 0.1146 -7.3233 {"}'S' -11.0342 0.1433 -7.3331 {"}'S' P -11.4539 0.187 -8.3097 {"}'S' -11.4509 0.242 -8.2737 {"}'S' P -11.3255 0.0863 -8.1146 {"}'S' -11.3312 0.173 -8.079 {"}'S' P -11.1782 0.0432 -7.912 {"}'S' -11.1919 0.1126 -7.8971 {"}'S' P -11.02 0.061 -7.7135 {"}'S' -11.0234 0.0704 -7.7135 {"}'S' P -11.2166 0.2621 -8.3905 {"}'S' -11.2199 0.2792 -8.3766 {"}'S' P -11.0817 0.1673 -8.1896 {"}'S' -11.0928 0.2036 -8.1702 {"}'S' P -10.926 0.143 -7.9814 {"}'S' -10.929 0.1491 -7.9801 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 354 A}'M' greentint -9.2311 1.9724 -6.4584 {"}'M' greentint -9.3747 1.8647 -6.7309 {"}'M' greentint -9.1324 2.2603 -6.5277 {"}'M' greentint -9.281 2.1034 -6.6761 {"}'M' greentint -9.3847 2.0071 -6.9736 {"}'M' greentint -9.4413 1.7576 -6.9769 {"}'M' greentint -8.9832 2.4905 -6.5898 {"}'M' greentint -9.1418 2.3973 -6.7682 {"}'M' greentint -9.281 2.2293 -6.9014 {"}'M' greentint -9.3543 2.1011 -7.2184 {"}'M' greentint -9.4255 1.856 -7.2426 {"}'M' greentint -8.7962 2.6796 -6.6577 {"}'M' greentint -8.9564 2.6213 -6.8497 {"}'M' greentint -9.1112 2.4983 -7.0143 {"}'M' greentint -9.2469 2.3207 -7.1405 {"}'M' greentint -9.2765 2.1813 -7.4567 {"}'M' greentint -9.3577 1.9381 -7.4951 {"}'M' greentint -8.713 2.799 -6.9011 {"}'M' greentint -8.8755 2.7174 -7.0874 {"}'M' greentint -9.0278 2.5814 -7.2474 {"}'M' greentint -9.1644 2.3999 -7.3722 {"}'M' greentint -9.162 2.226 -7.6863 {"}'M' greentint -9.2475 1.9912 -7.7309 {"}'M' greentint -8.6186 2.8624 -7.1607 {"}'M' greentint -8.7744 2.7636 -7.3341 {"}'M' greentint -8.9206 2.6201 -7.484 {"}'M' greentint -9.0514 2.4381 -7.6024 {"}'M' greentint -8.7654 2.6438 -7.6891 {"}'M' greentint -8.8975 2.4609 -7.8091 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 363 A}'M' greentint -9.2057 1.929 -6.4445 {"}'M' greentint -9.0851 2.1232 -6.3428 {"}'M' greentint -9.3912 1.641 -7.0339 {"}'M' greentint -9.233 1.7047 -6.8476 {"}'M' greentint -9.0828 1.8291 -6.6878 {"}'M' greentint -8.9497 2.0047 -6.5647 {"}'M' greentint -8.8444 2.2194 -6.487 {"}'M' greentint -8.7709 2.4592 -6.4601 {"}'M' greentint -9.3406 1.6999 -7.385 {"}'M' greentint -9.1824 1.7022 -7.1812 {"}'M' greentint -9.0218 1.7781 -6.9944 {"}'M' greentint -8.8722 1.9235 -6.842 {"}'M' greentint -8.7477 2.1235 -6.7361 {"}'M' greentint -8.6591 2.3611 -6.6881 {"}'M' greentint -8.6146 2.6158 -6.7008 {"}'M' greentint -9.2375 1.8626 -7.64 {"}'M' greentint -9.0887 1.813 -7.4339 {"}'M' greentint -8.9264 1.8579 -7.2359 {"}'M' greentint -8.7722 1.9905 -7.0742 {"}'M' greentint -8.6479 2.1938 -6.9696 {"}'M' greentint -8.5697 2.4395 -6.9375 {"}'M' greentint -8.5487 2.6949 -6.9808 {"}'M' greentint -9.1095 2.0982 -7.8025 {"}'M' greentint -8.9778 1.9965 -7.6043 {"}'M' greentint -8.8168 2.0245 -7.4044 {"}'M' greentint -8.6687 2.1765 -7.2555 {"}'M' greentint -8.5739 2.4106 -7.1982 {"}'M' greentint -8.5576 2.6643 -7.2475 {"}'M' greentint -8.9485 2.3695 -7.8357 {"}'M' greentint -8.8443 2.2143 -7.6579 {"}'M' greentint -8.6843 2.3112 -7.4784 {"}'M' greentint -8.6293 2.5645 -7.4782 {"}'M' greentint -8.7626 2.4609 -7.6777 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 354 A}'M' greentint -9.9076 1.0273 -4.3494 {"}'M' greentint -10.0408 0.9237 -4.5489 {"}'M' greentint -9.8259 1.2739 -4.3692 {"}'M' greentint -9.9859 1.177 -4.5486 {"}'M' greentint -10.0962 1.0776 -4.8289 {"}'M' greentint -10.1125 0.8239 -4.7796 {"}'M' greentint -10.0459 0.6186 -4.6365 {"}'M' greentint -9.6924 1.4918 -4.4227 {"}'M' greentint -9.8534 1.4637 -4.6227 {"}'M' greentint -10.0014 1.3117 -4.7716 {"}'M' greentint -10.068 1.1751 -5.0825 {"}'M' greentint -10.1184 0.9204 -5.0779 {"}'M' greentint -10.1097 0.6726 -4.9975 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-8.521 {"}'S' sky -12.9766 -0.0948 -8.5904 {"}'S' sky -12.7367 0.0729 -8.634 {"}'S' sky -12.5806 0.1683 -8.4595 {"}'S' sky -12.4434 0.3365 -8.3292 {"}'S' blue -12.5784 0.2859 -8.7208 {"}'S' blue -12.4277 0.4398 -8.5689 {HG22 ILE 12 A}'S' blue -13.0131 0.1232 -6.5523 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ILE 12 A}'S' sea -11.9529 0.4506 -8.0078 {"}'S' sea -11.8372 0.534 -8.2959 {"}'S' sea -11.6254 0.6057 -8.4329 {"}'S' sea -11.3847 0.6917 -8.5047 { CG2 ILE 12 A}'S' sea -13.3572 -0.0642 -7.3848 {"}'S' sea -13.1951 -0.0422 -7.1819 {"}'S' sea -13.0327 0.0186 -6.9875 {"}'S' sea -13.2479 -0.0635 -7.673 {"}'S' green -13.0885 -0.0642 -7.4652 {"}'S' green -12.9247 -0.0262 -7.2654 {"}'S' green -12.762 0.0496 -7.0757 {"}'S' sea -12.6036 0.1634 -6.9023 {"}'S' green -12.9911 -0.0339 -7.7628 {"}'S' green -12.515 0.1168 -7.1893 {"}'S' sea -12.3627 0.241 -7.0265 {"}'S' green -12.7776 0.0382 -7.8976 {"}'S' green -12.619 0.0543 -7.6965 {"}'S' green -12.4576 0.1132 -7.5046 {"}'S' green -12.2996 0.2131 -7.3287 {"}'S' green -12.5278 0.148 -7.9641 {"}'S' green -12.3657 0.1859 -7.7648 {"}'S' sea -12.2044 0.271 -7.5791 {"}'S' sea -12.2834 0.3038 -8.0091 {"}'S' sea -12.1222 0.3702 -7.8193 { HB ILE 12 A}'S' green -11.7663 0.311 -7.6166 {"}'S' green -11.6289 0.2295 -7.4171 {"}'S' sea -11.477 0.2038 -7.2138 {"}'S' green -11.714 0.4104 -8.0088 {"}'S' green -11.1717 0.1457 -7.2345 {"}'S' green -11.5636 0.5312 -8.2802 {"}'S' green -10.9115 0.1475 -7.3303 {"}'S' sea -10.7535 0.2332 -7.1493 {"}'S' green -10.5914 0.2556 -7.3567 {"}'S' sea -10.441 0.387 -7.1982 {"}'S' green -11.0494 0.5394 -8.3944 {"}'S' green -10.4918 0.3106 -7.6108 {"}'S' green -10.3346 0.429 -7.4401 {"}'S' green -10.7087 0.4936 -8.2497 {"}'S' green -10.5715 0.4185 -8.0502 {"}'S' green -10.4152 0.4293 -7.851 {"}'S' green -10.259 0.5247 -7.6765 {"}'S' sea -10.4204 0.6137 -8.1411 {"}'S' sea -10.2568 0.6423 -7.9378 {HG21 ILE 12 A}'S' sea -13.3346 -0.1462 -7.8307 {"}'S' green -13.233 -0.209 -8.1133 {"}'S' green -13.075 -0.1232 -7.9323 {"}'S' sea -13.0711 -0.1776 -8.323 {"}'S' green -12.913 -0.1008 -8.1397 {"}'S' green -12.7625 0.0306 -7.9812 {"}'S' sea -12.8134 -0.0458 -8.3938 {"}'S' sea -12.6562 0.0726 -8.2231 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 ILE 12 A}'S' P -12.8335 -0.0221 -7.562 {"}'S' -12.8346 -0.0186 -7.5627 {"}'S' P -12.6731 0.0282 -7.3698 {"}'S' -12.675 0.0333 -7.3701 { HB ILE 12 A}'S' P -11.6052 0.2698 -7.8297 {"}'S' -11.595 0.2917 -7.8223 {"}'S' P -11.4745 0.1754 -7.6346 {"}'S' -11.4624 0.2164 -7.6292 {"}'S' P -11.3272 0.1337 -7.4323 {"}'S' -11.325 0.1522 -7.4335 {"}'S' P -11.476 0.3551 -8.1168 {"}'S' -11.4657 0.3827 -8.0987 {"}'S' P -11.3598 0.2233 -7.9313 {"}'S' -11.3434 0.3009 -7.8993 {"}'S' P -11.2232 0.142 -7.7312 {"}'S' -11.2162 0.2323 -7.7132 {"}'S' P -11.0709 0.117 -7.5275 {"}'S' -11.0736 0.1699 -7.5262 {"}'S' P -11.2856 0.4584 -8.3108 {"}'S' -11.2854 0.4618 -8.3079 {"}'S' P -11.183 0.3056 -8.1357 {"}'S' -11.1797 0.3671 -8.0957 {"}'S' P -11.0546 0.2048 -7.9406 {"}'S' -11.0614 0.2955 -7.9039 {"}'S' P -10.9073 0.1618 -7.738 {"}'S' -10.921 0.2326 -7.7233 {"}'S' P -10.7491 0.1796 -7.5396 {"}'S' -10.7511 0.1832 -7.5396 {"}'S' P -10.9458 0.3807 -8.2165 {"}'S' -10.9506 0.4069 -8.1966 {"}'S' P -10.8109 0.2859 -8.0156 {"}'S' -10.8237 0.3293 -7.9934 {"}'S' P -10.6551 0.2616 -7.8074 {"}'S' -10.6592 0.2716 -7.805 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 23 A}'M' greentint -9.2547 2.2822 -6.1786 {"}'M' greentint -9.418 2.2488 -6.3805 {"}'M' greentint -9.5666 2.0919 -6.529 {"}'M' greentint -9.1108 2.4873 -6.2407 {"}'M' greentint -9.2688 2.479 -6.4427 {"}'M' greentint -9.4274 2.3858 -6.6211 {"}'M' greentint -9.5666 2.2179 -6.7542 {"}'M' greentint -9.6399 2.0896 -7.0713 {"}'M' greentint -8.9256 2.6574 -6.3067 {"}'M' greentint -9.0818 2.6681 -6.5105 {"}'M' greentint -9.242 2.6099 -6.7025 {"}'M' greentint -9.3968 2.4868 -6.8672 {"}'M' greentint -9.5325 2.3092 -6.9933 {"}'M' greentint -8.6856 2.7756 -6.3456 {"}'M' greentint -8.8385 2.8115 -6.5526 {"}'M' greentint -8.9986 2.7875 -6.7539 {"}'M' greentint -9.1611 2.7059 -6.9403 {"}'M' greentint -9.3133 2.57 -7.1002 {"}'M' greentint -9.45 2.3884 -7.225 {"}'M' greentint -8.5899 2.9029 -6.6214 {"}'M' greentint -8.7451 2.902 -6.8214 {"}'M' greentint -8.9042 2.8509 -7.0136 {"}'M' greentint -9.06 2.7522 -7.1869 {"}'M' greentint -9.2062 2.6086 -7.3368 {"}'M' greentint -9.3369 2.4266 -7.4552 {"}'M' greentint -8.4291 2.9586 -6.828 {"}'M' greentint -8.5872 2.9461 -7.0293 {"}'M' greentint -8.7474 2.8854 -7.219 {"}'M' greentint -8.9043 2.7795 -7.3921 {"}'M' greentint -9.051 2.6323 -7.5419 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 12 A}'M' greentint -9.5401 2.0191 -6.6283 {"}'M' greentint -9.3835 2.0566 -6.4364 {"}'M' greentint -9.2286 2.1538 -6.264 {"}'M' greentint -9.0873 2.3046 -6.1223 {"}'M' greentint -9.5671 2.0823 -7.1102 {"}'M' greentint -9.4271 2.0173 -6.9109 {"}'M' greentint -9.2728 2.0165 -6.7118 {"}'M' greentint -9.1146 2.0802 -6.5255 {"}'M' greentint -8.9644 2.2047 -6.3656 {"}'M' greentint -8.8313 2.3803 -6.2425 {"}'M' greentint -8.726 2.5949 -6.1648 {"}'M' greentint -9.3636 2.1485 -7.2659 {"}'M' greentint -9.2222 2.0755 -7.0628 {"}'M' greentint -9.064 2.0777 -6.859 {"}'M' greentint -8.9034 2.1537 -6.6722 {"}'M' greentint -8.7538 2.2991 -6.5198 {"}'M' greentint -8.6293 2.499 -6.414 {"}'M' greentint -8.5407 2.7366 -6.3659 {"}'M' greentint -9.2352 2.3752 -7.506 {"}'M' greentint -9.1191 2.2382 -7.3178 {"}'M' greentint -8.9703 2.1886 -7.1117 {"}'M' greentint -8.808 2.2335 -6.9138 {"}'M' greentint -8.6538 2.3661 -6.7521 {"}'M' greentint -8.5295 2.5694 -6.6475 {"}'M' greentint -8.4513 2.8151 -6.6153 {"}'M' greentint -8.9911 2.4738 -7.4803 {"}'M' greentint -8.8594 2.372 -7.2822 {"}'M' greentint -8.6984 2.4001 -7.0822 {"}'M' greentint -8.5503 2.5521 -6.9333 {"}'M' greentint -8.4555 2.7862 -6.876 {"}'M' greentint -8.8301 2.7451 -7.5135 {"}'M' greentint -8.7259 2.5899 -7.3357 {"}'M' greentint -8.5659 2.6868 -7.1563 {"}'M' greentint -8.5109 2.9401 -7.1561 {"}'M' greentint -8.6442 2.8365 -7.3555 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 23 A}'M' green -10.0884 0.7272 -4.3196 {"}'M' green -10.2934 0.5238 -4.7498 {"}'M' green -10.2203 0.7002 -5.3104 {"}'M' green -9.588 1.4962 -4.7151 {"}'M' green -9.7682 1.359 -5.3095 {"}'M' green -9.9014 1.1834 -5.4326 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 23 A}'M' greentint -10.2217 0.6236 -4.5191 {"}'M' greentint -10.0068 0.9738 -4.3394 {"}'M' greentint -10.1667 0.8769 -4.5189 {"}'M' greentint -10.2771 0.7775 -4.7991 {"}'M' greentint -9.8733 1.1916 -4.393 {"}'M' greentint -10.0343 1.1636 -4.5929 {"}'M' greentint -10.1823 1.0116 -4.7418 {"}'M' greentint -10.2488 0.8749 -5.0527 {"}'M' greentint -10.2992 0.6203 -5.0481 {"}'M' greentint -9.6849 1.3615 -4.4596 {"}'M' greentint -9.8437 1.3646 -4.6655 {"}'M' greentint -10.004 1.2736 -4.8484 {"}'M' greentint -10.1454 1.1031 -4.9839 {"}'M' greentint -10.152 0.9492 -5.2928 {"}'M' greentint -9.7493 1.457 -4.913 {"}'M' greentint -9.9059 1.345 -5.0844 {"}'M' greentint -10.0445 1.1702 -5.2151 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 12 A}'M' green -10.3284 0.5372 -4.558 {"}'M' green -10.1766 0.6579 -4.3952 {"}'M' green -10.0362 0.8199 -4.2591 {"}'M' green -9.9143 1.0165 -4.1561 {"}'M' green -10.3836 0.5416 -4.9933 {"}'M' green -9.6967 1.3048 -4.3193 {"}'M' green -10.3092 0.677 -5.2524 {"}'M' green -10.1906 0.8589 -5.4069 {"}'M' green -10.0563 1.0668 -5.4827 {"}'M' green -9.7849 1.394 -5.3403 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 12 A}'M' greentint -10.221 0.5973 -4.7992 {"}'M' greentint -10.0631 0.7076 -4.6257 {"}'M' greentint -9.9178 0.8693 -4.4827 {"}'M' greentint -9.7932 1.0717 -4.3792 {"}'M' greentint -10.15 0.6995 -5.0519 {"}'M' greentint -9.9903 0.788 -4.8709 {"}'M' greentint -9.8436 0.9376 -4.7234 {"}'M' greentint -9.7199 1.1374 -4.6187 {"}'M' greentint -9.628 1.3716 -4.5654 {"}'M' greentint -10.0318 0.87 -5.206 {"}'M' greentint -9.8747 0.9658 -5.0287 {"}'M' greentint -9.7363 1.1364 -4.8972 {"}'M' greentint -9.6333 1.3599 -4.8263 {"}'M' greentint -9.8931 1.096 -5.2801 {"}'M' greentint -9.7434 1.2497 -5.1292 {"}'M' greentint -9.6481 1.486 -5.0717 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 112 1t6lA_125F_114}P -7.2003 5.9552 -11.5879 {"}-7.2003 5.9552 -11.5879 { ca ala A 112 1t6lA_125F_114}-8.2907 6.3361 -10.7095 { c ala A 112 1t6lA_125F_114}-8.2039 5.4279 -9.5087 { o ala A 112 1t6lA_125F_114}-7.9843 4.2415 -9.6469 { c ala A 112 1t6lA_125F_114}P -8.2039 5.4279 -9.5087 { n lys A 113 1t6lA_125F_114}-8.3997 6.007 -8.3432 { ca lys A 113 1t6lA_125F_114}-8.4409 5.2424 -7.0988 { c lys A 113 1t6lA_125F_114}-9.8881 5.0025 -6.669 { o lys A 113 1t6lA_125F_114}-10.6156 5.9478 -6.3189 { c lys A 113 1t6lA_125F_114}P -9.8881 5.0025 -6.669 { n ile A 114 1t6lA_125F_114}-10.2783 3.7312 -6.6677 { ca ile A 114 1t6lA_125F_114}-11.6479 3.3259 -6.3436 { c ile A 114 1t6lA_125F_114}-11.6569 2.8038 -4.9123 { o ile A 114 1t6lA_125F_114}-10.8371 1.9559 -4.557 { c ile A 114 1t6lA_125F_114}P -11.6569 2.8038 -4.9123 { n ser A 115 1t6lA_125F_114}-12.5575 3.3317 -4.0952 { ca ser A 115 1t6lA_125F_114}-12.768 2.8049 -2.7384 { c ser A 115 1t6lA_125F_114}-14.177 2.2593 -2.5573 { o ser A 115 1t6lA_125F_114}-15.1468 2.8144 -3.0714 { c ser A 115 1t6lA_125F_114}P -14.177 2.2593 -2.5573 { n met A 116 1t6lA_125F_114}-14.2842 1.1421 -1.8371 { ca met A 116 1t6lA_125F_114}-15.565 0.4967 -1.6426 { c met A 116 1t6lA_125F_114}-15.5413 -0.1043 -0.2427 { o met A 116 1t6lA_125F_114}-14.4888 -0.5858 0.2206 { n met A 123 1t6lA_125F_114}P -11.9105 -1.7688 0.8925 {"}-11.9105 -1.7688 0.8925 { ca met A 123 1t6lA_125F_114}-10.9885 -2.1221 -0.1403 { c met A 123 1t6lA_125F_114}-10.7348 -0.8857 -0.9916 { o met A 123 1t6lA_125F_114}-11.5601 0.0407 -1.046 { c met A 123 1t6lA_125F_114}P -10.7348 -0.8857 -0.9916 { n glu A 124 1t6lA_125F_114}-9.5868 -0.8836 -1.648 { ca glu A 124 1t6lA_125F_114}-9.2035 0.2 -2.5301 { c glu A 124 1t6lA_125F_114}-8.4724 -0.471 -3.6658 { o glu A 124 1t6lA_125F_114}-7.8441 -1.5297 -3.4881 { c glu A 124 1t6lA_125F_114}P -8.4724 -0.471 -3.6658 { n phe A 125 1t6lA_125F_114}-8.6199 0.0787 -4.861 { ca phe A 125 1t6lA_125F_114}-7.7572 -0.3199 -5.9406 { c phe A 125 1t6lA_125F_114}-7.5086 0.8619 -6.8496 { o phe A 125 1t6lA_125F_114}-8.3031 1.797 -6.8913 { c phe A 125 1t6lA_125F_114}P -7.5086 0.8619 -6.8496 { n ser A 126 1t6lA_125F_114}-6.3919 0.7965 -7.5624 { ca ser A 126 1t6lA_125F_114}-6.0078 1.8287 -8.5001 { c ser A 126 1t6lA_125F_114}-5.9261 1.148 -9.8513 { o ser A 126 1t6lA_125F_114}-5.2524 0.1319 -10.0126 { c ser A 126 1t6lA_125F_114}P -5.9261 1.148 -9.8513 { n ser A 127 1t6lA_125F_114}-6.679 1.6763 -10.8061 { ca ser A 127 1t6lA_125F_114}-6.774 1.0807 -12.1261 { c ser A 127 1t6lA_125F_114}-6.2335 2.1096 -13.0987 { o ser A 127 1t6lA_125F_114}-6.4099 3.3055 -12.8847 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 112 1t6lA_125F_114}P -7.2003 5.9552 -11.5879 { ca ala A 112 1t6lA_125F_114}P -8.2907 6.3361 -10.7095 { n lys A 113 1t6lA_125F_114}P -8.3997 6.007 -8.3432 { ca lys A 113 1t6lA_125F_114}P -8.4409 5.2424 -7.0988 { n ile A 114 1t6lA_125F_114}P -10.2783 3.7312 -6.6677 { ca ile A 114 1t6lA_125F_114}P -11.6479 3.3259 -6.3436 { n ser A 115 1t6lA_125F_114}P -12.5575 3.3317 -4.0952 { ca ser A 115 1t6lA_125F_114}P -12.768 2.8049 -2.7384 { n met A 116 1t6lA_125F_114}P -14.2842 1.1421 -1.8371 { ca met A 116 1t6lA_125F_114}P -15.565 0.4967 -1.6426 { n met A 123 1t6lA_125F_114}P -11.9105 -1.7688 0.8925 { ca met A 123 1t6lA_125F_114}P -10.9885 -2.1221 -0.1403 { n glu A 124 1t6lA_125F_114}P -9.5868 -0.8836 -1.648 { ca glu A 124 1t6lA_125F_114}P -9.2035 0.2 -2.5301 { n phe A 125 1t6lA_125F_114}P -8.6199 0.0787 -4.861 { ca phe A 125 1t6lA_125F_114}P -7.7572 -0.3199 -5.9406 { n ser A 126 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{"}'S' green -10.4223 1.2321 -9.3428 {"}'S' green -10.26 1.25 -9.547 {"}'S' green -10.6298 1.1489 -10.3644 {"}'S' green -10.1536 1.292 -9.7889 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 ILE 114 A}'S' P -12.7656 0.0759 -7.2421 {"}'S' -12.7712 0.0875 -7.2388 {"}'S' P -12.6796 0.2197 -7.489 {"}'S' -12.6816 0.2223 -7.4871 {"}'S' P -12.5212 0.2316 -7.2871 {"}'S' -12.5223 0.2341 -7.2858 {HG21 ILE 114 A}'S' P -13.1987 -0.1237 -7.6108 {"}'S' -13.1999 -0.123 -7.6109 {"}'S' P -12.9659 0.0904 -7.6764 {"}'S' -12.9659 0.0904 -7.6764 {HD13 ILE 114 A}'S' P -11.296 1.0668 -9.5626 {"}'S' -11.2946 1.0717 -9.5636 {"}'S' P -11.1366 1.0973 -9.3654 {"}'S' -11.1351 1.1074 -9.3691 {"}'S' P -11.2935 1.0384 -9.9834 {"}'S' -11.293 1.0406 -9.9833 {"}'S' P -11.1462 0.9968 -9.7811 {"}'S' -11.136 1.0591 -9.7849 {"}'S' P -10.9907 1.0088 -9.5833 {"}'S' -10.9875 1.0917 -9.6013 {"}'S' P -10.832 1.0733 -9.3965 {"}'S' -10.8384 1.1302 -9.42 {"}'S' P -11.0422 1.005 -10.08 {"}'S' -11.0379 1.0543 -10.07 {"}'S' P -10.8898 0.98 -9.8763 {"}'S' -10.895 1.0821 -9.8742 {"}'S' P -10.7304 1.0105 -9.6791 {"}'S' -10.7506 1.1154 -9.6947 {"}'S' P -10.5724 1.0963 -9.4981 {"}'S' -10.5934 1.1557 -9.5181 {"}'S' P -10.8735 1.0679 -10.2894 {"}'S' -10.8737 1.0733 -10.2875 {"}'S' P -10.7263 1.0249 -10.0868 {"}'S' -10.7389 1.0919 -10.0732 {"}'S' P -10.5685 1.0418 -9.8888 {"}'S' -10.596 1.1239 -9.8852 {"}'S' P -10.4104 1.1186 -9.7055 {"}'S' -10.4343 1.1657 -9.7114 {"}'S' P -10.4741 1.1247 -10.1562 {"}'S' -10.4797 1.1363 -10.1529 {"}'S' P -10.3108 1.1736 -9.9596 {"}'S' -10.3135 1.1774 -9.9591 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 125 A}'M' greentint -9.6188 2.0817 -6.5074 {"}'M' greentint -9.3765 2.4773 -6.3041 {"}'M' greentint -9.5251 2.3204 -6.4526 {"}'M' greentint -9.6288 2.224 -6.7501 {"}'M' greentint -9.0693 2.7158 -6.1643 {"}'M' greentint -9.2272 2.7074 -6.3663 {"}'M' greentint -9.3858 2.6143 -6.5447 {"}'M' greentint -9.5251 2.4463 -6.6779 {"}'M' greentint -9.5984 2.3181 -6.9949 {"}'M' greentint -9.6696 2.0729 -7.0191 {"}'M' greentint -9.0403 2.8966 -6.4342 {"}'M' greentint -9.2004 2.8383 -6.6261 {"}'M' greentint -9.3552 2.7152 -6.7908 {"}'M' greentint -9.491 2.5377 -6.917 {"}'M' greentint -9.5205 2.3983 -7.2331 {"}'M' greentint -9.6017 2.1551 -7.2715 {"}'M' greentint -8.797 3.04 -6.4762 {"}'M' greentint -8.9571 3.0159 -6.6776 {"}'M' greentint -9.1196 2.9344 -6.8639 {"}'M' greentint -9.2718 2.7984 -7.0239 {"}'M' greentint -9.4085 2.6168 -7.1487 {"}'M' greentint -9.406 2.443 -7.4628 {"}'M' greentint -9.4916 2.2082 -7.5074 {"}'M' greentint -8.7035 3.1305 -6.745 {"}'M' greentint -8.8627 3.0794 -6.9372 {"}'M' greentint -9.0185 2.9806 -7.1105 {"}'M' greentint -9.1646 2.8371 -7.2604 {"}'M' greentint -9.2954 2.6551 -7.3789 {"}'M' greentint -8.8628 3.0079 -7.3158 {"}'M' greentint -9.0094 2.8608 -7.4656 {"}'M' greentint -9.1415 2.6778 -7.5855 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 114 A}'M' greentint -9.6304 2.0197 -6.5706 {"}'M' greentint -9.4755 2.1169 -6.3981 {"}'M' greentint -9.3342 2.2676 -6.2565 {"}'M' greentint -9.2135 2.4619 -6.1548 {"}'M' greentint -9.674 1.9803 -7.0451 {"}'M' greentint -9.5197 1.9796 -6.846 {"}'M' greentint -9.3615 2.0433 -6.6596 {"}'M' greentint -9.2113 2.1678 -6.4998 {"}'M' greentint -9.0781 2.3434 -6.3767 {"}'M' greentint -8.9729 2.558 -6.299 {"}'M' greentint -8.8994 2.7978 -6.2721 {"}'M' greentint -9.4691 2.0386 -7.197 {"}'M' greentint -9.3109 2.0408 -6.9932 {"}'M' greentint -9.1503 2.1168 -6.8064 {"}'M' greentint -9.0007 2.2622 -6.654 {"}'M' greentint -8.8761 2.4621 -6.5481 {"}'M' greentint -8.7876 2.6997 -6.5001 {"}'M' greentint -8.7431 2.9545 -6.5128 {"}'M' greentint -9.366 2.2013 -7.452 {"}'M' greentint -9.2172 2.1517 -7.2459 {"}'M' greentint -9.0549 2.1966 -7.048 {"}'M' greentint -8.9007 2.3292 -6.8862 {"}'M' greentint -8.7764 2.5325 -6.7816 {"}'M' greentint -8.6981 2.7782 -6.7495 {"}'M' greentint -8.6772 3.0336 -6.7928 {"}'M' greentint -9.238 2.4369 -7.6145 {"}'M' greentint -9.1062 2.3351 -7.4163 {"}'M' greentint -8.9452 2.3632 -7.2164 {"}'M' greentint -8.7972 2.5152 -7.0675 {"}'M' greentint -8.7024 2.7493 -7.0102 {"}'M' greentint -8.6861 3.003 -7.0595 {"}'M' greentint -8.9727 2.553 -7.4699 {"}'M' greentint -8.8128 2.6499 -7.2904 {"}'M' greentint -8.7578 2.9032 -7.2902 {"}'M' greentint -8.8911 2.7996 -7.4897 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 125 A}'M' greentint -10.081 0.9414 -4.4882 {"}'M' greentint -10.2142 0.8377 -4.6876 {"}'M' greentint -9.8951 1.0328 -4.3302 {"}'M' greentint -9.9993 1.1879 -4.508 {"}'M' greentint -10.1593 1.091 -4.6874 {"}'M' greentint -10.2697 0.9917 -4.9677 {"}'M' greentint -10.286 0.7379 -4.9184 {"}'M' greentint -9.7341 1.304 -4.3634 {"}'M' greentint -9.8658 1.4058 -4.5615 {"}'M' greentint -10.0268 1.3777 -4.7615 {"}'M' greentint -10.1749 1.2258 -4.9104 {"}'M' greentint -10.2414 1.0891 -5.2213 {"}'M' greentint -9.5425 1.4808 -4.4273 {"}'M' greentint -9.6774 1.5756 -4.6282 {"}'M' greentint -9.8363 1.5788 -4.8341 {"}'M' greentint -9.9965 1.4877 -5.0169 {"}'M' greentint -10.1379 1.3172 -5.1525 {"}'M' greentint -10.1445 1.1634 -5.4613 {"}'M' greentint -9.5805 1.7104 -4.8837 {"}'M' greentint -9.7419 1.6712 -5.0815 {"}'M' greentint -9.8985 1.5591 -5.2529 {"}'M' greentint -10.0371 1.3844 -5.3837 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 114 A}'M' green -9.6684 1.2482 -4.2489 {"}'M' green -9.5033 1.548 -4.4351 {"}'M' green -10.2042 1.1122 -5.4782 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 114 A}'M' greentint -10.2588 0.7181 -4.8631 {"}'M' greentint -10.0962 0.7738 -4.669 {"}'M' greentint -9.9384 0.884 -4.4955 {"}'M' greentint -9.793 1.0458 -4.3525 {"}'M' greentint -10.1845 0.8535 -5.1222 {"}'M' greentint -10.0253 0.8759 -4.9217 {"}'M' greentint -9.8656 0.9645 -4.7407 {"}'M' greentint -9.7189 1.1141 -4.5931 {"}'M' greentint -9.5951 1.3139 -4.4884 {"}'M' greentint -10.0658 1.0354 -5.2767 {"}'M' greentint -9.907 1.0464 -5.0758 {"}'M' greentint -9.75 1.1423 -4.8985 {"}'M' greentint -9.6115 1.3129 -4.7669 {"}'M' greentint -9.5086 1.5364 -4.6961 {"}'M' greentint -9.9315 1.2433 -5.3525 {"}'M' greentint -9.7684 1.2725 -5.1498 {"}'M' greentint -9.6186 1.4262 -4.999 {"}'M' greentint -9.5233 1.6625 -4.9415 {"}'M' greentint -9.8189 1.4731 -5.3877 {"}'M' greentint -9.6602 1.5704 -5.2101 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 477 1tf4A_562F_479}P -7.9715 5.3458 -12.3525 {"}-7.9715 5.3458 -12.3525 { ca thr A 477 1tf4A_562F_479}-9.1917 5.4946 -11.5832 { c thr A 477 1tf4A_562F_479}-8.856 4.7846 -10.2856 { o thr A 477 1tf4A_562F_479}-8.3734 3.6536 -10.3077 { c thr A 477 1tf4A_562F_479}P -8.856 4.7846 -10.2856 { n glu A 478 1tf4A_562F_479}-8.99 5.4887 -9.1735 { ca glu A 478 1tf4A_562F_479}-8.7316 4.9025 -7.8765 { c glu A 478 1tf4A_562F_479}-10.0429 4.9187 -7.1143 { o glu A 478 1tf4A_562F_479}-10.551 5.9746 -6.7425 { c glu A 478 1tf4A_562F_479}P -10.0429 4.9187 -7.1143 { n ile A 479 1tf4A_562F_479}-10.5711 3.7286 -6.8828 { ca ile A 479 1tf4A_562F_479}-11.8305 3.5374 -6.1972 { c ile A 479 1tf4A_562F_479}-11.6065 3.0725 -4.7697 { o ile A 479 1tf4A_562F_479}-10.6076 2.4221 -4.4659 { c ile A 479 1tf4A_562F_479}P -11.6065 3.0725 -4.7697 { n lys A 480 1tf4A_562F_479}-12.5008 3.4845 -3.8834 { ca lys A 480 1tf4A_562F_479}-12.4672 3.0266 -2.5095 { c lys A 480 1tf4A_562F_479}-13.7956 2.2942 -2.3789 { o lys A 480 1tf4A_562F_479}-14.8522 2.9167 -2.4425 { c lys A 480 1tf4A_562F_479}P -13.7956 2.2942 -2.3789 { n ala A 481 1tf4A_562F_479}-13.7377 0.9684 -2.3612 { ca ala A 481 1tf4A_562F_479}-14.9323 0.1479 -2.2379 { c ala A 481 1tf4A_562F_479}-15.0629 -0.3777 -0.8166 { o ala A 481 1tf4A_562F_479}-14.0694 -0.563 -0.117 { n val A 560 1tf4A_562F_479}P -11.7647 -2.0452 0.4919 {"}-11.7647 -2.0452 0.4919 { ca val A 560 1tf4A_562F_479}-10.9304 -2.3722 -0.6479 { c val A 560 1tf4A_562F_479}-10.6327 -1.1175 -1.4452 { o val A 560 1tf4A_562F_479}-11.5417 -0.5094 -2.001 { c val A 560 1tf4A_562F_479}P -10.6327 -1.1175 -1.4452 { n gln A 561 1tf4A_562F_479}-9.376 -0.6942 -1.4509 { ca gln A 561 1tf4A_562F_479}-8.9725 0.4649 -2.2355 { c gln A 561 1tf4A_562F_479}-8.2107 -0.1295 -3.4065 { o gln A 561 1tf4A_562F_479}-7.3888 -1.0198 -3.2113 { c gln A 561 1tf4A_562F_479}P -8.2107 -0.1295 -3.4065 { n phe A 562 1tf4A_562F_479}-8.5295 0.2931 -4.6223 { ca phe A 562 1tf4A_562F_479}-7.8383 -0.2298 -5.7883 { c phe A 562 1tf4A_562F_479}-7.7256 0.8058 -6.8976 { o phe A 562 1tf4A_562F_479}-8.672 1.5463 -7.1811 { c phe A 562 1tf4A_562F_479}P -7.7256 0.8058 -6.8976 { n arg A 563 1tf4A_562F_479}-6.526 0.8983 -7.4631 { ca arg A 563 1tf4A_562F_479}-6.2323 1.8241 -8.5393 { c arg A 563 1tf4A_562F_479}-5.9878 1.057 -9.8278 { o arg A 563 1tf4A_562F_479}-5.1441 0.1581 -9.869 { c arg A 563 1tf4A_562F_479}P -5.9878 1.057 -9.8278 { n ile A 564 1tf4A_562F_479}-6.7387 1.3956 -10.8681 { ca ile A 564 1tf4A_562F_479}-6.575 0.7675 -12.1721 { c ile A 564 1tf4A_562F_479}-5.8613 1.8349 -13.0023 { o ile A 564 1tf4A_562F_479}-6.44 2.8808 -13.2971 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 477 1tf4A_562F_479}P -7.9715 5.3458 -12.3525 { ca thr A 477 1tf4A_562F_479}P -9.1917 5.4946 -11.5832 { n glu A 478 1tf4A_562F_479}P -8.99 5.4887 -9.1735 { ca glu A 478 1tf4A_562F_479}P -8.7316 4.9025 -7.8765 { n ile A 479 1tf4A_562F_479}P -10.5711 3.7286 -6.8828 { ca ile A 479 1tf4A_562F_479}P -11.8305 3.5374 -6.1972 { n lys A 480 1tf4A_562F_479}P -12.5008 3.4845 -3.8834 { ca lys A 480 1tf4A_562F_479}P -12.4672 3.0266 -2.5095 { n ala A 481 1tf4A_562F_479}P -13.7377 0.9684 -2.3612 { ca ala A 481 1tf4A_562F_479}P -14.9323 0.1479 -2.2379 { n val A 560 1tf4A_562F_479}P -11.7647 -2.0452 0.4919 { ca val A 560 1tf4A_562F_479}P -10.9304 -2.3722 -0.6479 { n gln A 561 1tf4A_562F_479}P -9.376 -0.6942 -1.4509 { ca gln A 561 1tf4A_562F_479}P -8.9725 0.4649 -2.2355 { n phe A 562 1tf4A_562F_479}P -8.5295 0.2931 -4.6223 { ca phe A 562 1tf4A_562F_479}P -7.8383 -0.2298 -5.7883 { n arg A 563 1tf4A_562F_479}P -6.526 0.8983 -7.4631 { ca arg A 563 1tf4A_562F_479}P -6.2323 1.8241 -8.5393 { n ile A 564 1tf4A_562F_479}P -6.7387 1.3956 -10.8681 { ca ile A 564 1tf4A_562F_479}P -6.575 0.7675 -12.1721 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca thr A 477 1tf4A_562F_479}P -9.1917 5.4946 -11.5832 {"}-9.1917 5.4946 -11.5832 { ca glu A 478 1tf4A_562F_479}-8.7316 4.9025 -7.8765 { ca ile A 479 1tf4A_562F_479}-11.8305 3.5374 -6.1972 { ca lys A 480 1tf4A_562F_479}-12.4672 3.0266 -2.5095 { ca ala A 481 1tf4A_562F_479}-14.9323 0.1479 -2.2379 { ca val A 560 1tf4A_562F_479}-10.9304 -2.3722 -0.6479 { ca gln A 561 1tf4A_562F_479}-8.9725 0.4649 -2.2355 { ca phe A 562 1tf4A_562F_479}-7.8383 -0.2298 -5.7883 { ca arg A 563 1tf4A_562F_479}-6.2323 1.8241 -8.5393 { ca ile A 564 1tf4A_562F_479}-6.575 0.7675 -12.1721 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ile A 479 1tf4A_562F_479}P -11.8305 3.5374 -6.1972 { cb ile A 479 1tf4A_562F_479}-12.6648 2.44 -6.9212 { cg1 ile A 479 1tf4A_562F_479}-13.0162 2.8819 -8.3448 { cd1 ile A 479 1tf4A_562F_479}-13.9277 4.0885 -8.4118 { cb ile A 479 1tf4A_562F_479}P -12.6648 2.44 -6.9212 { cg2 ile A 479 1tf4A_562F_479}-13.9244 2.1053 -6.1415 { ca phe A 562 1tf4A_562F_479}P -7.8383 -0.2298 -5.7883 { cb phe A 562 1tf4A_562F_479}-8.4777 -1.5374 -6.292 { cg phe A 562 1tf4A_562F_479}-9.8842 -1.3901 -6.8177 { cd1 phe A 562 1tf4A_562F_479}-10.9761 -1.4286 -5.9533 { ce1 phe A 562 1tf4A_562F_479}-12.2775 -1.3381 -6.4436 { cz phe A 562 1tf4A_562F_479}-12.4983 -1.2085 -7.8158 { cg phe A 562 1tf4A_562F_479}P -9.8842 -1.3901 -6.8177 { cd2 phe A 562 1tf4A_562F_479}-10.1188 -1.2591 -8.185 { ce2 phe A 562 1tf4A_562F_479}-11.4155 -1.1666 -8.6864 { cz phe A 562 1tf4A_562F_479}ghost -12.4983 -1.2085 -7.8158 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ile A 479 1tf4A_562F_479}P -12.6648 2.44 -6.9212 { cg1 ile A 479 1tf4A_562F_479}P -13.0162 2.8819 -8.3448 {"}P -13.0162 2.8819 -8.3448 { cg2 ile A 479 1tf4A_562F_479}P -13.9244 2.1053 -6.1415 {"}P -13.9244 2.1053 -6.1415 {"}P -13.9244 2.1053 -6.1415 { cd1 ile A 479 1tf4A_562F_479}P -13.9277 4.0885 -8.4118 {"}P -13.9277 4.0885 -8.4118 {"}P -13.9277 4.0885 -8.4118 { cb phe A 562 1tf4A_562F_479}P -8.4777 -1.5374 -6.292 {"}P -8.4777 -1.5374 -6.292 { cd1 phe A 562 1tf4A_562F_479}P -10.9761 -1.4286 -5.9533 { cd2 phe A 562 1tf4A_562F_479}P -10.1188 -1.2591 -8.185 { ce1 phe A 562 1tf4A_562F_479}P -12.2775 -1.3381 -6.4436 { ce2 phe A 562 1tf4A_562F_479}P -11.4155 -1.1666 -8.6864 { cz phe A 562 1tf4A_562F_479}P -12.4983 -1.2085 -7.8158 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 562 A}'S' blue -11.3688 0.245 -6.2808 {"}'S' blue -11.1902 0.2286 -6.4738 { CE1 PHE 562 A}'S' blue -13.3109 0.0119 -6.0281 {"}'S' blue -12.9152 0.1929 -5.8859 {"}'S' blue -13.0763 0.178 -6.0889 {"}'S' blue -13.2391 0.1153 -6.2817 {"}'S' blue -13.3977 0.0063 -6.4566 {"}'S' blue -12.8144 0.2998 -6.1433 {"}'S' sky -12.9748 0.2636 -6.3406 {"}'S' blue -13.1355 0.1852 -6.5252 {"}'S' blue -13.2906 0.0665 -6.6931 {"}'S' sky -12.5319 0.3751 -6.1895 {"}'S' sky -12.6895 0.3619 -6.39 {"}'S' sky -12.8503 0.3094 -6.5825 {"}'S' blue -13.0076 0.2196 -6.7616 {"}'S' sky -11.8598 0.3367 -6.1525 {"}'S' sky -11.651 0.2898 -6.3042 {"}'S' sky -11.5303 0.1601 -6.9538 { CE2 PHE 562 A}'S' blue -11.3956 0.1967 -7.5897 {"}'S' blue -11.5132 0.3258 -7.7782 {"}'S' blue -11.6486 0.416 -7.977 {"}'S' blue -11.7965 0.4658 -8.182 { CZ PHE 562 A}'S' blue -13.2162 0.1617 -6.9975 {"}'S' blue -12.9831 0.2884 -7.0496 {"}'S' blue -13.1361 0.3226 -7.258 {"}'S' sky -12.8794 0.4239 -7.3113 {"}'S' blue -13.0353 0.4295 -7.5154 {"}'S' blue -12.9104 0.4916 -7.7622 {"}'S' blue -12.7272 0.5218 -7.9476 {"}'S' sky -12.3867 0.5337 -7.9395 {"}'S' sky -11.6125 0.2023 -7.2808 {"}'S' blue -12.1781 0.4905 -8.0906 {"}'S' sky -11.6596 0.3273 -7.8043 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 562 A}'S' sea -12.1881 0.3866 -6.1632 {"}'S' green -12.3447 0.4096 -6.3706 {"}'S' green -12.5063 0.3922 -6.5754 {"}'S' sea -12.6702 0.3355 -6.7711 {"}'S' green -12.0089 0.3897 -6.3598 {"}'S' green -12.1658 0.404 -6.5673 {"}'S' green -12.3279 0.3806 -6.7699 {"}'S' green -11.7997 0.3436 -6.5111 {"}'S' green -11.9573 0.3608 -6.7185 {"}'S' green -12.119 0.3378 -6.9223 {"}'S' sea -11.5863 0.2571 -6.639 {"}'S' green -11.7422 0.2786 -6.8466 {"}'S' green -11.9038 0.2598 -7.0513 { CZ PHE 562 A}'S' sea -12.7315 0.3741 -7.1064 {"}'S' green -12.4584 0.4117 -7.1552 {"}'S' green -12.6008 0.4775 -7.3581 {"}'S' sea -12.7527 0.5047 -7.5617 {"}'S' green -12.1278 0.3571 -7.1267 {"}'S' green -12.409 0.5163 -7.5354 {"}'S' sea -12.5656 0.5393 -7.7427 {"}'S' green -11.8204 0.2507 -7.1283 {"}'S' green -11.9427 0.3753 -7.3222 {"}'S' green -12.0807 0.4663 -7.5247 {"}'S' green -12.2298 0.5193 -7.732 {"}'S' sea -11.7348 0.3285 -7.4733 {"}'S' sea -11.8719 0.4195 -7.6763 {"}'S' sea -12.0205 0.4732 -7.8832 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 562 A}'S' P -12.2622 0.4555 -7.3277 {"}'S' -12.2634 0.4463 -7.3306 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ILE 479 A}'S' blue -12.8178 0.7657 -6.437 {"}'S' blue -12.6549 0.8272 -6.2422 {"}'S' blue -13.087 0.7677 -7.219 {"}'S' blue -12.9384 0.7139 -7.0121 {"}'S' blue -12.9662 0.8175 -7.5045 {"}'S' blue -12.8368 0.9261 -7.783 { CG2 ILE 479 A}'S' blue -13.517 0.4049 -6.2014 {"}'S' blue -13.3567 0.4553 -6.0091 {"}'S' blue -13.1986 0.5438 -5.8286 {"}'S' blue -13.4611 0.4652 -6.5369 {"}'S' sky -13.3025 0.4813 -6.3358 {"}'S' sky -13.1411 0.5402 -6.144 {"}'S' blue -12.9832 0.6401 -5.968 {"}'S' blue -13.3692 0.5867 -6.8098 {"}'S' blue -13.2114 0.575 -6.6034 {"}'S' sky -13.0492 0.613 -6.4041 {"}'S' blue -12.8879 0.6981 -6.2184 {"}'S' blue -12.967 0.7308 -6.6484 { HB ILE 479 A}'S' sky -12.7642 0.6208 -6.8109 {"}'S' sky -12.3014 0.6725 -6.2261 {"}'S' sky -11.928 0.7026 -6.1618 {"}'S' sky -12.7133 0.8387 -7.6473 {"}'S' sky -11.5215 0.6149 -6.4765 {"}'S' sky -11.5095 0.5015 -6.8392 {"}'S' blue -11.3591 0.6329 -6.6807 {"}'S' sky -11.9676 0.7853 -7.877 {"}'S' sky -11.5732 0.5075 -7.2899 {"}'S' blue -11.6268 0.7394 -7.7322 {"}'S' blue -11.4896 0.6644 -7.5328 @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 479 A}'S' sea -12.6169 0.5778 -6.6084 {"}'S' sea -12.4595 0.5957 -6.4093 {"}'S' sea -12.7998 0.6886 -7.2852 {"}'S' sea -12.6844 0.5569 -7.0991 {"}'S' green -12.5471 0.4754 -6.8997 {"}'S' green -12.3951 0.4497 -6.6963 {"}'S' green -12.2357 0.4801 -6.4991 {"}'S' sea -12.0773 0.5666 -6.3177 {"}'S' green -12.6322 0.6563 -7.4913 {"}'S' green -12.5234 0.5156 -7.3122 {"}'S' green -12.3927 0.4213 -7.1172 {"}'S' green -12.2454 0.3796 -6.9149 {"}'S' green -12.0898 0.3916 -6.717 {"}'S' green -11.9312 0.4561 -6.5303 {"}'S' sea -11.7783 0.5721 -6.3648 {"}'S' sea -12.4818 0.7771 -7.7627 {"}'S' green -12.3941 0.601 -7.5993 {"}'S' green -11.989 0.3629 -7.01 {"}'S' green -11.8296 0.3933 -6.8128 {"}'S' sea -11.6716 0.4791 -6.6318 {"}'S' sea -12.2037 0.7043 -7.7933 {"}'S' green -12.1012 0.5515 -7.6183 {"}'S' green -11.9727 0.4507 -7.4231 {"}'S' green -11.8254 0.4077 -7.2206 {"}'S' sea -11.6677 0.4247 -7.0225 {"}'S' sea -11.8639 0.6266 -7.699 {"}'S' sea -11.729 0.5317 -7.4981 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 479 A}'S' P -12.2779 0.4692 -7.4138 {"}'S' -12.2769 0.4739 -7.4118 {"}'S' P -12.1414 0.3878 -7.2138 {"}'S' -12.1408 0.3914 -7.2139 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 562 A}'M' green -9.2317 2.7573 -7.6056 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 562 A}'M' greentint -9.7454 2.2267 -6.5939 {"}'M' greentint -9.894 2.0697 -6.7424 {"}'M' greentint -9.9977 1.9734 -7.0399 {"}'M' greentint -9.5962 2.4568 -6.6561 {"}'M' greentint -9.7547 2.3636 -6.8345 {"}'M' greentint -9.894 2.1957 -6.9677 {"}'M' greentint -9.9673 2.0674 -7.2847 {"}'M' greentint -9.4092 2.6459 -6.7239 {"}'M' greentint -9.5694 2.5877 -6.9159 {"}'M' greentint -9.7241 2.4646 -7.0806 {"}'M' greentint -9.8599 2.2871 -7.2068 {"}'M' greentint -9.8894 2.1476 -7.5229 {"}'M' greentint -9.3264 2.7659 -6.968 {"}'M' greentint -9.4885 2.6837 -7.1537 {"}'M' greentint -9.6407 2.5478 -7.3137 {"}'M' greentint -9.7774 2.3662 -7.4385 {"}'M' greentint -9.7749 2.1924 -7.7526 {"}'M' greentint -9.2316 2.8287 -7.227 {"}'M' greentint -9.3874 2.73 -7.4003 {"}'M' greentint -9.5335 2.5864 -7.5502 {"}'M' greentint -9.6643 2.4044 -7.6686 {"}'M' greentint -9.3783 2.6102 -7.7554 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 479 A}'M' greentint -9.9841 1.8855 -7.126 {"}'M' greentint -9.8259 1.9492 -6.9397 {"}'M' greentint -9.6757 2.0736 -6.7799 {"}'M' greentint -9.5426 2.2492 -6.6568 {"}'M' greentint -9.4373 2.4639 -6.579 {"}'M' greentint -9.9335 1.9445 -7.477 {"}'M' greentint -9.7754 1.9467 -7.2733 {"}'M' greentint -9.6147 2.0227 -7.0864 {"}'M' greentint -9.4652 2.168 -6.934 {"}'M' greentint -9.3406 2.368 -6.8282 {"}'M' greentint -9.252 2.6056 -6.7802 {"}'M' greentint -9.6817 2.0575 -7.526 {"}'M' greentint -9.5193 2.1024 -7.328 {"}'M' greentint -9.3651 2.235 -7.1663 {"}'M' greentint -9.2409 2.4384 -7.0617 {"}'M' greentint -9.1626 2.684 -7.0296 {"}'M' greentint -9.5707 2.241 -7.6964 {"}'M' greentint -9.4097 2.269 -7.4964 {"}'M' greentint -9.2616 2.421 -7.3476 {"}'M' greentint -9.1668 2.6551 -7.2902 {"}'M' greentint -9.4372 2.4588 -7.7499 {"}'M' greentint -9.2772 2.5557 -7.5705 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 562 A}'M' greentint -9.9349 1.385 -4.236 {"}'M' greentint -10.0949 1.2881 -4.4154 {"}'M' greentint -10.2053 1.1887 -4.6957 {"}'M' greentint -9.6697 1.5011 -4.0913 {"}'M' greentint -9.8014 1.6028 -4.2895 {"}'M' greentint -9.9624 1.5748 -4.4895 {"}'M' greentint -10.1105 1.4228 -4.6383 {"}'M' greentint -10.177 1.2862 -4.9493 {"}'M' greentint -9.4781 1.6779 -4.1552 {"}'M' greentint -9.613 1.7727 -4.3561 {"}'M' greentint -9.7719 1.7759 -4.562 {"}'M' greentint -9.9321 1.6848 -4.7449 {"}'M' greentint -10.0735 1.5143 -4.8805 {"}'M' greentint -10.0801 1.3604 -5.1893 {"}'M' greentint -9.3645 1.8719 -4.4065 {"}'M' greentint -9.5161 1.9074 -4.6116 {"}'M' greentint -9.6774 1.8682 -4.8095 {"}'M' greentint -9.8341 1.7562 -4.9809 {"}'M' greentint -9.9726 1.5815 -5.1116 {"}'M' greentint -9.3879 1.9584 -4.8599 {"}'M' greentint -9.5461 1.8946 -5.0462 {"}'M' greentint -9.6964 1.7702 -5.206 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 479 A}'M' green -9.682 1.4626 -4.0379 {"}'M' green -9.439 1.7144 -4.1579 {"}'M' green -10.103 1.3667 -5.2357 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 479 A}'M' greentint -10.1322 1.1059 -4.5206 {"}'M' greentint -9.9742 1.1799 -4.3368 {"}'M' greentint -9.8223 1.3006 -4.1739 {"}'M' greentint -10.1866 1.1889 -4.9777 {"}'M' greentint -10.0294 1.1843 -4.7721 {"}'M' greentint -9.8668 1.24 -4.578 {"}'M' greentint -9.7089 1.3503 -4.4045 {"}'M' greentint -9.5636 1.512 -4.2615 {"}'M' greentint -9.955 1.3197 -5.0312 {"}'M' greentint -9.7958 1.3422 -4.8307 {"}'M' greentint -9.6361 1.4307 -4.6497 {"}'M' greentint -9.4894 1.5803 -4.5021 {"}'M' greentint -9.3657 1.7801 -4.3974 {"}'M' greentint -9.8364 1.5016 -5.1857 {"}'M' greentint -9.6775 1.5127 -4.9848 {"}'M' greentint -9.5205 1.6085 -4.8075 {"}'M' greentint -9.3821 1.7791 -4.6759 {"}'M' greentint -9.7021 1.7095 -5.2615 {"}'M' greentint -9.5389 1.7387 -5.0588 {"}'M' greentint -9.3891 1.8924 -4.908 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n his A 516 1tg7A_518F_547}P -11.9738 -1.7459 1.2485 {"}-11.9738 -1.7459 1.2485 { ca his A 516 1tg7A_518F_547}-10.9186 -1.9885 0.2734 { c his A 516 1tg7A_518F_547}-10.7186 -0.858 -0.7246 { o his A 516 1tg7A_518F_547}-11.5141 0.0767 -0.7949 { c his A 516 1tg7A_518F_547}P -10.7186 -0.858 -0.7246 { n glu A 517 1tg7A_518F_547}-9.6486 -0.9614 -1.5011 { ca glu A 517 1tg7A_518F_547}-9.3266 0.0561 -2.4878 { c glu A 517 1tg7A_518F_547}-8.4733 -0.542 -3.5996 { o glu A 517 1tg7A_518F_547}-7.6719 -1.4476 -3.3621 { c glu A 517 1tg7A_518F_547}P -8.4733 -0.542 -3.5996 { n phe A 518 1tg7A_518F_547}-8.6726 -0.0592 -4.8212 { ca phe A 518 1tg7A_518F_547}-7.8745 -0.5133 -5.9491 { c phe A 518 1tg7A_518F_547}-7.6369 0.6806 -6.8572 { o phe A 518 1tg7A_518F_547}-8.2942 1.7138 -6.7166 { c phe A 518 1tg7A_518F_547}P -7.6369 0.6806 -6.8572 { n ala A 519 1tg7A_518F_547}-6.6755 0.5555 -7.7618 { ca ala A 519 1tg7A_518F_547}-6.3568 1.6454 -8.6703 { c ala A 519 1tg7A_518F_547}-6.0331 1.0982 -10.0511 { o ala A 519 1tg7A_518F_547}-5.4007 0.0473 -10.1824 { c ala A 519 1tg7A_518F_547}P -6.0331 1.0982 -10.0511 { n val A 520 1tg7A_518F_547}-6.4795 1.8133 -11.0791 { ca val A 520 1tg7A_518F_547}-6.2478 1.4135 -12.4603 { c val A 520 1tg7A_518F_547}-5.395 2.4711 -13.1527 { o val A 520 1tg7A_518F_547}-5.7932 3.6337 -13.26 { n leu A 545 1tg7A_518F_547}P -6.5742 5.9043 -11.5408 {"}-6.5742 5.9043 -11.5408 { ca leu A 545 1tg7A_518F_547}-7.9049 6.1833 -11.0138 { c leu A 545 1tg7A_518F_547}-8.0862 5.261 -9.8104 { o leu A 545 1tg7A_518F_547}-8.0311 4.0362 -9.9408 { c leu A 545 1tg7A_518F_547}P -8.0862 5.261 -9.8104 { n val A 546 1tg7A_518F_547}-8.2842 5.8577 -8.6399 { ca val A 546 1tg7A_518F_547}-8.4489 5.0944 -7.4075 { c val A 546 1tg7A_518F_547}-9.9165 4.9218 -7.0362 { o val A 546 1tg7A_518F_547}-10.6928 5.8759 -7.0778 { c val A 546 1tg7A_518F_547}P -9.9165 4.9218 -7.0362 { n val A 547 1tg7A_518F_547}-10.2846 3.6949 -6.6783 { ca val A 547 1tg7A_518F_547}-11.6543 3.3781 -6.2856 { c val A 547 1tg7A_518F_547}-11.6743 2.6936 -4.9229 { o val A 547 1tg7A_518F_547}-11.0075 1.6796 -4.72 { c val A 547 1tg7A_518F_547}P -11.6743 2.6936 -4.9229 { n ala A 548 1tg7A_518F_547}-12.432 3.2634 -3.9918 { ca ala A 548 1tg7A_518F_547}-12.5593 2.709 -2.6499 { c ala A 548 1tg7A_518F_547}-13.9628 2.1365 -2.4997 { o ala A 548 1tg7A_518F_547}-14.9199 2.6695 -3.0683 { c ala A 548 1tg7A_518F_547}P -13.9628 2.1365 -2.4997 { n trp A 549 1tg7A_518F_547}-14.0864 1.0529 -1.7378 { ca trp A 549 1tg7A_518F_547}-15.3771 0.4079 -1.5313 { c trp A 549 1tg7A_518F_547}-15.4258 -0.4123 -0.2469 { o trp A 549 1tg7A_518F_547}-14.3884 -0.754 0.3211 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n his A 516 1tg7A_518F_547}P -11.9738 -1.7459 1.2485 { ca his A 516 1tg7A_518F_547}P -10.9186 -1.9885 0.2734 { n glu A 517 1tg7A_518F_547}P -9.6486 -0.9614 -1.5011 { ca glu A 517 1tg7A_518F_547}P -9.3266 0.0561 -2.4878 { n phe A 518 1tg7A_518F_547}P -8.6726 -0.0592 -4.8212 { ca phe A 518 1tg7A_518F_547}P -7.8745 -0.5133 -5.9491 { n ala A 519 1tg7A_518F_547}P -6.6755 0.5555 -7.7618 { ca ala A 519 1tg7A_518F_547}P -6.3568 1.6454 -8.6703 { n val A 520 1tg7A_518F_547}P -6.4795 1.8133 -11.0791 { ca val A 520 1tg7A_518F_547}P -6.2478 1.4135 -12.4603 { n leu A 545 1tg7A_518F_547}P -6.5742 5.9043 -11.5408 { ca leu A 545 1tg7A_518F_547}P -7.9049 6.1833 -11.0138 { n val A 546 1tg7A_518F_547}P -8.2842 5.8577 -8.6399 { ca val A 546 1tg7A_518F_547}P -8.4489 5.0944 -7.4075 { n val A 547 1tg7A_518F_547}P -10.2846 3.6949 -6.6783 { ca val A 547 1tg7A_518F_547}P -11.6543 3.3781 -6.2856 { n ala A 548 1tg7A_518F_547}P -12.432 3.2634 -3.9918 { ca ala A 548 1tg7A_518F_547}P -12.5593 2.709 -2.6499 { n trp A 549 1tg7A_518F_547}P -14.0864 1.0529 -1.7378 { ca trp A 549 1tg7A_518F_547}P -15.3771 0.4079 -1.5313 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca his A 516 1tg7A_518F_547}P -10.9186 -1.9885 0.2734 {"}-10.9186 -1.9885 0.2734 { ca glu A 517 1tg7A_518F_547}-9.3266 0.0561 -2.4878 { ca phe A 518 1tg7A_518F_547}-7.8745 -0.5133 -5.9491 { ca ala A 519 1tg7A_518F_547}-6.3568 1.6454 -8.6703 { ca val A 520 1tg7A_518F_547}-6.2478 1.4135 -12.4603 { ca leu A 545 1tg7A_518F_547}P -7.9049 6.1833 -11.0138 {"}-7.9049 6.1833 -11.0138 { ca val A 546 1tg7A_518F_547}-8.4489 5.0944 -7.4075 { ca val A 547 1tg7A_518F_547}-11.6543 3.3781 -6.2856 { ca ala A 548 1tg7A_518F_547}-12.5593 2.709 -2.6499 { ca trp A 549 1tg7A_518F_547}-15.3771 0.4079 -1.5313 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 518 1tg7A_518F_547}P -7.8745 -0.5133 -5.9491 { cb phe A 518 1tg7A_518F_547}-8.5495 -1.6813 -6.699 { cg phe A 518 1tg7A_518F_547}-9.8431 -1.3319 -7.3916 { cd1 phe A 518 1tg7A_518F_547}-9.8447 -0.8445 -8.6961 { ce1 phe A 518 1tg7A_518F_547}-11.0484 -0.5769 -9.3618 { cz phe A 518 1tg7A_518F_547}-12.2598 -0.7956 -8.7152 { cg phe A 518 1tg7A_518F_547}P -9.8431 -1.3319 -7.3916 { cd2 phe A 518 1tg7A_518F_547}-11.063 -1.5418 -6.757 { ce2 phe A 518 1tg7A_518F_547}-12.2686 -1.2769 -7.4109 { cz phe A 518 1tg7A_518F_547}ghost -12.2598 -0.7956 -8.7152 { ca val A 547 1tg7A_518F_547}P -11.6543 3.3781 -6.2856 { cb val A 547 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contact} { CD1 PHE 518 A}'S' blue -10.9073 0.1607 -7.7361 {"}'S' blue -10.7624 0.3614 -7.8214 {"}'S' blue -10.5625 0.5257 -7.8779 { CD2 PHE 518 A}'S' blue -11.475 0.1582 -6.7034 {"}'S' blue -11.1302 0.2059 -6.684 {"}'S' sky -11.2918 0.1885 -6.8888 {"}'S' sky -11.1134 0.1769 -7.0833 {"}'S' blue -11.0677 0.0735 -7.4295 { CE1 PHE 518 A}'S' sky -11.1004 0.3471 -7.8767 {"}'S' blue -11.6862 0.9542 -8.8041 {"}'S' sky -10.856 0.4277 -7.9422 {"}'S' sky -11.2816 1.0057 -8.6524 {"}'S' blue -11.5854 1.0611 -9.0615 {"}'S' blue -11.7458 1.0249 -9.2588 {"}'S' blue -10.7679 0.8026 -8.3226 {"}'S' blue -10.8805 0.9403 -8.5063 { CE2 PHE 518 A}'S' blue -12.9864 0.0933 -6.5927 {"}'S' sky -13.1407 0.1109 -6.7973 {"}'S' sky -13.302 0.0731 -6.9955 {"}'S' blue -13.4606 -0.0176 -7.1761 {"}'S' blue -12.7534 0.2199 -6.6448 {"}'S' sky -12.9064 0.2541 -6.8532 {"}'S' sky -13.2302 0.1765 -7.2491 {"}'S' blue -13.3888 0.0675 -7.4239 {"}'S' sky -12.6496 0.3554 -6.9065 {"}'S' sky -13.1266 0.2464 -7.4926 {"}'S' sky -12.6806 0.4231 -7.3574 {"}'S' sky -11.295 0.1612 -7.198 { CZ PHE 518 A}'S' blue -13.3224 0.2097 -7.7552 {"}'S' sky -13.4853 0.2019 -7.9624 {"}'S' blue -13.6487 0.1056 -8.1466 {"}'S' sky -13.0347 0.3439 -7.6369 {"}'S' sky -13.1775 0.4104 -7.8405 {"}'S' sky -13.3352 0.4103 -8.044 {"}'S' sky -13.496 0.3461 -8.2337 {"}'S' blue -13.6492 0.2189 -8.397 {"}'S' sky -12.8353 0.5042 -7.695 {"}'S' sky -12.9776 0.5746 -7.897 {"}'S' sky -13.1319 0.5923 -8.1016 {"}'S' sky -13.2932 0.5545 -8.2998 {"}'S' blue -13.4517 0.4638 -8.4804 {"}'S' blue -13.0586 0.7205 -8.3605 {"}'S' blue -13.2214 0.6579 -8.5533 {"}'S' sky -12.6718 0.9045 -8.6617 {"}'S' blue -12.4886 0.9347 -8.8471 {"}'S' blue -12.6525 0.8781 -9.0427 {"}'S' blue -12.1481 0.9466 -8.8389 {"}'S' blue -12.3102 0.9231 -9.0415 {"}'S' blue -12.4738 0.8617 -9.2357 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 518 A}'S' green -11.1722 0.5471 -8.0257 {"}'S' green -11.2711 0.7128 -8.2004 {"}'S' green -11.3933 0.8391 -8.3928 {"}'S' sea -11.5332 0.92 -8.5957 {"}'S' sea -10.931 0.6225 -8.0925 {"}'S' sea -11.0286 0.7864 -8.2651 {"}'S' sea -11.1462 0.9155 -8.4535 { CE2 PHE 518 A}'S' sea -13.0674 0.2392 -7.0562 {"}'S' sea -12.8055 0.361 -7.1106 {"}'S' sea -12.9659 0.3248 -7.3079 {"}'S' sea -12.2286 0.3432 -6.7504 {"}'S' sea -12.3711 0.4091 -6.9533 {"}'S' sea -12.523 0.4363 -7.1568 {"}'S' sea -11.8981 0.2887 -6.7219 {"}'S' green -12.0324 0.3871 -6.9229 {"}'S' green -12.1792 0.4478 -7.1305 {"}'S' green -12.3358 0.4708 -7.3379 {"}'S' green -11.713 0.3069 -6.9174 {"}'S' green -11.505 0.2601 -7.0685 {"}'S' green -11.4298 0.2588 -7.3995 { CZ PHE 518 A}'S' green -12.4824 0.4941 -7.5538 {"}'S' green -12.6047 0.6204 -7.7463 {"}'S' green -12.7445 0.7013 -7.9491 {"}'S' sea -12.8975 0.7355 -8.1575 {"}'S' green -12.4929 0.787 -8.0058 {"}'S' green -12.6408 0.8368 -8.2108 {"}'S' sea -12.7967 0.8424 -8.4149 {"}'S' green -12.3623 0.8905 -8.2576 {"}'S' sea -12.5142 0.9176 -8.4611 {"}'S' green -12.1704 0.9292 -8.4348 {"}'S' sea -12.327 0.9522 -8.6422 {"}'S' green -11.3908 0.3215 -7.6868 {"}'S' green -11.8421 0.8793 -8.4241 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 518 A}'S' P -11.8509 0.3979 -7.1199 {"}'S' -11.853 0.3861 -7.1217 {"}'S' P -12 0.4509 -7.3272 {"}'S' -12.0059 0.4096 -7.3292 {"}'S' P -11.6421 0.351 -7.2715 {"}'S' -11.6426 0.3502 -7.2719 {"}'S' P -11.7908 0.4048 -7.4784 {"}'S' -11.7995 0.3758 -7.4768 { CZ PHE 518 A}'S' P -12.2399 0.5677 -7.6186 {"}'S' -12.2408 0.5354 -7.6448 {"}'S' P -12.3575 0.6968 -7.807 {"}'S' -12.356 0.6666 -7.8254 {"}'S' P -11.9792 0.5839 -7.676 {"}'S' -11.9924 0.5154 -7.728 {"}'S' P -12.0919 0.7216 -7.8597 {"}'S' -12.1005 0.6397 -7.9058 {"}'S' P -12.2198 0.8246 -8.0547 {"}'S' -12.2214 0.7769 -8.0751 {"}'S' P -11.6705 0.4699 -7.6603 {"}'S' -11.6861 0.4364 -7.6877 {"}'S' P -11.7706 0.6363 -7.8351 {"}'S' -11.7966 0.5598 -7.8823 {"}'S' P -11.8892 0.77 -8.0261 {"}'S' -11.9087 0.6883 -8.0614 {"}'S' P -12.0236 0.8684 -8.2271 {"}'S' -12.0287 0.8313 -8.2377 {"}'S' P -11.4769 0.5073 -7.8486 {"}'S' -11.4831 0.4959 -7.8562 {"}'S' P -11.5819 0.6636 -8.0278 {"}'S' -11.5995 0.6253 -8.0465 {"}'S' P -11.7042 0.7882 -8.2217 {"}'S' -11.7143 0.7595 -8.2307 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 547 A}'S' sky -12.6457 0.7443 -7.0309 {"}'S' blue -12.4835 0.7678 -6.8283 {"}'S' sky -13.0121 0.987 -8.0058 {"}'S' sky -12.8686 1.0844 -8.2762 {"}'S' sky -12.7072 1.2373 -8.5246 {"}'S' blue -12.4856 1.3302 -8.6546 {"}'S' sky -12.1636 1.2356 -8.569 { CG1 VAL 547 A}'S' blue -13.5901 0.3634 -6.8215 {"}'S' blue -13.4263 0.4014 -6.6217 {"}'S' blue -13.645 0.4214 -7.3233 {"}'S' sky -13.4927 0.3937 -7.1191 {"}'S' sky -13.3351 0.4054 -6.9183 {"}'S' sky -13.1747 0.4558 -6.726 {"}'S' blue -13.0166 0.5443 -6.5455 {"}'S' blue -13.4324 0.4919 -7.4589 {"}'S' sky -13.2792 0.4657 -7.2538 {"}'S' sky -12.9592 0.5407 -6.8609 {"}'S' blue -12.8012 0.6406 -6.6849 {"}'S' sky -13.3336 0.646 -7.7334 {"}'S' sky -13.1872 0.5872 -7.5267 {"}'S' sky -13.0294 0.5755 -7.3203 {"}'S' sky -12.8673 0.6135 -7.1211 {"}'S' sky -12.7059 0.6986 -6.9353 {"}'S' sky -13.2265 0.8574 -7.9701 {"}'S' sky -13.0937 0.7614 -7.7719 {"}'S' sky -12.9435 0.7194 -7.5672 {"}'S' sky -12.785 0.7313 -7.3653 { CG2 VAL 547 A}'S' blue -12.6265 1.3751 -8.7737 {"}'S' blue -12.3599 1.3596 -8.8535 {"}'S' blue -12.1031 1.3892 -8.9434 {"}'S' blue -11.9455 1.4009 -8.7426 {"}'S' blue -11.89 1.4605 -9.0785 {"}'S' blue -11.731 1.4773 -8.877 {"}'S' blue -11.6398 1.571 -9.1446 { HB VAL 547 A}'S' sky -12.5982 0.7004 -7.4089 {"}'S' sky -11.7825 0.5445 -6.7215 {"}'S' blue -11.2267 0.5928 -6.8803 {"}'S' blue -11.0644 0.6108 -7.0845 {"}'S' blue -11.7566 1.2145 -8.5154 {"}'S' blue -11.4901 1.3255 -8.508 {"}'S' sky -11.0385 0.6531 -7.7373 {"}'S' blue -10.8824 0.7485 -7.5628 {"}'S' blue -10.8802 0.8661 -7.8241 {"}'S' blue -11.0238 1.2193 -8.2514 {"}'S' sky -10.9188 1.063 -8.0722 {HG11 VAL 547 A}'S' blue -13.6777 0.4106 -7.4544 {"}'S' blue -13.8971 0.4409 -8.1132 {"}'S' sky -13.7413 0.4166 -7.905 {"}'S' sky -13.5781 0.4656 -7.7085 {"}'S' blue -13.7949 0.6486 -8.3473 {"}'S' sky -13.6577 0.5736 -8.1479 {"}'S' sky -13.5014 0.5843 -7.9486 {"}'S' blue -13.64 0.8715 -8.4394 {"}'S' sky -13.5066 0.7687 -8.2388 {"}'S' sky -13.3431 0.7973 -8.0354 {"}'S' blue -13.3816 0.9942 -8.2835 {HG21 VAL 547 A}'S' blue -12.8781 1.2888 -9.1441 {"}'S' blue -12.7195 1.3532 -8.9574 {"}'S' blue -12.6179 1.2905 -9.2399 {"}'S' blue -12.4599 1.3762 -9.059 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 547 A}'S' sea -12.8903 0.8616 -7.8123 {"}'S' sea -12.7528 0.7698 -7.6103 {"}'S' sea -12.7587 0.9353 -8.092 {"}'S' green -12.632 0.8197 -7.8958 {"}'S' sea -12.6144 1.0676 -8.3572 {"}'S' green -12.5034 0.9284 -8.1737 {"}'S' sea -12.3988 1.1511 -8.4918 {"}'S' green -12.2894 1.0051 -8.3105 { CG1 VAL 547 A}'S' sea -13.1206 0.4818 -7.0527 { HB VAL 547 A}'S' green -12.4694 0.5987 -7.2147 {"}'S' green -12.3222 0.5557 -7.0122 {"}'S' sea -12.1648 0.5736 -6.8131 {"}'S' green -12.505 0.6664 -7.689 {"}'S' green -12.3897 0.5348 -7.5029 {"}'S' green -11.941 0.458 -6.9029 {"}'S' green -12.4186 0.8166 -8.0511 {"}'S' green -11.6364 0.434 -6.9341 {"}'S' green -12.2433 0.9667 -8.297 {"}'S' green -11.5348 0.3712 -7.2166 {"}'S' sea -11.3768 0.457 -7.0356 {"}'S' green -11.5307 0.3856 -7.6244 {"}'S' sea -11.3725 0.4033 -7.4259 {"}'S' green -11.7373 0.9721 -8.4234 {"}'S' sea -11.2785 0.4854 -7.6937 {"}'S' sea -11.4897 1.0814 -8.4397 {"}'S' green -11.4346 0.8701 -8.3111 {"}'S' green -11.332 0.7173 -8.136 {"}'S' green -11.1949 0.6423 -7.9366 {"}'S' sea -11.245 1.1487 -8.3735 {"}'S' green -11.1772 0.9402 -8.2281 {"}'S' sea -11.0437 0.8375 -8.0275 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 547 A}'S' P -12.2523 0.4533 -7.3035 {"}'S' -12.2492 0.461 -7.3044 {"}'S' P -12.1004 0.4275 -7.1002 {"}'S' -12.099 0.4324 -7.1011 {"}'S' P -12.3374 0.6342 -7.8951 {"}'S' -12.3128 0.6721 -7.8735 {"}'S' P -12.2286 0.4935 -7.716 {"}'S' -12.2049 0.5444 -7.6986 {"}'S' P -12.0979 0.3992 -7.521 {"}'S' -12.0887 0.4285 -7.5167 {"}'S' P -11.9506 0.3575 -7.3187 {"}'S' -11.9444 0.3986 -7.3213 {"}'S' P -11.7951 0.3695 -7.1208 {"}'S' -11.7949 0.375 -7.1218 {"}'S' P -12.187 0.755 -8.1665 {"}'S' -12.168 0.7885 -8.1311 {"}'S' P -12.0993 0.5789 -8.0031 {"}'S' -12.0703 0.6554 -7.9519 {"}'S' P -11.9832 0.4471 -7.8177 {"}'S' -11.9648 0.534 -7.7816 {"}'S' P -11.8466 0.3657 -7.6176 {"}'S' -11.8423 0.415 -7.6076 {"}'S' P -11.6942 0.3408 -7.4138 {"}'S' -11.6949 0.3574 -7.4134 {"}'S' P -11.9801 0.8785 -8.3425 {"}'S' -11.9786 0.8815 -8.3378 {"}'S' P -11.909 0.6822 -8.1971 {"}'S' -11.8997 0.7332 -8.1465 {"}'S' P -11.8064 0.5294 -8.0221 {"}'S' -11.8019 0.6081 -7.9706 {"}'S' P -11.678 0.4286 -7.8269 {"}'S' -11.6816 0.4887 -7.8028 {"}'S' P -11.6728 0.7632 -8.2808 {"}'S' -11.6739 0.7723 -8.2707 {"}'S' P -11.5691 0.6045 -8.1028 {"}'S' -11.5742 0.6333 -8.0805 {"}'S' P -11.4342 0.5096 -7.9019 {"}'S' -11.4342 0.5113 -7.9005 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 518 A}'M' greentint -9.6099 1.9985 -6.3327 {"}'M' greentint -9.2044 2.4275 -5.9276 {"}'M' greentint -9.3676 2.3941 -6.1295 {"}'M' greentint -9.5162 2.2372 -6.278 {"}'M' greentint -9.6199 2.1408 -6.5755 {"}'M' greentint -9.0604 2.6326 -5.9896 {"}'M' greentint -9.2184 2.6243 -6.1916 {"}'M' greentint -9.377 2.5311 -6.3701 {"}'M' greentint -9.5162 2.3631 -6.5032 {"}'M' greentint -9.5895 2.2349 -6.8202 {"}'M' greentint -9.6607 1.9897 -6.8445 {"}'M' greentint -8.8753 2.8027 -6.0556 {"}'M' greentint -9.0314 2.8134 -6.2595 {"}'M' greentint -9.1916 2.7551 -6.4515 {"}'M' greentint -9.3464 2.6321 -6.6162 {"}'M' greentint -9.4821 2.4545 -6.7423 {"}'M' greentint -9.5117 2.3151 -7.0585 {"}'M' greentint -9.5929 2.0719 -7.0969 {"}'M' greentint -8.7882 2.9568 -6.3016 {"}'M' greentint -8.9482 2.9328 -6.5029 {"}'M' greentint -9.1107 2.8512 -6.6893 {"}'M' greentint -9.263 2.7152 -6.8492 {"}'M' greentint -9.3996 2.5336 -6.974 {"}'M' greentint -9.3972 2.3598 -7.2882 {"}'M' greentint -8.6947 3.0473 -6.5704 {"}'M' greentint -8.8538 2.9962 -6.7626 {"}'M' greentint -9.0096 2.8974 -6.9359 {"}'M' greentint -9.1558 2.7539 -7.0858 {"}'M' greentint -9.2866 2.5719 -7.2042 {"}'M' greentint -8.8539 2.9247 -7.1411 {"}'M' greentint -9.0006 2.7776 -7.2909 {"}'M' greentint -9.1327 2.5947 -7.4109 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 547 A}'M' greentint -9.4663 2.063 -6.1632 {"}'M' greentint -9.325 2.2138 -6.0216 {"}'M' greentint -9.2044 2.4081 -5.9199 {"}'M' greentint -9.6649 1.9265 -6.8101 {"}'M' greentint -9.5106 1.9258 -6.611 {"}'M' greentint -9.3524 1.9895 -6.4247 {"}'M' greentint -9.2021 2.114 -6.2649 {"}'M' greentint -9.069 2.2896 -6.1418 {"}'M' greentint -8.9638 2.5042 -6.064 {"}'M' greentint -8.8903 2.744 -6.0371 {"}'M' greentint -9.46 1.9848 -6.962 {"}'M' greentint -9.3018 1.987 -6.7583 {"}'M' greentint -9.1411 2.063 -6.5714 {"}'M' greentint -8.9916 2.2084 -6.419 {"}'M' greentint 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-7.919 {"}'S' sky -11.3464 -0.5688 -8.6173 {"}'S' sky -10.8708 -0.5723 -8.0025 {"}'S' blue -10.7081 -0.4966 -7.8127 {"}'S' blue -11.2307 -0.4855 -8.9054 {"}'S' sky -11.0895 -0.5523 -8.7041 {"}'S' sky -10.6192 -0.518 -8.1068 {"}'S' blue -10.4612 -0.4294 -7.9263 {"}'S' blue -11.0188 -0.4138 -9.0424 {"}'S' sky -10.8769 -0.4818 -8.8397 {"}'S' sky -10.4037 -0.433 -8.2417 {"}'S' blue -10.6317 -0.3865 -8.9075 {"}'S' sky -10.4739 -0.3982 -8.7011 {"}'S' sky -10.3118 -0.3602 -8.5018 {"}'S' blue -10.1505 -0.2751 -8.3161 {"}'S' blue -10.388 -0.2544 -8.948 {"}'S' sky -10.2295 -0.2424 -8.7461 {"}'S' blue -10.0683 -0.176 -8.5563 {"}'S' blue -10.1166 -0.075 -8.9171 {HG21 VAL 569 A}'S' blue -11.39 -0.5174 -8.9502 {"}'S' blue -11.2277 -0.4853 -9.1594 {HG23 VAL 569 A}'S' blue -11.5866 -0.6156 -7.0826 {"}'S' blue -11.4272 -0.5851 -6.8854 {"}'S' blue -11.5841 -0.644 -7.5034 {"}'S' sky -11.4368 -0.6856 -7.3011 {"}'S' sky -11.1227 -0.6092 -6.9165 {"}'S' blue -10.9697 -0.4931 -6.7511 {"}'S' sky -11.3328 -0.6774 -7.6 {"}'S' blue -10.713 -0.4503 -6.8627 {"}'S' blue -11.1642 -0.6145 -7.8094 {"}'S' blue -10.5506 -0.4324 -7.067 {"}'S' sky -10.7647 -0.5577 -7.6762 {"}'S' sky -10.6014 -0.5088 -7.4796 @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 569 A}'S' sea -11.194 -0.6097 -8.41 {"}'S' sea -11.0346 -0.6104 -8.2023 {"}'S' sea -10.9372 -0.5801 -8.4999 {"}'S' sea -10.7796 -0.5683 -8.2991 {"}'S' sea -10.7237 -0.508 -8.6346 {"}'S' sea -10.5651 -0.4919 -8.4335 {HG23 VAL 569 A}'S' sea -11.2813 -0.6737 -7.1032 {"}'S' sea -11.1804 -0.7024 -7.3963 {"}'S' sea -11.0211 -0.6719 -7.1991 {"}'S' sea -10.8631 -0.5862 -7.0181 {"}'S' sea -11.0169 -0.6576 -7.6068 {"}'S' sea -10.8587 -0.6398 -7.4083 {"}'S' sea -10.701 -0.5638 -7.2255 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 620 A}'M' greentint -9.1318 1.9111 -6.3104 {"}'M' greentint -9.2754 1.8034 -6.5829 {"}'M' greentint -8.8699 2.2324 -6.1778 {"}'M' greentint -9.0331 2.199 -6.3797 {"}'M' greentint -9.1817 2.0421 -6.5281 {"}'M' greentint -9.2854 1.9457 -6.8256 {"}'M' greentint -9.342 1.6962 -6.8289 {"}'M' greentint -8.7259 2.4375 -6.2398 {"}'M' greentint -8.8839 2.4291 -6.4418 {"}'M' greentint -9.0425 2.336 -6.6202 {"}'M' greentint -9.1817 2.168 -6.7534 {"}'M' greentint -9.255 2.0398 -7.0704 {"}'M' greentint -9.3262 1.7946 -7.0946 {"}'M' greentint -8.6969 2.6183 -6.5097 {"}'M' greentint -8.8571 2.56 -6.7017 {"}'M' greentint -9.0119 2.4369 -6.8663 {"}'M' greentint -9.1476 2.2594 -6.9925 {"}'M' greentint -9.1772 2.12 -7.3087 {"}'M' greentint -8.6141 2.7382 -6.7538 {"}'M' greentint -8.7762 2.6561 -6.9394 {"}'M' greentint -8.9285 2.5201 -7.0994 {"}'M' greentint -9.0651 2.3385 -7.2242 {"}'M' greentint -8.5193 2.8011 -7.0127 {"}'M' greentint -8.6751 2.7023 -7.1861 {"}'M' greentint -8.8213 2.5588 -7.336 {"}'M' greentint -8.9521 2.3768 -7.4544 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 569 A}'M' greentint -9.3103 1.6858 -6.6926 {"}'M' greentint -9.1521 1.7495 -6.5063 {"}'M' greentint -9.0019 1.8739 -6.3465 {"}'M' greentint -8.8687 2.0495 -6.2234 {"}'M' greentint -8.7635 2.2642 -6.1456 {"}'M' greentint -9.2597 1.7447 -7.0436 {"}'M' greentint -9.1015 1.747 -6.8399 {"}'M' greentint -8.9409 1.8229 -6.653 {"}'M' greentint -8.7913 1.9683 -6.5006 {"}'M' greentint -8.6668 2.1683 -6.3948 {"}'M' greentint -8.5782 2.4059 -6.3468 {"}'M' greentint -9.1566 1.9074 -7.2987 {"}'M' greentint -9.0078 1.8578 -7.0926 {"}'M' greentint -8.8455 1.9027 -6.8946 {"}'M' greentint -8.6913 2.0353 -6.7329 {"}'M' greentint -8.567 2.2387 -6.6283 {"}'M' greentint -8.4887 2.4843 -6.5962 {"}'M' greentint -8.4678 2.7397 -6.6395 {"}'M' greentint -9.0286 2.143 -7.4612 {"}'M' greentint -8.8968 2.0413 -7.263 {"}'M' greentint -8.7358 2.0693 -7.063 {"}'M' greentint -8.5878 2.2213 -6.9142 {"}'M' greentint -8.493 2.4554 -6.8568 {"}'M' greentint -8.4767 2.7091 -6.9062 {"}'M' greentint -8.8675 2.4143 -7.4944 {"}'M' greentint -8.7633 2.2591 -7.3165 {"}'M' greentint -8.6034 2.356 -7.1371 {"}'M' greentint -8.5484 2.6093 -7.1369 {"}'M' greentint -8.6817 2.5057 -7.3364 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 620 A}'M' green -9.6588 0.8209 -4.5433 {"}'M' green -9.5772 1.0674 -4.5631 {"}'M' green -9.4437 1.2853 -4.6166 {"}'M' green -9.8609 0.4661 -5.1914 {"}'M' green -9.4141 1.4583 -4.8892 {"}'M' green -9.8111 0.5406 -5.4906 {"}'M' green -9.3197 1.5507 -5.1366 {"}'M' green -9.577 1.0624 -5.734 {"}'M' green -9.4718 1.277 -5.6563 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 620 A}'M' greentint -9.7921 0.7172 -4.7428 {"}'M' greentint -9.7371 0.9705 -4.7425 {"}'M' greentint -9.8475 0.8711 -5.0228 {"}'M' greentint -9.8638 0.6174 -4.9735 {"}'M' greentint -9.6047 1.2572 -4.8166 {"}'M' greentint -9.7527 1.1053 -4.9655 {"}'M' greentint -9.8192 0.9686 -5.2764 {"}'M' greentint -9.8696 0.7139 -5.2718 {"}'M' greentint -9.5744 1.3672 -5.072 {"}'M' greentint -9.7158 1.1967 -5.2076 {"}'M' greentint -9.7224 1.0429 -5.5164 {"}'M' greentint -9.7906 0.7939 -5.5341 {"}'M' greentint -9.4763 1.4386 -5.308 {"}'M' greentint -9.6149 1.2639 -5.4388 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 569 A}'M' green -9.8757 0.6221 -4.6114 {"}'M' green -9.7537 0.8187 -4.5084 {"}'M' green -9.6554 1.0435 -4.4424 {"}'M' green -9.9026 0.5097 -4.978 {"}'M' green -9.4724 1.3587 -4.659 {"}'M' green -9.8712 0.6721 -5.5583 {"}'M' green -9.7326 0.8982 -5.6323 {"}'M' green -9.4711 1.5447 -5.4739 {"}'M' green -9.6244 1.1961 -5.6926 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 569 A}'M' greentint -9.7572 0.6715 -4.835 {"}'M' greentint -9.6326 0.8739 -4.7314 {"}'M' greentint -9.5362 1.107 -4.6716 {"}'M' greentint -9.8298 0.5902 -5.2232 {"}'M' greentint -9.683 0.7398 -5.0757 {"}'M' greentint -9.5593 0.9395 -4.9709 {"}'M' greentint -9.4675 1.1737 -4.9176 {"}'M' greentint -9.4155 1.4246 -4.9192 {"}'M' greentint -9.7142 0.768 -5.381 {"}'M' greentint -9.5757 0.9386 -5.2494 {"}'M' greentint -9.4728 1.1621 -5.1786 {"}'M' greentint -9.4184 1.4118 -5.1783 {"}'M' greentint -9.5828 1.0519 -5.4815 {"}'M' greentint -9.4875 1.2882 -5.424 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 803 1tqwA_836F_805}P -7.5082 9.124 -10.4763 {"}-7.5082 9.124 -10.4763 { ca ile A 803 1tqwA_836F_805}-8.6529 8.2779 -10.1304 { c ile A 803 1tqwA_836F_805}-8.2552 7.1287 -9.251 { o ile A 803 1tqwA_836F_805}-7.171 6.5241 -9.4084 { c ile A 803 1tqwA_836F_805}P -8.2552 7.1287 -9.251 { n phe A 804 1tqwA_836F_805}-9.1235 6.8171 -8.2699 { ca phe A 804 1tqwA_836F_805}-8.9541 5.6173 -7.4416 { c phe A 804 1tqwA_836F_805}-10.3423 5.1979 -6.9738 { o phe A 804 1tqwA_836F_805}-11.3004 5.9591 -7.1685 { c phe A 804 1tqwA_836F_805}P -10.3423 5.1979 -6.9738 { n tyr A 805 1tqwA_836F_805}-10.4533 4.0126 -6.3936 { ca tyr A 805 1tqwA_836F_805}-11.7439 3.4955 -5.9479 { c tyr A 805 1tqwA_836F_805}-11.6244 3.0454 -4.5232 { o tyr A 805 1tqwA_836F_805}-10.5998 2.4346 -4.1318 { c tyr A 805 1tqwA_836F_805}P -11.6244 3.0454 -4.5232 { n thr A 806 1tqwA_836F_805}-12.6581 3.3439 -3.7297 { ca thr A 806 1tqwA_836F_805}-12.7091 2.8972 -2.3167 { c thr A 806 1tqwA_836F_805}-14.1156 2.3479 -2.0938 { o thr A 806 1tqwA_836F_805}-15.0637 2.6765 -2.8357 { c thr A 806 1tqwA_836F_805}P -14.1156 2.3479 -2.0938 { n asp A 807 1tqwA_836F_805}-14.2821 1.4849 -1.1041 { ca asp A 807 1tqwA_836F_805}-15.612 0.9788 -0.8462 { c asp A 807 1tqwA_836F_805}-16.3849 1.7717 0.1737 { o asp A 807 1tqwA_836F_805}-15.8621 2.5793 0.9551 { n gly A 834 1tqwA_836F_805}P -11.8088 -2.1406 1.154 {"}-11.8088 -2.1406 1.154 { ca gly A 834 1tqwA_836F_805}-10.8689 -2.267 0.0375 { c gly A 834 1tqwA_836F_805}-10.7582 -1.0104 -0.7748 { o gly A 834 1tqwA_836F_805}-11.5537 -0.0615 -0.6791 { c gly A 834 1tqwA_836F_805}P -10.7582 -1.0104 -0.7748 { n met A 835 1tqwA_836F_805}-9.6972 -1.0047 -1.6004 { ca met A 835 1tqwA_836F_805}-9.4158 0.1218 -2.4812 { c met A 835 1tqwA_836F_805}-8.6332 -0.388 -3.6704 { o met A 835 1tqwA_836F_805}-7.9524 -1.4163 -3.6057 { c met A 835 1tqwA_836F_805}P -8.6332 -0.388 -3.6704 { n phe A 836 1tqwA_836F_805}-8.7456 0.3485 -4.7971 { ca phe A 836 1tqwA_836F_805}-7.9408 -0.0573 -5.9883 { c phe A 836 1tqwA_836F_805}-7.6659 1.101 -6.8766 { o phe A 836 1tqwA_836F_805}-8.3092 2.1422 -6.852 { c phe A 836 1tqwA_836F_805}P -7.6659 1.101 -6.8766 { n ile A 837 1tqwA_836F_805}-6.5925 0.9087 -7.6589 { ca ile A 837 1tqwA_836F_805}-6.2347 1.8343 -8.7756 { c ile A 837 1tqwA_836F_805}-6.0786 0.9637 -10.004 { o ile A 837 1tqwA_836F_805}-5.7447 -0.2205 -9.9301 { c ile A 837 1tqwA_836F_805}P -6.0786 0.9637 -10.004 { n glu A 838 1tqwA_836F_805}-6.338 1.5976 -11.1747 { ca glu A 838 1tqwA_836F_805}-6.1748 0.8658 -12.4253 { c glu A 838 1tqwA_836F_805}-5.9331 1.7946 -13.6004 { o glu A 838 1tqwA_836F_805}-6.1844 2.9921 -13.5457 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 803 1tqwA_836F_805}P -7.5082 9.124 -10.4763 { ca ile A 803 1tqwA_836F_805}P -8.6529 8.2779 -10.1304 { n phe A 804 1tqwA_836F_805}P -9.1235 6.8171 -8.2699 { ca phe A 804 1tqwA_836F_805}P -8.9541 5.6173 -7.4416 { n tyr A 805 1tqwA_836F_805}P -10.4533 4.0126 -6.3936 { ca tyr A 805 1tqwA_836F_805}P -11.7439 3.4955 -5.9479 { n thr A 806 1tqwA_836F_805}P -12.6581 3.3439 -3.7297 { ca thr A 806 1tqwA_836F_805}P -12.7091 2.8972 -2.3167 { n asp A 807 1tqwA_836F_805}P -14.2821 1.4849 -1.1041 { ca asp A 807 1tqwA_836F_805}P -15.612 0.9788 -0.8462 { n gly A 834 1tqwA_836F_805}P -11.8088 -2.1406 1.154 { ca gly A 834 1tqwA_836F_805}P -10.8689 -2.267 0.0375 {"}P -10.8689 -2.267 0.0375 { n met A 835 1tqwA_836F_805}P -9.6972 -1.0047 -1.6004 { ca met A 835 1tqwA_836F_805}P -9.4158 0.1218 -2.4812 { n phe A 836 1tqwA_836F_805}P -8.7456 0.3485 -4.7971 { ca phe A 836 1tqwA_836F_805}P -7.9408 -0.0573 -5.9883 { n ile A 837 1tqwA_836F_805}P -6.5925 0.9087 -7.6589 { ca ile A 837 1tqwA_836F_805}P -6.2347 1.8343 -8.7756 { n glu A 838 1tqwA_836F_805}P -6.338 1.5976 -11.1747 { ca glu A 838 1tqwA_836F_805}P -6.1748 0.8658 -12.4253 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 803 1tqwA_836F_805}P -8.6529 8.2779 -10.1304 {"}-8.6529 8.2779 -10.1304 { ca phe A 804 1tqwA_836F_805}-8.9541 5.6173 -7.4416 { ca tyr A 805 1tqwA_836F_805}-11.7439 3.4955 -5.9479 { ca thr A 806 1tqwA_836F_805}-12.7091 2.8972 -2.3167 { ca asp A 807 1tqwA_836F_805}-15.612 0.9788 -0.8462 { ca gly A 834 1tqwA_836F_805}P -10.8689 -2.267 0.0375 {"}-10.8689 -2.267 0.0375 { ca met A 835 1tqwA_836F_805}-9.4158 0.1218 -2.4812 { ca phe A 836 1tqwA_836F_805}-7.9408 -0.0573 -5.9883 { ca ile A 837 1tqwA_836F_805}-6.2347 1.8343 -8.7756 { ca glu A 838 1tqwA_836F_805}-6.1748 0.8658 -12.4253 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 805 1tqwA_836F_805}P -11.7439 3.4955 -5.9479 { cb tyr A 805 1tqwA_836F_805}-12.2012 2.3027 -6.7962 { cg tyr A 805 1tqwA_836F_805}-12.4325 2.677 -8.2505 { cd1 tyr A 805 1tqwA_836F_805}-11.3342 2.8985 -9.1359 { ce1 tyr A 805 1tqwA_836F_805}-11.5885 3.2918 -10.4703 { cz tyr A 805 1tqwA_836F_805}-12.8921 3.427 -10.9072 { oh tyr A 805 1tqwA_836F_805}-13.1204 3.7388 -12.2423 { cg tyr A 805 1tqwA_836F_805}P -12.4325 2.677 -8.2505 { cd2 tyr A 805 1tqwA_836F_805}-13.7198 2.8387 -8.7275 { ce2 tyr A 805 1tqwA_836F_805}-13.9782 3.2095 -10.0864 { cz tyr A 805 1tqwA_836F_805}ghost -12.8921 3.427 -10.9072 { ca phe A 836 1tqwA_836F_805}P -7.9408 -0.0573 -5.9883 { cb phe A 836 1tqwA_836F_805}-8.5718 -1.2578 -6.7357 { cg phe A 836 1tqwA_836F_805}-9.9195 -1.0341 -7.3931 { cd1 phe A 836 1tqwA_836F_805}-10.0144 -0.482 -8.7083 { ce1 phe A 836 1tqwA_836F_805}-11.2788 -0.3674 -9.34 { cz phe A 836 1tqwA_836F_805}-12.4122 -0.7987 -8.6939 { cg phe A 836 1tqwA_836F_805}P -9.9195 -1.0341 -7.3931 { cd2 phe A 836 1tqwA_836F_805}-11.1141 -1.4446 -6.7568 { ce2 phe A 836 1tqwA_836F_805}-12.3389 -1.3312 -7.404 { cz phe A 836 1tqwA_836F_805}ghost -12.4122 -0.7987 -8.6939 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-9.7364 {"}'S' -11.0264 1.2994 -9.7309 {"}'S' P -10.871 1.2584 -9.5313 {"}'S' -10.8797 1.2874 -9.5242 {"}'S' P -10.7124 1.2745 -9.3302 {"}'S' -10.7146 1.2805 -9.3295 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 836 A}'M' green -9.6249 2.4269 -6.4681 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 836 A}'M' greentint -9.3224 2.6234 -6.014 {"}'M' greentint -9.4813 2.5346 -6.1956 {"}'M' greentint -9.085 2.7561 -5.8617 {"}'M' greentint -9.2193 2.8559 -6.063 {"}'M' greentint -9.3826 2.8225 -6.2648 {"}'M' greentint -9.5312 2.6656 -6.4133 {"}'M' greentint -9.6349 2.5693 -6.7108 {"}'M' greentint -8.9376 2.9817 -5.9253 {"}'M' greentint -9.0754 3.061 -6.125 {"}'M' greentint -9.2333 3.0527 -6.327 {"}'M' greentint -9.3919 2.9595 -6.5054 {"}'M' greentint -9.5312 2.7915 -6.6386 {"}'M' greentint -8.7511 3.1528 -5.9898 {"}'M' greentint -8.8902 3.2311 -6.191 {"}'M' greentint -9.0464 3.2418 -6.3948 {"}'M' greentint -9.2066 3.1835 -6.5868 {"}'M' greentint -9.3613 3.0605 -6.7515 {"}'M' greentint -9.4971 2.8829 -6.8777 {"}'M' greentint -8.8031 3.3852 -6.4369 {"}'M' greentint -8.9636 3.3618 -6.6389 {"}'M' greentint -9.1257 3.2796 -6.8246 {"}'M' greentint -9.2779 3.1436 -6.9846 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 805 A}'M' greentint -9.6212 2.5447 -6.7359 {"}'M' greentint -9.4798 2.4717 -6.5329 {"}'M' greentint -9.3216 2.4739 -6.3291 {"}'M' greentint -9.1609 2.5498 -6.1423 {"}'M' greentint -9.0114 2.6952 -5.9899 {"}'M' greentint -8.8868 2.8952 -5.884 {"}'M' greentint -9.4927 2.7713 -6.9761 {"}'M' greentint -9.3766 2.6343 -6.7879 {"}'M' greentint -9.2279 2.5847 -6.5818 {"}'M' greentint -9.0655 2.6296 -6.3839 {"}'M' greentint -8.9113 2.7622 -6.2221 {"}'M' greentint -8.7871 2.9656 -6.1175 {"}'M' greentint -8.7088 3.2112 -6.0854 {"}'M' greentint -9.3153 3.0752 -7.0935 {"}'M' greentint -9.2486 2.8699 -6.9504 {"}'M' greentint -9.1169 2.7682 -6.7522 {"}'M' greentint -8.9559 2.7962 -6.5523 {"}'M' greentint -8.8079 2.9482 -6.4034 {"}'M' greentint -8.713 3.1823 -6.3461 {"}'M' greentint -9.0876 3.1412 -6.9836 {"}'M' greentint -8.9834 2.986 -6.8058 {"}'M' greentint -8.8234 3.0829 -6.6263 {"}'M' greentint -8.7685 3.3362 -6.6261 {"}'M' greentint -8.9017 3.2326 -6.8256 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 836 A}'M' greentint -10.1057 1.322 -4.3098 {"}'M' greentint -10.239 1.2184 -4.5093 {"}'M' greentint -9.9199 1.4134 -4.1518 {"}'M' greentint -10.0241 1.5686 -4.3297 {"}'M' greentint -10.184 1.4717 -4.5091 {"}'M' greentint -10.2944 1.3723 -4.7894 {"}'M' greentint -9.6922 1.4794 -4.042 {"}'M' greentint -9.7588 1.6847 -4.185 {"}'M' greentint -9.8906 1.7864 -4.3832 {"}'M' greentint -10.0516 1.7584 -4.5832 {"}'M' greentint -10.1996 1.6064 -4.732 {"}'M' greentint -10.2661 1.4697 -5.043 {"}'M' greentint -9.4741 1.6869 -4.0801 {"}'M' greentint -9.5673 1.8615 -4.2489 {"}'M' greentint -9.7022 1.9563 -4.4498 {"}'M' greentint -9.861 1.9595 -4.6557 {"}'M' greentint -10.0213 1.8684 -4.8386 {"}'M' greentint -10.1627 1.6979 -4.9742 {"}'M' greentint -9.3254 1.9464 -4.3035 {"}'M' greentint -9.4536 2.0555 -4.5002 {"}'M' greentint -9.6053 2.091 -4.7053 {"}'M' greentint -9.7666 2.0518 -4.9032 {"}'M' greentint -9.9232 1.9398 -5.0746 {"}'M' greentint -10.0618 1.7651 -5.2053 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 805 A}'M' green -10.325 1.2647 -4.8494 {"}'M' green -10.0703 1.7449 -5.2295 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 805 A}'M' greentint -10.1788 1.2014 -4.6436 {"}'M' greentint -10.0216 1.1968 -4.4379 {"}'M' greentint -9.859 1.2525 -4.2438 {"}'M' greentint -9.7012 1.3627 -4.0703 {"}'M' greentint -10.2208 1.4917 -5.0954 {"}'M' greentint -10.0952 1.3792 -4.9015 {"}'M' greentint -9.9472 1.3322 -4.697 {"}'M' greentint -9.788 1.3546 -4.4965 {"}'M' greentint -9.6283 1.4432 -4.3155 {"}'M' greentint -9.4816 1.5928 -4.1679 {"}'M' greentint -9.967 1.5909 -5.053 {"}'M' greentint -9.8286 1.5141 -4.8515 {"}'M' greentint -9.6698 1.5251 -4.6506 {"}'M' greentint -9.5127 1.621 -4.4733 {"}'M' greentint -9.3743 1.7916 -4.3417 {"}'M' greentint -9.8272 1.8255 -5.1275 {"}'M' greentint -9.6943 1.722 -4.9273 {"}'M' greentint -9.5311 1.7512 -4.7246 {"}'M' greentint -9.3814 1.9049 -4.5738 {"}'M' greentint -9.5816 1.9518 -4.9625 {"}'M' greentint -9.4229 2.0491 -4.7849 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 85 1ty9A_87F_185F}P -12.4186 -1.8054 0.5329 {"}-12.4186 -1.8054 0.5329 { ca val A 85 1ty9A_87F_185F}-11.081 -2.1183 -0.0044 { c val A 85 1ty9A_87F_185F}-10.8303 -1.099 -1.1145 { o val A 85 1ty9A_87F_185F}-11.7569 -0.5261 -1.6573 { c val A 85 1ty9A_87F_185F}P -10.8303 -1.099 -1.1145 { n val A 86 1ty9A_87F_185F}-9.5819 -0.9022 -1.4901 { ca val A 86 1ty9A_87F_185F}-9.2113 0.1927 -2.3375 { c val A 86 1ty9A_87F_185F}-8.3345 -0.4353 -3.4137 { o val A 86 1ty9A_87F_185F}-7.5369 -1.3105 -3.0808 { c val A 86 1ty9A_87F_185F}P -8.3345 -0.4353 -3.4137 { n phe A 87 1ty9A_87F_185F}-8.5641 -0.0848 -4.6808 { ca phe A 87 1ty9A_87F_185F}-7.6027 -0.4405 -5.7548 { c phe A 87 1ty9A_87F_185F}-7.3839 0.7283 -6.7564 { o phe A 87 1ty9A_87F_185F}-8.1262 1.7156 -6.7728 { c phe A 87 1ty9A_87F_185F}P -7.3839 0.7283 -6.7564 { n ser A 88 1ty9A_87F_185F}-6.3723 0.601 -7.6038 { ca ser A 88 1ty9A_87F_185F}-6.1202 1.6548 -8.5917 { c ser A 88 1ty9A_87F_185F}-6.2356 1.0433 -9.9992 { o ser A 88 1ty9A_87F_185F}-5.9838 -0.1283 -10.184 { c ser A 88 1ty9A_87F_185F}P -6.2356 1.0433 -9.9992 { n thr A 89 1ty9A_87F_185F}-6.5964 1.8478 -11.0023 { ca thr A 89 1ty9A_87F_185F}-6.7399 1.3639 -12.3748 { c thr A 89 1ty9A_87F_185F}-6.7624 2.5679 -13.2956 { o thr A 89 1ty9A_87F_185F}-6.4192 3.6817 -12.8688 { n cys A 183 1ty9A_87F_185F}P -6.5472 6.3801 -11.7885 {"}-6.5472 6.3801 -11.7885 { ca cys A 183 1ty9A_87F_185F}-7.5908 6.6716 -10.7659 { c cys A 183 1ty9A_87F_185F}-7.684 5.5839 -9.6744 { o cys A 183 1ty9A_87F_185F}-7.0922 4.5037 -9.7726 { c cys A 183 1ty9A_87F_185F}P -7.684 5.5839 -9.6744 { n val A 184 1ty9A_87F_185F}-8.3218 5.9324 -8.57 { ca val A 184 1ty9A_87F_185F}-8.3308 5.064 -7.4322 { c val A 184 1ty9A_87F_185F}-9.8313 4.877 -7.089 { o val A 184 1ty9A_87F_185F}-10.6216 5.8413 -7.0786 { c val A 184 1ty9A_87F_185F}P -9.8313 4.877 -7.089 { n phe A 185 1ty9A_87F_185F}-10.2284 3.6373 -6.8601 { ca phe A 185 1ty9A_87F_185F}-11.6244 3.3385 -6.5176 { c phe A 185 1ty9A_87F_185F}-11.6977 2.7839 -5.119 { o phe A 185 1ty9A_87F_185F}-10.8165 2.0077 -4.7183 { c phe A 185 1ty9A_87F_185F}P -11.6977 2.7839 -5.119 { n glu A 186 1ty9A_87F_185F}-12.7475 3.1252 -4.3642 { ca glu A 186 1ty9A_87F_185F}-12.9899 2.4082 -3.1272 { c glu A 186 1ty9A_87F_185F}-14.2327 1.5516 -3.3554 { o glu A 186 1ty9A_87F_185F}-15.2802 2.0402 -3.7878 { c glu A 186 1ty9A_87F_185F}P -14.2327 1.5516 -3.3554 { n leu A 187 1ty9A_87F_185F}-14.095 0.2722 -3.0683 { ca leu A 187 1ty9A_87F_185F}-15.2139 -0.6042 -3.1194 { c leu A 187 1ty9A_87F_185F}-15.851 -0.6118 -1.7242 { o leu A 187 1ty9A_87F_185F}-15.3413 -1.2235 -0.775 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 85 1ty9A_87F_185F}P -12.4186 -1.8054 0.5329 { ca val A 85 1ty9A_87F_185F}P -11.081 -2.1183 -0.0044 { n val A 86 1ty9A_87F_185F}P -9.5819 -0.9022 -1.4901 { ca val A 86 1ty9A_87F_185F}P -9.2113 0.1927 -2.3375 { n phe A 87 1ty9A_87F_185F}P -8.5641 -0.0848 -4.6808 { ca phe A 87 1ty9A_87F_185F}P -7.6027 -0.4405 -5.7548 { n ser A 88 1ty9A_87F_185F}P -6.3723 0.601 -7.6038 { ca ser A 88 1ty9A_87F_185F}P -6.1202 1.6548 -8.5917 { n thr A 89 1ty9A_87F_185F}P -6.5964 1.8478 -11.0023 { ca thr A 89 1ty9A_87F_185F}P -6.7399 1.3639 -12.3748 { n cys A 183 1ty9A_87F_185F}P -6.5472 6.3801 -11.7885 { ca cys A 183 1ty9A_87F_185F}P -7.5908 6.6716 -10.7659 { n val A 184 1ty9A_87F_185F}P -8.3218 5.9324 -8.57 { ca val A 184 1ty9A_87F_185F}P -8.3308 5.064 -7.4322 { n phe A 185 1ty9A_87F_185F}P -10.2284 3.6373 -6.8601 { ca phe A 185 1ty9A_87F_185F}P -11.6244 3.3385 -6.5176 { n glu A 186 1ty9A_87F_185F}P -12.7475 3.1252 -4.3642 { ca glu A 186 1ty9A_87F_185F}P -12.9899 2.4082 -3.1272 { n leu A 187 1ty9A_87F_185F}P -14.095 0.2722 -3.0683 { ca leu A 187 1ty9A_87F_185F}P -15.2139 -0.6042 -3.1194 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 85 1ty9A_87F_185F}P -11.081 -2.1183 -0.0044 {"}-11.081 -2.1183 -0.0044 { ca val A 86 1ty9A_87F_185F}-9.2113 0.1927 -2.3375 { ca phe A 87 1ty9A_87F_185F}-7.6027 -0.4405 -5.7548 { ca ser A 88 1ty9A_87F_185F}-6.1202 1.6548 -8.5917 { ca thr A 89 1ty9A_87F_185F}-6.7399 1.3639 -12.3748 { ca cys A 183 1ty9A_87F_185F}P -7.5908 6.6716 -10.7659 {"}-7.5908 6.6716 -10.7659 { ca val A 184 1ty9A_87F_185F}-8.3308 5.064 -7.4322 { ca phe A 185 1ty9A_87F_185F}-11.6244 3.3385 -6.5176 { ca glu A 186 1ty9A_87F_185F}-12.9899 2.4082 -3.1272 { ca leu A 187 1ty9A_87F_185F}-15.2139 -0.6042 -3.1194 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 87 1ty9A_87F_185F}P -7.6027 -0.4405 -5.7548 { cb phe A 87 1ty9A_87F_185F}-8.0548 -1.7269 -6.5064 { cg phe A 87 1ty9A_87F_185F}-9.3437 -1.5639 -7.244 { cd1 phe A 87 1ty9A_87F_185F}-10.5534 -1.7322 -6.5776 { ce1 phe A 87 1ty9A_87F_185F}-11.7687 -1.5379 -7.2526 { cz phe A 87 1ty9A_87F_185F}-11.7893 -1.1958 -8.5857 { cg phe A 87 1ty9A_87F_185F}P -9.3437 -1.5639 -7.244 { cd2 phe A 87 1ty9A_87F_185F}-9.3768 -1.2201 -8.5929 { ce2 phe A 87 1ty9A_87F_185F}-10.6004 -1.0618 -9.2727 { cz phe A 87 1ty9A_87F_185F}ghost -11.7893 -1.1958 -8.5857 { ca phe A 185 1ty9A_87F_185F}P -11.6244 3.3385 -6.5176 { cb phe A 185 1ty9A_87F_185F}-12.1452 2.2272 -7.4389 { cg phe A 185 1ty9A_87F_185F}-12.6386 2.7188 -8.762 { cd1 phe A 185 1ty9A_87F_185F}-13.8876 3.3449 -8.8708 { ce1 phe A 185 1ty9A_87F_185F}-14.3287 3.8188 -10.1081 { cz phe A 185 1ty9A_87F_185F}-13.5278 3.5988 -11.2959 { cg phe A 185 1ty9A_87F_185F}P -12.6386 2.7188 -8.762 { cd2 phe A 185 1ty9A_87F_185F}-11.8581 2.5599 -9.9078 { ce2 phe A 185 1ty9A_87F_185F}-12.2917 3.0082 -11.1805 { cz phe A 185 1ty9A_87F_185F}ghost -13.5278 3.5988 -11.2959 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 87 1ty9A_87F_185F}P -8.0548 -1.7269 -6.5064 {"}P -8.0548 -1.7269 -6.5064 { cd1 phe A 87 1ty9A_87F_185F}P -10.5534 -1.7322 -6.5776 { cd2 phe A 87 1ty9A_87F_185F}P -9.3768 -1.2201 -8.5929 { ce1 phe A 87 1ty9A_87F_185F}P -11.7687 -1.5379 -7.2526 { ce2 phe A 87 1ty9A_87F_185F}P -10.6004 -1.0618 -9.2727 { cz phe A 87 1ty9A_87F_185F}P -11.7893 -1.1958 -8.5857 { cb phe A 185 1ty9A_87F_185F}P -12.1452 2.2272 -7.4389 {"}P -12.1452 2.2272 -7.4389 { cd1 phe A 185 1ty9A_87F_185F}P -13.8876 3.3449 -8.8708 { cd2 phe A 185 1ty9A_87F_185F}P -11.8581 2.5599 -9.9078 { ce1 phe A 185 1ty9A_87F_185F}P -14.3287 3.8188 -10.1081 { ce2 phe A 185 1ty9A_87F_185F}P -12.2917 3.0082 -11.1805 { cz phe A 185 1ty9A_87F_185F}P -13.5278 3.5988 -11.2959 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 87 A}'S' blue -12.3057 0.1 -6.9523 {"}'S' blue -11.8712 0.1481 -6.7949 {"}'S' blue -12.0231 0.1753 -6.9985 {"}'S' sky -12.1808 0.1621 -7.199 {"}'S' blue -12.3416 0.1096 -7.3915 {"}'S' sky -11.6794 0.1868 -6.9722 {"}'S' sky -11.836 0.2098 -7.1795 {"}'S' sky -11.9976 0.1924 -7.3844 {"}'S' sky -11.3511 0.1369 -6.9615 {"}'S' sky -11.1423 0.09 -7.1132 {"}'S' sky -11.0776 0.0573 -7.4479 { CE2 PHE 87 A}'S' blue -10.7242 0.0621 -7.9366 {"}'S' sky -10.8231 0.2278 -8.1113 {"}'S' sky -11.2382 0.4693 -8.715 {"}'S' blue -10.5806 0.3015 -8.1761 {"}'S' sky -10.6981 0.4306 -8.3645 {"}'S' sky -10.8336 0.5208 -8.5633 {"}'S' blue -10.9815 0.5706 -8.7683 {"}'S' blue -11.2978 0.5399 -9.1697 {"}'S' blue -11.4585 0.4615 -9.3544 {"}'S' blue -10.5605 0.5584 -8.6122 {"}'S' blue -11.0125 0.6383 -9.2192 {"}'S' blue -11.1733 0.5857 -9.4116 {"}'S' blue -11.3306 0.496 -9.5907 {"}'S' blue -10.8292 0.6685 -9.4046 {"}'S' blue -10.9932 0.6118 -9.6003 {"}'S' blue -11.1543 0.5181 -9.782 {"}'S' blue -10.6509 0.6569 -9.599 {"}'S' blue -10.8145 0.5955 -9.7932 { CZ PHE 87 A}'S' blue -12.3648 0.104 -7.5655 {"}'S' blue -12.5071 0.1744 -7.7675 {"}'S' blue -12.6614 0.1921 -7.9721 {"}'S' sky -12.1341 0.2201 -7.6168 {"}'S' sky -12.427 0.3353 -8.028 {"}'S' blue -12.5881 0.3203 -8.231 {"}'S' blue -12.4866 0.406 -8.4827 {"}'S' sky -12.2013 0.5043 -8.5322 {"}'S' blue -12.0181 0.5345 -8.7176 {"}'S' sky -11.0064 0.107 -7.7191 {"}'S' sky -11.6776 0.5464 -8.7094 {"}'S' sky -10.9035 0.215 -8.0508 {"}'S' sky -11.3115 0.4859 -8.6532 {"}'S' blue -11.794 0.4195 -9.2582 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 87 A}'S' sea -11.5002 0.1899 -7.1688 {"}'S' sea -11.6571 0.2042 -7.3763 {"}'S' sea -11.2909 0.1438 -7.3201 {"}'S' sea -11.4485 0.161 -7.5275 { CE2 PHE 87 A}'S' sea -10.9453 0.3541 -8.3038 {"}'S' sea -11.0852 0.4351 -8.5066 { CZ PHE 87 A}'S' sea -12.274 0.3011 -7.8196 {"}'S' green -11.887 0.2966 -7.6775 {"}'S' green -12.0224 0.3868 -7.8763 {"}'S' sea -12.1703 0.4366 -8.0813 {"}'S' sea -12.3262 0.4422 -8.2854 {"}'S' sea -11.5087 0.1837 -7.5465 {"}'S' green -11.6214 0.3214 -7.7302 {"}'S' green -11.7493 0.4244 -7.9252 {"}'S' green -11.8918 0.4903 -8.1281 {"}'S' sea -12.0437 0.5174 -8.3316 {"}'S' green -11.3 0.2361 -7.7056 {"}'S' green -11.6999 0.529 -8.3053 {"}'S' sea -11.8565 0.552 -8.5127 {"}'S' green -11.1114 0.2634 -7.8983 {"}'S' green -11.2337 0.388 -8.0922 {"}'S' green -11.3716 0.4791 -8.2946 {"}'S' sea -11.5207 0.5321 -8.502 {"}'S' sea -11.0257 0.3413 -8.2433 {"}'S' sea -11.1628 0.4322 -8.4463 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 87 A}'S' P -11.4187 0.3698 -7.8967 {"}'S' -11.4192 0.3676 -7.8968 {"}'S' P -11.5531 0.4682 -8.0976 {"}'S' -11.5542 0.4621 -8.0994 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 185 A}'S' blue -12.4603 0.5294 -7.1573 {"}'S' blue -12.2981 0.5529 -6.9547 {"}'S' blue -12.7049 0.6467 -7.9388 {"}'S' sky -12.5674 0.5548 -7.7368 {"}'S' sky -12.4187 0.5011 -7.5299 {"}'S' sky -12.2615 0.4847 -7.3214 {"}'S' sky -12.0994 0.5068 -7.1186 {"}'S' blue -11.937 0.5676 -6.9242 {"}'S' blue -12.5733 0.7204 -8.2185 {"}'S' sky -11.9928 0.4848 -7.4019 {"}'S' blue -12.429 0.8526 -8.4836 {"}'S' sky -12.3172 0.7133 -8.3008 {"}'S' sky -12.104 0.7901 -8.437 {"}'S' sky -11.8676 0.8728 -8.5121 { CD2 PHE 185 A}'S' blue -11.8482 0.9471 -9.2289 {"}'S' blue -11.5419 0.8555 -9.6711 {"}'S' blue -11.3791 0.9313 -9.4813 {"}'S' blue -11.2208 1.0451 -9.308 {"}'S' blue -11.4507 0.8595 -9.9677 {"}'S' blue -11.2903 0.9099 -9.7754 {"}'S' blue -11.1322 0.9984 -9.5949 {"}'S' blue -10.9799 1.1226 -9.4322 {"}'S' blue -11.0748 0.9948 -9.9103 { HB2 PHE 185 A}'S' blue -11.7526 0.5609 -7.0381 {"}'S' sky -11.5288 0.4454 -7.1279 {"}'S' blue -11.3704 0.5319 -6.9465 {"}'S' sky -11.2243 0.4213 -7.159 {"}'S' sky -11.1227 0.3586 -7.4416 {"}'S' blue -10.9647 0.4443 -7.2606 {"}'S' sky -11.5679 0.8659 -8.5675 {"}'S' sky -10.9603 0.3907 -7.6508 {"}'S' sky -11.2606 0.7506 -8.5057 {"}'S' sky -10.8663 0.4728 -7.9187 {"}'S' sky -11.0224 0.8575 -8.5361 {"}'S' sky -10.9198 0.7047 -8.361 {"}'S' sky -10.7827 0.6297 -8.1615 {"}'S' blue -10.6264 0.6405 -7.9623 {"}'S' blue -10.765 0.9276 -8.4531 {"}'S' blue -10.6316 0.8249 -8.2524 { HD2 PHE 185 A}'S' blue -10.8356 1.1241 -9.5053 {"}'S' blue -10.7249 1.084 -9.7806 {"}'S' blue -10.5667 1.1478 -9.5943 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 185 A}'S' sea -12.4466 0.6047 -8.0222 {"}'S' sea -12.3045 0.5263 -7.817 {"}'S' sea -12.1522 0.4855 -7.6097 {"}'S' sea -12.1888 0.6097 -8.1051 {"}'S' green -12.0477 0.5429 -7.9038 {"}'S' sea -11.977 0.6814 -8.2421 { HB2 PHE 185 A}'S' sea -11.8401 0.4407 -7.5284 {"}'S' sea -11.6882 0.4149 -7.3251 {"}'S' green -11.9252 0.6216 -8.1201 {"}'S' green -11.8164 0.4809 -7.941 {"}'S' green -11.6857 0.3865 -7.7459 {"}'S' green -11.5384 0.3449 -7.5436 {"}'S' sea -11.3829 0.3569 -7.3457 {"}'S' sea -11.7748 0.7424 -8.3915 {"}'S' green -11.6872 0.5662 -8.2281 {"}'S' green -11.4344 0.3531 -7.8425 {"}'S' green -11.2821 0.3281 -7.6388 {"}'S' green -11.4968 0.6695 -8.4221 {"}'S' green -11.3942 0.5168 -8.247 {"}'S' green -11.2658 0.416 -8.0519 {"}'S' green -11.1185 0.3729 -7.8493 {"}'S' sea -11.157 0.5918 -8.3278 {"}'S' sea -11.0221 0.497 -8.1269 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 PHE 185 A}'S' P -11.571 0.4345 -8.0426 {"}'S' -11.5698 0.4422 -8.0394 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 87 A}'M' greentint -9.4419 2.0003 -6.3889 {"}'M' greentint -9.1997 2.3959 -6.1857 {"}'M' greentint -9.3483 2.239 -6.3342 {"}'M' greentint -9.452 2.1427 -6.6317 {"}'M' greentint -9.5085 1.8932 -6.6349 {"}'M' greentint -9.0504 2.6261 -6.2479 {"}'M' greentint -9.209 2.5329 -6.4263 {"}'M' greentint -9.3482 2.3649 -6.5594 {"}'M' greentint -9.4216 2.2367 -6.8765 {"}'M' greentint -9.4927 1.9916 -6.9007 {"}'M' greentint -8.8634 2.8152 -6.3157 {"}'M' greentint -9.0236 2.7569 -6.5077 {"}'M' greentint -9.1784 2.6339 -6.6724 {"}'M' greentint -9.3141 2.4563 -6.7985 {"}'M' greentint -9.3437 2.3169 -7.1147 {"}'M' greentint -9.4249 2.0737 -7.1531 {"}'M' greentint -8.7803 2.9346 -6.5591 {"}'M' greentint -8.9427 2.853 -6.7455 {"}'M' greentint -9.095 2.717 -6.9055 {"}'M' greentint -9.2316 2.5355 -7.0303 {"}'M' greentint -9.2292 2.3616 -7.3444 {"}'M' greentint -9.3148 2.1268 -7.3889 {"}'M' greentint -8.6858 2.998 -6.8188 {"}'M' greentint -8.8417 2.8992 -6.9921 {"}'M' greentint -8.9878 2.7557 -7.142 {"}'M' greentint -9.1186 2.5737 -7.2604 {"}'M' greentint -9.0782 2.3834 -7.5531 {"}'M' greentint -8.6859 2.9266 -7.1973 {"}'M' greentint -8.8326 2.7794 -7.3471 {"}'M' greentint -8.9647 2.5965 -7.4671 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 185 A}'M' greentint -9.4343 1.9862 -6.4129 {"}'M' greentint -9.293 2.137 -6.2713 {"}'M' greentint -9.1724 2.3312 -6.1696 {"}'M' greentint -9.4786 1.8489 -6.8608 {"}'M' greentint -9.3204 1.9127 -6.6744 {"}'M' greentint -9.1702 2.0371 -6.5146 {"}'M' greentint -9.037 2.2127 -6.3915 {"}'M' greentint -8.9318 2.4273 -6.3138 {"}'M' greentint -8.8583 2.6671 -6.2869 {"}'M' greentint -9.428 1.9079 -7.2118 {"}'M' greentint -9.2698 1.9101 -7.008 {"}'M' greentint -9.1091 1.9861 -6.8212 {"}'M' greentint -8.9596 2.1315 -6.6688 {"}'M' greentint -8.835 2.3314 -6.5629 {"}'M' greentint -8.7464 2.569 -6.5149 {"}'M' greentint -8.7019 2.8238 -6.5276 {"}'M' greentint -9.1761 2.021 -7.2607 {"}'M' greentint -9.0138 2.0659 -7.0628 {"}'M' greentint -8.8596 2.1985 -6.901 {"}'M' greentint -8.7353 2.4018 -6.7964 {"}'M' greentint -8.657 2.6475 -6.7643 {"}'M' greentint -8.636 2.9029 -6.8076 {"}'M' greentint -9.0651 2.2045 -7.4311 {"}'M' greentint -8.9041 2.2325 -7.2312 {"}'M' greentint -8.7561 2.3845 -7.0823 {"}'M' greentint -8.6613 2.6186 -7.025 {"}'M' greentint -8.645 2.8723 -7.0743 {"}'M' greentint -8.9316 2.4223 -7.4847 {"}'M' greentint -8.7717 2.5192 -7.3052 {"}'M' greentint -8.7167 2.7725 -7.305 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 87 A}'M' green -10.0667 0.8364 -4.4054 {"}'M' green -10.2267 0.7395 -4.5848 {"}'M' green -10.337 0.6401 -4.8651 {"}'M' green -9.8015 0.9525 -4.2607 {"}'M' green -10.3088 0.7375 -5.1187 {"}'M' green -10.2119 0.8118 -5.3587 {"}'M' green -9.4962 1.3233 -4.5759 {"}'M' green -9.5197 1.4097 -5.0293 {"}'M' green -9.6779 1.346 -5.2156 {"}'M' green -9.8282 1.2216 -5.3754 {"}'M' green -9.9613 1.046 -5.4985 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 87 A}'M' greentint -9.9332 1.0542 -4.4589 {"}'M' greentint -10.0942 1.0262 -4.6589 {"}'M' greentint -10.2422 0.8742 -4.8077 {"}'M' greentint -9.7448 1.2241 -4.5255 {"}'M' greentint -9.9037 1.2272 -4.7314 {"}'M' greentint -10.0639 1.1362 -4.9143 {"}'M' greentint -10.2053 0.9656 -5.0499 {"}'M' greentint -9.6479 1.3588 -4.781 {"}'M' greentint -9.8092 1.3196 -4.9789 {"}'M' greentint -9.9658 1.2076 -5.1503 {"}'M' greentint -10.1044 1.0328 -5.281 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 185 A}'M' sea -10.499 0.6675 -4.9696 {"}'M' green -10.3411 0.6914 -4.7729 {"}'M' green -9.8909 1.0481 -4.2903 {"}'M' green -10.3954 0.7744 -5.2301 {"}'M' green -9.6478 1.2999 -4.4103 {"}'M' green -9.5745 1.3656 -4.6498 {"}'M' green -10.0452 1.0872 -5.4381 {"}'M' sea -9.9109 1.295 -5.5138 {"}'M' green -9.7478 1.3242 -5.3112 {"}'M' green -9.598 1.4779 -5.1604 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 185 A}'M' greentint -10.183 0.7654 -4.5891 {"}'M' greentint -10.0312 0.8861 -4.4263 {"}'M' greentint -10.2382 0.7698 -5.0245 {"}'M' greentint -10.0756 0.8255 -4.8303 {"}'M' greentint -9.9178 0.9358 -4.6569 {"}'M' greentint -9.7724 1.0975 -4.5139 {"}'M' greentint -10.1639 0.9052 -5.2836 {"}'M' greentint -10.0047 0.9277 -5.0831 {"}'M' greentint -9.8449 1.0162 -4.9021 {"}'M' greentint -9.6982 1.1658 -4.7545 {"}'M' greentint -9.8864 1.0982 -5.2372 {"}'M' greentint -9.7294 1.1941 -5.0598 {"}'M' greentint -9.5909 1.3646 -4.9283 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 32 1tyjA_34Y_91R}P -10.1011 -3.3613 0.0516 {"}-10.1011 -3.3613 0.0516 { ca ser A 32 1tyjA_34Y_91R}-10.6196 -2.0322 0.4271 { c ser A 32 1tyjA_34Y_91R}-10.5074 -0.9747 -0.6845 { o ser A 32 1tyjA_34Y_91R}-10.99 0.1563 -0.5103 { c ser A 32 1tyjA_34Y_91R}P -10.5074 -0.9747 -0.6845 { n gly A 33 1tyjA_34Y_91R}-9.8573 -1.3028 -1.7972 { ca gly A 33 1tyjA_34Y_91R}-9.7202 -0.3062 -2.8388 { c gly A 33 1tyjA_34Y_91R}-8.7343 -0.6751 -3.9139 { o gly A 33 1tyjA_34Y_91R}-7.9211 -1.5898 -3.7421 { c gly A 33 1tyjA_34Y_91R}P -8.7343 -0.6751 -3.9139 { n tyr A 34 1tyjA_34Y_91R}-8.8017 0.0332 -5.0306 { ca tyr A 34 1tyjA_34Y_91R}-7.8953 -0.2641 -6.1693 { c tyr A 34 1tyjA_34Y_91R}-7.5572 1.011 -6.8869 { o tyr A 34 1tyjA_34Y_91R}-8.2447 2.0418 -6.7409 { c tyr A 34 1tyjA_34Y_91R}P -7.5572 1.011 -6.8869 { n gln A 35 1tyjA_34Y_91R}-6.5207 0.9243 -7.7062 { ca gln A 35 1tyjA_34Y_91R}-6.2619 1.9239 -8.7512 { c gln A 35 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-6.1693 { n gln A 35 1tyjA_34Y_91R}P -6.5207 0.9243 -7.7062 { ca gln A 35 1tyjA_34Y_91R}P -6.2619 1.9239 -8.7512 { n phe A 36 1tyjA_34Y_91R}P -6.2876 1.5307 -11.1436 { ca phe A 36 1tyjA_34Y_91R}P -5.9162 0.8839 -12.416 { n phe A 89 1tyjA_34Y_91R}P -7.9198 5.3128 -13.0877 { ca phe A 89 1tyjA_34Y_91R}P -8.991 5.601 -12.1448 { n gly A 90 1tyjA_34Y_91R}P -9.6583 4.9605 -9.9305 { ca gly A 90 1tyjA_34Y_91R}P -9.6002 4.0963 -8.7601 {"}P -9.6002 4.0963 -8.7601 { n arg A 91 1tyjA_34Y_91R}P -10.9533 3.5662 -6.8485 { ca arg A 91 1tyjA_34Y_91R}P -11.9654 3.7873 -5.8319 { n leu A 92 1tyjA_34Y_91R}P -11.7193 3.7391 -3.4373 { ca leu A 92 1tyjA_34Y_91R}P -11.2961 3.1414 -2.1569 { n tyr A 93 1tyjA_34Y_91R}P -12.2424 2.7303 0.0134 { ca tyr A 93 1tyjA_34Y_91R}P -12.9396 3.1121 1.212 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ser A 32 1tyjA_34Y_91R}P -10.6196 -2.0322 0.4271 {"}-10.6196 -2.0322 0.4271 { ca gly A 33 1tyjA_34Y_91R}-9.7202 -0.3062 -2.8388 { ca tyr A 34 1tyjA_34Y_91R}-7.8953 -0.2641 -6.1693 { ca gln A 35 1tyjA_34Y_91R}-6.2619 1.9239 -8.7512 { ca phe A 36 1tyjA_34Y_91R}-5.9162 0.8839 -12.416 { ca phe A 89 1tyjA_34Y_91R}P -8.991 5.601 -12.1448 {"}-8.991 5.601 -12.1448 { ca gly A 90 1tyjA_34Y_91R}-9.6002 4.0963 -8.7601 { ca arg A 91 1tyjA_34Y_91R}-11.9654 3.7873 -5.8319 { ca leu A 92 1tyjA_34Y_91R}-11.2961 3.1414 -2.1569 { ca tyr A 93 1tyjA_34Y_91R}-12.9396 3.1121 1.212 @subgroup {sidechain} off @vectorlist {sc} color= green alpha= 0.2353 master= {sidechain} { ca tyr A 34 1tyjA_34Y_91R}P -7.8953 -0.2641 -6.1693 { ca arg A 91 1tyjA_34Y_91R}P -11.9654 3.7873 -5.8319 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 34 A}'S' sky -12.364 1.9074 -7.6376 { HE2 TYR 34 A}'S' sky -13.4384 0.8513 -7.0127 {"}'S' sky -13.5702 0.9531 -7.2108 {"}'S' sky -13.5406 1.1261 -7.4834 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 34 A}'S' green -13.0399 0.9583 -6.9265 {"}'S' green -12.7991 1.0381 -6.7949 {"}'S' green -13.2085 1.2725 -7.3892 {"}'S' green -12.5518 1.1077 -6.7122 {"}'S' green -13.0584 1.4809 -7.4709 {"}'S' sea -13.2191 1.4167 -7.6605 {"}'S' green -12.3403 1.2857 -6.7592 {"}'S' green -12.8551 1.6629 -7.5284 {"}'S' sea -13.0163 1.6251 -7.7266 {"}'S' sea -12.1067 1.3989 -6.8059 {"}'S' green -12.2056 1.5646 -6.9806 {"}'S' green -12.3278 1.6909 -7.1731 {"}'S' green -12.4677 1.7719 -7.3759 {"}'S' green -12.6207 1.8061 -7.5843 {"}'S' sea -12.7817 1.7911 -7.7873 {"}'S' sea -12.0807 1.7674 -7.2338 {"}'S' sea -12.2161 1.8576 -7.4326 { HE2 TYR 34 A}'S' sea -13.1537 0.8535 -6.9077 {"}'S' green -13.2469 1.0281 -7.0766 {"}'S' green -13.3818 1.1229 -7.2775 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 34 A}'S' P -12.9044 1.1992 -6.9756 {"}'S' -12.8928 1.1876 -6.9896 {"}'S' P -13.0456 1.2802 -7.182 {"}'S' -13.0327 1.2682 -7.1942 {"}'S' P -12.6389 1.2877 -6.874 {"}'S' -12.6311 1.2752 -6.8895 {"}'S' P -12.7578 1.4145 -7.0637 {"}'S' -12.7305 1.3749 -7.1011 {"}'S' P -12.9007 1.481 -7.2673 {"}'S' -12.875 1.4459 -7.2926 {"}'S' P -12.437 1.4528 -6.9295 {"}'S' -12.4345 1.4464 -6.9366 {"}'S' P -12.5585 1.5748 -7.1218 {"}'S' -12.5446 1.5424 -7.1467 {"}'S' P -12.7008 1.6452 -7.3238 {"}'S' -12.6845 1.6163 -7.3411 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ARG 91 A}'S' blue -12.6773 2.2437 -7.5668 {"}'S' blue -12.2617 2.2446 -7.2467 { HB3 ARG 91 A}'S' blue -13.6683 1.429 -7.3169 {"}'S' sky -13.3279 1.0397 -6.768 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ARG 91 A}'S' sea -13.5807 1.2529 -7.1535 {"}'S' sea -13.4645 1.1211 -6.968 {"}'S' sea -13.3903 1.3561 -7.3475 {"}'S' green -13.2877 1.2034 -7.1724 {"}'S' green -13.1593 1.1026 -6.9773 {"}'S' green -13.012 1.0596 -6.7747 {"}'S' sea -12.8538 1.0773 -6.5763 {"}'S' sea -13.2186 1.6461 -7.5738 {"}'S' green -13.1541 1.4372 -7.4311 {"}'S' green -12.7598 1.1594 -6.8441 {"}'S' green -12.5965 1.2083 -6.6475 {"}'S' green -12.971 1.7554 -7.5901 {"}'S' green -12.3637 1.4224 -6.7132 {"}'S' green -12.7263 1.8227 -7.5239 {"}'S' green -12.3615 1.5401 -6.9745 {"}'S' sea -12.2109 1.694 -6.8226 {"}'S' green -12.5051 1.8933 -7.4018 {"}'S' green -12.4001 1.737 -7.2226 {"}'S' sea -12.2397 1.8347 -7.0427 {"}'S' sea -12.322 1.9864 -7.2393 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ARG 91 A}'S' P -13.0505 1.2785 -7.2532 {"}'S' -13.0526 1.2928 -7.2423 {"}'S' P -12.9156 1.1836 -7.0523 {"}'S' -12.9219 1.2062 -7.0405 {"}'S' P -12.9159 1.5441 -7.4615 {"}'S' -12.9206 1.5533 -7.4478 {"}'S' P -12.8133 1.3913 -7.2864 {"}'S' -12.8345 1.4313 -7.2492 {"}'S' P -12.6762 1.3163 -7.0869 {"}'S' -12.7032 1.3589 -7.0601 {"}'S' P -12.5199 1.3271 -6.8877 {"}'S' -12.528 1.3373 -6.8841 {"}'S' P -12.6585 1.6142 -7.3785 {"}'S' -12.6746 1.6307 -7.3547 {"}'S' P -12.5251 1.5115 -7.1778 {"}'S' -12.5523 1.5372 -7.1525 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 34 A}'M' sky -9.3181 2.7221 -6.1537 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 34 A}'M' sea -9.4168 2.4342 -6.0845 {"}'M' green -9.5604 2.3265 -6.357 {"}'M' sea -9.5742 2.0706 -6.3038 {"}'M' green -9.4667 2.5652 -6.3022 {"}'M' green -9.6283 1.9721 -6.5365 {"}'M' sea -9.3274 2.8591 -6.3943 {"}'M' green -9.6417 2.064 -6.8372 {"}'M' sea -9.6274 1.8219 -6.7522 {"}'M' sea -9.2968 2.9601 -6.6404 {"}'M' green -9.4326 2.7825 -6.7666 {"}'M' green -9.4621 2.6431 -7.0827 {"}'M' green -9.5433 2.3999 -7.1211 {"}'M' green -9.5907 2.1455 -7.1108 {"}'M' sea -9.6015 1.8923 -7.0541 {"}'M' green -9.3501 2.8617 -6.9983 {"}'M' sea -9.3476 2.6878 -7.3124 {"}'M' sea -9.4332 2.453 -7.357 {"}'M' sea -9.4896 2.2063 -7.3607 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 34 A}'M' greentint -9.5704 2.4689 -6.5997 {"}'M' greentint -9.6269 2.2194 -6.6029 {"}'M' greentint -9.4667 2.6911 -6.5275 {"}'M' greentint -9.54 2.5629 -6.8445 {"}'M' greentint -9.6112 2.3178 -6.8687 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ARG 91 A}'M' sea -9.7344 2.3104 -6.1486 {"}'M' sea -9.661 2.5502 -6.1217 {"}'M' green -9.7623 2.0145 -6.5036 {"}'M' green -9.6377 2.2145 -6.3978 {"}'M' green -9.5491 2.4521 -6.3498 {"}'M' green -9.5046 2.7068 -6.3625 {"}'M' sea -9.5078 2.9538 -6.4352 {"}'M' sea -9.8164 1.9489 -6.8976 {"}'M' green -9.6622 2.0815 -6.7359 {"}'M' green -9.4387 2.786 -6.6425 {"}'M' sea -9.4769 3.0162 -6.7558 {"}'M' green -9.7068 2.1156 -7.066 {"}'M' green -9.4476 2.7553 -6.9091 {"}'M' sea -9.5143 2.9606 -7.0522 {"}'M' sea -9.7343 2.3053 -7.3195 {"}'M' green -9.5743 2.4022 -7.1401 {"}'M' green -9.5194 2.6555 -7.1399 {"}'M' sea -9.6526 2.5519 -7.3394 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 91 A}'M' greentint -9.538 2.2849 -6.6313 {"}'M' greentint -9.4597 2.5306 -6.5992 {"}'M' greentint -9.5587 2.2675 -6.9172 {"}'M' greentint -9.4639 2.5016 -6.8598 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 34 A}'M' greentint -10.2178 0.9573 -4.5813 {"}'M' greentint -10.351 0.8536 -4.7808 {"}'M' greentint -10.0319 1.0487 -4.4233 {"}'M' greentint -10.1361 1.2038 -4.6012 {"}'M' greentint -10.296 1.1069 -4.7806 {"}'M' greentint -10.4064 1.0075 -5.0609 {"}'M' greentint -10.4227 0.7538 -5.0115 {"}'M' greentint -9.8708 1.3199 -4.4565 {"}'M' greentint -10.0026 1.4217 -4.6547 {"}'M' greentint -10.1636 1.3936 -4.8547 {"}'M' greentint -10.3116 1.2417 -5.0035 {"}'M' greentint -10.3782 1.105 -5.3145 {"}'M' greentint -9.6793 1.4967 -4.5204 {"}'M' greentint -9.8142 1.5915 -4.7213 {"}'M' greentint -9.973 1.5947 -4.9272 {"}'M' greentint -10.1333 1.5036 -5.1101 {"}'M' greentint -10.2747 1.3331 -5.2457 {"}'M' greentint -9.7173 1.7262 -4.9768 {"}'M' greentint -9.8786 1.6871 -5.1747 {"}'M' greentint -10.0352 1.575 -5.3461 {"}'M' greentint -10.1738 1.4003 -5.4768 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 91 A}'M' green -10.4501 0.9294 -5.3864 {"}'M' green -10.3218 1.1411 -5.5379 {"}'M' green -10.1821 1.3757 -5.6124 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 91 A}'M' greentint -10.3765 0.7469 -4.9228 {"}'M' greentint -10.2139 0.8026 -4.7287 {"}'M' greentint -10.056 0.9129 -4.5552 {"}'M' greentint -9.9107 1.0746 -4.4122 {"}'M' greentint -10.3021 0.8823 -5.1819 {"}'M' greentint -10.1429 0.9048 -4.9814 {"}'M' greentint -9.9832 0.9933 -4.8004 {"}'M' greentint -9.8365 1.1429 -4.6528 {"}'M' greentint -9.7128 1.3427 -4.5481 {"}'M' greentint -10.1835 1.0643 -5.3364 {"}'M' greentint -10.0246 1.0753 -5.1355 {"}'M' greentint -9.8676 1.1712 -4.9582 {"}'M' greentint -9.7291 1.3417 -4.8266 {"}'M' greentint -9.6262 1.5652 -4.7558 {"}'M' greentint -10.0492 1.2721 -5.4122 {"}'M' greentint -9.886 1.3013 -5.2095 {"}'M' greentint -9.7362 1.4551 -5.0587 {"}'M' greentint -9.6409 1.6914 -5.0012 {"}'M' greentint -9.9365 1.5019 -5.4474 {"}'M' greentint -9.7778 1.5993 -5.2698 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 73 1u0aA_149F_75Y}P -8.3175 5.458 -12.4596 {"}-8.3175 5.458 -12.4596 { ca gly A 73 1u0aA_149F_75Y}-8.4207 6.2125 -11.2315 { c gly A 73 1u0aA_149F_75Y}-8.4186 5.323 -9.9866 { o gly A 73 1u0aA_149F_75Y}-8.3084 4.1002 -10.1055 { c gly A 73 1u0aA_149F_75Y}P -8.4186 5.323 -9.9866 { n leu A 74 1u0aA_149F_75Y}-8.5622 5.9515 -8.826 { ca leu A 74 1u0aA_149F_75Y}-8.5751 5.2657 -7.5337 { c leu A 74 1u0aA_149F_75Y}-9.992 5.0283 -7.0253 { o leu A 74 1u0aA_149F_75Y}-10.7766 5.967 -6.8099 { c leu A 74 1u0aA_149F_75Y}P -9.992 5.0283 -7.0253 { n tyr A 75 1u0aA_149F_75Y}-10.3029 3.747 -6.8092 { ca tyr A 75 1u0aA_149F_75Y}-11.6249 3.3085 -6.3868 { c tyr A 75 1u0aA_149F_75Y}-11.5363 2.7847 -4.9721 { o tyr A 75 1u0aA_149F_75Y}-10.7887 1.8405 -4.6918 { c tyr A 75 1u0aA_149F_75Y}P -11.5363 2.7847 -4.9721 { n glu A 76 1u0aA_149F_75Y}-12.3009 3.3835 -4.064 { ca glu A 76 1u0aA_149F_75Y}-12.255 2.9974 -2.6622 { c glu A 76 1u0aA_149F_75Y}-13.651 2.7189 -2.109 { o glu A 76 1u0aA_149F_75Y}-14.6239 3.374 -2.4674 { c glu A 76 1u0aA_149F_75Y}P -13.651 2.7189 -2.109 { n val A 77 1u0aA_149F_75Y}-13.7374 1.7546 -1.2125 { ca val A 77 1u0aA_149F_75Y}-15.0104 1.3928 -0.6243 { c val A 77 1u0aA_149F_75Y}-14.8101 0.9611 0.8228 { o val A 77 1u0aA_149F_75Y}-13.9065 0.1643 1.1374 { n tyr A 147 1u0aA_149F_75Y}P -11.3489 -0.9746 1.3797 {"}-11.3489 -0.9746 1.3797 { ca tyr A 147 1u0aA_149F_75Y}-10.729 -1.709 0.2843 { c tyr A 147 1u0aA_149F_75Y}-10.6231 -0.801 -0.9266 { o tyr A 147 1u0aA_149F_75Y}-11.4412 0.0942 -1.1299 { c tyr A 147 1u0aA_149F_75Y}P -10.6231 -0.801 -0.9266 { n ala A 148 1u0aA_149F_75Y}-9.6335 -1.0523 -1.7707 { ca ala A 148 1u0aA_149F_75Y}-9.4212 -0.1974 -2.9147 { c ala A 148 1u0aA_149F_75Y}-8.6378 -0.8627 -4.0383 { o ala A 148 1u0aA_149F_75Y}-7.8725 -1.7751 -3.8162 { c ala A 148 1u0aA_149F_75Y}P -8.6378 -0.8627 -4.0383 { n phe A 149 1u0aA_149F_75Y}-8.8292 -0.3219 -5.23 { ca phe A 149 1u0aA_149F_75Y}-7.9786 -0.6173 -6.3445 { c phe A 149 1u0aA_149F_75Y}-7.7152 0.6746 -7.1183 { o phe A 149 1u0aA_149F_75Y}-8.6063 1.501 -7.3389 { c phe A 149 1u0aA_149F_75Y}P -7.7152 0.6746 -7.1183 { n asp A 150 1u0aA_149F_75Y}-6.4493 0.8303 -7.4572 { ca asp A 150 1u0aA_149F_75Y}-5.9604 1.9383 -8.274 { c asp A 150 1u0aA_149F_75Y}-5.7762 1.3404 -9.6596 { o asp A 150 1u0aA_149F_75Y}-4.9245 0.4907 -9.8583 { c asp A 150 1u0aA_149F_75Y}P -5.7762 1.3404 -9.6596 { n trp A 151 1u0aA_149F_75Y}-6.6206 1.768 -10.5935 { ca trp A 151 1u0aA_149F_75Y}-6.6645 1.2692 -11.946 { c trp A 151 1u0aA_149F_75Y}-5.9567 2.2474 -12.8491 { o trp A 151 1u0aA_149F_75Y}-6.4376 3.3672 -13.0119 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 73 1u0aA_149F_75Y}P -8.3175 5.458 -12.4596 { ca gly A 73 1u0aA_149F_75Y}P -8.4207 6.2125 -11.2315 {"}P -8.4207 6.2125 -11.2315 { n leu A 74 1u0aA_149F_75Y}P -8.5622 5.9515 -8.826 { ca leu A 74 1u0aA_149F_75Y}P -8.5751 5.2657 -7.5337 { n tyr A 75 1u0aA_149F_75Y}P -10.3029 3.747 -6.8092 { ca tyr A 75 1u0aA_149F_75Y}P -11.6249 3.3085 -6.3868 { n glu A 76 1u0aA_149F_75Y}P -12.3009 3.3835 -4.064 { ca glu A 76 1u0aA_149F_75Y}P -12.255 2.9974 -2.6622 { n val A 77 1u0aA_149F_75Y}P -13.7374 1.7546 -1.2125 { ca val A 77 1u0aA_149F_75Y}P -15.0104 1.3928 -0.6243 { n tyr A 147 1u0aA_149F_75Y}P -11.3489 -0.9746 1.3797 { ca tyr A 147 1u0aA_149F_75Y}P -10.729 -1.709 0.2843 { n ala A 148 1u0aA_149F_75Y}P -9.6335 -1.0523 -1.7707 { ca ala A 148 1u0aA_149F_75Y}P -9.4212 -0.1974 -2.9147 { n phe A 149 1u0aA_149F_75Y}P -8.8292 -0.3219 -5.23 { ca phe A 149 1u0aA_149F_75Y}P -7.9786 -0.6173 -6.3445 { n asp A 150 1u0aA_149F_75Y}P -6.4493 0.8303 -7.4572 { ca asp A 150 1u0aA_149F_75Y}P -5.9604 1.9383 -8.274 { n trp A 151 1u0aA_149F_75Y}P -6.6206 1.768 -10.5935 { ca trp A 151 1u0aA_149F_75Y}P -6.6645 1.2692 -11.946 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 73 1u0aA_149F_75Y}P -8.4207 6.2125 -11.2315 {"}-8.4207 6.2125 -11.2315 { ca leu A 74 1u0aA_149F_75Y}-8.5751 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-8.1882 {"}'S' green -11.3479 0.6336 -8.3608 {"}'S' sea -11.4655 0.7627 -8.5492 {"}'S' sea -11.6009 0.8529 -8.748 {"}'S' green -11.7488 0.9027 -8.953 {"}'S' green -11.9047 0.9083 -9.1571 {"}'S' green -12.0651 0.8721 -9.3544 {"}'S' sea -12.2258 0.7936 -9.5391 {"}'S' sea -11.0872 0.6498 -8.4182 {"}'S' sea -11.4702 0.9564 -8.9998 {"}'S' green -11.6221 0.9835 -9.2034 {"}'S' green -11.7798 0.9704 -9.4039 {"}'S' sea -11.9406 0.9179 -9.5963 {"}'S' sea -11.2784 0.9951 -9.1771 {"}'S' green -11.435 1.0181 -9.3844 {"}'S' green -11.5966 1.0007 -9.5893 {"}'S' sea -11.7605 0.944 -9.785 {"}'S' sea -11.0992 0.9982 -9.3737 {"}'S' green -11.2561 1.0125 -9.5812 {"}'S' green -11.4182 0.989 -9.7837 {"}'S' sea -11.5818 0.9276 -9.978 {"}'S' sea -10.8899 0.9521 -9.5249 {"}'S' sea -11.0476 0.9693 -9.7323 {"}'S' sea -11.2093 0.9463 -9.9362 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 75 A}'S' blue -12.4246 0.8337 -8.3503 {"}'S' blue -12.3128 0.6944 -8.1675 {"}'S' 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{"}'S' sea -11.1743 1.2042 -9.1253 {"}'S' sea -11.5418 1.1629 -10.018 {"}'S' green -11.3895 1.1221 -9.8107 {"}'S' green -11.2301 1.1214 -9.6029 {"}'S' sea -11.0663 1.1594 -9.4032 {"}'S' sea -11.1327 1.1517 -9.9005 {"}'S' sea -10.9751 1.1634 -9.6997 { HB2 TYR 75 A}'S' sea -11.8383 0.6384 -8.0939 {"}'S' sea -11.7506 0.4623 -7.9305 {"}'S' sea -11.6314 0.7619 -8.2699 {"}'S' green -11.5603 0.5656 -8.1246 {"}'S' green -11.4577 0.4128 -7.9495 {"}'S' sea -11.3293 0.312 -7.7543 {"}'S' sea -11.3886 0.8555 -8.3508 {"}'S' green -11.3241 0.6466 -8.2082 {"}'S' green -11.2204 0.4879 -8.0302 {"}'S' green -11.0855 0.393 -7.8293 {"}'S' sea -10.9298 0.3688 -7.6211 {"}'S' sea -11.0859 0.7535 -8.2385 {"}'S' green -10.9833 0.6007 -8.0634 {"}'S' green -10.8462 0.5257 -7.864 {"}'S' sea -10.6898 0.5365 -7.6647 {"}'S' sea -10.8284 0.8236 -8.1555 {"}'S' sea -10.695 0.7209 -7.9549 {"}'S' sea -10.5315 0.7495 -7.7515 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 149 A}'M' 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greentint -9.4678 2.541 -7.7081 {"}'M' greentint -8.8489 2.8785 -7.4006 {"}'M' greentint -9.0091 2.8178 -7.5903 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 75 A}'M' greentint -9.7647 2.0139 -6.7973 {"}'M' greentint -9.608 2.0513 -6.6054 {"}'M' greentint -9.4531 2.1485 -6.4329 {"}'M' greentint -9.7916 2.0771 -7.2791 {"}'M' greentint -9.6517 2.012 -7.0799 {"}'M' greentint -9.4974 2.0113 -6.8807 {"}'M' greentint -9.3391 2.075 -6.6944 {"}'M' greentint -9.1889 2.1994 -6.5346 {"}'M' greentint -9.0558 2.375 -6.4115 {"}'M' greentint -9.7007 2.2852 -7.6194 {"}'M' greentint -9.5881 2.1433 -7.4348 {"}'M' greentint -9.4468 2.0703 -7.2318 {"}'M' greentint -9.2886 2.0725 -7.028 {"}'M' greentint -9.1279 2.1485 -6.8412 {"}'M' greentint -8.9784 2.2938 -6.6888 {"}'M' greentint -8.8538 2.4938 -6.5829 {"}'M' greentint -9.4597 2.37 -7.675 {"}'M' greentint -9.3436 2.233 -7.4868 {"}'M' greentint -9.1949 2.1833 -7.2807 {"}'M' greentint -9.0325 2.2282 -7.0828 {"}'M' greentint -8.8783 2.3609 -6.921 {"}'M' greentint -8.7541 2.5642 -6.8164 {"}'M' greentint -9.2156 2.4685 -7.6493 {"}'M' greentint -9.0839 2.3668 -7.4511 {"}'M' greentint -8.9229 2.3949 -7.2512 {"}'M' greentint -8.7748 2.5468 -7.1023 {"}'M' greentint -8.68 2.7809 -7.045 {"}'M' greentint -9.0546 2.7398 -7.6825 {"}'M' greentint -8.9504 2.5846 -7.5047 {"}'M' greentint -8.7904 2.6815 -7.3252 {"}'M' greentint -8.8687 2.8312 -7.5245 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 149 A}'M' green -10.3458 0.4889 -4.8323 {"}'M' green -10.1599 0.5803 -4.6743 {"}'M' green -10.5345 0.5391 -5.3118 {"}'M' green -9.7142 0.8538 -4.6025 {"}'M' green -9.5655 1.1132 -4.8259 {"}'M' green -10.3019 0.9319 -5.7278 {"}'M' green -9.5629 1.3081 -5.2769 {"}'M' green -9.7172 1.3088 -5.476 {"}'M' green -9.8754 1.2451 -5.6624 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 149 A}'M' greentint -10.2641 0.7354 -4.8521 {"}'M' greentint -10.4241 0.6385 -5.0316 {"}'M' 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{"}'M' greentint -9.2723 2.0653 -4.962 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O MET 180 A}'M' green -9.633 1.1809 -4.2109 {"}'M' green -9.5871 1.149 -4.8226 {"}'M' green -9.176 2.2175 -4.8464 @dotlist {x} color= red width= 1 master= {H-bonds} { O MET 180 A}'M' greentint -9.5111 1.3775 -4.1079 {"}'M' greentint -9.4127 1.6024 -4.0418 {"}'M' greentint -9.34 1.8434 -4.0163 {"}'M' greentint -9.2982 2.0934 -4.0316 {"}'M' greentint -9.5146 1.2303 -4.4345 {"}'M' greentint -9.39 1.4327 -4.3309 {"}'M' greentint -9.2935 1.6658 -4.271 {"}'M' greentint -9.2298 1.9176 -4.2584 {"}'M' greentint -9.2025 2.1723 -4.293 {"}'M' greentint -9.4404 1.2986 -4.6751 {"}'M' greentint -9.3167 1.4984 -4.5704 {"}'M' greentint -9.2248 1.7326 -4.5171 {"}'M' greentint -9.1729 1.9834 -4.5187 {"}'M' greentint -9.163 2.2336 -4.576 {"}'M' greentint -9.4715 1.3268 -4.9804 {"}'M' greentint -9.3331 1.4974 -4.8489 {"}'M' greentint -9.2302 1.7209 -4.778 {"}'M' greentint -9.1757 1.9706 -4.7777 {"}'M' greentint -9.3402 1.6107 -5.0809 {"}'M' greentint -9.2449 1.847 -5.0234 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 14 1u58A_29F_16T}P -7.3037 5.9292 -11.978 {"}-7.3037 5.9292 -11.978 { ca ala A 14 1u58A_29F_16T}-8.6758 5.7867 -11.471 { c ala A 14 1u58A_29F_16T}-8.6649 4.98 -10.1749 { o ala A 14 1u58A_29F_16T}-8.4358 3.7759 -10.192 { c ala A 14 1u58A_29F_16T}P -8.6649 4.98 -10.1749 { n tyr A 15 1u58A_29F_16T}-8.895 5.6603 -9.0316 { ca tyr A 15 1u58A_29F_16T}-8.9222 5.023 -7.7134 { c tyr A 15 1u58A_29F_16T}-10.341 4.8811 -7.2176 { o tyr A 15 1u58A_29F_16T}-11.159 5.7621 -7.4276 { c tyr A 15 1u58A_29F_16T}P -10.341 4.8811 -7.2176 { n thr A 16 1u58A_29F_16T}-10.6045 3.7578 -6.5694 { ca thr A 16 1u58A_29F_16T}-11.881 3.4744 -5.9817 { c thr A 16 1u58A_29F_16T}-11.6358 2.9279 -4.5872 { o thr A 16 1u58A_29F_16T}-10.8552 1.9647 -4.3718 { c thr A 16 1u58A_29F_16T}P -11.6358 2.9279 -4.5872 { n leu A 17 1u58A_29F_16T}-12.3526 3.5052 -3.6446 { ca leu A 17 1u58A_29F_16T}-12.4661 2.9163 -2.3119 { c leu A 17 1u58A_29F_16T}-13.8919 2.5665 -2.0037 { o leu A 17 1u58A_29F_16T}-14.7809 3.3886 -2.1624 { c leu A 17 1u58A_29F_16T}P -13.8919 2.5665 -2.0037 { n val A 18 1u58A_29F_16T}-14.0911 1.3481 -1.5211 { ca val A 18 1u58A_29F_16T}-15.4047 0.8355 -1.2001 { c val A 18 1u58A_29F_16T}-15.4748 0.6164 0.3023 { o val A 18 1u58A_29F_16T}-14.5481 0.103 0.9085 { n arg A 27 1u58A_29F_16T}P -11.8147 -1.5488 1.1458 {"}-11.8147 -1.5488 1.1458 { ca arg A 27 1u58A_29F_16T}-10.7875 -1.9292 0.1845 { c arg A 27 1u58A_29F_16T}-10.6393 -0.9232 -0.9585 { o arg A 27 1u58A_29F_16T}-11.6167 -0.3395 -1.4331 { c arg A 27 1u58A_29F_16T}P -10.6393 -0.9232 -0.9585 { n cys A 28 1u58A_29F_16T}-9.3895 -0.7363 -1.3709 { ca cys A 28 1u58A_29F_16T}-9.0075 0.192 -2.3936 { c cys A 28 1u58A_29F_16T}-8.4691 -0.5738 -3.6225 { o cys A 28 1u58A_29F_16T}-7.6795 -1.5376 -3.4972 { c cys A 28 1u58A_29F_16T}P -8.4691 -0.5738 -3.6225 { n phe A 29 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{"}'S' sea -13.1999 0.3703 -7.2399 {"}'S' sea -13.0421 0.3586 -7.0335 { HB VAL 134 A}'S' sea -12.3991 0.3282 -6.5853 {"}'S' green -12.2519 0.2851 -6.3827 {"}'S' sea -12.0945 0.3031 -6.1836 {"}'S' sea -12.3194 0.2643 -6.8735 {"}'S' green -12.182 0.1828 -6.674 {"}'S' green -12.0301 0.157 -6.4707 {"}'S' green -11.8707 0.1875 -6.2734 {"}'S' sea -12.1583 0.223 -7.0865 {"}'S' sea -12.0276 0.1286 -6.8915 {"}'S' sea -11.8803 0.087 -6.6892 {"}'S' sea -11.7248 0.099 -6.4913 {"}'S' sea -11.5661 0.1635 -6.3046 {"}'S' sea -11.4132 0.2795 -6.1391 {"}'S' sea -11.4645 0.1007 -6.5871 {"}'S' sea -11.3065 0.1864 -6.4061 {HG11 VAL 134 A}'S' sea -14.6359 0.016 -7.4607 {"}'S' green -14.5052 -0.0784 -7.2656 {"}'S' green -14.3579 -0.1201 -7.0633 {"}'S' sea -14.2023 -0.1081 -6.8654 {"}'S' sea -14.0437 -0.0436 -6.6787 {"}'S' green -14.3904 -0.0305 -7.5623 {"}'S' green -14.2539 -0.1118 -7.3622 {"}'S' green -14.1015 -0.1368 -7.1585 {"}'S' green -13.9421 -0.1063 -6.9613 {"}'S' green -13.7841 -0.0206 -6.7803 {"}'S' 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-7.7883 {"}'S' sky -13.0372 0.797 -7.8377 {"}'S' blue -12.854 0.8273 -8.0232 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 6 A}'S' green -12.2827 0.9313 -7.842 {"}'S' sea -11.5722 0.258 -7.0556 {"}'S' green -11.6168 0.4851 -7.1752 {"}'S' green -11.9097 0.9771 -7.6913 {"}'S' sea -12.0496 1.058 -7.8941 {"}'S' sea -11.3725 0.5657 -7.2407 {"}'S' green -11.4474 0.7605 -7.391 {"}'S' green -11.545 0.9244 -7.5636 {"}'S' sea -11.6626 1.0535 -7.752 { CE2 PHE 6 A}'S' sea -12.3326 0.0203 -6.0515 {"}'S' green -12.475 0.0862 -6.2544 {"}'S' green -12.6269 0.1133 -6.4579 {"}'S' sea -12.1364 0.0641 -6.2239 {"}'S' green -12.2832 0.1249 -6.4316 {"}'S' green -11.9549 0.075 -6.4209 {"}'S' sea -11.7461 0.0281 -6.5726 { CZ PHE 6 A}'S' sea -13.343 0.4671 -7.0731 {"}'S' green -12.7489 0.2209 -6.5552 {"}'S' green -13.1099 0.5938 -7.1252 {"}'S' sea -13.2629 0.628 -7.3336 {"}'S' green -13.0062 0.7293 -7.3869 {"}'S' sea -13.1621 0.7349 -7.591 {"}'S' green -12.8795 0.8101 -7.6372 {"}'S' green 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{"}'S' sea -12.4754 0.2733 -6.1097 {"}'S' green -12.3296 0.1848 -6.3276 {"}'S' sea -12.1709 0.2493 -6.1408 {"}'S' green -12.0693 0.1865 -6.4234 {"}'S' sea -11.9113 0.2723 -6.2424 {"}'S' green -12.2911 1.0298 -7.7222 {"}'S' green -11.8129 0.3007 -6.9005 {"}'S' green -12.0246 1.1408 -7.7147 {"}'S' green -11.7293 0.4576 -7.1433 {"}'S' sea -11.573 0.4684 -6.9441 {"}'S' sea -11.763 1.2219 -7.6304 {"}'S' green -11.7794 0.964 -7.5803 {"}'S' green -11.5782 0.6528 -7.2342 {"}'S' sea -11.4147 0.6814 -7.0309 {"}'S' sea -11.5583 1.0347 -7.4582 {"}'S' sea -11.4533 0.8783 -7.279 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 PHE 233 A}'S' P -12.9241 0.3501 -6.7097 {"}'S' -12.9229 0.3508 -6.7099 {"}'S' P -12.953 0.6319 -7.2579 {"}'S' -12.937 0.6482 -7.2414 {"}'S' P -12.8719 0.4495 -7.1019 {"}'S' -12.8307 0.5112 -7.0664 {"}'S' P -12.7631 0.3088 -6.9228 {"}'S' -12.7238 0.3922 -6.8949 {"}'S' P -12.6324 0.2145 -6.7277 {"}'S' -12.6129 0.2789 -6.7192 {"}'S' P -12.4851 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{"}'S' P -12.0242 0.8967 -7.6465 {"}'S' -12.0252 0.8984 -7.6415 {"}'S' P -11.9691 0.6854 -7.5179 {"}'S' -11.982 0.7119 -7.4784 {"}'S' P -11.8665 0.5326 -7.3428 {"}'S' -11.8817 0.562 -7.3155 {"}'S' P -11.7116 0.7555 -7.4349 {"}'S' -11.7193 0.7637 -7.4233 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 6 A}'M' green -9.6396 2.2165 -7.3408 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 6 A}'M' greentint -9.4354 2.0964 -6.161 {"}'M' greentint -9.5943 2.0077 -6.3425 {"}'M' greentint -9.7379 1.8999 -6.615 {"}'M' greentint -9.3323 2.3289 -6.2099 {"}'M' greentint -9.4956 2.2956 -6.4118 {"}'M' greentint -9.6442 2.1387 -6.5603 {"}'M' greentint -9.7479 2.0423 -6.8577 {"}'M' greentint -9.1884 2.5341 -6.2719 {"}'M' greentint -9.3463 2.5257 -6.4739 {"}'M' greentint -9.5049 2.4326 -6.6523 {"}'M' greentint -9.6442 2.2646 -6.7855 {"}'M' greentint -9.7175 2.1363 -7.1025 {"}'M' greentint -9.0032 2.7042 -6.3379 {"}'M' greentint -9.1594 2.7148 -6.5418 {"}'M' greentint -9.3196 2.6566 -6.7338 {"}'M' greentint -9.4743 2.5335 -6.8984 {"}'M' greentint -9.6101 2.356 -7.0246 {"}'M' greentint -9.0766 2.8348 -6.7859 {"}'M' greentint -9.2387 2.7526 -6.9715 {"}'M' greentint -9.3909 2.6167 -7.1315 {"}'M' greentint -9.5276 2.4351 -7.2563 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 233 A}'M' greentint -9.5023 2.0095 -6.2121 {"}'M' greentint -9.7601 1.8803 -6.9092 {"}'M' greentint -9.6019 1.8825 -6.7055 {"}'M' greentint -9.4413 1.9585 -6.5186 {"}'M' greentint -9.2917 2.1039 -6.3662 {"}'M' greentint -9.1672 2.3038 -6.2604 {"}'M' greentint -9.0786 2.5414 -6.2124 {"}'M' greentint -9.657 2.043 -7.1643 {"}'M' greentint -9.5082 1.9934 -6.9582 {"}'M' greentint -9.3459 2.0383 -6.7602 {"}'M' greentint -9.1917 2.1709 -6.5985 {"}'M' greentint -9.0674 2.3742 -6.4939 {"}'M' greentint -8.9891 2.6199 -6.4618 {"}'M' greentint -9.529 2.2786 -7.3268 {"}'M' greentint -9.3972 2.1769 -7.1286 {"}'M' greentint -9.2362 2.2049 -6.9286 {"}'M' greentint -9.0882 2.3569 -6.7798 {"}'M' greentint -8.9934 2.591 -6.7224 {"}'M' greentint -8.9771 2.8447 -6.7717 {"}'M' greentint -9.3679 2.5499 -7.36 {"}'M' greentint -9.2637 2.3947 -7.1821 {"}'M' greentint -9.1038 2.4916 -7.0027 {"}'M' greentint -9.0488 2.7449 -7.0025 {"}'M' greentint -9.1821 2.6413 -7.202 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 6 A}'M' greentint -9.9161 0.9964 -4.4309 {"}'M' greentint -10.0494 0.8927 -4.6304 {"}'M' greentint -9.7302 1.0878 -4.2729 {"}'M' greentint -9.8344 1.2429 -4.4507 {"}'M' greentint -9.9944 1.146 -4.6301 {"}'M' greentint -10.1048 1.0466 -4.9104 {"}'M' greentint -9.5692 1.359 -4.3061 {"}'M' greentint -9.7009 1.4608 -4.5042 {"}'M' greentint -9.8619 1.4327 -4.7042 {"}'M' greentint -10.01 1.2808 -4.8531 {"}'M' greentint -10.0765 1.1441 -5.164 {"}'M' greentint -9.3776 1.5358 -4.37 {"}'M' greentint -9.5125 1.6306 -4.5709 {"}'M' greentint -9.6714 1.6338 -4.7768 {"}'M' greentint -9.8317 1.5427 -4.9597 {"}'M' greentint -9.9731 1.3722 -5.0952 {"}'M' greentint -9.264 1.7299 -4.6212 {"}'M' greentint -9.4156 1.7654 -4.8264 {"}'M' greentint -9.577 1.7262 -5.0243 {"}'M' greentint -9.7336 1.6141 -5.1956 {"}'M' greentint -9.8722 1.4394 -5.3264 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 233 A}'M' green -9.4459 1.2647 -4.1502 {"}'M' green -9.248 1.5328 -4.2861 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 233 A}'M' greentint -10.0689 0.9416 -4.8664 {"}'M' greentint -9.9117 0.937 -4.6608 {"}'M' greentint -9.7491 0.9927 -4.4666 {"}'M' greentint -9.5913 1.103 -4.2932 {"}'M' greentint -9.9853 1.1194 -5.1244 {"}'M' greentint -9.8374 1.0724 -4.9199 {"}'M' greentint -9.6782 1.0948 -4.7194 {"}'M' greentint -9.5184 1.1834 -4.5384 {"}'M' greentint -9.3717 1.333 -4.3908 {"}'M' greentint -9.8571 1.3312 -5.2759 {"}'M' greentint -9.7187 1.2543 -5.0744 {"}'M' greentint -9.5599 1.2654 -4.8735 {"}'M' greentint -9.4029 1.3612 -4.6961 {"}'M' greentint -9.2644 1.5318 -4.5646 {"}'M' greentint -9.7174 1.5657 -5.3504 {"}'M' greentint -9.5844 1.4622 -5.1501 {"}'M' greentint -9.4213 1.4914 -4.9475 {"}'M' greentint -9.2715 1.6451 -4.7967 {"}'M' greentint -9.4718 1.692 -5.1854 {"}'M' greentint -9.313 1.7893 -5.0077 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 31 1ulrA_33Y_45V}P -10.1388 -0.4438 1.5284 {"}-10.1388 -0.4438 1.5284 { ca ser A 31 1ulrA_33Y_45V}-10.1299 -1.417 0.4434 { c ser A 31 1ulrA_33Y_45V}-10.4619 -0.7509 -0.8425 { o ser A 31 1ulrA_33Y_45V}-11.1362 0.3008 -0.8353 { c ser A 31 1ulrA_33Y_45V}P -10.4619 -0.7509 -0.8425 { n gly A 32 1ulrA_33Y_45V}-10.0363 -1.309 -1.9602 { ca gly A 32 1ulrA_33Y_45V}-10.3479 -0.6981 -3.2569 { c gly A 32 1ulrA_33Y_45V}-9.3087 -1.0756 -4.2967 { o gly A 32 1ulrA_33Y_45V}-8.7637 -2.1883 -4.2769 { c gly A 32 1ulrA_33Y_45V}P -9.3087 -1.0756 -4.2967 { n tyr A 33 1ulrA_33Y_45V}-9.0508 -0.152 -5.1957 { ca tyr A 33 1ulrA_33Y_45V}-8.1019 -0.3998 -6.2943 { c tyr A 33 1ulrA_33Y_45V}-7.6298 0.8863 -6.956 { o tyr A 33 1ulrA_33Y_45V}-8.2521 1.9359 -6.8072 { c tyr A 33 1ulrA_33Y_45V}P -7.6298 0.8863 -6.956 { n ala A 34 1ulrA_33Y_45V}-6.5091 0.7715 -7.6519 { ca ala A 34 1ulrA_33Y_45V}-5.9506 1.8718 -8.4728 { c ala A 34 1ulrA_33Y_45V}-5.5942 1.2763 -9.8149 { o ala A 34 1ulrA_33Y_45V}-4.74 0.3728 -9.8749 { c ala A 34 1ulrA_33Y_45V}P -5.5942 1.2763 -9.8149 { n glu A 35 1ulrA_33Y_45V}-6.2707 1.7101 -10.8693 { ca glu A 35 1ulrA_33Y_45V}-6.113 1.156 -12.1865 { c glu A 35 1ulrA_33Y_45V}-5.7269 2.2158 -13.2405 { o glu A 35 1ulrA_33Y_45V}-6.3399 3.2554 -13.3757 { n glu A 43 1ulrA_33Y_45V}P -7.7931 5.5259 -12.3855 {"}-7.7931 5.5259 -12.3855 { ca glu A 43 1ulrA_33Y_45V}-9.0478 5.3674 -11.6668 { c glu A 43 1ulrA_33Y_45V}-8.74 4.7774 -10.2946 { o glu A 43 1ulrA_33Y_45V}-8.1199 3.7166 -10.2097 { c glu A 43 1ulrA_33Y_45V}P -8.74 4.7774 -10.2946 { n val A 44 1ulrA_33Y_45V}-9.1303 5.4674 -9.239 { ca val A 44 1ulrA_33Y_45V}-8.9236 4.9925 -7.8827 { c val A 44 1ulrA_33Y_45V}-10.249 4.8902 -7.1896 { o val A 44 1ulrA_33Y_45V}-11.0695 5.8144 -7.2284 { c val A 44 1ulrA_33Y_45V}P -10.249 4.8902 -7.1896 { n val A 45 1ulrA_33Y_45V}-10.5124 3.7196 -6.5972 { ca val A 45 1ulrA_33Y_45V}-11.7361 3.4799 -5.8123 { c val A 45 1ulrA_33Y_45V}-11.2906 3.0424 -4.4081 { o val A 45 1ulrA_33Y_45V}-10.3777 2.222 -4.282 { c val A 45 1ulrA_33Y_45V}P -11.2906 3.0424 -4.4081 { n ala A 46 1ulrA_33Y_45V}-11.9363 3.5863 -3.3795 { ca ala A 46 1ulrA_33Y_45V}-11.6431 3.195 -2.0214 { c ala A 46 1ulrA_33Y_45V}-12.9094 3.1651 -1.2025 { o ala A 46 1ulrA_33Y_45V}-13.8111 3.9838 -1.4119 { c ala A 46 1ulrA_33Y_45V}P -12.9094 3.1651 -1.2025 { n glu A 47 1ulrA_33Y_45V}-12.9703 2.2272 -0.2617 { ca glu A 47 1ulrA_33Y_45V}-14.1417 2.0662 0.6092 { c glu A 47 1ulrA_33Y_45V}-13.6649 2.0267 2.0594 { o glu A 47 1ulrA_33Y_45V}-12.6969 1.3443 2.3983 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 31 1ulrA_33Y_45V}P -10.1388 -0.4438 1.5284 { ca ser A 31 1ulrA_33Y_45V}P -10.1299 -1.417 0.4434 { n gly A 32 1ulrA_33Y_45V}P -10.0363 -1.309 -1.9602 { ca gly A 32 1ulrA_33Y_45V}P -10.3479 -0.6981 -3.2569 {"}P -10.3479 -0.6981 -3.2569 { n tyr A 33 1ulrA_33Y_45V}P -9.0508 -0.152 -5.1957 { ca tyr A 33 1ulrA_33Y_45V}P -8.1019 -0.3998 -6.2943 { n ala A 34 1ulrA_33Y_45V}P -6.5091 0.7715 -7.6519 { ca ala A 34 1ulrA_33Y_45V}P -5.9506 1.8718 -8.4728 { n glu A 35 1ulrA_33Y_45V}P -6.2707 1.7101 -10.8693 { ca glu A 35 1ulrA_33Y_45V}P -6.113 1.156 -12.1865 { n glu A 43 1ulrA_33Y_45V}P -7.7931 5.5259 -12.3855 { ca glu A 43 1ulrA_33Y_45V}P -9.0478 5.3674 -11.6668 { n val A 44 1ulrA_33Y_45V}P -9.1303 5.4674 -9.239 { ca val A 44 1ulrA_33Y_45V}P -8.9236 4.9925 -7.8827 { n val A 45 1ulrA_33Y_45V}P -10.5124 3.7196 -6.5972 { ca val A 45 1ulrA_33Y_45V}P -11.7361 3.4799 -5.8123 { n ala A 46 1ulrA_33Y_45V}P -11.9363 3.5863 -3.3795 { ca ala A 46 1ulrA_33Y_45V}P -11.6431 3.195 -2.0214 { n glu A 47 1ulrA_33Y_45V}P -12.9703 2.2272 -0.2617 { ca glu A 47 1ulrA_33Y_45V}P -14.1417 2.0662 0.6092 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ser A 31 1ulrA_33Y_45V}P -10.1299 -1.417 0.4434 {"}-10.1299 -1.417 0.4434 { ca gly A 32 1ulrA_33Y_45V}-10.3479 -0.6981 -3.2569 { ca tyr A 33 1ulrA_33Y_45V}-8.1019 -0.3998 -6.2943 { ca ala A 34 1ulrA_33Y_45V}-5.9506 1.8718 -8.4728 { ca glu A 35 1ulrA_33Y_45V}-6.113 1.156 -12.1865 { ca glu A 43 1ulrA_33Y_45V}P -9.0478 5.3674 -11.6668 {"}-9.0478 5.3674 -11.6668 { ca val A 44 1ulrA_33Y_45V}-8.9236 4.9925 -7.8827 { ca val A 45 1ulrA_33Y_45V}-11.7361 3.4799 -5.8123 { ca ala A 46 1ulrA_33Y_45V}-11.6431 3.195 -2.0214 { ca glu A 47 1ulrA_33Y_45V}-14.1417 2.0662 0.6092 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 33 1ulrA_33Y_45V}P -8.1019 -0.3998 -6.2943 { cb tyr A 33 1ulrA_33Y_45V}-8.7342 -1.3244 -7.3268 { cg tyr A 33 1ulrA_33Y_45V}-9.9494 -0.7776 -8.0599 { cd1 tyr A 33 1ulrA_33Y_45V}-9.7774 0.0675 -9.1439 { ce1 tyr A 33 1ulrA_33Y_45V}-10.8816 0.572 -9.8745 { cz tyr A 33 1ulrA_33Y_45V}-12.1171 0.1701 -9.4737 { oh tyr A 33 1ulrA_33Y_45V}-13.2178 0.6502 -10.2334 { cg tyr A 33 1ulrA_33Y_45V}P -9.9494 -0.7776 -8.0599 { cd2 tyr A 33 1ulrA_33Y_45V}-11.2225 -1.1586 -7.6726 { ce2 tyr A 33 1ulrA_33Y_45V}-12.3695 -0.6933 -8.4152 { cz tyr A 33 1ulrA_33Y_45V}ghost -12.1171 0.1701 -9.4737 { ca val A 45 1ulrA_33Y_45V}P -11.7361 3.4799 -5.8123 { cb val A 45 1ulrA_33Y_45V}-12.6145 2.4464 -6.4677 { cg1 val A 45 1ulrA_33Y_45V}-13.7908 2.0558 -5.5101 { cb val A 45 1ulrA_33Y_45V}P -12.6145 2.4464 -6.4677 { cg2 val A 45 1ulrA_33Y_45V}-13.1683 2.9836 -7.7607 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 33 1ulrA_33Y_45V}P -8.7342 -1.3244 -7.3268 {"}P -8.7342 -1.3244 -7.3268 { cd1 tyr A 33 1ulrA_33Y_45V}P -9.7774 0.0675 -9.1439 { cd2 tyr A 33 1ulrA_33Y_45V}P -11.2225 -1.1586 -7.6726 { ce1 tyr A 33 1ulrA_33Y_45V}P -10.8816 0.572 -9.8745 { ce2 tyr A 33 1ulrA_33Y_45V}P -12.3695 -0.6933 -8.4152 { oh tyr A 33 1ulrA_33Y_45V}P -13.2178 0.6502 -10.2334 { cb val A 45 1ulrA_33Y_45V}P -12.6145 2.4464 -6.4677 { cg1 val A 45 1ulrA_33Y_45V}P -13.7908 2.0558 -5.5101 {"}P -13.7908 2.0558 -5.5101 {"}P -13.7908 2.0558 -5.5101 { cg2 val A 45 1ulrA_33Y_45V}P -13.1683 2.9836 -7.7607 {"}P -13.1683 2.9836 -7.7607 {"}P -13.1683 2.9836 -7.7607 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 33 A}'S' sky -12.1402 0.0474 -6.7978 {"}'S' sky -11.798 0.1412 -6.6523 {"}'S' blue -11.4451 0.131 -6.5111 {"}'S' blue -11.0545 0.3586 -6.817 {"}'S' blue -10.9863 0.5054 -7.1845 {"}'S' sky -11.1331 0.5662 -7.3922 {"}'S' sky -11.2897 0.5892 -7.5995 { CE1 TYR 33 A}'S' blue -11.5995 1.9422 -9.0562 {"}'S' blue -11.7537 1.9598 -9.2609 {"}'S' blue -11.5194 2.1031 -9.3168 { CE2 TYR 33 A}'S' sky -12.7268 0.3173 -7.0324 {"}'S' sky -12.8235 0.4845 -7.2027 {"}'S' sky -12.9451 0.6065 -7.3949 {"}'S' blue -13.0873 0.6769 -7.5969 {"}'S' sky -12.8543 0.8036 -7.649 {"}'S' blue -13.0073 0.8378 -7.8574 {"}'S' blue -13.1683 0.8228 -8.0605 {"}'S' blue -13.3311 0.7602 -8.2533 {"}'S' blue -13.4897 0.6511 -8.4281 {"}'S' sky -12.7505 0.9391 -7.9107 {"}'S' sky -12.9064 0.9447 -8.1148 {"}'S' sky -12.472 0.9927 -7.9575 { CZ TYR 33 A}'S' sky -13.1741 0.8533 -8.2582 {"}'S' sky -12.686 1.0028 -8.0439 {"}'S' sky -11.9247 1.1746 -8.0542 {"}'S' sky -11.9996 1.3694 -8.2044 {"}'S' sky -12.8144 1.7718 -9.3707 {"}'S' sky -11.6218 0.966 -7.9959 {"}'S' blue -11.6708 1.1852 -8.1197 {"}'S' sky -11.8365 1.5495 -8.4345 {"}'S' sky -12.5291 1.8701 -9.4202 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 33 A}'S' sea -11.9403 0.2116 -6.8543 {"}'S' sea -11.5673 0.2573 -6.7036 {"}'S' green -11.7072 0.3383 -6.9064 {"}'S' green -11.8602 0.3725 -7.1148 {"}'S' sea -11.3202 0.3338 -6.7643 {"}'S' green -11.4556 0.424 -6.9631 {"}'S' green -11.6035 0.4738 -7.1681 {"}'S' sea -11.1825 0.4616 -7.012 {"}'S' sea -11.3249 0.5274 -7.2149 {"}'S' sea -11.4768 0.5546 -7.4185 { CE2 TYR 33 A}'S' sea -12.4214 0.2306 -6.9301 {"}'S' green -12.4933 0.4306 -7.0791 {"}'S' green -12.5921 0.5963 -7.2537 {"}'S' sea -12.7144 0.7226 -7.4462 {"}'S' green -12.1771 0.3113 -6.9956 {"}'S' green -12.4672 0.7991 -7.5069 {"}'S' sea -12.6026 0.8893 -7.7058 {"}'S' green -12.3295 0.9269 -7.7546 {"}'S' green -11.7802 0.5722 -7.3603 {"}'S' green -11.8803 0.7386 -7.5351 {"}'S' green -11.999 0.8723 -7.7261 {"}'S' sea -11.5866 0.6095 -7.5485 {"}'S' sea -11.6916 0.7659 -7.7277 { CZ TYR 33 A}'S' sea -13.3113 0.9546 -8.4638 {"}'S' sea -13.4776 0.9212 -8.6696 {"}'S' sea -13.0385 1.0943 -8.3073 {"}'S' green -13.1797 1.1753 -8.5137 {"}'S' green -13.3427 1.1675 -8.7209 {"}'S' sea -13.506 1.0713 -8.9051 {"}'S' green -12.7731 1.1828 -8.2057 {"}'S' green -12.892 1.3095 -8.3954 {"}'S' green -13.0348 1.376 -8.599 {"}'S' green -13.1925 1.376 -8.8025 {"}'S' green -13.3533 1.3117 -8.9922 {"}'S' sea -12.4744 1.1807 -8.0909 {"}'S' green -12.5711 1.3479 -8.2612 {"}'S' green -12.9892 1.5579 -8.8601 {"}'S' green -13.1505 1.5202 -9.0583 {"}'S' sea -12.169 1.094 -7.9886 {"}'S' sea -12.2409 1.294 -8.1376 {"}'S' green -12.3397 1.4597 -8.3123 {"}'S' green -12.7549 1.7011 -8.916 {"}'S' green -12.9159 1.6862 -9.119 {"}'S' sea -11.8748 0.9556 -7.9292 {"}'S' sea -12.0973 1.5333 -8.3771 {"}'S' green -12.2148 1.6624 -8.5655 {"}'S' green -12.3502 1.7526 -8.7643 {"}'S' green -12.4982 1.8024 -8.9693 {"}'S' sea -12.654 1.808 -9.1734 {"}'S' sea -11.9492 1.6873 -8.6182 {"}'S' sea -12.0771 1.7902 -8.8132 {"}'S' sea -12.2196 1.8561 -9.0161 {"}'S' sea -12.3715 1.8833 -9.2196 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 33 A}'S' P -12.252 0.5061 -7.1459 {"}'S' -12.2512 0.5059 -7.1465 {"}'S' P -12.3497 0.67 -7.3185 {"}'S' -12.3498 0.6588 -7.3281 {"}'S' P -11.9956 0.5172 -7.2081 {"}'S' -11.9962 0.5143 -7.2117 {"}'S' P -12.0889 0.6861 -7.3759 {"}'S' -12.0929 0.6635 -7.3933 {"}'S' P -12.2016 0.8239 -7.5597 {"}'S' -12.2014 0.8182 -7.5633 { CZ TYR 33 A}'S' P -12.6927 1.4699 -8.4535 {"}'S' -12.6902 1.4624 -8.4586 {"}'S' P -12.8349 1.5403 -8.6555 {"}'S' -12.8308 1.5328 -8.6601 {"}'S' P -12.462 1.586 -8.5048 {"}'S' -12.4598 1.5794 -8.5089 {"}'S' P -12.6019 1.6669 -8.7076 {"}'S' -12.5972 1.6531 -8.7151 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 33 A}'S' sky -13.9236 1.0596 -9.0956 {"}'S' blue -14.128 1.3639 -9.4444 {"}'S' blue -13.6922 0.8724 -8.9347 {"}'S' sky -13.9841 1.5691 -9.5064 {"}'S' sky -13.7989 1.7392 -9.5724 {"}'S' sky -13.5589 1.8573 -9.6114 {"}'S' sky -13.188 1.8369 -9.4911 {"}'S' blue -12.8953 1.7992 -9.5011 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 33 A}'S' sea -13.9937 1.2642 -9.2431 {"}'S' sea -13.6912 1.1189 -9.0016 {"}'S' green -13.7445 1.3344 -9.1305 {"}'S' green -13.8462 1.4898 -9.3067 {"}'S' green -13.4717 1.328 -9.0348 {"}'S' green -13.5488 1.5202 -9.1875 {"}'S' green -13.6598 1.6608 -9.3712 {"}'S' green -13.3123 1.619 -9.2268 {"}'S' sea -13.424 1.7639 -9.4107 {"}'S' sea -13.08 1.695 -9.3111 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 45 A}'S' blue -13.1526 1.0887 -7.4315 {"}'S' blue -13.0427 0.9396 -7.2473 {"}'S' blue -12.916 0.8239 -7.0511 {"}'S' blue -12.9912 1.2416 -7.6799 {"}'S' sky -12.8984 1.0718 -7.5125 {"}'S' sky -12.6828 1.1553 -7.6471 {"}'S' sky -12.4476 1.2398 -7.7243 {"}'S' blue -12.048 1.6201 -7.9023 { CG2 VAL 45 A}'S' blue -13.1753 1.2419 -7.9316 {"}'S' blue -13.0159 1.2412 -7.7238 {"}'S' sky -12.7609 1.2832 -7.8206 {"}'S' blue -13.1442 2.1772 -9.3141 {"}'S' sky -13.0867 1.9626 -9.1796 {"}'S' sky -12.8451 2.0635 -9.2143 {"}'S' sky -12.0496 1.6756 -8.0778 {"}'S' sky -12.6017 2.1573 -9.1953 {"}'S' sky -11.9368 1.8389 -8.248 {"}'S' sky -12.3498 2.2142 -9.1032 {"}'S' sky -11.9372 1.9881 -8.5064 { HB VAL 45 A}'S' sky -12.7627 0.7086 -6.9862 {"}'S' blue -12.2083 0.3997 -6.6158 {"}'S' sky -11.7925 0.4134 -6.5138 {"}'S' sky -11.4725 0.5216 -6.5402 {"}'S' blue -11.9874 1.5131 -7.8498 {"}'S' blue -11.2157 0.6949 -6.6236 {"}'S' sky -11.7478 1.3677 -7.8051 {"}'S' sky -11.7474 1.1236 -7.7369 {"}'S' blue -11.1401 0.7907 -6.86 {"}'S' blue -11.5026 1.1909 -7.6707 {"}'S' sky -11.3014 0.8797 -7.3247 {HG21 VAL 45 A}'S' blue -13.5892 1.084 -8.0647 {"}'S' sky -14.0689 1.8189 -9.2982 {"}'S' sky -13.7323 1.1414 -8.675 {"}'S' sky -13.585 1.0983 -8.4725 {"}'S' sky -13.4268 1.1161 -8.274 {"}'S' sky -13.2691 1.1921 -8.0912 {"}'S' sky -13.811 1.9272 -9.3635 {"}'S' sky -13.5444 2.0383 -9.3561 {HG23 VAL 45 A}'S' blue -12.1548 2.3298 -9.1586 {"}'S' blue -12.0199 2.235 -8.9577 {"}'S' blue -11.8641 2.2107 -8.7496 {"}'S' blue -11.7805 2.3676 -8.9924 {"}'S' blue -11.6242 2.3784 -8.7931 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 45 A}'S' sea -12.7874 0.9326 -7.329 { CG2 VAL 45 A}'S' sea -13.0708 1.2992 -8.2256 {"}'S' sea -12.9185 1.2715 -8.0214 {"}'S' green -13.0001 1.4378 -8.5639 {"}'S' green -12.8582 1.3697 -8.3612 {"}'S' green -12.7054 1.3427 -8.1566 {"}'S' sea -12.5464 1.3596 -7.955 {"}'S' green -13.0014 1.777 -9.0173 {"}'S' green -12.8907 1.6291 -8.834 {"}'S' green -12.4552 1.4533 -8.2226 {"}'S' sea -12.2931 1.4913 -8.0233 {"}'S' green -12.7623 1.8788 -9.0555 {"}'S' green -12.6523 1.7352 -8.8724 {"}'S' green -12.3693 1.5972 -8.4695 {"}'S' green -12.2108 1.6091 -8.2676 {"}'S' sea -12.5155 1.9757 -9.0343 {"}'S' green -12.3975 1.8474 -8.8454 {"}'S' green -12.2552 1.7787 -8.642 {"}'S' sea -12.0979 1.7766 -8.4386 {"}'S' sea -12.2432 2.0554 -8.9212 {"}'S' sea -12.0999 1.9766 -8.7142 { HB VAL 45 A}'S' sea -12.6762 0.8588 -7.3483 {"}'S' green -12.5951 0.6764 -7.1923 {"}'S' green -12.4863 0.5357 -7.0132 {"}'S' sea -12.3556 0.4414 -6.8181 {"}'S' green -12.501 1.0089 -7.5942 {"}'S' green -12.4447 0.7972 -7.4637 {"}'S' green -12.2408 0.4893 -7.1148 {"}'S' green -12.1043 0.4079 -6.9148 {"}'S' sea -11.9519 0.383 -6.711 {"}'S' sea -12.2722 1.1483 -7.7473 {"}'S' green -12.2377 0.9207 -7.6397 {"}'S' green -11.9356 0.4708 -7.1241 {"}'S' green -11.7884 0.4278 -6.9215 {"}'S' sea -11.6302 0.4455 -6.7231 {"}'S' sea -12.0143 1.2567 -7.8126 {"}'S' green -11.995 1.0143 -7.7206 {"}'S' green -11.9305 0.8054 -7.5779 {"}'S' green -11.8268 0.6467 -7.4 {"}'S' green -11.6919 0.5518 -7.1991 {"}'S' green -11.5361 0.5276 -6.9909 {"}'S' sea -11.3729 0.5765 -6.7943 {"}'S' sea -11.6923 0.9123 -7.6083 {"}'S' sea -11.5897 0.7595 -7.4332 {"}'S' sea -11.4525 0.6845 -7.2338 {"}'S' sea -11.2962 0.6953 -7.0345 {HG21 VAL 45 A}'S' sea -14.0344 1.5913 -9.1906 {"}'S' sea -13.9633 1.3949 -9.0452 {"}'S' sea -13.8607 1.2422 -8.8702 {"}'S' green -13.7916 1.6849 -9.2715 {"}'S' green -13.7271 1.476 -9.1289 {"}'S' green -13.6235 1.3172 -8.9509 {"}'S' green -13.4886 1.2224 -8.75 {"}'S' green -13.3328 1.1982 -8.5418 {"}'S' green -13.1695 1.2471 -8.3453 {"}'S' green -13.544 1.7941 -9.2879 {"}'S' green -13.4889 1.5829 -9.1592 {"}'S' green -13.3864 1.4301 -8.9841 {"}'S' green -13.2492 1.3551 -8.7847 {"}'S' green -13.0929 1.3659 -8.5854 {"}'S' sea -13.2993 1.8615 -9.2216 {"}'S' green -13.2315 1.653 -9.0762 {"}'S' green -13.0981 1.5502 -8.8756 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 VAL 45 A}'S' P -12.7595 1.5238 -8.6357 {"}'S' -12.7633 1.5378 -8.627 {"}'S' P -12.613 1.465 -8.429 {"}'S' -12.6152 1.4713 -8.4266 {"}'S' P -12.5195 1.6392 -8.6742 {"}'S' -12.5247 1.6508 -8.6668 { HB VAL 45 A}'S' P -12.357 0.6211 -7.3003 {"}'S' -12.3528 0.6316 -7.2936 {"}'S' P -12.1667 0.7244 -7.4943 {"}'S' -12.1641 0.7418 -7.4777 {"}'S' P -12.0641 0.5716 -7.3192 {"}'S' -12.0635 0.5921 -7.3061 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 33 A}'M' greentint -9.4242 2.3284 -6.1508 {"}'M' greentint -9.5678 2.2206 -6.4233 {"}'M' greentint -9.3255 2.6162 -6.22 {"}'M' greentint -9.4741 2.4593 -6.3685 {"}'M' greentint -9.5778 2.363 -6.666 {"}'M' greentint -9.6344 2.1135 -6.6692 {"}'M' greentint -9.1763 2.8464 -6.2822 {"}'M' greentint -9.3349 2.7532 -6.4606 {"}'M' greentint -9.4741 2.5853 -6.5938 {"}'M' greentint -9.5474 2.457 -6.9108 {"}'M' greentint -9.6186 2.2119 -6.935 {"}'M' greentint -8.9893 3.0355 -6.35 {"}'M' greentint -9.1495 2.9773 -6.542 {"}'M' greentint -9.3043 2.8542 -6.7067 {"}'M' greentint -9.44 2.6766 -6.8329 {"}'M' greentint -9.4695 2.5372 -7.149 {"}'M' greentint -9.5507 2.294 -7.1874 {"}'M' greentint -9.0686 3.0733 -6.7798 {"}'M' greentint -9.2208 2.9374 -6.9398 {"}'M' greentint -9.3575 2.7558 -7.0646 {"}'M' greentint -9.355 2.582 -7.3787 {"}'M' greentint -9.1137 2.976 -7.1763 {"}'M' greentint -9.2444 2.794 -7.2947 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 45 A}'M' greentint -9.5923 2.0059 -6.4163 {"}'M' greentint -9.4421 2.1304 -6.2565 {"}'M' greentint -9.3089 2.306 -6.1334 {"}'M' greentint -9.2037 2.5206 -6.0556 {"}'M' greentint -9.5417 2.0034 -6.7499 {"}'M' greentint -9.381 2.0794 -6.563 {"}'M' greentint -9.2315 2.2248 -6.4106 {"}'M' greentint -9.1069 2.4247 -6.3048 {"}'M' greentint -9.0184 2.6623 -6.2568 {"}'M' greentint -8.9739 2.9171 -6.2695 {"}'M' greentint -9.448 2.1143 -7.0026 {"}'M' greentint -9.2857 2.1592 -6.8046 {"}'M' greentint -9.1315 2.2918 -6.6429 {"}'M' greentint -9.0072 2.4951 -6.5383 {"}'M' greentint -8.9289 2.7408 -6.5062 {"}'M' greentint -8.9079 2.9962 -6.5495 {"}'M' greentint -9.337 2.2978 -7.173 {"}'M' greentint -9.176 2.3258 -6.973 {"}'M' greentint -9.028 2.4778 -6.8242 {"}'M' greentint -8.9332 2.7119 -6.7668 {"}'M' greentint -8.9169 2.9656 -6.8162 {"}'M' greentint -9.2035 2.5156 -7.2265 {"}'M' greentint -9.0436 2.6125 -7.0471 {"}'M' greentint -8.9886 2.8658 -7.0469 {"}'M' greentint -9.1219 2.7622 -7.2464 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 33 A}'M' greentint -10.2449 0.9255 -4.5975 {"}'M' greentint -10.059 1.0169 -4.4395 {"}'M' greentint -10.1632 1.172 -4.6173 {"}'M' greentint -10.3232 1.0751 -4.7968 {"}'M' greentint -9.8313 1.0829 -4.3296 {"}'M' greentint -9.898 1.2881 -4.4727 {"}'M' greentint -10.0297 1.3899 -4.6709 {"}'M' greentint -10.1907 1.3618 -4.8708 {"}'M' greentint -10.3388 1.2099 -5.0197 {"}'M' greentint -9.6133 1.2904 -4.3677 {"}'M' greentint -9.7064 1.4649 -4.5366 {"}'M' greentint -9.8413 1.5598 -4.7375 {"}'M' greentint -10.0002 1.5629 -4.9434 {"}'M' greentint -10.1605 1.4718 -5.1263 {"}'M' greentint -10.3019 1.3013 -5.2618 {"}'M' greentint -9.3713 1.3781 -4.4228 {"}'M' greentint -9.4646 1.5499 -4.5911 {"}'M' greentint -9.5928 1.659 -4.7878 {"}'M' greentint -9.7444 1.6945 -4.993 {"}'M' greentint -9.9058 1.6553 -5.1909 {"}'M' greentint -10.0624 1.5432 -5.3623 {"}'M' greentint -9.322 1.6796 -4.8429 {"}'M' greentint -9.4619 1.7447 -5.0421 {"}'M' greentint -9.6163 1.7454 -5.2413 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 45 A}'M' greentint -10.3493 0.9843 -4.9347 {"}'M' greentint -10.2113 0.9078 -4.7356 {"}'M' greentint -10.0603 0.8818 -4.5334 {"}'M' greentint -9.9023 0.9058 -4.3367 {"}'M' greentint -10.2275 1.1703 -5.1935 {"}'M' greentint -10.1029 1.0521 -4.9996 {"}'M' greentint -9.9566 0.9888 -4.7938 {"}'M' greentint -9.7995 0.9842 -4.5882 {"}'M' greentint -9.6368 1.0399 -4.394 {"}'M' greentint -10.0932 1.4488 -5.4136 {"}'M' greentint -9.9987 1.2791 -5.2456 {"}'M' greentint -9.8731 1.1666 -5.0518 {"}'M' greentint -9.7251 1.1196 -4.8473 {"}'M' greentint -9.5659 1.142 -4.6468 {"}'M' greentint -9.4062 1.2306 -4.4658 {"}'M' greentint -9.8482 1.5323 -5.3798 {"}'M' greentint -9.7448 1.3783 -5.2033 {"}'M' greentint -9.6065 1.3015 -5.0018 {"}'M' greentint -9.4476 1.3125 -4.8009 {"}'M' greentint -9.2906 1.4084 -4.6235 {"}'M' greentint -9.6051 1.6129 -5.2778 {"}'M' greentint -9.4721 1.5094 -5.0776 {"}'M' greentint -9.309 1.5386 -4.8749 {"}'M' greentint -9.3595 1.7392 -5.1128 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 43 1umzA_45F_171S}P -11.3547 -1.2558 1.6701 {"}-11.3547 -1.2558 1.6701 { ca thr A 43 1umzA_45F_171S}-10.5942 -1.7803 0.5565 { c thr A 43 1umzA_45F_171S}-10.5863 -0.7833 -0.5831 { o thr A 43 1umzA_45F_171S}-11.3446 0.2038 -0.5803 { c thr A 43 1umzA_45F_171S}P -10.5863 -0.7833 -0.5831 { n gly A 44 1umzA_45F_171S}-9.7195 -1.0258 -1.5405 { ca gly A 44 1umzA_45F_171S}-9.5949 -0.1841 -2.6954 { c gly A 44 1umzA_45F_171S}-8.7804 -0.8034 -3.7956 { o gly A 44 1umzA_45F_171S}-8.0851 -1.8404 -3.6151 { c gly A 44 1umzA_45F_171S}P -8.7804 -0.8034 -3.7956 { n phe A 45 1umzA_45F_171S}-8.8432 -0.147 -4.9386 { ca phe A 45 1umzA_45F_171S}-8.154 -0.5708 -6.1214 { c phe A 45 1umzA_45F_171S}-7.7611 0.6168 -6.9663 { o phe A 45 1umzA_45F_171S}-8.213 1.7204 -6.7149 { c phe A 45 1umzA_45F_171S}P -7.7611 0.6168 -6.9663 { n gln A 46 1umzA_45F_171S}-6.9194 0.3876 -7.9525 { ca gln A 46 1umzA_45F_171S}-6.4443 1.4685 -8.8009 { c gln A 46 1umzA_45F_171S}-6.0938 0.9625 -10.1731 { o gln A 46 1umzA_45F_171S}-5.8959 -0.255 -10.3954 { c gln A 46 1umzA_45F_171S}P -6.0938 0.9625 -10.1731 { n ser A 47 1umzA_45F_171S}-6.0484 1.8905 -11.1193 { ca ser A 47 1umzA_45F_171S}-5.7418 1.5508 -12.4904 { c ser A 47 1umzA_45F_171S}-4.2864 1.1623 -12.629 { o ser A 47 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-12.6121 1.2052 -7.719 {"}'S' -12.6189 1.1353 -7.7586 {"}'S' P -12.74 1.3082 -7.914 {"}'S' -12.7406 1.2941 -7.9202 {"}'S' P -12.1907 0.9535 -7.5197 {"}'S' -12.1971 0.9401 -7.5305 {"}'S' P -12.2908 1.1199 -7.6945 {"}'S' -12.2988 1.0966 -7.7087 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 171 A}'S' sky -13.5878 1.314 -7.5515 {"}'S' blue -13.5352 1.5913 -7.9888 {"}'S' sky -13.2829 1.5643 -8.0702 {"}'S' sky -13.0613 1.6572 -8.2003 {"}'S' sky -12.8246 1.7482 -8.277 {"}'S' sky -12.5002 1.6643 -8.1529 {"}'S' blue -12.2535 1.7613 -8.1316 {"}'S' blue -12.1355 1.633 -7.9428 { HB3 SER 171 A}'S' blue -11.9993 1.3942 -7.7072 {"}'S' blue -11.8942 1.2378 -7.528 @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 171 A}'S' sea -13.4443 1.4114 -7.8218 {"}'S' green -13.19 1.3946 -7.9028 {"}'S' green -12.9745 1.4781 -8.0375 {"}'S' sea -12.7393 1.5626 -8.1146 {"}'S' sea -12.3902 1.5208 -7.9697 { HB3 SER 171 A}'S' green -13.3651 0.7096 -6.9587 {"}'S' green -13.2278 0.6281 -6.7593 {"}'S' green -13.0758 0.6024 -6.556 {"}'S' green -12.9164 0.6328 -6.3587 {"}'S' green -13.394 0.9914 -7.5069 {"}'S' green -12.6119 0.6088 -6.3899 {"}'S' green -12.3523 0.6318 -6.4914 {"}'S' green -12.1903 0.6542 -6.6989 {"}'S' green -12.7321 1.3893 -7.9712 {"}'S' green -12.0907 0.7092 -6.953 {"}'S' green -12.1526 1.1151 -7.6839 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 SER 171 A}'S' P -13.3129 0.809 -7.3509 {"}'S' -13.3115 0.8114 -7.3496 {"}'S' P -13.2041 0.6684 -7.1718 {"}'S' -13.1933 0.6911 -7.164 {"}'S' P -13.0734 0.574 -6.9768 {"}'S' -13.053 0.6413 -6.9677 {"}'S' P -12.9261 0.5323 -6.7745 {"}'S' -12.9144 0.604 -6.7783 {"}'S' P -12.7705 0.5443 -6.5766 {"}'S' -12.7693 0.5753 -6.5836 {"}'S' P -13.2188 1.1415 -7.7528 {"}'S' -13.2135 1.1474 -7.7435 {"}'S' P -13.1625 0.9298 -7.6223 {"}'S' -13.1366 0.9747 -7.5751 {"}'S' P -13.0748 0.7537 -7.4589 {"}'S' -13.0485 0.8251 -7.4119 {"}'S' P -12.9586 0.6219 -7.2734 {"}'S' -12.9442 0.6932 -7.2444 {"}'S' P -12.8221 0.5406 -7.0734 {"}'S' -12.8134 0.6518 -7.051 {"}'S' P -12.6697 0.5156 -6.8696 {"}'S' -12.6749 0.6162 -6.8673 {"}'S' P -12.5103 0.546 -6.6724 {"}'S' -12.5188 0.5884 -6.6784 {"}'S' P -12.99 1.2809 -7.9059 {"}'S' -12.9886 1.2825 -7.901 {"}'S' P -12.9555 1.0533 -7.7983 {"}'S' -12.9386 1.099 -7.7292 {"}'S' P -12.8844 0.857 -7.6529 {"}'S' -12.8672 0.9483 -7.563 {"}'S' P -12.7819 0.7042 -7.4779 {"}'S' -12.7768 0.8108 -7.4081 {"}'S' P -12.6534 0.6034 -7.2827 {"}'S' -12.6592 0.6902 -7.2471 {"}'S' P -12.5061 0.5604 -7.0801 {"}'S' -12.5239 0.6524 -7.0605 {"}'S' P -12.348 0.5782 -6.8817 {"}'S' -12.3652 0.625 -6.88 {"}'S' P -12.7127 1.1469 -7.8792 {"}'S' -12.7133 1.1775 -7.8203 {"}'S' P -12.6483 0.938 -7.7366 {"}'S' -12.656 1.0146 -7.6449 {"}'S' P -12.5446 0.7793 -7.5586 {"}'S' -12.5636 0.873 -7.4846 {"}'S' P -12.4097 0.6845 -7.3577 {"}'S' -12.4272 0.7417 -7.328 {"}'S' P -12.2539 0.6602 -7.1495 {"}'S' -12.2641 0.6826 -7.1429 {"}'S' P -12.4652 1.2562 -7.8956 {"}'S' -12.4658 1.2587 -7.8901 {"}'S' P -12.4101 1.0449 -7.7669 {"}'S' -12.4278 1.0803 -7.7155 {"}'S' P -12.3075 0.8922 -7.5918 {"}'S' -12.3305 0.9351 -7.551 {"}'S' P -12.1703 0.8171 -7.3924 {"}'S' -12.1714 0.8196 -7.391 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 45 A}'M' green -9.3852 2.1129 -6.0585 {"}'M' green -9.5953 1.898 -6.5769 {"}'M' green -8.9502 2.82 -6.2578 {"}'M' green -9.5117 2.0785 -7.0951 {"}'M' green -8.8675 2.94 -6.5018 {"}'M' green -9.316 2.3664 -7.2864 {"}'M' green -8.9285 2.9041 -6.9341 {"}'M' green -9.0746 2.7605 -7.084 {"}'M' green -9.2054 2.5785 -7.2025 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 45 A}'M' greentint -9.5287 2.0051 -6.331 {"}'M' greentint -9.2865 2.4007 -6.1277 {"}'M' greentint -9.4351 2.2438 -6.2762 {"}'M' greentint -9.5388 2.1475 -6.5737 {"}'M' greentint -9.1372 2.6309 -6.1899 {"}'M' greentint -9.2958 2.5377 -6.3683 {"}'M' greentint -9.4351 2.3697 -6.5015 {"}'M' greentint -9.5084 2.2415 -6.8185 {"}'M' greentint -9.5795 1.9964 -6.8427 {"}'M' greentint -9.1104 2.7617 -6.4497 {"}'M' greentint -9.2652 2.6387 -6.6144 {"}'M' greentint -9.4009 2.4611 -6.7406 {"}'M' greentint -9.4305 2.3217 -7.0567 {"}'M' greentint -9.0296 2.8578 -6.6875 {"}'M' greentint -9.1818 2.7219 -6.8475 {"}'M' greentint -9.3185 2.5403 -6.9723 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H SER 171 A}'M' green -9.4767 2.0783 -6.1946 {"}'M' green -9.3436 2.2539 -6.0715 {"}'M' green -9.2384 2.4685 -5.9937 {"}'M' green -8.9426 2.9441 -6.4876 {"}'M' green -8.9516 2.9135 -6.7543 {"}'M' green -9.1565 2.7101 -7.1845 @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 171 A}'M' greentint -9.5764 1.9513 -6.688 {"}'M' greentint -9.4157 2.0273 -6.5011 {"}'M' greentint -9.2662 2.1727 -6.3487 {"}'M' greentint -9.1416 2.3726 -6.2429 {"}'M' greentint -9.053 2.6102 -6.1949 {"}'M' greentint -9.4827 2.0622 -6.9407 {"}'M' greentint -9.3204 2.1071 -6.7427 {"}'M' greentint -9.1661 2.2397 -6.581 {"}'M' greentint -9.0419 2.443 -6.4764 {"}'M' greentint -8.9636 2.6887 -6.4443 {"}'M' greentint -9.3717 2.2457 -7.1111 {"}'M' greentint -9.2107 2.2737 -6.9111 {"}'M' greentint -9.0627 2.4257 -6.7623 {"}'M' greentint -8.9679 2.6598 -6.7049 {"}'M' greentint -9.2382 2.4635 -7.1646 {"}'M' greentint -9.0782 2.5604 -6.9852 {"}'M' greentint -9.0233 2.8137 -6.985 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 45 A}'M' greentint -10.1546 0.858 -4.4569 {"}'M' greentint -10.2878 0.7543 -4.6564 {"}'M' greentint -9.9687 0.9494 -4.2989 {"}'M' greentint -10.0729 1.1045 -4.4767 {"}'M' greentint -10.2329 1.0076 -4.6562 {"}'M' greentint -10.3432 0.9083 -4.9364 {"}'M' greentint -9.8076 1.2206 -4.3321 {"}'M' greentint -9.9394 1.3224 -4.5303 {"}'M' greentint -10.1004 1.2943 -4.7302 {"}'M' greentint -10.2484 1.1424 -4.8791 {"}'M' greentint -10.315 1.0057 -5.19 {"}'M' greentint -9.6161 1.3974 -4.396 {"}'M' greentint -9.751 1.4923 -4.5969 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3.3411 -12.7519 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 75 A}'S' blue -9.9651 0.4464 -6.3836 {"}'S' sky -10.5587 -0.0906 -7.0005 {"}'S' sky -9.8406 0.4921 -6.6255 {"}'S' sky -9.8216 0.4245 -6.9959 { CD1 TYR 75 A}'S' sky -10.7768 0.4177 -5.9997 {"}'S' blue -10.4345 0.4628 -5.9985 {"}'S' blue -10.2256 0.4201 -6.1509 {"}'S' sky -10.6372 -0.1039 -6.9647 { CD2 TYR 75 A}'S' sky -9.8448 0.4671 -7.3688 {"}'S' blue -9.8758 0.5348 -7.8197 {"}'S' blue -10.0366 0.4823 -8.0121 { CE1 TYR 75 A}'S' blue -12.3563 0.2687 -6.1081 {"}'S' blue -12.517 0.1903 -6.2927 {"}'S' blue -12.6721 0.0717 -6.4606 {"}'S' blue -11.9133 0.3802 -5.957 {"}'S' sky -12.071 0.367 -6.1575 {"}'S' sky -12.2318 0.3145 -6.35 {"}'S' sky -12.3891 0.2248 -6.5291 {"}'S' blue -12.5422 0.0993 -6.691 {"}'S' blue -11.5695 0.3918 -5.9307 {"}'S' sky -11.3903 0.3948 -6.1274 { CE2 TYR 75 A}'S' sky -11.4442 0.3857 -8.3162 {"}'S' blue -11.6049 0.3072 -8.5008 {"}'S' sky -11.1589 0.484 -8.3656 {"}'S' sky -11.3197 0.4314 -8.5581 {"}'S' blue -11.477 0.3417 -8.7372 {"}'S' sky -10.8141 0.5317 -8.3461 {"}'S' sky -10.9757 0.5142 -8.551 {"}'S' sky -11.1396 0.4576 -8.7467 {"}'S' blue -11.3007 0.3638 -8.9285 {"}'S' sky -10.3292 0.4588 -8.1281 {"}'S' sky -10.6352 0.5261 -8.5429 {"}'S' sky -11.1218 0.3427 -9.12 {"}'S' blue -11.276 0.2111 -9.2837 {"}'S' sky -10.4267 0.4829 -8.6941 {"}'S' sky -10.9128 0.3027 -9.2729 {"}'S' blue -11.0678 0.1713 -9.436 {"}'S' blue -10.2116 0.4006 -8.8222 {"}'S' sky -10.3732 0.3818 -9.0268 {"}'S' sky -10.5367 0.3245 -9.2219 {"}'S' blue -10.6987 0.2292 -9.4045 {"}'S' blue -10.3173 0.2191 -9.3234 { CZ TYR 75 A}'S' blue -12.6974 0.0703 -6.975 {"}'S' blue -12.8586 0.0326 -7.1732 {"}'S' sky -12.31 0.1793 -6.8225 {"}'S' sky -12.6241 0.1986 -7.2339 {"}'S' blue -12.7869 0.1359 -7.4267 {"}'S' blue -12.2002 0.2412 -8.2894 {"}'S' sky -11.83 0.2978 -8.2611 {"}'S' blue -11.9912 0.2013 -8.4424 @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 75 A}'S' sea -10.1258 0.3679 -6.5682 {"}'S' sea -10.2809 0.2493 -6.7361 {"}'S' sea -10.4265 0.0951 -6.8811 {"}'S' sea -9.9979 0.4024 -6.8046 {"}'S' sea -10.1511 0.2769 -6.9665 { CD1 TYR 75 A}'S' sea -10.9379 0.324 -6.1815 {"}'S' sea -10.5981 0.4013 -6.1927 {"}'S' green -10.759 0.3029 -6.373 {"}'S' sea -10.3888 0.3594 -6.3447 {"}'S' green -10.55 0.2629 -6.5259 {"}'S' green -10.705 0.1315 -6.689 {"}'S' sea -10.4917 0.0592 -6.8219 { CD2 TYR 75 A}'S' sea -10.5391 0.0407 -7.202 {"}'S' green -10.3358 0.2226 -7.2596 {"}'S' sea -10.1015 0.3658 -7.3155 {"}'S' green -10.2625 0.3509 -7.5185 {"}'S' sea -10.0007 0.4727 -7.5729 {"}'S' sea -10.1611 0.4365 -7.7702 { CE1 TYR 75 A}'S' sea -11.7262 0.4147 -6.1381 {"}'S' sea -11.8877 0.3973 -6.343 {"}'S' green -12.0516 0.3406 -6.5387 {"}'S' sea -12.2128 0.2469 -6.7204 {"}'S' sea -11.5472 0.4092 -6.3348 {"}'S' green -11.7094 0.3857 -6.5374 {"}'S' green -11.873 0.3242 -6.7316 {"}'S' green -11.1811 0.3487 -6.2786 {"}'S' green -11.3387 0.366 -6.486 {"}'S' green -11.5005 0.343 -6.6898 {"}'S' green -11.6636 0.2823 -6.8836 {"}'S' green -10.9678 0.2623 -6.4065 {"}'S' green -11.1236 0.2837 -6.6141 {"}'S' green -10.9117 0.1652 -6.7213 {"}'S' green -11.0694 0.1535 -6.9221 {"}'S' sea -10.8366 0.0105 -6.9729 { CE2 TYR 75 A}'S' sea -10.6294 -0.0167 -7.1499 {"}'S' green -10.727 0.1472 -7.3225 {"}'S' green -11.1279 0.4163 -7.9148 {"}'S' sea -11.2838 0.4219 -8.1189 {"}'S' green -10.579 0.3011 -7.5637 {"}'S' green -10.7069 0.4041 -7.7587 {"}'S' green -10.8493 0.47 -7.9615 {"}'S' sea -11.0012 0.4971 -8.1651 {"}'S' green -10.3763 0.3495 -7.7301 {"}'S' green -10.5107 0.4479 -7.9311 {"}'S' sea -10.6575 0.5087 -8.1388 {"}'S' sea -10.7973 0.5026 -8.7455 {"}'S' sea -10.9609 0.4412 -8.9397 {"}'S' sea -10.5884 0.4599 -8.8979 {"}'S' sea -10.7516 0.3992 -9.0917 { CZ TYR 75 A}'S' sea -12.463 0.2135 -7.0309 {"}'S' green -12.0584 0.265 -6.8792 {"}'S' green -12.2063 0.3148 -7.0842 {"}'S' green -12.3622 0.3204 -7.2883 {"}'S' sea -12.5226 0.2842 -7.4856 {"}'S' green -11.7853 0.3026 -6.9281 {"}'S' green -12.2373 0.3825 -7.5351 {"}'S' sea -12.3981 0.33 -7.7275 {"}'S' green -12.218 0.3561 -7.9162 {"}'S' green -11.8757 0.4012 -7.9149 {"}'S' sea -12.0393 0.3397 -8.1091 {"}'S' green -10.9394 0.0932 -7.0537 {"}'S' green -11.5051 0.3814 -7.8635 {"}'S' sea -11.6668 0.3584 -8.0673 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 75 A}'S' P -11.2853 0.2649 -6.8188 {"}'S' -11.2871 0.2582 -6.8163 { CE2 TYR 75 A}'S' P -10.8446 0.2763 -7.511 {"}'S' -10.8439 0.2656 -7.5178 {"}'S' P -10.98 0.3665 -7.7098 {"}'S' -10.9786 0.3529 -7.7167 { CZ TYR 75 A}'S' P -11.9277 0.3685 -7.131 {"}'S' -11.9272 0.3512 -7.1348 {"}'S' P -12.0796 0.3957 -7.3345 {"}'S' -12.0768 0.3727 -7.3373 {"}'S' P -11.5891 0.3465 -7.1005 {"}'S' -11.5901 0.3404 -7.1023 {"}'S' P -11.7359 0.4073 -7.3082 {"}'S' -11.7377 0.3681 -7.3137 {"}'S' P -11.8925 0.4302 -7.5156 {"}'S' -11.8906 0.3895 -7.5174 {"}'S' P -12.0541 0.4128 -7.7205 {"}'S' -12.0537 0.4108 -7.7195 {"}'S' P -11.2697 0.2663 -7.0951 {"}'S' -11.2793 0.2383 -7.1037 {"}'S' P -11.4076 0.3573 -7.2975 {"}'S' -11.4178 0.3137 -7.3049 {"}'S' P -11.5567 0.4103 -7.5049 {"}'S' -11.5603 0.3864 -7.5061 {"}'S' P -11.7136 0.4246 -7.7123 {"}'S' -11.7145 0.4082 -7.7116 {"}'S' P -11.0617 0.2195 -7.2462 {"}'S' -11.0701 0.2024 -7.2503 {"}'S' P -11.1988 0.3104 -7.4492 {"}'S' -11.2109 0.2779 -7.4515 {"}'S' P -11.3474 0.3642 -7.6561 {"}'S' -11.3479 0.3634 -7.6565 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 170 A}'S' sky -12.2313 0.6413 -6.335 {"}'S' blue -12.0728 0.7316 -6.1561 {"}'S' sky -11.7811 0.6861 -6.181 {"}'S' sky -11.4807 0.6918 -6.2229 {"}'S' sky -11.5288 0.7203 -8.3185 {"}'S' sky -11.1576 0.7303 -8.1587 { CG TYR 170 A}'S' blue -11.9062 0.6777 -8.3956 {"}'S' blue -11.7996 0.6557 -8.6789 {"}'S' blue -11.6358 0.6937 -8.4791 {"}'S' blue -11.7022 0.686 -8.9765 {"}'S' blue -11.5445 0.6978 -8.7757 {"}'S' sky -11.3842 0.7481 -8.5834 {"}'S' blue -11.2261 0.8367 -8.403 { CD2 TYR 170 A}'S' blue -11.3214 0.7036 -9.077 {"}'S' sky -11.1584 0.7403 -8.8763 {"}'S' sky -10.9949 0.8159 -8.6871 {"}'S' blue -10.8362 0.9278 -8.5128 {"}'S' sky -11.1766 0.6185 -9.2955 {"}'S' sky -10.6912 0.8013 -8.7182 {"}'S' blue -10.5358 0.9335 -8.5547 {"}'S' sky -10.9778 0.5739 -9.4596 {"}'S' sky -10.4921 0.7533 -8.8811 {"}'S' blue -10.3371 0.8847 -8.718 {"}'S' blue -10.7091 0.574 -9.5401 {"}'S' sky -10.5453 0.612 -9.3403 {"}'S' sky -10.3826 0.6877 -9.1505 {"}'S' blue -10.2242 0.8015 -8.9771 { HB2 TYR 170 A}'S' sky -11.3393 0.729 -6.1834 {"}'S' sky -11.0997 0.6129 -6.2089 {"}'S' sky -10.7427 0.6916 -6.1797 {"}'S' sky -10.4664 0.7397 -6.2677 {"}'S' sky -10.3365 0.6048 -6.4934 {"}'S' sky -10.1754 0.6218 -6.6992 {"}'S' blue -10.0669 0.8369 -6.6187 {"}'S' sky -10.9812 0.8042 -8.1599 {"}'S' sky -10.0628 0.6617 -6.932 {"}'S' blue -9.9892 0.7487 -7.1691 {"}'S' sky -10.421 0.7723 -7.9646 {"}'S' sky -10.2876 0.6695 -7.764 {"}'S' sky -10.1241 0.6981 -7.5607 {"}'S' blue -9.9735 0.8521 -7.4087 { HB3 TYR 170 A}'S' blue -12.7738 0.4567 -6.6294 {"}'S' sky -12.6151 0.5212 -6.4426 {"}'S' blue -12.4622 0.6372 -6.2772 {"}'S' sky -12.8253 0.4529 -7.1262 {"}'S' sky -12.6729 0.428 -6.9224 {"}'S' sky -12.5135 0.4584 -6.7252 {"}'S' sky -12.3555 0.5442 -6.5442 {"}'S' blue -12.7851 0.6166 -7.5306 {"}'S' sky -12.6567 0.5158 -7.3355 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 170 A}'S' sea -12.426 0.4649 -6.9522 {"}'S' sea -12.2663 0.4619 -6.7452 {"}'S' sea -12.1033 0.4987 -6.5446 {"}'S' sea -11.9398 0.5743 -6.3554 {"}'S' sea -12.5659 0.5345 -7.5813 {"}'S' green -12.4283 0.4443 -7.3779 {"}'S' green -12.2792 0.3913 -7.1706 {"}'S' green -12.1215 0.3769 -6.9637 {"}'S' green -11.9594 0.4004 -6.7611 {"}'S' green -11.7966 0.4619 -6.5663 {"}'S' sea -11.6361 0.5596 -6.3865 {"}'S' green -12.3661 0.4942 -7.7451 {"}'S' green -12.2286 0.4023 -7.5431 {"}'S' green -11.7606 0.3543 -6.925 {"}'S' green -11.5983 0.4151 -6.7306 {"}'S' sea -12.2346 0.5679 -8.0248 {"}'S' green -12.1079 0.4522 -7.8286 {"}'S' sea -11.9784 0.5608 -8.1071 {"}'S' green -11.8501 0.4572 -7.9115 {"}'S' sea -11.6383 0.5289 -8.0485 {"}'S' green -11.4963 0.4608 -7.8457 {"}'S' sea -11.3976 0.6149 -8.1202 { CD2 TYR 170 A}'S' sea -11.0145 0.642 -9.0929 {"}'S' sea -10.8516 0.7036 -8.8981 {"}'S' sea -10.8157 0.596 -9.2567 {"}'S' sea -10.6534 0.6568 -9.0624 { HB2 TYR 170 A}'S' green -11.5661 0.3877 -6.7487 {"}'S' green -11.4087 0.4056 -6.5496 {"}'S' green -11.2505 0.4824 -6.3664 {"}'S' green -11.0264 0.3766 -6.458 {"}'S' sea -10.8771 0.5126 -6.3021 {"}'S' green -11.039 0.2015 -6.8573 {"}'S' green -10.8803 0.266 -6.6706 {"}'S' green -10.7274 0.3821 -6.5051 {"}'S' sea -10.5879 0.5428 -6.3683 {"}'S' green -11.3432 0.4109 -7.7396 {"}'S' green -10.9381 0.1728 -7.1504 {"}'S' sea -10.7787 0.2033 -6.9531 {"}'S' sea -10.6207 0.289 -6.7721 {"}'S' sea -10.4706 0.4249 -6.6168 {"}'S' green -11.1529 0.5142 -7.9337 {"}'S' green -10.7746 0.2176 -7.3609 {"}'S' sea -10.6164 0.2354 -7.1624 {"}'S' sea -10.4587 0.3114 -6.9796 {"}'S' sea -10.3083 0.4428 -6.8211 {"}'S' green -10.9167 0.5953 -8.0173 {"}'S' green -10.813 0.4365 -7.8393 {"}'S' green -10.5224 0.3175 -7.4303 {"}'S' green -10.3591 0.3664 -7.2337 {"}'S' sea -10.2019 0.4848 -7.0629 {"}'S' sea -10.6785 0.7022 -8.0476 {"}'S' green -10.5759 0.5494 -7.8725 {"}'S' green -10.4388 0.4744 -7.6731 {"}'S' green -10.2824 0.4851 -7.4738 {"}'S' sea -10.1263 0.5805 -7.2993 { HB3 TYR 170 A}'S' sea -12.5094 0.4728 -7.1329 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB TYR 170 A}'S' P -12.08 0.3486 -7.3362 {"}'S' -12.0764 0.3711 -7.3347 {"}'S' P -11.9227 0.3322 -7.1278 {"}'S' -11.9222 0.3492 -7.1293 {"}'S' P -11.9658 0.3739 -7.6234 {"}'S' -11.964 0.3992 -7.6182 {"}'S' P -11.8134 0.333 -7.4161 {"}'S' -11.8134 0.3786 -7.4111 {"}'S' P -11.654 0.3323 -7.2083 {"}'S' -11.6561 0.3559 -7.2097 {"}'S' P -11.7089 0.3904 -7.7101 {"}'S' -11.7091 0.4071 -7.7056 {"}'S' P -11.5566 0.3626 -7.5059 {"}'S' -11.5603 0.3857 -7.5025 { HB2 TYR 170 A}'S' P -11.4962 0.2854 -7.04 {"}'S' -11.4909 0.2966 -7.0405 {"}'S' P -11.3443 0.2596 -6.8367 {"}'S' -11.3429 0.2644 -6.8376 {"}'S' P -11.1849 0.2901 -6.6394 {"}'S' -11.1848 0.2928 -6.64 {"}'S' P -11.4725 0.3256 -7.4525 {"}'S' -11.46 0.3529 -7.4433 {"}'S' P -11.3418 0.2312 -7.2575 {"}'S' -11.3283 0.276 -7.251 {"}'S' P -11.1945 0.1896 -7.0552 {"}'S' -11.1924 0.2052 -7.0558 {"}'S' P -11.2271 0.2792 -7.5542 {"}'S' -11.2237 0.2994 -7.5457 {"}'S' P -11.0905 0.1978 -7.3541 {"}'S' -11.0884 0.2223 -7.3499 {"}'S' P -11.0503 0.3615 -7.7586 {"}'S' -11.0504 0.3672 -7.7549 {"}'S' P -10.9219 0.2607 -7.5634 {"}'S' -10.9232 0.277 -7.5571 {"}'S' P -10.6781 0.3417 -7.6384 {"}'S' -10.678 0.3448 -7.6373 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O TYR 75 A}'M' P -9.101 3.1213 -6.4694 {"}'M' -9.099 3.1204 -6.4699 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 75 A}'M' greentint -9.221 2.5955 -5.9135 {"}'M' greentint -9.3645 2.4877 -6.186 {"}'M' greentint -8.959 2.9167 -5.7809 {"}'M' greentint -9.1223 2.8834 -5.9827 {"}'M' greentint -9.2709 2.7264 -6.1312 {"}'M' greentint -9.3746 2.6301 -6.4287 {"}'M' greentint -9.4311 2.3806 -6.4319 {"}'M' greentint -8.8151 3.1219 -5.8429 {"}'M' greentint -8.973 3.1135 -6.0449 {"}'M' greentint -9.1316 3.0203 -6.2233 {"}'M' greentint -9.2709 2.8524 -6.3565 {"}'M' greentint -9.3442 2.7241 -6.6735 {"}'M' greentint -9.4153 2.479 -6.6977 {"}'M' greentint -8.786 3.3026 -6.1127 {"}'M' greentint -8.9462 3.2444 -6.3047 {"}'M' greentint -9.2367 2.9438 -6.5956 {"}'M' greentint -9.2663 2.8043 -6.9117 {"}'M' greentint -9.3475 2.5611 -6.9501 {"}'M' greentint -8.7033 3.4226 -6.3568 {"}'M' greentint -8.8654 3.3404 -6.5425 {"}'M' greentint -9.0176 3.2045 -6.7025 {"}'M' greentint -9.1543 3.0229 -6.8273 {"}'M' greentint -9.1518 2.8491 -7.1414 {"}'M' greentint -9.2374 2.6142 -7.1859 {"}'M' greentint -8.6085 3.4854 -6.6158 {"}'M' greentint -8.7643 3.3867 -6.7891 {"}'M' greentint -8.9104 3.2431 -6.939 {"}'M' greentint -9.0412 3.0611 -7.0574 {"}'M' greentint -8.7552 3.2669 -7.1441 {"}'M' greentint -8.8873 3.0839 -7.2641 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H TYR 170 A}'M' P -8.6966 2.6301 -6.4966 {"}'M' -8.7042 2.6368 -6.4965 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 170 A}'M' greentint -9.2714 2.4177 -6.0085 {"}'M' greentint -9.1301 2.5685 -5.8669 {"}'M' greentint -9.0095 2.7628 -5.7652 {"}'M' greentint -9.3157 2.2805 -6.4563 {"}'M' greentint -9.1575 2.3442 -6.27 {"}'M' greentint -9.0072 2.4687 -6.1102 {"}'M' greentint -8.8741 2.6443 -5.9871 {"}'M' greentint -8.7689 2.8589 -5.9094 {"}'M' greentint -8.6954 3.0987 -5.8825 {"}'M' greentint -9.2651 2.3395 -6.8074 {"}'M' greentint -9.1069 2.3417 -6.6036 {"}'M' greentint -8.9462 2.4177 -6.4167 {"}'M' greentint -8.7967 2.5631 -6.2644 {"}'M' greentint -8.6721 2.763 -6.1585 {"}'M' greentint -8.5835 3.0006 -6.1105 {"}'M' greentint -8.539 3.2554 -6.1232 {"}'M' greentint -9.1619 2.5022 -7.0624 {"}'M' greentint -9.0132 2.4526 -6.8563 {"}'M' greentint -8.8509 2.4975 -6.6583 {"}'M' greentint -8.5724 2.8334 -6.392 {"}'M' greentint -8.4941 3.0791 -6.3599 {"}'M' greentint -8.4731 3.3345 -6.4032 {"}'M' greentint -9.0339 2.7378 -7.2249 {"}'M' greentint -8.9022 2.636 -7.0267 {"}'M' greentint -8.7412 2.6641 -6.8267 {"}'M' greentint -8.5932 2.816 -6.6779 {"}'M' greentint -8.4983 3.0502 -6.6206 {"}'M' greentint -8.4821 3.3039 -6.6699 {"}'M' greentint -8.8729 3.009 -7.2581 {"}'M' greentint -8.7687 2.8539 -7.0803 {"}'M' greentint -8.6087 2.9508 -6.9008 {"}'M' greentint -8.5538 3.2041 -6.9006 {"}'M' greentint -8.687 3.1004 -7.1001 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 75 A}'M' greentint -9.5981 1.56 -3.8788 {"}'M' greentint -9.7313 1.4564 -4.0783 {"}'M' greentint -9.5164 1.8066 -3.8986 {"}'M' greentint -9.6764 1.7097 -4.078 {"}'M' greentint -9.7867 1.6103 -4.3583 {"}'M' greentint -9.803 1.3566 -4.309 {"}'M' greentint -9.3829 2.0244 -3.9521 {"}'M' greentint -9.5439 1.9964 -4.1521 {"}'M' greentint -9.6919 1.8444 -4.301 {"}'M' greentint -9.7585 1.7078 -4.6119 {"}'M' greentint -9.8089 1.4531 -4.6073 {"}'M' greentint -9.1945 2.1943 -4.0188 {"}'M' greentint -9.3534 2.1975 -4.2247 {"}'M' greentint -9.5136 2.1064 -4.4076 {"}'M' greentint -9.655 1.9359 -4.5431 {"}'M' greentint -9.6616 1.782 -4.8519 {"}'M' greentint -9.7299 1.533 -4.8696 {"}'M' greentint -9.0976 2.329 -4.2743 {"}'M' greentint -9.2589 2.2898 -4.4721 {"}'M' greentint -9.4156 2.1778 -4.6435 {"}'M' greentint -9.5541 2.0031 -4.7743 {"}'M' greentint -9.5162 1.8016 -5.0695 {"}'M' greentint -9.1276 2.3162 -4.7088 {"}'M' greentint -9.2779 2.1918 -4.8687 {"}'M' greentint -9.411 2.0162 -4.9918 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 170 A}'M' greentint -9.6865 1.3086 -4.1029 {"}'M' greentint -9.5462 1.4706 -3.9669 {"}'M' greentint -9.4242 1.6672 -3.8639 {"}'M' greentint -9.3259 1.8921 -3.7978 {"}'M' greentint -9.7309 1.2481 -4.5069 {"}'M' greentint -9.5731 1.3583 -4.3335 {"}'M' greentint -9.4277 1.52 -4.1905 {"}'M' greentint -9.3031 1.7224 -4.0869 {"}'M' greentint -9.2067 1.9555 -4.027 {"}'M' greentint -9.1429 2.2073 -4.0145 {"}'M' greentint -9.66 1.3502 -4.7597 {"}'M' greentint -9.5002 1.4388 -4.5787 {"}'M' greentint -9.3535 1.5884 -4.4311 {"}'M' greentint -9.2298 1.7881 -4.3264 {"}'M' greentint -9.138 2.0223 -4.2731 {"}'M' greentint -9.086 2.2732 -4.2747 {"}'M' greentint -9.5417 1.5207 -4.9138 {"}'M' greentint -9.3847 1.6166 -4.7364 {"}'M' greentint -9.2462 1.7871 -4.6049 {"}'M' greentint -9.1433 2.0106 -4.534 {"}'M' greentint -9.0889 2.2604 -4.5337 {"}'M' greentint -9.4031 1.7468 -4.9878 {"}'M' greentint -9.2533 1.9005 -4.837 {"}'M' greentint -9.158 2.1368 -4.7795 {"}'M' greentint -9.2949 2.0447 -5.048 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 276 1uowA_278F_403}P -12.2779 -2.5262 0.0044 {"}-12.2779 -2.5262 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c gln A 403 1uowA_278F_403}P -11.9305 2.6066 -5.0721 { n trp A 404 1uowA_278F_403}-12.8264 2.8834 -4.1126 { ca trp A 404 1uowA_278F_403}-13.2528 1.9364 -3.1122 { c trp A 404 1uowA_278F_403}-14.315 0.9855 -3.6633 { o trp A 404 1uowA_278F_403}-15.1515 1.3728 -4.5123 { c trp A 404 1uowA_278F_403}P -14.315 0.9855 -3.6633 { n his A 405 1uowA_278F_403}-14.2945 -0.2223 -3.129 { ca his A 405 1uowA_278F_403}-15.2561 -1.2518 -3.4102 { c his A 405 1uowA_278F_403}-15.6376 -2.0018 -2.1524 { o his A 405 1uowA_278F_403}-14.7739 -2.3304 -1.3276 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 276 1uowA_278F_403}P -12.2779 -2.5262 0.0044 { ca ile A 276 1uowA_278F_403}P -10.9233 -2.4915 -0.5922 { n cys A 277 1uowA_278F_403}P -9.6373 -0.6772 -1.5267 { ca cys A 277 1uowA_278F_403}P -9.3473 0.4278 -2.4095 { n phe A 278 1uowA_278F_403}P -8.3897 0.1668 -4.6143 { ca phe A 278 1uowA_278F_403}P -7.3325 -0.1142 -5.5558 { n ser A 279 1uowA_278F_403}P -6.3061 1.0222 -7.4027 { ca ser A 279 1uowA_278F_403}P -6.2953 1.7812 -8.6429 { n leu A 280 1uowA_278F_403}P -6.7158 1.3366 -10.9446 { ca leu A 280 1uowA_278F_403}P -6.6789 0.6973 -12.2436 { n ile A 401 1uowA_278F_403}P -6.8611 5.3667 -11.9042 { ca ile A 401 1uowA_278F_403}P -8.0961 5.747 -11.249 { n ala A 402 1uowA_278F_403}P -8.2916 5.5239 -8.8455 { ca ala A 402 1uowA_278F_403}P -8.4823 4.8223 -7.5688 { n gln A 403 1uowA_278F_403}P -10.4406 3.7366 -6.6259 { ca gln A 403 1uowA_278F_403}P -11.8012 3.6921 -6.136 { n trp A 404 1uowA_278F_403}P -12.8264 2.8834 -4.1126 { ca trp A 404 1uowA_278F_403}P -13.2528 1.9364 -3.1122 { n his A 405 1uowA_278F_403}P -14.2945 -0.2223 -3.129 { ca his A 405 1uowA_278F_403}P -15.2561 -1.2518 -3.4102 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 276 1uowA_278F_403}P -10.9233 -2.4915 -0.5922 {"}-10.9233 -2.4915 -0.5922 { ca cys A 277 1uowA_278F_403}-9.3473 0.4278 -2.4095 { ca phe A 278 1uowA_278F_403}-7.3325 -0.1142 -5.5558 { ca ser A 279 1uowA_278F_403}-6.2953 1.7812 -8.6429 { ca leu A 280 1uowA_278F_403}-6.6789 0.6973 -12.2436 { ca ile A 401 1uowA_278F_403}P -8.0961 5.747 -11.249 {"}-8.0961 5.747 -11.249 { ca ala A 402 1uowA_278F_403}-8.4823 4.8223 -7.5688 { ca gln A 403 1uowA_278F_403}-11.8012 3.6921 -6.136 { ca trp A 404 1uowA_278F_403}-13.2528 1.9364 -3.1122 { ca his A 405 1uowA_278F_403}-15.2561 -1.2518 -3.4102 @subgroup {sidechain} off @vectorlist {sc} color= green alpha= 0.2353 master= {sidechain} { ca phe A 278 1uowA_278F_403}P -7.3325 -0.1142 -5.5558 { ca gln A 403 1uowA_278F_403}P -11.8012 3.6921 -6.136 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 278 A}'M' green -9.6443 1.816 -6.3398 {"}'M' green -9.7979 1.8506 -6.855 {"}'M' green -9.7675 1.9446 -7.0998 {"}'M' green -9.5776 2.2434 -7.2536 {"}'M' green -8.8726 2.7571 -6.8499 {"}'M' green -9.0318 2.706 -7.0421 {"}'M' green -9.1876 2.6072 -7.2154 {"}'M' green -9.3337 2.4636 -7.3653 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 278 A}'M' greentint -9.3823 2.1373 -6.2072 {"}'M' greentint -9.5456 2.1039 -6.409 {"}'M' greentint -9.6942 1.947 -6.5575 {"}'M' greentint -9.2384 2.3424 -6.2692 {"}'M' greentint -9.3963 2.334 -6.4712 {"}'M' greentint -9.5549 2.2409 -6.6496 {"}'M' greentint -9.6942 2.0729 -6.7827 {"}'M' greentint -9.0532 2.5125 -6.3352 {"}'M' greentint -9.2094 2.5231 -6.539 {"}'M' greentint -9.3696 2.4649 -6.731 {"}'M' greentint -9.5243 2.3418 -6.8957 {"}'M' greentint -9.6601 2.1643 -7.0219 {"}'M' greentint -8.9661 2.6666 -6.5811 {"}'M' greentint -9.1262 2.6425 -6.7824 {"}'M' greentint -9.2887 2.5609 -6.9688 {"}'M' greentint -9.4409 2.425 -7.1288 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLN 403 A}'M' green -9.7817 1.8935 -6.4803 {"}'M' green -9.6235 1.9572 -6.294 {"}'M' green -9.4733 2.0817 -6.1342 {"}'M' green -9.1381 2.376 -6.1825 {"}'M' green -8.9601 2.6921 -6.3839 {"}'M' green -9.5 2.3508 -7.2489 {"}'M' green -9.1531 2.7134 -7.1241 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLN 403 A}'M' greentint -9.7311 1.9525 -6.8314 {"}'M' greentint -9.5729 1.9547 -6.6276 {"}'M' greentint -9.4122 2.0307 -6.4407 {"}'M' greentint -9.2627 2.1761 -6.2883 {"}'M' greentint -9.628 2.1152 -7.0864 {"}'M' greentint -9.4792 2.0656 -6.8803 {"}'M' greentint -9.3169 2.1105 -6.6823 {"}'M' greentint -9.1627 2.2431 -6.5206 {"}'M' greentint -9.0384 2.4464 -6.416 {"}'M' greentint -9.3682 2.249 -7.0507 {"}'M' greentint -9.2072 2.2771 -6.8507 {"}'M' greentint -9.0592 2.429 -6.7019 {"}'M' greentint -8.9644 2.6632 -6.6445 {"}'M' greentint -9.2347 2.4669 -7.1043 {"}'M' greentint -9.0748 2.5638 -6.9248 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 278 A}'M' -9.8122 1.1055 -4.4966 {"}'M' -10.2295 0.2863 -5.0714 {"}'M' -10.1797 0.3608 -5.3706 {"}'M' -10.019 0.6428 -5.6409 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 278 A}'M' sea -10.1606 0.5375 -4.6227 {"}'M' sea -9.9457 0.8877 -4.4431 {"}'M' green -10.1057 0.7907 -4.6225 {"}'M' sea -10.2324 0.4377 -4.8535 {"}'M' green -9.9732 1.0774 -4.6966 {"}'M' green -10.2382 0.5341 -5.1518 {"}'M' sea -9.7827 1.2785 -4.7692 {"}'M' green -9.9429 1.1875 -4.952 {"}'M' green -10.0909 0.8631 -5.3964 {"}'M' green -10.1592 0.6141 -5.4141 {"}'M' sea -9.6882 1.3709 -5.0166 {"}'M' green -9.8449 1.2589 -5.188 {"}'M' green -9.9834 1.0841 -5.3188 {"}'M' sea -9.9455 0.8826 -5.614 {"}'M' sea -9.7072 1.2728 -5.4132 {"}'M' sea -9.8403 1.0973 -5.5362 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 278 A}'M' greentint -10.2161 0.6914 -4.9028 {"}'M' greentint -10.1213 0.9255 -4.8455 {"}'M' greentint -10.1878 0.7888 -5.1564 {"}'M' greentint -10.0843 1.0169 -5.0876 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLN 403 A}'M' sky -10.4945 0.4556 -4.8177 {"}'M' sky -10.0612 1.2801 -4.4871 {"}'M' sky -10.3497 0.6677 -5.6286 @dotlist {x} color= red width= 1 master= {vdw contact} { O GLN 403 A}'M' sea -10.3542 0.6176 -4.6817 {"}'M' green -10.2322 0.8142 -4.5787 {"}'M' sea -10.1339 1.0391 -4.5127 {"}'M' green -10.3811 0.5053 -5.0483 {"}'M' green -10.2357 0.667 -4.9053 {"}'M' green -10.0147 1.1025 -4.7419 {"}'M' sea -9.9509 1.3543 -4.7293 {"}'M' green -10.3082 0.5857 -5.2935 {"}'M' green -9.894 1.4201 -4.9895 {"}'M' green -10.1927 0.7635 -5.4512 {"}'M' green -9.9513 1.1576 -5.2488 {"}'M' sea -9.8969 1.4073 -5.2485 {"}'M' sea -10.2111 0.8937 -5.7026 {"}'M' green -10.0613 1.0474 -5.5518 {"}'M' sea -9.966 1.2837 -5.4943 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLN 403 A}'M' greentint -10.1111 0.8694 -4.8017 {"}'M' greentint -10.1615 0.7353 -5.1459 {"}'M' greentint -10.0378 0.9351 -5.0412 {"}'M' greentint -9.946 1.1692 -4.9879 {"}'M' greentint -10.0542 0.9341 -5.3197 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 7 1uteA_9F_276V}P -12.1682 -1.3365 0.6604 {"}-12.1682 -1.3365 0.6604 { ca leu A 7 1uteA_9F_276V}-11.3201 -2.0802 -0.2663 { c leu A 7 1uteA_9F_276V}-10.8835 -0.9854 -1.2337 { o leu A 7 1uteA_9F_276V}-11.7205 -0.2433 -1.7439 { c leu A 7 1uteA_9F_276V}P -10.8835 -0.9854 -1.2337 { n arg A 8 1uteA_9F_276V}-9.5823 -0.8737 -1.4766 { ca arg A 8 1uteA_9F_276V}-9.0713 0.1772 -2.3561 { c arg A 8 1uteA_9F_276V}-8.1532 -0.353 -3.4496 { o arg A 8 1uteA_9F_276V}-7.3712 -1.2714 -3.2221 { c arg A 8 1uteA_9F_276V}P -8.1532 -0.353 -3.4496 { n phe A 9 1uteA_9F_276V}-8.2572 0.2241 -4.6376 { ca phe A 9 1uteA_9F_276V}-7.3945 -0.1893 -5.7344 { c phe A 9 1uteA_9F_276V}-7.2411 0.8779 -6.8038 { o phe A 9 1uteA_9F_276V}-8.0913 1.7576 -6.9568 { c phe A 9 1uteA_9F_276V}P -7.2411 0.8779 -6.8038 { n val A 10 1uteA_9F_276V}-6.1252 0.8011 -7.5203 { ca val A 10 1uteA_9F_276V}-5.8297 1.7347 -8.6009 { c val A 10 1uteA_9F_276V}-6.1641 1.044 -9.9273 { o val A 10 1uteA_9F_276V}-5.8293 -0.1211 -10.1145 { c val A 10 1uteA_9F_276V}P -6.1641 1.044 -9.9273 { n ala A 11 1uteA_9F_276V}-6.8424 1.7527 -10.8265 { ca ala A 11 1uteA_9F_276V}-7.1744 1.2154 -12.1453 { c ala A 11 1uteA_9F_276V}-6.4228 2.0664 -13.1663 { o ala A 11 1uteA_9F_276V}-6.7412 3.2387 -13.3582 { n ala A 274 1uteA_9F_276V}P -7.5051 6.0732 -12.2262 {"}-7.5051 6.0732 -12.2262 { ca ala A 274 1uteA_9F_276V}-8.6804 6.0694 -11.3624 { c ala A 274 1uteA_9F_276V}-8.3646 5.3778 -10.0502 { o ala A 274 1uteA_9F_276V}-7.635 4.3894 -10.0184 { c ala A 274 1uteA_9F_276V}P -8.3646 5.3778 -10.0502 { n tyr A 275 1uteA_9F_276V}-8.9094 5.9222 -8.9658 { ca tyr A 275 1uteA_9F_276V}-8.7186 5.3578 -7.6363 { c tyr A 275 1uteA_9F_276V}-10.1007 4.974 -7.112 { o tyr A 275 1uteA_9F_276V}-10.9491 5.8379 -6.8795 { c tyr A 275 1uteA_9F_276V}P -10.1007 4.974 -7.112 { n val A 276 1uteA_9F_276V}-10.3161 3.6724 -6.9435 { ca val A 276 1uteA_9F_276V}-11.5889 3.1355 -6.4775 { c val A 276 1uteA_9F_276V}-11.567 2.7367 -4.9945 { o val A 276 1uteA_9F_276V}-10.6576 2.042 -4.5347 { c val A 276 1uteA_9F_276V}P -11.567 2.7367 -4.9945 { n glu A 277 1uteA_9F_276V}-12.5755 3.1898 -4.2549 { ca glu A 277 1uteA_9F_276V}-12.7158 2.8859 -2.8274 { c glu A 277 1uteA_9F_276V}-14.1076 2.2831 -2.6149 { o glu A 277 1uteA_9F_276V}-15.1195 2.9294 -2.8928 { c glu A 277 1uteA_9F_276V}P -14.1076 2.2831 -2.6149 { n ile A 278 1uteA_9F_276V}-14.1484 1.0458 -2.1285 { ca ile A 278 1uteA_9F_276V}-15.4086 0.346 -1.902 { c ile A 278 1uteA_9F_276V}-15.6293 0.036 -0.4241 { o ile A 278 1uteA_9F_276V}-14.8237 -0.6452 0.2054 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 7 1uteA_9F_276V}P -12.1682 -1.3365 0.6604 { ca leu A 7 1uteA_9F_276V}P -11.3201 -2.0802 -0.2663 { n arg A 8 1uteA_9F_276V}P -9.5823 -0.8737 -1.4766 { ca arg A 8 1uteA_9F_276V}P -9.0713 0.1772 -2.3561 { n phe A 9 1uteA_9F_276V}P -8.2572 0.2241 -4.6376 { ca phe A 9 1uteA_9F_276V}P -7.3945 -0.1893 -5.7344 { n val A 10 1uteA_9F_276V}P -6.1252 0.8011 -7.5203 { ca val A 10 1uteA_9F_276V}P -5.8297 1.7347 -8.6009 { n ala A 11 1uteA_9F_276V}P -6.8424 1.7527 -10.8265 { ca ala A 11 1uteA_9F_276V}P -7.1744 1.2154 -12.1453 { n ala A 274 1uteA_9F_276V}P -7.5051 6.0732 -12.2262 { ca ala A 274 1uteA_9F_276V}P -8.6804 6.0694 -11.3624 { n tyr A 275 1uteA_9F_276V}P -8.9094 5.9222 -8.9658 { ca tyr A 275 1uteA_9F_276V}P -8.7186 5.3578 -7.6363 { n val A 276 1uteA_9F_276V}P -10.3161 3.6724 -6.9435 { ca val A 276 1uteA_9F_276V}P -11.5889 3.1355 -6.4775 { n glu A 277 1uteA_9F_276V}P -12.5755 3.1898 -4.2549 { ca glu A 277 1uteA_9F_276V}P -12.7158 2.8859 -2.8274 { n ile A 278 1uteA_9F_276V}P -14.1484 1.0458 -2.1285 { ca ile A 278 1uteA_9F_276V}P -15.4086 0.346 -1.902 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 7 1uteA_9F_276V}P -11.3201 -2.0802 -0.2663 {"}-11.3201 -2.0802 -0.2663 { ca arg A 8 1uteA_9F_276V}-9.0713 0.1772 -2.3561 { ca phe A 9 1uteA_9F_276V}-7.3945 -0.1893 -5.7344 { ca val A 10 1uteA_9F_276V}-5.8297 1.7347 -8.6009 { ca ala A 11 1uteA_9F_276V}-7.1744 1.2154 -12.1453 { ca ala A 274 1uteA_9F_276V}P -8.6804 6.0694 -11.3624 {"}-8.6804 6.0694 -11.3624 { ca tyr A 275 1uteA_9F_276V}-8.7186 5.3578 -7.6363 { ca val A 276 1uteA_9F_276V}-11.5889 3.1355 -6.4775 { ca glu A 277 1uteA_9F_276V}-12.7158 2.8859 -2.8274 { ca ile A 278 1uteA_9F_276V}-15.4086 0.346 -1.902 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 9 1uteA_9F_276V}P -7.3945 -0.1893 -5.7344 { cb phe A 9 1uteA_9F_276V}-7.879 -1.5142 -6.3556 { cg phe A 9 1uteA_9F_276V}-9.21 -1.4256 -7.074 { cd1 phe A 9 1uteA_9F_276V}-9.2651 -1.1343 -8.4341 { ce1 phe A 9 1uteA_9F_276V}-10.4816 -1.1167 -9.1218 { cz phe A 9 1uteA_9F_276V}-11.6684 -1.395 -8.4401 { cg phe A 9 1uteA_9F_276V}P -9.21 -1.4256 -7.074 { cd2 phe A 9 1uteA_9F_276V}-10.4004 -1.6988 -6.4001 { ce2 phe A 9 1uteA_9F_276V}-11.6312 -1.6852 -7.0772 { cz phe A 9 1uteA_9F_276V}ghost -11.6684 -1.395 -8.4401 { ca val A 276 1uteA_9F_276V}P -11.5889 3.1355 -6.4775 { cb val A 276 1uteA_9F_276V}-11.9724 1.8975 -7.3171 { cg1 val A 276 1uteA_9F_276V}-13.3273 1.3614 -6.8866 { cb val A 276 1uteA_9F_276V}P -11.9724 1.8975 -7.3171 { cg2 val A 276 1uteA_9F_276V}-11.9822 2.2596 -8.7871 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 9 1uteA_9F_276V}P -7.879 -1.5142 -6.3556 {"}P -7.879 -1.5142 -6.3556 { cd1 phe A 9 1uteA_9F_276V}P -9.2651 -1.1343 -8.4341 { cd2 phe A 9 1uteA_9F_276V}P -10.4004 -1.6988 -6.4001 { ce1 phe A 9 1uteA_9F_276V}P -10.4816 -1.1167 -9.1218 { ce2 phe A 9 1uteA_9F_276V}P -11.6312 -1.6852 -7.0772 { cz phe A 9 1uteA_9F_276V}P -11.6684 -1.395 -8.4401 { cb val A 276 1uteA_9F_276V}P -11.9724 1.8975 -7.3171 { cg1 val A 276 1uteA_9F_276V}P -13.3273 1.3614 -6.8866 {"}P -13.3273 1.3614 -6.8866 {"}P -13.3273 1.3614 -6.8866 { cg2 val A 276 1uteA_9F_276V}P -11.9822 2.2596 -8.7871 {"}P -11.9822 2.2596 -8.7871 {"}P -11.9822 2.2596 -8.7871 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 9 A}'S' blue -10.1716 0.0279 -6.9121 {"}'S' sky -10.3302 -0.0811 -7.0869 {"}'S' blue -9.9073 0.1762 -6.9709 {"}'S' 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VAL 276 A}'S' P -11.7253 0.0512 -7.0724 {"}'S' -11.7235 0.0568 -7.0729 {"}'S' P -11.5733 0.0254 -6.8691 {"}'S' -11.5697 0.0377 -6.8721 {"}'S' P -11.5709 -0.0029 -7.2899 {"}'S' -11.563 0.0226 -7.2867 {"}'S' P -11.4236 -0.0446 -7.0876 {"}'S' -11.4156 0.0021 -7.0907 {"}'S' P -11.2681 -0.0326 -6.8897 {"}'S' -11.2666 -0.0092 -6.8947 {"}'S' P -11.5723 0.1768 -7.772 {"}'S' -11.5658 0.1929 -7.7617 {"}'S' P -11.4561 0.045 -7.5866 {"}'S' -11.4504 0.0736 -7.5751 {"}'S' P -11.3196 -0.0364 -7.3865 {"}'S' -11.3175 -0.0147 -7.3818 {"}'S' P -11.1672 -0.0613 -7.1827 {"}'S' -11.1695 -0.0324 -7.1822 {"}'S' P -11.2794 0.1273 -7.791 {"}'S' -11.2784 0.1485 -7.7773 {"}'S' P -11.1509 0.0265 -7.5958 {"}'S' -11.151 0.035 -7.5927 {HG11 VAL 276 A}'S' P -13.0266 -0.3853 -8.0472 {"}'S' -13.0296 -0.3803 -8.044 {"}'S' P -12.8702 -0.3745 -7.848 {"}'S' -12.8905 -0.3505 -7.8384 {"}'S' P -12.7141 -0.2791 -7.6734 {"}'S' -12.7283 -0.2666 -7.6701 {"}'S' P -12.8754 -0.1901 -8.1381 {"}'S' -12.8809 -0.1861 -8.1328 {"}'S' P -12.7119 -0.1615 -7.9348 {"}'S' -12.7332 -0.1457 -7.9231 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 9 A}'M' greentint -9.3133 2.281 -6.5182 {"}'M' greentint -9.4171 2.1847 -6.8157 {"}'M' greentint -9.0155 2.6681 -6.4319 {"}'M' greentint -9.1741 2.5749 -6.6103 {"}'M' greentint -9.3133 2.4069 -6.7434 {"}'M' greentint -9.3867 2.2787 -7.0605 {"}'M' greentint -9.4578 2.0336 -7.0847 {"}'M' greentint -8.9887 2.7989 -6.6917 {"}'M' greentint -9.1435 2.6759 -6.8564 {"}'M' greentint -9.2792 2.4983 -6.9826 {"}'M' greentint -9.3088 2.3589 -7.2987 {"}'M' greentint -9.39 2.1157 -7.3371 {"}'M' greentint -8.7458 2.9772 -6.7438 {"}'M' greentint -8.9078 2.895 -6.9295 {"}'M' greentint -9.0601 2.759 -7.0895 {"}'M' greentint -9.1967 2.5775 -7.2143 {"}'M' greentint -9.1943 2.4036 -7.5284 {"}'M' greentint -9.2798 2.1688 -7.5729 {"}'M' greentint -8.6509 3.04 -7.0028 {"}'M' greentint -8.8067 2.9413 -7.1761 {"}'M' greentint -8.9529 2.7977 -7.326 {"}'M' greentint -9.0837 2.6157 -7.4444 {"}'M' greentint -8.7977 2.8214 -7.5311 {"}'M' greentint -8.9298 2.6385 -7.6511 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 276 A}'M' greentint -9.2881 2.273 -6.4921 {"}'M' greentint -9.3154 2.0486 -6.8953 {"}'M' greentint -9.1652 2.1731 -6.7354 {"}'M' greentint -9.0321 2.3487 -6.6123 {"}'M' greentint -8.9268 2.5633 -6.5346 {"}'M' greentint -8.8534 2.8031 -6.5077 {"}'M' greentint -9.2649 2.0461 -7.2288 {"}'M' greentint -9.1042 2.1221 -7.042 {"}'M' greentint -8.9547 2.2675 -6.8896 {"}'M' greentint -8.8301 2.4674 -6.7838 {"}'M' greentint -8.7415 2.705 -6.7357 {"}'M' greentint -8.697 2.9598 -6.7484 {"}'M' greentint -9.1712 2.157 -7.4815 {"}'M' greentint -9.0088 2.2019 -7.2836 {"}'M' greentint -8.8546 2.3345 -7.1219 {"}'M' greentint -8.7304 2.5378 -7.0172 {"}'M' greentint -8.6521 2.7835 -6.9851 {"}'M' greentint -8.6311 3.0389 -7.0284 {"}'M' greentint -9.0602 2.3404 -7.652 {"}'M' greentint -8.8992 2.3685 -7.452 {"}'M' greentint -8.7511 2.5205 -7.3031 {"}'M' greentint -8.6563 2.7546 -7.2458 {"}'M' greentint -8.9267 2.5583 -7.7055 {"}'M' greentint -8.7667 2.6552 -7.5261 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 9 A}'M' green -9.2807 1.7544 -4.3985 {"}'M' green -9.8161 1.0931 -5.2494 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 9 A}'M' greentint -9.6843 1.1201 -4.2585 {"}'M' greentint -9.8176 1.0165 -4.458 {"}'M' greentint -9.6027 1.3667 -4.2784 {"}'M' greentint -9.7626 1.2698 -4.4578 {"}'M' greentint -9.873 1.1704 -4.7381 {"}'M' greentint -9.8893 0.9167 -4.6887 {"}'M' greentint -9.4692 1.5845 -4.3319 {"}'M' greentint -9.6302 1.5565 -4.5319 {"}'M' greentint -9.7782 1.4045 -4.6807 {"}'M' greentint -9.8447 1.2678 -4.9917 {"}'M' greentint -9.8951 1.0132 -4.987 {"}'M' greentint -9.4396 1.7575 -4.6044 {"}'M' greentint -9.5999 1.6665 -4.7873 {"}'M' greentint -9.7413 1.496 -4.9229 {"}'M' greentint -9.7479 1.3421 -5.2317 {"}'M' greentint -9.3452 1.8499 -4.8519 {"}'M' greentint -9.5018 1.7379 -5.0233 {"}'M' greentint -9.6404 1.5631 -5.154 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 276 A}'M' green -9.9168 0.8599 -4.6467 {"}'M' green -9.3925 1.5674 -4.1669 {"}'M' green -9.2719 1.885 -4.4145 {"}'M' green -9.8864 1.1215 -5.2545 {"}'M' green -9.2747 1.8722 -4.6735 {"}'M' green -9.7521 1.3294 -5.3302 {"}'M' green -9.6395 1.5592 -5.3655 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 276 A}'M' greentint -9.759 0.9701 -4.4733 {"}'M' greentint -9.6136 1.1319 -4.3303 {"}'M' greentint -9.489 1.3343 -4.2267 {"}'M' greentint -9.8459 0.962 -4.8995 {"}'M' greentint -9.6861 1.0506 -4.7185 {"}'M' greentint -9.5394 1.2002 -4.5709 {"}'M' greentint -9.4157 1.4 -4.4662 {"}'M' greentint -9.3238 1.6341 -4.4129 {"}'M' greentint -9.7276 1.1325 -5.0536 {"}'M' greentint -9.5706 1.2284 -4.8762 {"}'M' greentint -9.4321 1.399 -4.7447 {"}'M' greentint -9.3292 1.6225 -4.6738 {"}'M' greentint -9.589 1.3586 -5.1276 {"}'M' greentint -9.4392 1.5123 -4.9768 {"}'M' greentint -9.3439 1.7486 -4.9193 {"}'M' greentint -9.4807 1.6565 -5.1878 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n mse A 42 1v0aA_160F_44V}P -6.9223 5.9348 -11.8252 {"}-6.9223 5.9348 -11.8252 { ca mse A 42 1v0aA_160F_44V}-8.1004 6.1676 -10.9971 { c mse A 42 1v0aA_160F_44V}-8.1396 5.23 -9.796 { o mse A 42 1v0aA_160F_44V}-8.1381 4.0065 -9.9505 { c mse A 42 1v0aA_160F_44V}P -8.1396 5.23 -9.796 { n glu A 43 1v0aA_160F_44V}-8.1726 5.8199 -8.6019 { ca glu A 43 1v0aA_160F_44V}-8.3588 5.0637 -7.3696 { c glu A 43 1v0aA_160F_44V}-9.8435 4.8965 -7.0794 { o glu A 43 1v0aA_160F_44V}-10.609 5.8626 -7.1312 { c glu A 43 1v0aA_160F_44V}P -9.8435 4.8965 -7.0794 { n val A 44 1v0aA_160F_44V}-10.2372 3.6616 -6.7786 { ca val A 44 1v0aA_160F_44V}-11.6123 3.345 -6.4087 { c val A 44 1v0aA_160F_44V}-11.6408 2.8541 -4.9634 { o val A 44 1v0aA_160F_44V}-11.0211 1.8413 -4.6319 { c val A 44 1v0aA_160F_44V}P -11.6408 2.8541 -4.9634 { n ser A 45 1v0aA_160F_44V}-12.3541 3.5874 -4.1131 { ca ser A 45 1v0aA_160F_44V}-12.4686 3.2565 -2.6954 { c ser A 45 1v0aA_160F_44V}-13.8994 2.8482 -2.3773 { o ser A 45 1v0aA_160F_44V}-14.8353 3.6087 -2.6219 { c ser A 45 1v0aA_160F_44V}P -13.8994 2.8482 -2.3773 { n tyr A 46 1v0aA_160F_44V}-14.0631 1.6468 -1.8295 { ca tyr A 46 1v0aA_160F_44V}-15.3945 1.093 -1.6038 { c tyr A 46 1v0aA_160F_44V}-15.5845 0.4797 -0.2214 { o tyr A 46 1v0aA_160F_44V}-14.6456 -0.0524 0.3716 { n gly A 158 1v0aA_160F_44V}P -12.4588 -2.2685 0.4383 {"}-12.4588 -2.2685 0.4383 { ca gly A 158 1v0aA_160F_44V}-11.1235 -2.2196 -0.1317 { c gly A 158 1v0aA_160F_44V}-10.8409 -0.9796 -0.9563 { o gly A 158 1v0aA_160F_44V}-11.7021 -0.1133 -1.1247 { c gly A 158 1v0aA_160F_44V}P -10.8409 -0.9796 -0.9563 { n lys A 159 1v0aA_160F_44V}-9.6145 -0.9046 -1.4658 { ca lys A 159 1v0aA_160F_44V}-9.1614 0.2133 -2.2893 { c lys A 159 1v0aA_160F_44V}-8.2367 -0.3022 -3.3839 { o lys A 159 1v0aA_160F_44V}-7.3342 -1.0982 -3.1188 { c lys A 159 1v0aA_160F_44V}P -8.2367 -0.3022 -3.3839 { n phe A 160 1v0aA_160F_44V}-8.4696 0.1477 -4.6132 { ca phe A 160 1v0aA_160F_44V}-7.6252 -0.2417 -5.7422 { c phe A 160 1v0aA_160F_44V}-7.4328 0.8948 -6.7434 { o phe A 160 1v0aA_160F_44V}-8.1695 1.8814 -6.7246 { c phe A 160 1v0aA_160F_44V}P -7.4328 0.8948 -6.7434 { n val A 161 1v0aA_160F_44V}-6.4251 0.7544 -7.6 { ca val A 161 1v0aA_160F_44V}-6.1415 1.7378 -8.6432 { c val A 161 1v0aA_160F_44V}-6.1004 1.0463 -10.0047 { o val A 161 1v0aA_160F_44V}-5.5397 -0.0456 -10.1427 { c val A 161 1v0aA_160F_44V}P -6.1004 1.0463 -10.0047 { n val A 162 1v0aA_160F_44V}-6.7114 1.6813 -11.0019 { ca val A 162 1v0aA_160F_44V}-6.7146 1.1564 -12.3647 { c val A 162 1v0aA_160F_44V}-6.0484 2.123 -13.3392 { o val A 162 1v0aA_160F_44V}-6.0138 3.3349 -13.1071 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n mse A 42 1v0aA_160F_44V}P -6.9223 5.9348 -11.8252 { ca mse A 42 1v0aA_160F_44V}P -8.1004 6.1676 -10.9971 { n glu A 43 1v0aA_160F_44V}P -8.1726 5.8199 -8.6019 { ca glu A 43 1v0aA_160F_44V}P -8.3588 5.0637 -7.3696 { n val A 44 1v0aA_160F_44V}P -10.2372 3.6616 -6.7786 { ca val A 44 1v0aA_160F_44V}P -11.6123 3.345 -6.4087 { n ser A 45 1v0aA_160F_44V}P -12.3541 3.5874 -4.1131 { ca ser A 45 1v0aA_160F_44V}P -12.4686 3.2565 -2.6954 { n tyr A 46 1v0aA_160F_44V}P -14.0631 1.6468 -1.8295 { ca tyr A 46 1v0aA_160F_44V}P -15.3945 1.093 -1.6038 { n gly A 158 1v0aA_160F_44V}P -12.4588 -2.2685 0.4383 { ca gly A 158 1v0aA_160F_44V}P -11.1235 -2.2196 -0.1317 {"}P -11.1235 -2.2196 -0.1317 { n lys A 159 1v0aA_160F_44V}P -9.6145 -0.9046 -1.4658 { ca lys A 159 1v0aA_160F_44V}P -9.1614 0.2133 -2.2893 { n phe A 160 1v0aA_160F_44V}P -8.4696 0.1477 -4.6132 { ca phe A 160 1v0aA_160F_44V}P -7.6252 -0.2417 -5.7422 { n val A 161 1v0aA_160F_44V}P -6.4251 0.7544 -7.6 { ca val A 161 1v0aA_160F_44V}P -6.1415 1.7378 -8.6432 { n val A 162 1v0aA_160F_44V}P -6.7114 1.6813 -11.0019 { ca val A 162 1v0aA_160F_44V}P -6.7146 1.1564 -12.3647 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca mse A 42 1v0aA_160F_44V}P -8.1004 6.1676 -10.9971 {"}-8.1004 6.1676 -10.9971 { ca glu A 43 1v0aA_160F_44V}-8.3588 5.0637 -7.3696 { ca val A 44 1v0aA_160F_44V}-11.6123 3.345 -6.4087 { ca ser A 45 1v0aA_160F_44V}-12.4686 3.2565 -2.6954 { ca tyr A 46 1v0aA_160F_44V}-15.3945 1.093 -1.6038 { ca gly A 158 1v0aA_160F_44V}P -11.1235 -2.2196 -0.1317 {"}-11.1235 -2.2196 -0.1317 { ca lys A 159 1v0aA_160F_44V}-9.1614 0.2133 -2.2893 { ca phe A 160 1v0aA_160F_44V}-7.6252 -0.2417 -5.7422 { ca val A 161 1v0aA_160F_44V}-6.1415 1.7378 -8.6432 { ca val A 162 1v0aA_160F_44V}-6.7146 1.1564 -12.3647 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 44 1v0aA_160F_44V}P -11.6123 3.345 -6.4087 { cb val A 44 1v0aA_160F_44V}-12.2341 2.2806 -7.3488 { cg1 val A 44 1v0aA_160F_44V}-13.6746 1.9699 -6.95 { cb val A 44 1v0aA_160F_44V}P -12.2341 2.2806 -7.3488 { cg2 val A 44 1v0aA_160F_44V}-12.1667 2.734 -8.8076 { ca phe A 160 1v0aA_160F_44V}P -7.6252 -0.2417 -5.7422 { cb phe A 160 1v0aA_160F_44V}-8.1532 -1.5165 -6.4291 { cg phe A 160 1v0aA_160F_44V}-9.5144 -1.363 -7.0601 { cd1 phe A 160 1v0aA_160F_44V}-9.6405 -0.9649 -8.3913 { ce1 phe A 160 1v0aA_160F_44V}-10.8972 -0.8277 -8.9816 { cz phe A 160 1v0aA_160F_44V}-12.0424 -1.1004 -8.241 { cg phe A 160 1v0aA_160F_44V}P -9.5144 -1.363 -7.0601 { cd2 phe A 160 1v0aA_160F_44V}-10.6683 -1.6393 -6.332 { ce2 phe A 160 1v0aA_160F_44V}-11.9306 -1.506 -6.9138 { cz phe A 160 1v0aA_160F_44V}ghost -12.0424 -1.1004 -8.241 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A 44 1v0aA_160F_44V}P -12.2341 2.2806 -7.3488 { cg1 val A 44 1v0aA_160F_44V}P -13.6746 1.9699 -6.95 {"}P -13.6746 1.9699 -6.95 {"}P -13.6746 1.9699 -6.95 { cg2 val A 44 1v0aA_160F_44V}P -12.1667 2.734 -8.8076 {"}P -12.1667 2.734 -8.8076 {"}P -12.1667 2.734 -8.8076 { cb phe A 160 1v0aA_160F_44V}P -8.1532 -1.5165 -6.4291 {"}P -8.1532 -1.5165 -6.4291 { cd1 phe A 160 1v0aA_160F_44V}P -9.6405 -0.9649 -8.3913 { cd2 phe A 160 1v0aA_160F_44V}P -10.6683 -1.6393 -6.332 { ce1 phe A 160 1v0aA_160F_44V}P -10.8972 -0.8277 -8.9816 { ce2 phe A 160 1v0aA_160F_44V}P -11.9306 -1.506 -6.9138 { cz phe A 160 1v0aA_160F_44V}P -12.0424 -1.1004 -8.241 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 160 A}'S' blue -10.7031 0.0403 -7.4312 {"}'S' blue -10.5582 0.241 -7.5165 {"}'S' blue -10.5126 0.4229 -7.7777 { CD2 PHE 160 A}'S' blue -11.061 0.0343 -6.6595 {"}'S' blue -10.8823 0.0179 -6.8525 { CE1 PHE 160 A}'S' sky -10.9491 0.0963 -7.4965 {"}'S' blue -11.696 0.6885 -8.6269 {"}'S' blue -11.8588 0.6258 -8.8197 {"}'S' blue -12.0174 0.5168 -8.9946 {"}'S' sky -11.4341 0.8103 -8.6813 {"}'S' sky -11.5945 0.7741 -8.8786 {"}'S' sky -11.7552 0.6957 -9.0632 {"}'S' blue -11.9103 0.577 -9.2311 {"}'S' blue -12.0559 0.4229 -9.376 {"}'S' sky -10.6166 0.5518 -7.9424 {"}'S' sky -10.7293 0.6895 -8.1261 {"}'S' sky -10.8572 0.7925 -8.3211 {"}'S' sky -10.9997 0.8584 -8.5239 {"}'S' blue -11.1516 0.8855 -8.7275 {"}'S' sky -11.3092 0.8724 -8.928 {"}'S' sky -11.4701 0.8199 -9.1205 {"}'S' blue -11.6273 0.7301 -9.2996 {"}'S' blue -11.7805 0.6047 -9.4615 {"}'S' blue -10.9644 0.9201 -8.9085 {"}'S' blue -11.126 0.9027 -9.1134 {"}'S' blue -11.2899 0.846 -9.3091 { CE2 PHE 160 A}'S' blue -12.7294 0.0101 -6.559 {"}'S' blue -12.8922 -0.0525 -6.7519 {"}'S' blue -13.0508 -0.1616 -6.9267 {"}'S' blue -12.4675 0.1319 -6.6134 {"}'S' blue -12.6279 0.0957 -6.8107 {"}'S' blue -12.7886 0.0173 -6.9954 {"}'S' sky -12.0331 0.18 -6.4561 {"}'S' sky -12.5035 0.1415 -7.0526 {"}'S' sky -11.6944 0.158 -6.4257 {"}'S' sky -11.0918 0.0297 -6.9023 {"}'S' blue -11.0316 -0.0363 -7.2201 { CZ PHE 160 A}'S' blue -13.1051 -0.0951 -7.2809 {"}'S' blue -13.268 -0.1029 -7.4882 {"}'S' blue -13.4313 -0.1992 -7.6723 {"}'S' blue -12.8173 0.0391 -7.1626 {"}'S' sky -12.9602 0.1056 -7.3662 {"}'S' sky -13.1179 0.1056 -7.5698 {"}'S' sky -13.2786 0.0413 -7.7594 {"}'S' sky -13.4319 -0.0859 -7.9228 {"}'S' sky -12.618 0.1995 -7.2207 {"}'S' sky -13.385 0.0196 -8.1614 {"}'S' sky -13.0041 0.3531 -8.0791 {"}'S' sky -13.1627 0.2441 -8.2539 {"}'S' blue -13.312 0.0925 -8.4046 {"}'S' sky -12.7398 0.5014 -8.1379 {"}'S' blue -12.9005 0.4229 -8.3226 {"}'S' sky -12.6153 0.5472 -8.3798 {"}'S' blue -12.4352 0.5733 -8.5685 {"}'S' blue -12.5963 0.4796 -8.7502 {"}'S' sky -12.0929 0.6183 -8.5672 {"}'S' blue -12.2565 0.5569 -8.7614 {"}'S' blue -12.4174 0.4584 -8.9417 {"}'S' blue -12.0472 0.515 -8.9135 {"}'S' blue -12.2084 0.4185 -9.0947 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 160 A}'S' green -11.0209 0.2963 -7.6455 {"}'S' green -11.1198 0.462 -7.8202 {"}'S' green -11.382 0.6692 -8.2155 {"}'S' sea -11.535 0.7034 -8.4239 {"}'S' sea -10.7797 0.3717 -7.7123 {"}'S' green -10.8774 0.5356 -7.8849 {"}'S' green -10.9949 0.6647 -8.0734 {"}'S' green -11.1303 0.7549 -8.2722 {"}'S' sea -11.2782 0.8047 -8.4772 { CE2 PHE 160 A}'S' sea -12.185 0.2072 -6.6597 {"}'S' sea 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73 1v0aA_73F_116I}P -7.2333 0.9328 -6.7938 { n asp A 74 1v0aA_73F_116I}-6.0747 1.0173 -7.4424 { ca asp A 74 1v0aA_73F_116I}-5.8818 1.8957 -8.5909 { c asp A 74 1v0aA_73F_116I}-6.1555 1.0969 -9.8558 { o asp A 74 1v0aA_73F_116I}-5.7504 -0.0626 -9.9602 { c asp A 74 1v0aA_73F_116I}P -6.1555 1.0969 -9.8558 { n ile A 75 1v0aA_73F_116I}-6.8487 1.7124 -10.8087 { ca ile A 75 1v0aA_73F_116I}-7.1779 1.0499 -12.073 { c ile A 75 1v0aA_73F_116I}-7.104 1.9978 -13.2752 { o ile A 75 1v0aA_73F_116I}-7.364 3.199 -13.1528 { n lys A 114 1v0aA_73F_116I}P -7.1838 6.0349 -11.7732 {"}-7.1838 6.0349 -11.7732 { ca lys A 114 1v0aA_73F_116I}-8.0848 6.4906 -10.7215 { c lys A 114 1v0aA_73F_116I}-8.124 5.5067 -9.5593 { o lys A 114 1v0aA_73F_116I}-8.0345 4.2907 -9.7559 { c lys A 114 1v0aA_73F_116I}P -8.124 5.5067 -9.5593 { n thr A 115 1v0aA_73F_116I}-8.2291 6.0448 -8.3493 { ca thr A 115 1v0aA_73F_116I}-8.3548 5.2335 -7.1483 { c thr A 115 1v0aA_73F_116I}-9.8295 4.9563 -6.8859 { o thr A 115 1v0aA_73F_116I}-10.6383 5.8829 -6.7845 { c thr A 115 1v0aA_73F_116I}P -9.8295 4.9563 -6.8859 { n ile A 116 1v0aA_73F_116I}-10.1706 3.6743 -6.7964 { ca ile A 116 1v0aA_73F_116I}-11.5328 3.2588 -6.487 { c ile A 116 1v0aA_73F_116I}-11.5667 2.6474 -5.09 { o ile A 116 1v0aA_73F_116I}-10.9516 1.6097 -4.8413 { c ile A 116 1v0aA_73F_116I}P -11.5667 2.6474 -5.09 { n glu A 117 1v0aA_73F_116I}-12.2718 3.3165 -4.1815 { ca glu A 117 1v0aA_73F_116I}-12.4406 2.8366 -2.8142 { c glu A 117 1v0aA_73F_116I}-13.892 2.433 -2.5886 { o glu A 117 1v0aA_73F_116I}-14.7902 3.2784 -2.6028 { c glu A 117 1v0aA_73F_116I}P -13.892 2.433 -2.5886 { n ile A 118 1v0aA_73F_116I}-14.1131 1.1365 -2.3863 { ca ile A 118 1v0aA_73F_116I}-15.4541 0.5984 -2.1773 { c ile A 118 1v0aA_73F_116I}-15.6239 0.102 -0.7411 { o ile A 118 1v0aA_73F_116I}-14.9445 -0.8436 -0.3263 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 71 1v0aA_73F_116I}P -12.3187 -1.6663 0.6291 { ca ile A 71 1v0aA_73F_116I}P -11.2442 -2.1764 -0.2192 { n ser A 72 1v0aA_73F_116I}P -9.6411 -0.8911 -1.524 { ca ser A 72 1v0aA_73F_116I}P -9.2085 0.1467 -2.4547 { n phe A 73 1v0aA_73F_116I}P -8.2836 0.1428 -4.6945 { ca phe A 73 1v0aA_73F_116I}P -7.3327 -0.1835 -5.7555 { n asp A 74 1v0aA_73F_116I}P -6.0747 1.0173 -7.4424 { ca asp A 74 1v0aA_73F_116I}P -5.8818 1.8957 -8.5909 { n ile A 75 1v0aA_73F_116I}P -6.8487 1.7124 -10.8087 { ca ile A 75 1v0aA_73F_116I}P -7.1779 1.0499 -12.073 { n lys A 114 1v0aA_73F_116I}P -7.1838 6.0349 -11.7732 { ca lys A 114 1v0aA_73F_116I}P -8.0848 6.4906 -10.7215 { n thr A 115 1v0aA_73F_116I}P -8.2291 6.0448 -8.3493 { ca thr A 115 1v0aA_73F_116I}P -8.3548 5.2335 -7.1483 { n ile A 116 1v0aA_73F_116I}P -10.1706 3.6743 -6.7964 { ca ile A 116 1v0aA_73F_116I}P -11.5328 3.2588 -6.487 { n glu A 117 1v0aA_73F_116I}P -12.2718 3.3165 -4.1815 { ca glu A 117 1v0aA_73F_116I}P -12.4406 2.8366 -2.8142 { n ile A 118 1v0aA_73F_116I}P -14.1131 1.1365 -2.3863 { ca ile A 118 1v0aA_73F_116I}P -15.4541 0.5984 -2.1773 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 71 1v0aA_73F_116I}P -11.2442 -2.1764 -0.2192 {"}-11.2442 -2.1764 -0.2192 { ca ser A 72 1v0aA_73F_116I}-9.2085 0.1467 -2.4547 { ca phe A 73 1v0aA_73F_116I}-7.3327 -0.1835 -5.7555 { ca asp A 74 1v0aA_73F_116I}-5.8818 1.8957 -8.5909 { ca ile A 75 1v0aA_73F_116I}-7.1779 1.0499 -12.073 { ca lys A 114 1v0aA_73F_116I}P -8.0848 6.4906 -10.7215 {"}-8.0848 6.4906 -10.7215 { ca thr A 115 1v0aA_73F_116I}-8.3548 5.2335 -7.1483 { ca ile A 116 1v0aA_73F_116I}-11.5328 3.2588 -6.487 { ca glu A 117 1v0aA_73F_116I}-12.4406 2.8366 -2.8142 { ca ile A 118 1v0aA_73F_116I}-15.4541 0.5984 -2.1773 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 73 1v0aA_73F_116I}P -7.3327 -0.1835 -5.7555 { cb phe A 73 1v0aA_73F_116I}-7.6816 -1.5204 -6.4347 { cg phe A 73 1v0aA_73F_116I}-9.0907 -1.5954 -6.9714 { cd1 phe A 73 1v0aA_73F_116I}-9.4025 -1.0884 -8.2309 { ce1 phe A 73 1v0aA_73F_116I}-10.7029 -1.1609 -8.7305 { cz phe A 73 1v0aA_73F_116I}-11.7052 -1.7573 -7.9701 { cg phe A 73 1v0aA_73F_116I}P -9.0907 -1.5954 -6.9714 { cd2 phe A 73 1v0aA_73F_116I}-10.0996 -2.1962 -6.224 { ce2 phe A 73 1v0aA_73F_116I}-11.4042 -2.2771 -6.7156 { cz phe A 73 1v0aA_73F_116I}ghost -11.7052 -1.7573 -7.9701 { ca ile A 116 1v0aA_73F_116I}P -11.5328 3.2588 -6.487 { cb ile A 116 1v0aA_73F_116I}-12.0683 2.2664 -7.5513 { cg1 ile A 116 1v0aA_73F_116I}-12.0885 2.9257 -8.9358 { cd1 ile A 116 1v0aA_73F_116I}-12.5146 2.0076 -10.0588 { cb ile A 116 1v0aA_73F_116I}P -12.0683 2.2664 -7.5513 { cg2 ile A 116 1v0aA_73F_116I}-13.4617 1.7596 -7.1698 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 73 1v0aA_73F_116I}P -7.6816 -1.5204 -6.4347 {"}P -7.6816 -1.5204 -6.4347 { cd1 phe A 73 1v0aA_73F_116I}P -9.4025 -1.0884 -8.2309 { cd2 phe A 73 1v0aA_73F_116I}P -10.0996 -2.1962 -6.224 { ce1 phe A 73 1v0aA_73F_116I}P -10.7029 -1.1609 -8.7305 { ce2 phe A 73 1v0aA_73F_116I}P -11.4042 -2.2771 -6.7156 { cz phe A 73 1v0aA_73F_116I}P -11.7052 -1.7573 -7.9701 { cb ile A 116 1v0aA_73F_116I}P -12.0683 2.2664 -7.5513 { cg1 ile A 116 1v0aA_73F_116I}P -12.0885 2.9257 -8.9358 {"}P -12.0885 2.9257 -8.9358 { cg2 ile A 116 1v0aA_73F_116I}P -13.4617 1.7596 -7.1698 {"}P -13.4617 1.7596 -7.1698 {"}P -13.4617 1.7596 -7.1698 { cd1 ile A 116 1v0aA_73F_116I}P -12.5146 2.0076 -10.0588 {"}P -12.5146 2.0076 -10.0588 {"}P -12.5146 2.0076 -10.0588 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 73 A}'S' blue -10.2746 0.2995 -7.6172 {"}'S' blue -10.2013 0.4277 -7.8761 { CE1 PHE 73 A}'S' sky -11.4778 -0.0215 -7.6522 {"}'S' sky -11.7783 0.045 -8.0593 {"}'S' sky -11.7363 0.1891 -8.3151 {"}'S' sky -11.6645 0.2925 -8.5687 {"}'S' sky -11.716 0.2438 -8.98 {"}'S' sky -11.8616 0.0896 -9.125 {"}'S' blue -11.9938 -0.0962 -9.2444 {"}'S' sky -11.2758 0.4866 -8.8694 {"}'S' sky -10.4667 0.5031 -8.2424 {"}'S' sky -10.6135 0.5638 -8.4501 {"}'S' sky -10.7701 0.5868 -8.6575 {"}'S' sky -11.0956 0.5127 -9.0581 {"}'S' sky -10.7076 0.4544 -9.403 {"}'S' sky -10.6547 0.2844 -9.7158 { CZ PHE 73 A}'S' blue -11.6652 -0.1371 -7.3096 {"}'S' blue -11.8077 -0.0712 -7.5125 {"}'S' blue -11.9596 -0.0441 -7.716 {"}'S' sky -11.469 -0.0933 -7.482 {"}'S' sky -11.6158 -0.0325 -7.6897 {"}'S' sky -11.7724 -0.0095 -7.8971 {"}'S' blue -11.934 -0.027 -8.102 { HE1 PHE 73 A}'S' sky -10.8404 0.0892 -10.2633 {"}'S' sky -10.9914 -0.0351 -10.4226 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 73 A}'S' sea -11.6206 0.045 -7.8558 {"}'S' sea -11.1569 0.0169 -7.518 {"}'S' green -11.2784 0.1389 -7.7103 {"}'S' green -11.4207 0.2093 -7.9123 {"}'S' green -11.575 0.2269 -8.1169 {"}'S' sea -10.9255 0.1287 -7.5691 {"}'S' green -11.0478 0.255 -7.7616 {"}'S' green -11.3406 0.3701 -8.1728 {"}'S' green -11.5017 0.3552 -8.3758 {"}'S' sea -10.683 0.2023 -7.6339 {"}'S' green -10.8006 0.3314 -7.8223 {"}'S' green -11.2398 0.477 -8.4302 {"}'S' sea -11.4002 0.4408 -8.6275 {"}'S' sea -10.535 0.3563 -7.875 {"}'S' green -10.6629 0.4592 -8.07 {"}'S' green -10.8054 0.5251 -8.2729 {"}'S' green -10.9573 0.5523 -8.4764 {"}'S' sea -11.1149 0.5391 -8.677 {"}'S' sea -11.433 0.3968 -9.0485 {"}'S' green -11.5862 0.2714 -9.2104 {"}'S' green -11.7298 0.1128 -9.3517 {"}'S' sea -11.8595 -0.0738 -9.4675 {"}'S' green -11.2567 0.419 -9.2398 {"}'S' green -11.4122 0.2893 -9.4056 {"}'S' green -11.5584 0.1273 -9.5497 {"}'S' green -11.6919 -0.0632 -9.6682 {"}'S' sea -10.917 0.4963 -9.251 {"}'S' green -11.0778 0.3978 -9.4313 {"}'S' green -11.232 0.2663 -9.595 {"}'S' sea -10.8688 0.3579 -9.5843 { HE1 PHE 73 A}'S' sea -11.7719 -0.2038 -9.7846 {"}'S' green -11.3758 0.1501 -9.7137 {"}'S' green -11.5324 0.0381 -9.8851 {"}'S' green -11.671 -0.1366 -10.0158 {"}'S' green -11.0863 0.2402 -9.7641 {"}'S' green -11.3947 0.0521 -10.1102 {"}'S' green -11.5278 -0.1235 -10.2333 {"}'S' sea -10.897 0.2266 -9.9449 {"}'S' green -11.0541 0.1583 -10.1286 {"}'S' green -11.2035 0.034 -10.2873 {"}'S' sea -11.3357 -0.14 -10.4096 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 73 A}'S' P -11.1876 0.3359 -7.9644 {"}'S' -11.1844 0.3269 -7.9699 {"}'S' P -10.936 0.4216 -8.0211 {"}'S' -10.9353 0.4184 -8.0229 {"}'S' P -11.0839 0.4714 -8.2261 {"}'S' -11.0832 0.4699 -8.2264 { HE1 PHE 73 A}'S' P -11.2445 0.1765 -9.9504 {"}'S' -11.2407 0.1668 -9.948 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 116 A}'S' blue -11.8906 0.3457 -7.5091 {"}'S' blue -11.7387 0.32 -7.3058 {"}'S' sky -11.7363 0.2916 -7.7266 {"}'S' sky -11.5889 0.2499 -7.5243 {"}'S' blue -11.4334 0.2619 -7.3265 {"}'S' sky -11.7377 0.4713 -8.2088 {"}'S' sky -10.8531 0.3718 -7.4487 {"}'S' sky -10.5963 0.5451 -7.5321 {"}'S' sky -10.5208 0.6409 -7.7685 {"}'S' sky -10.8155 0.8326 -8.4338 {"}'S' sky -10.5185 0.7585 -8.0298 {HD12 ILE 116 A}'S' blue -12.075 0.2978 -9.3667 {"}'S' sky -11.9242 0.4282 -9.2092 {"}'S' blue -11.7914 0.6072 -9.0873 {"}'S' sky -12.0093 0.1054 -9.6397 {"}'S' sky -11.4564 0.7218 -9.0965 {"}'S' sky -11.195 0.7807 -9.2055 {"}'S' sky -10.8913 0.6522 -9.619 {"}'S' sky -11.1069 0.3005 -10.4741 {"}'S' sky -10.9508 0.3958 -10.2996 @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 116 A}'S' green -11.6215 0.3395 -8.0233 {"}'S' green -11.485 0.2581 -7.8233 {"}'S' green -11.3326 0.2332 -7.6195 {"}'S' sea -11.1732 0.2636 -7.4223 {"}'S' sea -11.5473 0.5746 -8.4028 {"}'S' green -11.4447 0.4218 -8.2277 {"}'S' green -11.169 0.278 -7.83 {"}'S' green -11.0113 0.295 -7.632 {"}'S' sea -11.3112 0.6556 -8.4864 {"}'S' green -11.2075 0.4969 -8.3085 {"}'S' green -10.9168 0.3778 -7.8994 {"}'S' green -10.7536 0.4268 -7.7028 {"}'S' sea -11.073 0.7625 -8.5168 {"}'S' green -10.9704 0.6097 -8.3417 {"}'S' green -10.8332 0.5347 -8.1422 {"}'S' green -10.6769 0.5455 -7.943 {"}'S' sea -10.6821 0.7299 -8.2331 {HD12 ILE 116 A}'S' sea -11.8509 0.1919 -9.4583 {"}'S' green -11.7016 0.3279 -9.3024 {"}'S' sea -11.5671 0.5069 -9.18 {"}'S' sea -11.8634 0.0168 -9.8576 {"}'S' green -11.7048 0.0813 -9.6709 {"}'S' green -11.5518 0.1974 -9.5054 {"}'S' green -11.4124 0.3582 -9.3686 {"}'S' green -11.2909 0.555 -9.2679 {"}'S' sea -11.7626 -0.0119 -10.1507 {"}'S' green -11.6032 0.0186 -9.9534 {"}'S' green -11.2951 0.2402 -9.6171 {"}'S' green -11.161 0.4201 -9.4937 {"}'S' sea -11.0507 0.6342 -9.4107 {"}'S' sea -11.599 0.0329 -10.3612 {"}'S' green -11.4408 0.0507 -10.1627 {"}'S' green -11.1327 0.2581 -9.8213 {"}'S' green -10.9999 0.4371 -9.6995 {"}'S' sea -11.3468 0.1328 -10.4305 {"}'S' green -11.1835 0.1817 -10.234 {"}'S' green -11.0263 0.3001 -10.0632 {"}'S' sea -10.8873 0.477 -9.9323 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 116 A}'S' P -11.3163 0.321 -8.0326 {"}'S' -11.3163 0.321 -8.0326 {"}'S' P -11.0726 0.402 -8.1076 {"}'S' -11.0757 0.4142 -8.101 {HD12 ILE 116 A}'S' P -11.4452 0.1043 -9.7724 {"}'S' -11.4459 0.1069 -9.7741 {"}'S' P -11.2831 0.1267 -9.9799 {"}'S' -11.2881 0.1375 -9.9806 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 73 A}'M' greentint -9.4971 1.9837 -6.6076 {"}'M' greentint -9.0916 2.4127 -6.2025 {"}'M' greentint -9.2549 2.3793 -6.4043 {"}'M' greentint -9.4035 2.2224 -6.5528 {"}'M' greentint -9.5072 2.126 -6.8503 {"}'M' greentint -8.9477 2.6178 -6.2645 {"}'M' greentint -9.1056 2.6094 -6.4665 {"}'M' greentint -9.2642 2.5163 -6.6449 {"}'M' greentint -9.4035 2.3483 -6.7781 {"}'M' greentint -9.4768 2.22 -7.0951 {"}'M' greentint -9.5479 1.9749 -7.1193 {"}'M' greentint -8.7625 2.7879 -6.3305 {"}'M' greentint -8.9186 2.7985 -6.5344 {"}'M' greentint -9.0788 2.7403 -6.7263 {"}'M' greentint -9.2336 2.6172 -6.891 {"}'M' greentint -9.3693 2.4397 -7.0172 {"}'M' greentint -9.3989 2.3002 -7.3333 {"}'M' greentint -9.4801 2.0571 -7.3717 {"}'M' greentint -8.6754 2.9419 -6.5764 {"}'M' greentint -8.8359 2.9185 -6.7784 {"}'M' greentint -8.998 2.8363 -6.9641 {"}'M' greentint -9.1502 2.7004 -7.1241 {"}'M' greentint -9.2869 2.5188 -7.2489 {"}'M' greentint -9.2844 2.345 -7.563 {"}'M' greentint -8.5819 3.0325 -6.8452 {"}'M' greentint -8.7411 2.9814 -7.0374 {"}'M' greentint -8.8969 2.8826 -7.2107 {"}'M' greentint -9.043 2.739 -7.3606 {"}'M' greentint -9.1738 2.5571 -7.4791 {"}'M' greentint -8.7412 2.9099 -7.416 {"}'M' greentint -8.8878 2.7628 -7.5658 {"}'M' greentint -9.0199 2.5798 -7.6857 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 116 A}'M' greentint -9.4908 1.9699 -6.6146 {"}'M' greentint -9.3359 2.0671 -6.4421 {"}'M' greentint -9.1946 2.2179 -6.3005 {"}'M' greentint -9.074 2.4121 -6.1988 {"}'M' greentint -9.5344 1.9306 -7.089 {"}'M' greentint -9.3801 1.9299 -6.8899 {"}'M' greentint -9.2219 1.9936 -6.7036 {"}'M' greentint -9.0717 2.118 -6.5438 {"}'M' greentint -8.9386 2.2936 -6.4207 {"}'M' greentint -8.8333 2.5083 -6.3429 {"}'M' greentint -8.7598 2.7481 -6.316 {"}'M' greentint -9.3295 1.9888 -7.2409 {"}'M' greentint -9.1713 1.9911 -7.0372 {"}'M' greentint -9.0107 2.067 -6.8503 {"}'M' greentint -8.8611 2.2124 -6.6979 {"}'M' greentint -8.7366 2.4124 -6.5921 {"}'M' greentint -8.648 2.65 -6.5441 {"}'M' greentint -8.6035 2.9047 -6.5567 {"}'M' greentint -9.2264 2.1515 -7.496 {"}'M' greentint -9.0776 2.1019 -7.2899 {"}'M' greentint -8.9153 2.1468 -7.0919 {"}'M' greentint -8.7611 2.2794 -6.9302 {"}'M' greentint -8.6368 2.4827 -6.8256 {"}'M' greentint -8.5586 2.7284 -6.7935 {"}'M' greentint -8.5376 2.9838 -6.8368 {"}'M' greentint -9.0984 2.3871 -7.6585 {"}'M' greentint -8.9667 2.2854 -7.4603 {"}'M' greentint -8.8057 2.3134 -7.2603 {"}'M' greentint -8.6576 2.4654 -7.1115 {"}'M' greentint -8.5628 2.6995 -7.0541 {"}'M' greentint -8.5465 2.9532 -7.1034 {"}'M' greentint -8.8332 2.5032 -7.5138 {"}'M' greentint -8.6732 2.6001 -7.3344 {"}'M' greentint -8.6182 2.8534 -7.3342 {"}'M' greentint -8.7515 2.7498 -7.5337 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 73 A}'M' green -9.7759 0.9562 -4.3667 {"}'M' green -9.9142 0.5475 -4.6539 {"}'M' green -9.5607 1.4206 -4.4401 {"}'M' green -9.978 0.6014 -5.0149 {"}'M' green -9.5312 1.5936 -4.7127 {"}'M' green -9.9282 0.676 -5.3141 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 73 A}'M' greentint -9.9091 0.8526 -4.5662 {"}'M' greentint -9.6942 1.2028 -4.3866 {"}'M' greentint -9.8542 1.1058 -4.566 {"}'M' greentint -9.9646 1.0065 -4.8463 {"}'M' greentint -9.9809 0.7528 -4.797 {"}'M' greentint -9.7217 1.3925 -4.6401 {"}'M' greentint -9.8698 1.2406 -4.789 {"}'M' greentint -9.9363 1.1039 -5.0999 {"}'M' greentint -9.9867 0.8493 -5.0953 {"}'M' greentint -9.6914 1.5026 -4.8955 {"}'M' greentint -9.8329 1.332 -5.0311 {"}'M' greentint -9.8394 1.1782 -5.3399 {"}'M' greentint -9.9077 0.9292 -5.3576 {"}'M' greentint -9.5934 1.574 -5.1315 {"}'M' greentint -9.7319 1.3992 -5.2623 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 116 A}'M' green -9.9041 0.8467 -4.3102 {"}'M' green -9.8057 1.0716 -4.2442 {"}'M' green -10.053 0.5378 -4.7798 {"}'M' green -9.6228 1.3868 -4.4608 {"}'M' green -9.556 1.7029 -4.7783 {"}'M' green -10.0216 0.7002 -5.3601 {"}'M' green -9.569 1.6868 -5.0488 {"}'M' green -9.8829 0.9263 -5.4341 {"}'M' green -9.6215 1.5728 -5.2757 {"}'M' green -9.7747 1.2242 -5.4944 {"}'M' green -9.7194 1.4755 -5.4932 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 116 A}'M' greentint -9.9076 0.6995 -4.6368 {"}'M' greentint -9.783 0.9019 -4.5332 {"}'M' greentint -9.6865 1.135 -4.4734 {"}'M' greentint -9.9801 0.6183 -5.025 {"}'M' greentint -9.8334 0.7679 -4.8774 {"}'M' greentint -9.7097 0.9676 -4.7727 {"}'M' greentint -9.6178 1.2018 -4.7194 {"}'M' greentint -9.5658 1.4527 -4.721 {"}'M' greentint -9.8645 0.7961 -5.1828 {"}'M' greentint -9.7261 0.9666 -5.0512 {"}'M' greentint -9.6232 1.1901 -4.9804 {"}'M' greentint -9.5687 1.4399 -4.9801 {"}'M' greentint -9.7332 1.08 -5.2833 {"}'M' greentint -9.6379 1.3163 -5.2258 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 342 1v0eA_344Y_358}P -12.1964 -2.1472 0.0378 {"}-12.1964 -2.1472 0.0378 { ca ala A 342 1v0eA_344Y_358}-10.993 -2.5526 -0.6787 { c ala A 342 1v0eA_344Y_358}-10.6239 -1.5386 -1.7641 { o ala A 342 1v0eA_344Y_358}-10.9854 -1.7156 -2.9442 { c ala A 342 1v0eA_344Y_358}P -10.6239 -1.5386 -1.7641 { n pro A 343 1v0eA_344Y_358}-9.9308 -0.4623 -1.3907 { ca pro A 343 1v0eA_344Y_358}-9.501 0.5137 -2.3896 { c pro A 343 1v0eA_344Y_358}-8.3207 -0.0137 -3.1801 { o pro A 343 1v0eA_344Y_358}-7.5786 -0.902 -2.7303 { c pro A 343 1v0eA_344Y_358}P -8.3207 -0.0137 -3.1801 { n tyr A 344 1v0eA_344Y_358}-8.1833 0.5026 -4.39 { ca tyr A 344 1v0eA_344Y_358}-7.1415 0.0402 -5.2922 { c tyr A 344 1v0eA_344Y_358}-6.963 1.1009 -6.3499 { o tyr A 344 1v0eA_344Y_358}-7.5952 2.1713 -6.2946 { c tyr A 344 1v0eA_344Y_358}P -6.963 1.1009 -6.3499 { n met A 345 1v0eA_344Y_358}-6.0937 0.8248 -7.3134 { ca met A 345 1v0eA_344Y_358}-5.9984 1.7056 -8.4795 { c met A 345 1v0eA_344Y_358}-6.3374 0.9576 -9.7634 { o met A 345 1v0eA_344Y_358}-5.8375 -0.1534 -9.9971 { c met A 345 1v0eA_344Y_358}P -6.3374 0.9576 -9.7634 { n gly A 346 1v0eA_344Y_358}-7.2396 1.5473 -10.5568 { ca gly A 346 1v0eA_344Y_358}-7.6043 0.9914 -11.8495 { c gly A 346 1v0eA_344Y_358}-6.9712 1.8618 -12.919 { o gly A 346 1v0eA_344Y_358}-7.3646 3.0303 -13.0776 { n his A 356 1v0eA_344Y_358}P -7.7923 5.7786 -12.1756 {"}-7.7923 5.7786 -12.1756 { ca his A 356 1v0eA_344Y_358}-8.6412 6.2914 -11.1032 { c his A 356 1v0eA_344Y_358}-8.3596 5.5526 -9.8063 { o his A 356 1v0eA_344Y_358}-8.2906 4.3178 -9.7737 { c his A 356 1v0eA_344Y_358}P -8.3596 5.5526 -9.8063 { n val A 357 1v0eA_344Y_358}-8.2118 6.303 -8.7333 { ca val A 357 1v0eA_344Y_358}-8.1858 5.6718 -7.4394 { c val A 357 1v0eA_344Y_358}-9.6354 5.2114 -7.2326 { o val A 357 1v0eA_344Y_358}-10.5555 5.9971 -7.4253 { c val A 357 1v0eA_344Y_358}P -9.6354 5.2114 -7.2326 { n ser A 358 1v0eA_344Y_358}-9.8171 3.9311 -6.9187 { ca ser A 358 1v0eA_344Y_358}-11.1405 3.2945 -6.8903 { c ser A 358 1v0eA_344Y_358}-11.3326 2.4888 -5.6122 { o ser A 358 1v0eA_344Y_358}-10.3861 2.2723 -4.8672 { c ser A 358 1v0eA_344Y_358}P -11.3326 2.4888 -5.6122 { n trp A 359 1v0eA_344Y_358}-12.5592 2.0401 -5.3474 { ca trp A 359 1v0eA_344Y_358}-12.7286 0.9451 -4.4046 { c trp A 359 1v0eA_344Y_358}-13.9103 0.0806 -4.78 { o trp A 359 1v0eA_344Y_358}-14.7704 0.5054 -5.5331 { c trp A 359 1v0eA_344Y_358}P -13.9103 0.0806 -4.78 { n val A 360 1v0eA_344Y_358}-13.902 -1.1388 -4.2631 { ca val A 360 1v0eA_344Y_358}-15.1033 -1.9571 -4.1717 { c val A 360 1v0eA_344Y_358}-15.2977 -2.2204 -2.6787 { o val A 360 1v0eA_344Y_358}-14.3407 -2.0905 -1.8856 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 342 1v0eA_344Y_358}P -12.1964 -2.1472 0.0378 { ca ala A 342 1v0eA_344Y_358}P -10.993 -2.5526 -0.6787 { ca pro A 343 1v0eA_344Y_358}P -9.501 0.5137 -2.3896 { n tyr A 344 1v0eA_344Y_358}P -8.1833 0.5026 -4.39 { ca tyr A 344 1v0eA_344Y_358}P -7.1415 0.0402 -5.2922 { n met A 345 1v0eA_344Y_358}P -6.0937 0.8248 -7.3134 { ca met A 345 1v0eA_344Y_358}P -5.9984 1.7056 -8.4795 { n gly A 346 1v0eA_344Y_358}P -7.2396 1.5473 -10.5568 { ca gly A 346 1v0eA_344Y_358}P -7.6043 0.9914 -11.8495 {"}P -7.6043 0.9914 -11.8495 { n his A 356 1v0eA_344Y_358}P -7.7923 5.7786 -12.1756 { ca his A 356 1v0eA_344Y_358}P -8.6412 6.2914 -11.1032 { n val A 357 1v0eA_344Y_358}P -8.2118 6.303 -8.7333 { ca val A 357 1v0eA_344Y_358}P -8.1858 5.6718 -7.4394 { n ser A 358 1v0eA_344Y_358}P -9.8171 3.9311 -6.9187 { ca ser A 358 1v0eA_344Y_358}P -11.1405 3.2945 -6.8903 { n trp A 359 1v0eA_344Y_358}P -12.5592 2.0401 -5.3474 { ca trp A 359 1v0eA_344Y_358}P -12.7286 0.9451 -4.4046 { n val A 360 1v0eA_344Y_358}P -13.902 -1.1388 -4.2631 { ca val A 360 1v0eA_344Y_358}P -15.1033 -1.9571 -4.1717 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 342 1v0eA_344Y_358}P -10.993 -2.5526 -0.6787 {"}-10.993 -2.5526 -0.6787 { ca pro A 343 1v0eA_344Y_358}-9.501 0.5137 -2.3896 { ca tyr A 344 1v0eA_344Y_358}-7.1415 0.0402 -5.2922 { ca met A 345 1v0eA_344Y_358}-5.9984 1.7056 -8.4795 { ca gly A 346 1v0eA_344Y_358}-7.6043 0.9914 -11.8495 { ca his A 356 1v0eA_344Y_358}P -8.6412 6.2914 -11.1032 {"}-8.6412 6.2914 -11.1032 { ca val A 357 1v0eA_344Y_358}-8.1858 5.6718 -7.4394 { ca ser A 358 1v0eA_344Y_358}-11.1405 3.2945 -6.8903 { ca trp A 359 1v0eA_344Y_358}-12.7286 0.9451 -4.4046 { ca val A 360 1v0eA_344Y_358}-15.1033 -1.9571 -4.1717 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 344 1v0eA_344Y_358}P -7.1415 0.0402 -5.2922 { cb tyr A 344 1v0eA_344Y_358}-7.5393 -1.3181 -5.9396 { cg tyr A 344 1v0eA_344Y_358}-8.7839 -1.2708 -6.8447 { cd1 tyr A 344 1v0eA_344Y_358}-8.6512 -1.2325 -8.2426 { ce1 tyr A 344 1v0eA_344Y_358}-9.773 -1.2141 -9.0795 { cz tyr A 344 1v0eA_344Y_358}-11.0446 -1.2086 -8.5168 { oh tyr A 344 1v0eA_344Y_358}-12.1222 -1.1648 -9.369 { cg tyr A 344 1v0eA_344Y_358}P -8.7839 -1.2708 -6.8447 { cd2 tyr A 344 1v0eA_344Y_358}-10.0881 -1.2644 -6.3013 { ce2 tyr A 344 1v0eA_344Y_358}-11.2189 -1.2402 -7.1278 { cz tyr A 344 1v0eA_344Y_358}ghost -11.0446 -1.2086 -8.5168 { ca ser A 358 1v0eA_344Y_358}P -11.1405 3.2945 -6.8903 { cb ser A 358 1v0eA_344Y_358}-11.2906 2.3377 -8.0956 { og ser A 358 1v0eA_344Y_358}-10.9508 2.9779 -9.3392 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 344 1v0eA_344Y_358}P -7.5393 -1.3181 -5.9396 {"}P -7.5393 -1.3181 -5.9396 { cd1 tyr A 344 1v0eA_344Y_358}P -8.6512 -1.2325 -8.2426 { cd2 tyr A 344 1v0eA_344Y_358}P -10.0881 -1.2644 -6.3013 { ce1 tyr A 344 1v0eA_344Y_358}P -9.773 -1.2141 -9.0795 { ce2 tyr A 344 1v0eA_344Y_358}P -11.2189 -1.2402 -7.1278 { oh tyr A 344 1v0eA_344Y_358}P -12.1222 -1.1648 -9.369 { cb ser A 358 1v0eA_344Y_358}P -11.2906 2.3377 -8.0956 {"}P -11.2906 2.3377 -8.0956 { og ser A 358 1v0eA_344Y_358}P -10.9508 2.9779 -9.3392 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 344 A}'S' blue -9.6846 0.1176 -7.8272 {"}'S' blue -9.6128 0.2209 -8.0807 { CD2 TYR 344 A}'S' blue -10.3022 0.3928 -6.8218 {"}'S' blue -10.0928 0.3509 -6.9738 {"}'S' sky -10.254 0.2544 -7.1551 {"}'S' blue -10.04 0.1809 -7.2866 { CE1 TYR 344 A}'S' blue -9.9957 0.0756 -7.918 {"}'S' sky -9.8708 0.2783 -8.1712 {"}'S' sky -10.4704 0.3877 -8.9764 {"}'S' sky -9.7331 0.4061 -8.4189 {"}'S' sky -9.8755 0.472 -8.6218 {"}'S' sky -10.0274 0.4991 -8.8254 {"}'S' blue -10.1851 0.486 -9.0259 { CE2 TYR 344 A}'S' blue -11.6309 0.4599 -7.0743 {"}'S' blue -11.7917 0.4073 -7.2667 {"}'S' sky -11.2861 0.5076 -7.0548 {"}'S' sky -11.4477 0.4902 -7.2597 {"}'S' sky -11.6116 0.4335 -7.4554 {"}'S' blue -11.7727 0.3398 -7.6371 {"}'S' sky -11.5938 0.3186 -7.8286 {"}'S' sky -10.5924 0.3878 -6.9884 {"}'S' sky -10.3801 0.2956 -7.1163 { CZ TYR 344 A}'S' sky -11.6823 0.3225 -7.959 {"}'S' blue -11.8434 0.3075 -8.1621 {"}'S' sky -11.7419 0.3931 -8.4138 {"}'S' sky -11.6174 0.4389 -8.6557 {"}'S' sky -11.4373 0.465 -8.8443 {"}'S' blue -11.2586 0.4486 -9.0373 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 344 A}'S' sea -10.0062 0.3685 -8.37 {"}'S' green -10.1541 0.4183 -8.575 {"}'S' sea -10.31 0.4239 -8.7791 { CE2 TYR 344 A}'S' sea -10.9503 0.4877 -7.0441 {"}'S' green -11.1072 0.502 -7.2515 {"}'S' green -11.2693 0.4785 -7.4541 {"}'S' sea -11.4329 0.4171 -7.6483 {"}'S' green -10.7411 0.4416 -7.1953 {"}'S' green -10.5277 0.3551 -7.3232 {"}'S' sea -10.3198 0.2295 -7.4341 {"}'S' green -10.4717 0.2581 -7.638 { CZ TYR 344 A}'S' green -11.2777 0.3739 -7.8074 {"}'S' green -11.4256 0.4237 -8.0124 {"}'S' sea -11.5815 0.4293 -8.2165 {"}'S' green -11.299 0.5046 -8.2627 {"}'S' green -11.4566 0.4914 -8.4632 {"}'S' green -11.2734 0.5217 -8.6486 {"}'S' green -10.3667 0.2506 -7.8293 {"}'S' green -10.9329 0.5335 -8.6405 {"}'S' sea -11.095 0.5101 -8.8431 {"}'S' sea -10.1588 0.2021 -7.9819 {"}'S' green -10.281 0.3284 -8.1743 {"}'S' green -10.5668 0.4731 -8.5842 {"}'S' green -10.7244 0.4903 -8.7917 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 344 A}'S' P -10.8987 0.4588 -7.4027 {"}'S' -10.8987 0.4574 -7.4024 {"}'S' P -11.0604 0.4358 -7.6065 {"}'S' -11.061 0.4298 -7.6042 {"}'S' P -10.6836 0.3766 -7.5308 {"}'S' -10.6854 0.3723 -7.5306 {"}'S' P -10.8452 0.3577 -7.7355 {"}'S' -10.8488 0.3444 -7.7305 { CZ TYR 344 A}'S' P -11.0046 0.4115 -7.8563 {"}'S' -11.0062 0.3842 -7.8675 {"}'S' P -11.1471 0.4774 -8.0591 {"}'S' -11.1454 0.4478 -8.0671 {"}'S' P -10.674 0.357 -7.8277 {"}'S' -10.6797 0.3297 -7.8395 {"}'S' P -10.8084 0.4554 -8.0287 {"}'S' -10.8182 0.3847 -8.0498 {"}'S' P -10.9552 0.5162 -8.2364 {"}'S' -10.9589 0.4488 -8.2466 {"}'S' P -11.1118 0.5391 -8.4437 {"}'S' -11.1106 0.5261 -8.4443 {"}'S' P -10.489 0.3752 -8.0233 {"}'S' -10.5005 0.3427 -8.0333 {"}'S' P -10.6269 0.4662 -8.2257 {"}'S' -10.6429 0.399 -8.2373 {"}'S' P -10.776 0.5192 -8.433 {"}'S' -10.7839 0.4679 -8.4355 {"}'S' P -10.4181 0.4193 -8.3774 {"}'S' -10.4225 0.4093 -8.3777 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 358 A}'S' sky -11.7505 0.7249 -7.5955 {"}'S' sky -11.5876 0.7617 -7.3949 {"}'S' sky -11.424 0.8373 -7.2057 {"}'S' blue -11.9125 0.7074 -8.2282 {"}'S' sky -11.7634 0.6543 -8.0209 {"}'S' sky -11.6057 0.6399 -7.814 {"}'S' blue -11.8503 0.7572 -8.5955 {"}'S' sky -11.5921 0.7152 -8.6789 {"}'S' blue -11.4627 0.8238 -8.9575 {"}'S' sky -11.1225 0.7919 -8.8988 {"}'S' blue -10.8818 0.878 -8.9705 { HB2 SER 358 A}'S' sky -10.748 0.7315 -7.0368 {"}'S' blue -10.2362 0.6615 -7.1962 {"}'S' blue -10.1189 0.5435 -7.4448 {"}'S' blue -9.8501 0.6034 -7.8909 {"}'S' blue -10.3268 0.8208 -8.8756 {"}'S' blue -9.7746 0.6992 -8.1273 {"}'S' blue -10.0693 0.8909 -8.7926 {"}'S' sky -9.9359 0.7882 -8.5919 {"}'S' blue -9.7723 0.8168 -8.3886 @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 358 A}'S' sea -11.4436 0.6634 -7.6114 {"}'S' sea -11.7129 0.6654 -8.3935 {"}'S' sea -11.5642 0.6116 -8.1866 {"}'S' green -11.45 0.6368 -8.4737 {"}'S' sea -11.3343 0.7202 -8.7618 { HB2 SER 358 A}'S' sea -11.3075 0.6811 -7.3783 {"}'S' sea -11.1451 0.7302 -7.1811 {"}'S' sea -11.3616 0.5494 -7.7792 {"}'S' green -11.2143 0.5064 -7.5767 {"}'S' green -11.0569 0.5243 -7.3776 {"}'S' green -10.8988 0.6011 -7.1944 {"}'S' green -11.2818 0.4855 -8.0674 {"}'S' green -10.6747 0.4952 -7.286 {"}'S' sea -10.5254 0.6312 -7.1301 {"}'S' green -11.2296 0.5849 -8.4596 {"}'S' green -10.5286 0.3847 -7.4985 {"}'S' sea -10.3756 0.5007 -7.3331 {"}'S' sea -11.0791 0.7057 -8.731 {"}'S' green -10.427 0.3219 -7.7811 {"}'S' sea -10.269 0.4077 -7.6001 {"}'S' green -10.8011 0.6329 -8.7616 {"}'S' green -10.2647 0.354 -7.9904 {"}'S' green -10.4613 0.5552 -8.6673 {"}'S' green -10.3264 0.4603 -8.4664 {"}'S' green -10.1706 0.4361 -8.2582 {"}'S' sea -10.0074 0.485 -8.0616 {"}'S' sea -10.2242 0.668 -8.7005 {"}'S' sea -10.087 0.593 -8.501 {"}'S' sea -9.9307 0.6038 -8.3018 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 SER 358 A}'S' P -11.1445 0.404 -7.8679 {"}'S' -11.1427 0.4082 -7.8682 {"}'S' P -10.9925 0.3782 -7.6646 {"}'S' -10.9876 0.3926 -7.6681 {"}'S' P -10.8331 0.4087 -7.4674 {"}'S' -10.8321 0.4194 -7.4718 {"}'S' P -11.1208 0.4442 -8.2805 {"}'S' -11.1055 0.4776 -8.269 {"}'S' P -10.9901 0.3499 -8.0854 {"}'S' -10.9711 0.4121 -8.0771 {"}'S' P -10.8428 0.3082 -7.8831 {"}'S' -10.836 0.3542 -7.8861 {"}'S' P -10.6872 0.3202 -7.6853 {"}'S' -10.6867 0.3251 -7.6856 {"}'S' P -10.9915 0.5296 -8.5676 {"}'S' -10.9901 0.5336 -8.5649 {"}'S' P -10.8753 0.3978 -8.3821 {"}'S' -10.863 0.4567 -8.3583 {"}'S' P -10.7388 0.3164 -8.1821 {"}'S' -10.7318 0.3941 -8.1663 {"}'S' P -10.5864 0.2915 -7.9783 {"}'S' -10.5893 0.3371 -7.9774 {"}'S' P -10.6985 0.4801 -8.5865 {"}'S' -10.6976 0.4908 -8.5792 {"}'S' P -10.5701 0.3793 -8.3914 {"}'S' -10.5725 0.4199 -8.3749 {"}'S' P -10.4228 0.3363 -8.1888 {"}'S' -10.4276 0.3618 -8.1841 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 344 A}'M' greentint -8.921 2.5984 -6.1535 {"}'M' greentint -8.678 2.9886 -5.9481 {"}'M' greentint -8.8172 2.8207 -6.0812 {"}'M' greentint -8.8906 2.6924 -6.3983 {"}'M' greentint -8.9617 2.4473 -6.4225 {"}'M' greentint -8.4926 3.2127 -6.0295 {"}'M' greentint -8.6474 3.0896 -6.1942 {"}'M' greentint -8.7831 2.912 -6.3203 {"}'M' greentint -8.8127 2.7726 -6.6365 {"}'M' greentint -8.8939 2.5294 -6.6749 {"}'M' greentint -8.4117 3.3087 -6.2673 {"}'M' greentint -8.564 3.1728 -6.4272 {"}'M' greentint -8.7006 2.9912 -6.552 {"}'M' greentint -8.6982 2.8174 -6.8662 {"}'M' greentint -8.7837 2.5825 -6.9107 {"}'M' greentint -8.1548 3.4537 -6.3406 {"}'M' greentint -8.3106 3.355 -6.5139 {"}'M' greentint -8.4568 3.2114 -6.6638 {"}'M' greentint -8.5876 3.0294 -6.7822 {"}'M' greentint -8.5472 2.8391 -7.0749 {"}'M' greentint -8.6358 2.604 -7.1252 {"}'M' greentint -8.1549 3.3823 -6.7191 {"}'M' greentint -8.3016 3.2351 -6.8689 {"}'M' greentint -8.4337 3.0522 -6.9889 {"}'M' greentint -8.2587 3.0317 -7.1775 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 358 A}'M' greentint -8.872 2.4622 -6.1921 {"}'M' greentint -8.7307 2.613 -6.0505 {"}'M' greentint -8.6101 2.8073 -5.9488 {"}'M' greentint -8.5176 3.0333 -5.8928 {"}'M' greentint -8.9162 2.325 -6.64 {"}'M' greentint -8.758 2.3887 -6.4536 {"}'M' greentint -8.6078 2.5132 -6.2938 {"}'M' greentint -8.4746 2.6888 -6.1707 {"}'M' greentint -8.3694 2.9034 -6.093 {"}'M' greentint -8.2959 3.1432 -6.0661 {"}'M' greentint -8.7074 2.3862 -6.7872 {"}'M' greentint -8.5468 2.4622 -6.6004 {"}'M' greentint -8.3972 2.6076 -6.448 {"}'M' greentint -8.2727 2.8075 -6.3421 {"}'M' greentint -8.1841 3.0451 -6.2941 {"}'M' greentint -8.1396 3.2999 -6.3068 {"}'M' greentint -8.6137 2.4971 -7.0399 {"}'M' greentint -8.4514 2.542 -6.842 {"}'M' greentint -8.2972 2.6746 -6.6802 {"}'M' greentint -8.1729 2.8779 -6.5756 {"}'M' greentint -8.0946 3.1236 -6.5435 {"}'M' greentint -8.0737 3.379 -6.5868 {"}'M' greentint -8.5027 2.6805 -7.2103 {"}'M' greentint -8.3417 2.7086 -7.0104 {"}'M' greentint -8.1937 2.8605 -6.8615 {"}'M' greentint -8.0989 3.0947 -6.8042 {"}'M' greentint -8.0826 3.3484 -6.8535 {"}'M' greentint -8.2093 2.9953 -7.0844 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 344 A}'M' greentint -9.6789 1.2891 -4.358 {"}'M' greentint -9.464 1.6393 -4.1784 {"}'M' greentint -9.6239 1.5423 -4.3578 {"}'M' greentint -9.7343 1.443 -4.6381 {"}'M' greentint -9.7506 1.1893 -4.5887 {"}'M' greentint -9.3305 1.8571 -4.2319 {"}'M' greentint -9.4915 1.829 -4.4319 {"}'M' greentint -9.6395 1.6771 -4.5807 {"}'M' greentint -9.706 1.5404 -4.8917 {"}'M' greentint -9.7564 1.2858 -4.887 {"}'M' greentint -9.7477 1.0379 -4.8066 {"}'M' greentint -9.142 2.027 -4.2985 {"}'M' greentint -9.3009 2.0301 -4.5044 {"}'M' greentint -9.4612 1.9391 -4.6873 {"}'M' greentint -9.6026 1.7685 -4.8229 {"}'M' greentint -9.6092 1.6147 -5.1317 {"}'M' greentint -9.6775 1.3657 -5.1494 {"}'M' greentint -9.6979 1.1125 -5.1059 {"}'M' greentint -9.0452 2.1617 -4.554 {"}'M' greentint -9.2065 2.1225 -4.7519 {"}'M' greentint -9.3631 2.0105 -4.9233 {"}'M' greentint -9.5017 1.8357 -5.054 {"}'M' greentint -9.4638 1.6342 -5.3493 {"}'M' greentint -9.5373 1.3944 -5.3762 {"}'M' greentint -9.0752 2.1489 -4.9886 {"}'M' greentint -9.2254 2.0245 -5.1484 {"}'M' greentint -9.3586 1.8489 -5.2715 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 358 A}'M' greentint -9.6008 1.1508 -4.5752 {"}'M' greentint -9.4605 1.3128 -4.4392 {"}'M' greentint -9.3385 1.5094 -4.3362 {"}'M' greentint -9.2402 1.7343 -4.2701 {"}'M' greentint -9.1675 1.9753 -4.2446 {"}'M' greentint -9.6452 1.0902 -4.9792 {"}'M' greentint -9.4874 1.2005 -4.8057 {"}'M' greentint -9.342 1.3622 -4.6628 {"}'M' greentint -9.2174 1.5646 -4.5592 {"}'M' greentint -9.121 1.7977 -4.4993 {"}'M' greentint -9.0572 2.0495 -4.4867 {"}'M' greentint -9.5743 1.1923 -5.2319 {"}'M' greentint -9.4146 1.2809 -5.0509 {"}'M' greentint -9.2678 1.4305 -4.9034 {"}'M' greentint -9.1441 1.6303 -4.7987 {"}'M' greentint -9.0523 1.8644 -4.7454 {"}'M' greentint -9.0003 2.1153 -4.747 {"}'M' greentint -9.456 1.3629 -5.386 {"}'M' greentint -9.299 1.4587 -5.2087 {"}'M' greentint -9.1605 1.6293 -5.0772 {"}'M' greentint -9.0576 1.8528 -5.0063 {"}'M' greentint -9.0032 2.1025 -5.006 {"}'M' greentint -9.3174 1.5889 -5.4601 {"}'M' greentint -9.1676 1.7426 -5.3092 {"}'M' greentint -9.0723 1.9789 -5.2517 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 716 1v0eA_718F_748}P -12.4533 -2.1124 -0.1947 {"}-12.4533 -2.1124 -0.1947 { ca tyr A 716 1v0eA_718F_748}-11.1833 -2.4232 -0.888 { c tyr A 716 1v0eA_718F_748}-10.7686 -1.2062 -1.7302 { o tyr A 716 1v0eA_718F_748}-11.4438 -0.8956 -2.7087 { c tyr A 716 1v0eA_718F_748}P -10.7686 -1.2062 -1.7302 { n met A 717 1v0eA_718F_748}-9.6756 -0.5299 -1.3511 { ca met A 717 1v0eA_718F_748}-9.2045 0.6485 -2.0801 { c met A 717 1v0eA_718F_748}-8.0524 0.2233 -2.9854 { o met A 717 1v0eA_718F_748}-7.1065 -0.4166 -2.524 { c met A 717 1v0eA_718F_748}P -8.0524 0.2233 -2.9854 { n phe A 718 1v0eA_718F_748}-8.1215 0.5822 -4.2639 { ca phe A 718 1v0eA_718F_748}-7.1774 0.0497 -5.2513 { c phe A 718 1v0eA_718F_748}-7.1061 0.8832 -6.5489 { o phe A 718 1v0eA_718F_748}-7.9636 1.7277 -6.8097 { c phe A 718 1v0eA_718F_748}P -7.1061 0.8832 -6.5489 { n gly A 719 1v0eA_718F_748}-6.065 0.6424 -7.3487 { ca gly A 719 1v0eA_718F_748}-5.8873 1.372 -8.5934 { c gly A 719 1v0eA_718F_748}-6.6705 0.7911 -9.7585 { o gly A 719 1v0eA_718F_748}-7.0221 -0.3924 -9.7741 { c gly A 719 1v0eA_718F_748}P -6.6705 0.7911 -9.7585 { n gly A 720 1v0eA_718F_748}-6.9354 1.6405 -10.7451 { ca gly A 720 1v0eA_718F_748}-7.5815 1.2497 -11.9798 { c gly A 720 1v0eA_718F_748}-7.1863 2.2979 -13.0102 { o gly A 720 1v0eA_718F_748}-6.9974 3.4647 -12.6612 { n asp A 746 1v0eA_718F_748}P -5.9947 5.9833 -11.4298 {"}-5.9947 5.9833 -11.4298 { ca asp A 746 1v0eA_718F_748}-6.6428 6.6334 -10.2972 { c asp A 746 1v0eA_718F_748}-7.1425 5.5546 -9.3498 { o asp A 746 1v0eA_718F_748}-7.0649 4.3687 -9.6481 { c asp A 746 1v0eA_718F_748}P -7.1425 5.5546 -9.3498 { n leu A 747 1v0eA_718F_748}-7.6785 5.9751 -8.2148 { ca leu A 747 1v0eA_718F_748}-8.1213 5.0387 -7.1795 { c leu A 747 1v0eA_718F_748}-9.6037 4.7685 -7.259 { o leu A 747 1v0eA_718F_748}-10.3874 5.6655 -7.5694 { c leu A 747 1v0eA_718F_748}P -9.6037 4.7685 -7.259 { n tyr A 748 1v0eA_718F_748}-9.9675 3.5232 -6.9747 { ca tyr A 748 1v0eA_718F_748}-11.3454 3.0957 -6.7884 { c tyr A 748 1v0eA_718F_748}-11.5148 2.4868 -5.4027 { o tyr A 748 1v0eA_718F_748}-10.5392 2.2096 -4.7118 { c tyr A 748 1v0eA_718F_748}P -11.5148 2.4868 -5.4027 { n cys A 749 1v0eA_718F_748}-12.7639 2.3122 -4.9973 { ca cys A 749 1v0eA_718F_748}-13.0586 1.6364 -3.7489 { c cys A 749 1v0eA_718F_748}-14.2668 0.7268 -3.9434 { o cys A 749 1v0eA_718F_748}-15.3504 1.1766 -4.3464 { c cys A 749 1v0eA_718F_748}P -14.2668 0.7268 -3.9434 { n tyr A 750 1v0eA_718F_748}-14.0773 -0.5633 -3.6975 { ca tyr A 750 1v0eA_718F_748}-15.2199 -1.4721 -3.6831 { c tyr A 750 1v0eA_718F_748}-15.7797 -1.5708 -2.2588 { o tyr A 750 1v0eA_718F_748}-15.0632 -1.9525 -1.3376 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 716 1v0eA_718F_748}P -12.4533 -2.1124 -0.1947 { ca tyr A 716 1v0eA_718F_748}P -11.1833 -2.4232 -0.888 { n met A 717 1v0eA_718F_748}P -9.6756 -0.5299 -1.3511 { ca met A 717 1v0eA_718F_748}P -9.2045 0.6485 -2.0801 { n phe A 718 1v0eA_718F_748}P -8.1215 0.5822 -4.2639 { ca phe A 718 1v0eA_718F_748}P -7.1774 0.0497 -5.2513 { n gly A 719 1v0eA_718F_748}P -6.065 0.6424 -7.3487 { ca gly A 719 1v0eA_718F_748}P -5.8873 1.372 -8.5934 {"}P -5.8873 1.372 -8.5934 { n gly A 720 1v0eA_718F_748}P -6.9354 1.6405 -10.7451 { ca gly A 720 1v0eA_718F_748}P -7.5815 1.2497 -11.9798 {"}P -7.5815 1.2497 -11.9798 { n asp A 746 1v0eA_718F_748}P -5.9947 5.9833 -11.4298 { ca asp A 746 1v0eA_718F_748}P -6.6428 6.6334 -10.2972 { n leu A 747 1v0eA_718F_748}P -7.6785 5.9751 -8.2148 { ca leu A 747 1v0eA_718F_748}P -8.1213 5.0387 -7.1795 { n tyr A 748 1v0eA_718F_748}P -9.9675 3.5232 -6.9747 { ca tyr A 748 1v0eA_718F_748}P -11.3454 3.0957 -6.7884 { n cys A 749 1v0eA_718F_748}P -12.7639 2.3122 -4.9973 { ca cys A 749 1v0eA_718F_748}P -13.0586 1.6364 -3.7489 { n tyr A 750 1v0eA_718F_748}P -14.0773 -0.5633 -3.6975 { ca tyr A 750 1v0eA_718F_748}P -15.2199 -1.4721 -3.6831 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 716 1v0eA_718F_748}P -11.1833 -2.4232 -0.888 {"}-11.1833 -2.4232 -0.888 { ca met A 717 1v0eA_718F_748}-9.2045 0.6485 -2.0801 { ca phe A 718 1v0eA_718F_748}-7.1774 0.0497 -5.2513 { ca gly A 719 1v0eA_718F_748}-5.8873 1.372 -8.5934 { ca gly A 720 1v0eA_718F_748}-7.5815 1.2497 -11.9798 { ca asp A 746 1v0eA_718F_748}P -6.6428 6.6334 -10.2972 {"}-6.6428 6.6334 -10.2972 { ca leu A 747 1v0eA_718F_748}-8.1213 5.0387 -7.1795 { ca tyr A 748 1v0eA_718F_748}-11.3454 3.0957 -6.7884 { ca cys A 749 1v0eA_718F_748}-13.0586 1.6364 -3.7489 { ca tyr A 750 1v0eA_718F_748}-15.2199 -1.4721 -3.6831 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 718 1v0eA_718F_748}P -7.1774 0.0497 -5.2513 { cb phe A 718 1v0eA_718F_748}-7.5287 -1.4269 -5.5533 { cg phe A 718 1v0eA_718F_748}-8.8394 -1.6184 -6.2842 { cd1 phe A 718 1v0eA_718F_748}-8.8461 -2.1067 -7.5986 { ce1 phe A 718 1v0eA_718F_748}-10.0462 -2.3004 -8.2787 { cz phe A 718 1v0eA_718F_748}-11.2813 -2.0045 -7.6436 { cg phe A 718 1v0eA_718F_748}P -8.8394 -1.6184 -6.2842 { cd2 phe A 718 1v0eA_718F_748}-10.0718 -1.3491 -5.6565 { ce2 phe A 718 1v0eA_718F_748}-11.2812 -1.528 -6.3168 { cz phe A 718 1v0eA_718F_748}ghost -11.2813 -2.0045 -7.6436 { ca tyr A 748 1v0eA_718F_748}P -11.3454 3.0957 -6.7884 { cb tyr A 748 1v0eA_718F_748}-11.7645 2.0846 -7.8806 { cg tyr A 748 1v0eA_718F_748}-11.6398 2.7144 -9.2466 { cd1 tyr A 748 1v0eA_718F_748}-10.3845 2.91 -9.8449 { ce1 tyr A 748 1v0eA_718F_748}-10.2785 3.5454 -11.108 { cz tyr A 748 1v0eA_718F_748}-11.4371 3.9842 -11.7219 { oh tyr A 748 1v0eA_718F_748}-11.4095 4.5881 -12.9345 { cg tyr A 748 1v0eA_718F_748}P -11.6398 2.7144 -9.2466 { cd2 tyr A 748 1v0eA_718F_748}-12.7672 3.1732 -9.9063 { ce2 tyr A 748 1v0eA_718F_748}-12.6744 3.7956 -11.1484 { cz tyr A 748 1v0eA_718F_748}ghost -11.4371 3.9842 -11.7219 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 718 1v0eA_718F_748}P -7.5287 -1.4269 -5.5533 {"}P -7.5287 -1.4269 -5.5533 { cd1 phe A 718 1v0eA_718F_748}P -8.8461 -2.1067 -7.5986 { cd2 phe A 718 1v0eA_718F_748}P -10.0718 -1.3491 -5.6565 { ce1 phe A 718 1v0eA_718F_748}P -10.0462 -2.3004 -8.2787 { ce2 phe A 718 1v0eA_718F_748}P -11.2812 -1.528 -6.3168 { cz phe A 718 1v0eA_718F_748}P -11.2813 -2.0045 -7.6436 { cb tyr A 748 1v0eA_718F_748}P -11.7645 2.0846 -7.8806 {"}P -11.7645 2.0846 -7.8806 { cd1 tyr A 748 1v0eA_718F_748}P -10.3845 2.91 -9.8449 { cd2 tyr A 748 1v0eA_718F_748}P -12.7672 3.1732 -9.9063 { ce1 tyr A 748 1v0eA_718F_748}P -10.2785 3.5454 -11.108 { ce2 tyr A 748 1v0eA_718F_748}P -12.6744 3.7956 -11.1484 { oh tyr A 748 1v0eA_718F_748}P -11.4095 4.5881 -12.9345 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 718 A}'S' blue -11.3316 0.1907 -6.6431 {"}'S' sky -11.4953 0.1292 -6.8373 {"}'S' sky -11.6561 0.0308 -7.0176 {"}'S' blue -11.8103 -0.1008 -7.1813 {"}'S' sky -11.1227 0.148 -6.7955 {"}'S' sky -11.6021 -0.1406 -7.3336 {"}'S' sky -10.9075 0.0699 -6.9244 {"}'S' sky -11.3889 -0.2129 -7.4665 {"}'S' blue -10.6916 -0.0415 -7.0277 {"}'S' sky -10.8516 -0.0928 -7.221 {"}'S' sky -11.0105 -0.1812 -7.4009 {"}'S' blue -10.7801 -0.302 -7.4599 { CZ PHE 718 A}'S' blue -11.6933 -0.3044 -7.59 {"}'S' sky -11.3485 -0.2567 -7.5705 {"}'S' sky -11.5101 -0.2742 -7.7754 {"}'S' sky -11.0127 -0.2766 -7.5598 {"}'S' sky -11.1696 -0.2623 -7.7673 {"}'S' sky -11.3317 -0.2858 -7.9698 {"}'S' blue -11.4953 -0.3472 -8.1641 {"}'S' blue -10.8034 -0.3227 -7.711 {"}'S' sky -10.9611 -0.3055 -7.9184 {"}'S' blue -11.1228 -0.3285 -8.1223 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 718 A}'S' sea -11.2859 0.0873 -6.9893 {"}'S' sea -11.4471 -0.0092 -7.1705 {"}'S' sea -11.071 0.0126 -7.1194 {"}'S' sea -11.2331 -0.0827 -7.3021 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 748 A}'S' blue -11.6318 0.4569 -7.056 {"}'S' blue -11.7011 0.233 -7.4516 {"}'S' sky -11.5437 0.251 -7.2525 {"}'S' sky -11.3855 0.3278 -7.0693 {"}'S' sky -11.2347 0.4582 -6.9118 {"}'S' blue -11.6312 0.1307 -7.7429 {"}'S' sky -11.4793 0.1049 -7.5396 {"}'S' sky -11.0121 0.3579 -7.005 {"}'S' blue -11.4768 0.0765 -7.9604 {"}'S' sky -11.3295 0.0349 -7.7581 {"}'S' sky -11.174 0.0469 -7.5602 {"}'S' sky -10.8624 0.2274 -7.208 {"}'S' blue -10.7229 0.3882 -7.0712 {"}'S' sky -11.2255 0.0431 -8.057 {"}'S' sky -11.0731 0.0181 -7.8533 {"}'S' sky -10.9137 0.0486 -7.656 {"}'S' sky -10.7557 0.1343 -7.475 {"}'S' blue -10.6056 0.2702 -7.3197 {"}'S' blue -10.9096 0.0629 -8.0638 {"}'S' blue -10.7514 0.0807 -7.8653 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 748 A}'S' sea -11.3199 0.1354 -7.3423 {"}'S' sea -11.1614 0.2219 -7.1609 {"}'S' sea -11.0153 0.1114 -7.3735 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O PHE 718 A}'M' P -9.0158 2.646 -6.7092 {"}'M' -8.9995 2.6329 -6.7113 {"}'M' P -9.1515 2.4684 -6.8354 {"}'M' -9.1299 2.4549 -6.8352 {"}'M' P -8.9324 2.7291 -6.9423 {"}'M' -8.9272 2.7242 -6.9409 {"}'M' P -9.069 2.5476 -7.0671 {"}'M' -9.0638 2.544 -7.066 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 718 A}'M' greentint -9.1357 2.1201 -6.1533 {"}'M' greentint -9.2793 2.0124 -6.4258 {"}'M' greentint -9.037 2.408 -6.2225 {"}'M' greentint -9.1856 2.2511 -6.371 {"}'M' greentint -9.2894 2.1548 -6.6685 {"}'M' greentint -9.3459 1.9053 -6.6717 {"}'M' greentint -8.7299 2.6465 -6.0827 {"}'M' greentint -8.8878 2.6382 -6.2847 {"}'M' greentint -9.0464 2.545 -6.4631 {"}'M' greentint -9.1856 2.377 -6.5963 {"}'M' greentint -9.259 2.2488 -6.9133 {"}'M' greentint -9.3301 2.0037 -6.9375 {"}'M' greentint -8.7008 2.8273 -6.3526 {"}'M' greentint -8.861 2.769 -6.5445 {"}'M' greentint -9.1811 2.329 -7.1516 {"}'M' greentint -9.2623 2.0858 -7.1899 {"}'M' greentint -9.3097 1.8314 -7.1796 {"}'M' greentint -8.4576 2.9707 -6.3946 {"}'M' greentint -8.6177 2.9467 -6.596 {"}'M' greentint -8.7801 2.8651 -6.7823 {"}'M' greentint -9.0666 2.3737 -7.3812 {"}'M' greentint -9.1521 2.1389 -7.4258 {"}'M' greentint -8.5232 3.0101 -6.8556 {"}'M' greentint -8.679 2.9113 -7.0289 {"}'M' greentint -8.8252 2.7678 -7.1788 {"}'M' greentint -8.956 2.5858 -7.2973 {"}'M' greentint -8.9156 2.3955 -7.59 {"}'M' greentint -8.3665 3.0446 -7.0611 {"}'M' greentint -8.5233 2.9387 -7.2342 {"}'M' greentint -8.67 2.7915 -7.384 {"}'M' greentint -8.8021 2.6086 -7.5039 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H TYR 748 A}'M' P -8.6376 2.0744 -6.636 {"}'M' -8.6451 2.0822 -6.6378 {"}'M' P -8.5375 2.1414 -6.8683 {"}'M' -8.5721 2.1706 -6.8675 {"}'M' P -8.4133 2.3447 -6.7637 {"}'M' -8.4286 2.352 -6.7658 {"}'M' P -8.4341 2.3274 -7.0495 {"}'M' -8.4349 2.3275 -7.0489 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 748 A}'M' greentint -9.2673 1.8319 -6.5526 {"}'M' greentint -9.1123 1.9291 -6.3802 {"}'M' greentint -8.971 2.0799 -6.2385 {"}'M' greentint -8.8504 2.2741 -6.1368 {"}'M' greentint -8.7579 2.5001 -6.0808 {"}'M' greentint -9.3109 1.7925 -7.0271 {"}'M' greentint -9.1566 1.7918 -6.828 {"}'M' greentint -8.9984 1.8555 -6.6417 {"}'M' greentint -8.8481 1.98 -6.4818 {"}'M' greentint -8.715 2.1556 -6.3587 {"}'M' greentint -8.6098 2.3702 -6.281 {"}'M' greentint -8.5363 2.61 -6.2541 {"}'M' greentint -8.5033 2.8591 -6.2795 {"}'M' greentint -9.106 1.8508 -7.179 {"}'M' greentint -8.9478 1.853 -6.9753 {"}'M' greentint -8.7871 1.929 -6.7884 {"}'M' greentint -8.513 2.2743 -6.5302 {"}'M' greentint -8.4244 2.5119 -6.4821 {"}'M' greentint -8.3799 2.7667 -6.4948 {"}'M' greentint -8.3832 3.0136 -6.5676 {"}'M' greentint -9.0029 2.0135 -7.434 {"}'M' greentint -8.8541 1.9639 -7.2279 {"}'M' greentint -8.6918 2.0088 -7.03 {"}'M' greentint -8.335 2.5904 -6.7315 {"}'M' greentint -8.314 2.8458 -6.7748 {"}'M' greentint -8.8748 2.2491 -7.5965 {"}'M' greentint -8.7431 2.1473 -7.3984 {"}'M' greentint -8.5821 2.1754 -7.1984 {"}'M' greentint -8.3393 2.5615 -6.9922 {"}'M' greentint -8.323 2.8152 -7.0415 {"}'M' greentint -8.7138 2.5204 -7.6297 {"}'M' greentint -8.6096 2.3652 -7.4519 {"}'M' greentint -8.4496 2.4621 -7.2725 {"}'M' greentint -8.3947 2.7154 -7.2723 {"}'M' greentint -8.5279 2.6118 -7.4717 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 718 A}'M' greentint -9.7106 1.2837 -4.2309 {"}'M' greentint -9.4957 1.6339 -4.0513 {"}'M' greentint -9.6556 1.537 -4.2307 {"}'M' greentint -9.766 1.4376 -4.511 {"}'M' greentint -9.7823 1.1839 -4.4617 {"}'M' greentint -9.3622 1.8518 -4.1048 {"}'M' greentint -9.5232 1.8237 -4.3048 {"}'M' greentint -9.6712 1.6718 -4.4536 {"}'M' greentint -9.7377 1.5351 -4.7646 {"}'M' greentint -9.7881 1.2804 -4.76 {"}'M' greentint -9.3326 2.0248 -4.3774 {"}'M' greentint -9.4929 1.9337 -4.5602 {"}'M' greentint -9.6343 1.7632 -4.6958 {"}'M' greentint -9.6409 1.6094 -5.0046 {"}'M' greentint -9.7091 1.3604 -5.0223 {"}'M' greentint -9.7296 1.1071 -4.9788 {"}'M' greentint -9.2382 2.1172 -4.6248 {"}'M' greentint -9.3948 2.0051 -4.7962 {"}'M' greentint -9.5334 1.8304 -4.9269 {"}'M' greentint -9.4955 1.6289 -5.2222 {"}'M' greentint -9.569 1.3891 -5.2491 {"}'M' greentint -9.2571 2.0191 -5.0213 {"}'M' greentint -9.3903 1.8435 -5.1444 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 748 A}'M' green -9.3206 1.9125 -4.0892 {"}'M' green -9.7983 1.0275 -4.8238 {"}'M' green -9.7274 1.1296 -5.0766 {"}'M' green -9.6091 1.3001 -5.2306 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 748 A}'M' greentint -9.7539 1.0881 -4.4198 {"}'M' greentint -9.6136 1.2501 -4.2838 {"}'M' greentint -9.4916 1.4467 -4.1808 {"}'M' greentint -9.3933 1.6715 -4.1147 {"}'M' greentint -9.6405 1.1377 -4.6503 {"}'M' greentint -9.4951 1.2995 -4.5074 {"}'M' greentint -9.3705 1.5019 -4.4038 {"}'M' greentint -9.274 1.735 -4.3439 {"}'M' greentint -9.2103 1.9867 -4.3313 {"}'M' greentint -9.5676 1.2182 -4.8956 {"}'M' greentint -9.4209 1.3678 -4.748 {"}'M' greentint -9.2972 1.5676 -4.6433 {"}'M' greentint -9.2054 1.8017 -4.59 {"}'M' greentint -9.1534 2.0526 -4.5916 {"}'M' greentint -9.4521 1.396 -5.0533 {"}'M' greentint -9.3136 1.5666 -4.9218 {"}'M' greentint -9.2107 1.7901 -4.8509 {"}'M' greentint -9.1562 2.0398 -4.8506 {"}'M' greentint -9.4705 1.5262 -5.3047 {"}'M' greentint -9.3207 1.6799 -5.1539 {"}'M' greentint -9.2254 1.9162 -5.0963 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg F 56 1v54F_72F_58V}P -6.9489 5.7272 -11.705 {"}-6.9489 5.7272 -11.705 { ca arg F 56 1v54F_72F_58V}-7.7318 6.3781 -10.6609 { c arg F 56 1v54F_72F_58V}-7.9691 5.394 -9.5337 { o arg F 56 1v54F_72F_58V}-8.1787 4.2114 -9.7827 { c arg F 56 1v54F_72F_58V}P -7.9691 5.394 -9.5337 { n ile F 57 1v54F_72F_58V}-7.9081 5.8646 -8.2898 { ca ile F 57 1v54F_72F_58V}-8.1611 4.9732 -7.1625 { c ile F 57 1v54F_72F_58V}-9.645 4.6919 -7.0536 { o ile F 57 1v54F_72F_58V}-10.4719 5.5985 -7.133 { c ile F 57 1v54F_72F_58V}P -9.645 4.6919 -7.0536 { n val F 58 1v54F_72F_58V}-9.9804 3.4131 -6.9501 { ca val F 58 1v54F_72F_58V}-11.3546 2.984 -6.7789 { c val F 58 1v54F_72F_58V}-11.4908 2.4297 -5.3621 { o val F 58 1v54F_72F_58V}-10.5737 1.8014 -4.8316 { c val F 58 1v54F_72F_58V}P -11.4908 2.4297 -5.3621 { n gly F 59 1v54F_72F_58V}-12.6253 2.7229 -4.7375 { ca gly F 59 1v54F_72F_58V}-12.9163 2.2177 -3.412 { c gly F 59 1v54F_72F_58V}-14.1685 1.3936 -3.599 { o gly F 59 1v54F_72F_58V}-15.1798 1.9079 -4.0767 { c gly F 59 1v54F_72F_58V}P -14.1685 1.3936 -3.599 { n cys F 60 1v54F_72F_58V}-14.1053 0.108 -3.2722 { ca cys F 60 1v54F_72F_58V}-15.2577 -0.753 -3.4528 { c cys F 60 1v54F_72F_58V}-15.894 -1.1841 -2.1461 { o cys F 60 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-4.7972 {"}'M' greentint -9.7894 1.3558 -4.9328 {"}'M' greentint -9.796 1.202 -5.2416 {"}'M' greentint -9.8643 0.953 -5.2593 {"}'M' greentint -9.8848 0.6997 -5.2158 {"}'M' greentint -9.3933 1.7098 -4.8618 {"}'M' greentint -9.55 1.5977 -5.0332 {"}'M' greentint -9.6885 1.423 -5.1639 {"}'M' greentint -9.6507 1.2215 -5.4592 {"}'M' greentint -9.7241 0.9817 -5.4861 {"}'M' greentint -9.4123 1.6117 -5.2583 {"}'M' greentint -9.5454 1.4361 -5.3814 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LEU 55 A}'M' green -9.5298 1.4037 -4.2539 {"}'M' green -9.8183 0.7913 -5.3953 {"}'M' green -9.5715 1.3153 -5.5296 @dotlist {x} color= red width= 1 master= {H-bonds} { O LEU 55 A}'M' greentint -9.8228 0.7413 -4.4484 {"}'M' greentint -9.7008 0.9379 -4.3454 {"}'M' greentint -9.6025 1.1627 -4.2794 {"}'M' greentint -9.8497 0.6289 -4.815 {"}'M' greentint -9.7043 0.7907 -4.6721 {"}'M' greentint -9.5797 0.9931 -4.5685 {"}'M' greentint -9.4833 1.2262 -4.5086 {"}'M' greentint 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-7.1562 {"}'M' greentint -8.8681 2.6644 -7.3557 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 484 A}'M' greentint -9.8697 1.1383 -4.4271 {"}'M' greentint -10.0029 1.0346 -4.6266 {"}'M' greentint -9.788 1.3848 -4.447 {"}'M' greentint -9.948 1.2879 -4.6264 {"}'M' greentint -10.0583 1.1885 -4.9067 {"}'M' greentint -10.0746 0.9349 -4.8574 {"}'M' greentint -9.6545 1.6027 -4.5005 {"}'M' greentint -9.8155 1.5746 -4.7005 {"}'M' greentint -9.9635 1.4227 -4.8493 {"}'M' greentint -10.0301 1.286 -5.1603 {"}'M' greentint -10.0805 1.0313 -5.1556 {"}'M' greentint -9.4661 1.7726 -4.5671 {"}'M' greentint -9.625 1.7757 -4.773 {"}'M' greentint -9.7852 1.6846 -4.9559 {"}'M' greentint -9.9266 1.5141 -5.0915 {"}'M' greentint -9.9332 1.3603 -5.4003 {"}'M' greentint -10.0015 1.1113 -5.418 {"}'M' greentint -9.5305 1.8681 -5.0205 {"}'M' greentint -9.6871 1.756 -5.1919 {"}'M' greentint -9.8257 1.5813 -5.3226 {"}'M' greentint -9.5495 1.77 -5.417 {"}'M' greentint -9.6826 1.5944 -5.5401 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 438 A}'M' green -9.8442 1.0282 -4.3654 {"}'M' green -9.8642 1.2752 -5.589 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 438 A}'M' greentint -10.0289 0.8057 -4.9055 {"}'M' greentint -9.8711 0.9159 -4.732 {"}'M' greentint -9.7257 1.0776 -4.589 {"}'M' greentint -9.6011 1.28 -4.4854 {"}'M' greentint -9.5046 1.5131 -4.4256 {"}'M' greentint -9.958 0.9078 -5.1582 {"}'M' greentint -9.7982 0.9964 -4.9772 {"}'M' greentint -9.6515 1.146 -4.8297 {"}'M' greentint -9.5278 1.3457 -4.7249 {"}'M' greentint -9.4359 1.5799 -4.6716 {"}'M' greentint -9.384 1.8308 -4.6732 {"}'M' greentint -9.8397 1.0783 -5.3123 {"}'M' greentint -9.6827 1.1742 -5.135 {"}'M' greentint -9.5442 1.3448 -5.0034 {"}'M' greentint -9.4413 1.5682 -4.9326 {"}'M' greentint -9.3868 1.818 -4.9323 {"}'M' greentint -9.701 1.3044 -5.3863 {"}'M' greentint -9.5513 1.4581 -5.2355 {"}'M' greentint -9.456 1.6944 -5.178 {"}'M' greentint -9.5928 1.6023 -5.4466 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg A 2 1vgjA_4F_163K}P -12.3661 -1.8349 0.3618 {"}-12.3661 -1.8349 0.3618 { ca arg A 2 1vgjA_4F_163K}-11.1146 -2.2802 -0.2304 { c arg A 2 1vgjA_4F_163K}-10.8128 -1.3478 -1.4303 { o arg A 2 1vgjA_4F_163K}-11.6143 -1.2999 -2.4016 { c arg A 2 1vgjA_4F_163K}P -10.8128 -1.3478 -1.4303 { n ala A 3 1vgjA_4F_163K}-9.6886 -0.6431 -1.3465 { ca ala A 3 1vgjA_4F_163K}-9.3073 0.3288 -2.4279 { c ala A 3 1vgjA_4F_163K}-8.376 -0.3043 -3.4695 { o ala A 3 1vgjA_4F_163K}-7.5911 -1.2462 -3.1337 { c ala A 3 1vgjA_4F_163K}P -8.376 -0.3043 -3.4695 { n phe A 4 1vgjA_4F_163K}-8.339 0.2597 -4.6978 { ca phe A 4 1vgjA_4F_163K}-7.3813 -0.2188 -5.6634 { c phe A 4 1vgjA_4F_163K}-7.2396 0.862 -6.7315 { o phe A 4 1vgjA_4F_163K}-7.9975 1.8601 -6.6931 { c phe A 4 1vgjA_4F_163K}P -7.2396 0.862 -6.7315 { n ile A 5 1vgjA_4F_163K}-6.2011 0.7168 -7.5552 { ca ile A 5 1vgjA_4F_163K}-5.9491 1.7053 -8.5608 { c ile A 5 1vgjA_4F_163K}-6.1622 1.0648 -9.9277 { o ile A 5 1vgjA_4F_163K}-5.7781 -0.0768 -10.1043 { c ile A 5 1vgjA_4F_163K}P -6.1622 1.0648 -9.9277 { n ala A 6 1vgjA_4F_163K}-6.7964 1.7784 -10.8702 { ca ala A 6 1vgjA_4F_163K}-7.1415 1.1786 -12.1141 { c ala A 6 1vgjA_4F_163K}-7.157 2.158 -13.2697 { o ala A 6 1vgjA_4F_163K}-7.0828 3.3868 -13.0796 { n glu A 161 1vgjA_4F_163K}P -7.1197 5.9045 -11.8216 {"}-7.1197 5.9045 -11.8216 { ca glu A 161 1vgjA_4F_163K}-8.2022 6.2027 -10.888 { c glu A 161 1vgjA_4F_163K}-7.9871 5.4279 -9.6242 { o glu A 161 1vgjA_4F_163K}-7.5782 4.2606 -9.655 { c glu A 161 1vgjA_4F_163K}P -7.9871 5.4279 -9.6242 { n leu A 162 1vgjA_4F_163K}-8.4669 6.0248 -8.5451 { ca leu A 162 1vgjA_4F_163K}-8.4738 5.4062 -7.2239 { c leu A 162 1vgjA_4F_163K}-9.8989 5.0625 -6.9862 { o leu A 162 1vgjA_4F_163K}-10.801 5.9338 -7.0698 { c leu A 162 1vgjA_4F_163K}P -9.8989 5.0625 -6.9862 { n lys A 163 1vgjA_4F_163K}-10.1421 3.7752 -6.7497 { ca lys A 163 1vgjA_4F_163K}-11.4852 3.2795 -6.5839 { c lys A 163 1vgjA_4F_163K}-11.5466 2.477 -5.2766 { o lys A 163 1vgjA_4F_163K}-10.5284 2.1054 -4.6596 { c lys A 163 1vgjA_4F_163K}P -11.5466 2.477 -5.2766 { n lys A 164 1vgjA_4F_163K}-12.7607 2.1719 -4.9011 { ca lys A 164 1vgjA_4F_163K}-12.9485 1.2626 -3.7899 { c lys A 164 1vgjA_4F_163K}-14.2029 0.3845 -4.0155 { o lys A 164 1vgjA_4F_163K}-15.0928 0.7833 -4.7622 { c lys A 164 1vgjA_4F_163K}P -14.2029 0.3845 -4.0155 { n ser A 165 1vgjA_4F_163K}-14.2082 -0.8217 -3.4313 { ca ser A 165 1vgjA_4F_163K}-15.366 -1.7387 -3.5313 { c ser A 165 1vgjA_4F_163K}-15.8528 -2.0045 -2.1229 { o ser A 165 1vgjA_4F_163K}-15.0525 -2.107 -1.1784 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 2 1vgjA_4F_163K}P -12.3661 -1.8349 0.3618 { ca arg A 2 1vgjA_4F_163K}P -11.1146 -2.2802 -0.2304 { n ala A 3 1vgjA_4F_163K}P -9.6886 -0.6431 -1.3465 { ca ala A 3 1vgjA_4F_163K}P -9.3073 0.3288 -2.4279 { n phe A 4 1vgjA_4F_163K}P -8.339 0.2597 -4.6978 { ca phe A 4 1vgjA_4F_163K}P -7.3813 -0.2188 -5.6634 { n ile A 5 1vgjA_4F_163K}P -6.2011 0.7168 -7.5552 { ca ile A 5 1vgjA_4F_163K}P -5.9491 1.7053 -8.5608 { n ala A 6 1vgjA_4F_163K}P -6.7964 1.7784 -10.8702 { ca ala A 6 1vgjA_4F_163K}P -7.1415 1.1786 -12.1141 { n glu A 161 1vgjA_4F_163K}P -7.1197 5.9045 -11.8216 { ca glu A 161 1vgjA_4F_163K}P -8.2022 6.2027 -10.888 { n leu A 162 1vgjA_4F_163K}P -8.4669 6.0248 -8.5451 { ca leu A 162 1vgjA_4F_163K}P -8.4738 5.4062 -7.2239 { n lys A 163 1vgjA_4F_163K}P -10.1421 3.7752 -6.7497 { ca lys A 163 1vgjA_4F_163K}P -11.4852 3.2795 -6.5839 { n lys A 164 1vgjA_4F_163K}P -12.7607 2.1719 -4.9011 { ca lys A 164 1vgjA_4F_163K}P -12.9485 1.2626 -3.7899 { n ser A 165 1vgjA_4F_163K}P -14.2082 -0.8217 -3.4313 { ca ser A 165 1vgjA_4F_163K}P -15.366 -1.7387 -3.5313 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca arg A 2 1vgjA_4F_163K}P -11.1146 -2.2802 -0.2304 {"}-11.1146 -2.2802 -0.2304 { ca ala A 3 1vgjA_4F_163K}-9.3073 0.3288 -2.4279 { ca phe A 4 1vgjA_4F_163K}-7.3813 -0.2188 -5.6634 { ca ile A 5 1vgjA_4F_163K}-5.9491 1.7053 -8.5608 { ca ala A 6 1vgjA_4F_163K}-7.1415 1.1786 -12.1141 { ca glu A 161 1vgjA_4F_163K}P -8.2022 6.2027 -10.888 {"}-8.2022 6.2027 -10.888 { ca leu A 162 1vgjA_4F_163K}-8.4738 5.4062 -7.2239 { ca lys A 163 1vgjA_4F_163K}-11.4852 3.2795 -6.5839 { ca lys A 164 1vgjA_4F_163K}-12.9485 1.2626 -3.7899 { ca ser A 165 1vgjA_4F_163K}-15.366 -1.7387 -3.5313 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 4 1vgjA_4F_163K}P -7.3813 -0.2188 -5.6634 { cb phe A 4 1vgjA_4F_163K}-7.8819 -1.5331 -6.2732 { cg phe A 4 1vgjA_4F_163K}-9.2333 -1.4212 -6.9172 { cd1 phe A 4 1vgjA_4F_163K}-10.3795 -1.437 -6.1578 { ce1 phe A 4 1vgjA_4F_163K}-11.7266 -1.3192 -6.8195 { cz phe A 4 1vgjA_4F_163K}-11.8085 -1.2199 -8.2357 { cg phe A 4 1vgjA_4F_163K}P -9.2333 -1.4212 -6.9172 { cd2 phe A 4 1vgjA_4F_163K}-9.3205 -1.3057 -8.2828 { ce2 phe A 4 1vgjA_4F_163K}-10.6425 -1.2145 -8.9896 { cz phe A 4 1vgjA_4F_163K}ghost -11.8085 -1.2199 -8.2357 { ca lys A 163 1vgjA_4F_163K}P -11.4852 3.2795 -6.5839 { cb lys A 163 1vgjA_4F_163K}-11.7734 2.25 -7.7152 { cg lys A 163 1vgjA_4F_163K}-11.7219 2.9048 -9.1238 { cd lys A 163 1vgjA_4F_163K}-12.3134 1.9712 -10.1446 { ce lys A 163 1vgjA_4F_163K}-12.2375 2.5831 -11.4947 { nz lys A 163 1vgjA_4F_163K}-13.2932 3.5919 -11.7426 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 4 1vgjA_4F_163K}P -7.8819 -1.5331 -6.2732 {"}P -7.8819 -1.5331 -6.2732 { cd1 phe A 4 1vgjA_4F_163K}P -10.3795 -1.437 -6.1578 { cd2 phe A 4 1vgjA_4F_163K}P -9.3205 -1.3057 -8.2828 { ce1 phe A 4 1vgjA_4F_163K}P -11.7266 -1.3192 -6.8195 { ce2 phe A 4 1vgjA_4F_163K}P -10.6425 -1.2145 -8.9896 { cz phe A 4 1vgjA_4F_163K}P -11.8085 -1.2199 -8.2357 { cb lys A 163 1vgjA_4F_163K}P -11.7734 2.25 -7.7152 {"}P -11.7734 2.25 -7.7152 { cg lys A 163 1vgjA_4F_163K}P -11.7219 2.9048 -9.1238 {"}P -11.7219 2.9048 -9.1238 { cd lys A 163 1vgjA_4F_163K}P -12.3134 1.9712 -10.1446 {"}P -12.3134 1.9712 -10.1446 { ce lys A 163 1vgjA_4F_163K}P -12.2375 2.5831 -11.4947 {"}P -12.2375 2.5831 -11.4947 { nz lys A 163 1vgjA_4F_163K}P -13.2932 3.5919 -11.7426 {"}P -13.2932 3.5919 -11.7426 {"}P -13.2932 3.5919 -11.7426 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 4 A}'S' blue -10.5936 0.2203 -6.6783 {"}'S' blue -10.5454 0.0818 -7.0116 { CD2 PHE 4 A}'S' blue -10.1926 0.0821 -7.6692 {"}'S' blue -9.9583 0.2253 -7.7251 {"}'S' blue -10.1193 0.2104 -7.9281 {"}'S' blue -10.0178 0.296 -8.1798 { CE1 PHE 4 A}'S' blue -12.1387 0.3809 -6.7659 {"}'S' blue -12.2995 0.3283 -6.9583 {"}'S' blue -12.4568 0.2386 -7.1374 {"}'S' sky -11.7939 0.4286 -6.7464 {"}'S' sky -12.1193 0.3545 -7.147 {"}'S' sky -12.2805 0.2607 -7.3288 {"}'S' sky -11.458 0.4087 -6.7357 {"}'S' sky -11.1002 0.3088 -6.68 {"}'S' sky -10.8879 0.2166 -6.808 {"}'S' sky -10.7484 0.0201 -7.3774 { CE2 PHE 4 A}'S' blue -10.525 -0.0151 -7.7203 {"}'S' sky -11.1795 0.4235 -8.6892 {"}'S' sky -10.362 0.165 -7.9503 {"}'S' sky -10.8969 0.4987 -8.7355 {"}'S' sky -10.272 0.3511 -8.3005 {"}'S' sky -10.4064 0.4495 -8.5015 {"}'S' sky -10.5532 0.5103 -8.7092 { CZ PHE 4 A}'S' sky -12.2933 0.277 -7.4696 {"}'S' sky -12.4463 0.3112 -7.6779 {"}'S' blue -12.6073 0.2963 -7.881 {"}'S' sky -12.5058 0.3819 -8.1327 {"}'S' sky -12.3814 0.4276 -8.3746 {"}'S' sky -12.2012 0.4538 -8.5632 {"}'S' blue -12.3624 0.3601 -8.745 {"}'S' blue -12.5178 0.2303 -8.9107 {"}'S' sky -12.0226 0.4374 -8.7562 {"}'S' sky -12.1834 0.3389 -8.9365 {"}'S' sky -12.3377 0.2074 -9.1001 {"}'S' sky -12.4827 0.0436 -9.2422 {"}'S' sky -10.8177 0.0331 -7.5213 {"}'S' sky -11.65 0.4561 -8.7144 {"}'S' sky -12.4072 -0.1855 -9.5139 {"}'S' sky -11.2732 0.3969 -8.6387 {"}'S' sky -11.4348 0.378 -8.8433 {"}'S' sky -12.1939 -0.2591 -9.6465 {"}'S' sky -11.9642 -0.3412 -9.741 { HE2 PHE 4 A}'S' blue -11.1449 -0.344 -10.473 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 4 A}'S' sea -11.9554 0.4111 -6.9513 {"}'S' sea -11.6149 0.423 -6.9432 {"}'S' sea -11.7771 0.3995 -7.1457 {"}'S' sea -11.9407 0.3381 -7.34 {"}'S' sea -11.2488 0.3626 -6.8869 {"}'S' green -11.4064 0.3798 -7.0943 {"}'S' green -11.5682 0.3568 -7.2982 {"}'S' sea -11.0355 0.2761 -7.0148 {"}'S' green -11.1913 0.2975 -7.2225 {"}'S' green -11.353 0.2787 -7.4271 {"}'S' sea -10.8276 0.1505 -7.1258 {"}'S' green -10.9795 0.1791 -7.3296 { CE2 PHE 4 A}'S' sea -10.6227 0.1488 -7.8929 {"}'S' green -10.7403 0.2779 -8.0813 {"}'S' green -10.8757 0.3681 -8.2802 {"}'S' green -11.0236 0.4179 -8.4852 {"}'S' green -11.5006 0.3088 -9.0712 {"}'S' sea -11.9131 -0.3387 -9.8152 {"}'S' sea -10.4746 0.3027 -8.1341 {"}'S' green -10.6026 0.4057 -8.329 {"}'S' sea -10.745 0.4716 -8.5319 {"}'S' green -11.2154 0.4331 -9.1284 {"}'S' green -11.7991 -0.1273 -9.7265 {"}'S' sea -11.7482 -0.3315 -10.0187 {"}'S' green -11.0353 0.4592 -9.3171 {"}'S' sea -11.566 -0.3575 -10.2047 {"}'S' green -10.8566 0.4428 -9.5101 {"}'S' green -11.4494 -0.1427 -10.1132 {"}'S' sea -10.6473 0.4009 -9.6621 {"}'S' green -10.8085 0.3044 -9.8433 {"}'S' green -10.9635 0.173 -10.0064 {"}'S' green -11.1089 0.0098 -10.1491 {"}'S' green -11.2412 -0.1801 -10.2678 {"}'S' sea -10.7502 0.1007 -10.1393 {"}'S' sea -10.8957 -0.0624 -10.282 { CZ PHE 4 A}'S' sea -12.0416 0.3627 -7.5263 {"}'S' green -12.1896 0.4125 -7.7313 {"}'S' sea -12.3454 0.4181 -7.9354 {"}'S' green -11.7685 0.4003 -7.5751 {"}'S' green -11.911 0.4662 -7.778 {"}'S' green -12.0629 0.4933 -7.9816 {"}'S' green -12.2205 0.4802 -8.1821 {"}'S' green -11.7191 0.5049 -7.9553 {"}'S' green -11.8757 0.5279 -8.1626 {"}'S' green -12.0373 0.5105 -8.3675 {"}'S' green -11.1306 0.2393 -7.5482 {"}'S' green -11.6968 0.5223 -8.3594 {"}'S' sea -11.859 0.4988 -8.562 {"}'S' green -10.9227 0.1909 -7.7007 {"}'S' green -11.3307 0.4619 -8.3031 {"}'S' sea -11.4883 0.4791 -8.5105 {"}'S' sea -11.8132 0.3954 -8.9082 {"}'S' green -11.9744 0.2989 -9.0894 {"}'S' green -12.1295 0.1675 -9.2525 {"}'S' sea -12.2749 0.0044 -9.3952 {"}'S' green -11.1174 0.3754 -8.431 {"}'S' green -11.5983 0.3208 -9.0383 {"}'S' green -11.7604 0.2255 -9.2209 {"}'S' green -11.9162 0.0953 -9.3854 {"}'S' green -12.0616 -0.0679 -9.5281 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 4 A}'S' P -11.3727 0.3433 -9.3075 {"}'S' -11.3665 0.3293 -9.3045 {"}'S' P -11.5259 0.2179 -9.4694 {"}'S' -11.5 0.1752 -9.4551 {"}'S' P -11.6694 0.0593 -9.6107 {"}'S' -11.6468 0.0316 -9.5973 {"}'S' P -11.1964 0.3655 -9.4989 {"}'S' -11.1812 0.3229 -9.4854 {"}'S' P -11.3518 0.2357 -9.6646 {"}'S' -11.3183 0.1661 -9.6319 {"}'S' P -11.4981 0.0738 -9.8087 {"}'S' -11.4643 0.0235 -9.7767 {"}'S' P -11.6316 -0.1167 -9.9272 {"}'S' -11.6276 -0.1206 -9.9242 {"}'S' P -11.0175 0.3443 -9.6903 {"}'S' -11.0104 0.3142 -9.6772 {"}'S' P -11.1717 0.2128 -9.854 {"}'S' -11.1523 0.1592 -9.8222 {"}'S' P -11.3167 0.0491 -9.9961 {"}'S' -11.2989 0.0141 -9.9688 { CZ PHE 4 A}'S' P -11.438 0.3457 -7.5466 {"}'S' -11.4381 0.3426 -7.5478 {"}'S' P -11.5723 0.4441 -7.7476 {"}'S' -11.5752 0.4236 -7.7537 {"}'S' P -11.2529 0.3639 -7.7422 {"}'S' -11.2653 0.3298 -7.753 {"}'S' P -11.3908 0.455 -7.9446 {"}'S' -11.4015 0.4106 -7.9524 {"}'S' P -11.5399 0.508 -8.1519 {"}'S' -11.5405 0.503 -8.1516 {"}'S' P -11.0449 0.3172 -7.8932 {"}'S' -11.052 0.3038 -7.8964 {"}'S' P -11.182 0.4081 -8.0962 {"}'S' -11.1906 0.3857 -8.0977 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 163 A}'S' blue -12.393 0.6401 -7.4222 {"}'S' sky -12.2332 0.6372 -7.2151 {"}'S' sky -12.0703 0.6739 -7.0145 {"}'S' sky -11.9067 0.7495 -6.8253 {"}'S' sky -12.5328 0.7097 -8.0513 {"}'S' sky -11.6031 0.7349 -6.8564 {"}'S' blue -12.455 0.7948 -8.4086 {"}'S' sky -12.2016 0.7431 -8.4948 {"}'S' sky -11.7322 0.8129 -8.7133 {"}'S' sky -11.3646 0.7902 -8.5901 { CD LYS 163 A}'S' blue -12.5797 0.6281 -9.0554 {"}'S' blue -12.4274 0.7537 -8.8929 {"}'S' blue -12.6103 0.3951 -9.4439 {"}'S' sky -12.4467 0.4707 -9.2547 {"}'S' sky -12.288 0.5826 -9.0804 {"}'S' sky -12.1364 0.7291 -8.9253 {"}'S' blue -11.8426 0.752 -8.9802 { HB2 LYS 163 A}'S' sky -11.5384 0.7043 -6.8977 {"}'S' blue -11.1414 0.7057 -6.7535 {"}'S' sky -10.9188 0.6054 -6.8467 {"}'S' sky -10.769 0.4749 -7.0497 {"}'S' blue -10.6295 0.6356 -6.9128 {"}'S' sky -10.6624 0.3818 -7.3167 {"}'S' blue -10.5123 0.5177 -7.1614 {"}'S' blue -10.5003 0.4042 -7.5242 {"}'S' sky -10.4007 0.4592 -7.7783 {"}'S' blue -10.2435 0.5776 -7.6075 {"}'S' sky -10.7201 0.795 -8.5922 {"}'S' sky -10.3241 0.5779 -8.0184 {"}'S' blue -10.1679 0.6733 -7.8439 {"}'S' blue -10.3293 0.7623 -8.3086 { HB3 LYS 163 A}'S' blue -12.859 0.6574 -7.7913 {"}'S' blue -12.7066 0.6324 -7.5875 {"}'S' blue -12.5472 0.6628 -7.3903 {"}'S' blue -12.6903 0.7202 -8.0006 {"}'S' sky -12.543 0.6772 -7.7981 { HD2 LYS 163 A}'S' sky -12.4336 0.236 -9.5659 {"}'S' sky -12.3404 0.0612 -9.7643 {"}'S' sky -11.6327 0.6804 -9.0221 {"}'S' sky -12.1186 -0.0669 -9.8523 @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 163 A}'S' sea -12.3953 0.6196 -7.8478 {"}'S' sea 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-0.1119 -9.9702 {"}'S' P -11.3951 -0.0375 -9.7878 {"}'S' -11.4175 0.0261 -9.8091 {"}'S' P -11.2449 0.0983 -9.6324 {"}'S' -11.2828 0.1646 -9.6685 {"}'S' P -11.1108 0.2783 -9.509 {"}'S' -11.1406 0.31 -9.5364 {"}'S' P -11.233 -0.0151 -9.9952 {"}'S' -11.2508 0.0191 -9.9999 {"}'S' P -11.0826 0.1163 -9.8367 {"}'S' -11.1158 0.1592 -9.8508 {"}'S' P -10.9498 0.2953 -9.7148 {"}'S' -10.9662 0.3092 -9.7234 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 4 A}'M' greentint -9.071 2.5404 -6.106 {"}'M' greentint -9.2196 2.3835 -6.2545 {"}'M' greentint -9.3233 2.2872 -6.552 {"}'M' greentint -8.9217 2.7706 -6.1682 {"}'M' greentint -9.0803 2.6774 -6.3466 {"}'M' greentint -9.2195 2.5094 -6.4797 {"}'M' greentint -9.2929 2.3812 -6.7968 {"}'M' greentint -9.364 2.1361 -6.821 {"}'M' greentint -8.7347 2.9597 -6.236 {"}'M' greentint -8.8949 2.9014 -6.428 {"}'M' greentint -9.0497 2.7784 -6.5927 {"}'M' greentint -9.1854 2.6008 -6.7189 {"}'M' greentint -9.215 2.4614 -7.035 {"}'M' greentint -9.2962 2.2182 -7.0734 {"}'M' greentint -8.6516 3.0791 -6.4794 {"}'M' greentint -8.8141 2.9975 -6.6658 {"}'M' greentint -8.9663 2.8615 -6.8258 {"}'M' greentint -9.1029 2.68 -6.9506 {"}'M' greentint -9.1005 2.5061 -7.2647 {"}'M' greentint -8.5571 3.1425 -6.7391 {"}'M' greentint -8.713 3.0437 -6.9124 {"}'M' greentint -8.8591 2.9002 -7.0623 {"}'M' greentint -8.9899 2.7182 -7.1807 {"}'M' greentint -8.5572 3.0711 -7.1177 {"}'M' greentint -8.7039 2.9239 -7.2674 {"}'M' greentint -8.836 2.741 -7.3874 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 163 A}'M' greentint -9.2359 2.2266 -6.1846 {"}'M' greentint -9.0946 2.3773 -6.043 {"}'M' greentint -9.2801 2.0893 -6.6324 {"}'M' greentint -9.1219 2.153 -6.4461 {"}'M' greentint -8.9717 2.2775 -6.2862 {"}'M' greentint -8.8385 2.4531 -6.1632 {"}'M' greentint -8.7333 2.6677 -6.0854 {"}'M' greentint -8.6598 2.9075 -6.0585 {"}'M' greentint -9.2295 2.1483 -6.9834 {"}'M' greentint -9.0713 2.1505 -6.7797 {"}'M' greentint -8.9107 2.2265 -6.5928 {"}'M' greentint -8.7611 2.3719 -6.4404 {"}'M' greentint -8.6366 2.5718 -6.3346 {"}'M' greentint -8.548 2.8094 -6.2865 {"}'M' greentint -8.5035 3.0642 -6.2992 {"}'M' greentint -9.1264 2.311 -7.2385 {"}'M' greentint -8.9776 2.2614 -7.0324 {"}'M' greentint -8.8153 2.3063 -6.8344 {"}'M' greentint -8.6611 2.4389 -6.6727 {"}'M' greentint -8.5368 2.6422 -6.5681 {"}'M' greentint -8.4585 2.8879 -6.5359 {"}'M' greentint -8.4376 3.1433 -6.5792 {"}'M' greentint -8.8666 2.4448 -7.2028 {"}'M' greentint -8.7056 2.4729 -7.0028 {"}'M' greentint -8.5576 2.6248 -6.8539 {"}'M' greentint -8.4628 2.859 -6.7966 {"}'M' greentint -8.4465 3.1127 -6.8459 {"}'M' greentint -8.7331 2.6627 -7.2563 {"}'M' greentint -8.5732 2.7596 -7.0769 {"}'M' greentint -8.5182 3.0129 -7.0767 {"}'M' greentint -8.6515 2.9092 -7.2762 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 4 A}'M' greentint -9.7121 1.1692 -4.4068 {"}'M' greentint -9.8454 1.0656 -4.6063 {"}'M' greentint -9.5262 1.2606 -4.2488 {"}'M' greentint -9.6304 1.4158 -4.4267 {"}'M' greentint -9.7904 1.3189 -4.6061 {"}'M' greentint -9.9008 1.2195 -4.8864 {"}'M' greentint -9.9171 0.9658 -4.8371 {"}'M' greentint -9.3652 1.5319 -4.282 {"}'M' greentint -9.4969 1.6336 -4.4802 {"}'M' greentint -9.6579 1.6056 -4.6802 {"}'M' greentint -9.806 1.4536 -4.829 {"}'M' greentint -9.8725 1.3169 -5.14 {"}'M' greentint -9.9229 1.0623 -5.1354 {"}'M' greentint -9.3085 1.8035 -4.5468 {"}'M' greentint -9.4674 1.8067 -4.7527 {"}'M' greentint -9.6277 1.7156 -4.9356 {"}'M' greentint -9.7691 1.5451 -5.0712 {"}'M' greentint -9.7757 1.3912 -5.38 {"}'M' greentint -9.8439 1.1422 -5.3977 {"}'M' greentint -9.2117 1.9382 -4.8023 {"}'M' greentint -9.373 1.899 -5.0002 {"}'M' greentint -9.5296 1.787 -5.1716 {"}'M' greentint -9.6682 1.6123 -5.3023 {"}'M' greentint -9.3919 1.801 -5.3967 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LYS 163 A}'M' green -9.2633 1.6308 -4.2917 @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 163 A}'M' greentint -9.7875 0.9233 -4.7716 {"}'M' greentint -9.6297 1.0335 -4.5982 {"}'M' greentint -9.4843 1.1953 -4.4552 {"}'M' greentint -9.3597 1.3977 -4.3516 {"}'M' greentint -9.8758 1.003 -5.2249 {"}'M' greentint -9.7166 1.0254 -5.0244 {"}'M' greentint -9.5569 1.114 -4.8434 {"}'M' greentint -9.4102 1.2636 -4.6958 {"}'M' greentint -9.2864 1.4634 -4.5911 {"}'M' greentint -9.1946 1.6975 -4.5378 {"}'M' greentint -9.7571 1.1849 -5.3794 {"}'M' greentint -9.5983 1.1959 -5.1785 {"}'M' greentint -9.4413 1.2918 -5.0011 {"}'M' greentint -9.3028 1.4624 -4.8696 {"}'M' greentint -9.1999 1.6859 -4.7987 {"}'M' greentint -9.1455 1.9356 -4.7984 {"}'M' greentint -9.6228 1.3928 -5.4551 {"}'M' greentint -9.4597 1.422 -5.2525 {"}'M' greentint -9.3099 1.5757 -5.1017 {"}'M' greentint -9.2146 1.812 -5.0442 {"}'M' greentint -9.5102 1.6226 -5.4903 {"}'M' greentint -9.3515 1.7199 -5.3127 @subgroup {mainchain} @vectorlist {mc} color= green 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{"}'S' blue -12.415 -0.1935 -7.1356 {"}'S' blue -11.8202 -0.1092 -6.7809 {"}'S' blue -11.9721 -0.082 -6.9845 {"}'S' sky -12.1297 -0.0951 -7.185 {"}'S' blue -12.2906 -0.1477 -7.3775 {"}'S' blue -11.6283 -0.0704 -6.9582 {"}'S' sky -11.7849 -0.0474 -7.1655 {"}'S' sky -11.9465 -0.0649 -7.3704 {"}'S' blue -12.1104 -0.1216 -7.5661 {"}'S' blue -11.3 -0.1204 -6.9475 {"}'S' sky -11.4491 -0.0674 -7.1548 {"}'S' sky -11.606 -0.053 -7.3623 {"}'S' sky -11.7682 -0.0765 -7.5649 {"}'S' blue -11.0912 -0.1673 -7.0992 {"}'S' sky -11.2399 -0.1135 -7.3061 {"}'S' sky -11.3975 -0.0962 -7.5135 {"}'S' blue -11.0266 -0.1999 -7.434 { CE2 PHE 104 A}'S' blue -10.6687 -0.1303 -7.9296 {"}'S' sky -10.7676 0.0353 -8.1043 {"}'S' sky -11.0297 0.2426 -8.4996 {"}'S' blue -11.1827 0.2768 -8.708 {"}'S' sky -10.5251 0.109 -8.1691 {"}'S' sky -10.7781 0.3283 -8.5563 {"}'S' blue -10.926 0.3781 -8.7613 {"}'S' blue -10.377 0.2629 -8.4102 {"}'S' blue -10.505 0.3659 -8.6052 {"}'S' blue -10.6474 0.4318 -8.8081 {"}'S' blue -10.957 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-6.5023 {"}'M' greentint -9.0794 2.6636 -6.6943 {"}'M' greentint -9.2342 2.5405 -6.8589 {"}'M' greentint -9.37 2.363 -6.9851 {"}'M' greentint -9.3995 2.2235 -7.3013 {"}'M' greentint -8.676 2.8652 -6.5443 {"}'M' greentint -8.8365 2.8418 -6.7464 {"}'M' greentint -8.9986 2.7596 -6.932 {"}'M' greentint -9.1508 2.6237 -7.092 {"}'M' greentint -9.2875 2.4421 -7.2168 {"}'M' greentint -9.285 2.2683 -7.531 {"}'M' greentint -8.7417 2.9047 -7.0054 {"}'M' greentint -8.8975 2.8059 -7.1787 {"}'M' greentint -9.0436 2.6623 -7.3286 {"}'M' greentint -9.1744 2.4803 -7.447 {"}'M' greentint -8.7418 2.8332 -7.3839 {"}'M' greentint -8.8884 2.6861 -7.5337 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 41 A}'M' greentint -9.3952 2.0637 -6.4233 {"}'M' greentint -9.2539 2.2145 -6.2817 {"}'M' greentint -9.4395 1.9265 -6.8711 {"}'M' greentint -9.2813 1.9902 -6.6848 {"}'M' greentint -9.131 2.1146 -6.525 {"}'M' greentint -8.9979 2.2902 -6.4019 {"}'M' greentint -8.8927 2.5049 -6.3242 {"}'M' greentint -9.3889 1.9855 -7.2222 {"}'M' greentint -9.2307 1.9877 -7.0184 {"}'M' greentint -9.07 2.0637 -6.8316 {"}'M' greentint -8.9205 2.209 -6.6792 {"}'M' greentint -8.7959 2.409 -6.5733 {"}'M' greentint -8.7073 2.6466 -6.5253 {"}'M' greentint -9.2858 2.1481 -7.4772 {"}'M' greentint -9.137 2.0985 -7.2711 {"}'M' greentint -8.9747 2.1434 -7.0731 {"}'M' greentint -8.8204 2.276 -6.9114 {"}'M' greentint -8.6962 2.4794 -6.8068 {"}'M' greentint -8.6179 2.725 -6.7747 {"}'M' greentint -9.026 2.282 -7.4415 {"}'M' greentint -8.865 2.31 -7.2416 {"}'M' greentint -8.717 2.462 -7.0927 {"}'M' greentint -8.6222 2.6961 -7.0354 {"}'M' greentint -8.6059 2.9498 -7.0847 {"}'M' greentint -8.8925 2.4998 -7.4951 {"}'M' greentint -8.7325 2.5967 -7.3156 {"}'M' greentint -8.6776 2.85 -7.3154 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 104 A}'M' green -9.272 1.7298 -4.7791 {"}'M' green -9.4522 1.5926 -5.3735 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 104 A}'M' greentint -9.7724 0.9608 -4.3836 {"}'M' greentint -9.9057 0.8572 -4.5831 {"}'M' greentint -9.6908 1.2074 -4.4034 {"}'M' greentint -9.8507 1.1105 -4.5829 {"}'M' greentint -9.9611 1.0111 -4.8631 {"}'M' greentint -9.9774 0.7574 -4.8138 {"}'M' greentint -9.5573 1.4252 -4.457 {"}'M' greentint -9.7183 1.3972 -4.6569 {"}'M' greentint -9.8663 1.2452 -4.8058 {"}'M' greentint -9.9328 1.1086 -5.1167 {"}'M' greentint -9.9832 0.8539 -5.1121 {"}'M' greentint -9.3688 1.5951 -4.5236 {"}'M' greentint -9.5277 1.5983 -4.7295 {"}'M' greentint -9.688 1.5072 -4.9124 {"}'M' greentint -9.8294 1.3367 -5.0479 {"}'M' greentint -9.836 1.1828 -5.3568 {"}'M' greentint -9.4333 1.6906 -4.977 {"}'M' greentint -9.5899 1.5786 -5.1484 {"}'M' greentint -9.7285 1.4039 -5.2791 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 41 A}'M' green -9.8688 0.8374 -4.4 {"}'M' green -9.7285 0.9994 -4.264 {"}'M' green -9.3889 1.4843 -4.3241 {"}'M' green -10.0015 0.8565 -5.2573 {"}'M' green -9.8828 1.0385 -5.4117 {"}'M' green -9.2711 1.7891 -4.8308 {"}'M' green -9.7485 1.2463 -5.4875 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 41 A}'M' greentint -9.9132 0.7768 -4.804 {"}'M' greentint -9.7554 0.8871 -4.6305 {"}'M' greentint -9.61 1.0488 -4.4876 {"}'M' greentint -9.4854 1.2512 -4.384 {"}'M' greentint -9.8423 0.879 -5.0568 {"}'M' greentint -9.6825 0.9676 -4.8758 {"}'M' greentint -9.5358 1.1172 -4.7282 {"}'M' greentint -9.4121 1.3169 -4.6235 {"}'M' greentint -9.3203 1.5511 -4.5702 {"}'M' greentint -9.724 1.0495 -5.2109 {"}'M' greentint -9.567 1.1454 -5.0335 {"}'M' greentint -9.4285 1.3159 -4.902 {"}'M' greentint -9.3256 1.5394 -4.8311 {"}'M' greentint -9.5854 1.2755 -5.2849 {"}'M' greentint -9.4356 1.4293 -5.1341 {"}'M' greentint -9.3403 1.6656 -5.0766 {"}'M' greentint -9.4772 1.5735 -5.3451 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 53 1vjjA_73F_55F}P -6.13 6.9564 -10.6697 {"}-6.13 6.9564 -10.6697 { ca leu A 53 1vjjA_73F_55F}-7.4691 6.776 -10.1296 { c leu A 53 1vjjA_73F_55F}-7.467 5.5999 -9.1593 { o leu A 53 1vjjA_73F_55F}-6.8856 4.5513 -9.443 { c leu A 53 1vjjA_73F_55F}P -7.467 5.5999 -9.1593 { n glu A 54 1vjjA_73F_55F}-8.1163 5.7858 -8.0147 { ca glu A 54 1vjjA_73F_55F}-8.2104 4.7496 -6.9892 { c glu A 54 1vjjA_73F_55F}-9.6696 4.5405 -6.6272 { o glu A 54 1vjjA_73F_55F}-10.3149 5.4478 -6.103 { c glu A 54 1vjjA_73F_55F}P -9.6696 4.5405 -6.6272 { n phe A 55 1vjjA_73F_55F}-10.1952 3.3548 -6.9143 { ca phe A 55 1vjjA_73F_55F}-11.5801 3.0622 -6.5786 { c phe A 55 1vjjA_73F_55F}-11.6378 2.6626 -5.112 { o phe A 55 1vjjA_73F_55F}-10.7046 2.0655 -4.5854 { c phe A 55 1vjjA_73F_55F}P -11.6378 2.6626 -5.112 { n ile A 56 1vjjA_73F_55F}-12.7336 3.0116 -4.4526 { ca ile A 56 1vjjA_73F_55F}-12.9117 2.691 -3.0438 { c ile A 56 1vjjA_73F_55F}-14.2867 2.0892 -2.8343 { o ile A 56 1vjjA_73F_55F}-15.2927 2.7547 -3.0743 { c ile A 56 1vjjA_73F_55F}P -14.2867 2.0892 -2.8343 { n val A 57 1vjjA_73F_55F}-14.3307 0.8349 -2.3928 { ca val A 57 1vjjA_73F_55F}-15.6036 0.1816 -2.1241 { c val A 57 1vjjA_73F_55F}-15.6757 -0.1252 -0.6334 { o val A 57 1vjjA_73F_55F}-14.6592 -0.4265 0.0009 { n ala A 71 1vjjA_73F_55F}P -12.2267 -1.7527 0.4259 {"}-12.2267 -1.7527 0.4259 { ca ala A 71 1vjjA_73F_55F}-11.1444 -2.0858 -0.483 { c ala A 71 1vjjA_73F_55F}-10.7762 -0.8638 -1.3095 { o ala A 71 1vjjA_73F_55F}-11.6511 -0.1706 -1.8212 { c ala A 71 1vjjA_73F_55F}P -10.7762 -0.8638 -1.3095 { n val A 72 1vjjA_73F_55F}-9.4784 -0.6014 -1.4173 { ca val A 72 1vjjA_73F_55F}-8.9803 0.5243 -2.1965 { c val A 72 1vjjA_73F_55F}-8.0915 -0.0899 -3.2663 { o val A 72 1vjjA_73F_55F}-7.1246 -0.7773 -2.9499 { c val A 72 1vjjA_73F_55F}P -8.0915 -0.0899 -3.2663 { n phe A 73 1vjjA_73F_55F}-8.4276 0.1382 -4.5314 { ca phe A 73 1vjjA_73F_55F}-7.6539 -0.4315 -5.6269 { c phe A 73 1vjjA_73F_55F}-7.4875 0.5355 -6.7942 { o phe A 73 1vjjA_73F_55F}-8.4187 1.2571 -7.1568 { c phe A 73 1vjjA_73F_55F}P -7.4875 0.5355 -6.7942 { n pro A 74 1vjjA_73F_55F}-6.2905 0.5538 -7.4027 { ca pro A 74 1vjjA_73F_55F}-5.9739 1.4294 -8.5318 { c pro A 74 1vjjA_73F_55F}-6.4 0.9036 -9.8913 { o pro A 74 1vjjA_73F_55F}-6.4829 -0.3064 -10.1094 { c pro A 74 1vjjA_73F_55F}P -6.4 0.9036 -9.8913 { n leu A 75 1vjjA_73F_55F}-6.6659 1.8343 -10.8021 { ca leu A 75 1vjjA_73F_55F}-7.0472 1.4931 -12.1647 { c leu A 75 1vjjA_73F_55F}-5.7436 1.0635 -12.826 { o leu A 75 1vjjA_73F_55F}-4.7712 1.8123 -12.8179 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 53 1vjjA_73F_55F}P -6.13 6.9564 -10.6697 { ca leu A 53 1vjjA_73F_55F}P -7.4691 6.776 -10.1296 { n glu A 54 1vjjA_73F_55F}P -8.1163 5.7858 -8.0147 { ca glu A 54 1vjjA_73F_55F}P -8.2104 4.7496 -6.9892 { n phe A 55 1vjjA_73F_55F}P -10.1952 3.3548 -6.9143 { ca phe A 55 1vjjA_73F_55F}P -11.5801 3.0622 -6.5786 { n ile A 56 1vjjA_73F_55F}P -12.7336 3.0116 -4.4526 { ca ile A 56 1vjjA_73F_55F}P -12.9117 2.691 -3.0438 { n val A 57 1vjjA_73F_55F}P -14.3307 0.8349 -2.3928 { ca val A 57 1vjjA_73F_55F}P -15.6036 0.1816 -2.1241 { n ala A 71 1vjjA_73F_55F}P -12.2267 -1.7527 0.4259 { ca ala A 71 1vjjA_73F_55F}P -11.1444 -2.0858 -0.483 { n val A 72 1vjjA_73F_55F}P -9.4784 -0.6014 -1.4173 { ca val A 72 1vjjA_73F_55F}P -8.9803 0.5243 -2.1965 { n phe A 73 1vjjA_73F_55F}P -8.4276 0.1382 -4.5314 { ca phe A 73 1vjjA_73F_55F}P -7.6539 -0.4315 -5.6269 { ca pro A 74 1vjjA_73F_55F}P -5.9739 1.4294 -8.5318 { n leu A 75 1vjjA_73F_55F}P -6.6659 1.8343 -10.8021 { ca leu A 75 1vjjA_73F_55F}P -7.0472 1.4931 -12.1647 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 53 1vjjA_73F_55F}P -7.4691 6.776 -10.1296 {"}-7.4691 6.776 -10.1296 { ca glu A 54 1vjjA_73F_55F}-8.2104 4.7496 -6.9892 { ca phe A 55 1vjjA_73F_55F}-11.5801 3.0622 -6.5786 { ca ile A 56 1vjjA_73F_55F}-12.9117 2.691 -3.0438 { ca val A 57 1vjjA_73F_55F}-15.6036 0.1816 -2.1241 { ca ala A 71 1vjjA_73F_55F}P -11.1444 -2.0858 -0.483 {"}-11.1444 -2.0858 -0.483 { ca val A 72 1vjjA_73F_55F}-8.9803 0.5243 -2.1965 { ca phe A 73 1vjjA_73F_55F}-7.6539 -0.4315 -5.6269 { ca pro A 74 1vjjA_73F_55F}-5.9739 1.4294 -8.5318 { ca leu A 75 1vjjA_73F_55F}-7.0472 1.4931 -12.1647 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 55 1vjjA_73F_55F}P -11.5801 3.0622 -6.5786 { cb phe A 55 1vjjA_73F_55F}-12.1354 1.9292 -7.4566 { cg phe A 55 1vjjA_73F_55F}-12.36 2.329 -8.8853 { cd1 phe A 55 1vjjA_73F_55F}-11.3176 2.3018 -9.8041 { ce1 phe A 55 1vjjA_73F_55F}-11.5107 2.7164 -11.1195 { cz phe A 55 1vjjA_73F_55F}-12.7535 3.1645 -11.5294 { cg phe A 55 1vjjA_73F_55F}P -12.36 2.329 -8.8853 { cd2 phe A 55 1vjjA_73F_55F}-13.6058 2.7765 -9.3026 { ce2 phe A 55 1vjjA_73F_55F}-13.8094 3.1967 -10.62 { cz phe A 55 1vjjA_73F_55F}ghost -12.7535 3.1645 -11.5294 { ca phe A 73 1vjjA_73F_55F}P -7.6539 -0.4315 -5.6269 { cb phe A 73 1vjjA_73F_55F}-8.3011 -1.7421 -6.1099 { cg phe A 73 1vjjA_73F_55F}-9.7907 -1.6469 -6.3407 { cd1 phe A 73 1vjjA_73F_55F}-10.674 -1.5359 -5.2664 { ce1 phe A 73 1vjjA_73F_55F}-12.0576 -1.4602 -5.4778 { cz phe A 73 1vjjA_73F_55F}-12.5645 -1.4949 -6.7763 { cg phe A 73 1vjjA_73F_55F}P -9.7907 -1.6469 -6.3407 { cd2 phe A 73 1vjjA_73F_55F}-10.311 -1.6808 -7.6337 { ce2 phe A 73 1vjjA_73F_55F}-11.6887 -1.6058 -7.8592 { cz phe A 73 1vjjA_73F_55F}ghost -12.5645 -1.4949 -6.7763 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 55 1vjjA_73F_55F}P -12.1354 1.9292 -7.4566 {"}P -12.1354 1.9292 -7.4566 { cd1 phe A 55 1vjjA_73F_55F}P -11.3176 2.3018 -9.8041 { cd2 phe A 55 1vjjA_73F_55F}P -13.6058 2.7765 -9.3026 { ce1 phe A 55 1vjjA_73F_55F}P -11.5107 2.7164 -11.1195 { ce2 phe A 55 1vjjA_73F_55F}P -13.8094 3.1967 -10.62 { cz phe A 55 1vjjA_73F_55F}P -12.7535 3.1645 -11.5294 { cb phe A 73 1vjjA_73F_55F}P -8.3011 -1.7421 -6.1099 {"}P -8.3011 -1.7421 -6.1099 { cd1 phe A 73 1vjjA_73F_55F}P -10.674 -1.5359 -5.2664 { cd2 phe A 73 1vjjA_73F_55F}P -10.311 -1.6808 -7.6337 { ce1 phe A 73 1vjjA_73F_55F}P -12.0576 -1.4602 -5.4778 { ce2 phe A 73 1vjjA_73F_55F}P -11.6887 -1.6058 -7.8592 { cz phe A 73 1vjjA_73F_55F}P -12.5645 -1.4949 -6.7763 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 73 A}'S' blue -10.7958 -0.1839 -6.8675 {"}'S' blue -10.5441 -0.0982 -6.9243 {"}'S' sky -10.4135 0.0052 -7.176 {"}'S' sky -10.3783 0.067 -7.5606 { CE1 PHE 73 A}'S' blue -12.0623 0.1551 -6.1503 {"}'S' blue -11.8474 0.0804 -6.2804 {"}'S' blue -11.468 0.0263 -6.1887 {"}'S' blue -11.628 -0.025 -6.382 {"}'S' blue -11.3957 -0.1543 -6.4365 { CE2 PHE 73 A}'S' blue -12.5468 -0.0825 -7.9408 {"}'S' blue -12.4189 -0.048 -8.1771 {"}'S' blue -12.2426 -0.0259 -8.3685 { CZ PHE 73 A}'S' blue -13.1015 0.1431 -6.476 {"}'S' blue -13.2619 0.1069 -6.6733 {"}'S' blue -13.4226 0.0284 -6.8579 {"}'S' blue -12.667 0.1912 -6.3186 {"}'S' sky -12.8189 0.2183 -6.5222 {"}'S' sky -13.1374 0.1527 -6.9152 {"}'S' blue -13.2947 0.0629 -7.0942 {"}'S' blue -12.3284 0.1691 -6.2882 {"}'S' sky -13.1184 0.0851 -7.2856 {"}'S' sky -12.1469 0.18 -6.4852 {"}'S' sky -12.9395 0.0639 -7.4771 {"}'S' sky -11.801 0.0422 -6.4338 {"}'S' sky -12.7305 0.024 -7.63 {"}'S' sky -11.591 -0.0567 -6.5634 {"}'S' sky -12.5164 -0.0495 -7.7615 {"}'S' sky -11.3952 -0.1957 -6.6862 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 73 A}'S' sea -10.9488 -0.1497 -7.0759 {"}'S' sea -10.6921 -0.0484 -7.1293 {"}'S' green -10.848 -0.0428 -7.3334 {"}'S' sea -10.5654 0.0324 -7.3796 {"}'S' green -10.7231 0.0193 -7.5801 {"}'S' green -10.8839 -0.0333 -7.7725 {"}'S' sea -10.5398 0.0495 -7.7655 {"}'S' sea -10.7037 -0.0072 -7.9612 { CE2 PHE 73 A}'S' sea -12.3861 -0.004 -7.7562 {"}'S' green -11.5208 -0.0886 -7.0037 {"}'S' green -12.1008 0.0943 -7.8056 {"}'S' sea -12.2616 0.0417 -7.9981 {"}'S' sea -11.1995 -0.1739 -6.9791 {"}'S' green -11.9176 0.1245 -7.991 {"}'S' green -11.7392 0.1129 -8.1855 {"}'S' green -11.3686 0.0932 -8.1341 {"}'S' sea -11.5303 0.0702 -8.3379 {"}'S' sea -10.9976 -0.0105 -8.0545 {"}'S' sea -11.1535 0.0109 -8.2622 { CZ PHE 73 A}'S' sea -12.9766 0.2052 -6.7227 {"}'S' sea -12.4752 0.2299 -6.4959 {"}'S' sea -12.6318 0.2529 -6.7032 {"}'S' green -12.7934 0.2355 -6.9081 {"}'S' sea -12.9573 0.1788 -7.1038 {"}'S' green -12.296 0.233 -6.6925 {"}'S' green -12.4529 0.2473 -6.9 {"}'S' green -12.615 0.2238 -7.1026 {"}'S' green -12.7786 0.1624 -7.2968 {"}'S' sea -11.9381 0.1331 -6.6368 {"}'S' green -12.0867 0.1869 -6.8437 {"}'S' green -12.2444 0.2041 -7.0512 {"}'S' green -12.4061 0.1811 -7.255 {"}'S' green -12.5693 0.1205 -7.4488 {"}'S' green -11.7258 0.0409 -6.7648 {"}'S' green -12.1909 0.103 -7.3839 {"}'S' sea -12.3544 0.0458 -7.5789 {"}'S' green -11.5244 -0.092 -6.8813 {"}'S' green -11.6655 -0.0252 -7.0826 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 73 A}'S' P -11.6488 0.0144 -7.1986 {"}'S' -11.6504 -0.0129 -7.2099 {"}'S' P -11.7912 0.0802 -7.4015 {"}'S' -11.7888 0.0279 -7.4153 {"}'S' P -11.9431 0.1074 -7.6051 {"}'S' -11.9397 0.0785 -7.6091 {"}'S' P -11.3182 -0.0402 -7.1701 {"}'S' -11.3197 -0.0471 -7.1723 {"}'S' P -11.4526 0.0582 -7.3711 {"}'S' -11.4627 -0.0115 -7.3912 {"}'S' P -11.5994 0.119 -7.5788 {"}'S' -11.6043 0.0288 -7.5922 {"}'S' P -11.756 0.142 -7.7861 {"}'S' -11.7539 0.0838 -7.7888 {"}'S' P -11.1332 -0.022 -7.3656 {"}'S' -11.1377 -0.0326 -7.3694 {"}'S' P -11.2711 0.069 -7.5681 {"}'S' -11.2866 0.004 -7.5795 {"}'S' P -11.4202 0.122 -7.7754 {"}'S' -11.4313 0.0476 -7.7787 {"}'S' P -11.5771 0.1364 -7.9829 {"}'S' -11.5797 0.1037 -7.9808 {"}'S' P -11.0623 0.0222 -7.7197 {"}'S' -11.0645 0.0171 -7.7199 {"}'S' P -11.2109 0.0759 -7.9266 {"}'S' -11.215 0.0639 -7.926 { CZ PHE 73 A}'S' P -11.8734 0.1004 -6.9716 {"}'S' -11.8735 0.099 -6.9714 {"}'S' P -12.0293 0.1219 -7.1793 {"}'S' -12.0319 0.115 -7.1779 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 55 A}'S' sky -12.5603 0.4957 -6.5464 {"}'S' blue -12.4017 0.5861 -6.3674 {"}'S' blue -12.11 0.5405 -6.3924 {"}'S' sky -11.9651 0.4141 -6.5978 {"}'S' sky -12.5576 0.2568 -7.7545 {"}'S' sky -12.4368 0.3067 -8.04 {"}'S' sky -11.9672 0.3833 -8.2598 { HB2 PHE 55 A}'S' blue -11.7788 0.4689 -6.4923 {"}'S' blue -11.5392 0.3528 -6.5178 {"}'S' blue -11.3166 0.2525 -6.611 {"}'S' sky -10.9101 0.1647 -6.9257 {"}'S' blue -10.5023 0.4016 -7.2409 {"}'S' sky -10.5658 0.3204 -7.6082 { HB3 PHE 55 A}'S' blue -13.4328 0.4968 -6.7464 {"}'S' blue -13.2734 0.5273 -6.5492 {"}'S' sky -13.2831 0.4268 -6.9649 {"}'S' sky -13.1276 0.4388 -6.767 {"}'S' sky -12.9689 0.5033 -6.5803 {"}'S' blue -12.816 0.6193 -6.4149 {"}'S' sky -13.1791 0.435 -7.2638 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 55 A}'S' sea -12.7198 0.4438 -6.739 {"}'S' sea -12.9069 0.3606 -7.3721 {"}'S' green -12.755 0.3193 -7.1636 {"}'S' green -12.5952 0.3163 -6.9565 {"}'S' green -12.4323 0.3531 -6.7559 {"}'S' sea -12.2687 0.4287 -6.5667 {"}'S' sea -12.7573 0.2988 -7.5892 {"}'S' green -12.6082 0.2458 -7.3819 {"}'S' green -12.4505 0.2313 -7.175 {"}'S' green -12.2883 0.2548 -6.9725 {"}'S' green -12.1255 0.3164 -6.7777 {"}'S' green -12.409 0.203 -7.5476 {"}'S' green -12.2517 0.1867 -7.3392 {"}'S' sea -12.2948 0.2283 -7.8347 {"}'S' sea -12.179 0.3117 -8.1228 { HB2 PHE 55 A}'S' sea -11.9363 0.3514 -6.6621 {"}'S' green -12.1528 0.1706 -7.2602 {"}'S' green -11.8482 0.1455 -6.8586 {"}'S' sea -11.69 0.2223 -6.6753 {"}'S' green -12.0731 0.1067 -7.5484 {"}'S' green -11.6244 0.0299 -6.9484 {"}'S' sea -11.4659 0.1165 -6.767 {"}'S' green -12.0208 0.2061 -7.9406 {"}'S' green -11.3198 0.0059 -6.9795 {"}'S' green -11.7827 0.1508 -8.0485 {"}'S' sea -11.0602 0.0289 -7.0811 {"}'S' sea -11.5924 0.2541 -8.2426 {"}'S' green -10.8982 0.0513 -7.2885 {"}'S' sea -10.7478 0.1827 -7.13 {"}'S' green -11.2525 0.1764 -8.1483 {"}'S' green -11.1176 0.0816 -7.9474 {"}'S' green -10.9619 0.0573 -7.7392 {"}'S' green -10.7986 0.1063 -7.5426 {"}'S' sea -10.6414 0.2247 -7.3718 {"}'S' sea -10.7219 0.225 -7.7828 { HB3 PHE 55 A}'S' sea -13.0267 0.41 -7.0601 {"}'S' sea -12.8673 0.4405 -6.8629 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 PHE 55 A}'S' P -12.0056 0.1276 -7.0576 {"}'S' -12.0034 0.1323 -7.0592 {"}'S' P -11.9357 0.0252 -7.3489 {"}'S' -11.9309 0.0357 -7.3498 {"}'S' P -11.7838 -0.0005 -7.1456 {"}'S' -11.7802 0.0104 -7.1483 {"}'S' P -11.912 0.0655 -7.7615 {"}'S' -11.8999 0.092 -7.7527 {"}'S' P -11.7813 -0.0289 -7.5664 {"}'S' -11.7605 0.0392 -7.5569 {"}'S' P -11.634 -0.0706 -7.3641 {"}'S' -11.6233 -0.0033 -7.3682 {"}'S' P -11.4785 -0.0586 -7.1662 {"}'S' -11.4775 -0.0387 -7.1712 {"}'S' P -11.6666 0.019 -7.8631 {"}'S' -11.6548 0.0757 -7.8394 {"}'S' P -11.53 -0.0623 -7.663 {"}'S' -11.5225 0.0288 -7.6445 {"}'S' P -11.3776 -0.0873 -7.4593 {"}'S' -11.3812 -0.0127 -7.4574 {"}'S' P -11.2182 -0.0569 -7.2621 {"}'S' -11.2216 -0.0449 -7.2642 {"}'S' P -11.4898 0.1013 -8.0675 {"}'S' -11.4894 0.1095 -8.062 {"}'S' P -11.3614 0.0005 -7.8724 {"}'S' -11.3649 0.0521 -7.8514 {"}'S' P -11.2141 -0.0425 -7.6698 {"}'S' -11.224 0.0081 -7.659 {"}'S' P -11.0559 -0.0247 -7.4713 {"}'S' -11.0567 -0.0232 -7.471 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 73 A}'M' greentint -9.7444 1.6841 -7.0156 {"}'M' greentint -9.3429 2.1676 -6.6318 {"}'M' greentint -9.5015 2.0744 -6.8102 {"}'M' greentint -9.6407 1.9064 -6.9434 {"}'M' greentint -9.714 1.7782 -7.2604 {"}'M' greentint -9.1559 2.3567 -6.6997 {"}'M' greentint -9.3161 2.2984 -6.8916 {"}'M' greentint -9.4709 2.1754 -7.0563 {"}'M' greentint -9.6066 1.9978 -7.1825 {"}'M' greentint -9.6362 1.8584 -7.4986 {"}'M' greentint -9.0731 2.4767 -6.9438 {"}'M' greentint -9.2352 2.3945 -7.1294 {"}'M' greentint -9.3875 2.2585 -7.2894 {"}'M' greentint -9.5241 2.0769 -7.4142 {"}'M' greentint -9.5217 1.9031 -7.7283 {"}'M' greentint -8.8192 2.5906 -7.0105 {"}'M' greentint -8.9783 2.5395 -7.2027 {"}'M' greentint -9.1341 2.4407 -7.376 {"}'M' greentint -9.2803 2.2972 -7.5259 {"}'M' greentint -9.4111 2.1152 -7.6444 {"}'M' greentint -9.3707 1.9249 -7.9371 {"}'M' greentint -8.8215 2.5739 -7.4081 {"}'M' greentint -8.9784 2.468 -7.5813 {"}'M' greentint -9.1251 2.3209 -7.7311 {"}'M' greentint -9.2572 2.1379 -7.851 {"}'M' greentint -8.9501 2.3032 -7.9202 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 55 A}'M' greentint -9.6621 1.6608 -7.0465 {"}'M' greentint -9.5072 1.758 -6.874 {"}'M' greentint -9.3659 1.9088 -6.7324 {"}'M' greentint -9.2453 2.103 -6.6307 {"}'M' greentint -9.7058 1.6215 -7.5209 {"}'M' greentint -9.5515 1.6208 -7.3218 {"}'M' greentint -9.3933 1.6845 -7.1355 {"}'M' greentint -9.243 1.8089 -6.9757 {"}'M' greentint -9.1099 1.9845 -6.8526 {"}'M' greentint -9.0046 2.1992 -6.7748 {"}'M' greentint -8.9312 2.439 -6.7479 {"}'M' greentint -9.5009 1.6798 -7.6728 {"}'M' greentint -9.3427 1.682 -7.4691 {"}'M' greentint -9.182 1.7579 -7.2822 {"}'M' greentint -9.0325 1.9033 -7.1298 {"}'M' greentint -8.9079 2.1033 -7.024 {"}'M' greentint -8.8193 2.3409 -6.9759 {"}'M' greentint -8.7748 2.5956 -6.9886 {"}'M' greentint -9.3977 1.8424 -7.9279 {"}'M' greentint -9.249 1.7928 -7.7218 {"}'M' greentint -9.0866 1.8377 -7.5238 {"}'M' greentint -8.9324 1.9703 -7.3621 {"}'M' greentint -8.8082 2.1737 -7.2575 {"}'M' greentint -8.7299 2.4193 -7.2254 {"}'M' greentint -9.138 1.9763 -7.8922 {"}'M' greentint -8.977 2.0043 -7.6922 {"}'M' greentint -8.8289 2.1563 -7.5434 {"}'M' greentint -8.7341 2.3904 -7.486 {"}'M' greentint -9.0045 2.1941 -7.9457 {"}'M' greentint -8.8445 2.291 -7.7663 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 73 A}'M' green -9.3577 1.6845 -4.8569 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 73 A}'M' greentint -9.9047 1.1111 -4.233 {"}'M' greentint -10.0646 1.0142 -4.4124 {"}'M' greentint -10.175 0.9148 -4.6927 {"}'M' greentint -9.7712 1.329 -4.2865 {"}'M' greentint -9.9322 1.3009 -4.4865 {"}'M' greentint -10.0802 1.149 -4.6353 {"}'M' greentint -10.1468 1.0123 -4.9463 {"}'M' greentint -9.5828 1.4988 -4.3531 {"}'M' greentint -9.7416 1.502 -4.559 {"}'M' greentint -9.9019 1.4109 -4.7419 {"}'M' greentint -10.0433 1.2404 -4.8775 {"}'M' greentint -10.0499 1.0866 -5.1863 {"}'M' greentint -9.4859 1.6336 -4.6086 {"}'M' greentint -9.6472 1.5944 -4.8065 {"}'M' greentint -9.8038 1.4823 -4.9779 {"}'M' greentint -9.9424 1.3076 -5.1086 {"}'M' greentint -9.5159 1.6208 -5.0432 {"}'M' greentint -9.6661 1.4963 -5.203 {"}'M' greentint -9.7993 1.3207 -5.3261 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 55 A}'M' green -10.2292 0.7493 -4.64 {"}'M' green -9.3708 1.6576 -4.4636 {"}'M' green -9.799 1.3529 -5.3809 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 55 A}'M' greentint -10.0711 0.8233 -4.4563 {"}'M' greentint -9.9193 0.9439 -4.2934 {"}'M' greentint -9.779 1.1059 -4.1574 {"}'M' greentint -10.1263 0.8277 -4.8916 {"}'M' greentint -9.9637 0.8834 -4.6974 {"}'M' greentint -9.8059 0.9936 -4.524 {"}'M' greentint -9.6605 1.1553 -4.381 {"}'M' greentint -9.5359 1.3577 -4.2774 {"}'M' greentint -10.052 0.9631 -5.1507 {"}'M' greentint -9.8928 0.9855 -4.9502 {"}'M' greentint -9.7331 1.0741 -4.7692 {"}'M' greentint -9.5863 1.2237 -4.6216 {"}'M' greentint -9.4626 1.4234 -4.5169 {"}'M' greentint -9.9333 1.145 -5.3052 {"}'M' greentint -9.7745 1.156 -5.1043 {"}'M' greentint -9.6175 1.2519 -4.9269 {"}'M' greentint -9.479 1.4225 -4.7954 {"}'M' greentint -9.3761 1.6459 -4.7245 {"}'M' greentint -9.6359 1.3821 -5.1783 {"}'M' greentint -9.4861 1.5358 -5.0275 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 11 1vmbA_13F_67T}P -11.8406 -1.8017 0.6487 {"}-11.8406 -1.8017 0.6487 { ca ser A 11 1vmbA_13F_67T}-10.8622 -2.2231 -0.3547 { c ser A 11 1vmbA_13F_67T}-10.6867 -1.1328 -1.3514 { o ser A 11 1vmbA_13F_67T}-11.661 -0.7184 -2.0018 { c ser A 11 1vmbA_13F_67T}P -10.6867 -1.1328 -1.3514 { n met A 12 1vmbA_13F_67T}-9.4493 -0.6356 -1.4569 { ca met A 12 1vmbA_13F_67T}-9.0988 0.4406 -2.3872 { c met A 12 1vmbA_13F_67T}-8.3142 -0.2219 -3.4773 { o met A 12 1vmbA_13F_67T}-7.3684 -0.9959 -3.1923 { c met A 12 1vmbA_13F_67T}P -8.3142 -0.2219 -3.4773 { n phe A 13 1vmbA_13F_67T}-8.6662 0.0698 -4.724 { ca phe A 13 1vmbA_13F_67T}-7.9027 -0.443 -5.8481 { c phe A 13 1vmbA_13F_67T}-7.6542 0.6615 -6.8884 { o phe A 13 1vmbA_13F_67T}-8.5113 1.5436 -7.0411 { c phe A 13 1vmbA_13F_67T}P -7.6542 0.6615 -6.8884 { n ile A 14 1vmbA_13F_67T}-6.5081 0.6093 -7.588 { ca ile A 14 1vmbA_13F_67T}-6.1104 1.6666 -8.5161 { c ile A 14 1vmbA_13F_67T}-5.9131 1.0274 -9.8931 { o ile A 14 1vmbA_13F_67T}-5.1595 0.0933 -10.0239 { c ile A 14 1vmbA_13F_67T}P -5.9131 1.0274 -9.8931 { n ile A 15 1vmbA_13F_67T}-6.5913 1.5484 -10.898 { ca ile A 15 1vmbA_13F_67T}-6.5223 1.0765 -12.2511 { c ile A 15 1vmbA_13F_67T}-5.5407 1.9525 -13.0165 { o ile A 15 1vmbA_13F_67T}-5.488 3.226 -12.8864 { n asp A 65 1vmbA_13F_67T}P -6.3984 5.467 -11.416 {"}-6.3984 5.467 -11.416 { ca asp A 65 1vmbA_13F_67T}-7.8173 5.7865 -11.1691 { c asp A 65 1vmbA_13F_67T}-8.2182 5.038 -9.9058 { o asp A 65 1vmbA_13F_67T}-8.2427 3.8205 -9.9108 { c asp A 65 1vmbA_13F_67T}P -8.2182 5.038 -9.9058 { n tyr A 66 1vmbA_13F_67T}-8.522 5.8091 -8.865 { ca tyr A 66 1vmbA_13F_67T}-8.8296 5.2447 -7.5161 { c tyr A 66 1vmbA_13F_67T}-10.3117 4.9642 -7.3263 { o tyr A 66 1vmbA_13F_67T}-11.178 5.854 -7.6148 { c tyr A 66 1vmbA_13F_67T}P -10.3117 4.9642 -7.3263 { n thr A 67 1vmbA_13F_67T}-10.5721 3.8125 -6.7017 { ca thr A 67 1vmbA_13F_67T}-11.8839 3.4736 -6.223 { c thr A 67 1vmbA_13F_67T}-11.7304 2.8626 -4.8484 { o thr A 67 1vmbA_13F_67T}-10.7882 2.1227 -4.6461 { c thr A 67 1vmbA_13F_67T}P -11.7304 2.8626 -4.8484 { n val A 68 1vmbA_13F_67T}-12.6512 3.1854 -3.9199 { ca val A 68 1vmbA_13F_67T}-12.714 2.453 -2.6303 { c val A 68 1vmbA_13F_67T}-14.1022 1.8564 -2.4913 { o val A 68 1vmbA_13F_67T}-15.0976 2.5657 -2.7834 { c val A 68 1vmbA_13F_67T}P -14.1022 1.8564 -2.4913 { n ile A 69 1vmbA_13F_67T}-14.2061 0.6071 -2.0509 { ca ile A 69 1vmbA_13F_67T}-15.4952 -0.0403 -1.8604 { c ile A 69 1vmbA_13F_67T}-15.5527 -0.4284 -0.4013 { o ile A 69 1vmbA_13F_67T}-14.589 -1.0442 0.0533 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 11 1vmbA_13F_67T}P -11.8406 -1.8017 0.6487 { ca ser A 11 1vmbA_13F_67T}P -10.8622 -2.2231 -0.3547 { n met A 12 1vmbA_13F_67T}P -9.4493 -0.6356 -1.4569 { ca met A 12 1vmbA_13F_67T}P -9.0988 0.4406 -2.3872 { n phe A 13 1vmbA_13F_67T}P -8.6662 0.0698 -4.724 { ca phe A 13 1vmbA_13F_67T}P -7.9027 -0.443 -5.8481 { n ile A 14 1vmbA_13F_67T}P -6.5081 0.6093 -7.588 { ca ile A 14 1vmbA_13F_67T}P -6.1104 1.6666 -8.5161 { n ile A 15 1vmbA_13F_67T}P -6.5913 1.5484 -10.898 { ca ile A 15 1vmbA_13F_67T}P -6.5223 1.0765 -12.2511 { n asp A 65 1vmbA_13F_67T}P -6.3984 5.467 -11.416 { ca asp A 65 1vmbA_13F_67T}P -7.8173 5.7865 -11.1691 { n tyr A 66 1vmbA_13F_67T}P -8.522 5.8091 -8.865 { ca tyr A 66 1vmbA_13F_67T}P -8.8296 5.2447 -7.5161 { n thr A 67 1vmbA_13F_67T}P -10.5721 3.8125 -6.7017 { ca thr A 67 1vmbA_13F_67T}P -11.8839 3.4736 -6.223 { n val A 68 1vmbA_13F_67T}P -12.6512 3.1854 -3.9199 { ca val A 68 1vmbA_13F_67T}P -12.714 2.453 -2.6303 { n ile A 69 1vmbA_13F_67T}P -14.2061 0.6071 -2.0509 { ca ile A 69 1vmbA_13F_67T}P -15.4952 -0.0403 -1.8604 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ser A 11 1vmbA_13F_67T}P -10.8622 -2.2231 -0.3547 {"}-10.8622 -2.2231 -0.3547 { ca met A 12 1vmbA_13F_67T}-9.0988 0.4406 -2.3872 { ca phe A 13 1vmbA_13F_67T}-7.9027 -0.443 -5.8481 { ca ile A 14 1vmbA_13F_67T}-6.1104 1.6666 -8.5161 { ca ile A 15 1vmbA_13F_67T}-6.5223 1.0765 -12.2511 { ca asp A 65 1vmbA_13F_67T}P -7.8173 5.7865 -11.1691 {"}-7.8173 5.7865 -11.1691 { ca tyr A 66 1vmbA_13F_67T}-8.8296 5.2447 -7.5161 { ca thr A 67 1vmbA_13F_67T}-11.8839 3.4736 -6.223 { ca val A 68 1vmbA_13F_67T}-12.714 2.453 -2.6303 { ca ile A 69 1vmbA_13F_67T}-15.4952 -0.0403 -1.8604 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 13 1vmbA_13F_67T}P -7.9027 -0.443 -5.8481 { cb phe A 13 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{"}'M' greentint -9.522 2.1858 -6.6313 {"}'M' greentint -9.3614 2.2618 -6.4445 {"}'M' greentint -9.2118 2.4071 -6.2921 {"}'M' greentint -9.5771 2.3463 -7.0901 {"}'M' greentint -9.4283 2.2966 -6.884 {"}'M' greentint -9.266 2.3415 -6.6861 {"}'M' greentint -9.1118 2.4741 -6.5243 {"}'M' greentint -8.9875 2.6775 -6.4197 {"}'M' greentint -9.3174 2.4801 -7.0545 {"}'M' greentint -9.1563 2.5081 -6.8545 {"}'M' greentint -9.0083 2.6601 -6.7056 {"}'M' greentint -9.1839 2.6979 -7.108 {"}'M' greentint -9.0239 2.7948 -6.9285 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 13 A}'M' green -10.0424 1.2639 -5.4813 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 13 A}'M' greentint -10.1478 1.0543 -4.3882 {"}'M' greentint -10.3077 0.9574 -4.5676 {"}'M' greentint -10.4181 0.858 -4.8479 {"}'M' greentint -9.8825 1.1704 -4.2436 {"}'M' greentint -10.0143 1.2722 -4.4417 {"}'M' greentint -10.1753 1.2441 -4.6417 {"}'M' greentint -10.3233 1.0921 -4.7906 {"}'M' 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{"}'M' greentint -8.9809 3.1116 -6.6396 {"}'M' greentint -9.1331 2.9757 -6.7996 {"}'M' greentint -9.2698 2.7941 -6.9244 {"}'M' greentint -9.2673 2.6203 -7.2385 {"}'M' greentint -9.3529 2.3854 -7.2831 {"}'M' greentint -8.5648 3.3078 -6.5208 {"}'M' greentint -8.724 3.2566 -6.7129 {"}'M' greentint -8.8798 3.1579 -6.8862 {"}'M' greentint -9.0259 3.0143 -7.0361 {"}'M' greentint -9.1567 2.8323 -7.1546 {"}'M' greentint -8.5672 3.2911 -6.9184 {"}'M' greentint -8.7241 3.1852 -7.0915 {"}'M' greentint -8.8708 3.0381 -7.2413 {"}'M' greentint -9.0028 2.8551 -7.3612 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H TYR 9 A}'M' P -8.7285 2.5118 -6.6551 {"}'M' -8.7361 2.5185 -6.655 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 9 A}'M' greentint -9.4583 2.2023 -6.3395 {"}'M' greentint -9.3033 2.2995 -6.167 {"}'M' greentint -9.162 2.4503 -6.0254 {"}'M' greentint -9.0414 2.6445 -5.9237 {"}'M' greentint -9.5019 2.163 -6.8139 {"}'M' greentint -9.3476 2.1623 -6.6148 {"}'M' greentint -9.1894 2.226 -6.4285 {"}'M' greentint -9.0391 2.3504 -6.2687 {"}'M' greentint -8.906 2.526 -6.1456 {"}'M' greentint -8.8008 2.7407 -6.0678 {"}'M' greentint -8.7273 2.9805 -6.0409 {"}'M' greentint -9.297 2.2212 -6.9658 {"}'M' greentint -9.1388 2.2234 -6.7621 {"}'M' greentint -8.9781 2.2994 -6.5752 {"}'M' greentint -8.8286 2.4448 -6.4228 {"}'M' greentint -8.704 2.6448 -6.317 {"}'M' greentint -8.6154 2.8823 -6.2689 {"}'M' greentint -8.5709 3.1371 -6.2816 {"}'M' greentint -9.1939 2.3839 -7.2209 {"}'M' greentint -9.0451 2.3343 -7.0148 {"}'M' greentint -8.8828 2.3792 -6.8168 {"}'M' greentint -8.6043 2.7151 -6.5505 {"}'M' greentint -8.526 2.9608 -6.5184 {"}'M' greentint -8.505 3.2162 -6.5617 {"}'M' greentint -9.0659 2.6195 -7.3834 {"}'M' greentint -8.9341 2.5178 -7.1852 {"}'M' greentint -8.7731 2.5458 -6.9852 {"}'M' greentint -8.6251 2.6978 -6.8364 {"}'M' greentint -8.5303 2.9319 -6.779 {"}'M' greentint -8.514 3.1856 -6.8283 {"}'M' greentint -8.9048 2.8908 -7.4166 {"}'M' greentint -8.8006 2.7356 -7.2387 {"}'M' greentint -8.6406 2.8325 -7.0593 {"}'M' greentint -8.5857 3.0858 -7.0591 {"}'M' greentint -8.719 2.9822 -7.2586 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 71 A}'M' greentint -9.8753 1.4238 -4.0745 {"}'M' greentint -10.0353 1.3269 -4.254 {"}'M' greentint -10.1457 1.2275 -4.5342 {"}'M' greentint -9.7418 1.6417 -4.1281 {"}'M' greentint -9.9028 1.6136 -4.328 {"}'M' greentint -10.0509 1.4617 -4.4769 {"}'M' greentint -10.1174 1.325 -4.7878 {"}'M' greentint -9.5534 1.8115 -4.1947 {"}'M' greentint -9.7123 1.8147 -4.4006 {"}'M' greentint -9.8725 1.7236 -4.5835 {"}'M' greentint -10.014 1.5531 -4.719 {"}'M' greentint -10.0205 1.3993 -5.0278 {"}'M' greentint -9.4565 1.9462 -4.4502 {"}'M' greentint -9.6179 1.9071 -4.6481 {"}'M' greentint -9.7745 1.795 -4.8194 {"}'M' greentint -9.9131 1.6203 -4.9502 {"}'M' greentint -9.3284 1.9972 -4.6985 {"}'M' greentint -9.4866 1.9335 -4.8848 {"}'M' greentint -9.6368 1.809 -5.0446 {"}'M' greentint -9.7699 1.6334 -5.1677 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 9 A}'M' green -10.1792 1.0474 -4.5441 {"}'M' green -9.6071 1.6007 -3.9584 {"}'M' green -9.3208 1.9557 -4.3676 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 9 A}'M' greentint -10.0211 1.1214 -4.3603 {"}'M' greentint -9.8693 1.2421 -4.1975 {"}'M' greentint -9.729 1.4041 -4.0614 {"}'M' greentint -10.0764 1.1258 -4.7956 {"}'M' greentint -9.9137 1.1815 -4.6015 {"}'M' greentint -9.7559 1.2917 -4.428 {"}'M' greentint -9.6105 1.4535 -4.285 {"}'M' greentint -9.4859 1.6559 -4.1814 {"}'M' greentint -10.002 1.2612 -5.0547 {"}'M' greentint -9.8428 1.2836 -4.8542 {"}'M' greentint -9.6831 1.3722 -4.6732 {"}'M' greentint -9.5364 1.5218 -4.5257 {"}'M' greentint -9.4127 1.7216 -4.4209 {"}'M' greentint -9.8834 1.4431 -5.2092 {"}'M' greentint -9.7245 1.4541 -5.0083 {"}'M' greentint -9.5675 1.55 -4.831 {"}'M' greentint -9.429 1.7206 -4.6995 {"}'M' greentint -9.3261 1.9441 -4.6286 {"}'M' greentint -9.5859 1.6802 -5.0824 {"}'M' greentint -9.4361 1.8339 -4.9315 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 2 1vmfA_126F_4F}P -6.7331 6.422 -11.3891 {"}-6.7331 6.422 -11.3891 { ca lys A 2 1vmfA_126F_4F}-7.8811 6.6172 -10.5112 { c lys A 2 1vmfA_126F_4F}-7.9418 5.4844 -9.5086 { o lys A 2 1vmfA_126F_4F}-7.7026 4.313 -9.8541 { c lys A 2 1vmfA_126F_4F}P -7.9418 5.4844 -9.5086 { n thr A 3 1vmfA_126F_4F}-8.2792 5.8353 -8.2691 { ca thr A 3 1vmfA_126F_4F}-8.4479 4.8609 -7.2144 { c thr A 3 1vmfA_126F_4F}-9.945 4.7386 -6.9052 { o thr A 3 1vmfA_126F_4F}-10.6894 5.7398 -6.8866 { c thr A 3 1vmfA_126F_4F}P -9.945 4.7386 -6.9052 { n phe A 4 1vmfA_126F_4F}-10.3636 3.4898 -6.6746 { ca phe A 4 1vmfA_126F_4F}-11.7452 3.1463 -6.3911 { c phe A 4 1vmfA_126F_4F}-11.851 2.4944 -5.025 { o phe A 4 1vmfA_126F_4F}-10.9711 1.7352 -4.6333 { c phe A 4 1vmfA_126F_4F}P -11.851 2.4944 -5.025 { n his A 5 1vmfA_126F_4F}-12.9749 2.7613 -4.3629 { ca his A 5 1vmfA_126F_4F}-13.3344 2.2654 -3.0442 { c his A 5 1vmfA_126F_4F}-14.4324 1.2095 -3.135 { o his A 5 1vmfA_126F_4F}-15.4018 1.381 -3.9044 { c his A 5 1vmfA_126F_4F}P -14.4324 1.2095 -3.135 { n leu A 6 1vmfA_126F_4F}-14.2723 0.1396 -2.3678 { ca leu A 6 1vmfA_126F_4F}-15.2757 -0.9089 -2.1841 { c leu A 6 1vmfA_126F_4F}-15.479 -1.1816 -0.7114 { o leu A 6 1vmfA_126F_4F}-14.5316 -1.1556 0.0632 { n arg A 124 1vmfA_126F_4F}P -11.8039 -0.9109 1.1825 {"}-11.8039 -0.9109 1.1825 { ca arg A 124 1vmfA_126F_4F}-10.9606 -1.6406 0.2562 { c arg A 124 1vmfA_126F_4F}-10.7233 -0.73 -0.9278 { o arg A 124 1vmfA_126F_4F}-11.5814 0.0981 -1.2489 { c arg A 124 1vmfA_126F_4F}P -10.7233 -0.73 -0.9278 { n lys A 125 1vmfA_126F_4F}-9.55 -0.8446 -1.5382 { ca lys A 125 1vmfA_126F_4F}-9.1321 0.0171 -2.6111 { c lys A 125 1vmfA_126F_4F}-8.4857 -0.7839 -3.7236 { o lys A 125 1vmfA_126F_4F}-7.7059 -1.7066 -3.4623 { c lys A 125 1vmfA_126F_4F}P -8.4857 -0.7839 -3.7236 { n phe A 126 1vmfA_126F_4F}-8.7609 -0.3667 -4.9537 { ca phe A 126 1vmfA_126F_4F}-7.9499 -0.7675 -6.0949 { c phe A 126 1vmfA_126F_4F}-7.6808 0.4772 -6.9306 { o phe A 126 1vmfA_126F_4F}-8.4543 1.4432 -6.9198 { c phe A 126 1vmfA_126F_4F}P -7.6808 0.4772 -6.9306 { n val A 127 1vmfA_126F_4F}-6.5549 0.4253 -7.6167 { ca val A 127 1vmfA_126F_4F}-6.0954 1.4921 -8.4813 { c val A 127 1vmfA_126F_4F}-6.0913 1.0678 -9.9391 { o val A 127 1vmfA_126F_4F}-5.7226 -0.0598 -10.2613 { c val A 127 1vmfA_126F_4F}P -6.0913 1.0678 -9.9391 { n val A 128 1vmfA_126F_4F}-6.5247 1.9774 -10.8195 { ca val A 128 1vmfA_126F_4F}-6.4964 1.7438 -12.2585 { c val A 128 1vmfA_126F_4F}-5.5916 2.7914 -12.8741 { o val A 128 1vmfA_126F_4F}-5.8626 3.9825 -12.78 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 2 1vmfA_126F_4F}P -6.7331 6.422 -11.3891 { ca lys A 2 1vmfA_126F_4F}P -7.8811 6.6172 -10.5112 { n thr A 3 1vmfA_126F_4F}P -8.2792 5.8353 -8.2691 { ca thr A 3 1vmfA_126F_4F}P -8.4479 4.8609 -7.2144 { n phe A 4 1vmfA_126F_4F}P -10.3636 3.4898 -6.6746 { ca phe A 4 1vmfA_126F_4F}P -11.7452 3.1463 -6.3911 { n his A 5 1vmfA_126F_4F}P -12.9749 2.7613 -4.3629 { ca his A 5 1vmfA_126F_4F}P -13.3344 2.2654 -3.0442 { n leu A 6 1vmfA_126F_4F}P -14.2723 0.1396 -2.3678 { ca leu A 6 1vmfA_126F_4F}P -15.2757 -0.9089 -2.1841 { n arg A 124 1vmfA_126F_4F}P -11.8039 -0.9109 1.1825 { ca arg A 124 1vmfA_126F_4F}P -10.9606 -1.6406 0.2562 { n lys A 125 1vmfA_126F_4F}P -9.55 -0.8446 -1.5382 { ca lys A 125 1vmfA_126F_4F}P -9.1321 0.0171 -2.6111 { n phe A 126 1vmfA_126F_4F}P -8.7609 -0.3667 -4.9537 { ca phe A 126 1vmfA_126F_4F}P -7.9499 -0.7675 -6.0949 { n val A 127 1vmfA_126F_4F}P -6.5549 0.4253 -7.6167 { ca val A 127 1vmfA_126F_4F}P -6.0954 1.4921 -8.4813 { n val A 128 1vmfA_126F_4F}P -6.5247 1.9774 -10.8195 { ca val A 128 1vmfA_126F_4F}P -6.4964 1.7438 -12.2585 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 2 1vmfA_126F_4F}P -7.8811 6.6172 -10.5112 {"}-7.8811 6.6172 -10.5112 { ca thr A 3 1vmfA_126F_4F}-8.4479 4.8609 -7.2144 { ca phe A 4 1vmfA_126F_4F}-11.7452 3.1463 -6.3911 { ca his A 5 1vmfA_126F_4F}-13.3344 2.2654 -3.0442 { ca leu A 6 1vmfA_126F_4F}-15.2757 -0.9089 -2.1841 { ca arg A 124 1vmfA_126F_4F}P -10.9606 -1.6406 0.2562 {"}-10.9606 -1.6406 0.2562 { ca lys A 125 1vmfA_126F_4F}-9.1321 0.0171 -2.6111 { ca phe A 126 1vmfA_126F_4F}-7.9499 -0.7675 -6.0949 { ca val A 127 1vmfA_126F_4F}-6.0954 1.4921 -8.4813 { ca val A 128 1vmfA_126F_4F}-6.4964 1.7438 -12.2585 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 4 1vmfA_126F_4F}P -11.7452 3.1463 -6.3911 { cb phe A 4 1vmfA_126F_4F}-12.2357 2.1869 -7.4646 { cg phe A 4 1vmfA_126F_4F}-12.2988 2.8048 -8.8266 { cd1 phe A 4 1vmfA_126F_4F}-11.1854 2.8223 -9.6465 { ce1 phe A 4 1vmfA_126F_4F}-11.2601 3.4026 -10.92 { cz phe A 4 1vmfA_126F_4F}-12.4453 3.966 -11.3356 { cg phe A 4 1vmfA_126F_4F}P -12.2988 2.8048 -8.8266 { cd2 phe A 4 1vmfA_126F_4F}-13.4837 3.3777 -9.2951 { ce2 phe A 4 1vmfA_126F_4F}-13.544 3.9526 -10.5221 { cz phe A 4 1vmfA_126F_4F}ghost -12.4453 3.966 -11.3356 { ca phe A 126 1vmfA_126F_4F}P -7.9499 -0.7675 -6.0949 { cb phe A 126 1vmfA_126F_4F}-8.5614 -1.9062 -6.9391 { cg phe A 126 1vmfA_126F_4F}-9.8533 -1.5597 -7.6047 { cd1 phe A 126 1vmfA_126F_4F}-11.0525 -1.7173 -6.9453 { ce1 phe A 126 1vmfA_126F_4F}-12.243 -1.4278 -7.562 { cz phe A 126 1vmfA_126F_4F}-12.2716 -0.9615 -8.8371 { cg phe A 126 1vmfA_126F_4F}P -9.8533 -1.5597 -7.6047 { cd2 phe A 126 1vmfA_126F_4F}-9.8754 -1.099 -8.9089 { ce2 phe A 126 1vmfA_126F_4F}-11.0926 -0.7993 -9.5286 { cz phe A 126 1vmfA_126F_4F}ghost -12.2716 -0.9615 -8.8371 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 4 1vmfA_126F_4F}P -12.2357 2.1869 -7.4646 {"}P -12.2357 2.1869 -7.4646 { cd1 phe A 4 1vmfA_126F_4F}P -11.1854 2.8223 -9.6465 { cd2 phe A 4 1vmfA_126F_4F}P -13.4837 3.3777 -9.2951 { ce1 phe A 4 1vmfA_126F_4F}P -11.2601 3.4026 -10.92 { ce2 phe A 4 1vmfA_126F_4F}P -13.544 3.9526 -10.5221 { cz phe A 4 1vmfA_126F_4F}P -12.4453 3.966 -11.3356 { cb phe A 126 1vmfA_126F_4F}P -8.5614 -1.9062 -6.9391 {"}P -8.5614 -1.9062 -6.9391 { cd1 phe A 126 1vmfA_126F_4F}P -11.0525 -1.7173 -6.9453 { cd2 phe A 126 1vmfA_126F_4F}P -9.8754 -1.099 -8.9089 { ce1 phe A 126 1vmfA_126F_4F}P -12.243 -1.4278 -7.562 { ce2 phe A 126 1vmfA_126F_4F}P -11.0926 -0.7993 -9.5286 { cz phe A 126 1vmfA_126F_4F}P -12.2716 -0.9615 -8.8371 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 126 A}'S' blue -10.5506 0.042 -7.5017 {"}'S' blue -10.7113 -0.0364 -7.6863 { CD1 PHE 126 A}'S' blue -11.3069 -0.0041 -6.6912 {"}'S' sky -11.1197 0.0304 -6.8722 {"}'S' sky -10.9408 0.0248 -7.069 {"}'S' sky -10.894 -0.0414 -7.424 {"}'S' sky -11.0572 -0.102 -7.6178 { CD2 PHE 126 A}'S' blue -10.6503 0.0404 -7.8306 {"}'S' blue -10.7931 0.1069 -8.0342 {"}'S' blue -10.4509 0.2008 -7.8887 {"}'S' blue -10.5932 0.2712 -8.0907 {"}'S' blue -10.5131 0.432 -8.3512 { CE1 PHE 126 A}'S' blue -12.4761 0.1547 -6.8525 {"}'S' sky -12.6241 0.2045 -7.0575 {"}'S' sky -12.7799 0.2101 -7.2616 {"}'S' blue -12.9403 0.1739 -7.4589 {"}'S' sky -11.5651 0.0314 -6.8745 { CE2 PHE 126 A}'S' blue -11.7303 0.7318 -8.9708 {"}'S' blue -11.8914 0.7169 -9.1738 {"}'S' sky -10.9002 0.2053 -8.109 {"}'S' sky -11.3257 0.7833 -8.8191 {"}'S' blue -11.4736 0.8331 -9.0241 {"}'S' sky -11.6295 0.8387 -9.2282 {"}'S' blue -11.7899 0.8025 -9.4255 {"}'S' sky -10.7187 0.4112 -8.3215 {"}'S' sky -10.812 0.5802 -8.4893 {"}'S' sky -10.9247 0.7179 -8.673 {"}'S' blue -11.0526 0.8209 -8.868 {"}'S' sky -11.1951 0.8868 -9.0709 {"}'S' sky -11.6654 0.8482 -9.6674 {"}'S' sky -10.8564 0.8647 -9.0405 {"}'S' blue -11.6464 0.7807 -10.0378 {"}'S' sky -10.6749 0.8756 -9.2375 {"}'S' sky -11.3066 0.858 -10.049 {"}'S' blue -11.4675 0.7595 -10.2293 {"}'S' blue -10.4661 0.8287 -9.3891 {"}'S' sky -10.6148 0.8825 -9.596 {"}'S' sky -11.0973 0.816 -10.2011 {"}'S' blue -10.5573 0.8175 -9.9316 {"}'S' blue -10.7189 0.7986 -10.1362 { CZ PHE 126 A}'S' sky -12.9895 0.4087 -8.0188 {"}'S' sky -12.6837 0.7386 -8.7835 {"}'S' blue -12.8445 0.686 -8.976 {"}'S' sky -12.5005 0.7688 -8.9689 {"}'S' blue -12.6644 0.7122 -9.1646 {"}'S' sky -12.16 0.7807 -8.9608 {"}'S' sky -12.3221 0.7572 -9.1634 {"}'S' blue -12.4857 0.6958 -9.3576 {"}'S' blue -11.9514 0.7375 -9.112 {"}'S' blue -12.1132 0.7145 -9.3158 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 126 A}'S' sea -11.2813 0.013 -7.0771 {"}'S' sea -11.1029 0.0014 -7.2716 { CE1 PHE 126 A}'S' sea -12.203 0.1923 -6.9014 {"}'S' sea -12.3455 0.2582 -7.1043 {"}'S' sea -12.4974 0.2854 -7.3079 {"}'S' sea -12.655 0.2722 -7.5084 {"}'S' sea -11.8725 0.1377 -6.8729 {"}'S' green -12.0068 0.2361 -7.0739 {"}'S' green -12.1536 0.2969 -7.2816 {"}'S' green -12.3102 0.3199 -7.4889 {"}'S' green -11.6874 0.156 -7.0684 {"}'S' green -11.4794 0.1092 -7.2195 {"}'S' sea -11.2694 0.0103 -7.3491 {"}'S' green -11.4042 0.1079 -7.5505 {"}'S' sea -11.2028 -0.025 -7.6669 { CE2 PHE 126 A}'S' sea 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greentint -9.8046 1.173 -4.9732 {"}'M' greentint -9.9659 1.1338 -5.1711 {"}'M' greentint -10.1225 1.0218 -5.3425 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 4 A}'M' green -10.4957 0.4189 -4.688 {"}'M' green -10.3376 0.493 -4.5042 {"}'M' green -10.1858 0.6136 -4.3413 {"}'M' green -10.55 0.5019 -5.1451 {"}'M' green -9.927 0.825 -4.4289 {"}'M' green -10.4665 0.6798 -5.4031 {"}'M' green -9.7291 1.0931 -4.5648 {"}'M' green -10.3382 0.8915 -5.5546 {"}'M' green -9.7526 1.2055 -5.0754 {"}'M' green -9.9529 1.2523 -5.4641 {"}'M' sea -9.7942 1.3497 -5.2864 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 4 A}'M' greentint -10.3928 0.4973 -4.9395 {"}'M' greentint -10.2302 0.553 -4.7453 {"}'M' greentint -10.0724 0.6633 -4.5719 {"}'M' greentint -10.3185 0.6327 -5.1986 {"}'M' greentint -10.1593 0.6552 -4.9981 {"}'M' greentint -9.9996 0.7438 -4.8171 {"}'M' greentint -9.8529 0.8933 -4.6695 {"}'M' greentint -10.1999 0.8147 -5.3531 {"}'M' greentint -10.041 0.8257 -5.1522 {"}'M' greentint -9.884 0.9216 -4.9748 {"}'M' greentint -9.7455 1.0921 -4.8433 {"}'M' greentint -10.0655 1.0225 -5.4289 {"}'M' greentint -9.9024 1.0517 -5.2262 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A1114 1vprA_1128F_11}P -7.0027 5.7626 -12.0821 {"}-7.0027 5.7626 -12.0821 { ca leu A1114 1vprA_1128F_11}-8.4435 5.8875 -11.8891 { c leu A1114 1vprA_1128F_11}-8.7016 4.8146 -10.8316 { o leu A1114 1vprA_1128F_11}-8.505 3.6238 -11.0806 { c leu A1114 1vprA_1128F_11}P -8.7016 4.8146 -10.8316 { n gly A1115 1vprA_1128F_11}-9.1156 5.2241 -9.6369 { ca gly A1115 1vprA_1128F_11}-9.3127 4.2387 -8.591 { c gly A1115 1vprA_1128F_11}-10.5368 4.4834 -7.7532 { o gly A1115 1vprA_1128F_11}-11.2406 5.4649 -7.9583 { c gly A1115 1vprA_1128F_11}P -10.5368 4.4834 -7.7532 { n val A1116 1vprA_1128F_11}-10.7537 3.6014 -6.7838 { ca val A1116 1vprA_1128F_11}-11.9077 3.6456 -5.9138 { c val A1116 1vprA_1128F_11}-11.5479 3.1418 -4.5347 { o val A1116 1vprA_1128F_11}-10.751 2.2182 -4.4206 { c val A1116 1vprA_1128F_11}P -11.5479 3.1418 -4.5347 { n trp A1117 1vprA_1128F_11}-12.1223 3.745 -3.4905 { ca trp A1117 1vprA_1128F_11}-11.9405 3.257 -2.131 { c trp A1117 1vprA_1128F_11}-13.3446 2.8481 -1.713 { o trp A1117 1vprA_1128F_11}-14.3302 3.5508 -2.0123 { c trp A1117 1vprA_1128F_11}P -13.3446 2.8481 -1.713 { n val A1118 1vprA_1128F_11}-13.4457 1.715 -1.0423 { ca val A1118 1vprA_1128F_11}-14.725 1.2589 -0.5079 { c val A1118 1vprA_1128F_11}-14.4814 1.2044 1.0064 { o val A1118 1vprA_1128F_11}-13.3899 0.8493 1.4513 { n ile A1126 1vprA_1128F_11}P -10.9573 -0.7764 1.5553 {"}-10.9573 -0.7764 1.5553 { ca ile A1126 1vprA_1128F_11}-10.4731 -1.7075 0.5259 { c ile A1126 1vprA_1128F_11}-10.7139 -1.0468 -0.8238 { o ile A1126 1vprA_1128F_11}-11.8026 -0.5359 -1.1024 { c ile A1126 1vprA_1128F_11}P -10.7139 -1.0468 -0.8238 { n gly A1127 1vprA_1128F_11}-9.7043 -1.0545 -1.6789 { ca gly A1127 1vprA_1128F_11}-9.8693 -0.3929 -2.9663 { c gly A1127 1vprA_1128F_11}-8.9222 -0.8975 -4.0225 { o gly A1127 1vprA_1128F_11}-8.2716 -1.9376 -3.8648 { c gly A1127 1vprA_1128F_11}P -8.9222 -0.8975 -4.0225 { n phe A1128 1vprA_1128F_11}-8.8339 -0.1699 -5.1121 { ca phe A1128 1vprA_1128F_11}-7.9468 -0.5731 -6.1897 { c phe A1128 1vprA_1128F_11}-7.6878 0.665 -7.0121 { o phe A1128 1vprA_1128F_11}-8.4706 1.6246 -6.9493 { c phe A1128 1vprA_1128F_11}P -7.6878 0.665 -7.0121 { n phe A1129 1vprA_1128F_11}-6.6002 0.6459 -7.7821 { ca phe A1129 1vprA_1128F_11}-6.2563 1.7638 -8.6489 { c phe A1129 1vprA_1128F_11}-5.7479 1.2111 -9.9587 { o phe A1129 1vprA_1128F_11}-4.8387 0.399 -9.9611 { c phe A1129 1vprA_1128F_11}P -5.7479 1.2111 -9.9587 { n trp A1130 1vprA_1128F_11}-6.3406 1.6631 -11.0565 { ca trp A1130 1vprA_1128F_11}-5.9249 1.2572 -12.3883 { c trp A1130 1vprA_1128F_11}-4.8534 2.2224 -12.8427 { o trp A1130 1vprA_1128F_11}-5.1183 3.4145 -12.9676 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A1114 1vprA_1128F_11}P -7.0027 5.7626 -12.0821 { ca leu A1114 1vprA_1128F_11}P -8.4435 5.8875 -11.8891 { n gly A1115 1vprA_1128F_11}P -9.1156 5.2241 -9.6369 { ca gly A1115 1vprA_1128F_11}P -9.3127 4.2387 -8.591 {"}P -9.3127 4.2387 -8.591 { n val A1116 1vprA_1128F_11}P -10.7537 3.6014 -6.7838 { ca val A1116 1vprA_1128F_11}P -11.9077 3.6456 -5.9138 { n trp A1117 1vprA_1128F_11}P -12.1223 3.745 -3.4905 { ca trp A1117 1vprA_1128F_11}P -11.9405 3.257 -2.131 { n val A1118 1vprA_1128F_11}P -13.4457 1.715 -1.0423 { ca val A1118 1vprA_1128F_11}P -14.725 1.2589 -0.5079 { n ile A1126 1vprA_1128F_11}P -10.9573 -0.7764 1.5553 { ca ile A1126 1vprA_1128F_11}P -10.4731 -1.7075 0.5259 { n gly A1127 1vprA_1128F_11}P -9.7043 -1.0545 -1.6789 { ca gly A1127 1vprA_1128F_11}P -9.8693 -0.3929 -2.9663 {"}P -9.8693 -0.3929 -2.9663 { n phe A1128 1vprA_1128F_11}P -8.8339 -0.1699 -5.1121 { ca phe A1128 1vprA_1128F_11}P -7.9468 -0.5731 -6.1897 { n phe A1129 1vprA_1128F_11}P -6.6002 0.6459 -7.7821 { ca phe A1129 1vprA_1128F_11}P -6.2563 1.7638 -8.6489 { n trp A1130 1vprA_1128F_11}P -6.3406 1.6631 -11.0565 { ca trp A1130 1vprA_1128F_11}P -5.9249 1.2572 -12.3883 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A1114 1vprA_1128F_11}P -8.4435 5.8875 -11.8891 {"}-8.4435 5.8875 -11.8891 { ca gly A1115 1vprA_1128F_11}-9.3127 4.2387 -8.591 { ca val A1116 1vprA_1128F_11}-11.9077 3.6456 -5.9138 { ca trp A1117 1vprA_1128F_11}-11.9405 3.257 -2.131 { ca val A1118 1vprA_1128F_11}-14.725 1.2589 -0.5079 { ca ile A1126 1vprA_1128F_11}P -10.4731 -1.7075 0.5259 {"}-10.4731 -1.7075 0.5259 { ca gly A1127 1vprA_1128F_11}-9.8693 -0.3929 -2.9663 { ca phe A1128 1vprA_1128F_11}-7.9468 -0.5731 -6.1897 { ca phe A1129 1vprA_1128F_11}-6.2563 1.7638 -8.6489 { ca trp A1130 1vprA_1128F_11}-5.9249 1.2572 -12.3883 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A1116 1vprA_1128F_11}P -11.9077 3.6456 -5.9138 { cb val A1116 1vprA_1128F_11}-13.0359 2.6732 -6.4408 { cg1 val A1116 1vprA_1128F_11}-14.1146 2.5216 -5.384 { cb val A1116 1vprA_1128F_11}P -13.0359 2.6732 -6.4408 { cg2 val A1116 1vprA_1128F_11}-13.6434 3.187 -7.7473 { ca phe A1128 1vprA_1128F_11}P -7.9468 -0.5731 -6.1897 { cb phe A1128 1vprA_1128F_11}-8.6268 -1.6158 -7.0811 { cg phe A1128 1vprA_1128F_11}-9.8449 -1.1042 -7.7605 { cd1 phe A1128 1vprA_1128F_11}-11.0732 -1.0625 -7.0872 { ce1 phe A1128 1vprA_1128F_11}-12.2 -0.5484 -7.7091 { cz phe A1128 1vprA_1128F_11}-12.103 -0.0607 -9.0276 { cg phe A1128 1vprA_1128F_11}P -9.8449 -1.1042 -7.7605 { cd2 phe A1128 1vprA_1128F_11}-9.771 -0.6184 -9.0657 { ce2 phe A1128 1vprA_1128F_11}-10.9045 -0.0931 -9.6942 { cz phe A1128 1vprA_1128F_11}ghost -12.103 -0.0607 -9.0276 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A1116 1vprA_1128F_11}P -13.0359 2.6732 -6.4408 { cg1 val A1116 1vprA_1128F_11}P -14.1146 2.5216 -5.384 {"}P -14.1146 2.5216 -5.384 {"}P -14.1146 2.5216 -5.384 { cg2 val A1116 1vprA_1128F_11}P -13.6434 3.187 -7.7473 {"}P -13.6434 3.187 -7.7473 {"}P -13.6434 3.187 -7.7473 { cb phe A1128 1vprA_1128F_11}P -8.6268 -1.6158 -7.0811 {"}P -8.6268 -1.6158 -7.0811 { cd1 phe A1128 1vprA_1128F_11}P -11.0732 -1.0625 -7.0872 { cd2 phe A1128 1vprA_1128F_11}P -9.771 -0.6184 -9.0657 { ce1 phe A1128 1vprA_1128F_11}P -12.2 -0.5484 -7.7091 { ce2 phe A1128 1vprA_1128F_11}P -10.9045 -0.0931 -9.6942 { cz phe A1128 1vprA_1128F_11}P -12.103 -0.0607 -9.0276 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE1128 A}'S' blue -11.4542 0.5699 -6.5828 { CZ PHE1128 A}'S' sky -12.8779 1.0787 -7.9493 {"}'S' blue -13.0208 1.1452 -8.1528 {"}'S' blue -13.1785 1.1452 -8.3564 {"}'S' sky -12.6786 1.2391 -8.0074 {"}'S' blue -12.8209 1.3095 -8.2093 {"}'S' sky -12.9752 1.3271 -8.414 {"}'S' blue -13.1364 1.2894 -8.6121 {"}'S' sky -12.4479 1.3552 -8.0586 {"}'S' blue -12.5878 1.4362 -8.2615 {"}'S' sky -12.7408 1.4704 -8.4699 {"}'S' sky -12.9019 1.4554 -8.6729 {"}'S' blue -13.0647 1.3928 -8.8657 {"}'S' sky -12.0832 1.3025 -7.9309 {"}'S' blue -12.2008 1.4316 -8.1194 {"}'S' blue -12.3362 1.5218 -8.3182 {"}'S' blue -12.4841 1.5716 -8.5232 {"}'S' blue -12.64 1.5772 -8.7273 {"}'S' blue -12.8004 1.541 -8.9246 {"}'S' blue -11.7292 1.1497 -7.8205 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE1128 A}'S' green -13.1177 0.6576 -6.8343 {"}'S' green -12.3238 0.5756 -6.373 {"}'S' green -12.0825 0.651 -6.4398 {"}'S' green -12.8973 1.0534 -7.606 {"}'S' green -11.7108 0.8836 -6.829 { CZ PHE1128 A}'S' sea -12.3257 1.2289 -7.8662 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE1128 A}'S' P -12.9749 0.5911 -6.6307 {"}'S' -12.9741 0.591 -6.6313 {"}'S' P -12.654 0.6295 -6.4966 {"}'S' -12.6415 0.5975 -6.5303 {"}'S' P -12.7756 0.7515 -6.6888 {"}'S' -12.7415 0.6736 -6.7492 {"}'S' P -12.9178 0.8218 -6.8908 {"}'S' -12.8754 0.7416 -6.9392 {"}'S' P -13.0721 0.8395 -7.0955 {"}'S' -13.0507 0.8042 -7.1112 {"}'S' P -12.4226 0.7413 -6.5476 {"}'S' -12.4098 0.6672 -6.614 {"}'S' P -12.5449 0.8676 -6.7401 {"}'S' -12.511 0.7302 -6.8334 {"}'S' P -12.6848 0.9485 -6.9429 {"}'S' -12.6353 0.7938 -7.0228 {"}'S' P -12.8378 0.9827 -7.1513 {"}'S' -12.7906 0.8678 -7.1922 {"}'S' P -12.9988 0.9678 -7.3543 {"}'S' -12.9825 0.9363 -7.3624 {"}'S' P -12.1802 0.8149 -6.6124 {"}'S' -12.1818 0.7351 -6.6767 {"}'S' P -12.2977 0.944 -6.8008 {"}'S' -12.288 0.7931 -6.8932 {"}'S' P -12.5811 1.084 -7.2046 {"}'S' -12.5437 0.9246 -7.2539 {"}'S' P -12.7369 1.0896 -7.4087 {"}'S' -12.7091 1.0037 -7.4245 {"}'S' P -11.9194 0.8311 -6.6698 {"}'S' -11.9255 0.7985 -6.6947 {"}'S' P -12.0321 0.9688 -6.8536 {"}'S' -12.0429 0.8668 -6.9116 {"}'S' P -12.16 1.0718 -7.0485 {"}'S' -12.1638 0.9251 -7.109 {"}'S' P -12.3025 1.1377 -7.2514 {"}'S' -12.2938 0.9926 -7.2902 {"}'S' P -12.4544 1.1648 -7.455 {"}'S' -12.4407 1.0696 -7.4692 {"}'S' P -12.612 1.1517 -7.6555 {"}'S' -12.6104 1.1408 -7.6558 {"}'S' P -11.8295 1.0172 -7.02 {"}'S' -11.839 0.9761 -7.0373 {"}'S' P -11.9638 1.1156 -7.221 {"}'S' -11.9739 1.0459 -7.2411 {"}'S' P -12.1106 1.1764 -7.4287 {"}'S' -12.1132 1.1179 -7.4376 {"}'S' P -12.2672 1.1994 -7.636 {"}'S' -12.2667 1.1906 -7.6367 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { CE1 PHE1128 A}'S' P -12.4331 1.0342 -6.9997 {"}'S' -12.4059 0.8507 -7.0829 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL1116 A}'S' blue -13.3333 1.5731 -8.3478 {"}'S' blue -13.1801 1.547 -8.1427 {"}'S' blue -13.0215 1.5631 -7.9416 {"}'S' blue -13.2345 1.7272 -8.6223 {"}'S' sky -13.0881 1.6685 -8.4156 {"}'S' sky -12.9303 1.6568 -8.2092 {"}'S' blue -12.7682 1.6947 -8.01 {"}'S' blue -12.9946 1.8426 -8.6608 {"}'S' sky -12.8444 1.8006 -8.4561 {"}'S' blue -12.6859 1.8125 -8.2542 {"}'S' blue -12.5247 1.879 -8.0644 {"}'S' blue -12.7302 1.9822 -8.6286 {"}'S' blue -12.573 1.98 -8.4252 { HB VAL1116 A}'S' sky -12.3196 1.5086 -7.7679 {"}'S' blue -12.058 1.5897 -7.6835 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL1116 A}'S' sea -12.5861 1.3976 -7.7753 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL1116 A}'S' P -13.0581 0.6766 -6.9759 {"}'S' -13.0419 0.713 -6.9638 {"}'S' P -12.9274 0.5823 -6.7809 {"}'S' -12.9103 0.6372 -6.7734 {"}'S' P -12.7801 0.5406 -6.5786 {"}'S' -12.7744 0.5781 -6.5811 {"}'S' P -13.0165 0.9381 -7.4264 {"}'S' -13.0106 0.9479 -7.4155 {"}'S' P -12.9288 0.762 -7.263 {"}'S' -12.9008 0.8352 -7.2141 {"}'S' P -12.8127 0.6302 -7.0776 {"}'S' -12.7857 0.7567 -7.0251 {"}'S' P -12.6761 0.5488 -6.8775 {"}'S' -12.6642 0.6923 -6.8478 {"}'S' P -12.5237 0.5239 -6.6738 {"}'S' -12.5294 0.6361 -6.6712 {"}'S' P -12.3643 0.5543 -6.4765 {"}'S' -12.3733 0.5972 -6.4832 {"}'S' P -12.8096 1.0616 -7.6024 {"}'S' -12.8071 1.0685 -7.592 {"}'S' P -12.7385 0.8653 -7.457 {"}'S' -12.7241 0.9418 -7.3813 {"}'S' P -12.6359 0.7125 -7.282 {"}'S' -12.6282 0.8584 -7.1868 {"}'S' P -12.5075 0.6117 -7.0868 {"}'S' -12.5206 0.7955 -7.0117 {"}'S' P -12.3602 0.5687 -6.8843 {"}'S' -12.393 0.7377 -6.8481 {"}'S' P -12.202 0.5864 -6.6858 {"}'S' -12.2389 0.6913 -6.6815 {"}'S' P -12.0443 0.6625 -6.503 {"}'S' -12.0516 0.6775 -6.5044 {"}'S' P -12.5668 1.1552 -7.6833 {"}'S' -12.5662 1.1567 -7.6795 {"}'S' P -12.5023 0.9463 -7.5407 {"}'S' -12.5097 1.0153 -7.4588 {"}'S' P -12.3986 0.7876 -7.3627 {"}'S' -12.426 0.9255 -7.2539 {"}'S' P -12.2637 0.6927 -7.1618 {"}'S' -12.3167 0.8605 -7.0743 {"}'S' P -12.108 0.6685 -6.9536 {"}'S' -12.1719 0.8064 -6.9119 {"}'S' P -11.9447 0.7174 -6.7571 {"}'S' -11.9846 0.7782 -6.7503 {"}'S' P -12.2641 1.0532 -7.571 {"}'S' -12.2836 1.0918 -7.5142 {"}'S' P -12.1615 0.9004 -7.3959 {"}'S' -12.2097 0.9915 -7.31 {"}'S' P -12.0244 0.8254 -7.1965 {"}'S' -12.0895 0.9265 -7.1325 {"}'S' P -11.868 0.8362 -6.9972 {"}'S' -11.9163 0.8938 -6.9738 {"}'S' P -12.0066 1.1233 -7.488 {"}'S' -12.0197 1.1359 -7.4694 {"}'S' P -11.8732 1.0206 -7.2874 {"}'S' -11.9012 1.0464 -7.2615 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE1128 A}'M' green -9.4838 2.1057 -6.1114 {"}'M' green -9.6427 2.017 -6.293 {"}'M' green -9.3808 2.3383 -6.1603 {"}'M' green -9.8529 1.8021 -6.8114 {"}'M' green -9.2368 2.5434 -6.2224 {"}'M' green -9.8371 1.9005 -7.0772 {"}'M' green -9.6881 2.2258 -7.2912 {"}'M' green -9.1251 2.8441 -6.7363 {"}'M' green -9.3322 2.6646 -7.3185 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE1128 A}'M' greentint -9.7863 1.9093 -6.5654 {"}'M' greentint -9.544 2.3049 -6.3622 {"}'M' greentint -9.6926 2.148 -6.5107 {"}'M' greentint -9.7964 2.0516 -6.8082 {"}'M' greentint -9.3948 2.535 -6.4244 {"}'M' greentint -9.5534 2.4419 -6.6028 {"}'M' greentint -9.6926 2.2739 -6.7359 {"}'M' greentint -9.766 2.1456 -7.053 {"}'M' greentint -9.2078 2.7241 -6.4922 {"}'M' greentint -9.368 2.6659 -6.6842 {"}'M' greentint -9.5228 2.5428 -6.8489 {"}'M' greentint -9.6585 2.3653 -6.975 {"}'M' greentint -9.2871 2.7619 -6.922 {"}'M' greentint -9.4394 2.626 -7.0819 {"}'M' greentint -9.576 2.4444 -7.2068 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H VAL1116 A}'M' green -9.2501 2.5737 -6.2012 {"}'M' green -9.8285 2.0753 -7.1532 {"}'M' green -9.7005 2.3109 -7.3156 {"}'M' green -9.1486 2.8769 -6.7606 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL1116 A}'M' greentint -9.7734 1.9148 -6.6944 {"}'M' greentint -9.6128 1.9908 -6.5075 {"}'M' greentint -9.4632 2.1362 -6.3551 {"}'M' greentint -9.3387 2.3361 -6.2493 {"}'M' greentint -9.6797 2.0256 -6.947 {"}'M' greentint -9.5174 2.0706 -6.7491 {"}'M' greentint -9.3632 2.2032 -6.5874 {"}'M' greentint -9.2389 2.4065 -6.4828 {"}'M' greentint -9.1607 2.6522 -6.4506 {"}'M' greentint -9.5688 2.2091 -7.1175 {"}'M' greentint -9.4078 2.2372 -6.9175 {"}'M' greentint -9.2597 2.3891 -6.7686 {"}'M' greentint -9.1649 2.6232 -6.7113 {"}'M' greentint -9.4353 2.427 -7.171 {"}'M' greentint -9.2753 2.5239 -6.9916 {"}'M' greentint -9.2203 2.7772 -6.9914 {"}'M' greentint -9.3536 2.6735 -7.1909 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE1128 A}'M' green -10.1235 0.8416 -4.6721 {"}'M' green -9.9376 0.933 -4.5141 {"}'M' green -10.2018 0.9913 -4.8714 {"}'M' sea -10.3122 0.8919 -5.1517 {"}'M' sea -9.7099 0.999 -4.4043 {"}'M' green -9.7766 1.2043 -4.5474 {"}'M' sea -9.4919 1.2065 -4.4424 {"}'M' green -9.585 1.3811 -4.6113 {"}'M' green -10.1804 1.2175 -5.3365 {"}'M' sea -9.3432 1.466 -4.6658 {"}'M' green -9.4714 1.5751 -4.8625 {"}'M' green -9.623 1.6106 -5.0676 {"}'M' green -9.7843 1.5715 -5.2655 {"}'M' green -9.941 1.4594 -5.4369 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE1128 A}'M' greentint -10.0418 1.0882 -4.692 {"}'M' greentint -9.9083 1.3061 -4.7455 {"}'M' greentint -10.0693 1.278 -4.9455 {"}'M' greentint -10.2174 1.126 -5.0943 {"}'M' greentint -9.7199 1.4759 -4.8122 {"}'M' greentint -9.8788 1.4791 -5.0181 {"}'M' greentint -10.039 1.388 -5.2009 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL1116 A}'M' sea -10.4762 1.0482 -5.1382 {"}'M' green -10.33 0.9849 -4.9324 {"}'M' green -10.1728 0.9803 -4.7268 {"}'M' green -10.0102 1.036 -4.5326 {"}'M' green -9.8524 1.1463 -4.3592 {"}'M' sea -10.372 1.2752 -5.3842 {"}'M' green -10.2464 1.1628 -5.1903 {"}'M' green -9.6328 1.3763 -4.4568 {"}'M' green -10.1182 1.3745 -5.3419 {"}'M' green -9.5255 1.5751 -4.6306 {"}'M' green -9.9785 1.6091 -5.4164 {"}'M' green -9.5326 1.6885 -4.8627 {"}'M' green -9.7329 1.7353 -5.2513 {"}'M' sea -9.5741 1.8327 -5.0737 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL1116 A}'M' greentint -10.0984 1.1157 -4.9859 {"}'M' greentint -9.9393 1.1382 -4.7854 {"}'M' greentint -9.7795 1.2268 -4.6044 {"}'M' greentint -9.9798 1.2977 -5.1404 {"}'M' greentint -9.821 1.3087 -4.9395 {"}'M' greentint -9.664 1.4046 -4.7621 {"}'M' greentint -9.8455 1.5055 -5.2161 {"}'M' greentint -9.6824 1.5347 -5.0135 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n his A 163 1vpsA_165F_240}P -10.968 -1.4552 1.5162 {"}-10.968 -1.4552 1.5162 { ca his A 163 1vpsA_165F_240}-10.8321 -1.9665 0.1593 { c his A 163 1vpsA_165F_240}-10.5943 -0.8263 -0.8234 { o his A 163 1vpsA_165F_240}-11.4123 0.0937 -0.9297 { c his A 163 1vpsA_165F_240}P -10.5943 -0.8263 -0.8234 { n val A 164 1vpsA_165F_240}-9.4585 -0.8623 -1.5116 { ca val A 164 1vpsA_165F_240}-9.1404 0.1607 -2.4998 { c val A 164 1vpsA_165F_240}-8.4406 -0.4996 -3.679 { o val A 164 1vpsA_165F_240}-7.6299 -1.4149 -3.4917 { c val A 164 1vpsA_165F_240}P -8.4406 -0.4996 -3.679 { n phe A 165 1vpsA_165F_240}-8.7889 -0.0813 -4.8914 { ca phe A 165 1vpsA_165F_240}-8.1227 -0.5879 -6.085 { c phe A 165 1vpsA_165F_240}-7.9616 0.5797 -7.0524 { o phe A 165 1vpsA_165F_240}-8.7272 1.5482 -7.0006 { c phe A 165 1vpsA_165F_240}P -7.9616 0.5797 -7.0524 { n ala A 166 1vpsA_165F_240}-6.9276 0.5129 -7.8848 { ca ala A 166 1vpsA_165F_240}-6.6409 1.5677 -8.8428 { c ala A 166 1vpsA_165F_240}-5.9901 0.9926 -10.093 { o ala A 166 1vpsA_165F_240}-5.3502 -0.064 -10.0436 { c ala A 166 1vpsA_165F_240}P -5.9901 0.9926 -10.093 { n val A 167 1vpsA_165F_240}-6.2174 1.6643 -11.2148 { ca val A 167 1vpsA_165F_240}-5.6459 1.2832 -12.5016 { c val A 167 1vpsA_165F_240}-5.1724 2.5931 -13.1173 { o val A 167 1vpsA_165F_240}-5.9344 3.5652 -13.1674 { n arg A 238 1vpsA_165F_240}P -7.4464 5.9053 -12.0923 {"}-7.4464 5.9053 -12.0923 { ca arg A 238 1vpsA_165F_240}-8.7851 5.9136 -11.5212 { c arg A 238 1vpsA_165F_240}-8.6865 5.0164 -10.2828 { o arg A 238 1vpsA_165F_240}-8.1788 3.8924 -10.3816 { c arg A 238 1vpsA_165F_240}P -8.6865 5.0164 -10.2828 { n tyr A 239 1vpsA_165F_240}-9.0687 5.5419 -9.1173 { ca tyr A 239 1vpsA_165F_240}-9.0402 4.763 -7.8768 { c tyr A 239 1vpsA_165F_240}-10.407 4.7794 -7.2025 { o tyr A 239 1vpsA_165F_240}-11.1678 5.744 -7.3381 { c tyr A 239 1vpsA_165F_240}P -10.407 4.7794 -7.2025 { n phe A 240 1vpsA_165F_240}-10.7138 3.6989 -6.49 { ca phe A 240 1vpsA_165F_240}-11.9962 3.5344 -5.8111 { c phe A 240 1vpsA_165F_240}-11.7299 2.903 -4.4435 { o phe A 240 1vpsA_165F_240}-11.1892 1.8009 -4.3568 { c phe A 240 1vpsA_165F_240}P -11.7299 2.903 -4.4435 { n gly A 241 1vpsA_165F_240}-12.1127 3.5891 -3.3768 { ca gly A 241 1vpsA_165F_240}-11.8736 3.0464 -2.0581 { c gly A 241 1vpsA_165F_240}-13.0352 3.1965 -1.1014 { o gly A 241 1vpsA_165F_240}-13.9394 4.0206 -1.3018 { c gly A 241 1vpsA_165F_240}P -13.0352 3.1965 -1.1014 { n asn A 242 1vpsA_165F_240}-13.0478 2.3398 -0.089 { ca asn A 242 1vpsA_165F_240}-14.0756 2.3858 0.9392 { c asn A 242 1vpsA_165F_240}-13.5284 1.8214 2.2399 { o asn A 242 1vpsA_165F_240}-12.6747 0.9319 2.246 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n his A 163 1vpsA_165F_240}P -10.968 -1.4552 1.5162 { ca his A 163 1vpsA_165F_240}P -10.8321 -1.9665 0.1593 { n val A 164 1vpsA_165F_240}P -9.4585 -0.8623 -1.5116 { ca val A 164 1vpsA_165F_240}P -9.1404 0.1607 -2.4998 { n phe A 165 1vpsA_165F_240}P -8.7889 -0.0813 -4.8914 { ca phe A 165 1vpsA_165F_240}P -8.1227 -0.5879 -6.085 { n ala A 166 1vpsA_165F_240}P -6.9276 0.5129 -7.8848 { ca ala A 166 1vpsA_165F_240}P -6.6409 1.5677 -8.8428 { n val A 167 1vpsA_165F_240}P -6.2174 1.6643 -11.2148 { ca val A 167 1vpsA_165F_240}P -5.6459 1.2832 -12.5016 { n arg A 238 1vpsA_165F_240}P -7.4464 5.9053 -12.0923 { ca arg A 238 1vpsA_165F_240}P -8.7851 5.9136 -11.5212 { n tyr A 239 1vpsA_165F_240}P -9.0687 5.5419 -9.1173 { ca tyr A 239 1vpsA_165F_240}P -9.0402 4.763 -7.8768 { n phe A 240 1vpsA_165F_240}P -10.7138 3.6989 -6.49 { ca phe A 240 1vpsA_165F_240}P -11.9962 3.5344 -5.8111 { n gly A 241 1vpsA_165F_240}P -12.1127 3.5891 -3.3768 { ca gly A 241 1vpsA_165F_240}P -11.8736 3.0464 -2.0581 {"}P -11.8736 3.0464 -2.0581 { n asn A 242 1vpsA_165F_240}P -13.0478 2.3398 -0.089 { ca asn A 242 1vpsA_165F_240}P -14.0756 2.3858 0.9392 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca his A 163 1vpsA_165F_240}P -10.8321 -1.9665 0.1593 {"}-10.8321 -1.9665 0.1593 { ca val A 164 1vpsA_165F_240}-9.1404 0.1607 -2.4998 { ca phe A 165 1vpsA_165F_240}-8.1227 -0.5879 -6.085 { ca ala A 166 1vpsA_165F_240}-6.6409 1.5677 -8.8428 { ca val A 167 1vpsA_165F_240}-5.6459 1.2832 -12.5016 { ca arg A 238 1vpsA_165F_240}P -8.7851 5.9136 -11.5212 {"}-8.7851 5.9136 -11.5212 { ca tyr A 239 1vpsA_165F_240}-9.0402 4.763 -7.8768 { ca phe A 240 1vpsA_165F_240}-11.9962 3.5344 -5.8111 { ca gly A 241 1vpsA_165F_240}-11.8736 3.0464 -2.0581 { ca asn A 242 1vpsA_165F_240}-14.0756 2.3858 0.9392 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 165 1vpsA_165F_240}P -8.1227 -0.5879 -6.085 { cb phe A 165 1vpsA_165F_240}-8.8496 -1.7831 -6.7237 { cg phe A 165 1vpsA_165F_240}-10.1216 -1.4249 -7.4503 { cd1 phe A 165 1vpsA_165F_240}-11.3379 -1.3821 -6.7728 { ce1 phe A 165 1vpsA_165F_240}-12.5224 -1.1173 -7.4508 { cz phe A 165 1vpsA_165F_240}-12.5061 -0.9046 -8.8271 { cg phe A 165 1vpsA_165F_240}P -10.1216 -1.4249 -7.4503 { cd2 phe A 165 1vpsA_165F_240}-10.1138 -1.2101 -8.8284 { ce2 phe A 165 1vpsA_165F_240}-11.2961 -0.9435 -9.5192 { cz phe A 165 1vpsA_165F_240}ghost -12.5061 -0.9046 -8.8271 { ca phe A 240 1vpsA_165F_240}P -11.9962 3.5344 -5.8111 { cb phe A 240 1vpsA_165F_240}-12.9037 2.5947 -6.6302 { cg phe A 240 1vpsA_165F_240}-12.9502 2.9068 -8.1151 { cd1 phe A 240 1vpsA_165F_240}-11.897 2.5306 -8.9633 { ce1 phe A 240 1vpsA_165F_240}-11.9393 2.7999 -10.3385 { cz phe A 240 1vpsA_165F_240}-13.0398 3.4514 -10.8806 { cg phe A 240 1vpsA_165F_240}P -12.9502 2.9068 -8.1151 { cd2 phe A 240 1vpsA_165F_240}-14.0476 3.5607 -8.6671 { ce2 phe A 240 1vpsA_165F_240}-14.1004 3.8343 -10.044 { cz phe A 240 1vpsA_165F_240}ghost -13.0398 3.4514 -10.8806 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 165 1vpsA_165F_240}P -8.8496 -1.7831 -6.7237 {"}P -8.8496 -1.7831 -6.7237 { cd1 phe A 165 1vpsA_165F_240}P -11.3379 -1.3821 -6.7728 { cd2 phe A 165 1vpsA_165F_240}P -10.1138 -1.2101 -8.8284 { ce1 phe A 165 1vpsA_165F_240}P -12.5224 -1.1173 -7.4508 { ce2 phe A 165 1vpsA_165F_240}P -11.2961 -0.9435 -9.5192 { cz phe A 165 1vpsA_165F_240}P -12.5061 -0.9046 -8.8271 { cb phe A 240 1vpsA_165F_240}P -12.9037 2.5947 -6.6302 {"}P -12.9037 2.5947 -6.6302 { cd1 phe A 240 1vpsA_165F_240}P -11.897 2.5306 -8.9633 { cd2 phe A 240 1vpsA_165F_240}P -14.0476 3.5607 -8.6671 { ce1 phe A 240 1vpsA_165F_240}P -11.9393 2.7999 -10.3385 { ce2 phe A 240 1vpsA_165F_240}P -14.1004 3.8343 -10.044 { cz phe A 240 1vpsA_165F_240}P -13.0398 3.4514 -10.8806 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 165 A}'S' blue -11.9757 0.149 -6.2151 {"}'S' blue -11.7189 0.2503 -6.2684 {"}'S' sky -11.8748 0.2559 -6.4725 {"}'S' blue -11.5923 0.3311 -6.5187 {"}'S' sky -11.7499 0.318 -6.7192 { CE1 PHE 165 A}'S' sky -12.7512 0.613 -7.5826 {"}'S' sky -11.8445 0.3419 -6.7634 {"}'S' sky -12.4107 0.6249 -7.5745 { CE2 PHE 165 A}'S' sky -11.3938 0.5489 -8.611 {"}'S' blue -11.1282 0.5737 -8.6637 {"}'S' blue -12.0263 0.6143 -9.8372 {"}'S' blue -10.9256 0.6221 -8.8301 {"}'S' sky -11.6888 0.7301 -9.8467 {"}'S' blue -11.85 0.6364 -10.0285 {"}'S' sky -10.8784 0.7313 -9.2281 {"}'S' sky -11.0275 0.7843 -9.4354 {"}'S' sky -11.3466 0.7752 -9.8455 {"}'S' blue -11.5102 0.7137 -10.0397 {"}'S' blue -11.671 0.6153 -10.22 { CZ PHE 165 A}'S' blue -12.8871 0.7278 -8.3226 {"}'S' blue -13.043 0.7334 -8.5267 {"}'S' sky -12.4661 0.7156 -8.1665 {"}'S' sky -12.9181 0.7955 -8.7735 {"}'S' sky -12.1355 0.661 -8.138 {"}'S' sky -12.8988 0.7691 -9.1546 {"}'S' sky -12.2959 0.636 -9.6297 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 165 A}'S' sea -12.7451 0.1723 -6.2894 {"}'S' green -12.8673 0.2986 -6.4818 {"}'S' green -13.0072 0.3796 -6.6847 {"}'S' sea -13.1602 0.4138 -6.8931 {"}'S' sea -12.5026 0.246 -6.3541 {"}'S' green -12.6201 0.375 -6.5426 {"}'S' green -12.9035 0.5151 -6.9464 {"}'S' sea -13.0594 0.5206 -7.1505 {"}'S' sea -12.2418 0.2621 -6.4116 {"}'S' green -12.3545 0.3999 -6.5953 {"}'S' green -12.7768 0.5959 -7.1967 {"}'S' sea -12.9345 0.5828 -7.3972 {"}'S' sea -12.0332 0.3146 -6.5707 {"}'S' green -12.1519 0.4483 -6.7617 {"}'S' green -12.433 0.6075 -7.1704 {"}'S' green -12.5897 0.6305 -7.3777 {"}'S' sea -11.9668 0.4665 -6.9573 {"}'S' green -12.1047 0.5575 -7.1597 {"}'S' sea -12.2538 0.6105 -7.367 { CE2 PHE 165 A}'S' sea -11.5292 0.639 -8.8098 {"}'S' green -11.6772 0.6889 -9.0148 {"}'S' green -11.8331 0.6944 -9.2189 {"}'S' sea -11.2562 0.6766 -8.8587 {"}'S' green -11.3986 0.7425 -9.0615 {"}'S' green -11.5505 0.7697 -9.2651 {"}'S' green -11.7082 0.7566 -9.4656 {"}'S' sea -11.869 0.704 -9.6581 {"}'S' sea -11.0599 0.7205 -9.0311 {"}'S' sea -11.2067 0.7813 -9.2388 {"}'S' green -11.3634 0.8043 -9.4461 {"}'S' sea -11.5249 0.7868 -9.651 {"}'S' sea -11.1844 0.7987 -9.6429 { CZ PHE 165 A}'S' sea -12.6086 0.7814 -8.3694 {"}'S' sea -12.7605 0.8086 -8.573 {"}'S' sea -12.2699 0.7594 -8.339 {"}'S' green -12.4167 0.8202 -8.5466 {"}'S' green -12.5733 0.8432 -8.754 {"}'S' green -12.7349 0.8257 -8.9589 {"}'S' sea -11.9505 0.6792 -8.3335 {"}'S' green -12.0884 0.7702 -8.536 {"}'S' green -12.2375 0.8233 -8.7433 {"}'S' green -12.3944 0.8376 -8.9508 {"}'S' green -12.5565 0.8141 -9.1533 {"}'S' sea -12.7202 0.7527 -9.3475 {"}'S' sea -11.7425 0.6325 -8.4846 {"}'S' green -11.8796 0.7234 -8.6876 {"}'S' green -12.0283 0.7771 -8.8945 {"}'S' green -12.1859 0.7944 -9.1019 {"}'S' green -12.3476 0.7714 -9.3058 {"}'S' sea -12.5108 0.7107 -9.4996 {"}'S' sea -11.6673 0.6312 -8.8156 {"}'S' green -11.815 0.6907 -9.0224 {"}'S' green -11.9708 0.7121 -9.2301 {"}'S' sea -12.1324 0.6933 -9.4347 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 165 A}'S' P -12.7555 0.4652 -6.7414 {"}'S' -12.7541 0.4517 -6.7483 {"}'S' P -12.4825 0.5028 -6.7903 {"}'S' -12.4838 0.4702 -6.8035 {"}'S' P -12.6249 0.5687 -6.9931 {"}'S' -12.6235 0.54 -7.0001 {"}'S' P -12.2862 0.5467 -6.9627 {"}'S' -12.2875 0.5361 -6.9654 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 240 A}'S' blue -13.1096 1.2059 -8.4932 {"}'S' blue -12.9573 1.1651 -8.2859 {"}'S' blue -12.7979 1.1644 -8.0781 { CD1 PHE 240 A}'S' sky -12.9335 1.1251 -8.8526 {"}'S' sky -12.4815 1.0452 -8.2457 {"}'S' blue -12.0304 1.0301 -8.0734 {"}'S' sky -11.4181 0.9019 -8.5367 {"}'S' blue -12.0691 1.0166 -9.8252 {"}'S' blue -11.1712 0.9691 -8.6504 {"}'S' sky -11.4882 1.0708 -9.8383 {"}'S' sky -11.0219 1.0382 -9.2259 {"}'S' blue -11.0981 1.1441 -9.6721 {"}'S' blue -10.9396 1.1561 -9.4702 { CE1 PHE 240 A}'S' blue -11.8935 1.0795 -10.0183 {"}'S' blue -11.7869 1.0575 -10.3016 {"}'S' blue -11.6231 1.0955 -10.1018 {"}'S' blue -11.3715 1.1499 -10.2061 { HB2 PHE 240 A}'S' sky -13.1929 0.586 -6.6148 {"}'S' blue -12.1801 0.5082 -6.1475 {"}'S' sky -12.018 0.5306 -6.3549 {"}'S' blue -11.8676 0.6619 -6.1964 {"}'S' blue -11.7612 0.7039 -6.4382 {"}'S' sky -11.8418 0.7043 -6.8492 { HD1 PHE 240 A}'S' blue -11.0253 1.0281 -8.7003 {"}'S' blue -10.8204 1.0864 -8.8522 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 240 A}'S' sea -12.7911 1.0592 -8.6497 {"}'S' sea -12.6392 1.032 -8.4462 {"}'S' sea -12.8098 1.042 -9.0832 {"}'S' green -12.6686 0.962 -8.8788 {"}'S' green -12.5166 0.9207 -8.6703 {"}'S' green -12.3569 0.9177 -8.4632 {"}'S' sea -12.194 0.9545 -8.2626 {"}'S' sea -12.6565 0.9903 -9.2994 {"}'S' green -12.5189 0.9002 -9.0959 {"}'S' green -12.3698 0.8472 -8.8886 {"}'S' green -12.2121 0.8327 -8.6817 {"}'S' green -12.05 0.8562 -8.4791 {"}'S' sea -11.8872 0.9177 -8.2843 {"}'S' sea -12.4567 0.95 -9.4632 {"}'S' green -12.3193 0.8582 -9.2612 {"}'S' green -12.1706 0.8044 -9.0543 {"}'S' green -12.0134 0.7881 -8.8459 {"}'S' green -11.8513 0.8101 -8.643 {"}'S' sea -11.6889 0.8709 -8.4486 {"}'S' sea -12.1985 0.908 -9.5466 {"}'S' green -12.0564 0.8297 -9.3414 {"}'S' green -11.9041 0.7888 -9.1341 {"}'S' green -11.7447 0.7881 -8.9263 {"}'S' sea -11.5809 0.8262 -8.7265 {"}'S' sea -11.9407 0.913 -9.6295 {"}'S' green -11.7996 0.8462 -9.4282 {"}'S' green -11.6473 0.8184 -9.2239 {"}'S' green -11.4896 0.8302 -9.0231 {"}'S' sea -11.3293 0.8805 -8.8308 {"}'S' sea -11.7289 0.9847 -9.7665 {"}'S' green -11.5869 0.9167 -9.5638 {"}'S' green -11.4342 0.8897 -9.3591 {"}'S' green -11.2752 0.9066 -9.1576 {"}'S' sea -11.1137 0.9655 -8.9657 {"}'S' sea -11.3418 1.012 -9.6315 {"}'S' sea -11.184 1.0003 -9.4252 { HB2 PHE 240 A}'S' sea -13.0555 0.5045 -6.4153 {"}'S' sea -13.1406 0.6854 -7.007 {"}'S' green -13.0318 0.5447 -6.8279 {"}'S' green -12.9011 0.4504 -6.6328 {"}'S' green -12.7538 0.4087 -6.4305 {"}'S' sea -12.5983 0.4207 -6.2326 {"}'S' sea -12.9902 0.8062 -7.2784 {"}'S' green -12.9026 0.6301 -7.115 {"}'S' green -12.4975 0.392 -6.5257 {"}'S' sea -12.3381 0.4224 -6.3285 {"}'S' green -12.7122 0.7334 -7.309 {"}'S' green -12.1757 0.4545 -6.5377 {"}'S' sea -12.476 0.8144 -7.3926 {"}'S' green -12.3724 0.6557 -7.2147 {"}'S' green -12.2375 0.5608 -7.0138 {"}'S' green -12.0817 0.5366 -6.8056 {"}'S' sea -11.9184 0.5855 -6.609 {"}'S' sea -12.1352 0.7685 -7.2479 {"}'S' sea -11.9981 0.6935 -7.0484 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 PHE 240 A}'S' P -12.7864 0.4983 -6.9295 {"}'S' -12.7833 0.5123 -6.9234 {"}'S' P -12.6498 0.4169 -6.7294 {"}'S' -12.6477 0.4414 -6.7253 {"}'S' P -12.6096 0.5806 -7.1339 {"}'S' -12.6088 0.5896 -7.128 {"}'S' P -12.4812 0.4798 -6.9388 {"}'S' -12.4835 0.5133 -6.9256 {"}'S' P -12.3339 0.4368 -6.7362 {"}'S' -12.3371 0.451 -6.7335 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 165 A}'M' green -9.8993 1.9406 -6.3442 {"}'M' green -9.503 2.1621 -6.0104 {"}'M' green -9.1691 2.5587 -6.1384 {"}'M' green -9.0682 2.7552 -6.3786 {"}'M' green -9.2868 2.8306 -7.0465 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 165 A}'M' greentint -9.7404 2.0293 -6.1626 {"}'M' greentint -9.6373 2.2619 -6.2116 {"}'M' greentint -9.8006 2.2285 -6.4135 {"}'M' greentint -9.9492 2.0716 -6.562 {"}'M' greentint -9.3556 2.3877 -6.074 {"}'M' greentint -9.4934 2.467 -6.2736 {"}'M' greentint -9.6514 2.4586 -6.4756 {"}'M' greentint -9.81 2.3655 -6.654 {"}'M' greentint -9.9492 2.1975 -6.7872 {"}'M' greentint -9.3082 2.6371 -6.3396 {"}'M' greentint -9.4644 2.6477 -6.5435 {"}'M' greentint -9.6246 2.5895 -6.7355 {"}'M' greentint -9.7794 2.4664 -6.9001 {"}'M' greentint -9.9151 2.2889 -7.0263 {"}'M' greentint -9.2211 2.7911 -6.5855 {"}'M' greentint -9.3812 2.7671 -6.7869 {"}'M' greentint -9.5437 2.6855 -6.9732 {"}'M' greentint -9.6959 2.5496 -7.1332 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 240 A}'M' green -10.0311 2.0701 -6.8838 {"}'M' green -9.2968 2.4206 -6.0318 {"}'M' green -9.1784 2.8616 -6.7739 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 240 A}'M' greentint -9.8897 1.997 -6.6807 {"}'M' greentint -9.7315 1.9993 -6.4769 {"}'M' greentint -9.5709 2.0752 -6.2901 {"}'M' greentint -9.4213 2.2206 -6.1377 {"}'M' greentint -9.9027 2.2967 -7.1239 {"}'M' greentint -9.7866 2.1597 -6.9357 {"}'M' greentint -9.6378 2.1101 -6.7296 {"}'M' greentint -9.4755 2.155 -6.5317 {"}'M' greentint -9.3213 2.2876 -6.37 {"}'M' greentint -9.197 2.4909 -6.2653 {"}'M' greentint -9.6586 2.3953 -7.0982 {"}'M' greentint -9.5269 2.2936 -6.9 {"}'M' greentint -9.3658 2.3216 -6.7001 {"}'M' greentint -9.2178 2.4736 -6.5512 {"}'M' greentint -9.123 2.7077 -6.4939 {"}'M' greentint -9.4976 2.6666 -7.1314 {"}'M' greentint -9.3934 2.5114 -6.9536 {"}'M' greentint -9.2334 2.6083 -6.7741 {"}'M' greentint -9.3117 2.758 -6.9734 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 165 A}'M' green -10.4221 0.653 -4.6647 {"}'M' green -10.103 0.848 -4.3072 {"}'M' green -10.4938 0.5532 -4.8954 {"}'M' green -9.9419 1.1193 -4.3404 {"}'M' green -10.4492 0.9044 -5.1983 {"}'M' green -9.7504 1.2961 -4.4043 {"}'M' green -9.7884 1.5256 -4.8607 {"}'M' green -9.9497 1.4864 -5.0586 {"}'M' green -10.1063 1.3744 -5.23 {"}'M' green -10.2449 1.1997 -5.3607 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 165 A}'M' greentint -10.2888 0.7566 -4.4652 {"}'M' greentint -10.2072 1.0032 -4.485 {"}'M' greentint -10.3671 0.9063 -4.6645 {"}'M' greentint -10.4775 0.8069 -4.9447 {"}'M' greentint -10.0737 1.221 -4.5386 {"}'M' greentint -10.2347 1.193 -4.7386 {"}'M' greentint -10.3827 1.041 -4.8874 {"}'M' greentint -9.8852 1.3909 -4.6052 {"}'M' greentint -10.0441 1.3941 -4.8111 {"}'M' greentint -10.2044 1.303 -4.994 {"}'M' greentint -10.3458 1.1325 -5.1295 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 240 A}'M' sea -10.6109 0.563 -4.663 {"}'M' green -10.4483 0.6187 -4.4689 {"}'M' green -10.2905 0.729 -4.2954 {"}'M' sea -10.1451 0.8907 -4.1524 {"}'M' green -10.5366 0.6984 -4.9221 {"}'M' green -9.9472 1.1588 -4.2883 {"}'M' green -10.5563 0.9572 -5.2781 {"}'M' green -9.8607 1.3813 -4.496 {"}'M' green -10.4166 1.1918 -5.3526 {"}'M' green -9.8754 1.5074 -4.7414 {"}'M' sea -9.9569 1.6667 -5.0088 {"}'M' green -10.0973 1.5659 -5.2016 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 240 A}'M' greentint -10.3774 0.7209 -4.7216 {"}'M' greentint -10.2177 0.8094 -4.5406 {"}'M' greentint -10.0709 0.959 -4.393 {"}'M' greentint -10.4179 0.8804 -5.0766 {"}'M' greentint -10.2591 0.8914 -4.8757 {"}'M' greentint -10.1021 0.9873 -4.6983 {"}'M' greentint -9.9636 1.1578 -4.5668 {"}'M' greentint -10.2836 1.0882 -5.1524 {"}'M' greentint -10.1205 1.1174 -4.9497 {"}'M' greentint -9.9707 1.2711 -4.7989 {"}'M' greentint -10.171 1.318 -5.1876 {"}'M' greentint -10.0123 1.4154 -5.0099 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 109 1vr8A_111F_122}P -11.6569 -1.669 1.2009 {"}-11.6569 -1.669 1.2009 { ca gly A 109 1vr8A_111F_122}-10.9234 -1.9895 0.004 { c gly A 109 1vr8A_111F_122}-10.5673 -0.7591 -0.795 { o gly A 109 1vr8A_111F_122}-11.2406 0.2791 -0.7031 { c gly A 109 1vr8A_111F_122}P -10.5673 -0.7591 -0.795 { n lys A 110 1vr8A_111F_122}-9.5096 -0.8885 -1.5858 { ca lys A 110 1vr8A_111F_122}-9.0713 0.14 -2.4843 { c lys A 110 1vr8A_111F_122}-8.4545 -0.5271 -3.7122 { o lys A 110 1vr8A_111F_122}-7.6834 -1.4693 -3.5745 { c lys A 110 1vr8A_111F_122}P -8.4545 -0.5271 -3.7122 { n phe A 111 1vr8A_111F_122}-8.8125 -0.0502 -4.8983 { ca phe A 111 1vr8A_111F_122}-8.0755 -0.3987 -6.1013 { c phe A 111 1vr8A_111F_122}-7.691 0.8235 -6.8937 { o phe A 111 1vr8A_111F_122}-8.3245 1.8724 -6.7926 { c phe A 111 1vr8A_111F_122}P -7.691 0.8235 -6.8937 { n ser A 112 1vr8A_111F_122}-6.6186 0.6759 -7.6567 { ca ser A 112 1vr8A_111F_122}-6.1764 1.6694 -8.6258 { c ser A 112 1vr8A_111F_122}-5.9568 1.0155 -9.9707 { o ser A 112 1vr8A_111F_122}-5.3765 -0.0811 -10.0619 { c ser A 112 1vr8A_111F_122}P -5.9568 1.0155 -9.9707 { n thr A 113 1vr8A_111F_122}-6.3633 1.7003 -11.0311 { ca thr A 113 1vr8A_111F_122}-6.1845 1.1733 -12.3617 { c thr A 113 1vr8A_111F_122}-6.1091 2.3237 -13.3722 { o thr A 113 1vr8A_111F_122}-6.1789 3.5018 -13.0069 { n ile A 120 1vr8A_111F_122}P -7.9944 5.6913 -12.4062 {"}-7.9944 5.6913 -12.4062 { ca ile A 120 1vr8A_111F_122}-9.1877 5.4195 -11.6221 { c ile A 120 1vr8A_111F_122}-8.7499 4.8449 -10.2706 { o ile A 120 1vr8A_111F_122}-7.9842 3.8771 -10.2044 { c ile A 120 1vr8A_111F_122}P -8.7499 4.8449 -10.2706 { n val A 121 1vr8A_111F_122}-9.2364 5.4639 -9.2089 { ca val A 121 1vr8A_111F_122}-9.0071 4.9922 -7.8515 { c val A 121 1vr8A_111F_122}-10.3604 4.8416 -7.1479 { o val A 121 1vr8A_111F_122}-11.173 5.7784 -7.1223 { c val A 121 1vr8A_111F_122}P -10.3604 4.8416 -7.1479 { n ala A 122 1vr8A_111F_122}-10.6337 3.6665 -6.5885 { ca ala A 122 1vr8A_111F_122}-11.9487 3.3989 -6.0109 { c ala A 122 1vr8A_111F_122}-11.7438 2.7537 -4.6454 { o ala A 122 1vr8A_111F_122}-10.9685 1.8001 -4.5404 { c ala A 122 1vr8A_111F_122}P -11.7438 2.7537 -4.6454 { n trp A 123 1vr8A_111F_122}-12.4597 3.2473 -3.6313 { ca trp A 123 1vr8A_111F_122}-12.3257 2.6659 -2.2935 { c trp A 123 1vr8A_111F_122}-13.6622 2.6623 -1.5715 { o trp A 123 1vr8A_111F_122}-14.5612 3.459 -1.8816 { c trp A 123 1vr8A_111F_122}P -13.6622 2.6623 -1.5715 { n trp A 124 1vr8A_111F_122}-13.791 1.7192 -0.6419 { ca trp A 124 1vr8A_111F_122}-14.975 1.5995 0.1868 { c trp A 124 1vr8A_111F_122}-14.5512 1.3681 1.6341 { o trp A 124 1vr8A_111F_122}-13.4841 0.7994 1.9082 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 109 1vr8A_111F_122}P -11.6569 -1.669 1.2009 { ca gly A 109 1vr8A_111F_122}P -10.9234 -1.9895 0.004 {"}P -10.9234 -1.9895 0.004 { n lys A 110 1vr8A_111F_122}P -9.5096 -0.8885 -1.5858 { ca lys A 110 1vr8A_111F_122}P -9.0713 0.14 -2.4843 { n phe A 111 1vr8A_111F_122}P -8.8125 -0.0502 -4.8983 { ca phe A 111 1vr8A_111F_122}P -8.0755 -0.3987 -6.1013 { n ser A 112 1vr8A_111F_122}P -6.6186 0.6759 -7.6567 { ca ser A 112 1vr8A_111F_122}P -6.1764 1.6694 -8.6258 { n thr A 113 1vr8A_111F_122}P -6.3633 1.7003 -11.0311 { ca thr A 113 1vr8A_111F_122}P -6.1845 1.1733 -12.3617 { n ile A 120 1vr8A_111F_122}P -7.9944 5.6913 -12.4062 { ca ile A 120 1vr8A_111F_122}P -9.1877 5.4195 -11.6221 { n val A 121 1vr8A_111F_122}P -9.2364 5.4639 -9.2089 { ca val A 121 1vr8A_111F_122}P -9.0071 4.9922 -7.8515 { n ala A 122 1vr8A_111F_122}P -10.6337 3.6665 -6.5885 { ca ala A 122 1vr8A_111F_122}P -11.9487 3.3989 -6.0109 { n trp A 123 1vr8A_111F_122}P -12.4597 3.2473 -3.6313 { ca trp A 123 1vr8A_111F_122}P -12.3257 2.6659 -2.2935 { n trp A 124 1vr8A_111F_122}P -13.791 1.7192 -0.6419 { ca trp A 124 1vr8A_111F_122}P -14.975 1.5995 0.1868 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 109 1vr8A_111F_122}P -10.9234 -1.9895 0.004 {"}-10.9234 -1.9895 0.004 { ca lys A 110 1vr8A_111F_122}-9.0713 0.14 -2.4843 { ca phe A 111 1vr8A_111F_122}-8.0755 -0.3987 -6.1013 { ca ser A 112 1vr8A_111F_122}-6.1764 1.6694 -8.6258 { ca thr A 113 1vr8A_111F_122}-6.1845 1.1733 -12.3617 { ca ile A 120 1vr8A_111F_122}P -9.1877 5.4195 -11.6221 {"}-9.1877 5.4195 -11.6221 { ca val A 121 1vr8A_111F_122}-9.0071 4.9922 -7.8515 { ca ala A 122 1vr8A_111F_122}-11.9487 3.3989 -6.0109 { ca trp A 123 1vr8A_111F_122}-12.3257 2.6659 -2.2935 { ca trp A 124 1vr8A_111F_122}-14.975 1.5995 0.1868 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 111 1vr8A_111F_122}P -8.0755 -0.3987 -6.1013 { cb phe A 111 1vr8A_111F_122}-8.7789 -1.4597 -6.9675 { cg phe A 111 1vr8A_111F_122}-10.0467 -0.9897 -7.6541 { cd1 phe A 111 1vr8A_111F_122}-9.9916 -0.1982 -8.8223 { ce1 phe A 111 1vr8A_111F_122}-11.1777 0.1979 -9.4761 { cz phe A 111 1vr8A_111F_122}-12.4174 -0.2264 -8.9923 { cg phe A 111 1vr8A_111F_122}P -10.0467 -0.9897 -7.6541 { cd2 phe A 111 1vr8A_111F_122}-11.2876 -1.4206 -7.213 { ce2 phe A 111 1vr8A_111F_122}-12.4758 -1.0384 -7.8648 { cz phe A 111 1vr8A_111F_122}ghost -12.4174 -0.2264 -8.9923 { ca ala A 122 1vr8A_111F_122}P -11.9487 3.3989 -6.0109 { cb ala A 122 1vr8A_111F_122}-12.7406 2.4764 -6.8929 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 111 1vr8A_111F_122}P -8.7789 -1.4597 -6.9675 {"}P -8.7789 -1.4597 -6.9675 { cd1 phe A 111 1vr8A_111F_122}P -9.9916 -0.1982 -8.8223 { cd2 phe A 111 1vr8A_111F_122}P -11.2876 -1.4206 -7.213 { ce1 phe A 111 1vr8A_111F_122}P -11.1777 0.1979 -9.4761 { ce2 phe A 111 1vr8A_111F_122}P -12.4758 -1.0384 -7.8648 { cz phe A 111 1vr8A_111F_122}P -12.4174 -0.2264 -8.9923 { cb ala A 122 1vr8A_111F_122}P -12.7406 2.4764 -6.8929 {"}P -12.7406 2.4764 -6.8929 {"}P -12.7406 2.4764 -6.8929 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 111 A}'S' blue -11.0801 0.3604 -7.2386 { CD2 PHE 111 A}'S' sky -11.9254 0.1105 -6.6553 {"}'S' sky -11.6686 0.2118 -6.7086 {"}'S' sky -11.3901 0.2655 -6.7554 {"}'S' blue -11.1982 0.3042 -6.9326 {"}'S' sky -11.3548 0.3272 -7.14 { CE1 PHE 111 A}'S' sky -11.7533 1.4977 -8.4559 {"}'S' blue -11.8956 1.5681 -8.6579 {"}'S' blue -11.1717 0.65 -7.7853 {"}'S' sky -11.1851 0.8948 -7.8714 {"}'S' sky -11.2297 1.1218 -7.991 {"}'S' sky -11.3015 1.3218 -8.14 {"}'S' blue -11.4004 1.4875 -8.3147 {"}'S' blue -11.5226 1.6138 -8.5072 { CE2 PHE 111 A}'S' blue -13.2746 0.4777 -7.5101 { CZ PHE 111 A}'S' sky -13.3352 0.9796 -8.1175 {"}'S' sky -13.2896 1.1615 -8.3787 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 111 A}'S' sea -11.542 0.2926 -6.9589 { CE1 PHE 111 A}'S' sea -11.4361 0.7734 -7.8433 {"}'S' green -11.4696 1.0054 -7.9506 {"}'S' green -11.5351 1.2085 -8.0933 {"}'S' sea -11.6318 1.3757 -8.2636 { CE2 PHE 111 A}'S' green -12.8207 0.3775 -6.8958 {"}'S' green -12.9606 0.4584 -7.0987 {"}'S' green -12.456 0.3248 -6.7681 {"}'S' green -12.8569 0.5939 -7.3604 {"}'S' sea -13.0128 0.5995 -7.5645 {"}'S' green -12.1952 0.341 -6.8256 {"}'S' sea -11.8865 0.2271 -6.8099 {"}'S' green -11.7979 0.4208 -7.1774 {"}'S' sea -11.59 0.3723 -7.3299 {"}'S' green -11.7122 0.4986 -7.5223 { CZ PHE 111 A}'S' sea -13.0734 0.7864 -7.7242 {"}'S' sea -13.1923 0.9131 -7.9139 {"}'S' green -12.8715 0.9515 -7.7798 {"}'S' green -12.993 1.0734 -7.9721 {"}'S' green -13.1353 1.1438 -8.174 {"}'S' green -12.9022 1.2705 -8.2262 {"}'S' sea -13.0552 1.3047 -8.4345 {"}'S' green -12.6506 1.3562 -8.2829 {"}'S' sea -12.7985 1.406 -8.4879 {"}'S' green -12.3775 1.3938 -8.3317 {"}'S' sea -12.5199 1.4597 -8.5346 {"}'S' green -11.6923 0.6277 -7.6477 {"}'S' green -11.9282 1.2055 -8.1122 {"}'S' green -12.0469 1.3392 -8.3032 {"}'S' sea -12.1813 1.4376 -8.5042 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 111 A}'S' P -12.5735 0.4539 -6.9566 {"}'S' -12.573 0.4384 -6.966 {"}'S' P -12.709 0.5441 -7.1554 {"}'S' -12.7048 0.5179 -7.1676 {"}'S' P -12.3079 0.4788 -7.0093 {"}'S' -12.3131 0.4266 -7.0387 {"}'S' P -12.4359 0.5817 -7.2043 {"}'S' -12.4385 0.499 -7.2386 {"}'S' P -12.5783 0.6476 -7.4072 {"}'S' -12.5743 0.5823 -7.4244 {"}'S' P -11.9866 0.3935 -6.9847 {"}'S' -11.9894 0.3853 -6.9902 {"}'S' P -12.1053 0.5272 -7.1757 {"}'S' -12.1217 0.4578 -7.2063 {"}'S' P -12.2396 0.6256 -7.3767 {"}'S' -12.2532 0.5314 -7.4045 {"}'S' P -11.9202 0.5454 -7.3713 {"}'S' -11.9345 0.5054 -7.3833 { CZ PHE 111 A}'S' P -12.7748 0.7843 -7.6095 {"}'S' -12.7693 0.7683 -7.6325 {"}'S' P -12.4694 0.6976 -7.5072 {"}'S' -12.4663 0.6531 -7.5783 {"}'S' P -12.5412 0.8976 -7.6562 {"}'S' -12.5341 0.8313 -7.7356 {"}'S' P -12.6401 1.0633 -7.8308 {"}'S' -12.6328 1.0162 -7.8733 {"}'S' P -12.7623 1.1896 -8.0233 {"}'S' -12.7586 1.1739 -8.0334 {"}'S' P -12.225 0.7782 -7.5727 {"}'S' -12.2383 0.7117 -7.668 {"}'S' P -12.2999 0.973 -7.723 {"}'S' -12.3083 0.8833 -7.8182 {"}'S' P -12.3976 1.1369 -7.8956 {"}'S' -12.3983 1.0665 -7.9523 {"}'S' P -12.5152 1.266 -8.084 {"}'S' -12.5147 1.2505 -8.0935 {"}'S' P -11.9712 0.7887 -7.6383 {"}'S' -11.9935 0.7386 -7.7052 {"}'S' P -12.0435 0.9841 -7.7852 {"}'S' -12.0655 0.9122 -7.8569 {"}'S' P -12.1369 1.1531 -7.953 {"}'S' -12.1484 1.0938 -7.998 {"}'S' P -12.2495 1.2908 -8.1368 {"}'S' -12.2494 1.2851 -8.1404 {"}'S' P -11.749 0.8452 -7.7816 {"}'S' -11.7575 0.8318 -7.797 {"}'S' P -11.8281 1.0391 -7.9374 {"}'S' -11.8373 1.019 -7.9539 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 122 A}'S' blue -13.3003 0.8958 -7.3928 {"}'S' sky -13.1628 0.804 -7.1908 {"}'S' sky -13.3695 1.2985 -8.0237 {"}'S' sky -13.1888 1.4684 -8.2511 {"}'S' sky -12.4689 1.7749 -8.4737 {"}'S' sky -12.174 1.65 -8.3275 {"}'S' sky -11.9221 1.7069 -8.2354 {"}'S' blue -11.6872 1.7985 -8.1147 { HB3 ALA 122 A}'S' blue -11.5136 0.6251 -6.7072 {"}'S' blue -11.4072 0.6671 -6.9491 {"}'S' blue -11.3316 0.7628 -7.1855 {"}'S' blue -11.3294 0.8805 -7.4468 {"}'S' blue -11.582 1.658 -7.9884 {"}'S' sky -11.4176 1.4878 -7.8735 {"}'S' sky -11.2899 1.3268 -7.7117 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 122 A}'S' sea -13.2786 1.1186 -7.8567 {"}'S' sea -13.1688 0.9695 -7.6725 {"}'S' sea -13.042 0.8539 -7.4763 {"}'S' green -13.1173 1.2715 -8.1051 {"}'S' green -13.0244 1.1017 -7.9377 {"}'S' green -12.9126 0.9624 -7.7548 {"}'S' sea -12.9593 1.571 -8.3745 {"}'S' green -12.8956 1.3644 -8.2352 {"}'S' sea -12.7165 1.6699 -8.4463 {"}'S' green -12.659 1.4553 -8.3118 {"}'S' green -12.4174 1.5563 -8.3465 {"}'S' green -12.3346 1.3715 -8.1877 { HB3 ALA 122 A}'S' green -12.9542 0.6808 -7.3117 {"}'S' green -12.8389 0.5492 -7.1256 {"}'S' green -12.7015 0.4677 -6.9262 {"}'S' green -12.5496 0.4419 -6.7229 {"}'S' green -12.7866 0.6486 -7.5178 {"}'S' green -12.2443 0.3838 -6.7435 {"}'S' green -11.9841 0.3856 -6.8393 {"}'S' green -11.8217 0.4177 -7.0486 {"}'S' sea -11.664 0.4937 -6.8658 {"}'S' green -11.7277 0.4998 -7.3164 {"}'S' green -11.9393 1.3399 -8.1307 {"}'S' green -11.6441 0.6567 -7.5593 {"}'S' sea -11.6778 1.4209 -8.0463 {"}'S' green -11.6942 1.1631 -7.9962 {"}'S' green -11.6264 0.9546 -7.8508 {"}'S' sea -11.473 1.2337 -7.8741 {"}'S' sea -11.368 1.0774 -7.6949 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB ALA 122 A}'S' P -12.8089 1.1853 -8.0723 {"}'S' -12.8089 1.193 -8.0655 {"}'S' P -12.5737 1.2697 -8.1495 {"}'S' -12.5744 1.2793 -8.1407 { HB3 ALA 122 A}'S' P -12.8678 0.831 -7.6738 {"}'S' -12.8678 0.831 -7.6738 {"}'S' P -12.6778 0.5079 -7.3387 {"}'S' -12.6568 0.5526 -7.3236 {"}'S' P -12.5471 0.4135 -7.1437 {"}'S' -12.5286 0.4736 -7.1355 {"}'S' P -12.3998 0.3719 -6.9414 {"}'S' -12.3947 0.403 -6.9432 {"}'S' P -12.6926 0.9811 -7.9197 {"}'S' -12.6687 1.0073 -7.8759 {"}'S' P -12.6362 0.7694 -7.7892 {"}'S' -12.6041 0.8249 -7.7306 {"}'S' P -12.5486 0.5932 -7.6258 {"}'S' -12.5256 0.6541 -7.5862 {"}'S' P -12.4324 0.4615 -7.4404 {"}'S' -12.4144 0.5476 -7.4047 {"}'S' P -12.2958 0.3801 -7.2403 {"}'S' -12.2878 0.4734 -7.2216 {"}'S' P -12.1434 0.3551 -7.0365 {"}'S' -12.1459 0.4029 -7.0355 {"}'S' P -12.4638 1.1205 -8.0728 {"}'S' -12.4496 1.1403 -8.0188 {"}'S' P -12.4293 0.8929 -7.9652 {"}'S' -12.4072 0.9547 -7.8705 {"}'S' P -12.3582 0.6965 -7.8198 {"}'S' -12.3414 0.7871 -7.7304 {"}'S' P -12.2556 0.5438 -7.6448 {"}'S' -12.2514 0.6234 -7.5923 {"}'S' P -12.1272 0.443 -7.4496 {"}'S' -12.1328 0.5227 -7.4174 {"}'S' P -11.9799 0.3999 -7.2471 {"}'S' -11.9898 0.4519 -7.2366 {"}'S' P -12.2058 1.2288 -8.1381 {"}'S' -12.2063 1.2354 -8.1146 {"}'S' P -12.1865 0.9865 -8.0461 {"}'S' -12.1876 1.0311 -7.9586 {"}'S' P -12.122 0.7776 -7.9035 {"}'S' -12.1297 0.8541 -7.8118 {"}'S' P -12.0184 0.6188 -7.7255 {"}'S' -12.0313 0.687 -7.6716 {"}'S' P -11.8835 0.524 -7.5246 {"}'S' -11.8891 0.5433 -7.5146 {"}'S' P -11.9389 1.0957 -8.0625 {"}'S' -11.9461 1.1071 -8.0338 {"}'S' P -11.8838 0.8845 -7.9338 {"}'S' -11.9012 0.919 -7.8834 {"}'S' P -11.7812 0.7317 -7.7587 {"}'S' -11.7927 0.7539 -7.7385 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 111 A}'M' green -9.0908 2.7912 -6.0656 {"}'M' green -9.6232 2.2305 -7.1728 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 111 A}'M' greentint -9.4967 2.2648 -6.1362 {"}'M' greentint -9.6402 2.1571 -6.4087 {"}'M' greentint -9.2347 2.5861 -6.0036 {"}'M' greentint -9.398 2.5527 -6.2054 {"}'M' greentint -9.5466 2.3958 -6.3539 {"}'M' greentint -9.6503 2.2994 -6.6514 {"}'M' greentint -9.7068 2.0499 -6.6547 {"}'M' greentint -9.2487 2.7828 -6.2676 {"}'M' greentint -9.4073 2.6897 -6.446 {"}'M' greentint -9.5465 2.5217 -6.5792 {"}'M' greentint -9.6199 2.3935 -6.8962 {"}'M' greentint -9.691 2.1483 -6.9204 {"}'M' greentint -9.0617 2.972 -6.3355 {"}'M' greentint -9.2219 2.9137 -6.5274 {"}'M' greentint -9.3767 2.7906 -6.6921 {"}'M' greentint -9.5124 2.6131 -6.8183 {"}'M' greentint -9.542 2.4736 -7.1345 {"}'M' greentint -9.1411 3.0098 -6.7652 {"}'M' greentint -9.2933 2.8738 -6.9252 {"}'M' greentint -9.4299 2.6922 -7.05 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 122 A}'M' greentint -9.5255 2.1086 -6.1366 {"}'M' greentint -9.3924 2.2842 -6.0135 {"}'M' greentint -9.6252 1.9817 -6.63 {"}'M' greentint -9.4645 2.0577 -6.4432 {"}'M' greentint -9.315 2.203 -6.2908 {"}'M' greentint -9.1904 2.403 -6.1849 {"}'M' greentint -9.1018 2.6406 -6.1369 {"}'M' greentint -9.5315 2.0925 -6.8827 {"}'M' greentint -9.3691 2.1374 -6.6848 {"}'M' greentint -9.2149 2.2701 -6.523 {"}'M' greentint -9.0907 2.4734 -6.4184 {"}'M' greentint -9.0124 2.7191 -6.3863 {"}'M' greentint -8.9914 2.9745 -6.4296 {"}'M' greentint -9.4205 2.276 -7.0531 {"}'M' greentint -9.2595 2.3041 -6.8532 {"}'M' greentint -9.1115 2.456 -6.7043 {"}'M' greentint -9.0166 2.6901 -6.647 {"}'M' greentint -9.0004 2.9438 -6.6963 {"}'M' greentint -9.287 2.4938 -7.1067 {"}'M' greentint -9.127 2.5908 -6.9272 {"}'M' greentint -9.0721 2.844 -6.927 {"}'M' greentint -9.2053 2.7404 -7.1265 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 111 A}'M' greentint -10.3668 0.7314 -4.443 {"}'M' greentint -10.5001 0.6278 -4.6425 {"}'M' greentint -10.1809 0.8228 -4.285 {"}'M' greentint -10.2851 0.978 -4.4628 {"}'M' greentint -10.4451 0.8811 -4.6422 {"}'M' greentint -10.5555 0.7817 -4.9225 {"}'M' greentint -10.5718 0.528 -4.8732 {"}'M' greentint -10.0199 1.0941 -4.3182 {"}'M' greentint -10.1516 1.1958 -4.5163 {"}'M' greentint -10.3126 1.1678 -4.7163 {"}'M' greentint -10.4607 1.0158 -4.8652 {"}'M' greentint -10.5272 0.8791 -5.1761 {"}'M' greentint -10.5776 0.6245 -5.1715 {"}'M' greentint -9.8283 1.2708 -4.3821 {"}'M' greentint -9.9632 1.3657 -4.583 {"}'M' greentint -10.1221 1.3688 -4.7889 {"}'M' greentint -10.2824 1.2778 -4.9718 {"}'M' greentint -10.4238 1.1073 -5.1073 {"}'M' greentint -10.4304 0.9534 -5.4161 {"}'M' greentint -9.7147 1.4649 -4.6333 {"}'M' greentint -9.8663 1.5004 -4.8385 {"}'M' greentint -10.0277 1.4612 -5.0363 {"}'M' greentint -10.1843 1.3492 -5.2077 {"}'M' greentint -10.3229 1.1744 -5.3385 {"}'M' greentint -9.7382 1.5513 -5.0867 {"}'M' greentint -9.8964 1.4876 -5.273 {"}'M' greentint -10.0466 1.3632 -5.4329 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 122 A}'M' greentint -10.3351 0.5579 -4.4113 {"}'M' greentint -10.5475 0.5669 -5.0522 {"}'M' greentint -10.3903 0.5623 -4.8466 {"}'M' greentint -10.2277 0.618 -4.6524 {"}'M' greentint -10.0699 0.7283 -4.479 {"}'M' greentint -9.9245 0.89 -4.336 {"}'M' greentint -9.7999 1.0924 -4.2324 {"}'M' greentint -10.4639 0.7447 -5.3101 {"}'M' greentint -10.3159 0.6977 -5.1057 {"}'M' greentint -10.1567 0.7202 -4.9052 {"}'M' greentint -9.997 0.8087 -4.7242 {"}'M' greentint -9.8503 0.9583 -4.5766 {"}'M' greentint -9.7266 1.1581 -4.4719 {"}'M' greentint -10.3357 0.9565 -5.4617 {"}'M' greentint -10.1973 0.8796 -5.2602 {"}'M' greentint -10.0385 0.8907 -5.0593 {"}'M' greentint -9.8814 0.9865 -4.8819 {"}'M' greentint -9.743 1.1571 -4.7504 {"}'M' greentint -9.64 1.3806 -4.6795 {"}'M' greentint -10.063 1.0875 -5.3359 {"}'M' greentint -9.8998 1.1167 -5.1333 {"}'M' greentint -9.7501 1.2704 -4.9825 {"}'M' greentint -9.6548 1.5067 -4.925 {"}'M' greentint -9.9503 1.3173 -5.3712 {"}'M' greentint -9.7916 1.4146 -5.1935 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 64 1vyoA_66F_79F}P -12.0528 -1.7779 0.9752 {"}-12.0528 -1.7779 0.9752 { ca phe A 64 1vyoA_66F_79F}-11.0133 -2.0851 0.0139 { c phe A 64 1vyoA_66F_79F}-10.7632 -0.8415 -0.8304 { o phe A 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-8.2817 {"}'S' P -10.4013 0.5239 -8.1031 {"}'S' -10.416 0.5463 -8.101 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 89 A}'M' greentint -9.1021 2.2378 -6.1922 {"}'M' greentint -9.2456 2.1301 -6.4647 {"}'M' greentint -8.8401 2.5591 -6.0596 {"}'M' greentint -9.0034 2.5257 -6.2615 {"}'M' greentint -9.152 2.3688 -6.41 {"}'M' greentint -9.2557 2.2724 -6.7075 {"}'M' greentint -9.3122 2.0229 -6.7107 {"}'M' greentint -8.6962 2.7642 -6.1216 {"}'M' greentint -8.8541 2.7558 -6.3236 {"}'M' greentint -9.0127 2.6627 -6.502 {"}'M' greentint -9.152 2.4947 -6.6352 {"}'M' greentint -9.2253 2.3664 -6.9522 {"}'M' greentint -9.2964 2.1213 -6.9764 {"}'M' greentint -8.511 2.9343 -6.1876 {"}'M' greentint -8.6671 2.9449 -6.3915 {"}'M' greentint -8.8273 2.8867 -6.5835 {"}'M' greentint -8.9821 2.7636 -6.7481 {"}'M' greentint -9.1178 2.5861 -6.8743 {"}'M' greentint -9.1474 2.4466 -7.1905 {"}'M' greentint -9.2286 2.2034 -7.2289 {"}'M' greentint -8.4239 3.0883 -6.4336 {"}'M' greentint -8.584 3.0643 -6.6349 {"}'M' greentint -8.7465 2.9827 -6.8213 {"}'M' greentint -8.8987 2.8468 -6.9812 {"}'M' greentint -9.0354 2.6652 -7.106 {"}'M' greentint -9.0329 2.4914 -7.4202 {"}'M' greentint -8.4896 3.1278 -6.8946 {"}'M' greentint -8.6454 3.029 -7.0679 {"}'M' greentint -8.7915 2.8854 -7.2178 {"}'M' greentint -8.9223 2.7035 -7.3362 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H CYS 106 A}'M' greentint -9.2099 2.0047 -6.6197 {"}'M' greentint -9.0517 2.0685 -6.4333 {"}'M' greentint -8.9015 2.1929 -6.2735 {"}'M' greentint -8.7683 2.3685 -6.1504 {"}'M' greentint -8.6631 2.5831 -6.0727 {"}'M' greentint -9.1593 2.0637 -6.9707 {"}'M' greentint -9.0011 2.0659 -6.7669 {"}'M' greentint -8.8405 2.1419 -6.5801 {"}'M' greentint -8.6909 2.2873 -6.4277 {"}'M' greentint -8.5663 2.4872 -6.3218 {"}'M' greentint -8.4778 2.7248 -6.2738 {"}'M' greentint -8.4333 2.9796 -6.2865 {"}'M' greentint -9.0562 2.2264 -7.2257 {"}'M' greentint -8.9074 2.1768 -7.0196 {"}'M' greentint -8.7451 2.2217 -6.8217 {"}'M' greentint -8.5909 2.3543 -6.6599 {"}'M' greentint -8.4666 2.5576 -6.5553 {"}'M' greentint -8.3883 2.8033 -6.5232 {"}'M' greentint -8.3674 3.0587 -6.5665 {"}'M' greentint -8.9282 2.462 -7.3882 {"}'M' greentint -8.7964 2.3603 -7.19 {"}'M' greentint -8.6354 2.3883 -6.9901 {"}'M' greentint -8.4874 2.5403 -6.8412 {"}'M' greentint -8.3926 2.7744 -6.7839 {"}'M' greentint -8.3763 3.0281 -6.8332 {"}'M' greentint -8.7671 2.7333 -7.4214 {"}'M' greentint -8.6629 2.5781 -7.2436 {"}'M' greentint -8.503 2.675 -7.0641 {"}'M' greentint -8.448 2.9283 -7.0639 {"}'M' greentint -8.5813 2.8247 -7.2634 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 89 A}'M' green -9.6145 1.5581 -4.1929 {"}'M' green -9.481 1.7759 -4.2465 {"}'M' green -9.8484 1.0313 -5.1205 {"}'M' green -9.357 2.0413 -4.7665 {"}'M' green -9.6878 1.3132 -5.3907 {"}'M' green -9.3759 1.9433 -5.163 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 89 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{"}'S' sea -12.7549 0.7123 -6.1954 {"}'S' sea -12.5914 0.7879 -6.0062 {"}'S' green -13.2175 0.7481 -7.2322 {"}'S' green -13.0177 0.7078 -7.396 {"}'S' green -12.8803 0.6159 -7.194 {"}'S' sea -12.7595 0.6658 -7.4795 { HB2 PHE 435 A}'S' green -12.5784 0.559 -6.2251 {"}'S' green -12.416 0.6081 -6.028 {"}'S' sea -12.2584 0.7256 -5.8582 {"}'S' green -12.0189 0.6094 -5.8837 {"}'S' green -11.9456 0.3731 -6.1328 {"}'S' green -11.7963 0.5091 -5.9769 {"}'S' green -11.9581 0.1981 -6.5321 {"}'S' green -11.7995 0.2626 -6.3454 {"}'S' sea -11.6466 0.3786 -6.1799 {"}'S' sea -12.3501 0.5836 -7.5779 {"}'S' green -12.2624 0.4075 -7.4144 {"}'S' green -11.8573 0.1693 -6.8252 {"}'S' green -12.0721 0.5108 -7.6085 {"}'S' green -11.6938 0.2141 -7.0357 {"}'S' sea -11.8359 0.5918 -7.6921 {"}'S' green -11.7322 0.4331 -7.5142 {"}'S' green -11.5973 0.3382 -7.3133 {"}'S' sea -11.4415 0.314 -7.1051 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB PHE 435 A}'S' P -13.0799 0.6579 -7.0288 {"}'S' -13.0786 0.66 -7.0292 {"}'S' P -12.9308 0.6049 -6.8215 {"}'S' -12.9225 0.6345 -6.8237 { HB2 PHE 435 A}'S' P -12.7342 0.5833 -6.4333 {"}'S' -12.7321 0.5852 -6.4343 {"}'S' P -12.7613 0.529 -6.8202 {"}'S' -12.7233 0.5655 -6.8193 {"}'S' P -12.6325 0.4273 -6.6261 {"}'S' -12.5841 0.4886 -6.6372 {"}'S' P -12.4852 0.3843 -6.4235 {"}'S' -12.4592 0.4285 -6.4408 {"}'S' P -12.3279 0.4022 -6.2245 {"}'S' -12.3202 0.4187 -6.2348 {"}'S' P -12.1697 0.479 -6.0412 {"}'S' -12.1689 0.4802 -6.0421 {"}'S' P -12.6681 0.495 -7.1003 {"}'S' -12.6403 0.5257 -7.0898 {"}'S' P -12.5527 0.3634 -6.9143 {"}'S' -12.5 0.4442 -6.9051 {"}'S' P -12.4154 0.2819 -6.7148 {"}'S' -12.3707 0.3772 -6.7216 {"}'S' P -12.2634 0.2561 -6.5115 {"}'S' -12.2446 0.316 -6.5268 {"}'S' P -12.104 0.2866 -6.3143 {"}'S' -12.1006 0.3086 -6.3232 {"}'S' P -12.5005 0.4628 -7.3064 {"}'S' -12.4978 0.4675 -7.3039 {"}'S' P -12.3917 0.3221 -7.1274 {"}'S' -12.3649 0.3795 -7.1089 {"}'S' P -12.261 0.2277 -6.9323 {"}'S' -12.2355 0.3104 -6.9215 {"}'S' P -12.1137 0.1861 -6.73 {"}'S' -12.104 0.2462 -6.7339 {"}'S' P -12.1462 0.2757 -7.229 {"}'S' -12.1426 0.295 -7.2216 {"}'S' P -12.0097 0.1943 -7.0289 {"}'S' -12.0082 0.2121 -7.0258 {"}'S' P -11.9695 0.358 -7.4334 {"}'S' -11.9698 0.3589 -7.4324 {"}'S' P -11.841 0.2572 -7.2383 {"}'S' -11.8413 0.2595 -7.2375 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 588 A}'M' greentint -10.1884 1.8024 -6.484 {"}'M' greentint -9.7434 1.9616 -6.1445 {"}'M' greentint -9.8813 2.0409 -6.3442 {"}'M' greentint -10.0392 2.0325 -6.5462 {"}'M' greentint -10.1978 1.9394 -6.7246 {"}'M' greentint -9.557 2.1326 -6.209 {"}'M' greentint -9.6961 2.211 -6.4102 {"}'M' greentint -9.8522 2.2216 -6.614 {"}'M' greentint -10.0124 2.1634 -6.806 {"}'M' greentint -10.1672 2.0403 -6.9707 {"}'M' greentint -10.3029 1.8628 -7.0969 {"}'M' greentint -9.3211 2.2357 -6.2485 {"}'M' greentint -9.4561 2.3291 -6.4492 {"}'M' greentint -9.609 2.365 -6.6561 {"}'M' greentint -9.7695 2.3416 -6.8581 {"}'M' greentint -9.9315 2.2594 -7.0438 {"}'M' greentint -10.0838 2.1235 -7.2038 {"}'M' greentint -10.2204 1.9419 -7.3286 {"}'M' greentint -9.2149 2.4061 -6.5233 {"}'M' greentint -9.3603 2.4564 -6.725 {"}'M' greentint -9.5155 2.4556 -6.9249 {"}'M' greentint -9.6746 2.4045 -7.1171 {"}'M' greentint -9.8305 2.3057 -7.2904 {"}'M' greentint -9.9766 2.1621 -7.4403 {"}'M' greentint -9.0487 2.4778 -6.7278 {"}'M' greentint -9.1996 2.5121 -6.9316 {"}'M' greentint -9.3577 2.4996 -7.1328 {"}'M' greentint -9.5179 2.4389 -7.3225 {"}'M' greentint -9.6747 2.333 -7.4957 {"}'M' greentint -9.0231 2.5179 -7.1257 {"}'M' greentint -9.1822 2.4968 -7.3265 {"}'M' greentint -9.3431 2.4298 -7.5156 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 435 A}'M' greentint -10.1944 1.7479 -6.8574 {"}'M' greentint -10.0454 1.7236 -6.6584 {"}'M' greentint -9.8887 1.761 -6.4665 {"}'M' greentint -9.7338 1.8582 -6.294 {"}'M' greentint -9.5925 2.009 -6.1524 {"}'M' greentint -10.1895 1.9114 -7.3255 {"}'M' greentint -10.0723 1.7867 -7.1402 {"}'M' greentint -9.9324 1.7217 -6.941 {"}'M' greentint -9.778 1.721 -6.7418 {"}'M' greentint -9.6198 1.7847 -6.5555 {"}'M' greentint -9.4696 1.9091 -6.3957 {"}'M' greentint -9.3365 2.0847 -6.2726 {"}'M' greentint -9.9814 1.9949 -7.4805 {"}'M' greentint -9.8688 1.853 -7.2959 {"}'M' greentint -9.7275 1.7799 -7.0929 {"}'M' greentint -9.5693 1.7821 -6.8891 {"}'M' greentint -9.4086 1.8581 -6.7023 {"}'M' greentint -9.2591 2.0035 -6.5499 {"}'M' greentint -9.1345 2.2034 -6.444 {"}'M' greentint -9.7404 2.0796 -7.5361 {"}'M' greentint -9.6243 1.9426 -7.3479 {"}'M' greentint -9.4756 1.893 -7.1418 {"}'M' greentint -9.3132 1.9379 -6.9439 {"}'M' greentint -9.159 2.0705 -6.7821 {"}'M' greentint -9.0348 2.2738 -6.6775 {"}'M' greentint -9.4963 2.1782 -7.5104 {"}'M' greentint -9.3646 2.0765 -7.3122 {"}'M' greentint -9.2036 2.1045 -7.1123 {"}'M' greentint -9.0555 2.2565 -6.9634 {"}'M' greentint -8.9607 2.4906 -6.9061 {"}'M' greentint -9.2311 2.2943 -7.3658 {"}'M' greentint -9.0711 2.3912 -7.1863 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 588 A}'M' green -10.0211 0.9236 -4.2109 {"}'M' green -9.8352 1.015 -4.0529 {"}'M' green -10.2098 0.9739 -4.6904 {"}'M' green -10.1815 1.0713 -4.944 {"}'M' green -9.3925 1.7435 -4.8547 {"}'M' green -9.5507 1.6798 -5.041 {"}'M' green -9.7009 1.5554 -5.2008 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 588 A}'M' greentint -9.9394 1.1702 -4.2307 {"}'M' greentint -10.0994 1.0732 -4.4102 {"}'M' greentint -9.6742 1.2863 -4.0861 {"}'M' greentint -9.806 1.388 -4.2843 {"}'M' greentint -9.967 1.3599 -4.4842 {"}'M' greentint -10.115 1.208 -4.6331 {"}'M' greentint -9.4826 1.463 -4.15 {"}'M' greentint -9.6175 1.5579 -4.3509 {"}'M' greentint -9.7764 1.561 -4.5568 {"}'M' greentint -9.9367 1.4699 -4.7397 {"}'M' greentint -10.0781 1.2994 -4.8752 {"}'M' greentint -9.369 1.6571 -4.4012 {"}'M' greentint -9.5207 1.6926 -4.6064 {"}'M' greentint -9.682 1.6534 -4.8043 {"}'M' greentint -9.8386 1.5414 -4.9757 {"}'M' greentint -9.9772 1.3666 -5.1064 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 435 A}'M' green -10.1487 0.9318 -4.3205 {"}'M' green -9.9906 1.0058 -4.1367 {"}'M' green -9.8388 1.1265 -3.9738 {"}'M' green -9.58 1.3379 -4.0614 {"}'M' green -10.1195 1.1926 -5.0356 {"}'M' green -9.3821 1.606 -4.1973 {"}'M' green -9.9912 1.4043 -5.1871 {"}'M' green -9.6059 1.7652 -5.0966 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 435 A}'M' greentint -10.203 1.0148 -4.7777 {"}'M' greentint -10.0458 1.0102 -4.572 {"}'M' greentint -9.8832 1.0659 -4.3779 {"}'M' greentint -9.7254 1.1761 -4.2044 {"}'M' greentint -9.9715 1.1456 -4.8311 {"}'M' greentint -9.8123 1.168 -4.6306 {"}'M' greentint -9.6526 1.2566 -4.4496 {"}'M' greentint -9.5059 1.4062 -4.302 {"}'M' greentint -9.8528 1.3275 -4.9856 {"}'M' greentint -9.694 1.3385 -4.7847 {"}'M' greentint -9.537 1.4344 -4.6074 {"}'M' greentint -9.3985 1.605 -4.4758 {"}'M' greentint -9.7185 1.5354 -5.0614 {"}'M' greentint -9.5554 1.5646 -4.8587 {"}'M' greentint -9.4056 1.7183 -4.7079 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n cys A 440 1w7cA_442F_468}P -12.5167 -2.1963 -0.0161 {"}-12.5167 -2.1963 -0.0161 { ca cys A 440 1w7cA_442F_468}-11.2228 -2.2759 -0.6783 { c cys A 440 1w7cA_442F_468}-10.9203 -0.9851 -1.402 { o cys A 440 1w7cA_442F_468}-11.8382 -0.2299 -1.7865 { c cys A 440 1w7cA_442F_468}P -10.9203 -0.9851 -1.402 { n val A 441 1w7cA_442F_468}-9.6238 -0.7574 -1.5872 { ca val A 441 1w7cA_442F_468}-9.0944 0.3825 -2.2824 { c val A 441 1w7cA_442F_468}-8.115 -0.0905 -3.3343 { o val A 441 1w7cA_442F_468}-7.2328 -0.888 -3.0383 { c val A 441 1w7cA_442F_468}P -8.115 -0.0905 -3.3343 { n phe A 442 1w7cA_442F_468}-8.2711 0.3532 -4.5734 { ca phe A 442 1w7cA_442F_468}-7.3908 -0.0484 -5.647 { c phe A 442 1w7cA_442F_468}-7.2572 1.0186 -6.7093 { o phe A 442 1w7cA_442F_468}-8.1621 1.8378 -6.9164 { c phe A 442 1w7cA_442F_468}P -7.2572 1.0186 -6.7093 { n glu A 443 1w7cA_442F_468}-6.1096 1.0057 -7.3799 { ca glu A 443 1w7cA_442F_468}-5.8857 1.8601 -8.5282 { c glu A 443 1w7cA_442F_468}-6.1602 1.0724 -9.8105 { o glu A 443 1w7cA_442F_468}-5.5886 0.0314 -10.063 { c glu A 443 1w7cA_442F_468}P -6.1602 1.0724 -9.8105 { n asn A 444 1w7cA_442F_468}-7.1197 1.5396 -10.5946 { ca asn A 444 1w7cA_442F_468}-7.3825 0.9334 -11.8937 { c asn A 444 1w7cA_442F_468}-6.603 1.6464 -12.9818 { o asn A 444 1w7cA_442F_468}-6.2344 2.8064 -12.8094 { n thr A 466 1w7cA_442F_468}P -7.1533 5.5507 -12.0192 {"}-7.1533 5.5507 -12.0192 { ca thr A 466 1w7cA_442F_468}-8.1971 6.044 -11.1063 { c thr A 466 1w7cA_442F_468}-8.0587 5.362 -9.7514 { o thr A 466 1w7cA_442F_468}-7.6574 4.1932 -9.6659 { c thr A 466 1w7cA_442F_468}P -8.0587 5.362 -9.7514 { n leu A 467 1w7cA_442F_468}-8.3676 6.0935 -8.7001 { ca leu A 467 1w7cA_442F_468}-8.5278 5.4724 -7.3811 { c leu A 467 1w7cA_442F_468}-9.964 4.9754 -7.2518 { o leu A 467 1w7cA_442F_468}-10.8882 5.6542 -7.6412 { c leu A 467 1w7cA_442F_468}P -9.964 4.9754 -7.2518 { n asn A 468 1w7cA_442F_468}-10.1194 3.8045 -6.6519 { ca asn A 468 1w7cA_442F_468}-11.4029 3.1401 -6.5507 { c asn A 468 1w7cA_442F_468}-11.5766 2.6281 -5.1402 { o asn A 468 1w7cA_442F_468}-10.6783 1.9553 -4.6201 { c asn A 468 1w7cA_442F_468}P -11.5766 2.6281 -5.1402 { n val A 469 1w7cA_442F_468}-12.7437 2.9626 -4.5765 { ca val A 469 1w7cA_442F_468}-13.1579 2.4796 -3.2552 { c val A 469 1w7cA_442F_468}-14.4649 1.7089 -3.4695 { o val A 469 1w7cA_442F_468}-15.4473 2.2526 -4.0152 { c val A 469 1w7cA_442F_468}P -14.4649 1.7089 -3.4695 { n arg A 470 1w7cA_442F_468}-14.4364 0.4147 -3.1095 { ca arg A 470 1w7cA_442F_468}-15.6214 -0.4294 -3.2547 { c arg A 470 1w7cA_442F_468}-16.0286 -1.1115 -1.9502 { o arg A 470 1w7cA_442F_468}-15.1645 -1.5071 -1.1522 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n cys A 440 1w7cA_442F_468}P -12.5167 -2.1963 -0.0161 { ca cys A 440 1w7cA_442F_468}P -11.2228 -2.2759 -0.6783 { n val A 441 1w7cA_442F_468}P -9.6238 -0.7574 -1.5872 { ca val A 441 1w7cA_442F_468}P -9.0944 0.3825 -2.2824 { n phe A 442 1w7cA_442F_468}P -8.2711 0.3532 -4.5734 { ca phe A 442 1w7cA_442F_468}P -7.3908 -0.0484 -5.647 { n glu A 443 1w7cA_442F_468}P -6.1096 1.0057 -7.3799 { ca glu A 443 1w7cA_442F_468}P -5.8857 1.8601 -8.5282 { n asn A 444 1w7cA_442F_468}P -7.1197 1.5396 -10.5946 { ca asn A 444 1w7cA_442F_468}P -7.3825 0.9334 -11.8937 { n thr A 466 1w7cA_442F_468}P -7.1533 5.5507 -12.0192 { ca thr A 466 1w7cA_442F_468}P -8.1971 6.044 -11.1063 { n leu A 467 1w7cA_442F_468}P -8.3676 6.0935 -8.7001 { ca leu A 467 1w7cA_442F_468}P -8.5278 5.4724 -7.3811 { n asn A 468 1w7cA_442F_468}P -10.1194 3.8045 -6.6519 { ca asn A 468 1w7cA_442F_468}P -11.4029 3.1401 -6.5507 { n val A 469 1w7cA_442F_468}P -12.7437 2.9626 -4.5765 { ca val A 469 1w7cA_442F_468}P -13.1579 2.4796 -3.2552 { n arg A 470 1w7cA_442F_468}P -14.4364 0.4147 -3.1095 { ca arg A 470 1w7cA_442F_468}P -15.6214 -0.4294 -3.2547 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca cys A 440 1w7cA_442F_468}P -11.2228 -2.2759 -0.6783 {"}-11.2228 -2.2759 -0.6783 { ca val A 441 1w7cA_442F_468}-9.0944 0.3825 -2.2824 { ca phe A 442 1w7cA_442F_468}-7.3908 -0.0484 -5.647 { ca glu A 443 1w7cA_442F_468}-5.8857 1.8601 -8.5282 { ca asn A 444 1w7cA_442F_468}-7.3825 0.9334 -11.8937 { ca thr A 466 1w7cA_442F_468}P -8.1971 6.044 -11.1063 {"}-8.1971 6.044 -11.1063 { ca leu A 467 1w7cA_442F_468}-8.5278 5.4724 -7.3811 { ca asn A 468 1w7cA_442F_468}-11.4029 3.1401 -6.5507 { ca val A 469 1w7cA_442F_468}-13.1579 2.4796 -3.2552 { ca arg A 470 1w7cA_442F_468}-15.6214 -0.4294 -3.2547 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 442 1w7cA_442F_468}P -7.3908 -0.0484 -5.647 { cb phe A 442 1w7cA_442F_468}-7.8025 -1.3901 -6.2965 { cg phe A 442 1w7cA_442F_468}-9.1523 -1.3706 -6.9872 { cd1 phe A 442 1w7cA_442F_468}-10.3055 -1.6104 -6.2684 { ce1 phe A 442 1w7cA_442F_468}-11.5496 -1.6281 -6.8881 { cz phe A 442 1w7cA_442F_468}-11.6319 -1.4124 -8.2562 { cg phe A 442 1w7cA_442F_468}P -9.1523 -1.3706 -6.9872 { cd2 phe A 442 1w7cA_442F_468}-9.2413 -1.1568 -8.3589 { ce2 phe A 442 1w7cA_442F_468}-10.4889 -1.1768 -8.9916 { cz phe A 442 1w7cA_442F_468}ghost -11.6319 -1.4124 -8.2562 { ca asn A 468 1w7cA_442F_468}P -11.4029 3.1401 -6.5507 { cb asn A 468 1w7cA_442F_468}-11.445 1.9661 -7.533 { cg asn A 468 1w7cA_442F_468}-11.4211 2.4099 -8.9688 { od1 asn A 468 1w7cA_442F_468}-12.4956 2.6872 -9.5335 { cg asn A 468 1w7cA_442F_468}P -11.4211 2.4099 -8.9688 { nd2 asn A 468 1w7cA_442F_468}-10.2204 2.636 -9.5359 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 442 1w7cA_442F_468}P -7.8025 -1.3901 -6.2965 {"}P -7.8025 -1.3901 -6.2965 { cd1 phe A 442 1w7cA_442F_468}P -10.3055 -1.6104 -6.2684 { cd2 phe A 442 1w7cA_442F_468}P -9.2413 -1.1568 -8.3589 { ce1 phe A 442 1w7cA_442F_468}P -11.5496 -1.6281 -6.8881 { ce2 phe A 442 1w7cA_442F_468}P -10.4889 -1.1768 -8.9916 { cz phe A 442 1w7cA_442F_468}P -11.6319 -1.4124 -8.2562 { cb asn A 468 1w7cA_442F_468}P -11.445 1.9661 -7.533 {"}P -11.445 1.9661 -7.533 { nd2 asn A 468 1w7cA_442F_468}P -10.2204 2.636 -9.5359 {"}P -10.2204 2.636 -9.5359 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 442 A}'S' sky -9.9511 0.1456 -6.6325 {"}'S' blue -9.6893 0.2674 -6.6869 {"}'S' sky -10.311 -0.12 -7.3816 {"}'S' sky -9.5643 0.3295 -6.9336 {"}'S' blue -9.3811 0.3598 -7.119 {"}'S' sky -9.545 0.3031 -7.3147 { CD1 PHE 442 A}'S' sky -10.5344 0.1199 -6.4002 {"}'S' sky -10.6983 0.0632 -6.5959 {"}'S' blue -10.1939 0.1317 -6.3921 {"}'S' sky -10.356 0.1083 -6.5946 {"}'S' sky -10.1471 0.0655 -6.7471 { CD2 PHE 442 A}'S' sky -9.4744 0.4258 -7.6495 {"}'S' blue -9.4956 0.5564 -8.1048 {"}'S' blue -9.6533 0.5433 -8.3053 { CE1 PHE 442 A}'S' blue -12.0865 0.0099 -6.5877 {"}'S' sky -12.2469 -0.0263 -6.785 {"}'S' blue -12.4076 -0.1048 -6.9697 {"}'S' blue -11.804 0.0851 -6.634 {"}'S' sky -11.9616 0.072 -6.8345 {"}'S' sky -12.2797 -0.0703 -7.206 {"}'S' sky -11.4602 0.0967 -6.6077 {"}'S' blue -11.1319 0.0468 -6.597 {"}'S' sky -11.281 0.0998 -6.8043 {"}'S' sky -10.9231 -0.0001 -6.7486 {"}'S' sky -10.6506 -0.1584 -7.1944 {"}'S' sky -10.8024 -0.1298 -7.3982 { CE2 PHE 442 A}'S' blue -11.4506 0.2767 -8.8297 {"}'S' sky -11.1863 0.4249 -8.8886 {"}'S' blue -11.347 0.3465 -9.0732 {"}'S' sky -10.901 0.5233 -8.938 {"}'S' sky -11.0618 0.4707 -9.1305 {"}'S' blue -11.2191 0.381 -9.3095 {"}'S' sky -10.2528 0.4872 -8.5035 {"}'S' blue -10.3996 0.548 -8.7112 {"}'S' blue -10.5562 0.571 -8.9185 {"}'S' sky -10.7178 0.5535 -9.1234 {"}'S' blue -10.8817 0.4968 -9.3191 {"}'S' blue -10.5394 0.5419 -9.3179 { CZ PHE 442 A}'S' sky -12.504 -0.0246 -7.6426 {"}'S' blue -12.6653 -0.0623 -7.8407 {"}'S' blue -12.5935 0.0411 -8.0943 {"}'S' sky -12.3292 0.1893 -8.1532 {"}'S' sky -12.2047 0.2351 -8.3951 {"}'S' sky -12.0246 0.2612 -8.5837 {"}'S' sky -10.6411 -0.1594 -7.5418 {"}'S' sky -11.4734 0.2636 -8.7349 @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 442 A}'S' sea -10.1139 0.0829 -6.8253 {"}'S' sea -9.8496 0.2312 -6.8842 {"}'S' green -10.0103 0.1528 -7.0688 {"}'S' sea -10.1655 0.0341 -7.2366 {"}'S' sea -9.7252 0.277 -7.1261 {"}'S' sea -9.8824 0.1872 -7.3052 { CD1 PHE 442 A}'S' sea -10.5196 0.0468 -6.7888 {"}'S' sea -10.6805 -0.0517 -6.9691 {"}'S' sea -10.3103 0.0049 -6.9409 {"}'S' sea -10.4715 -0.0916 -7.1221 { CD2 PHE 442 A}'S' sea -10.159 0.0491 -7.4841 {"}'S' sea -10.3167 0.0491 -7.6877 {"}'S' green -9.9591 0.2134 -7.5406 {"}'S' green -10.1134 0.2311 -7.7453 {"}'S' green -9.726 0.3401 -7.5928 {"}'S' green -9.879 0.3743 -7.8011 {"}'S' green -10.0401 0.3593 -8.0042 {"}'S' sea -9.6223 0.4756 -7.8545 {"}'S' sea -9.7782 0.4811 -8.0586 {"}'S' sea -9.9386 0.4449 -8.2559 { CE1 PHE 442 A}'S' sea -12.1225 0.0194 -7.0269 {"}'S' sea -11.6168 0.1197 -6.815 {"}'S' sea -11.7784 0.1022 -7.0199 {"}'S' sea -11.9423 0.0456 -7.2156 {"}'S' sea -11.4379 0.1141 -7.0118 {"}'S' sea -11.6 0.0906 -7.2144 {"}'S' sea -11.0718 0.0537 -6.9555 {"}'S' sea -11.2294 0.0709 -7.1629 {"}'S' sea -10.8585 -0.0328 -7.0834 {"}'S' sea -11.0143 -0.0114 -7.2911 { CE2 PHE 442 A}'S' sea -10.6127 -0.0529 -7.6555 {"}'S' green -10.7116 0.1128 -7.8301 {"}'S' green -10.8338 0.2391 -8.0226 {"}'S' green -10.9737 0.3201 -8.2255 {"}'S' green -11.1267 0.3543 -8.4338 {"}'S' sea -11.2878 0.3393 -8.6369 {"}'S' sea -10.3714 0.0226 -7.7223 {"}'S' green -10.4691 0.1865 -7.8949 {"}'S' green -10.5867 0.3155 -8.0833 {"}'S' green -10.7221 0.4058 -8.2822 {"}'S' green -10.87 0.4556 -8.4872 {"}'S' sea -11.0259 0.4611 -8.6913 {"}'S' green -10.321 0.3404 -8.1361 {"}'S' green -10.449 0.4433 -8.331 {"}'S' sea -10.5914 0.5092 -8.5339 {"}'S' sea -10.7433 0.5364 -8.7375 {"}'S' sea -10.1184 0.3888 -8.3025 { CZ PHE 442 A}'S' sea -12.3497 -0.0422 -7.4379 {"}'S' green -12.1166 0.0845 -7.4901 {"}'S' green -12.2696 0.1187 -7.6985 {"}'S' sea -12.4307 0.1037 -7.9015 {"}'S' sea -11.7296 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width= 1 master= {vdw contact} { CB ASN 468 A}'S' sky -11.7419 0.39 -6.8323 {"}'S' blue -11.5783 0.4656 -6.6431 {"}'S' blue -11.2747 0.451 -6.6742 {"}'S' sky -11.983 0.6083 -8.4968 {"}'S' sky -11.7288 0.5914 -8.5778 {"}'S' blue -11.5132 0.675 -8.7124 {"}'S' blue -11.278 0.7594 -8.7896 {"}'S' sky -10.6742 0.8298 -8.6177 {"}'S' sky -10.5318 0.7612 -8.4143 { CG ASN 468 A}'S' blue -11.4639 0.761 -8.9926 {"}'S' blue -11.3104 0.7831 -9.2186 {"}'S' sky -11.1515 0.7827 -9.0132 {"}'S' sky -10.9901 0.8246 -8.8158 {"}'S' blue -11.1494 0.8474 -9.425 {"}'S' sky -10.9945 0.8361 -9.221 {"}'S' sky -10.8347 0.8687 -9.0236 {"}'S' blue -10.6748 0.9445 -8.8379 {"}'S' blue -10.7991 0.9333 -9.3623 {"}'S' blue -10.6408 0.9698 -9.168 { HB2 ASN 468 A}'S' sky -10.9997 0.3688 -6.7735 {"}'S' blue -10.8416 0.4456 -6.5902 {"}'S' sky -10.7759 0.2533 -6.8633 {"}'S' sky -10.6175 0.3398 -6.6819 {"}'S' blue -10.4682 0.4758 -6.5259 {"}'S' sky -10.3184 0.3453 -6.729 {"}'S' blue -10.179 0.506 -6.5921 {"}'S' sky -10.5292 0.136 -7.3742 {"}'S' blue -9.9276 0.568 -6.7172 {"}'S' sky -9.7665 0.585 -6.923 {"}'S' sky -9.6539 0.6249 -7.1559 {"}'S' blue -9.5802 0.7119 -7.3929 {"}'S' sky -10.0121 0.7355 -8.1885 {"}'S' blue -9.5645 0.8153 -7.6326 {"}'S' blue -9.7537 0.8582 -8.0326 { HB3 ASN 468 A}'S' blue -12.6998 0.2656 -7.4894 {"}'S' blue -12.5525 0.2239 -7.2871 {"}'S' sky -12.397 0.2359 -7.0892 {"}'S' sky -12.2383 0.3004 -6.9025 {"}'S' blue -12.0854 0.4165 -6.7371 {"}'S' sky -12.585 0.3135 -7.7861 {"}'S' sky -11.9787 0.3234 -7.0041 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ASN 468 A}'S' green -11.9178 0.2827 -7.4583 {"}'S' sea -11.7601 0.2682 -7.2514 {"}'S' sea -11.5979 0.2917 -7.0489 {"}'S' sea -11.4351 0.3533 -6.8541 {"}'S' sea -12.1265 0.5109 -8.2264 {"}'S' green -12.0047 0.3855 -8.0329 {"}'S' green -11.8672 0.2937 -7.8309 {"}'S' green -11.7185 0.2399 -7.624 {"}'S' green -11.5613 0.2236 -7.4156 {"}'S' sea -11.3992 0.2456 -7.2127 {"}'S' sea -11.2368 0.3064 -7.0184 {"}'S' green -11.8731 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ASN 468 A}'S' P -11.6043 0.2652 -7.9111 {"}'S' -11.6029 0.283 -7.908 {"}'S' P -11.452 0.2243 -7.7038 {"}'S' -11.4521 0.2311 -7.7022 {"}'S' P -11.3475 0.2817 -7.9979 {"}'S' -11.3472 0.2879 -7.9955 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 442 A}'M' green -9.1753 2.319 -6.0785 {"}'M' green -8.4074 3.1722 -6.5703 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 442 A}'M' greentint -8.938 2.4517 -5.9262 {"}'M' greentint -9.0723 2.5515 -6.1274 {"}'M' greentint -9.2355 2.5181 -6.3293 {"}'M' greentint -9.3842 2.3612 -6.4778 {"}'M' greentint -8.7905 2.6773 -5.9898 {"}'M' greentint -8.9284 2.7567 -6.1895 {"}'M' greentint -9.0863 2.7483 -6.3915 {"}'M' greentint -9.2449 2.6551 -6.5699 {"}'M' greentint -9.3841 2.4872 -6.703 {"}'M' greentint -8.6041 2.8484 -6.0543 {"}'M' greentint -8.7432 2.9267 -6.2555 {"}'M' greentint -8.8993 2.9374 -6.4593 {"}'M' greentint -9.0595 2.8792 -6.6513 {"}'M' greentint -9.2143 2.7561 -6.816 {"}'M' greentint -8.5032 3.0449 -6.2944 {"}'M' greentint -8.6561 3.0808 -6.5014 {"}'M' greentint -8.8166 3.0574 -6.7034 {"}'M' greentint -8.9786 2.9752 -6.8891 {"}'M' greentint -8.5626 3.1713 -6.7702 {"}'M' greentint -8.7217 3.1202 -6.9624 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ASN 468 A}'M' green -9.3699 2.3117 -6.3872 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ASN 468 A}'M' greentint -9.2156 2.311 -6.1881 {"}'M' greentint -9.0574 2.3747 -6.0018 {"}'M' greentint -9.3064 2.443 -6.7422 {"}'M' greentint -9.165 2.37 -6.5391 {"}'M' greentint -9.0068 2.3722 -6.3354 {"}'M' greentint -8.8461 2.4481 -6.1485 {"}'M' greentint -8.6966 2.5935 -5.9961 {"}'M' greentint -9.0619 2.5326 -6.7942 {"}'M' greentint -8.9131 2.483 -6.588 {"}'M' greentint -8.7508 2.5279 -6.3901 {"}'M' greentint -8.5966 2.6605 -6.2284 {"}'M' greentint -8.4723 2.8639 -6.1238 {"}'M' greentint -8.9339 2.7682 -6.9566 {"}'M' greentint -8.8021 2.6665 -6.7585 {"}'M' greentint -8.6411 2.6945 -6.5585 {"}'M' greentint -8.4931 2.8465 -6.4096 {"}'M' greentint -8.3983 3.0806 -6.3523 {"}'M' greentint -8.7728 3.0395 -6.9899 {"}'M' greentint -8.6686 2.8843 -6.812 {"}'M' greentint -8.5087 2.9812 -6.6326 {"}'M' greentint -8.587 3.1309 -6.8319 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 442 A}'M' greentint -9.7737 1.1524 -4.2462 {"}'M' greentint -9.9069 1.0487 -4.4457 {"}'M' greentint -9.692 1.3989 -4.266 {"}'M' greentint -9.852 1.302 -4.4455 {"}'M' greentint -9.9624 1.2027 -4.7257 {"}'M' greentint -9.9787 0.9489 -4.6764 {"}'M' greentint -9.5585 1.6168 -4.3196 {"}'M' greentint -9.7195 1.5887 -4.5195 {"}'M' greentint -9.8676 1.4368 -4.6684 {"}'M' greentint -9.9341 1.3001 -4.9793 {"}'M' greentint -9.9845 1.0454 -4.9747 {"}'M' greentint -9.9758 0.7976 -4.8943 {"}'M' greentint -9.3701 1.7866 -4.3862 {"}'M' greentint -9.529 1.7898 -4.5921 {"}'M' greentint -9.6892 1.6987 -4.775 {"}'M' greentint -9.8306 1.5282 -4.9105 {"}'M' greentint -9.8372 1.3744 -5.2194 {"}'M' greentint -9.9055 1.1254 -5.237 {"}'M' greentint -9.4346 1.8822 -4.8396 {"}'M' greentint -9.5912 1.7701 -5.011 {"}'M' greentint -9.7297 1.5954 -5.1417 {"}'M' greentint -9.6919 1.3939 -5.4369 {"}'M' greentint -9.4535 1.7841 -5.2361 {"}'M' greentint -9.5866 1.6085 -5.3592 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ASN 468 A}'M' greentint -9.9375 0.7731 -4.7321 {"}'M' greentint -9.7797 0.8834 -4.5586 {"}'M' greentint -9.6343 1.0451 -4.4157 {"}'M' greentint -9.5097 1.2475 -4.3121 {"}'M' greentint -9.4132 1.4806 -4.2522 {"}'M' greentint -9.8665 0.8753 -4.9848 {"}'M' greentint -9.7068 0.9638 -4.8038 {"}'M' greentint -9.5601 1.1134 -4.6563 {"}'M' greentint -9.4364 1.3132 -4.5516 {"}'M' greentint -9.3445 1.5474 -4.4983 {"}'M' greentint -9.2926 1.7982 -4.4999 {"}'M' greentint -9.7483 1.0458 -5.1389 {"}'M' greentint -9.5912 1.1416 -4.9616 {"}'M' greentint -9.4528 1.3122 -4.8301 {"}'M' greentint -9.3499 1.5357 -4.7592 {"}'M' greentint -9.2954 1.7854 -4.7589 {"}'M' greentint -9.7728 1.2426 -5.4156 {"}'M' greentint -9.6096 1.2718 -5.213 {"}'M' greentint -9.4599 1.4255 -5.0621 {"}'M' greentint -9.3646 1.6618 -5.0046 {"}'M' greentint -9.5014 1.5698 -5.2732 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 492 1w7cA_713F_494}P -6.549 6.4151 -11.3478 {"}-6.549 6.4151 -11.3478 { ca leu A 492 1w7cA_713F_494}-7.7907 6.5347 -10.6029 { c leu A 492 1w7cA_713F_494}-7.8036 5.4533 -9.5107 { o leu A 492 1w7cA_713F_494}-7.4472 4.3198 -9.7715 { c leu A 492 1w7cA_713F_494}P -7.8036 5.4533 -9.5107 { n glu A 493 1w7cA_713F_494}-8.2578 5.8224 -8.319 { ca glu A 493 1w7cA_713F_494}-8.401 4.8842 -7.2172 { c glu A 493 1w7cA_713F_494}-9.8828 4.8277 -6.832 { o glu A 493 1w7cA_713F_494}-10.4994 5.8845 -6.6018 { c glu A 493 1w7cA_713F_494}P -9.8828 4.8277 -6.832 { n val A 494 1w7cA_713F_494}-10.3703 3.5908 -6.7204 { ca val A 494 1w7cA_713F_494}-11.7264 3.2671 -6.3315 { c val A 494 1w7cA_713F_494}-11.6455 2.6774 -4.9277 { o val A 494 1w7cA_713F_494}-10.8986 1.7198 -4.7153 { c val A 494 1w7cA_713F_494}P -11.6455 2.6774 -4.9277 { n ser A 495 1w7cA_713F_494}-12.4209 3.2238 -3.9865 { ca ser A 495 1w7cA_713F_494}-12.3705 2.6888 -2.6403 { c ser A 495 1w7cA_713F_494}-13.7133 2.6933 -1.9526 { o ser A 495 1w7cA_713F_494}-14.6412 3.4408 -2.3149 { c ser A 495 1w7cA_713F_494}P -13.7133 2.6933 -1.9526 { n val A 496 1w7cA_713F_494}-13.7976 1.8662 -0.9203 { ca val A 496 1w7cA_713F_494}-14.9328 1.8428 -0.0246 { c val A 496 1w7cA_713F_494}-14.4363 1.7287 1.4114 { o val A 496 1w7cA_713F_494}-13.4162 1.08 1.6738 { n ala A 711 1w7cA_713F_494}P -11.186 -0.8378 1.6908 {"}-11.186 -0.8378 1.6908 { ca ala A 711 1w7cA_713F_494}-10.789 -1.6479 0.5454 { c ala A 711 1w7cA_713F_494}-10.6386 -0.7283 -0.6654 { o ala A 711 1w7cA_713F_494}-11.3578 0.2664 -0.7921 { c ala A 711 1w7cA_713F_494}P -10.6386 -0.7283 -0.6654 { n ser A 712 1w7cA_713F_494}-9.6731 -1.0417 -1.5453 { ca ser A 712 1w7cA_713F_494}-9.4429 -0.1208 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{"}'S' sky -11.2895 0.2872 -7.3612 {"}'S' sky -11.1314 0.364 -7.1779 {"}'S' sky -11.3508 0.3943 -7.8368 {"}'S' blue -11.195 0.37 -7.6286 {"}'S' blue -11.0318 0.419 -7.432 {"}'S' sky -11.4063 0.966 -8.3746 {"}'S' sky -11.3512 0.7547 -8.2459 {"}'S' sky -11.2486 0.602 -8.0709 {"}'S' blue -11.1115 0.5269 -7.8714 {"}'S' blue -11.1615 1.0333 -8.3084 {"}'S' blue -11.0937 0.8249 -8.163 {"}'S' blue -10.9603 0.7221 -7.9623 {HG11 VAL 494 A}'S' blue -13.9078 -0.0143 -7.8035 {"}'S' sky -13.7496 0.0034 -7.605 {"}'S' sky -13.5919 0.0794 -7.4222 {"}'S' blue -13.8113 0.1097 -8.081 {"}'S' sky -13.6555 0.0855 -7.8728 {"}'S' sky -13.4923 0.1344 -7.6763 {"}'S' sky -13.3351 0.2528 -7.5055 {"}'S' sky -13.7091 0.3174 -8.3151 {"}'S' sky -13.572 0.2424 -8.1157 {"}'S' sky -13.4156 0.2532 -7.9164 {"}'S' sky -13.2595 0.3486 -7.7419 {"}'S' sky -13.5542 0.5403 -8.4072 {"}'S' sky -13.4208 0.4376 -8.2066 {"}'S' sky -13.2573 0.4662 -8.0033 {"}'S' sky -13.2959 0.6631 -8.2513 {HG21 VAL 494 A}'S' sky -13.1813 0.9805 -9.0729 {"}'S' sky -13.0219 1.011 -8.8757 {"}'S' blue -12.8635 1.0975 -8.6943 {"}'S' sky -13.1789 0.9521 -9.4937 {"}'S' sky -12.7589 0.9816 -9.7997 {"}'S' sky -12.5152 1.0626 -9.8747 {"}'S' sky -12.039 1.2057 -9.2991 {"}'S' blue -12.1195 1.2061 -9.7101 {"}'S' blue -11.9634 1.3014 -9.5355 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 494 A}'S' sea -12.6145 0.8973 -8.3475 {"}'S' sea -12.5027 0.758 -8.1646 {"}'S' sea -12.3743 0.6545 -7.969 {"}'S' sea -12.399 0.9809 -8.4821 {"}'S' sea -12.2895 0.8348 -8.3009 {"}'S' sea -12.0531 0.9175 -8.376 { CG1 VAL 494 A}'S' sea -13.0023 0.2986 -7.3037 { CG2 VAL 494 A}'S' sea -12.3969 1.0713 -8.8571 {"}'S' sea -12.1401 1.1009 -8.9469 { HB VAL 494 A}'S' sea -12.3062 0.4194 -7.4378 {"}'S' green -12.1689 0.3379 -7.2383 {"}'S' sea -12.0169 0.3122 -7.035 {"}'S' sea -12.254 0.5188 -7.8299 {"}'S' green -12.1452 0.3782 -7.6508 {"}'S' green -12.0145 0.2838 -7.4558 {"}'S' green -11.8672 0.2421 -7.2535 {"}'S' sea -11.7117 0.2541 -7.0556 {"}'S' green -12.1036 0.6396 -8.1014 {"}'S' green -12.0159 0.4635 -7.9379 {"}'S' green -11.8997 0.3317 -7.7525 {"}'S' green -11.7632 0.2504 -7.5524 {"}'S' green -11.6108 0.2254 -7.3487 {"}'S' green -11.8966 0.7631 -8.2773 {"}'S' green -11.8256 0.5668 -8.132 {"}'S' green -11.723 0.414 -7.9569 {"}'S' green -11.5945 0.3132 -7.7618 {"}'S' sea -11.4473 0.2702 -7.5592 {"}'S' sea -11.6539 0.8567 -8.3582 {"}'S' green -11.5894 0.6478 -8.2156 {"}'S' green -11.4857 0.4891 -8.0377 {HG21 VAL 494 A}'S' sea -13.0316 0.9105 -9.2914 {"}'S' sea -12.8761 0.9225 -9.0936 {"}'S' sea -12.7174 0.9869 -8.9068 {"}'S' sea -12.9276 0.9187 -9.5903 {"}'S' green -12.7752 0.8937 -9.3866 {"}'S' green -12.6158 0.9242 -9.1894 {"}'S' green -12.4578 1.0099 -9.0084 {"}'S' sea -12.6117 0.9385 -9.5971 {"}'S' green -12.4539 0.9555 -9.3991 {"}'S' sea -12.2958 1.0323 -9.2158 {"}'S' sea -12.3594 1.0384 -9.6665 {"}'S' sea -12.1962 1.0873 -9.4699 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 713 A}'M' greentint -9.453 2.1799 -6.2896 {"}'M' greentint -9.6016 2.023 -6.4381 {"}'M' greentint -9.7053 1.9266 -6.7355 {"}'M' greentint -9.3038 2.4101 -6.3517 {"}'M' greentint -9.4624 2.3169 -6.5301 {"}'M' greentint -9.6016 2.1489 -6.6633 {"}'M' greentint -9.6749 2.0207 -6.9803 {"}'M' greentint -9.1168 2.5992 -6.4196 {"}'M' greentint -9.277 2.5409 -6.6116 {"}'M' greentint -9.4318 2.4179 -6.7762 {"}'M' greentint -9.5675 2.2403 -6.9024 {"}'M' greentint -9.597 2.1009 -7.2186 {"}'M' greentint -9.6782 1.8577 -7.257 {"}'M' greentint -9.0336 2.7186 -6.663 {"}'M' greentint -9.1961 2.637 -6.8493 {"}'M' greentint -9.3483 2.501 -7.0093 {"}'M' greentint -9.485 2.3194 -7.1341 {"}'M' greentint -9.4825 2.1456 -7.4483 {"}'M' greentint -8.9392 2.782 -6.9226 {"}'M' greentint -9.095 2.6832 -7.096 {"}'M' greentint -9.2412 2.5397 -7.2459 {"}'M' greentint -9.3719 2.3577 -7.3643 {"}'M' greentint -8.9393 2.7105 -7.3012 {"}'M' greentint -9.086 2.5634 -7.451 {"}'M' greentint -9.218 2.3805 -7.571 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 494 A}'M' greentint -9.6193 1.9292 -6.4152 {"}'M' greentint -9.478 2.08 -6.2736 {"}'M' greentint -9.6636 1.792 -6.863 {"}'M' greentint -9.5054 1.8557 -6.6767 {"}'M' greentint -9.3551 1.9801 -6.5169 {"}'M' greentint -9.222 2.1557 -6.3938 {"}'M' greentint -9.1168 2.3703 -6.3161 {"}'M' greentint -9.613 1.8509 -7.2141 {"}'M' greentint -9.4548 1.8531 -7.0103 {"}'M' greentint -9.2941 1.9291 -6.8234 {"}'M' greentint -9.1446 2.0745 -6.671 {"}'M' greentint -9.02 2.2744 -6.5652 {"}'M' greentint -8.9314 2.512 -6.5172 {"}'M' greentint -9.5098 2.0136 -7.4691 {"}'M' greentint -9.3611 1.964 -7.263 {"}'M' greentint -9.1987 2.0089 -7.065 {"}'M' greentint -9.0445 2.1415 -6.9033 {"}'M' greentint -8.9203 2.3448 -6.7987 {"}'M' greentint -8.842 2.5905 -6.7666 {"}'M' greentint -9.2501 2.1475 -7.4334 {"}'M' greentint -9.0891 2.1755 -7.2334 {"}'M' greentint -8.941 2.3275 -7.0846 {"}'M' greentint -8.8462 2.5616 -7.0273 {"}'M' greentint -9.1166 2.3653 -7.487 {"}'M' greentint -8.9566 2.4622 -7.3075 {"}'M' greentint -8.9017 2.7155 -7.3073 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 713 A}'M' greentint -10.3126 0.5236 -4.6546 {"}'M' greentint -10.4458 0.42 -4.8541 {"}'M' greentint -10.1267 0.615 -4.4966 {"}'M' greentint -10.2309 0.7702 -4.6745 {"}'M' greentint -10.3909 0.6732 -4.8539 {"}'M' greentint -10.5012 0.5739 -5.1342 {"}'M' greentint -9.9656 0.8863 -4.5298 {"}'M' greentint -10.0974 0.988 -4.728 {"}'M' greentint -10.2584 0.9599 -4.928 {"}'M' greentint -10.4064 0.808 -5.0768 {"}'M' greentint -10.473 0.6713 -5.3878 {"}'M' greentint -9.7741 1.063 -4.5937 {"}'M' greentint -9.909 1.1579 -4.7946 {"}'M' greentint -10.0679 1.161 -5.0005 {"}'M' greentint -10.2281 1.07 -5.1834 {"}'M' greentint -10.3695 0.8994 -5.319 {"}'M' greentint -9.6604 1.2571 -4.845 {"}'M' greentint -9.8121 1.2926 -5.0501 {"}'M' greentint -9.9734 1.2534 -5.248 {"}'M' greentint -10.13 1.1414 -5.4194 {"}'M' greentint -10.2686 0.9666 -5.5501 {"}'M' greentint -9.6839 1.3435 -5.2984 {"}'M' greentint -9.8421 1.2798 -5.4847 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 494 A}'M' green -10.4233 0.4035 -4.77 {"}'M' green -10.2652 0.4775 -4.5862 {"}'M' green -9.5702 1.3002 -4.8545 {"}'M' green -9.7217 1.3343 -5.3685 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 494 A}'M' greentint -10.4776 0.4865 -5.2272 {"}'M' greentint -10.3204 0.4819 -5.0215 {"}'M' greentint -10.1578 0.5376 -4.8274 {"}'M' greentint -10 0.6479 -4.6539 {"}'M' greentint -9.8546 0.8096 -4.5109 {"}'M' greentint -10.394 0.6643 -5.4851 {"}'M' greentint -10.246 0.6173 -5.2806 {"}'M' greentint -10.0869 0.6398 -5.0801 {"}'M' greentint -9.9271 0.7283 -4.8991 {"}'M' greentint -9.7804 0.8779 -4.7515 {"}'M' greentint -9.6567 1.0777 -4.6468 {"}'M' greentint -10.2658 0.8761 -5.6366 {"}'M' greentint -10.1274 0.7993 -5.4351 {"}'M' greentint -9.9686 0.8103 -5.2342 {"}'M' greentint -9.8115 0.9062 -5.0569 {"}'M' greentint -9.6731 1.0767 -4.9253 {"}'M' greentint -9.9931 1.0071 -5.5109 {"}'M' greentint -9.8299 1.0363 -5.3082 {"}'M' greentint -9.6802 1.19 -5.1574 {"}'M' greentint -9.8804 1.2369 -5.5461 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n trp A 487 1w96A_489Y_508}P -11.4906 -1.5384 1.3233 {"}-11.4906 -1.5384 1.3233 { ca trp A 487 1w96A_489Y_508}-10.8106 -2.1503 0.1879 { c trp A 487 1w96A_489Y_508}-10.7704 -1.1138 -0.9319 { o trp A 487 1w96A_489Y_508}-11.7133 -0.3446 -1.1009 { c trp A 487 1w96A_489Y_508}P -10.7704 -1.1138 -0.9319 { n gly A 488 1w96A_489Y_508}-9.6855 -1.0945 -1.6972 { ca gly A 488 1w96A_489Y_508}-9.5734 -0.1268 -2.7697 { c gly A 488 1w96A_489Y_508}-8.6297 -0.5698 -3.8702 { o gly A 488 1w96A_489Y_508}-7.9565 -1.5926 -3.747 { c gly A 488 1w96A_489Y_508}P -8.6297 -0.5698 -3.8702 { n tyr A 489 1w96A_489Y_508}-8.5725 0.2071 -4.9435 { ca tyr A 489 1w96A_489Y_508}-7.7155 -0.1335 -6.0679 { c tyr A 489 1w96A_489Y_508}-7.4349 1.069 -6.95 { o tyr A 489 1w96A_489Y_508}-8.137 2.0789 -6.8978 { c tyr A 489 1w96A_489Y_508}P -7.4349 1.069 -6.95 { n phe A 490 1w96A_489Y_508}-6.4124 0.9166 -7.7836 { ca phe A 490 1w96A_489Y_508}-5.9953 1.9125 -8.7636 { c phe A 490 1w96A_489Y_508}-5.8532 1.0714 -10.0247 { o phe A 490 1w96A_489Y_508}-5.3102 -0.0282 -9.9662 { c phe A 490 1w96A_489Y_508}P -5.8532 1.0714 -10.0247 { n ser A 491 1w96A_489Y_508}-6.3409 1.5587 -11.1562 { ca ser A 491 1w96A_489Y_508}-6.2189 0.7722 -12.3753 { c ser A 491 1w96A_489Y_508}-5.6207 1.5399 -13.5443 { o ser A 491 1w96A_489Y_508}-5.892 2.7226 -13.7389 { n phe A 506 1w96A_489Y_508}P -7.0127 5.9746 -12.1698 {"}-7.0127 5.9746 -12.1698 { ca phe A 506 1w96A_489Y_508}-8.1711 6.2257 -11.3257 { c phe A 506 1w96A_489Y_508}-8.5913 4.9418 -10.6329 { o phe A 506 1w96A_489Y_508}-8.2113 3.8471 -11.0462 { c phe A 506 1w96A_489Y_508}P -8.5913 4.9418 -10.6329 { n gly A 507 1w96A_489Y_508}-9.373 5.0829 -9.5701 { ca gly A 507 1w96A_489Y_508}-9.8351 3.9188 -8.8441 { c gly A 507 1w96A_489Y_508}-10.8207 4.3399 -7.7787 { o gly A 507 1w96A_489Y_508}-11.2923 5.4745 -7.7818 { c gly A 507 1w96A_489Y_508}P -10.8207 4.3399 -7.7787 { n his A 508 1w96A_489Y_508}-11.1392 3.4226 -6.8751 { ca his A 508 1w96A_489Y_508}-12.0652 3.7192 -5.7922 { c his A 508 1w96A_489Y_508}-11.6653 2.9927 -4.5192 { o his A 508 1w96A_489Y_508}-10.9524 1.9881 -4.5527 { c his A 508 1w96A_489Y_508}P -11.6653 2.9927 -4.5192 { n ile A 509 1w96A_489Y_508}-12.1233 3.5295 -3.3965 { ca ile A 509 1w96A_489Y_508}-11.8999 2.9223 -2.1016 { c ile A 509 1w96A_489Y_508}-13.3095 2.7782 -1.5363 { o ile A 509 1w96A_489Y_508}-14.1121 3.7075 -1.6218 { c ile A 509 1w96A_489Y_508}P -13.3095 2.7782 -1.5363 { n phe A 510 1w96A_489Y_508}-13.6108 1.6082 -0.9923 { ca phe A 510 1w96A_489Y_508}-14.9251 1.3363 -0.4145 { c phe A 510 1w96A_489Y_508}-14.7464 1.0975 1.0787 { o phe A 510 1w96A_489Y_508}-13.903 0.3009 1.4837 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n trp A 487 1w96A_489Y_508}P -11.4906 -1.5384 1.3233 { ca trp A 487 1w96A_489Y_508}P -10.8106 -2.1503 0.1879 { n gly A 488 1w96A_489Y_508}P -9.6855 -1.0945 -1.6972 { ca gly A 488 1w96A_489Y_508}P -9.5734 -0.1268 -2.7697 {"}P -9.5734 -0.1268 -2.7697 { n tyr A 489 1w96A_489Y_508}P -8.5725 0.2071 -4.9435 { ca tyr A 489 1w96A_489Y_508}P -7.7155 -0.1335 -6.0679 { n phe A 490 1w96A_489Y_508}P -6.4124 0.9166 -7.7836 { ca phe A 490 1w96A_489Y_508}P -5.9953 1.9125 -8.7636 { n ser A 491 1w96A_489Y_508}P -6.3409 1.5587 -11.1562 { ca ser A 491 1w96A_489Y_508}P -6.2189 0.7722 -12.3753 { n phe A 506 1w96A_489Y_508}P -7.0127 5.9746 -12.1698 { ca phe A 506 1w96A_489Y_508}P -8.1711 6.2257 -11.3257 { n gly A 507 1w96A_489Y_508}P -9.373 5.0829 -9.5701 { ca gly A 507 1w96A_489Y_508}P -9.8351 3.9188 -8.8441 {"}P -9.8351 3.9188 -8.8441 { n his A 508 1w96A_489Y_508}P -11.1392 3.4226 -6.8751 { ca his A 508 1w96A_489Y_508}P -12.0652 3.7192 -5.7922 { n ile A 509 1w96A_489Y_508}P -12.1233 3.5295 -3.3965 { ca ile A 509 1w96A_489Y_508}P -11.8999 2.9223 -2.1016 { n phe A 510 1w96A_489Y_508}P -13.6108 1.6082 -0.9923 { ca phe A 510 1w96A_489Y_508}P -14.9251 1.3363 -0.4145 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca trp A 487 1w96A_489Y_508}P -10.8106 -2.1503 0.1879 {"}-10.8106 -2.1503 0.1879 { ca gly A 488 1w96A_489Y_508}-9.5734 -0.1268 -2.7697 { ca tyr A 489 1w96A_489Y_508}-7.7155 -0.1335 -6.0679 { ca phe A 490 1w96A_489Y_508}-5.9953 1.9125 -8.7636 { ca ser A 491 1w96A_489Y_508}-6.2189 0.7722 -12.3753 { ca phe A 506 1w96A_489Y_508}P -8.1711 6.2257 -11.3257 {"}-8.1711 6.2257 -11.3257 { ca gly A 507 1w96A_489Y_508}-9.8351 3.9188 -8.8441 { ca his A 508 1w96A_489Y_508}-12.0652 3.7192 -5.7922 { ca ile A 509 1w96A_489Y_508}-11.8999 2.9223 -2.1016 { ca phe A 510 1w96A_489Y_508}-14.9251 1.3363 -0.4145 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 489 1w96A_489Y_508}P -7.7155 -0.1335 -6.0679 { cb tyr A 489 1w96A_489Y_508}-8.3977 -1.1802 -6.9426 { cg tyr A 489 1w96A_489Y_508}-9.5917 -0.6047 -7.6805 { cd1 tyr A 489 1w96A_489Y_508}-10.8329 -0.4805 -7.0523 { ce1 tyr A 489 1w96A_489Y_508}-11.9179 0.0997 -7.7107 { cz tyr A 489 1w96A_489Y_508}-11.7617 0.5635 -9.0094 { oh tyr A 489 1w96A_489Y_508}-12.8191 1.1371 -9.6679 { cg tyr A 489 1w96A_489Y_508}P -9.5917 -0.6047 -7.6805 { cd2 tyr A 489 1w96A_489Y_508}-9.4652 -0.1334 -8.9857 { ce2 tyr A 489 1w96A_489Y_508}-10.5395 0.452 -9.653 { cz tyr A 489 1w96A_489Y_508}ghost -11.7617 0.5635 -9.0094 { ca his A 508 1w96A_489Y_508}P -12.0652 3.7192 -5.7922 { cb his A 508 1w96A_489Y_508}-13.4957 3.2891 -6.1504 { cg his A 508 1w96A_489Y_508}-14.1339 4.1151 -7.2232 { nd1 his A 508 1w96A_489Y_508}-13.8228 3.9729 -8.5581 { ce1 his A 508 1w96A_489Y_508}-14.5395 4.8265 -9.2678 { ne2 his A 508 1w96A_489Y_508}ghost -15.3025 5.5184 -8.4418 { cg his A 508 1w96A_489Y_508}P -14.1339 4.1151 -7.2232 { cd2 his A 508 1w96A_489Y_508}-15.0675 5.0935 -7.1556 { ne2 his A 508 1w96A_489Y_508}-15.3025 5.5184 -8.4418 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 489 1w96A_489Y_508}P -8.3977 -1.1802 -6.9426 {"}P -8.3977 -1.1802 -6.9426 { cd1 tyr A 489 1w96A_489Y_508}P -10.8329 -0.4805 -7.0523 { cd2 tyr A 489 1w96A_489Y_508}P -9.4652 -0.1334 -8.9857 { ce1 tyr A 489 1w96A_489Y_508}P -11.9179 0.0997 -7.7107 { ce2 tyr A 489 1w96A_489Y_508}P -10.5395 0.452 -9.653 { oh tyr A 489 1w96A_489Y_508}P -12.8191 1.1371 -9.6679 { cb his A 508 1w96A_489Y_508}P -13.4957 3.2891 -6.1504 {"}P -13.4957 3.2891 -6.1504 { cd2 his A 508 1w96A_489Y_508}P -15.0675 5.0935 -7.1556 { ce1 his A 508 1w96A_489Y_508}P -14.5395 4.8265 -9.2678 { ne2 his A 508 1w96A_489Y_508}P -15.3025 5.5184 -8.4418 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 489 A}'S' sky -12.5739 1.1124 -6.4427 {"}'S' sky -13.3074 1.1142 -7.3925 {"}'S' sky -12.372 1.2775 -6.4982 {"}'S' sky -12.2628 1.5156 -6.7418 {"}'S' blue -13.0382 1.4441 -7.7237 {"}'S' blue -12.1511 1.6823 -7.0013 {"}'S' sky -12.299 1.7321 -7.2063 {"}'S' sky -12.4549 1.7377 -7.4104 {"}'S' blue -12.6153 1.7015 -7.6077 { HE1 TYR 489 A}'S' blue -13.3231 0.7189 -6.4762 {"}'S' sky -13.4549 0.8206 -6.6744 {"}'S' sky -13.6159 0.7926 -6.8744 {"}'S' sky -13.5856 0.9026 -7.1298 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 489 A}'S' sea -12.8394 1.0239 -6.5443 {"}'S' green -12.9806 1.1049 -6.7506 {"}'S' green -12.6928 1.2392 -6.6324 {"}'S' green -12.8357 1.3057 -6.836 {"}'S' green -12.9934 1.3056 -7.0395 {"}'S' green -13.1541 1.2414 -7.2292 {"}'S' green -12.4935 1.3995 -6.6905 {"}'S' green -12.6358 1.4699 -6.8925 {"}'S' green -12.79 1.4876 -7.0971 {"}'S' green -12.9513 1.4498 -7.2952 {"}'S' sea -13.1099 1.3591 -7.4759 {"}'S' sea -12.4027 1.5966 -6.9446 {"}'S' green -12.5557 1.6308 -7.153 {"}'S' sea -12.7167 1.6158 -7.356 {"}'S' sea -12.8796 1.5532 -7.5488 { HE1 TYR 489 A}'S' sea -13.1316 0.8956 -6.5401 {"}'S' green -13.2665 0.9905 -6.741 {"}'S' sea -13.4253 0.9936 -6.9469 {"}'S' green -13.1696 1.1252 -6.9965 {"}'S' sea -13.3309 1.086 -7.1944 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 489 A}'S' green -13.7437 2.426 -8.6558 {"}'S' green -13.9193 2.4639 -9.0581 {"}'S' green -13.1938 2.5443 -8.4062 {"}'S' green -12.7853 2.809 -8.6961 {"}'S' green -13.0075 2.9857 -9.4605 @dotlist {x} color= red width= 1 master= {H-bonds} { HH TYR 489 A}'S' greentint -13.4785 2.5421 -8.5111 {"}'S' greentint -13.6102 2.6439 -8.7093 {"}'S' greentint -13.7712 2.6158 -8.9093 {"}'S' greentint -13.2869 2.7189 -8.575 {"}'S' greentint -13.4218 2.8137 -8.7759 {"}'S' greentint -13.5807 2.8169 -8.9818 {"}'S' greentint -13.7409 2.7258 -9.1647 {"}'S' greentint -13.0451 2.8038 -8.6296 {"}'S' greentint -13.1733 2.9129 -8.8263 {"}'S' greentint -13.3249 2.9484 -9.0314 {"}'S' greentint -13.4863 2.9093 -9.2293 {"}'S' greentint -13.6429 2.7972 -9.4007 {"}'S' greentint -12.9025 2.9336 -8.8813 {"}'S' greentint -13.0424 2.9987 -9.0806 {"}'S' greentint -13.1968 2.9994 -9.2797 {"}'S' greentint -13.355 2.9357 -9.466 {"}'S' greentint -12.8534 2.9925 -9.2634 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 HIS 508 A}'S' sky -13.7097 1.1756 -6.9073 {"}'S' sky -13.2614 1.0998 -6.3063 {"}'S' sky -13.533 1.2579 -7.1117 {"}'S' sky -12.9414 1.2079 -6.3327 {"}'S' sky -13.3994 1.4918 -7.3704 {"}'S' sky -12.4719 1.6452 -6.5222 {"}'S' sky -12.9715 1.8772 -7.4632 {"}'S' sky -12.7504 1.9479 -7.3411 {"}'S' sky -12.485 1.8892 -6.982 {"}'S' blue -12.5672 2.0409 -7.1786 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 HIS 508 A}'S' sea -13.5732 1.0943 -6.7072 {"}'S' sea -13.4208 1.0693 -6.5035 {"}'S' green -13.4045 1.1572 -6.9166 {"}'S' green -13.2573 1.1141 -6.714 {"}'S' sea -13.0995 1.1311 -6.516 {"}'S' sea -13.2957 1.333 -7.1925 {"}'S' green -13.1608 1.2382 -6.9916 {"}'S' green -13.005 1.2139 -6.7834 {"}'S' green -12.8418 1.2629 -6.5868 {"}'S' sea -12.6846 1.3813 -6.416 {"}'S' sea -13.1612 1.5986 -7.4007 {"}'S' green -13.0586 1.4459 -7.2257 {"}'S' green -12.9215 1.3708 -7.0262 {"}'S' green -12.7651 1.3816 -6.827 {"}'S' green -12.609 1.477 -6.6524 {"}'S' green -12.9037 1.6688 -7.3178 {"}'S' green -12.7703 1.566 -7.1171 {"}'S' green -12.6068 1.5946 -6.9138 {"}'S' sea -12.4562 1.7485 -6.7618 {"}'S' sea -12.6454 1.7915 -7.1618 @dotlist {x} color= sky width= 1 master= {vdw contact} { ND1 HIS 508 A}'S' green -13.8505 2.4418 -8.7985 {"}'S' green -13.6919 2.4289 -8.5908 {"}'S' green -13.5283 2.4603 -8.388 {"}'S' green -13.2079 2.5586 -8.4014 {"}'S' green -13.5224 2.8679 -9.6025 {"}'S' green -12.7576 2.8476 -8.6089 {"}'S' green -13.3006 2.9908 -9.6383 {"}'S' green -12.703 2.9421 -8.8515 {"}'S' green -12.9167 3.023 -9.3826 {"}'S' green -12.7587 3.0341 -9.1811 @dotlist {x} color= sky width= 1 master= {H-bonds} { ND1 HIS 508 A}'S' greentint -13.8342 2.5688 -9.2137 {"}'S' greentint -13.6896 2.4948 -9.0076 {"}'S' greentint -13.5338 2.4692 -8.7991 {"}'S' greentint -13.3717 2.4902 -8.5943 {"}'S' greentint -13.6359 2.6572 -9.3558 {"}'S' greentint -13.4934 2.5782 -9.1498 {"}'S' greentint -13.3369 2.5514 -8.94 {"}'S' greentint -13.1738 2.5764 -8.7366 {"}'S' greentint -13.0102 2.6537 -8.5459 {"}'S' greentint -13.395 2.7469 -9.4041 {"}'S' greentint -13.2462 2.6828 -9.1947 {"}'S' greentint -13.0844 2.6782 -8.9845 {"}'S' greentint -12.9197 2.734 -8.7857 {"}'S' greentint -13.1737 2.878 -9.4426 {"}'S' greentint -13.0245 2.8305 -9.2364 {"}'S' greentint -12.8632 2.8524 -9.0347 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 489 A}'M' blue -9.4527 2.3636 -6.5139 {"}'M' blue -9.4665 2.1077 -6.4607 {"}'M' sky -9.4627 2.506 -6.7567 {"}'M' sky -9.5193 2.2565 -6.7599 {"}'M' blue -9.5207 2.0092 -6.6934 {"}'M' sky -9.5035 2.3549 -7.0257 {"}'M' sky -9.5341 2.1011 -6.9941 {"}'M' blue -9.5198 1.859 -6.9091 {"}'M' blue -9.4357 2.437 -7.2781 {"}'M' blue -9.4831 2.1826 -7.2677 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H HIS 508 A}'M' blue -9.8963 2.2221 -6.4848 {"}'M' blue -9.8518 2.4769 -6.4975 {"}'M' blue -9.8852 2.0549 -6.7663 {"}'M' -9.8069 2.3006 -6.7342 {"}'M' -9.7859 2.556 -6.7775 {"}'M' blue -9.906 2.0375 -7.0522 {"}'M' -9.8112 2.2717 -6.9949 {"}'M' -9.7949 2.5254 -7.0442 {"}'M' blue -9.9216 2.1723 -7.2751 {"}'M' blue -9.8666 2.4256 -7.2749 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 489 A}'M' green -9.9026 0.9621 -4.473 {"}'M' green -9.6877 1.3123 -4.2934 {"}'M' green -9.5267 1.5836 -4.3266 {"}'M' green -9.47 1.8552 -4.5914 {"}'M' green -9.9371 1.4429 -5.4245 {"}'M' green -9.5345 1.9507 -5.0447 {"}'M' green -9.6911 1.8387 -5.2161 {"}'M' green -9.8297 1.664 -5.3469 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 489 A}'M' greentint -9.8736 1.2209 -4.4513 {"}'M' greentint -10.0068 1.1173 -4.6508 {"}'M' greentint -9.7919 1.4675 -4.4712 {"}'M' greentint -9.9519 1.3706 -4.6506 {"}'M' greentint -10.0623 1.2712 -4.9309 {"}'M' greentint -10.0786 1.0175 -4.8816 {"}'M' greentint -9.6584 1.6853 -4.5247 {"}'M' greentint -9.8194 1.6573 -4.7247 {"}'M' greentint -9.9675 1.5053 -4.8736 {"}'M' greentint -10.034 1.3686 -5.1845 {"}'M' greentint -10.0844 1.114 -5.1799 {"}'M' greentint -9.6289 1.8584 -4.7973 {"}'M' greentint -9.7891 1.7673 -4.9801 {"}'M' greentint -9.9306 1.5968 -5.1157 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O HIS 508 A}'M' green -10.0537 0.9162 -4.4913 {"}'M' green -9.9083 1.078 -4.3483 {"}'M' green -9.7837 1.2804 -4.2447 {"}'M' green -10.1406 0.9081 -4.9175 {"}'M' green -9.5666 1.8311 -4.4325 {"}'M' green -10.1811 1.0676 -5.2725 {"}'M' green -10.0468 1.2755 -5.3482 {"}'M' green -9.6222 1.9512 -4.9871 {"}'M' green -9.9342 1.5053 -5.3834 {"}'M' green -9.7201 1.8539 -5.2046 {"}'M' green -9.8605 1.7532 -5.3974 @dotlist {x} color= red width= 1 master= {H-bonds} { O HIS 508 A}'M' greentint -9.9809 0.9967 -4.7365 {"}'M' greentint -9.8341 1.1463 -4.5889 {"}'M' greentint -9.7104 1.3461 -4.4842 {"}'M' greentint -9.6186 1.5802 -4.4309 {"}'M' greentint -10.0223 1.0786 -5.0716 {"}'M' greentint -9.8653 1.1745 -4.8942 {"}'M' greentint -9.7268 1.3451 -4.7627 {"}'M' greentint -9.6239 1.5686 -4.6918 {"}'M' greentint -9.5695 1.8183 -4.6915 {"}'M' greentint -9.8837 1.3047 -5.1456 {"}'M' greentint -9.7339 1.4584 -4.9948 {"}'M' greentint -9.6386 1.6947 -4.9373 {"}'M' greentint -9.7755 1.6026 -5.2058 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 62 1wbiA_64F_77F}P -12.0391 -1.7385 1.0944 {"}-12.0391 -1.7385 1.0944 { ca phe A 62 1wbiA_64F_77F}-11.0024 -2.0468 0.1192 { c phe A 62 1wbiA_64F_77F}-10.7346 -0.8411 -0.7555 { o phe A 62 1wbiA_64F_77F}-11.535 0.0885 -0.8159 { c phe A 62 1wbiA_64F_77F}P -10.7346 -0.8411 -0.7555 { n gly A 63 1wbiA_64F_77F}-9.6487 -0.9137 -1.5189 { ca gly A 63 1wbiA_64F_77F}-9.3314 0.0972 -2.5071 { c gly A 63 1wbiA_64F_77F}-8.5625 -0.5192 -3.6566 { o gly A 63 1wbiA_64F_77F}-7.9109 -1.5903 -3.4801 { c gly A 63 1wbiA_64F_77F}P -8.5625 -0.5192 -3.6566 { n phe A 64 1wbiA_64F_77F}-8.6379 0.1002 -4.8375 { ca phe A 64 1wbiA_64F_77F}-7.7675 -0.2781 -5.9299 { c phe A 64 1wbiA_64F_77F}-7.4785 0.8679 -6.8663 { o phe A 64 1wbiA_64F_77F}-8.2241 1.8325 -6.9196 { c phe A 64 1wbiA_64F_77F}P -7.4785 0.8679 -6.8663 { n thr A 65 1wbiA_64F_77F}-6.4015 0.6931 -7.6238 { ca thr A 65 1wbiA_64F_77F}-5.9246 1.6273 -8.6462 { c thr A 65 1wbiA_64F_77F}-6.0894 0.9704 -10.0049 { o thr A 65 1wbiA_64F_77F}-5.7858 -0.2324 -10.1442 { c thr A 65 1wbiA_64F_77F}P -6.0894 0.9704 -10.0049 { n val A 66 1wbiA_64F_77F}-6.6168 1.7175 -10.9749 { ca val A 66 1wbiA_64F_77F}-6.592 1.2903 -12.3763 { c val A 66 1wbiA_64F_77F}-5.6628 2.1744 -13.1793 { o val A 66 1wbiA_64F_77F}-5.8207 3.3847 -13.2595 { n ser A 75 1wbiA_64F_77F}P -7.2273 6.0033 -12.386 {"}-7.2273 6.0033 -12.386 { ca ser A 75 1wbiA_64F_77F}-8.3736 6.0879 -11.4651 { c ser A 75 1wbiA_64F_77F}-8.1099 5.2852 -10.2004 { o ser A 75 1wbiA_64F_77F}-7.3909 4.319 -10.236 { c ser A 75 1wbiA_64F_77F}P -8.1099 5.2852 -10.2004 { n val A 76 1wbiA_64F_77F}-8.7137 5.7196 -9.0861 { ca val A 76 1wbiA_64F_77F}-8.7437 4.9324 -7.8606 { c val A 76 1wbiA_64F_77F}-10.1665 4.8177 -7.3593 { o val A 76 1wbiA_64F_77F}-11.0114 5.7373 -7.5517 { c val A 76 1wbiA_64F_77F}P -10.1665 4.8177 -7.3593 { n phe A 77 1wbiA_64F_77F}-10.465 3.6418 -6.8119 { ca phe A 77 1wbiA_64F_77F}-11.7624 3.3027 -6.2402 { c phe A 77 1wbiA_64F_77F}-11.5792 2.9125 -4.7933 { o phe A 77 1wbiA_64F_77F}-10.6554 2.1684 -4.4563 { c phe A 77 1wbiA_64F_77F}P -11.5792 2.9125 -4.7933 { n val A 78 1wbiA_64F_77F}-12.4959 3.3358 -3.9231 { ca val A 78 1wbiA_64F_77F}-12.4649 2.886 -2.5101 { c val A 78 1wbiA_64F_77F}-13.8679 2.5983 -2.0755 { o val A 78 1wbiA_64F_77F}-14.8189 3.2579 -2.5023 { c val A 78 1wbiA_64F_77F}P -13.8679 2.5983 -2.0755 { n gly A 79 1wbiA_64F_77F}-14.0713 1.595 -1.236 { ca gly A 79 1wbiA_64F_77F}-15.4091 1.2669 -0.8603 { c gly A 79 1wbiA_64F_77F}-15.5113 0.1787 0.1593 { o gly A 79 1wbiA_64F_77F}-14.5271 -0.1277 0.8531 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 62 1wbiA_64F_77F}P -12.0391 -1.7385 1.0944 { ca phe A 62 1wbiA_64F_77F}P -11.0024 -2.0468 0.1192 { n gly A 63 1wbiA_64F_77F}P -9.6487 -0.9137 -1.5189 { ca gly A 63 1wbiA_64F_77F}P -9.3314 0.0972 -2.5071 {"}P -9.3314 0.0972 -2.5071 { n phe A 64 1wbiA_64F_77F}P -8.6379 0.1002 -4.8375 { ca phe A 64 1wbiA_64F_77F}P -7.7675 -0.2781 -5.9299 { n thr A 65 1wbiA_64F_77F}P -6.4015 0.6931 -7.6238 { ca thr A 65 1wbiA_64F_77F}P -5.9246 1.6273 -8.6462 { n val A 66 1wbiA_64F_77F}P -6.6168 1.7175 -10.9749 { ca val A 66 1wbiA_64F_77F}P -6.592 1.2903 -12.3763 { n ser A 75 1wbiA_64F_77F}P -7.2273 6.0033 -12.386 { ca ser A 75 1wbiA_64F_77F}P -8.3736 6.0879 -11.4651 { n val A 76 1wbiA_64F_77F}P -8.7137 5.7196 -9.0861 { ca val A 76 1wbiA_64F_77F}P -8.7437 4.9324 -7.8606 { n phe A 77 1wbiA_64F_77F}P -10.465 3.6418 -6.8119 { ca phe A 77 1wbiA_64F_77F}P -11.7624 3.3027 -6.2402 { n val A 78 1wbiA_64F_77F}P -12.4959 3.3358 -3.9231 { ca val A 78 1wbiA_64F_77F}P -12.4649 2.886 -2.5101 { n gly A 79 1wbiA_64F_77F}P -14.0713 1.595 -1.236 { ca gly A 79 1wbiA_64F_77F}P -15.4091 1.2669 -0.8603 {"}P -15.4091 1.2669 -0.8603 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 62 1wbiA_64F_77F}P -11.0024 -2.0468 0.1192 {"}-11.0024 -2.0468 0.1192 { ca gly A 63 1wbiA_64F_77F}-9.3314 0.0972 -2.5071 { ca phe A 64 1wbiA_64F_77F}-7.7675 -0.2781 -5.9299 { ca thr A 65 1wbiA_64F_77F}-5.9246 1.6273 -8.6462 { ca val A 66 1wbiA_64F_77F}-6.592 1.2903 -12.3763 { ca ser A 75 1wbiA_64F_77F}P -8.3736 6.0879 -11.4651 {"}-8.3736 6.0879 -11.4651 { ca val A 76 1wbiA_64F_77F}-8.7437 4.9324 -7.8606 { ca phe A 77 1wbiA_64F_77F}-11.7624 3.3027 -6.2402 { ca val A 78 1wbiA_64F_77F}-12.4649 2.886 -2.5101 { ca gly A 79 1wbiA_64F_77F}-15.4091 1.2669 -0.8603 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 64 1wbiA_64F_77F}P -7.7675 -0.2781 -5.9299 { cb phe A 64 1wbiA_64F_77F}-8.2847 -1.524 -6.6908 { cg phe A 64 1wbiA_64F_77F}-9.6426 -1.3668 -7.3249 { cd1 phe A 64 1wbiA_64F_77F}-9.7821 -0.9409 -8.621 { ce1 phe A 64 1wbiA_64F_77F}-11.0282 -0.81 -9.2057 { cz phe A 64 1wbiA_64F_77F}-12.1667 -1.1959 -8.5257 { cg phe A 64 1wbiA_64F_77F}P -9.6426 -1.3668 -7.3249 { cd2 phe A 64 1wbiA_64F_77F}-10.7843 -1.7423 -6.6397 { ce2 phe A 64 1wbiA_64F_77F}-12.0429 -1.6084 -7.2028 { cz phe A 64 1wbiA_64F_77F}ghost -12.1667 -1.1959 -8.5257 { ca phe A 77 1wbiA_64F_77F}P -11.7624 3.3027 -6.2402 { cb phe A 77 1wbiA_64F_77F}-12.3637 2.0985 -7.0024 { cg phe A 77 1wbiA_64F_77F}-12.7548 2.3549 -8.45 { cd1 phe A 77 1wbiA_64F_77F}-14.0627 2.5239 -8.7809 { ce1 phe A 77 1wbiA_64F_77F}-14.4298 2.7417 -10.1355 { cz phe A 77 1wbiA_64F_77F}-13.4623 2.8747 -11.0753 { cg phe A 77 1wbiA_64F_77F}P -12.7548 2.3549 -8.45 { cd2 phe A 77 1wbiA_64F_77F}-11.7952 2.4713 -9.4446 { ce2 phe A 77 1wbiA_64F_77F}-12.1856 2.7171 -10.7844 { cz phe A 77 1wbiA_64F_77F}ghost -13.4623 2.8747 -11.0753 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 64 1wbiA_64F_77F}P -8.2847 -1.524 -6.6908 {"}P -8.2847 -1.524 -6.6908 { cd1 phe A 64 1wbiA_64F_77F}P -9.7821 -0.9409 -8.621 { cd2 phe A 64 1wbiA_64F_77F}P -10.7843 -1.7423 -6.6397 { ce1 phe A 64 1wbiA_64F_77F}P -11.0282 -0.81 -9.2057 { ce2 phe A 64 1wbiA_64F_77F}P -12.0429 -1.6084 -7.2028 { cz phe A 64 1wbiA_64F_77F}P -12.1667 -1.1959 -8.5257 { cb phe A 77 1wbiA_64F_77F}P -12.3637 2.0985 -7.0024 {"}P -12.3637 2.0985 -7.0024 { cd1 phe A 77 1wbiA_64F_77F}P -14.0627 2.5239 -8.7809 { cd2 phe A 77 1wbiA_64F_77F}P -11.7952 2.4713 -9.4446 { ce1 phe A 77 1wbiA_64F_77F}P -14.4298 2.7417 -10.1355 { ce2 phe A 77 1wbiA_64F_77F}P -12.1856 2.7171 -10.7844 { cz phe A 77 1wbiA_64F_77F}P -13.4623 2.8747 -11.0753 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 64 A}'S' blue -10.4414 0.1493 -6.9702 {"}'S' blue -10.6042 0.0866 -7.163 {"}'S' 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@dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 64 A}'M' greentint -9.3962 2.225 -6.2632 {"}'M' greentint -9.5398 2.1172 -6.5357 {"}'M' greentint -9.1342 2.5462 -6.1306 {"}'M' greentint -9.2975 2.5129 -6.3324 {"}'M' greentint -9.4461 2.3559 -6.4809 {"}'M' greentint -9.5498 2.2596 -6.7784 {"}'M' greentint -9.6063 2.0101 -6.7816 {"}'M' greentint -8.9903 2.7514 -6.1926 {"}'M' greentint -9.1482 2.743 -6.3946 {"}'M' greentint -9.3068 2.6499 -6.573 {"}'M' greentint -9.4461 2.4819 -6.7062 {"}'M' greentint -9.5194 2.3536 -7.0232 {"}'M' greentint -9.5906 2.1085 -7.0474 {"}'M' greentint -8.9613 2.9321 -6.4625 {"}'M' greentint -9.1215 2.8739 -6.6544 {"}'M' greentint -9.2762 2.7508 -6.8191 {"}'M' greentint -9.412 2.5733 -6.9453 {"}'M' greentint -9.4415 2.4338 -7.2614 {"}'M' greentint -9.5227 2.1906 -7.2998 {"}'M' greentint -8.8785 3.0521 -6.7066 {"}'M' greentint -9.0406 2.9699 -6.8922 {"}'M' greentint -9.1928 2.834 -7.0522 {"}'M' greentint -9.3295 2.6524 -7.177 {"}'M' greentint -9.327 2.4786 -7.4911 {"}'M' greentint -8.9395 3.0162 -7.1388 {"}'M' greentint -9.0856 2.8726 -7.2887 {"}'M' greentint -9.2164 2.6906 -7.4072 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 77 A}'M' greentint -9.4942 1.97 -6.5269 {"}'M' greentint -9.344 2.0944 -6.3671 {"}'M' greentint -9.2108 2.27 -6.244 {"}'M' greentint -9.1056 2.4847 -6.1663 {"}'M' greentint -9.6018 1.9653 -7.0643 {"}'M' greentint -9.4436 1.9675 -6.8605 {"}'M' greentint -9.2829 2.0435 -6.6736 {"}'M' greentint -9.1334 2.1888 -6.5212 {"}'M' greentint -9.0088 2.3888 -6.4154 {"}'M' greentint -8.9203 2.6264 -6.3674 {"}'M' greentint -8.8757 2.8811 -6.3801 {"}'M' greentint -9.4987 2.128 -7.3193 {"}'M' greentint -9.3499 2.0783 -7.1132 {"}'M' greentint -9.1876 2.1232 -6.9152 {"}'M' greentint -9.0334 2.2559 -6.7535 {"}'M' greentint -8.9091 2.4592 -6.6489 {"}'M' greentint -8.8308 2.7049 -6.6168 {"}'M' greentint -8.8098 2.9603 -6.6601 {"}'M' greentint -9.3707 2.3635 -7.4818 {"}'M' greentint -9.2389 2.2618 -7.2836 {"}'M' greentint -9.0779 2.2899 -7.0836 {"}'M' greentint -8.9299 2.4418 -6.9348 {"}'M' greentint -8.8351 2.6759 -6.8775 {"}'M' greentint -8.8188 2.9296 -6.9268 {"}'M' greentint -9.1054 2.4796 -7.3372 {"}'M' greentint -8.9455 2.5766 -7.1577 {"}'M' greentint -8.8905 2.8298 -7.1575 {"}'M' greentint -9.0238 2.7262 -7.357 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 64 A}'M' greentint -10.0565 1.0097 -4.4429 {"}'M' greentint -10.1897 0.906 -4.6424 {"}'M' greentint -9.8706 1.1011 -4.2849 {"}'M' greentint -9.9748 1.2562 -4.4628 {"}'M' greentint -10.1348 1.1593 -4.6422 {"}'M' greentint -10.2452 1.06 -4.9225 {"}'M' greentint -9.7096 1.3723 -4.3181 {"}'M' greentint -9.8413 1.4741 -4.5163 {"}'M' greentint -10.0023 1.446 -4.7163 {"}'M' greentint -10.1504 1.2941 -4.8651 {"}'M' greentint -10.2169 1.1574 -5.1761 {"}'M' greentint -9.518 1.5491 -4.382 {"}'M' greentint -9.6529 1.6439 -4.5829 {"}'M' greentint -9.8118 1.6471 -4.7888 {"}'M' greentint -9.972 1.556 -4.9717 {"}'M' greentint -10.1135 1.3855 -5.1073 {"}'M' greentint -9.4044 1.7432 -4.6333 {"}'M' greentint -9.556 1.7787 -4.8384 {"}'M' greentint -9.7173 1.7395 -5.0363 {"}'M' greentint -9.874 1.6274 -5.2077 {"}'M' greentint -10.0125 1.4527 -5.3384 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 77 A}'M' green -9.3269 1.7488 -4.5954 {"}'M' green -9.8828 1.5593 -5.452 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 77 A}'M' greentint -10.2344 0.9351 -4.9681 {"}'M' greentint -10.0772 0.9305 -4.7624 {"}'M' greentint -9.9146 0.9862 -4.5683 {"}'M' greentint -9.7567 1.0965 -4.3948 {"}'M' greentint -9.6114 1.2582 -4.2519 {"}'M' greentint -10.1508 1.1129 -5.226 {"}'M' greentint -10.0028 1.0659 -5.0215 {"}'M' greentint -9.8436 1.0884 -4.821 {"}'M' greentint -9.6839 1.1769 -4.64 {"}'M' greentint -9.5372 1.3265 -4.4925 {"}'M' greentint -9.4135 1.5263 -4.3878 {"}'M' greentint -10.0225 1.3247 -5.3775 {"}'M' greentint -9.8842 1.2479 -5.176 {"}'M' greentint -9.7254 1.2589 -4.9751 {"}'M' greentint -9.5683 1.3548 -4.7978 {"}'M' greentint -9.4299 1.5253 -4.6663 {"}'M' greentint -9.7499 1.4557 -5.2518 {"}'M' greentint -9.5867 1.4849 -5.0492 {"}'M' greentint -9.437 1.6386 -4.8983 {"}'M' greentint -9.6372 1.6855 -5.287 {"}'M' greentint -9.4785 1.7829 -5.1094 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 162 1wd3A_164Y_310}P -11.4077 -1.3663 1.4162 {"}-11.4077 -1.3663 1.4162 { ca gly A 162 1wd3A_164Y_310}-10.7713 -1.9788 0.2709 { c gly A 162 1wd3A_164Y_310}-10.5455 -0.8317 -0.6956 { o gly A 162 1wd3A_164Y_310}-11.1451 0.2292 -0.5372 { c gly A 162 1wd3A_164Y_310}P -10.5455 -0.8317 -0.6956 { n met A 163 1wd3A_164Y_310}-9.6725 -1.0216 -1.679 { ca met A 163 1wd3A_164Y_310}-9.4091 0.0168 -2.6667 { c met A 163 1wd3A_164Y_310}-8.6798 -0.6082 -3.841 { o met A 163 1wd3A_164Y_310}-8.1107 -1.6893 -3.7221 { c met A 163 1wd3A_164Y_310}P -8.6798 -0.6082 -3.841 { n tyr A 164 1wd3A_164Y_310}-8.7261 0.0527 -4.9883 { ca tyr A 164 1wd3A_164Y_310}-8.0051 -0.4345 -6.1506 { c tyr A 164 1wd3A_164Y_310}-7.7544 0.7651 -7.0337 { o tyr A 164 1wd3A_164Y_310}-8.3885 1.8106 -6.8744 { c tyr A 164 1wd3A_164Y_310}P -7.7544 0.7651 -7.0337 { n ala A 165 1wd3A_164Y_310}-6.8046 0.616 -7.9452 { ca ala A 165 1wd3A_164Y_310}-6.493 1.6708 -8.8845 { c ala A 165 1wd3A_164Y_310}-5.9173 1.0125 -10.1211 { o ala A 165 1wd3A_164Y_310}-5.268 -0.0315 -10.0343 { c ala A 165 1wd3A_164Y_310}P -5.9173 1.0125 -10.1211 { n val A 166 1wd3A_164Y_310}-6.1955 1.5999 -11.2779 { ca val A 166 1wd3A_164Y_310}-5.6381 1.1019 -12.5265 { c val A 166 1wd3A_164Y_310}-4.549 2.1245 -12.8077 { o val A 166 1wd3A_164Y_310}-4.8295 3.3153 -12.9724 { n glu A 308 1wd3A_164Y_310}P -8.1664 5.137 -12.966 {"}-8.1664 5.137 -12.966 { ca glu A 308 1wd3A_164Y_310}-9.3964 4.9817 -12.2038 { c glu A 308 1wd3A_164Y_310}-9.0747 4.3011 -10.8826 { o glu A 308 1wd3A_164Y_310}-8.039 3.6437 -10.7472 { c glu A 308 1wd3A_164Y_310}P -9.0747 4.3011 -10.8826 { n gly A 309 1wd3A_164Y_310}-9.9591 4.4723 -9.9089 { ca gly A 309 1wd3A_164Y_310}-9.7512 3.8547 -8.614 { c gly A 309 1wd3A_164Y_310}-10.8786 4.1799 -7.6624 { o gly A 309 1wd3A_164Y_310}-11.6273 5.1352 -7.8801 { c gly A 309 1wd3A_164Y_310}P -10.8786 4.1799 -7.6624 { n val A 310 1wd3A_164Y_310}-11.0149 3.3838 -6.6074 { ca val A 310 1wd3A_164Y_310}-12.0633 3.6159 -5.6223 { c val A 310 1wd3A_164Y_310}-11.5882 3.1986 -4.2439 { o val A 310 1wd3A_164Y_310}-10.5445 2.5664 -4.0999 { c val A 310 1wd3A_164Y_310}P -11.5882 3.1986 -4.2439 { n met A 311 1wd3A_164Y_310}-12.3685 3.5841 -3.24 { ca met A 311 1wd3A_164Y_310}-12.1331 3.2262 -1.8506 { c met A 311 1wd3A_164Y_310}-13.4978 2.7603 -1.3589 { o met A 311 1wd3A_164Y_310}-14.5169 3.3514 -1.7127 { c met A 311 1wd3A_164Y_310}P -13.4978 2.7603 -1.3589 { n thr A 312 1wd3A_164Y_310}-13.5232 1.7035 -0.5543 { ca thr A 312 1wd3A_164Y_310}-14.7897 1.1705 -0.0669 { c thr A 312 1wd3A_164Y_310}-14.8834 1.1443 1.4463 { o thr A 312 1wd3A_164Y_310}-13.9042 1.3866 2.1518 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 162 1wd3A_164Y_310}P -11.4077 -1.3663 1.4162 { ca gly A 162 1wd3A_164Y_310}P -10.7713 -1.9788 0.2709 {"}P -10.7713 -1.9788 0.2709 { n met A 163 1wd3A_164Y_310}P -9.6725 -1.0216 -1.679 { ca met A 163 1wd3A_164Y_310}P -9.4091 0.0168 -2.6667 { n tyr A 164 1wd3A_164Y_310}P -8.7261 0.0527 -4.9883 { ca tyr A 164 1wd3A_164Y_310}P -8.0051 -0.4345 -6.1506 { n ala A 165 1wd3A_164Y_310}P -6.8046 0.616 -7.9452 { ca ala A 165 1wd3A_164Y_310}P -6.493 1.6708 -8.8845 { n val A 166 1wd3A_164Y_310}P -6.1955 1.5999 -11.2779 { ca val A 166 1wd3A_164Y_310}P -5.6381 1.1019 -12.5265 { n glu A 308 1wd3A_164Y_310}P -8.1664 5.137 -12.966 { ca glu A 308 1wd3A_164Y_310}P -9.3964 4.9817 -12.2038 { n gly A 309 1wd3A_164Y_310}P -9.9591 4.4723 -9.9089 { ca gly A 309 1wd3A_164Y_310}P -9.7512 3.8547 -8.614 {"}P -9.7512 3.8547 -8.614 { n val A 310 1wd3A_164Y_310}P -11.0149 3.3838 -6.6074 { ca val A 310 1wd3A_164Y_310}P -12.0633 3.6159 -5.6223 { n met A 311 1wd3A_164Y_310}P -12.3685 3.5841 -3.24 { ca met A 311 1wd3A_164Y_310}P -12.1331 3.2262 -1.8506 { n thr A 312 1wd3A_164Y_310}P -13.5232 1.7035 -0.5543 { ca thr A 312 1wd3A_164Y_310}P -14.7897 1.1705 -0.0669 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 162 1wd3A_164Y_310}P -10.7713 -1.9788 0.2709 {"}-10.7713 -1.9788 0.2709 { ca met A 163 1wd3A_164Y_310}-9.4091 0.0168 -2.6667 { ca tyr A 164 1wd3A_164Y_310}-8.0051 -0.4345 -6.1506 { ca ala A 165 1wd3A_164Y_310}-6.493 1.6708 -8.8845 { ca val A 166 1wd3A_164Y_310}-5.6381 1.1019 -12.5265 { ca glu A 308 1wd3A_164Y_310}P -9.3964 4.9817 -12.2038 {"}-9.3964 4.9817 -12.2038 { ca gly A 309 1wd3A_164Y_310}-9.7512 3.8547 -8.614 { ca val A 310 1wd3A_164Y_310}-12.0633 3.6159 -5.6223 { ca met A 311 1wd3A_164Y_310}-12.1331 3.2262 -1.8506 { ca thr A 312 1wd3A_164Y_310}-14.7897 1.1705 -0.0669 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 164 1wd3A_164Y_310}P -8.0051 -0.4345 -6.1506 { cb tyr A 164 1wd3A_164Y_310}-8.8147 -1.4945 -6.9247 { cg tyr A 164 1wd3A_164Y_310}-9.7785 -0.9305 -7.9555 { cd1 tyr A 164 1wd3A_164Y_310}-9.3442 -0.5923 -9.2437 { ce1 tyr A 164 1wd3A_164Y_310}-10.2238 -0.0401 -10.1789 { cz tyr A 164 1wd3A_164Y_310}-11.5503 0.1733 -9.8277 { oh tyr A 164 1wd3A_164Y_310}-12.4253 0.7219 -10.7353 { cg tyr A 164 1wd3A_164Y_310}P -9.7785 -0.9305 -7.9555 { cd2 tyr A 164 1wd3A_164Y_310}-11.1172 -0.7072 -7.6334 { ce2 tyr A 164 1wd3A_164Y_310}-12.0037 -0.1585 -8.5619 { cz tyr A 164 1wd3A_164Y_310}ghost -11.5503 0.1733 -9.8277 { ca val A 310 1wd3A_164Y_310}P -12.0633 3.6159 -5.6223 { cb val A 310 1wd3A_164Y_310}-13.3556 2.8057 -5.929 { cg1 val A 310 1wd3A_164Y_310}-13.7353 2.942 -7.3966 { cb val A 310 1wd3A_164Y_310}P -13.3556 2.8057 -5.929 { cg2 val A 310 1wd3A_164Y_310}-13.1603 1.3358 -5.5589 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 164 1wd3A_164Y_310}P -8.8147 -1.4945 -6.9247 {"}P -8.8147 -1.4945 -6.9247 { cd1 tyr A 164 1wd3A_164Y_310}P -9.3442 -0.5923 -9.2437 { cd2 tyr A 164 1wd3A_164Y_310}P -11.1172 -0.7072 -7.6334 { ce1 tyr A 164 1wd3A_164Y_310}P -10.2238 -0.0401 -10.1789 { ce2 tyr A 164 1wd3A_164Y_310}P -12.0037 -0.1585 -8.5619 { oh tyr A 164 1wd3A_164Y_310}P -12.4253 0.7219 -10.7353 { cb val A 310 1wd3A_164Y_310}P -13.3556 2.8057 -5.929 { cg1 val A 310 1wd3A_164Y_310}P -13.7353 2.942 -7.3966 {"}P -13.7353 2.942 -7.3966 {"}P -13.7353 2.942 -7.3966 { cg2 val A 310 1wd3A_164Y_310}P -13.1603 1.3358 -5.5589 {"}P -13.1603 1.3358 -5.5589 {"}P -13.1603 1.3358 -5.5589 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 164 A}'S' sky -13.0031 0.0549 -7.1415 {"}'S' blue -13.0663 0.8467 -7.6018 {"}'S' sky -12.9214 1.0474 -7.6871 {"}'S' sky -13.0791 1.0474 -7.8907 {"}'S' blue -13.2398 0.9831 -8.0803 {"}'S' sky -13.1956 1.1008 -8.327 {"}'S' sky -12.3485 1.2574 -7.5929 {"}'S' sky -13.1239 1.1859 -8.5748 {"}'S' sky -12.1014 1.3338 -7.6536 {"}'S' blue -13.0168 1.2462 -8.8113 {"}'S' sky -11.9637 1.4616 -7.9013 {"}'S' sky -12.7338 1.3993 -8.8798 {"}'S' sky -11.9143 1.5663 -8.2815 {"}'S' sky -12.3964 1.5151 -8.8894 { CZ TYR 164 A}'S' blue -12.2682 1.5435 -9.0094 {"}'S' blue -12.4225 1.5611 -9.2141 {"}'S' blue -12.0351 1.6701 -9.0616 { HD2 TYR 164 A}'S' sky -11.9134 -0.4377 -5.9003 { HE2 TYR 164 A}'S' blue -13.422 0.335 -7.4192 {"}'S' blue -13.4886 0.5403 -7.5622 {"}'S' sky -13.2039 0.5425 -7.4573 {"}'S' blue -13.2971 0.717 -7.6261 {"}'S' blue -13.432 0.8119 -7.827 {"}'S' blue -13.3351 0.9466 -8.0825 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 164 A}'S' green -12.103 -0.233 -6.2678 {"}'S' green -11.8781 -0.1654 -6.1534 {"}'S' green -11.241 0.4167 -6.2973 { CE2 TYR 164 A}'S' sea -12.9895 0.3156 -7.1962 {"}'S' sea -13.0607 0.5247 -7.3463 {"}'S' green -12.7653 0.1292 -7.0129 {"}'S' green -12.8198 0.6045 -7.2147 {"}'S' sea -12.9251 0.7657 -7.3954 {"}'S' green -12.6597 0.8542 -7.2938 {"}'S' sea -12.7786 0.9809 -7.4835 {"}'S' green -12.4577 1.0193 -7.3494 {"}'S' sea -12.7215 1.2117 -7.7436 {"}'S' sea -12.8758 1.2293 -7.9482 {"}'S' sea -13.0371 1.1916 -8.1464 {"}'S' green -12.2263 1.1311 -7.4004 {"}'S' green -12.4884 1.3383 -7.7957 {"}'S' green -12.6414 1.3725 -8.0041 {"}'S' green -12.8025 1.3576 -8.2071 {"}'S' sea -12.9653 1.2949 -8.4 {"}'S' green -11.8862 1.0408 -7.2926 {"}'S' sea -12.2368 1.424 -7.8524 {"}'S' green -12.3847 1.4738 -8.0574 {"}'S' green -12.701 1.4432 -8.4588 {"}'S' sea -12.8617 1.3648 -8.6435 {"}'S' green -12.1062 1.5275 -8.1042 {"}'S' green -12.2581 1.5547 -8.3078 {"}'S' green -12.4157 1.5415 -8.5083 {"}'S' green -12.5765 1.489 -8.7007 {"}'S' sea -12.0709 1.5892 -8.4888 {"}'S' sea -12.2325 1.5718 -8.6937 { HD2 TYR 164 A}'S' green -12.0451 -0.3359 -6.0984 {"}'S' green -12.2061 -0.364 -6.2984 {"}'S' sea -11.7218 -0.2609 -5.9642 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD2 TYR 164 A}'S' P -12.4063 -0.1634 -6.582 {"}'S' -12.4055 -0.1635 -6.5826 {"}'S' P -12.1742 -0.0239 -6.4179 {"}'S' -12.1211 -0.0586 -6.4793 {"}'S' P -12.3114 0.0773 -6.6234 {"}'S' -12.2427 0.032 -6.6815 {"}'S' P -12.4777 0.044 -6.8293 {"}'S' -12.4587 0.0327 -6.8401 {"}'S' P -11.9333 0.0559 -6.2863 {"}'S' -11.8831 0.0095 -6.3678 {"}'S' P -12.0386 0.217 -6.467 {"}'S' -11.9465 0.1257 -6.5817 {"}'S' P -12.1798 0.298 -6.6734 {"}'S' -12.076 0.2003 -6.7672 {"}'S' P -12.3428 0.2903 -6.8806 {"}'S' -12.2721 0.2324 -6.9246 {"}'S' P -11.6861 0.1255 -6.2035 {"}'S' -11.6616 0.0903 -6.2646 {"}'S' P -11.7732 0.3055 -6.3654 {"}'S' -11.7142 0.2147 -6.4793 {"}'S' P -11.8921 0.4323 -6.5551 {"}'S' -11.8035 0.3029 -6.6778 {"}'S' P -12.0349 0.4987 -6.7587 {"}'S' -11.9378 0.3712 -6.8514 {"}'S' P -11.4745 0.3035 -6.2506 {"}'S' -11.4631 0.2708 -6.2959 {"}'S' P -11.5712 0.4706 -6.4209 {"}'S' -11.5387 0.3864 -6.5077 {"}'S' P -11.6928 0.5926 -6.6132 {"}'S' -11.6407 0.4745 -6.7047 {"}'S' P -11.835 0.663 -6.8152 {"}'S' -11.773 0.5465 -6.8849 {"}'S' P -11.9893 0.6807 -7.0198 {"}'S' -11.9396 0.6006 -7.0549 {"}'S' P -11.3398 0.5824 -6.472 {"}'S' -11.3356 0.5545 -6.4974 {"}'S' P -11.4621 0.7087 -6.6645 {"}'S' -11.448 0.6529 -6.7026 {"}'S' P -11.602 0.7897 -6.8673 {"}'S' -11.5829 0.7308 -6.8979 {"}'S' P -11.755 0.8239 -7.0757 {"}'S' -11.742 0.7919 -7.0865 { CE2 TYR 164 A}'S' P -12.7645 0.3832 -7.0819 {"}'S' -12.763 0.3827 -7.0847 {"}'S' P -12.5161 0.209 -6.9298 {"}'S' -12.5022 0.1996 -6.9737 {"}'S' P -12.5232 0.4544 -7.0074 {"}'S' -12.4985 0.4243 -7.083 {"}'S' P -12.5726 0.6742 -7.132 {"}'S' -12.5526 0.6455 -7.1818 {"}'S' P -12.262 0.417 -6.9291 {"}'S' -12.2445 0.3783 -7.0398 {"}'S' P -12.2955 0.649 -7.0363 {"}'S' -12.2755 0.5936 -7.1399 {"}'S' P -12.361 0.8521 -7.179 {"}'S' -12.3479 0.8146 -7.2311 {"}'S' P -12.0556 0.7654 -7.0768 {"}'S' -12.0524 0.716 -7.1551 {"}'S' P -12.1274 0.9654 -7.2257 {"}'S' -12.1255 0.9431 -7.2522 {"}'S' P -11.8113 0.846 -7.1423 {"}'S' -11.8137 0.8341 -7.16 {"}'S' P -12.5406 1.4794 -8.2615 {"}'S' -12.5406 1.4794 -8.2615 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG1 VAL 310 A}'S' blue -13.6378 1.2576 -7.8615 {"}'S' blue -13.4855 1.2299 -7.6573 {"}'S' blue -13.4252 1.3281 -7.9971 {"}'S' sky -13.272 1.3019 -7.792 {"}'S' sky -13.1134 1.318 -7.5909 {"}'S' blue -12.9519 1.3769 -7.3991 {"}'S' blue -13.3264 1.4822 -8.2716 {"}'S' sky -12.8601 1.4497 -7.6592 {"}'S' blue -12.6987 1.5348 -7.4735 { CG2 VAL 310 A}'S' blue -13.4265 0.9021 -7.2336 {"}'S' blue -13.4164 0.6595 -7.1524 {"}'S' blue -13.379 0.4304 -7.0405 {"}'S' blue -13.3154 0.2238 -6.9012 {"}'S' sky -13.161 1.0189 -7.28 {"}'S' sky -13.1633 0.7672 -7.2139 {"}'S' sky -12.9934 0.1292 -6.8155 {"}'S' blue -12.8827 -0.0187 -6.6322 {"}'S' sky -12.888 1.1278 -7.2753 {HG13 VAL 310 A}'S' sky -13.1474 1.4985 -8.4595 {"}'S' blue -12.391 1.6442 -7.5222 {"}'S' sky -12.2286 1.6621 -7.7264 {"}'S' sky -12.4963 1.7687 -8.7779 {"}'S' blue -12.3414 1.9916 -8.87 {"}'S' sky -12.208 1.8888 -8.6693 {"}'S' sky -12.0444 1.9174 -8.466 {HG22 VAL 310 A}'S' sky -11.9513 -0.134 -5.7958 @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 310 A}'S' sea -13.1363 0.5293 -7.1123 {"}'S' sea -13.0787 0.3148 -6.9778 {"}'S' sea -12.9055 0.8759 -7.2281 {"}'S' green -12.8887 0.6344 -7.1397 {HG13 VAL 310 A}'S' green -13.0109 1.4171 -8.2594 {"}'S' green -12.8585 1.3921 -8.0557 {"}'S' green -12.6991 1.4226 -7.8585 {"}'S' sea -12.5411 1.5083 -7.6775 {"}'S' sea -12.9706 1.5807 -8.6639 {"}'S' green -12.8422 1.48 -8.4688 {"}'S' green -12.6949 1.4369 -8.2662 {"}'S' green -12.5368 1.4547 -8.0678 {"}'S' green -12.379 1.5307 -7.8849 {"}'S' sea -12.7334 1.6558 -8.7447 {"}'S' green -12.5985 1.561 -8.5438 {"}'S' green -12.4427 1.5367 -8.3356 {"}'S' green -12.2795 1.5857 -8.139 {"}'S' sea -12.1222 1.7041 -7.9683 {"}'S' green -12.3591 1.6937 -8.5784 {"}'S' green -12.2028 1.7044 -8.3792 {"}'S' sea -12.0467 1.7998 -8.2047 {HG22 VAL 310 A}'S' green -12.8389 0.6136 -7.1507 {"}'S' green -12.8178 0.3758 -7.0572 {"}'S' green -12.7614 0.1641 -6.9268 {"}'S' sea -12.2686 -0.2502 -6.1741 {"}'S' sea -12.1093 -0.2197 -5.9768 {"}'S' green -12.5429 1.0107 -7.2895 {"}'S' green -11.7892 -0.1116 -6.0033 {"}'S' green -12.2333 1.1298 -7.2901 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} {HG22 VAL 310 A}'S' P -12.5847 0.7607 -7.2742 {"}'S' -12.5773 0.765 -7.2429 {"}'S' P -12.589 0.5152 -7.2104 {"}'S' -12.5738 0.5376 -7.1503 {"}'S' P -12.5545 0.2876 -7.1027 {"}'S' -12.5416 0.3216 -7.0501 {"}'S' P -12.4834 0.0912 -6.9574 {"}'S' -12.4803 0.1115 -6.9372 {"}'S' P -12.3808 -0.0615 -6.7823 {"}'S' -12.3785 -0.0213 -6.7558 {"}'S' P -12.2524 -0.1623 -6.5871 {"}'S' -12.2555 -0.11 -6.5657 {"}'S' P -12.1051 -0.2054 -6.3846 {"}'S' -12.1126 -0.1662 -6.3764 {"}'S' P -11.9474 -0.1884 -6.1865 {"}'S' -11.9481 -0.1869 -6.1862 {"}'S' P -12.3042 0.8799 -7.3128 {"}'S' -12.3055 0.882 -7.2638 {"}'S' P -12.331 0.6235 -7.2756 {"}'S' -12.3312 0.6499 -7.1742 {"}'S' P -12.3117 0.3812 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{"}'M' green -9.9627 1.0614 -5.3826 {"}'M' green -10.2583 0.872 -5.8288 {"}'M' green -10.0996 0.9693 -5.6512 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 123 A}'M' greentint -10.5356 0.1727 -5.1101 {"}'M' greentint -10.3778 0.2829 -4.9367 {"}'M' greentint -10.2324 0.4446 -4.7937 {"}'M' greentint -10.4647 0.2748 -5.3629 {"}'M' greentint -10.305 0.3634 -5.1819 {"}'M' greentint -10.1583 0.513 -5.0343 {"}'M' greentint -10.0345 0.7127 -4.9296 {"}'M' greentint -10.3464 0.4453 -5.517 {"}'M' greentint -10.1894 0.5412 -5.3396 {"}'M' greentint -10.0509 0.7118 -5.2081 {"}'M' greentint -9.948 0.9352 -5.1372 {"}'M' greentint -10.2078 0.6714 -5.591 {"}'M' greentint -10.058 0.8251 -5.4402 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 31 1wldA_122Y_33N}P -8.1129 5.1692 -12.608 {"}-8.1129 5.1692 -12.608 { ca ser A 31 1wldA_122Y_33N}-9.0687 5.5449 -11.5461 { c ser A 31 1wldA_122Y_33N}-8.5542 5.1484 -10.1697 { o ser A 31 1wldA_122Y_33N}-7.7598 4.2089 -10.0709 { c ser A 31 1wldA_122Y_33N}P -8.5542 5.1484 -10.1697 { n ile A 32 1wldA_122Y_33N}-9.0283 5.8525 -9.1586 { ca ile A 32 1wldA_122Y_33N}-8.8594 5.4154 -7.7718 { c ile A 32 1wldA_122Y_33N}-10.2431 5.0295 -7.2441 { o ile A 32 1wldA_122Y_33N}-11.2479 5.7058 -7.5567 { c ile A 32 1wldA_122Y_33N}P -10.2431 5.0295 -7.2441 { n asn A 33 1wldA_122Y_33N}-10.3134 3.8905 -6.5385 { ca asn A 33 1wldA_122Y_33N}-11.6243 3.3056 -6.2417 { c asn A 33 1wldA_122Y_33N}-11.7114 2.8907 -4.7726 { o asn A 33 1wldA_122Y_33N}-10.7547 2.2805 -4.2929 { c asn A 33 1wldA_122Y_33N}P -11.7114 2.8907 -4.7726 { n val A 34 1wldA_122Y_33N}-12.7712 3.2188 -4.0932 { ca val A 34 1wldA_122Y_33N}-12.9988 2.881 -2.6833 { c val A 34 1wldA_122Y_33N}-14.3226 2.1201 -2.5964 { o val A 34 1wldA_122Y_33N}-15.3362 2.6573 -3.0671 { c val A 34 1wldA_122Y_33N}P -14.3226 2.1201 -2.5964 { n gly A 35 1wldA_122Y_33N}-14.34 0.9322 -2.0312 { ca gly A 35 1wldA_122Y_33N}-15.5652 0.1332 -2.0162 { c gly A 35 1wldA_122Y_33N}-15.3179 -1.2493 -1.3814 { o gly A 35 1wldA_122Y_33N}-14.6358 -1.3718 -0.3733 { n leu A 120 1wldA_122Y_33N}P -11.9633 -2.3074 0.4375 {"}-11.9633 -2.3074 0.4375 { ca leu A 120 1wldA_122Y_33N}-11.1108 -2.3912 -0.7415 { c leu A 120 1wldA_122Y_33N}-10.7868 -1.0085 -1.315 { o leu A 120 1wldA_122Y_33N}-11.6842 -0.1841 -1.4669 { c leu A 120 1wldA_122Y_33N}P -10.7868 -1.0085 -1.315 { n ile A 121 1wldA_122Y_33N}-9.5166 -0.7561 -1.5299 { ca ile A 121 1wldA_122Y_33N}-9.0527 0.465 -2.2015 { c ile A 121 1wldA_122Y_33N}-8.2478 -0.0228 -3.3773 { o ile A 121 1wldA_122Y_33N}-7.3743 -0.8977 -3.1988 { c ile A 121 1wldA_122Y_33N}P -8.2478 -0.0228 -3.3773 { n tyr A 122 1wldA_122Y_33N}-8.4941 0.4781 -4.5905 { ca tyr A 122 1wldA_122Y_33N}-7.6158 0.0449 -5.6717 { c tyr A 122 1wldA_122Y_33N}-7.4807 1.0891 -6.778 { o tyr A 122 1wldA_122Y_33N}-8.3316 1.9336 -6.9802 { c tyr A 122 1wldA_122Y_33N}P -7.4807 1.0891 -6.778 { n leu A 123 1wldA_122Y_33N}-6.3079 1.0021 -7.3989 { ca leu A 123 1wldA_122Y_33N}-6.0505 1.8108 -8.5936 { c leu A 123 1wldA_122Y_33N}-6.2089 0.9411 -9.8197 { o leu A 123 1wldA_122Y_33N}-5.7068 -0.1873 -9.8363 { c leu A 123 1wldA_122Y_33N}P -6.2089 0.9411 -9.8197 { n ala A 124 1wldA_122Y_33N}-6.7997 1.4781 -10.8865 { ca ala A 124 1wldA_122Y_33N}-6.9274 0.7568 -12.1302 { c ala A 124 1wldA_122Y_33N}-6.555 1.6949 -13.2896 { o ala A 124 1wldA_122Y_33N}-6.5191 2.9138 -13.0813 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ser A 31 1wldA_122Y_33N}P -8.1129 5.1692 -12.608 { ca ser A 31 1wldA_122Y_33N}P -9.0687 5.5449 -11.5461 { n ile A 32 1wldA_122Y_33N}P -9.0283 5.8525 -9.1586 { ca ile A 32 1wldA_122Y_33N}P -8.8594 5.4154 -7.7718 { n asn A 33 1wldA_122Y_33N}P -10.3134 3.8905 -6.5385 { ca asn A 33 1wldA_122Y_33N}P -11.6243 3.3056 -6.2417 { n val A 34 1wldA_122Y_33N}P -12.7712 3.2188 -4.0932 { ca val A 34 1wldA_122Y_33N}P -12.9988 2.881 -2.6833 { n gly A 35 1wldA_122Y_33N}P -14.34 0.9322 -2.0312 { ca gly A 35 1wldA_122Y_33N}P -15.5652 0.1332 -2.0162 {"}P -15.5652 0.1332 -2.0162 { n leu A 120 1wldA_122Y_33N}P -11.9633 -2.3074 0.4375 { ca leu A 120 1wldA_122Y_33N}P -11.1108 -2.3912 -0.7415 { n ile A 121 1wldA_122Y_33N}P -9.5166 -0.7561 -1.5299 { ca ile A 121 1wldA_122Y_33N}P -9.0527 0.465 -2.2015 { n tyr A 122 1wldA_122Y_33N}P -8.4941 0.4781 -4.5905 { ca tyr A 122 1wldA_122Y_33N}P -7.6158 0.0449 -5.6717 { n leu A 123 1wldA_122Y_33N}P -6.3079 1.0021 -7.3989 { ca leu A 123 1wldA_122Y_33N}P -6.0505 1.8108 -8.5936 { n ala A 124 1wldA_122Y_33N}P -6.7997 1.4781 -10.8865 { ca ala A 124 1wldA_122Y_33N}P -6.9274 0.7568 -12.1302 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ser A 31 1wldA_122Y_33N}P -9.0687 5.5449 -11.5461 {"}-9.0687 5.5449 -11.5461 { ca ile A 32 1wldA_122Y_33N}-8.8594 5.4154 -7.7718 { ca asn A 33 1wldA_122Y_33N}-11.6243 3.3056 -6.2417 { ca val A 34 1wldA_122Y_33N}-12.9988 2.881 -2.6833 { ca gly A 35 1wldA_122Y_33N}-15.5652 0.1332 -2.0162 { ca leu A 120 1wldA_122Y_33N}P -11.1108 -2.3912 -0.7415 {"}-11.1108 -2.3912 -0.7415 { ca ile A 121 1wldA_122Y_33N}-9.0527 0.465 -2.2015 { ca tyr A 122 1wldA_122Y_33N}-7.6158 0.0449 -5.6717 { ca leu A 123 1wldA_122Y_33N}-6.0505 1.8108 -8.5936 { ca ala A 124 1wldA_122Y_33N}-6.9274 0.7568 -12.1302 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca asn A 33 1wldA_122Y_33N}P -11.6243 3.3056 -6.2417 { cb asn A 33 1wldA_122Y_33N}-11.8407 2.0236 -7.0754 { cg asn A 33 1wldA_122Y_33N}-11.7782 2.3243 -8.5659 { od1 asn A 33 1wldA_122Y_33N}-12.8035 2.6805 -9.1427 { cg asn A 33 1wldA_122Y_33N}P -11.7782 2.3243 -8.5659 { nd2 asn A 33 1wldA_122Y_33N}-10.5789 2.2397 -9.1698 { ca tyr A 122 1wldA_122Y_33N}P -7.6158 0.0449 -5.6717 { cb tyr A 122 1wldA_122Y_33N}-8.0408 -1.2711 -6.2751 { cg tyr A 122 1wldA_122Y_33N}-9.2688 -1.3535 -7.1434 { cd1 tyr A 122 1wldA_122Y_33N}-9.1422 -1.2631 -8.5257 { ce1 tyr A 122 1wldA_122Y_33N}-10.237 -1.3876 -9.3681 { cz tyr A 122 1wldA_122Y_33N}-11.4705 -1.6254 -8.8108 { oh tyr A 122 1wldA_122Y_33N}-12.5889 -1.7801 -9.6222 { cg tyr A 122 1wldA_122Y_33N}P -9.2688 -1.3535 -7.1434 { cd2 tyr A 122 1wldA_122Y_33N}-10.5243 -1.5926 -6.6193 { ce2 tyr A 122 1wldA_122Y_33N}-11.6271 -1.7483 -7.4451 { cz tyr A 122 1wldA_122Y_33N}ghost -11.4705 -1.6254 -8.8108 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb asn A 33 1wldA_122Y_33N}P -11.8407 2.0236 -7.0754 {"}P -11.8407 2.0236 -7.0754 { nd2 asn A 33 1wldA_122Y_33N}P -10.5789 2.2397 -9.1698 {"}P -10.5789 2.2397 -9.1698 { cb tyr A 122 1wldA_122Y_33N}P -8.0408 -1.2711 -6.2751 {"}P -8.0408 -1.2711 -6.2751 { cd1 tyr A 122 1wldA_122Y_33N}P -9.1422 -1.2631 -8.5257 { cd2 tyr A 122 1wldA_122Y_33N}P -10.5243 -1.5926 -6.6193 { ce1 tyr A 122 1wldA_122Y_33N}P -10.237 -1.3876 -9.3681 { ce2 tyr A 122 1wldA_122Y_33N}P -11.6271 -1.7483 -7.4451 { oh tyr A 122 1wldA_122Y_33N}P -12.5889 -1.7801 -9.6222 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 122 A}'S' sky -10.0676 0.1626 -6.7887 {"}'S' sky -10.2304 0.1 -6.9816 {"}'S' blue -9.8057 0.2845 -6.8431 {"}'S' blue -9.9661 0.2483 -7.0404 {"}'S' sky -10.1268 0.1698 -7.225 {"}'S' blue -10.2819 0.0512 -7.3929 { CD2 TYR 122 A}'S' blue -11.1621 -0.0615 -6.0616 {"}'S' sky -11.3231 -0.0765 -6.2646 {"}'S' sky -11.4859 -0.1391 -6.4574 {"}'S' sky -10.9054 0.0398 -6.1149 {"}'S' sky -10.6268 0.0935 -6.1616 {"}'S' sky -10.2557 0.1352 -6.5355 {"}'S' sky -10.2041 0.1064 -6.8942 {"}'S' sky -10.529 0.0227 -7.2918 { CE1 TYR 122 A}'S' blue -10.774 0.2503 -9.0678 {"}'S' blue -10.3395 0.2984 -8.9105 {"}'S' blue -10.4914 0.3256 -9.114 {"}'S' blue -10.6491 0.3124 -9.3145 {"}'S' blue -10.1476 0.3372 -9.0877 {"}'S' blue -10.3043 0.3602 -9.2951 {"}'S' blue -10.4658 0.3427 -9.5 {"}'S' blue -9.9684 0.3402 -9.2843 {"}'S' blue -10.1253 0.3546 -9.4918 {"}'S' blue -10.2875 0.3311 -9.6944 { CE2 TYR 122 A}'S' blue -12.0082 -0.1159 -6.9407 {"}'S' blue -12.1641 -0.1103 -7.1448 {"}'S' sky -11.5872 -0.1281 -6.7846 {"}'S' sky -11.7296 -0.0622 -6.9874 {"}'S' sky -11.8815 -0.0351 -7.191 {"}'S' blue -12.0392 -0.0482 -7.3915 {"}'S' sky -11.5378 -0.0235 -7.1647 {"}'S' sky -11.6944 -0.0005 -7.372 {"}'S' blue -11.856 -0.0179 -7.5769 {"}'S' sky -11.3585 -0.0204 -7.3613 {"}'S' blue -11.5155 -0.0061 -7.5688 {"}'S' blue -11.6776 -0.0296 -7.7714 {"}'S' sky -11.1493 -0.0665 -7.5126 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 122 A}'S' sea -11.0613 0.0454 -6.319 {"}'S' green -11.2217 0.0092 -6.5163 {"}'S' sea -11.3824 -0.0693 -6.7009 {"}'S' green -10.7787 0.1206 -6.3652 {"}'S' green -10.9364 0.1075 -6.5657 {"}'S' green -11.0972 0.0549 -6.7582 {"}'S' sea -11.2545 -0.0348 -6.9373 {"}'S' sea -10.435 0.1322 -6.3389 {"}'S' green -10.5916 0.1552 -6.5462 {"}'S' green -10.7532 0.1377 -6.7511 {"}'S' green -10.9171 0.0811 -6.9468 {"}'S' sea -11.0782 -0.0127 -7.1286 {"}'S' green -10.4127 0.1496 -6.743 {"}'S' green -10.5748 0.1261 -6.9456 {"}'S' green -10.7384 0.0647 -7.1398 {"}'S' sea -10.8993 -0.0338 -7.3201 {"}'S' sea -10.3659 0.0834 -7.098 { CE2 TYR 122 A}'S' sea -11.391 -0.0843 -6.957 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ASN 33 A}'S' blue -12.2629 0.3512 -7.3733 {"}'S' blue -12.1143 0.2974 -7.1664 {"}'S' blue -11.957 0.2811 -6.958 {"}'S' blue -11.7949 0.3031 -6.7551 {"}'S' blue -12.0001 0.3227 -7.4535 {"}'S' sky -11.8477 0.2818 -7.2462 {"}'S' sky -11.6883 0.2811 -7.0384 {"}'S' blue -11.8844 0.406 -7.7416 {"}'S' sky -11.7432 0.3392 -7.5403 {"}'S' sky -11.5909 0.3114 -7.336 {"}'S' blue -11.5306 0.4097 -7.6759 { HB2 ASN 33 A}'S' sky -11.5736 0.2235 -6.7352 {"}'S' sky -11.4217 0.1977 -6.5319 {"}'S' sky -11.1039 0.3147 -6.1533 {"}'S' sky -11.55 0.2637 -7.1478 {"}'S' blue -11.4207 0.349 -7.4349 {"}'S' sky -11.3045 0.2173 -7.2494 {"}'S' blue -11.1277 0.2996 -7.4539 {"}'S' sky -10.7556 0.2798 -7.3337 {"}'S' sky -10.2793 0.4229 -6.7582 {"}'S' blue -10.5162 0.4125 -7.3684 {"}'S' sky -10.3599 0.4232 -7.1691 {"}'S' sky -10.2038 0.5186 -6.9946 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ASN 33 A}'S' sea -11.2623 0.2282 -6.3347 {"}'S' sea -11.4193 0.1693 -6.9528 {"}'S' green -11.2719 0.1277 -6.7504 {"}'S' green -11.1164 0.1396 -6.5526 {"}'S' green -10.9578 0.2041 -6.3658 {"}'S' sea -10.8048 0.3202 -6.2004 {"}'S' green -11.168 0.1359 -7.0494 {"}'S' green -11.0156 0.1109 -6.8456 {"}'S' green -10.8562 0.1414 -6.6484 {"}'S' green -10.6982 0.2271 -6.4674 {"}'S' sea -10.5481 0.363 -6.3121 {"}'S' sea -10.9993 0.1988 -7.2587 {"}'S' green -10.852 0.1557 -7.0561 {"}'S' green -10.6943 0.1727 -6.8581 {"}'S' green -10.5361 0.2495 -6.6748 {"}'S' sea -10.3857 0.3809 -6.5163 {"}'S' sea -10.5998 0.2556 -7.1255 {"}'S' sea -10.4366 0.3045 -6.9289 @dotlist {x} color= sky width= 1 master= {vdw contact} { ND2 ASN 33 A}'S' blue -10.8583 0.7225 -9.3216 {"}'S' blue -10.7018 0.6956 -9.1118 {"}'S' blue -10.5402 0.7131 -8.9069 {"}'S' blue -10.6066 0.7085 -9.4102 {"}'S' blue -10.448 0.6957 -9.2024 {"}'S' blue -10.2844 0.727 -8.9996 {"}'S' blue -10.4456 0.7616 -9.6192 {"}'S' blue -10.2899 0.736 -9.4108 {"}'S' blue -10.1278 0.757 -9.206 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 122 A}'M' green -8.8583 2.6177 -5.8774 {"}'M' green -8.5377 3.0473 -6.1576 {"}'M' green -8.5768 3.268 -6.634 {"}'M' green -8.732 3.2671 -6.834 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 122 A}'M' greentint -9.3447 2.4148 -6.1422 {"}'M' greentint -9.1074 2.5475 -5.99 {"}'M' greentint -9.2417 2.6473 -6.1912 {"}'M' greentint -9.405 2.6139 -6.3931 {"}'M' greentint -9.5536 2.457 -6.5416 {"}'M' greentint -8.96 2.7731 -6.0536 {"}'M' greentint -9.0978 2.8525 -6.2532 {"}'M' greentint -9.2557 2.8441 -6.4552 {"}'M' greentint -9.4143 2.7509 -6.6336 {"}'M' greentint -8.7735 2.9442 -6.118 {"}'M' greentint -8.9126 3.0225 -6.3192 {"}'M' greentint -9.0688 3.0332 -6.5231 {"}'M' greentint -9.2289 2.975 -6.7151 {"}'M' greentint -8.6726 3.1407 -6.3582 {"}'M' greentint -8.8255 3.1766 -6.5651 {"}'M' greentint -8.986 3.1532 -6.7672 {"}'M' greentint -9.1481 3.071 -6.9528 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ASN 33 A}'M' green -9.3768 2.3976 -6.1428 {"}'M' green -8.5595 3.1672 -6.307 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ASN 33 A}'M' greentint -9.4676 2.5296 -6.6969 {"}'M' greentint -9.3262 2.4566 -6.4938 {"}'M' greentint -9.168 2.4588 -6.2901 {"}'M' greentint -9.0073 2.5348 -6.1032 {"}'M' greentint -8.8578 2.6802 -5.9508 {"}'M' greentint -9.2231 2.6193 -6.7489 {"}'M' greentint -9.0743 2.5697 -6.5428 {"}'M' greentint -8.912 2.6146 -6.3448 {"}'M' greentint -8.7578 2.7472 -6.1831 {"}'M' greentint -8.6335 2.9505 -6.0785 {"}'M' greentint -9.0951 2.8549 -6.9114 {"}'M' greentint -8.9633 2.7531 -6.7132 {"}'M' greentint -8.8023 2.7812 -6.5132 {"}'M' greentint -8.6543 2.9331 -6.3644 {"}'M' greentint -8.934 3.1261 -6.9446 {"}'M' greentint -8.8298 2.971 -6.7667 {"}'M' greentint -8.6699 3.0679 -6.5873 {"}'M' greentint -8.7482 3.2175 -6.7866 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 122 A}'M' greentint -10.0004 1.29 -4.2269 {"}'M' greentint -10.1336 1.1864 -4.4263 {"}'M' greentint -9.8145 1.3814 -4.0689 {"}'M' greentint -9.9187 1.5366 -4.2467 {"}'M' greentint -10.0787 1.4397 -4.4261 {"}'M' greentint -10.189 1.3403 -4.7064 {"}'M' greentint -10.2053 1.0866 -4.6571 {"}'M' greentint -9.6535 1.6527 -4.1021 {"}'M' greentint -9.7852 1.7544 -4.3002 {"}'M' greentint -9.9462 1.7264 -4.5002 {"}'M' greentint -10.0942 1.5744 -4.6491 {"}'M' greentint -10.1608 1.4377 -4.96 {"}'M' greentint -10.2112 1.1831 -4.9554 {"}'M' greentint -9.4619 1.8294 -4.166 {"}'M' greentint -9.5968 1.9243 -4.3669 {"}'M' greentint -9.7557 1.9274 -4.5728 {"}'M' greentint -9.9159 1.8364 -4.7556 {"}'M' greentint -10.0573 1.6658 -4.8912 {"}'M' greentint -10.0639 1.512 -5.2 {"}'M' greentint -9.4999 2.059 -4.6223 {"}'M' greentint -9.6612 2.0198 -4.8202 {"}'M' greentint -9.8178 1.9078 -4.9916 {"}'M' greentint -9.9564 1.733 -5.1224 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ASN 33 A}'M' green -9.5861 1.5728 -3.9849 {"}'M' green -9.4209 1.8726 -4.1711 {"}'M' green -10.1219 1.4368 -5.2142 @dotlist {x} color= red width= 1 master= {H-bonds} { O ASN 33 A}'M' greentint -10.1765 1.0427 -4.5991 {"}'M' greentint -10.0139 1.0984 -4.405 {"}'M' greentint -9.8561 1.2086 -4.2315 {"}'M' greentint -9.7107 1.3704 -4.0885 {"}'M' greentint -10.1021 1.1781 -4.8582 {"}'M' greentint -9.943 1.2005 -4.6577 {"}'M' greentint -9.7832 1.2891 -4.4767 {"}'M' greentint -9.6365 1.4387 -4.3291 {"}'M' greentint -9.5128 1.6385 -4.2244 {"}'M' greentint -9.9835 1.36 -5.0127 {"}'M' greentint -9.8247 1.371 -4.8118 {"}'M' greentint -9.6677 1.4669 -4.6345 {"}'M' greentint -9.5292 1.6375 -4.5029 {"}'M' greentint -9.4263 1.861 -4.4321 {"}'M' greentint -9.8492 1.5679 -5.0885 {"}'M' greentint -9.6861 1.5971 -4.8858 {"}'M' greentint -9.5363 1.7508 -4.735 {"}'M' greentint -9.441 1.9871 -4.6775 {"}'M' greentint -9.7366 1.7977 -5.1237 {"}'M' greentint -9.5778 1.895 -4.9461 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 56 1wltA_120F_58R}P -7.7369 5.6557 -12.4444 {"}-7.7369 5.6557 -12.4444 { ca val A 56 1wltA_120F_58R}-8.8013 5.6233 -11.4327 { c val A 56 1wltA_120F_58R}-8.4056 4.9545 -10.1446 { o val A 56 1wltA_120F_58R}-7.8924 3.8463 -10.1283 { c val A 56 1wltA_120F_58R}P -8.4056 4.9545 -10.1446 { n val A 57 1wltA_120F_58R}-8.8064 5.5779 -9.0045 { ca val A 57 1wltA_120F_58R}-8.8238 4.9445 -7.6755 { c val A 57 1wltA_120F_58R}-10.2661 4.921 -7.2354 { o val A 57 1wltA_120F_58R}-11.0385 5.915 -7.4345 { c val A 57 1wltA_120F_58R}P -10.2661 4.921 -7.2354 { n arg A 58 1wltA_120F_58R}-10.6189 3.7805 -6.7719 { ca arg A 58 1wltA_120F_58R}-11.8646 3.6078 -5.9779 { c arg A 58 1wltA_120F_58R}-11.5022 3.13 -4.6095 { o arg A 58 1wltA_120F_58R}-10.7421 2.1739 -4.4325 { c arg A 58 1wltA_120F_58R}P -11.5022 3.13 -4.6095 { n gly A 59 1wltA_120F_58R}-12.1394 3.7284 -3.5733 { ca gly A 59 1wltA_120F_58R}-11.9741 3.2056 -2.2215 { c gly A 59 1wltA_120F_58R}-11.6932 4.3327 -1.1806 { o gly A 59 1wltA_120F_58R}-11.8581 5.4974 -1.5112 { c gly A 59 1wltA_120F_58R}P -11.6932 4.3327 -1.1806 { n leu A 60 1wltA_120F_58R}-11.3432 3.9882 0.0531 { ca leu A 60 1wltA_120F_58R}-11.1605 2.6126 0.5621 { c leu A 60 1wltA_120F_58R}-12.4356 2.1983 1.3336 { o leu A 60 1wltA_120F_58R}-12.695 2.719 2.3897 { n his A 118 1wltA_120F_58R}P -11.3859 -1.7188 1.4324 {"}-11.3859 -1.7188 1.4324 { ca his A 118 1wltA_120F_58R}-10.8699 -2.1637 0.1151 { c his A 118 1wltA_120F_58R}-10.7994 -1.0627 -0.8601 { o his A 118 1wltA_120F_58R}-11.7986 -0.3315 -1.0598 { c his A 118 1wltA_120F_58R}P -10.7994 -1.0627 -0.8601 { n gly A 119 1wltA_120F_58R}-9.674 -0.9442 -1.6047 { ca gly A 119 1wltA_120F_58R}-9.6304 -0.0391 -2.741 { c gly A 119 1wltA_120F_58R}-8.5522 -0.5051 -3.7518 { o gly A 119 1wltA_120F_58R}-7.8797 -1.5119 -3.4981 { c gly A 119 1wltA_120F_58R}P -8.5522 -0.5051 -3.7518 { n phe A 120 1wltA_120F_58R}-8.495 0.1643 -4.8841 { ca phe A 120 1wltA_120F_58R}-7.5098 -0.1533 -5.9924 { c phe A 120 1wltA_120F_58R}-7.3137 1.0142 -6.8744 { o phe A 120 1wltA_120F_58R}-8.1444 1.9793 -6.9382 { c phe A 120 1wltA_120F_58R}P -7.3137 1.0142 -6.8744 { n gln A 121 1wltA_120F_58R}-6.2276 0.9706 -7.6374 { ca gln A 121 1wltA_120F_58R}-6.0215 1.8724 -8.686 { c gln A 121 1wltA_120F_58R}-5.8958 1.0159 -9.9625 { o gln A 121 1wltA_120F_58R}-5.2122 -0.0155 -9.9907 { c gln A 121 1wltA_120F_58R}P -5.8958 1.0159 -9.9625 { n ala A 122 1wltA_120F_58R}-6.5594 1.4839 -10.9832 { ca ala A 122 1wltA_120F_58R}-6.4837 0.8679 -12.2976 { c ala A 122 1wltA_120F_58R}-5.1485 1.3148 -12.9483 { o ala A 122 1wltA_120F_58R}-4.9503 2.4549 -13.2128 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 56 1wltA_120F_58R}P -7.7369 5.6557 -12.4444 { ca val A 56 1wltA_120F_58R}P -8.8013 5.6233 -11.4327 { n val A 57 1wltA_120F_58R}P -8.8064 5.5779 -9.0045 { ca val A 57 1wltA_120F_58R}P -8.8238 4.9445 -7.6755 { n arg A 58 1wltA_120F_58R}P -10.6189 3.7805 -6.7719 { ca arg A 58 1wltA_120F_58R}P -11.8646 3.6078 -5.9779 { n gly A 59 1wltA_120F_58R}P -12.1394 3.7284 -3.5733 { ca gly A 59 1wltA_120F_58R}P -11.9741 3.2056 -2.2215 {"}P -11.9741 3.2056 -2.2215 { n leu A 60 1wltA_120F_58R}P -11.3432 3.9882 0.0531 { ca leu A 60 1wltA_120F_58R}P -11.1605 2.6126 0.5621 { n his A 118 1wltA_120F_58R}P -11.3859 -1.7188 1.4324 { ca his A 118 1wltA_120F_58R}P -10.8699 -2.1637 0.1151 { n gly A 119 1wltA_120F_58R}P -9.674 -0.9442 -1.6047 { ca gly A 119 1wltA_120F_58R}P -9.6304 -0.0391 -2.741 {"}P -9.6304 -0.0391 -2.741 { n phe A 120 1wltA_120F_58R}P -8.495 0.1643 -4.8841 { ca phe A 120 1wltA_120F_58R}P -7.5098 -0.1533 -5.9924 { n gln A 121 1wltA_120F_58R}P -6.2276 0.9706 -7.6374 { ca gln A 121 1wltA_120F_58R}P -6.0215 1.8724 -8.686 { n ala A 122 1wltA_120F_58R}P -6.5594 1.4839 -10.9832 { ca ala A 122 1wltA_120F_58R}P -6.4837 0.8679 -12.2976 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 56 1wltA_120F_58R}P -8.8013 5.6233 -11.4327 {"}-8.8013 5.6233 -11.4327 { ca val A 57 1wltA_120F_58R}-8.8238 4.9445 -7.6755 { ca arg A 58 1wltA_120F_58R}-11.8646 3.6078 -5.9779 { ca gly A 59 1wltA_120F_58R}-11.9741 3.2056 -2.2215 { ca leu A 60 1wltA_120F_58R}-11.1605 2.6126 0.5621 { ca his A 118 1wltA_120F_58R}-10.8699 -2.1637 0.1151 { ca gly A 119 1wltA_120F_58R}-9.6304 -0.0391 -2.741 { ca phe A 120 1wltA_120F_58R}-7.5098 -0.1533 -5.9924 { ca gln A 121 1wltA_120F_58R}-6.0215 1.8724 -8.686 { ca ala A 122 1wltA_120F_58R}-6.4837 0.8679 -12.2976 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 58 1wltA_120F_58R}P -11.8646 3.6078 -5.9779 { cb arg A 58 1wltA_120F_58R}-12.7737 2.5499 -6.5961 { cg arg A 58 1wltA_120F_58R}-13.2213 2.9127 -7.9845 { cd arg A 58 1wltA_120F_58R}-14.1455 1.7928 -8.6929 { ne arg A 58 1wltA_120F_58R}-14.2813 2.0483 -10.1023 { cz arg A 58 1wltA_120F_58R}-15.3092 2.6651 -10.6722 { nh1 arg A 58 1wltA_120F_58R}-16.3535 3.1012 -9.9366 { cz arg A 58 1wltA_120F_58R}P -15.3092 2.6651 -10.6722 { nh2 arg A 58 1wltA_120F_58R}-15.3829 2.768 -11.9653 { ca phe A 120 1wltA_120F_58R}P -7.5098 -0.1533 -5.9924 { cb phe A 120 1wltA_120F_58R}-7.9704 -1.3612 -6.8214 { cg phe A 120 1wltA_120F_58R}-9.2142 -1.1544 -7.5603 { cd1 phe A 120 1wltA_120F_58R}-9.2067 -0.6278 -8.846 { ce1 phe A 120 1wltA_120F_58R}-10.42 -0.4236 -9.6093 { cz phe A 120 1wltA_120F_58R}-11.5886 -0.7717 -9.0731 { cg phe A 120 1wltA_120F_58R}P -9.2142 -1.1544 -7.5603 { cd2 phe A 120 1wltA_120F_58R}-10.4586 -1.5809 -7.0277 { ce2 phe A 120 1wltA_120F_58R}-11.6219 -1.4076 -7.7908 { cz phe A 120 1wltA_120F_58R}ghost -11.5886 -0.7717 -9.0731 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 58 1wltA_120F_58R}P -12.7737 2.5499 -6.5961 {"}P -12.7737 2.5499 -6.5961 { cg arg A 58 1wltA_120F_58R}P -13.2213 2.9127 -7.9845 {"}P -13.2213 2.9127 -7.9845 { cd arg A 58 1wltA_120F_58R}P -14.1455 1.7928 -8.6929 {"}P -14.1455 1.7928 -8.6929 { ne arg A 58 1wltA_120F_58R}P -14.2813 2.0483 -10.1023 { nh1 arg A 58 1wltA_120F_58R}P -16.3535 3.1012 -9.9366 {"}P -16.3535 3.1012 -9.9366 { nh2 arg A 58 1wltA_120F_58R}P -15.3829 2.768 -11.9653 {"}P -15.3829 2.768 -11.9653 { cb phe A 120 1wltA_120F_58R}P -7.9704 -1.3612 -6.8214 {"}P -7.9704 -1.3612 -6.8214 { cd1 phe A 120 1wltA_120F_58R}P -9.2067 -0.6278 -8.846 { cd2 phe A 120 1wltA_120F_58R}P -10.4586 -1.5809 -7.0277 { ce1 phe A 120 1wltA_120F_58R}P -10.42 -0.4236 -9.6093 { ce2 phe A 120 1wltA_120F_58R}P -11.6219 -1.4076 -7.7908 { cz phe A 120 1wltA_120F_58R}P -11.5886 -0.7717 -9.0731 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 120 A}'S' blue -12.9644 -0.2877 -7.7112 {"}'S' blue -13.0986 -0.4704 -7.8341 {"}'S' blue -13.1386 -0.619 -8.1623 {"}'S' blue -11.9667 0.0083 -6.8218 {"}'S' blue -12.1066 0.0892 -7.0246 {"}'S' blue -12.2596 0.1234 -7.233 {"}'S' sky -12.7421 -0.0632 -7.8037 {"}'S' sky -12.8914 -0.2147 -7.9544 {"}'S' sky -13.0249 -0.4015 -8.0754 {"}'S' blue -11.7196 0.0847 -6.8825 {"}'S' blue -11.855 0.1749 -7.0814 {"}'S' blue -12.0029 0.2247 -7.2863 {"}'S' blue -12.1588 0.2303 -7.4904 {"}'S' blue -11.5819 0.2125 -7.1302 {"}'S' blue -11.7243 0.2784 -7.3331 {"}'S' blue -11.8762 0.3056 -7.5367 { HZ PHE 120 A}'S' sky -13.3619 -0.0262 -9.6743 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ PHE 120 A}'S' sea -13.0389 -0.3177 -8.2059 {"}'S' sea -13.1966 -0.4239 -8.4759 {"}'S' green -12.7829 0.0128 -8.0631 {"}'S' green -13.2276 -0.2733 -8.7167 {"}'S' green -12.6513 0.2336 -8.113 {"}'S' sea -13.2966 -0.4001 -8.9871 {"}'S' green -12.5064 0.4343 -8.1983 {"}'S' green -12.4608 0.6162 -8.4595 {"}'S' sea -12.3875 0.7445 -8.7184 {"}'S' green -12.5503 0.6818 -8.9112 { HZ PHE 120 A}'S' sea -13.3049 -0.402 -9.01 {"}'S' green -13.3832 -0.2524 -9.2093 {"}'S' green -13.3988 -0.1176 -9.4322 {"}'S' green -13.0602 0.2354 -9.3559 {"}'S' green -13.2205 0.1443 -9.5388 {"}'S' sea -12.9658 0.3278 -9.6034 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 120 A}'S' P -12.9491 -0.0205 -8.269 {"}'S' -12.9404 -0.0261 -8.2746 {"}'S' P -13.1011 -0.1806 -8.4197 {"}'S' -13.0947 -0.1828 -8.4224 {"}'S' P -12.8142 0.2258 -8.3203 {"}'S' -12.7828 0.1996 -8.3397 {"}'S' P -12.9775 0.1295 -8.5044 {"}'S' -12.9046 0.0829 -8.5342 {"}'S' P -13.1207 -0.0441 -8.6417 {"}'S' -13.0587 -0.0731 -8.6598 {"}'S' P -13.2229 -0.1558 -8.9593 {"}'S' -13.2121 -0.16 -8.9606 {"}'S' P -12.6641 0.4343 -8.4019 {"}'S' -12.6458 0.4136 -8.4132 {"}'S' P -12.8248 0.37 -8.5915 {"}'S' -12.7572 0.3069 -8.618 {"}'S' P -12.9781 0.2428 -8.7549 {"}'S' -12.886 0.1757 -8.776 {"}'S' P -13.1146 0.064 -8.8802 {"}'S' -13.0406 0.0234 -8.8894 {"}'S' P -12.622 0.5784 -8.6576 {"}'S' -12.6046 0.5558 -8.6644 {"}'S' P -12.7806 0.4877 -8.8382 {"}'S' -12.7295 0.4326 -8.8481 {"}'S' P -12.9312 0.3483 -8.9935 {"}'S' -12.8669 0.2939 -8.9974 {"}'S' P -13.0654 0.1656 -9.1164 {"}'S' -13.0226 0.138 -9.1148 {"}'S' P -12.7089 0.5728 -9.086 {"}'S' -12.705 0.5683 -9.0865 {"}'S' P -12.8582 0.4212 -9.2367 {"}'S' -12.8538 0.4175 -9.2367 { HZ PHE 120 A}'S' P -13.2508 0.0343 -9.2834 {"}'S' -13.2464 0.0303 -9.2851 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD ARG 58 A}'S' blue -12.5147 1.1696 -8.8082 {"}'S' sky -12.9144 0.7972 -9.4386 {"}'S' sky -12.7518 0.8961 -9.2561 {"}'S' blue -12.6098 1.0716 -9.1209 { HB2 ARG 58 A}'S' blue -12.3352 0.4442 -6.861 {"}'S' blue -12.295 0.6079 -7.2655 {"}'S' blue -12.1665 0.5071 -7.0703 {"}'S' blue -12.0193 0.464 -6.8678 {"}'S' blue -11.8615 0.481 -6.6697 {"}'S' blue -12.0577 0.6829 -7.3462 {"}'S' blue -11.9228 0.5881 -7.1453 {"}'S' blue -11.767 0.5639 -6.9371 { HD2 ARG 58 A}'S' blue -12.9337 0.275 -7.8301 {"}'S' sky -13.6242 0.0514 -9.437 @dotlist {x} color= white width= 1 master= {vdw contact} { HD2 ARG 58 A}'S' green -13.3239 -0.3085 -8.5822 {"}'S' green -13.1661 -0.2325 -8.3993 {"}'S' green -13.0157 -0.1011 -8.2408 {"}'S' green -12.8829 0.0779 -8.1189 {"}'S' green -12.7743 0.293 -8.0384 {"}'S' sea -13.5205 -0.1074 -9.2591 {"}'S' green -13.3856 -0.2022 -9.0582 {"}'S' green -12.5898 0.5896 -8.2504 {"}'S' green -13.386 0.1583 -9.4674 {"}'S' green -13.2834 0.0055 -9.2923 {"}'S' green -12.541 0.6738 -8.5174 {"}'S' sea -13.1963 0.4369 -9.5298 {"}'S' green -13.1285 0.2284 -9.3844 {"}'S' green -12.5688 0.8031 -8.8206 {"}'S' green -12.6547 0.7038 -9.047 {"}'S' green -12.792 0.6006 -9.2452 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HD2 ARG 58 A}'S' P -13.2298 -0.2264 -8.85 {"}'S' -13.2313 -0.2234 -8.8494 {"}'S' P -13.0666 -0.1775 -8.6534 {"}'S' -13.0944 -0.134 -8.6485 {"}'S' P -12.9093 -0.0591 -8.4827 {"}'S' -12.956 -0.0094 -8.486 {"}'S' P -12.7703 0.1178 -8.3518 {"}'S' -12.8115 0.1483 -8.3604 {"}'S' P -12.6602 0.3405 -8.2727 {"}'S' -12.6655 0.3426 -8.2736 {"}'S' P -13.1462 -0.0695 -9.0928 {"}'S' -13.1576 -0.0513 -9.0818 {"}'S' P -12.9899 -0.0587 -8.8936 {"}'S' -13.0412 0.0022 -8.8683 {"}'S' P -12.8338 0.0366 -8.7191 {"}'S' -12.9172 0.1094 -8.701 {"}'S' P -12.6966 0.2048 -8.5888 {"}'S' -12.7815 0.2542 -8.5845 {"}'S' P -12.595 0.426 -8.5192 {"}'S' -12.6379 0.4401 -8.5195 {"}'S' P -12.9951 0.1256 -9.1837 {"}'S' -13.0192 0.1477 -9.1619 {"}'S' P -12.8315 0.1543 -8.9804 {"}'S' -12.9049 0.2081 -8.9426 {"}'S' P -12.6809 0.3082 -8.8285 {"}'S' -12.7669 0.3489 -8.8049 {"}'S' P -12.5852 0.5452 -8.7705 {"}'S' -12.6191 0.5532 -8.764 {"}'S' P -12.8701 0.3511 -9.2285 {"}'S' -12.8839 0.3588 -9.2166 {"}'S' P -12.7097 0.4488 -9.0486 {"}'S' -12.7489 0.4624 -9.0283 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 120 A}'M' green -9.3166 2.3718 -6.2819 {"}'M' green -9.2179 2.6596 -6.3511 {"}'M' green -9.0686 2.8898 -6.4133 {"}'M' green -9.5415 2.0015 -7.0346 {"}'M' green -9.0418 3.0207 -6.6731 {"}'M' green -9.4905 2.083 -7.3081 {"}'M' green -9.2474 2.6254 -7.5098 {"}'M' green -9.333 2.3905 -7.5543 {"}'M' green -9.1368 2.8374 -7.4258 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 120 A}'M' greentint -9.4601 2.264 -6.5544 {"}'M' greentint -9.3665 2.5027 -6.4996 {"}'M' greentint -9.4702 2.4064 -6.7971 {"}'M' greentint -9.5267 2.1569 -6.8003 {"}'M' greentint -9.2272 2.7966 -6.5917 {"}'M' greentint -9.3665 2.6287 -6.7248 {"}'M' greentint -9.4398 2.5004 -7.0419 {"}'M' greentint -9.5109 2.2553 -7.0661 {"}'M' greentint -9.1966 2.8976 -6.8378 {"}'M' greentint -9.3323 2.7201 -6.964 {"}'M' greentint -9.3619 2.5806 -7.2801 {"}'M' greentint -9.4431 2.3374 -7.3185 {"}'M' greentint -9.1132 2.9808 -7.0709 {"}'M' greentint -9.2499 2.7992 -7.1957 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ARG 58 A}'M' green -9.5036 2.3146 -6.3963 {"}'M' green -9.3984 2.5292 -6.3186 {"}'M' green -9.5757 2.088 -6.8259 {"}'M' green -9.1685 2.9256 -6.5324 {"}'M' green -9.6427 2.1228 -7.2655 {"}'M' green -9.1026 3.0048 -6.8124 {"}'M' green -9.5317 2.3063 -7.4359 {"}'M' green -9.3982 2.5241 -7.4895 {"}'M' green -9.1833 2.8743 -7.3098 {"}'M' green -9.3165 2.7707 -7.5093 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 58 A}'M' greentint -9.4262 2.2334 -6.6735 {"}'M' greentint -9.3016 2.4333 -6.5677 {"}'M' greentint -9.213 2.6709 -6.5197 {"}'M' greentint -9.4804 2.1677 -7.0675 {"}'M' greentint -9.3261 2.3004 -6.9058 {"}'M' greentint -9.2019 2.5037 -6.8012 {"}'M' greentint -9.1236 2.7494 -6.7691 {"}'M' greentint -9.3707 2.3344 -7.2359 {"}'M' greentint -9.2227 2.4863 -7.0871 {"}'M' greentint -9.1279 2.7204 -7.0297 {"}'M' greentint -9.1116 2.9741 -7.0791 {"}'M' greentint -9.2382 2.6211 -7.31 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 120 A}'M' green -10.0125 0.9962 -4.6908 {"}'M' green -9.6934 1.1912 -4.3333 {"}'M' green -10.0843 0.8964 -4.9215 {"}'M' green -9.5324 1.4625 -4.3665 {"}'M' green -10.0397 1.2475 -5.2245 {"}'M' green -9.3408 1.6392 -4.4304 {"}'M' green -9.3788 1.8688 -4.8868 {"}'M' green -9.5402 1.8296 -5.0847 {"}'M' green -9.6968 1.7176 -5.2561 {"}'M' green -9.8354 1.5428 -5.3868 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 120 A}'M' greentint -9.8793 1.0998 -4.4913 {"}'M' greentint -9.7976 1.3464 -4.5112 {"}'M' greentint -9.9576 1.2495 -4.6906 {"}'M' greentint -10.068 1.1501 -4.9709 {"}'M' greentint -9.6641 1.5642 -4.5647 {"}'M' greentint -9.8251 1.5362 -4.7647 {"}'M' greentint -9.9732 1.3842 -4.9135 {"}'M' greentint -9.4757 1.7341 -4.6313 {"}'M' greentint -9.6346 1.7372 -4.8372 {"}'M' greentint -9.7948 1.6462 -5.0201 {"}'M' greentint -9.9363 1.4756 -5.1557 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 58 A}'M' green -10.1639 0.9361 -4.7387 {"}'M' green -10.0013 0.9918 -4.5445 {"}'M' green -9.8435 1.102 -4.3711 {"}'M' green -9.6981 1.2637 -4.2281 {"}'M' sea -10.2375 1.1185 -5.2023 {"}'M' green -10.0896 1.0715 -4.9978 {"}'M' green -9.5002 1.5318 -4.364 {"}'M' green -10.1093 1.3302 -5.3538 {"}'M' green -9.4137 1.7543 -4.5717 {"}'M' green -9.9696 1.5648 -5.4283 {"}'M' green -9.4284 1.8805 -4.8171 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 58 A}'M' greentint -9.9304 1.0939 -4.7973 {"}'M' greentint -9.7706 1.1825 -4.6163 {"}'M' greentint -9.6239 1.3321 -4.4687 {"}'M' greentint -9.9709 1.2534 -5.1523 {"}'M' greentint -9.8121 1.2644 -4.9514 {"}'M' greentint -9.6551 1.3603 -4.774 {"}'M' greentint -9.5166 1.5309 -4.6425 {"}'M' greentint -9.8366 1.4613 -5.2281 {"}'M' greentint -9.6735 1.4905 -5.0254 {"}'M' greentint -9.5237 1.6442 -4.8746 {"}'M' greentint -9.724 1.6911 -5.2633 {"}'M' greentint -9.5652 1.7884 -5.0856 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 169 1wtjA_183F_171}P -8.2817 5.1766 -12.9002 {"}-8.2817 5.1766 -12.9002 { ca ile A 169 1wtjA_183F_171}-9.5004 5.2806 -12.1084 { c ile A 169 1wtjA_183F_171}-9.1784 4.5958 -10.7823 { o ile A 169 1wtjA_183F_171}-8.536 3.5399 -10.7671 { c ile A 169 1wtjA_183F_171}P -9.1784 4.5958 -10.7823 { n ala A 170 1wtjA_183F_171}-9.6094 5.1961 -9.6782 { ca ala A 170 1wtjA_183F_171}-9.3748 4.6237 -8.3537 { c ala A 170 1wtjA_183F_171}-10.6729 4.6038 -7.5669 { o ala A 170 1wtjA_183F_171}-11.545 5.4542 -7.7602 { c ala A 170 1wtjA_183F_171}P -10.6729 4.6038 -7.5669 { n phe A 171 1wtjA_183F_171}-10.7878 3.6311 -6.6697 { ca phe A 171 1wtjA_183F_171}-11.9844 3.4606 -5.8534 { c phe A 171 1wtjA_183F_171}-11.5909 3.01 -4.4505 { o phe A 171 1wtjA_183F_171}-10.7114 2.1636 -4.284 { c phe A 171 1wtjA_183F_171}P -11.5909 3.01 -4.4505 { n gly A 172 1wtjA_183F_171}-12.2384 3.5897 -3.4463 { ca gly A 172 1wtjA_183F_171}-11.9531 3.2207 -2.0698 { c gly A 172 1wtjA_183F_171}-13.2418 3.0895 -1.2841 { o gly A 172 1wtjA_183F_171}-14.1392 3.9227 -1.4123 { c gly A 172 1wtjA_183F_171}P -13.2418 3.0895 -1.2841 { n ala A 173 1wtjA_183F_171}-13.347 2.038 -0.4787 { ca ala A 173 1wtjA_183F_171}-14.5403 1.8234 0.3334 { c ala A 173 1wtjA_183F_171}-14.1812 1.1796 1.6649 { o ala A 173 1wtjA_183F_171}-13.2886 0.3385 1.7354 { n ile A 181 1wtjA_183F_171}P -11.0285 -1.2281 1.2261 {"}-11.0285 -1.2281 1.2261 { ca ile A 181 1wtjA_183F_171}-10.9707 -1.9811 -0.0233 { c ile A 181 1wtjA_183F_171}-10.6208 -0.8821 -1.0161 { o ile A 181 1wtjA_183F_171}-11.4059 0.0463 -1.2142 { c ile A 181 1wtjA_183F_171}P -10.6208 -0.8821 -1.0161 { n val A 182 1wtjA_183F_171}-9.4424 -0.9698 -1.6206 { ca val A 182 1wtjA_183F_171}-9.0102 0.0654 -2.5461 { c val A 182 1wtjA_183F_171}-8.323 -0.4803 -3.7876 { o val A 182 1wtjA_183F_171}-7.4568 -1.3527 -3.6998 { c val A 182 1wtjA_183F_171}P -8.323 -0.4803 -3.7876 { n phe A 183 1wtjA_183F_171}-8.7199 0.0205 -4.9518 { ca phe A 183 1wtjA_183F_171}-8.0572 -0.3867 -6.1799 { c phe A 183 1wtjA_183F_171}-7.7507 0.8683 -6.9821 { o phe A 183 1wtjA_183F_171}-8.3799 1.9185 -6.7968 { c phe A 183 1wtjA_183F_171}P -7.7507 0.8683 -6.9821 { n asp A 184 1wtjA_183F_171}-6.7466 0.7573 -7.84 { ca asp A 184 1wtjA_183F_171}-6.2703 1.8709 -8.6446 { c asp A 184 1wtjA_183F_171}-5.7709 1.2615 -9.9505 { o asp A 184 1wtjA_183F_171}-4.7677 0.5442 -9.9586 { c asp A 184 1wtjA_183F_171}P -5.7709 1.2615 -9.9505 { n leu A 185 1wtjA_183F_171}-6.4629 1.5439 -11.0512 { ca leu A 185 1wtjA_183F_171}-6.0858 0.9635 -12.3327 { c leu A 185 1wtjA_183F_171}-6.0081 1.9384 -13.4948 { o leu A 185 1wtjA_183F_171}-6.8465 2.8207 -13.6323 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 169 1wtjA_183F_171}P -8.2817 5.1766 -12.9002 { ca ile A 169 1wtjA_183F_171}P -9.5004 5.2806 -12.1084 { n ala A 170 1wtjA_183F_171}P -9.6094 5.1961 -9.6782 { ca ala A 170 1wtjA_183F_171}P -9.3748 4.6237 -8.3537 { n phe A 171 1wtjA_183F_171}P -10.7878 3.6311 -6.6697 { ca phe A 171 1wtjA_183F_171}P -11.9844 3.4606 -5.8534 { n gly A 172 1wtjA_183F_171}P -12.2384 3.5897 -3.4463 { ca gly A 172 1wtjA_183F_171}P -11.9531 3.2207 -2.0698 {"}P -11.9531 3.2207 -2.0698 { n ala A 173 1wtjA_183F_171}P -13.347 2.038 -0.4787 { ca ala A 173 1wtjA_183F_171}P -14.5403 1.8234 0.3334 { n ile A 181 1wtjA_183F_171}P -11.0285 -1.2281 1.2261 { ca ile A 181 1wtjA_183F_171}P -10.9707 -1.9811 -0.0233 { n val A 182 1wtjA_183F_171}P -9.4424 -0.9698 -1.6206 { ca val A 182 1wtjA_183F_171}P -9.0102 0.0654 -2.5461 { n phe A 183 1wtjA_183F_171}P -8.7199 0.0205 -4.9518 { ca phe A 183 1wtjA_183F_171}P -8.0572 -0.3867 -6.1799 { n asp A 184 1wtjA_183F_171}P -6.7466 0.7573 -7.84 { ca asp A 184 1wtjA_183F_171}P -6.2703 1.8709 -8.6446 { n leu A 185 1wtjA_183F_171}P -6.4629 1.5439 -11.0512 { ca leu A 185 1wtjA_183F_171}P -6.0858 0.9635 -12.3327 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 169 1wtjA_183F_171}P -9.5004 5.2806 -12.1084 {"}-9.5004 5.2806 -12.1084 { ca ala A 170 1wtjA_183F_171}-9.3748 4.6237 -8.3537 { ca phe A 171 1wtjA_183F_171}-11.9844 3.4606 -5.8534 { ca gly A 172 1wtjA_183F_171}-11.9531 3.2207 -2.0698 { ca ala A 173 1wtjA_183F_171}-14.5403 1.8234 0.3334 { ca ile A 181 1wtjA_183F_171}P -10.9707 -1.9811 -0.0233 {"}-10.9707 -1.9811 -0.0233 { ca val A 182 1wtjA_183F_171}-9.0102 0.0654 -2.5461 { ca phe A 183 1wtjA_183F_171}-8.0572 -0.3867 -6.1799 { ca asp A 184 1wtjA_183F_171}-6.2703 1.8709 -8.6446 { ca leu A 185 1wtjA_183F_171}-6.0858 0.9635 -12.3327 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 171 1wtjA_183F_171}P -11.9844 3.4606 -5.8534 { cb phe A 171 1wtjA_183F_171}-12.8868 2.4061 -6.5059 { cg phe A 171 1wtjA_183F_171}-14.0965 2.0383 -5.6915 { cd1 phe A 171 1wtjA_183F_171}-15.2116 2.869 -5.6639 { ce1 phe A 171 1wtjA_183F_171}-16.3514 2.5163 -4.9266 { cz phe A 171 1wtjA_183F_171}-16.3725 1.3272 -4.2124 { cg phe A 171 1wtjA_183F_171}P -14.0965 2.0383 -5.6915 { cd2 phe A 171 1wtjA_183F_171}-14.1256 0.848 -4.9692 { ce2 phe A 171 1wtjA_183F_171}-15.2583 0.487 -4.2288 { cz phe A 171 1wtjA_183F_171}ghost -16.3725 1.3272 -4.2124 { ca phe A 183 1wtjA_183F_171}P -8.0572 -0.3867 -6.1799 { cb phe A 183 1wtjA_183F_171}-8.8728 -1.4303 -6.9709 { cg phe A 183 1wtjA_183F_171}-10.1518 -0.9251 -7.5681 { cd1 phe A 183 1wtjA_183F_171}-10.1444 -0.0939 -8.6824 { ce1 phe A 183 1wtjA_183F_171}-11.3378 0.3085 -9.2844 { cz phe A 183 1wtjA_183F_171}-12.5553 -0.1244 -8.7631 { cg phe A 183 1wtjA_183F_171}P -10.1518 -0.9251 -7.5681 { cd2 phe A 183 1wtjA_183F_171}-11.3785 -1.3471 -7.055 { ce2 phe A 183 1wtjA_183F_171}-12.5723 -0.9521 -7.6473 { cz phe A 183 1wtjA_183F_171}ghost -12.5553 -0.1244 -8.7631 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 171 1wtjA_183F_171}P -12.8868 2.4061 -6.5059 {"}P -12.8868 2.4061 -6.5059 { cd1 phe A 171 1wtjA_183F_171}P -15.2116 2.869 -5.6639 { cd2 phe A 171 1wtjA_183F_171}P -14.1256 0.848 -4.9692 { ce1 phe A 171 1wtjA_183F_171}P -16.3514 2.5163 -4.9266 { ce2 phe A 171 1wtjA_183F_171}P -15.2583 0.487 -4.2288 { cz phe A 171 1wtjA_183F_171}P -16.3725 1.3272 -4.2124 { cb phe A 183 1wtjA_183F_171}P -8.8728 -1.4303 -6.9709 {"}P -8.8728 -1.4303 -6.9709 { cd1 phe A 183 1wtjA_183F_171}P -10.1444 -0.0939 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1.6339 -4.726 {"}'M' green -9.6932 1.6808 -5.1147 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 171 A}'M' greentint -10.2904 0.9304 -4.7958 {"}'M' greentint -10.1332 0.9258 -4.5901 {"}'M' greentint -9.9706 0.9815 -4.396 {"}'M' greentint -10.2068 1.1082 -5.0537 {"}'M' greentint -10.0588 1.0612 -4.8492 {"}'M' greentint -9.8996 1.0836 -4.6487 {"}'M' greentint -9.7399 1.1722 -4.4677 {"}'M' greentint -9.5932 1.3218 -4.3201 {"}'M' greentint -10.0786 1.3199 -5.2052 {"}'M' greentint -9.9402 1.2431 -5.0037 {"}'M' greentint -9.7814 1.2541 -4.8028 {"}'M' greentint -9.6243 1.35 -4.6255 {"}'M' greentint -9.8059 1.451 -5.0795 {"}'M' greentint -9.6427 1.4802 -4.8768 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 246 1wvfA_248F_325}P -11.8225 -1.9808 0.6066 {"}-11.8225 -1.9808 0.6066 { ca lys A 246 1wvfA_248F_325}-10.879 -2.4745 -0.3886 { c lys A 246 1wvfA_248F_325}-10.5887 -1.4213 -1.4387 { o lys A 246 1wvfA_248F_325}-11.3004 -1.3172 -2.4454 { c lys A 246 1wvfA_248F_325}P -10.5887 -1.4213 -1.4387 { n pro A 247 1wvfA_248F_325}-9.5717 -0.5859 -1.1895 { ca pro A 247 1wvfA_248F_325}-9.2015 0.4551 -2.1549 { c pro A 247 1wvfA_248F_325}-8.397 -0.1906 -3.2593 { o pro A 247 1wvfA_248F_325}-7.6939 -1.1749 -3.0272 { c pro A 247 1wvfA_248F_325}P -8.397 -0.1906 -3.2593 { n phe A 248 1wvfA_248F_325}-8.4796 0.3542 -4.4707 { ca phe A 248 1wvfA_248F_325}-7.7212 -0.1771 -5.5976 { c phe A 248 1wvfA_248F_325}-7.5045 0.8999 -6.6477 { o phe A 248 1wvfA_248F_325}-8.0981 1.982 -6.5816 { c phe A 248 1wvfA_248F_325}P -7.5045 0.8999 -6.6477 { n glu A 249 1wvfA_248F_325}-6.6381 0.6032 -7.5984 { ca glu A 249 1wvfA_248F_325}-6.3117 1.5401 -8.6565 { c glu A 249 1wvfA_248F_325}-6.3049 0.8507 -10.0004 { o glu A 249 1wvfA_248F_325}-6.0747 -0.3606 -10.1013 { c glu A 249 1wvfA_248F_325}P -6.3049 0.8507 -10.0004 { n val A 250 1wvfA_248F_325}-6.6037 1.61 -11.0503 { ca val A 250 1wvfA_248F_325}-6.5171 1.0527 -12.3837 { c val A 250 1wvfA_248F_325}-5.7297 2.08 -13.1979 { o val A 250 1wvfA_248F_325}-6.1193 3.2418 -13.2847 { n leu A 323 1wvfA_248F_325}P -6.8515 5.7792 -12.0895 {"}-6.8515 5.7792 -12.0895 { ca leu A 323 1wvfA_248F_325}-8.1736 5.6741 -11.4835 { c leu A 323 1wvfA_248F_325}-8.0987 5.08 -10.0887 { o leu A 323 1wvfA_248F_325}-7.5386 3.992 -9.9241 { c leu A 323 1wvfA_248F_325}P -8.0987 5.08 -10.0887 { n tyr A 324 1wvfA_248F_325}-8.6174 5.7944 -9.0946 { ca tyr A 324 1wvfA_248F_325}-8.6233 5.3093 -7.7068 { c tyr A 324 1wvfA_248F_325}-10.0691 5.1438 -7.2682 { o tyr A 324 1wvfA_248F_325}-10.8795 6.0904 -7.3426 { c tyr A 324 1wvfA_248F_325}P -10.0691 5.1438 -7.2682 { n ala A 325 1wvfA_248F_325}-10.3873 3.9391 -6.8112 { ca ala A 325 1wvfA_248F_325}-11.7473 3.5948 -6.3989 { c ala A 325 1wvfA_248F_325}-11.6925 2.67 -5.1953 { o ala A 325 1wvfA_248F_325}-10.6124 2.215 -4.8165 { c ala A 325 1wvfA_248F_325}P -11.6925 2.67 -5.1953 { n ala A 326 1wvfA_248F_325}-12.8498 2.3387 -4.6337 { ca ala A 326 1wvfA_248F_325}-12.8581 1.4275 -3.4973 { c ala A 326 1wvfA_248F_325}-14.1756 0.6963 -3.3778 { o ala A 326 1wvfA_248F_325}-15.2162 1.1321 -3.8981 { c ala A 326 1wvfA_248F_325}P -14.1756 0.6963 -3.3778 { n leu A 327 1wvfA_248F_325}-14.105 -0.452 -2.715 { ca leu A 327 1wvfA_248F_325}-15.2847 -1.2611 -2.415 { c leu A 327 1wvfA_248F_325}-15.4071 -1.2829 -0.8942 { o leu A 327 1wvfA_248F_325}-14.4016 -1.1803 -0.1738 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 246 1wvfA_248F_325}P -11.8225 -1.9808 0.6066 { ca lys A 246 1wvfA_248F_325}P -10.879 -2.4745 -0.3886 { ca pro A 247 1wvfA_248F_325}P -9.2015 0.4551 -2.1549 { n phe A 248 1wvfA_248F_325}P -8.4796 0.3542 -4.4707 { ca phe A 248 1wvfA_248F_325}P -7.7212 -0.1771 -5.5976 { n glu A 249 1wvfA_248F_325}P -6.6381 0.6032 -7.5984 { ca glu A 249 1wvfA_248F_325}P -6.3117 1.5401 -8.6565 { n val A 250 1wvfA_248F_325}P -6.6037 1.61 -11.0503 { ca val A 250 1wvfA_248F_325}P -6.5171 1.0527 -12.3837 { n leu A 323 1wvfA_248F_325}P -6.8515 5.7792 -12.0895 { ca leu A 323 1wvfA_248F_325}P -8.1736 5.6741 -11.4835 { n tyr A 324 1wvfA_248F_325}P -8.6174 5.7944 -9.0946 { ca tyr A 324 1wvfA_248F_325}P -8.6233 5.3093 -7.7068 { n ala A 325 1wvfA_248F_325}P -10.3873 3.9391 -6.8112 { ca ala A 325 1wvfA_248F_325}P -11.7473 3.5948 -6.3989 { n ala A 326 1wvfA_248F_325}P -12.8498 2.3387 -4.6337 { ca ala A 326 1wvfA_248F_325}P -12.8581 1.4275 -3.4973 { n leu A 327 1wvfA_248F_325}P -14.105 -0.452 -2.715 { ca leu A 327 1wvfA_248F_325}P -15.2847 -1.2611 -2.415 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 246 1wvfA_248F_325}P -10.879 -2.4745 -0.3886 {"}-10.879 -2.4745 -0.3886 { ca pro A 247 1wvfA_248F_325}-9.2015 0.4551 -2.1549 { ca phe A 248 1wvfA_248F_325}-7.7212 -0.1771 -5.5976 { ca glu A 249 1wvfA_248F_325}-6.3117 1.5401 -8.6565 { ca val A 250 1wvfA_248F_325}-6.5171 1.0527 -12.3837 { ca leu A 323 1wvfA_248F_325}-8.1736 5.6741 -11.4835 { ca tyr A 324 1wvfA_248F_325}-8.6233 5.3093 -7.7068 { ca ala A 325 1wvfA_248F_325}-11.7473 3.5948 -6.3989 { ca ala A 326 1wvfA_248F_325}-12.8581 1.4275 -3.4973 { ca leu A 327 1wvfA_248F_325}-15.2847 -1.2611 -2.415 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 248 1wvfA_248F_325}P -7.7212 -0.1771 -5.5976 { cb phe A 248 1wvfA_248F_325}-8.4108 -1.3947 -6.2314 { cg phe A 248 1wvfA_248F_325}-9.7548 -1.0963 -6.8548 { cd1 phe A 248 1wvfA_248F_325}-9.8684 -0.8415 -8.2182 { ce1 phe A 248 1wvfA_248F_325}-11.1348 -0.5778 -8.7927 { cz phe A 248 1wvfA_248F_325}-12.2579 -0.5727 -7.9996 { cg phe A 248 1wvfA_248F_325}P -9.7548 -1.0963 -6.8548 { cd2 phe A 248 1wvfA_248F_325}-10.9138 -1.0838 -6.0733 { ce2 phe A 248 1wvfA_248F_325}-12.1578 -0.8254 -6.638 { cz phe A 248 1wvfA_248F_325}ghost -12.2579 -0.5727 -7.9996 { ca ala A 325 1wvfA_248F_325}P -11.7473 3.5948 -6.3989 { cb ala A 325 1wvfA_248F_325}-12.432 2.8827 -7.5534 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 248 1wvfA_248F_325}P -8.4108 -1.3947 -6.2314 {"}P -8.4108 -1.3947 -6.2314 { cd1 phe A 248 1wvfA_248F_325}P -9.8684 -0.8415 -8.2182 { cd2 phe A 248 1wvfA_248F_325}P -10.9138 -1.0838 -6.0733 { ce1 phe A 248 1wvfA_248F_325}P -11.1348 -0.5778 -8.7927 { ce2 phe A 248 1wvfA_248F_325}P -12.1578 -0.8254 -6.638 { cz phe A 248 1wvfA_248F_325}P -12.2579 -0.5727 -7.9996 { cb ala A 325 1wvfA_248F_325}P -12.432 2.8827 -7.5534 {"}P -12.432 2.8827 -7.5534 {"}P -12.432 2.8827 -7.5534 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 248 A}'S' sky -11.7077 1.0697 -8.9315 { CE2 PHE 248 A}'S' blue -12.225 0.9223 -6.5649 {"}'S' blue -12.3866 0.9049 -6.7698 {"}'S' blue -12.5505 0.8482 -6.9655 {"}'S' sky -12.0461 0.9167 -6.7617 {"}'S' blue -11.6799 0.8563 -6.7054 {"}'S' sky -11.6225 0.7913 -7.041 { CZ PHE 248 A}'S' blue -12.6027 0.8432 -7.0307 {"}'S' sky -12.7426 0.9241 -7.2335 {"}'S' sky -13.0567 0.9434 -7.6449 {"}'S' blue -13.1159 0.9506 -8.0812 {"}'S' blue -12.988 0.985 -8.3176 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 248 A}'S' sea -11.115 0.7855 -7.696 {"}'S' green -11.2325 0.9146 -7.8844 {"}'S' green -11.8321 1.024 -8.6896 {"}'S' sea -10.9669 0.9394 -7.9371 {"}'S' green -11.0948 1.0424 -8.1321 {"}'S' green -11.2373 1.1082 -8.335 {"}'S' green -11.3892 1.1354 -8.5386 {"}'S' green -11.5468 1.1223 -8.7391 {"}'S' sea -10.8986 1.0862 -8.3046 {"}'S' sea -11.0454 1.147 -8.5122 {"}'S' sea -11.202 1.17 -8.7196 { CE2 PHE 248 A}'S' sea -12.2082 0.8933 -6.9642 {"}'S' sea -11.8376 0.8736 -6.9128 { CZ PHE 248 A}'S' sea -12.8956 0.9583 -7.4419 {"}'S' green -12.491 1.0098 -7.2902 {"}'S' green -12.6389 1.0596 -7.4952 {"}'S' green -12.7948 1.0652 -7.6993 {"}'S' sea -12.9552 1.029 -7.8966 {"}'S' green -12.09 0.9445 -7.1441 {"}'S' green -11.58 0.8865 -7.3122 {"}'S' green -11.2843 0.8654 -7.7867 {"}'S' green -11.8842 1.0252 -8.6073 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 248 A}'S' P -11.3679 1.0048 -8.0832 {"}'S' -11.3647 0.9841 -8.093 {"}'S' P -11.5159 1.0546 -8.2882 {"}'S' -11.5075 1.0191 -8.2994 {"}'S' P -11.6718 1.0602 -8.4923 {"}'S' -11.6695 1.0542 -8.493 { CZ PHE 248 A}'S' P -12.2179 1.0474 -7.3391 {"}'S' -12.2195 1.0099 -7.3549 {"}'S' P -12.3604 1.1133 -7.542 {"}'S' -12.3562 1.0412 -7.5609 {"}'S' P -12.5123 1.1405 -7.7455 {"}'S' -12.5038 1.0809 -7.7546 {"}'S' P -12.6699 1.1273 -7.9461 {"}'S' -12.6704 1.1265 -7.9465 {"}'S' P -11.8873 0.9929 -7.3106 {"}'S' -11.8953 0.9586 -7.3256 {"}'S' P -12.0217 1.0913 -7.5115 {"}'S' -12.0375 0.9805 -7.5438 {"}'S' P -12.1685 1.152 -7.7192 {"}'S' -12.1759 1.0061 -7.7421 {"}'S' P -12.3251 1.175 -7.9266 {"}'S' -12.32 1.0507 -7.9322 {"}'S' P -12.4867 1.1576 -8.1315 {"}'S' -12.4805 1.1072 -8.1269 {"}'S' P -11.7023 1.0111 -7.5061 {"}'S' -11.7267 0.9423 -7.5271 {"}'S' P -11.8402 1.1021 -7.7085 {"}'S' -11.8757 0.9603 -7.7332 {"}'S' P -11.9893 1.1551 -7.9159 {"}'S' -12.0146 0.9873 -7.9241 {"}'S' P -12.1462 1.1694 -8.1233 {"}'S' -12.1549 1.0369 -8.1135 {"}'S' P -12.3083 1.146 -8.3259 {"}'S' -12.3073 1.0959 -8.3165 {"}'S' P -11.4943 0.9643 -7.6572 {"}'S' -11.5133 0.9265 -7.666 {"}'S' P -11.6314 1.0552 -7.8602 {"}'S' -11.6714 0.9518 -7.869 {"}'S' P -11.7801 1.109 -8.0671 {"}'S' -11.8165 0.9807 -8.0619 {"}'S' P -11.9377 1.1262 -8.2745 {"}'S' -11.9561 1.0276 -8.2584 {"}'S' P -12.0994 1.1032 -8.4783 {"}'S' -12.1021 1.0794 -8.4714 {"}'S' P -11.4191 0.963 -7.9881 {"}'S' -11.4313 0.9404 -7.9877 {"}'S' P -11.5667 1.0225 -8.195 {"}'S' -11.5865 0.976 -8.1892 {"}'S' P -11.7226 1.044 -8.4026 {"}'S' -11.7315 1.0166 -8.3966 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 325 A}'S' sky -13.0539 1.2523 -7.686 {"}'S' sky -12.585 1.2083 -7.0692 {"}'S' blue -12.4222 1.2699 -6.8744 {"}'S' blue -12.2618 1.3676 -6.6946 {"}'S' sky -12.9917 1.3021 -8.0533 {"}'S' sky -12.8602 1.3758 -8.3329 { HB3 ALA 325 A}'S' sky -11.9745 1.2411 -6.8934 {"}'S' sky -11.7519 1.1408 -6.9866 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 325 A}'S' sea -12.9048 1.1993 -7.4787 {"}'S' sea -12.7471 1.1848 -7.2718 {"}'S' green -12.8543 1.2103 -7.8512 {"}'S' green -12.7056 1.1565 -7.6444 { HB3 ALA 325 A}'S' green -12.7169 1.1607 -7.8299 {"}'S' green -12.2835 1.0338 -7.2342 {"}'S' green -11.4955 0.9172 -7.4567 {"}'S' green -11.3335 0.9396 -7.6641 {"}'S' sea -11.7915 1.2235 -8.7018 {"}'S' green -11.6878 1.0647 -8.5239 {"}'S' green -11.2339 0.9946 -7.9182 {"}'S' sea -11.0767 1.113 -7.7474 {"}'S' sea -11.5533 1.3304 -8.7322 {"}'S' green -11.4507 1.1776 -8.5571 {"}'S' green -11.1572 1.1134 -8.1584 {"}'S' sea -11.0011 1.2087 -7.9838 {"}'S' sea -11.2958 1.4005 -8.6492 {"}'S' sea -11.1624 1.2977 -8.4485 {"}'S' sea -10.9989 1.3264 -8.2452 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 325 A}'S' P -12.5881 1.059 -7.6358 {"}'S' -12.5737 1.0767 -7.639 {"}'S' P -12.4409 1.0159 -7.4332 {"}'S' -12.428 1.0385 -7.4414 {"}'S' P -12.6237 1.1267 -8.11 {"}'S' -12.6211 1.1297 -8.1089 {"}'S' P -12.5083 0.9951 -7.924 {"}'S' -12.4643 1.0614 -7.9166 {"}'S' P -12.371 0.9136 -7.7245 {"}'S' -12.3215 1.0194 -7.7323 {"}'S' P -12.219 0.8878 -7.5212 {"}'S' -12.1873 0.9865 -7.5465 {"}'S' P -12.0597 0.9183 -7.324 {"}'S' -12.0516 0.9639 -7.344 {"}'S' P -12.4561 1.0945 -8.3162 {"}'S' -12.446 1.1095 -8.3075 {"}'S' P -12.3473 0.9538 -8.1371 {"}'S' -12.3039 1.047 -8.1059 {"}'S' P -12.2166 0.8594 -7.942 {"}'S' -12.17 1.0093 -7.9227 {"}'S' P -12.0693 0.8178 -7.7397 {"}'S' -12.0422 0.9765 -7.7492 {"}'S' P -11.9138 0.8297 -7.5419 {"}'S' -11.9097 0.9443 -7.5676 {"}'S' P -11.7551 0.8942 -7.3551 {"}'S' -11.7596 0.9271 -7.3688 {"}'S' P -12.218 1.0391 -8.4242 {"}'S' -12.2054 1.0724 -8.4025 {"}'S' P -12.1018 0.9074 -8.2387 {"}'S' -12.0784 1.0173 -8.1942 {"}'S' P -11.9653 0.826 -8.0386 {"}'S' -11.9521 0.9828 -8.0068 {"}'S' P -11.8129 0.801 -7.8349 {"}'S' -11.8206 0.9495 -7.8314 {"}'S' P -11.6535 0.8315 -7.6377 {"}'S' -11.6705 0.9189 -7.6501 {"}'S' P -11.9251 0.9897 -8.4431 {"}'S' -11.9236 1.0283 -8.4175 {"}'S' P -11.7966 0.8889 -8.248 {"}'S' -11.803 0.9803 -8.2109 {"}'S' P -11.6494 0.8458 -8.0454 {"}'S' -11.6689 0.9446 -8.0246 {"}'S' P -11.4912 0.8636 -7.8469 {"}'S' -11.5106 0.9178 -7.8448 {"}'S' P -11.5529 0.9699 -8.323 {"}'S' -11.5628 1.0038 -8.305 {"}'S' P -11.3971 0.9457 -8.1148 {"}'S' -11.4096 0.9727 -8.1072 {"}'S' P -11.3136 1.1026 -8.3576 {"}'S' -11.3151 1.1042 -8.3567 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 248 A}'M' green -9.1715 2.6623 -5.9944 {"}'M' green -9.0223 2.8924 -6.0566 {"}'M' green -8.7525 3.2015 -6.3685 {"}'M' green -9.2866 2.3931 -7.1976 {"}'M' green -8.8045 3.0458 -7.1559 {"}'M' green -8.9366 2.8628 -7.2758 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 248 A}'M' greentint -9.3201 2.5054 -6.1429 {"}'M' greentint -9.4238 2.409 -6.4404 {"}'M' greentint -9.1809 2.7993 -6.235 {"}'M' greentint -9.3201 2.6313 -6.3682 {"}'M' greentint -9.3934 2.503 -6.6852 {"}'M' greentint -9.4646 2.2579 -6.7094 {"}'M' greentint -8.9955 3.0233 -6.3164 {"}'M' greentint -9.1503 2.9002 -6.4811 {"}'M' greentint -9.286 2.7227 -6.6073 {"}'M' greentint -9.3155 2.5832 -6.9234 {"}'M' greentint -9.3967 2.3401 -6.9618 {"}'M' greentint -8.9146 3.1193 -6.5542 {"}'M' greentint -9.0669 2.9834 -6.7142 {"}'M' greentint -9.2035 2.8018 -6.839 {"}'M' greentint -9.2011 2.628 -7.1531 {"}'M' greentint -8.8135 3.1656 -6.8008 {"}'M' greentint -8.9597 3.022 -6.9507 {"}'M' greentint -9.0905 2.8401 -7.0692 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ALA 325 A}'M' green -8.8027 3.1773 -6.3444 {"}'M' green -9.0323 2.7758 -7.3014 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 325 A}'M' greentint -9.4211 2.2662 -6.4912 {"}'M' greentint -9.2709 2.3906 -6.3314 {"}'M' greentint -9.1377 2.5662 -6.2083 {"}'M' greentint -9.0325 2.7809 -6.1305 {"}'M' greentint -9.3705 2.2637 -6.8248 {"}'M' greentint -9.2098 2.3396 -6.6379 {"}'M' greentint -9.0603 2.485 -6.4855 {"}'M' greentint -8.9357 2.685 -6.3797 {"}'M' greentint -8.8472 2.9226 -6.3317 {"}'M' greentint -9.2768 2.3745 -7.0775 {"}'M' greentint -9.1145 2.4194 -6.8795 {"}'M' greentint -8.9603 2.552 -6.7178 {"}'M' greentint -8.836 2.7554 -6.6132 {"}'M' greentint -8.7577 3.001 -6.5811 {"}'M' greentint -9.1658 2.558 -7.2479 {"}'M' greentint -9.0048 2.586 -7.0479 {"}'M' greentint -8.8568 2.738 -6.8991 {"}'M' greentint -8.762 2.9721 -6.8417 {"}'M' greentint -8.8724 2.8727 -7.122 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 248 A}'M' greentint -9.8307 1.3129 -4.0873 {"}'M' greentint -9.9639 1.2092 -4.2868 {"}'M' greentint -9.749 1.5594 -4.1071 {"}'M' greentint -9.9089 1.4625 -4.2865 {"}'M' greentint -10.0193 1.3632 -4.5668 {"}'M' greentint -10.0356 1.1095 -4.5175 {"}'M' greentint -9.6155 1.7773 -4.1606 {"}'M' greentint -9.7765 1.7492 -4.3606 {"}'M' greentint -9.9245 1.5973 -4.5095 {"}'M' greentint -9.9911 1.4606 -4.8204 {"}'M' greentint -10.0415 1.2059 -4.8158 {"}'M' greentint -10.0328 0.9581 -4.7354 {"}'M' greentint -9.4271 1.9472 -4.2273 {"}'M' greentint -9.5859 1.9503 -4.4332 {"}'M' greentint -9.7462 1.8592 -4.6161 {"}'M' greentint -9.8876 1.6887 -4.7516 {"}'M' greentint -9.8942 1.5349 -5.0604 {"}'M' greentint -9.9625 1.2859 -5.0781 {"}'M' greentint -9.983 1.0326 -5.0346 {"}'M' greentint -9.3302 2.0819 -4.4828 {"}'M' greentint -9.4915 2.0427 -4.6806 {"}'M' greentint -9.6481 1.9306 -4.852 {"}'M' greentint -9.7867 1.7559 -4.9828 {"}'M' greentint -9.7488 1.5544 -5.278 {"}'M' greentint -9.8223 1.3146 -5.3049 {"}'M' greentint -9.3602 2.0691 -4.9173 {"}'M' greentint -9.5104 1.9446 -5.0772 {"}'M' greentint -9.6436 1.769 -5.2003 {"}'M' greentint -9.3192 1.9266 -5.2543 {"}'M' greentint -9.4515 1.7525 -5.3765 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 325 A}'M' greentint -9.834 1.2445 -4.1754 {"}'M' greentint -9.7116 1.4447 -4.0725 {"}'M' greentint -9.9789 0.9728 -4.6874 {"}'M' greentint -9.8271 1.0935 -4.5245 {"}'M' greentint -9.6868 1.2555 -4.3885 {"}'M' greentint -9.5648 1.4521 -4.2855 {"}'M' greentint -9.4665 1.6769 -4.2195 {"}'M' greentint -9.3938 1.9179 -4.1939 {"}'M' greentint -9.8715 1.0329 -4.9285 {"}'M' greentint -9.7137 1.1431 -4.7551 {"}'M' greentint -9.5683 1.3049 -4.6121 {"}'M' greentint -9.4437 1.5073 -4.5085 {"}'M' greentint -9.3473 1.7404 -4.4487 {"}'M' greentint -9.2835 1.9921 -4.4361 {"}'M' greentint -9.8006 1.135 -5.1813 {"}'M' greentint -9.6409 1.2236 -5.0003 {"}'M' greentint -9.4942 1.3732 -4.8527 {"}'M' greentint -9.3704 1.573 -4.748 {"}'M' greentint -9.2786 1.8071 -4.6947 {"}'M' greentint -9.2266 2.058 -4.6963 {"}'M' greentint -9.6823 1.3055 -5.3354 {"}'M' greentint -9.5253 1.4014 -5.158 {"}'M' greentint -9.3868 1.572 -5.0265 {"}'M' greentint -9.2839 1.7955 -4.9556 {"}'M' greentint -9.2295 2.0452 -4.9553 {"}'M' greentint -9.5437 1.5316 -5.4094 {"}'M' greentint -9.3939 1.6853 -5.2586 {"}'M' greentint -9.2986 1.9216 -5.2011 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 152 1x0cA_154F_179}P -12.4283 -2.2403 -0.0715 {"}-12.4283 -2.2403 -0.0715 { ca tyr A 152 1x0cA_154F_179}-11.2173 -2.282 -0.8813 { c tyr A 152 1x0cA_154F_179}-10.833 -0.8962 -1.3712 { o tyr A 152 1x0cA_154F_179}-11.6833 -0.0189 -1.5408 { c tyr A 152 1x0cA_154F_179}P -10.833 -0.8962 -1.3712 { n arg A 153 1x0cA_154F_179}-9.5388 -0.7149 -1.597 { ca arg A 153 1x0cA_154F_179}-8.9939 0.5366 -2.1068 { c arg A 153 1x0cA_154F_179}-7.987 0.098 -3.1665 { o arg A 153 1x0cA_154F_179}-6.9627 -0.5062 -2.8503 { c arg A 153 1x0cA_154F_179}P -7.987 0.098 -3.1665 { n phe A 154 1x0cA_154F_179}-8.2894 0.3817 -4.4289 { ca phe A 154 1x0cA_154F_179}-7.4112 -0.0419 -5.5089 { c phe A 154 1x0cA_154F_179}-7.2491 0.9598 -6.6421 { o phe A 154 1x0cA_154F_179}-8.0231 1.9059 -6.7745 { c phe A 154 1x0cA_154F_179}P -7.2491 0.9598 -6.6421 { n ser A 155 1x0cA_154F_179}-6.2225 0.7289 -7.4522 { ca ser A 155 1x0cA_154F_179}-5.8926 1.5879 -8.5833 { c ser A 155 1x0cA_154F_179}-6.1854 0.8782 -9.9014 { o ser 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-11.9187 2.1761 -8.6898 { cg2 ile A 179 1x0cA_154F_179}P -13.5858 1.6404 -6.8747 {"}P -13.5858 1.6404 -6.8747 {"}P -13.5858 1.6404 -6.8747 { cd1 ile A 179 1x0cA_154F_179}P -12.6701 3.3641 -9.2497 {"}P -12.6701 3.3641 -9.2497 {"}P -12.6701 3.3641 -9.2497 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 154 A}'S' blue -10.3026 0.0166 -6.8698 {"}'S' blue -10.4482 -0.1375 -7.0148 { CD1 PHE 154 A}'S' blue -10.5634 -0.2399 -7.0293 {"}'S' blue -10.4185 -0.0392 -7.1146 {"}'S' sky -10.5762 -0.0392 -7.3182 {"}'S' blue -10.2186 0.1251 -7.1711 {"}'S' blue -10.3729 0.1427 -7.3758 { CD2 PHE 154 A}'S' sky -10.9655 0.0739 -5.928 {"}'S' sky -10.7854 0.1 -6.1167 {"}'S' sky -10.6067 0.0836 -6.3096 {"}'S' blue -10.3973 0.0417 -6.4616 {"}'S' sky -10.5586 -0.0548 -6.6429 {"}'S' sky -10.7136 -0.1862 -6.806 { CE1 PHE 154 A}'S' sky -11.5895 0.2235 -8.1752 {"}'S' sky -11.7523 0.1609 -8.3681 {"}'S' sky -11.9109 0.0518 -8.5429 {"}'S' sky -10.6732 -0.0932 -7.2607 {"}'S' 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1.3371 -4.5384 {"}'M' greentint -10.0444 1.2004 -4.8493 {"}'M' greentint -10.0948 0.9457 -4.8447 {"}'M' greentint -9.6393 1.6901 -4.4621 {"}'M' greentint -9.7996 1.599 -4.645 {"}'M' greentint -9.941 1.4285 -4.7805 {"}'M' greentint -9.9476 1.2747 -5.0894 {"}'M' greentint -9.7015 1.6704 -4.881 {"}'M' greentint -9.8401 1.4957 -5.0117 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 179 A}'M' green -10.2024 0.7127 -4.5934 {"}'M' green -10.1315 0.8148 -4.8461 {"}'M' green -9.5575 1.7378 -4.3611 {"}'M' green -9.6131 1.8579 -4.9157 {"}'M' green -9.7663 1.5093 -5.1345 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 179 A}'M' greentint -10.0446 0.8229 -4.4199 {"}'M' greentint -9.8992 0.9846 -4.2769 {"}'M' greentint -9.7746 1.187 -4.1733 {"}'M' greentint -9.6781 1.4201 -4.1135 {"}'M' greentint -9.9717 0.9034 -4.6651 {"}'M' greentint -9.825 1.053 -4.5175 {"}'M' greentint -9.7013 1.2527 -4.4128 {"}'M' greentint -9.6095 1.4869 -4.3595 {"}'M' greentint -10.0132 0.9853 -5.0002 {"}'M' greentint -9.8562 1.0812 -4.8229 {"}'M' greentint -9.7177 1.2517 -4.6913 {"}'M' greentint -9.6148 1.4752 -4.6205 {"}'M' greentint -9.5603 1.725 -4.6202 {"}'M' greentint -9.8746 1.2114 -5.0742 {"}'M' greentint -9.7248 1.3651 -4.9234 {"}'M' greentint -9.6295 1.6014 -4.8659 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 518 1x1iA_642Y_520}P -7.169 5.754 -11.8137 {"}-7.169 5.754 -11.8137 { ca ile A 518 1x1iA_642Y_520}-8.5434 5.8945 -11.337 { c ile A 518 1x1iA_642Y_520}-8.5647 5.1022 -10.0385 { o ile A 518 1x1iA_642Y_520}-8.4261 3.8738 -10.0455 { c ile A 518 1x1iA_642Y_520}P -8.5647 5.1022 -10.0385 { n val A 519 1x1iA_642Y_520}-8.7108 5.8062 -8.9208 { ca val A 519 1x1iA_642Y_520}-8.7161 5.1517 -7.6217 { c val A 519 1x1iA_642Y_520}-10.1214 4.8525 -7.1261 { o val A 519 1x1iA_642Y_520}-10.9701 5.7395 -7.0344 { c val A 519 1x1iA_642Y_520}P -10.1214 4.8525 -7.1261 { n ala A 520 1x1iA_642Y_520}-10.3617 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-0.9121 { n gly A 641 1x1iA_642Y_520}-9.6259 -0.9388 -1.6718 { ca gly A 641 1x1iA_642Y_520}-8.9678 0.1718 -2.3228 { c gly A 641 1x1iA_642Y_520}-8.0806 -0.3423 -3.4349 { o gly A 641 1x1iA_642Y_520}-7.1984 -1.1718 -3.2017 { c gly A 641 1x1iA_642Y_520}P -8.0806 -0.3423 -3.4349 { n tyr A 642 1x1iA_642Y_520}-8.3306 0.1163 -4.6553 { ca tyr A 642 1x1iA_642Y_520}-7.5046 -0.3 -5.781 { c tyr A 642 1x1iA_642Y_520}-7.3624 0.8265 -6.7819 { o tyr A 642 1x1iA_642Y_520}-8.1652 1.7596 -6.8088 { c tyr A 642 1x1iA_642Y_520}P -7.3624 0.8265 -6.7819 { n val A 643 1x1iA_642Y_520}-6.3246 0.7347 -7.605 { ca val A 643 1x1iA_642Y_520}-6.0566 1.7552 -8.5995 { c val A 643 1x1iA_642Y_520}-6.0202 1.1333 -9.9816 { o val A 643 1x1iA_642Y_520}-5.2674 0.183 -10.2175 { c val A 643 1x1iA_642Y_520}P -6.0202 1.1333 -9.9816 { n leu A 644 1x1iA_642Y_520}-6.8563 1.6522 -10.8771 { ca leu A 644 1x1iA_642Y_520}-6.8871 1.1939 -12.257 { c leu A 644 1x1iA_642Y_520}-5.8024 1.9959 -12.9602 { o leu A 644 1x1iA_642Y_520}-5.7807 3.2315 -12.8827 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 518 1x1iA_642Y_520}P -7.169 5.754 -11.8137 { ca ile A 518 1x1iA_642Y_520}P -8.5434 5.8945 -11.337 { n val A 519 1x1iA_642Y_520}P -8.7108 5.8062 -8.9208 { ca val A 519 1x1iA_642Y_520}P -8.7161 5.1517 -7.6217 { n ala A 520 1x1iA_642Y_520}P -10.3617 3.5872 -6.8069 { ca ala A 520 1x1iA_642Y_520}P -11.663 3.1684 -6.3112 { n leu A 521 1x1iA_642Y_520}P -12.3706 3.4368 -4.0056 { ca leu A 521 1x1iA_642Y_520}P -12.3554 3.1764 -2.5719 { n gly A 522 1x1iA_642Y_520}P -13.727 1.812 -1.1396 { ca gly A 522 1x1iA_642Y_520}P -14.9746 1.3348 -0.5827 {"}P -14.9746 1.3348 -0.5827 { n tyr A 640 1x1iA_642Y_520}P -12.1815 -1.6138 0.7876 { ca tyr A 640 1x1iA_642Y_520}P -11.3007 -1.9973 -0.3083 { n gly A 641 1x1iA_642Y_520}P -9.6259 -0.9388 -1.6718 { ca gly A 641 1x1iA_642Y_520}P -8.9678 0.1718 -2.3228 {"}P -8.9678 0.1718 -2.3228 { n tyr A 642 1x1iA_642Y_520}P -8.3306 0.1163 -4.6553 { ca tyr A 642 1x1iA_642Y_520}P -7.5046 -0.3 -5.781 { n val A 643 1x1iA_642Y_520}P -6.3246 0.7347 -7.605 { ca val A 643 1x1iA_642Y_520}P -6.0566 1.7552 -8.5995 { n leu A 644 1x1iA_642Y_520}P -6.8563 1.6522 -10.8771 { ca leu A 644 1x1iA_642Y_520}P -6.8871 1.1939 -12.257 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 518 1x1iA_642Y_520}P -8.5434 5.8945 -11.337 {"}-8.5434 5.8945 -11.337 { ca val A 519 1x1iA_642Y_520}-8.7161 5.1517 -7.6217 { ca ala A 520 1x1iA_642Y_520}-11.663 3.1684 -6.3112 { ca leu A 521 1x1iA_642Y_520}-12.3554 3.1764 -2.5719 { ca gly A 522 1x1iA_642Y_520}-14.9746 1.3348 -0.5827 { ca tyr A 640 1x1iA_642Y_520}-11.3007 -1.9973 -0.3083 { ca gly A 641 1x1iA_642Y_520}-8.9678 0.1718 -2.3228 { ca tyr A 642 1x1iA_642Y_520}-7.5046 -0.3 -5.781 { ca val A 643 1x1iA_642Y_520}-6.0566 1.7552 -8.5995 { ca leu A 644 1x1iA_642Y_520}-6.8871 1.1939 -12.257 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ala A 520 1x1iA_642Y_520}P -11.663 3.1684 -6.3112 { cb ala A 520 1x1iA_642Y_520}-12.1576 1.9641 -7.107 { ca tyr A 642 1x1iA_642Y_520}P -7.5046 -0.3 -5.781 { cb tyr A 642 1x1iA_642Y_520}-8.0611 -1.5603 -6.4676 { cg tyr A 642 1x1iA_642Y_520}-9.4414 -1.4358 -7.0837 { cd1 tyr A 642 1x1iA_642Y_520}-10.5909 -1.6865 -6.33 { ce1 tyr A 642 1x1iA_642Y_520}-11.8635 -1.6077 -6.9083 { cz tyr A 642 1x1iA_642Y_520}-11.99 -1.273 -8.2511 { oh tyr A 642 1x1iA_642Y_520}-13.2394 -1.1794 -8.8199 { cg tyr A 642 1x1iA_642Y_520}P -9.4414 -1.4358 -7.0837 { cd2 tyr A 642 1x1iA_642Y_520}-9.5956 -1.101 -8.4305 { ce2 tyr A 642 1x1iA_642Y_520}-10.861 -1.0182 -9.0168 { cz tyr A 642 1x1iA_642Y_520}ghost -11.99 -1.273 -8.2511 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ala A 520 1x1iA_642Y_520}P -12.1576 1.9641 -7.107 {"}P -12.1576 1.9641 -7.107 {"}P -12.1576 1.9641 -7.107 { cb tyr A 642 1x1iA_642Y_520}P -8.0611 -1.5603 -6.4676 {"}P -8.0611 -1.5603 -6.4676 { cd1 tyr A 642 1x1iA_642Y_520}P -10.5909 -1.6865 -6.33 { cd2 tyr A 642 1x1iA_642Y_520}P -9.5956 -1.101 -8.4305 { ce1 tyr A 642 1x1iA_642Y_520}P -11.8635 -1.6077 -6.9083 { ce2 tyr A 642 1x1iA_642Y_520}P -10.861 -1.0182 -9.0168 { oh tyr A 642 1x1iA_642Y_520}P -13.2394 -1.1794 -8.8199 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 642 A}'S' blue -10.2402 0.0803 -6.729 {"}'S' blue -10.403 0.0176 -6.9218 {"}'S' sky -10.5616 -0.0914 -7.0967 {"}'S' blue -10.1387 0.1659 -6.9807 {"}'S' blue -10.2994 0.0875 -7.1653 {"}'S' blue -10.4545 -0.0312 -7.3332 { CD1 TYR 642 A}'S' blue -11.1279 -0.0486 -6.0297 {"}'S' sky -11.2883 -0.0848 -6.227 {"}'S' blue -10.8453 0.0267 -6.0759 {"}'S' blue -10.6582 0.0612 -6.257 {"}'S' blue -10.4792 0.0556 -6.4537 {"}'S' blue -10.4325 -0.0106 -6.8087 {"}'S' sky -10.5956 -0.0712 -7.0025 {"}'S' sky -10.7569 -0.1677 -7.1838 { CD2 TYR 642 A}'S' blue -10.6583 -0.0958 -7.4704 {"}'S' blue -10.3705 0.0384 -7.3521 {"}'S' sky -10.5134 0.1049 -7.5557 {"}'S' blue -10.3135 0.2692 -7.6122 {"}'S' blue -10.4677 0.2868 -7.8168 { CE1 TYR 642 A}'S' sky -12.2446 0.0247 -6.4039 {"}'S' sky -12.4005 0.0302 -6.608 {"}'S' sky -12.5609 -0.006 -6.8053 {"}'S' blue -12.7216 -0.0844 -6.9899 { CE2 TYR 642 A}'S' sky -10.9129 -0.0942 -7.5317 {"}'S' sky -11.4987 0.5129 -8.459 {"}'S' blue -11.6598 0.4979 -8.662 {"}'S' sky -11.0941 0.5644 -8.3073 {"}'S' blue -11.242 0.6142 -8.5123 {"}'S' sky -10.5804 0.3613 -7.9775 {"}'S' blue -10.693 0.499 -8.1612 { CZ TYR 642 A}'S' sky -12.8621 0.1149 -7.6375 {"}'S' sky -12.6873 0.3288 -8.1481 {"}'S' sky -12.5628 0.3745 -8.39 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 642 A}'S' sea -11.003 0.0135 -6.2765 {"}'S' green -11.1638 -0.039 -6.4689 {"}'S' sea -10.8197 0.0438 -6.4619 {"}'S' green -10.9836 -0.0129 -6.6576 {"}'S' sea -10.6414 0.0322 -6.6563 {"}'S' sea -10.805 -0.0293 -6.8505 { CE1 TYR 642 A}'S' sea -11.8236 0.0124 -6.2478 {"}'S' green -11.966 0.0783 -6.4506 {"}'S' green -12.1179 0.1055 -6.6542 {"}'S' green -12.2756 0.0924 -6.8547 {"}'S' sea -12.4364 0.0398 -7.0472 {"}'S' sea -11.493 -0.0421 -6.2192 {"}'S' green -11.6274 0.0563 -6.4202 {"}'S' green -12.0924 0.1226 -7.0401 {"}'S' green -11.308 -0.0239 -6.4148 {"}'S' green -11.0248 -0.072 -6.8968 {"}'S' green -11.1724 -0.0124 -7.1036 {"}'S' sea -10.9645 -0.138 -7.2146 { CE2 TYR 642 A}'S' green -10.9847 0.1058 -7.6806 {"}'S' green -11.0836 0.2715 -7.8553 {"}'S' green -11.2058 0.3977 -8.0478 {"}'S' sea -11.3457 0.4787 -8.2506 {"}'S' sea -10.7435 0.1812 -7.7475 {"}'S' sea -10.8411 0.3451 -7.9201 {"}'S' sea -10.9587 0.4742 -8.1085 { CZ TYR 642 A}'S' sea -12.5655 0.0269 -7.2309 {"}'S' sea -12.7078 0.0972 -7.4329 {"}'S' green -12.3348 0.143 -7.2822 {"}'S' green -12.4747 0.2239 -7.485 {"}'S' green -12.6277 0.2581 -7.6934 {"}'S' sea -12.7888 0.2432 -7.8964 {"}'S' green -12.0877 0.2194 -7.3429 {"}'S' green -12.5269 0.365 -7.9508 {"}'S' green -12.2443 0.4402 -7.997 {"}'S' sea -12.402 0.4271 -8.1976 {"}'S' green -11.9006 0.4518 -7.9707 {"}'S' green -12.0572 0.4748 -8.1781 {"}'S' sea -12.2188 0.4574 -8.383 {"}'S' green -11.207 0.0299 -7.3845 {"}'S' green -11.5723 0.4019 -7.96 {"}'S' green -11.7214 0.4549 -8.1674 {"}'S' sea -11.8783 0.4692 -8.3748 {"}'S' sea -10.9992 -0.02 -7.5367 {"}'S' green -11.1041 0.1378 -7.7162 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 642 A}'S' P -11.7742 0.1171 -6.6279 {"}'S' -11.7752 0.0987 -6.6303 {"}'S' P -11.9308 0.1401 -6.8352 {"}'S' -11.9296 0.1146 -6.8364 {"}'S' P -11.4459 0.0671 -6.6172 {"}'S' -11.4498 0.0494 -6.6202 {"}'S' P -11.595 0.1201 -6.8245 {"}'S' -11.6041 0.0558 -6.8275 {"}'S' P -11.7519 0.1345 -7.032 {"}'S' -11.7562 0.0735 -7.0275 {"}'S' P -11.2371 0.0202 -6.7689 {"}'S' -11.2393 0.0138 -6.7688 {"}'S' P -11.3857 0.074 -6.9758 {"}'S' -11.4005 0.023 -6.974 {"}'S' P -11.5434 0.0913 -7.1832 {"}'S' -11.5527 0.039 -7.1754 { CZ TYR 642 A}'S' P -12.2231 0.3096 -7.5417 {"}'S' -12.2206 0.2922 -7.5497 {"}'S' P -12.371 0.3594 -7.7467 {"}'S' -12.3704 0.3548 -7.7482 {"}'S' P -11.822 0.2442 -7.3956 {"}'S' -11.8274 0.1903 -7.4265 {"}'S' P -11.95 0.3472 -7.5906 {"}'S' -11.9512 0.3176 -7.6026 {"}'S' P -12.0924 0.4131 -7.7935 {"}'S' -12.091 0.3875 -7.7993 {"}'S' P -11.5007 0.159 -7.371 {"}'S' -11.5182 0.1082 -7.4022 {"}'S' P -11.6194 0.2926 -7.5621 {"}'S' -11.6344 0.2287 -7.5902 {"}'S' P -11.7538 0.391 -7.7631 {"}'S' -11.7574 0.3622 -7.7716 {"}'S' P -11.312 0.1862 -7.5637 {"}'S' -11.3233 0.1621 -7.5753 {"}'S' P -11.4344 0.3108 -7.7576 {"}'S' -11.443 0.2889 -7.7644 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 520 A}'S' blue -12.6174 0.3513 -6.6069 {"}'S' blue -12.4545 0.3881 -6.4063 {"}'S' sky -12.7795 0.3337 -7.2396 {"}'S' sky -12.6304 0.2807 -7.0323 {"}'S' sky -12.1477 0.3513 -6.428 {"}'S' sky -12.8391 0.5089 -7.8004 {"}'S' sky -12.6956 0.6064 -8.0707 {"}'S' sky -11.9907 0.7575 -8.3636 {"}'S' blue -11.7516 0.8593 -8.4018 {"}'S' sky -11.6416 0.7157 -8.2186 {"}'S' blue -11.5048 0.9562 -8.3805 {"}'S' sky -11.3868 0.8279 -8.1917 { HB3 ALA 520 A}'S' blue -11.325 0.3063 -6.1819 {"}'S' sky -11.0358 0.3366 -6.2481 {"}'S' sky -10.7844 0.3986 -6.3732 {"}'S' blue -10.6233 0.4155 -6.579 {"}'S' sky -10.807 0.1602 -7.1135 {"}'S' sky -10.6498 0.2785 -6.9427 {"}'S' blue -10.5107 0.4555 -6.8118 {"}'S' sky -11.1815 0.7072 -8.0561 {"}'S' sky -10.7303 0.2789 -7.3537 {"}'S' blue -10.5742 0.3743 -7.1791 {"}'S' sky -10.9367 0.7745 -7.9899 {"}'S' sky -10.7355 0.4633 -7.6438 {"}'S' blue -10.572 0.4919 -7.4405 {"}'S' blue -10.6106 0.6888 -7.6885 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 520 A}'S' sea -12.4727 0.2663 -6.8254 {"}'S' sea -12.3105 0.2897 -6.6228 {"}'S' sea -12.7173 0.3836 -7.6069 {"}'S' green -12.5798 0.2917 -7.4049 {"}'S' green -12.4312 0.2379 -7.198 {"}'S' green -12.2739 0.2216 -6.9896 {"}'S' green -12.5858 0.4573 -7.8866 {"}'S' green -12.459 0.3416 -7.6903 {"}'S' green -12.1646 0.2224 -7.2778 {"}'S' sea -12.4414 0.5895 -8.1517 {"}'S' green -12.3296 0.4502 -7.9689 {"}'S' sea -12.2259 0.673 -8.2864 {"}'S' green -12.1164 0.527 -8.1051 {"}'S' green -11.88 0.6096 -8.1802 {"}'S' green -11.7487 0.5043 -7.982 { HB3 ALA 520 A}'S' green -12.1612 0.2245 -6.8311 {"}'S' green -12.0139 0.1815 -6.6285 {"}'S' green -11.8566 0.1994 -6.4295 {"}'S' green -12.0814 0.1606 -7.1193 {"}'S' green -11.6327 0.0838 -6.5193 {"}'S' sea -11.4743 0.1704 -6.3379 {"}'S' green -11.3282 0.0598 -6.5504 {"}'S' sea -11.1753 0.1759 -6.3849 {"}'S' green -11.0686 0.0828 -6.652 {"}'S' sea -10.9185 0.2186 -6.4966 {"}'S' green -11.6718 0.5043 -7.9589 {"}'S' green -11.2225 0.0114 -7.2407 {"}'S' green -11.0643 0.0292 -7.0422 {"}'S' green -10.9066 0.1052 -6.8594 {"}'S' sea -10.7561 0.2366 -6.7009 {"}'S' sea -11.4291 0.5979 -8.0397 {"}'S' green -11.3646 0.389 -7.8971 {"}'S' green -11.2609 0.2303 -7.7192 {"}'S' green -11.126 0.1354 -7.5183 {"}'S' sea -10.9702 0.1112 -7.3101 {"}'S' green -11.1264 0.4959 -7.9274 {"}'S' green -11.0238 0.3431 -7.7524 {"}'S' sea -10.8866 0.2681 -7.5529 {"}'S' sea -10.8689 0.566 -7.8445 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB ALA 520 A}'S' P -12.3169 0.2632 -7.4851 {"}'S' -12.3169 0.2646 -7.4854 {"}'S' P -12.2012 0.3466 -7.7732 {"}'S' -12.2007 0.3692 -7.764 {"}'S' P -12.0601 0.2798 -7.5719 {"}'S' -12.0615 0.3057 -7.5644 {"}'S' P -11.9894 0.4183 -7.9102 {"}'S' -11.9906 0.4296 -7.9041 { HB3 ALA 520 A}'S' P -11.9441 0.0791 -6.9198 {"}'S' -11.9309 0.1071 -6.9219 {"}'S' P -11.7921 0.0534 -6.7165 {"}'S' -11.7813 0.0888 -6.7252 {"}'S' P -12.0292 0.26 -7.5114 {"}'S' -12.0173 0.2782 -7.5011 {"}'S' P -11.9204 0.1194 -7.3323 {"}'S' -11.9047 0.1535 -7.3204 {"}'S' P -11.7897 0.025 -7.1373 {"}'S' -11.7749 0.0718 -7.1312 {"}'S' P -11.6424 -0.0167 -6.935 {"}'S' -11.6311 0.0542 -6.9392 {"}'S' P -11.4869 -0.0047 -6.7371 {"}'S' -11.4851 0.0416 -6.7471 {"}'S' P -11.7911 0.2047 -7.6194 {"}'S' -11.7715 0.2566 -7.5857 {"}'S' P -11.6749 0.0729 -7.434 {"}'S' -11.6615 0.1382 -7.4067 {"}'S' P -11.5384 -0.0084 -7.2339 {"}'S' -11.5352 0.0334 -7.2254 {"}'S' P -11.386 -0.0334 -7.0302 {"}'S' -11.3888 0.0167 -7.0284 {"}'S' P -11.2266 -0.003 -6.833 {"}'S' -11.2287 0.0082 -6.835 {"}'S' P -11.6008 0.308 -7.8135 {"}'S' -11.5971 0.3308 -7.7914 {"}'S' P -11.4982 0.1552 -7.6384 {"}'S' -11.4954 0.2053 -7.605 {"}'S' P -11.3697 0.0544 -7.4433 {"}'S' -11.3719 0.0896 -7.4287 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 642 A}'M' greentint -9.4809 2.0443 -6.4249 {"}'M' greentint -9.2386 2.4399 -6.2217 {"}'M' greentint -9.3872 2.283 -6.3702 {"}'M' greentint -9.4909 2.1867 -6.6676 {"}'M' greentint -9.5475 1.9372 -6.6709 {"}'M' greentint -9.0894 2.6701 -6.2838 {"}'M' greentint -9.248 2.5769 -6.4622 {"}'M' greentint -9.3872 2.4089 -6.5954 {"}'M' greentint -9.4605 2.2807 -6.9124 {"}'M' greentint -9.5317 2.0356 -6.9366 {"}'M' greentint -8.9024 2.8592 -6.3517 {"}'M' greentint -9.0626 2.8009 -6.5437 {"}'M' greentint -9.2174 2.6779 -6.7083 {"}'M' greentint -9.3531 2.5003 -6.8345 {"}'M' greentint -9.3827 2.3609 -7.1507 {"}'M' greentint -9.4639 2.1177 -7.1891 {"}'M' greentint -8.8196 2.9792 -6.5958 {"}'M' greentint -8.9817 2.897 -6.7814 {"}'M' greentint -9.134 2.7611 -6.9414 {"}'M' greentint -9.2706 2.5795 -7.0662 {"}'M' greentint -9.2682 2.4056 -7.3804 {"}'M' greentint -9.3537 2.1708 -7.4249 {"}'M' greentint -8.7248 3.042 -6.8548 {"}'M' greentint -8.8806 2.9433 -7.0281 {"}'M' greentint -9.0268 2.7997 -7.178 {"}'M' greentint -9.1576 2.6177 -7.2964 {"}'M' greentint -8.8716 2.8234 -7.3831 {"}'M' greentint -9.0037 2.6405 -7.5031 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 520 A}'M' greentint -9.3509 2.1525 -6.2514 {"}'M' greentint -9.2303 2.3467 -6.1497 {"}'M' greentint -9.5365 1.8645 -6.8409 {"}'M' greentint -9.3783 1.9282 -6.6546 {"}'M' greentint -9.228 2.0526 -6.4947 {"}'M' greentint -9.0949 2.2282 -6.3716 {"}'M' greentint -8.9897 2.4428 -6.2939 {"}'M' greentint -8.9162 2.6826 -6.267 {"}'M' greentint -9.4859 1.9234 -7.1919 {"}'M' greentint -9.3277 1.9256 -6.9882 {"}'M' greentint -9.167 2.0016 -6.8013 {"}'M' greentint -9.0175 2.147 -6.6489 {"}'M' greentint -8.8929 2.3469 -6.5431 {"}'M' greentint -8.8043 2.5845 -6.495 {"}'M' greentint -8.7598 2.8393 -6.5077 {"}'M' greentint -9.234 2.0365 -7.2408 {"}'M' greentint -9.0717 2.0814 -7.0429 {"}'M' greentint -8.9174 2.214 -6.8812 {"}'M' greentint -8.7932 2.4173 -6.7766 {"}'M' greentint -8.7149 2.663 -6.7444 {"}'M' greentint -8.6939 2.9184 -6.7877 {"}'M' greentint -9.123 2.22 -7.4113 {"}'M' greentint -8.962 2.248 -7.2113 {"}'M' greentint -8.814 2.4 -7.0624 {"}'M' greentint -8.7191 2.6341 -7.0051 {"}'M' greentint -8.7029 2.8878 -7.0544 {"}'M' greentint -8.9895 2.4378 -7.4648 {"}'M' greentint -8.8295 2.5347 -7.2854 {"}'M' greentint -8.7746 2.788 -7.2852 {"}'M' greentint -8.9078 2.6844 -7.4846 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 642 A}'M' green -9.6633 1.0091 -4.1225 {"}'M' green -10.0542 0.7143 -4.7107 {"}'M' green -9.5023 1.2804 -4.1557 {"}'M' green -10.06 0.8108 -5.009 {"}'M' green -9.9128 1.1397 -5.2536 {"}'M' green -9.3487 1.6867 -4.676 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 642 A}'M' greentint -9.8492 0.9177 -4.2805 {"}'M' greentint -9.9825 0.8141 -4.4799 {"}'M' greentint -9.7675 1.1643 -4.3003 {"}'M' greentint -9.9275 1.0674 -4.4797 {"}'M' greentint -10.0379 0.968 -4.76 {"}'M' greentint -9.634 1.3821 -4.3538 {"}'M' greentint -9.795 1.3541 -4.5538 {"}'M' greentint -9.9431 1.2021 -4.7027 {"}'M' greentint -10.0096 1.0655 -5.0136 {"}'M' greentint -9.4456 1.552 -4.4205 {"}'M' greentint -9.6045 1.5552 -4.6264 {"}'M' greentint -9.7648 1.4641 -4.8092 {"}'M' greentint -9.9062 1.2936 -4.9448 {"}'M' greentint -9.5101 1.6475 -4.8738 {"}'M' greentint -9.6667 1.5355 -5.0452 {"}'M' greentint -9.8053 1.3608 -5.176 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 520 A}'M' green -10.1226 0.7566 -4.7643 {"}'M' green -9.5322 1.2866 -4.1501 {"}'M' green -9.367 1.5865 -4.3363 {"}'M' green -9.3871 1.701 -4.8427 {"}'M' green -9.6827 1.5116 -5.2889 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 520 A}'M' greentint -9.96 0.8123 -4.5702 {"}'M' greentint -9.8022 0.9225 -4.3967 {"}'M' greentint -9.6568 1.0842 -4.2537 {"}'M' greentint -10.0483 0.8919 -5.0234 {"}'M' greentint -9.8891 0.9144 -4.8229 {"}'M' greentint -9.7293 1.003 -4.6419 {"}'M' greentint -9.5826 1.1526 -4.4943 {"}'M' greentint -9.4589 1.3523 -4.3896 {"}'M' greentint -9.9296 1.0739 -5.1779 {"}'M' greentint -9.7708 1.0849 -4.977 {"}'M' greentint -9.6138 1.1808 -4.7996 {"}'M' greentint -9.4753 1.3513 -4.6681 {"}'M' greentint -9.3724 1.5748 -4.5973 {"}'M' greentint -9.7953 1.2817 -5.2537 {"}'M' greentint -9.6322 1.311 -5.051 {"}'M' greentint -9.4824 1.4647 -4.9002 {"}'M' greentint -9.5239 1.6089 -5.1112 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 730 1x1iA_758F_732}P -7.4239 5.4991 -12.0783 {"}-7.4239 5.4991 -12.0783 { ca ile A 730 1x1iA_758F_732}-8.6899 5.8436 -11.4537 { c ile A 730 1x1iA_758F_732}-8.5812 5.1318 -10.1089 { o ile A 730 1x1iA_758F_732}-8.352 3.9194 -10.0709 { c ile A 730 1x1iA_758F_732}P -8.5812 5.1318 -10.1089 { n ala A 731 1x1iA_758F_732}-8.7069 5.8746 -9.0114 { ca ala A 731 1x1iA_758F_732}-8.6251 5.2743 -7.6826 { c ala A 731 1x1iA_758F_732}-10.028 4.981 -7.1629 { o ala A 731 1x1iA_758F_732}-10.8565 5.8831 -7.0264 { c ala A 731 1x1iA_758F_732}P -10.028 4.981 -7.1629 { n ile A 732 1x1iA_758F_732}-10.2834 3.7116 -6.8719 { ca ile A 732 1x1iA_758F_732}-11.5858 3.2789 -6.3847 { c ile A 732 1x1iA_758F_732}-11.5195 2.7415 -4.9615 { o ile A 732 1x1iA_758F_732}-10.5467 2.0885 -4.5766 { c ile A 732 1x1iA_758F_732}P -11.5195 2.7415 -4.9615 { n glu A 733 1x1iA_758F_732}-12.556 3.0375 -4.1815 { ca glu A 733 1x1iA_758F_732}-12.6618 2.5188 -2.8269 { c glu A 733 1x1iA_758F_732}-14.0581 1.9239 -2.7063 { o glu A 733 1x1iA_758F_732}-15.0407 2.5607 -3.0838 { c glu A 733 1x1iA_758F_732}P -14.0581 1.9239 -2.7063 { n leu A 734 1x1iA_758F_732}-14.1397 0.6881 -2.2178 { ca leu A 734 1x1iA_758F_732}-15.4254 0.0182 -2.0432 { c leu A 734 1x1iA_758F_732}-15.6617 -0.2011 -0.5526 { o leu A 734 1x1iA_758F_732}-14.8136 -0.7582 0.1458 { n ile A 756 1x1iA_758F_732}P -12.1019 -1.7917 0.7917 {"}-12.1019 -1.7917 0.7917 { ca ile A 756 1x1iA_758F_732}-11.3455 -2.1569 -0.3981 { c ile A 756 1x1iA_758F_732}-10.848 -0.9239 -1.1428 { o ile A 756 1x1iA_758F_732}-11.6173 0.002 -1.3974 { c ile A 756 1x1iA_758F_732}P -10.848 -0.9239 -1.1428 { n lys A 757 1x1iA_758F_732}-9.5637 -0.9239 -1.4877 { ca lys A 757 1x1iA_758F_732}-8.9662 0.1826 -2.2273 { c lys A 757 1x1iA_758F_732}-8.0603 -0.356 -3.3253 { o lys A 757 1x1iA_758F_732}-7.2824 -1.2818 -3.1034 { c lys A 757 1x1iA_758F_732}P -8.0603 -0.356 -3.3253 { n phe A 758 1x1iA_758F_732}-8.1803 0.2175 -4.5157 { ca phe A 758 1x1iA_758F_732}-7.3479 -0.188 -5.6402 { c phe A 758 1x1iA_758F_732}-7.3213 0.9026 -6.7004 { o phe A 758 1x1iA_758F_732}-8.1758 1.7885 -6.7222 { c phe A 758 1x1iA_758F_732}P -7.3213 0.9026 -6.7004 { n thr A 759 1x1iA_758F_732}-6.3148 0.8544 -7.5643 { ca thr A 759 1x1iA_758F_732}-6.2201 1.8187 -8.6426 { c thr A 759 1x1iA_758F_732}-6.2839 1.0402 -9.9432 { o thr A 759 1x1iA_758F_732}-5.9036 -0.1269 -9.9961 { c thr A 759 1x1iA_758F_732}P -6.2839 1.0402 -9.9432 { n val A 760 1x1iA_758F_732}-6.79 1.6858 -10.9823 { ca val A 760 1x1iA_758F_732}-6.9144 1.0566 -12.2868 { c val A 760 1x1iA_758F_732}-6.0688 1.847 -13.275 { o val A 760 1x1iA_758F_732}-6.3233 3.0273 -13.4872 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 730 1x1iA_758F_732}P -7.4239 5.4991 -12.0783 { ca ile A 730 1x1iA_758F_732}P -8.6899 5.8436 -11.4537 { n ala A 731 1x1iA_758F_732}P -8.7069 5.8746 -9.0114 { ca ala A 731 1x1iA_758F_732}P -8.6251 5.2743 -7.6826 { n ile A 732 1x1iA_758F_732}P -10.2834 3.7116 -6.8719 { ca ile A 732 1x1iA_758F_732}P -11.5858 3.2789 -6.3847 { n glu A 733 1x1iA_758F_732}P -12.556 3.0375 -4.1815 { ca glu A 733 1x1iA_758F_732}P -12.6618 2.5188 -2.8269 { n leu A 734 1x1iA_758F_732}P -14.1397 0.6881 -2.2178 { ca leu A 734 1x1iA_758F_732}P -15.4254 0.0182 -2.0432 { n ile A 756 1x1iA_758F_732}P -12.1019 -1.7917 0.7917 { ca ile A 756 1x1iA_758F_732}P -11.3455 -2.1569 -0.3981 { n lys A 757 1x1iA_758F_732}P -9.5637 -0.9239 -1.4877 { ca lys A 757 1x1iA_758F_732}P -8.9662 0.1826 -2.2273 { n phe A 758 1x1iA_758F_732}P -8.1803 0.2175 -4.5157 { ca phe A 758 1x1iA_758F_732}P -7.3479 -0.188 -5.6402 { n thr A 759 1x1iA_758F_732}P -6.3148 0.8544 -7.5643 { ca thr A 759 1x1iA_758F_732}P -6.2201 1.8187 -8.6426 { n val A 760 1x1iA_758F_732}P -6.79 1.6858 -10.9823 { ca val A 760 1x1iA_758F_732}P -6.9144 1.0566 -12.2868 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 730 1x1iA_758F_732}P -8.6899 5.8436 -11.4537 {"}-8.6899 5.8436 -11.4537 { ca ala A 731 1x1iA_758F_732}-8.6251 5.2743 -7.6826 { ca ile A 732 1x1iA_758F_732}-11.5858 3.2789 -6.3847 { ca glu A 733 1x1iA_758F_732}-12.6618 2.5188 -2.8269 { ca leu A 734 1x1iA_758F_732}-15.4254 0.0182 -2.0432 { ca ile A 756 1x1iA_758F_732}-11.3455 -2.1569 -0.3981 { ca lys A 757 1x1iA_758F_732}-8.9662 0.1826 -2.2273 { ca phe A 758 1x1iA_758F_732}-7.3479 -0.188 -5.6402 { ca thr A 759 1x1iA_758F_732}-6.2201 1.8187 -8.6426 { ca val A 760 1x1iA_758F_732}-6.9144 1.0566 -12.2868 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ile A 732 1x1iA_758F_732}P -11.5858 3.2789 -6.3847 { cb ile A 732 1x1iA_758F_732}-12.1557 2.1478 -7.2814 { cg1 ile A 732 1x1iA_758F_732}-12.3159 2.6479 -8.7184 { cd1 ile A 732 1x1iA_758F_732}-13.3901 3.717 -8.8943 { cb ile A 732 1x1iA_758F_732}P -12.1557 2.1478 -7.2814 { cg2 ile A 732 1x1iA_758F_732}-13.4825 1.6473 -6.7232 { ca phe A 758 1x1iA_758F_732}P -7.3479 -0.188 -5.6402 { cb phe A 758 1x1iA_758F_732}-7.8526 -1.5076 -6.2595 { cg phe A 758 1x1iA_758F_732}-9.246 -1.4355 -6.8424 { cd1 phe A 758 1x1iA_758F_732}-10.3641 -1.6851 -6.0511 { ce1 phe A 758 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1.4051 -5.1695 {"}'M' greentint -9.3283 1.5588 -5.0186 {"}'M' greentint -9.233 1.7951 -4.9611 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 227 1x54A_402F_229}P -7.0786 5.7424 -12.1437 {"}-7.0786 5.7424 -12.1437 { ca leu A 227 1x54A_402F_229}-8.5017 5.6981 -11.7461 { c leu A 227 1x54A_402F_229}-8.5641 4.8581 -10.481 { o leu A 227 1x54A_402F_229}-8.1888 3.6766 -10.4929 { c leu A 227 1x54A_402F_229}P -8.5641 4.8581 -10.481 { n glu A 228 1x54A_402F_229}-8.9632 5.4837 -9.3749 { ca glu A 228 1x54A_402F_229}-8.8824 4.8166 -8.0835 { c glu A 228 1x54A_402F_229}-10.2275 4.8141 -7.3992 { o glu A 228 1x54A_402F_229}-10.9379 5.8084 -7.4384 { c glu A 228 1x54A_402F_229}P -10.2275 4.8141 -7.3992 { n leu A 229 1x54A_402F_229}-10.5517 3.6931 -6.7627 { ca leu A 229 1x54A_402F_229}-11.8047 3.5173 -6.0137 { c leu A 229 1x54A_402F_229}-11.4633 3.0865 -4.5977 { o leu A 229 1x54A_402F_229}-10.488 2.339 -4.3808 { c leu A 229 1x54A_402F_229}P -11.4633 3.0865 -4.5977 { n glu A 230 1x54A_402F_229}-12.2913 3.5066 -3.6431 { ca glu A 230 1x54A_402F_229}-12.1533 3.0326 -2.2544 { c glu A 230 1x54A_402F_229}-13.5515 2.9227 -1.6659 { o glu A 230 1x54A_402F_229}-14.3988 3.7783 -1.9273 { c glu A 230 1x54A_402F_229}P -13.5515 2.9227 -1.6659 { n ala A 231 1x54A_402F_229}-13.7858 1.8737 -0.8786 { ca ala A 231 1x54A_402F_229}-15.1427 1.6378 -0.3416 { c ala A 231 1x54A_402F_229}-15.1189 1.1345 1.084 { o ala A 231 1x54A_402F_229}-14.4697 0.1306 1.3871 { n ser A 400 1x54A_402F_229}P -11.6 -1.4436 1.4614 {"}-11.6 -1.4436 1.4614 { ca ser A 400 1x54A_402F_229}-10.7254 -1.9418 0.4055 { c ser A 400 1x54A_402F_229}-10.7986 -0.967 -0.7612 { o ser A 400 1x54A_402F_229}-11.7287 -0.169 -0.8749 { c ser A 400 1x54A_402F_229}P -10.7986 -0.967 -0.7612 { n gly A 401 1x54A_402F_229}-9.8118 -1.0455 -1.64 { ca gly A 401 1x54A_402F_229}-9.8184 -0.2049 -2.8321 { c gly A 401 1x54A_402F_229}-8.7572 -0.6787 -3.818 { o gly A 401 1x54A_402F_229}-8.0992 -1.6983 -3.612 { c gly A 401 1x54A_402F_229}P -8.7572 -0.6787 -3.818 { n phe A 402 1x54A_402F_229}-8.5985 0.0727 -4.9004 { ca phe A 402 1x54A_402F_229}-7.6992 -0.2988 -5.972 { c phe A 402 1x54A_402F_229}-7.4288 0.8782 -6.8879 { o phe A 402 1x54A_402F_229}-8.1667 1.8794 -6.8877 { c phe A 402 1x54A_402F_229}P -7.4288 0.8782 -6.8879 { n gly A 403 1x54A_402F_229}-6.3783 0.7342 -7.6886 { ca gly A 403 1x54A_402F_229}-6.0385 1.7193 -8.7067 { c gly A 403 1x54A_402F_229}-5.8286 1.0356 -10.0427 { o gly A 403 1x54A_402F_229}-5.1402 0.0097 -10.1168 { c gly A 403 1x54A_402F_229}P -5.8286 1.0356 -10.0427 { n leu A 404 1x54A_402F_229}-6.4312 1.6168 -11.0758 { ca leu A 404 1x54A_402F_229}-6.2924 1.2002 -12.4607 { c leu A 404 1x54A_402F_229}-5.3999 2.1921 -13.2324 { o leu A 404 1x54A_402F_229}-5.6122 3.4131 -13.1843 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 227 1x54A_402F_229}P -7.0786 5.7424 -12.1437 { ca leu A 227 1x54A_402F_229}P -8.5017 5.6981 -11.7461 { n glu A 228 1x54A_402F_229}P -8.9632 5.4837 -9.3749 { ca glu A 228 1x54A_402F_229}P -8.8824 4.8166 -8.0835 { n leu A 229 1x54A_402F_229}P -10.5517 3.6931 -6.7627 { ca leu A 229 1x54A_402F_229}P -11.8047 3.5173 -6.0137 { n glu A 230 1x54A_402F_229}P -12.2913 3.5066 -3.6431 { ca glu A 230 1x54A_402F_229}P -12.1533 3.0326 -2.2544 { n ala A 231 1x54A_402F_229}P -13.7858 1.8737 -0.8786 { ca ala A 231 1x54A_402F_229}P -15.1427 1.6378 -0.3416 { n ser A 400 1x54A_402F_229}P -11.6 -1.4436 1.4614 { ca ser A 400 1x54A_402F_229}P -10.7254 -1.9418 0.4055 { n gly A 401 1x54A_402F_229}P -9.8118 -1.0455 -1.64 { ca gly A 401 1x54A_402F_229}P -9.8184 -0.2049 -2.8321 {"}P -9.8184 -0.2049 -2.8321 { n phe A 402 1x54A_402F_229}P -8.5985 0.0727 -4.9004 { ca phe A 402 1x54A_402F_229}P -7.6992 -0.2988 -5.972 { n gly A 403 1x54A_402F_229}P -6.3783 0.7342 -7.6886 { ca gly A 403 1x54A_402F_229}P -6.0385 1.7193 -8.7067 {"}P -6.0385 1.7193 -8.7067 { n leu A 404 1x54A_402F_229}P -6.4312 1.6168 -11.0758 { ca leu A 404 1x54A_402F_229}P -6.2924 1.2002 -12.4607 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 227 1x54A_402F_229}P -8.5017 5.6981 -11.7461 {"}-8.5017 5.6981 -11.7461 { ca glu A 228 1x54A_402F_229}-8.8824 4.8166 -8.0835 { ca leu A 229 1x54A_402F_229}-11.8047 3.5173 -6.0137 { ca glu A 230 1x54A_402F_229}-12.1533 3.0326 -2.2544 { ca ala A 231 1x54A_402F_229}-15.1427 1.6378 -0.3416 { ca ser A 400 1x54A_402F_229}P -10.7254 -1.9418 0.4055 {"}-10.7254 -1.9418 0.4055 { ca gly A 401 1x54A_402F_229}-9.8184 -0.2049 -2.8321 { ca phe A 402 1x54A_402F_229}-7.6992 -0.2988 -5.972 { ca gly A 403 1x54A_402F_229}-6.0385 1.7193 -8.7067 { ca leu A 404 1x54A_402F_229}-6.2924 1.2002 -12.4607 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca leu A 229 1x54A_402F_229}P -11.8047 3.5173 -6.0137 { cb leu A 229 1x54A_402F_229}-12.6737 2.4151 -6.6388 { cg leu A 229 1x54A_402F_229}-13.5527 2.7769 -7.8391 { cd1 leu A 229 1x54A_402F_229}-12.7591 3.1641 -9.095 { cg leu A 229 1x54A_402F_229}P -13.5527 2.7769 -7.8391 { cd2 leu A 229 1x54A_402F_229}-14.5152 1.6042 -8.1316 { ca phe A 402 1x54A_402F_229}P -7.6992 -0.2988 -5.972 { cb phe A 402 1x54A_402F_229}-8.2557 -1.4583 -6.8115 { cg phe A 402 1x54A_402F_229}-9.481 -1.12 -7.6133 { cd1 phe A 402 1x54A_402F_229}-9.3651 -0.6641 -8.9328 { ce1 phe A 402 1x54A_402F_229}-10.5011 -0.3902 -9.685 { cz phe A 402 1x54A_402F_229}-11.7715 -0.5822 -9.127 { cg phe A 402 1x54A_402F_229}P -9.481 -1.12 -7.6133 { cd2 phe A 402 1x54A_402F_229}-10.7523 -1.3065 -7.0645 { ce2 phe A 402 1x54A_402F_229}-11.9025 -1.0494 -7.8084 { cz phe A 402 1x54A_402F_229}ghost -11.7715 -0.5822 -9.127 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb leu A 229 1x54A_402F_229}P -12.6737 2.4151 -6.6388 {"}P -12.6737 2.4151 -6.6388 { cg leu A 229 1x54A_402F_229}P -13.5527 2.7769 -7.8391 { cd1 leu A 229 1x54A_402F_229}P -12.7591 3.1641 -9.095 {"}P -12.7591 3.1641 -9.095 {"}P -12.7591 3.1641 -9.095 { cd2 leu A 229 1x54A_402F_229}P -14.5152 1.6042 -8.1316 {"}P -14.5152 1.6042 -8.1316 {"}P -14.5152 1.6042 -8.1316 { cb phe A 402 1x54A_402F_229}P -8.2557 -1.4583 -6.8115 {"}P -8.2557 -1.4583 -6.8115 { cd1 phe A 402 1x54A_402F_229}P -9.3651 -0.6641 -8.9328 { cd2 phe A 402 1x54A_402F_229}P -10.7523 -1.3065 -7.0645 { ce1 phe A 402 1x54A_402F_229}P -10.5011 -0.3902 -9.685 { ce2 phe A 402 1x54A_402F_229}P -11.9025 -1.0494 -7.8084 { cz phe A 402 1x54A_402F_229}P -11.7715 -0.5822 -9.127 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 402 A}'S' blue -11.39 0.2246 -6.5067 {"}'S' blue -11.1333 0.3259 -6.5601 {"}'S' sky -11.2892 0.3315 -6.7642 {"}'S' blue -11.0066 0.4067 -6.8104 {"}'S' sky -11.1643 0.3936 -7.0109 {"}'S' blue -10.9811 0.4238 -7.1963 { CE1 PHE 402 A}'S' blue -11.1389 1.1409 -9.1273 {"}'S' sky -11.2999 1.1259 -9.3303 {"}'S' blue -11.038 1.2477 -9.3847 {"}'S' sky -11.1984 1.2115 -9.582 {"}'S' sky -11.3591 1.1331 -9.7666 {"}'S' blue -11.5143 1.0145 -9.9345 {"}'S' blue -10.9131 1.3099 -9.6315 {"}'S' blue -11.074 1.2573 -9.8239 {"}'S' blue -11.2312 1.1676 -10.003 { CE2 PHE 402 A}'S' sky -12.5999 0.5523 -7.7054 { CZ PHE 402 A}'S' sky -12.3471 0.7176 -8.1068 {"}'S' sky -12.1164 0.8338 -8.1581 {"}'S' sky -11.8692 0.9102 -8.2188 {"}'S' sky -12.1526 1.0502 -8.6226 {"}'S' sky -12.6296 0.9411 -9.2086 {"}'S' sky -11.3976 0.6283 -7.92 {"}'S' sky -11.4909 0.7973 -8.0878 {"}'S' blue -11.6036 0.935 -8.2715 {"}'S' sky -11.874 1.1039 -8.6694 {"}'S' blue -12.4808 0.868 -9.8021 {"}'S' sky -11.2937 1.0995 -9.1945 {"}'S' sky -11.9375 0.9366 -9.9808 { HE2 PHE 402 A}'S' sky -13.6348 -0.6003 -7.6623 { HZ PHE 402 A}'S' sky -13.5822 -0.3013 -9.3196 {"}'S' sky -13.3645 0.3487 -9.6489 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 402 A}'S' sea -13.5368 -0.4336 -7.6946 {"}'S' green -13.292 -0.0349 -7.4903 {"}'S' green -13.4285 -0.2137 -7.6156 {"}'S' green -13.4913 -0.328 -7.9367 {"}'S' sea -13.5761 -0.5668 -7.9794 {"}'S' sea -12.6204 0.3208 -6.9902 {"}'S' green -13.0945 0.21 -7.5736 {"}'S' green -13.5091 -0.4994 -8.2296 {"}'S' sea -12.1252 0.2402 -6.647 {"}'S' green -12.2474 0.3665 -6.8395 {"}'S' green -12.3873 0.4475 -7.0423 {"}'S' green -12.5403 0.4817 -7.2507 {"}'S' sea -12.7013 0.4667 -7.4537 {"}'S' green -12.8641 0.4041 -7.6466 {"}'S' green -13.4013 -0.43 -8.4672 {"}'S' green -11.8827 0.3139 -6.7118 {"}'S' green -12.4395 0.5885 -7.5081 {"}'S' green -12.7606 0.4739 -7.89 {"}'S' sea -11.6219 0.33 -6.7692 {"}'S' green -12.3146 0.6507 -7.7549 {"}'S' sea -11.4133 0.3825 -6.9283 {"}'S' green -11.532 0.5162 -7.1194 {"}'S' green -11.9698 0.6984 -7.7354 {"}'S' sea -12.1314 0.6809 -7.9403 {"}'S' green -11.3469 0.5344 -7.3149 {"}'S' green -11.4849 0.6254 -7.5173 {"}'S' green -11.6339 0.6784 -7.7247 { CZ PHE 402 A}'S' green -13.4681 -0.3405 -8.7737 {"}'S' green -13.4795 -0.2106 -9.041 {"}'S' green -12.6892 0.6238 -8.2523 {"}'S' green -12.8049 0.7679 -8.7116 {"}'S' sea -11.9942 0.7074 -7.9656 {"}'S' green -13.0411 0.6107 -9.2906 {"}'S' sea -11.7517 0.7811 -8.0304 {"}'S' sea -12.3085 1.0558 -8.8267 {"}'S' sea -12.4689 1.0196 -9.024 {"}'S' green -12.0259 1.131 -8.8729 {"}'S' green -12.1836 1.1179 -9.0735 {"}'S' green -12.3444 1.0653 -9.2659 {"}'S' sea -12.5017 0.9756 -9.445 {"}'S' sea -11.6821 1.1426 -8.8466 {"}'S' green -11.8388 1.1656 -9.054 {"}'S' green -12.0003 1.1481 -9.2589 {"}'S' green -12.1642 1.0915 -9.4546 {"}'S' sea -12.3254 0.9977 -9.6363 {"}'S' sea -11.5029 1.1457 -9.0433 {"}'S' green -11.6598 1.16 -9.2507 {"}'S' green -11.822 1.1365 -9.4533 {"}'S' green -11.9856 1.0751 -9.6475 {"}'S' sea -12.1464 0.9766 -9.8278 {"}'S' sea -11.4513 1.1168 -9.4019 {"}'S' sea -11.6131 1.0938 -9.6057 {"}'S' sea -11.7762 1.0331 -9.7995 { HZ PHE 402 A}'S' green -13.5272 -0.048 -9.3194 {"}'S' green -13.3947 0.2387 -9.3935 {"}'S' sea -13.5428 0.0867 -9.5424 {"}'S' sea -13.2042 0.4398 -9.4661 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 402 A}'S' P -13.2451 0.0706 -7.7289 {"}'S' -13.2285 0.0555 -7.73 {"}'S' P -13.3793 -0.1122 -7.8517 {"}'S' -13.3517 -0.1294 -7.851 {"}'S' P -13.4192 -0.2608 -8.18 {"}'S' -13.3906 -0.2755 -8.1733 {"}'S' P -13.0228 0.295 -7.8214 {"}'S' -13.0106 0.2795 -7.8218 {"}'S' P -13.1721 0.1435 -7.9721 {"}'S' -13.1168 0.0921 -7.9651 {"}'S' P -13.3055 -0.0432 -8.093 {"}'S' -13.2406 -0.0903 -8.0807 {"}'S' P -12.0003 0.443 -6.9002 {"}'S' -12.0006 0.4364 -6.9042 {"}'S' P -12.1357 0.5332 -7.099 {"}'S' -12.1296 0.4928 -7.1175 {"}'S' P -12.2836 0.583 -7.304 {"}'S' -12.2769 0.5546 -7.3124 {"}'S' P -12.9157 0.3553 -8.0579 {"}'S' -12.8992 0.3339 -8.0543 {"}'S' P -13.0613 0.2011 -8.2029 {"}'S' -13.0104 0.1467 -8.1859 {"}'S' P -11.7346 0.4678 -6.9529 {"}'S' -11.7344 0.4638 -6.9551 {"}'S' P -11.8626 0.5708 -7.1479 {"}'S' -11.864 0.5176 -7.1702 {"}'S' P -12.005 0.6366 -7.3508 {"}'S' -12.0009 0.5745 -7.3668 {"}'S' P -12.1569 0.6638 -7.5543 {"}'S' -12.1541 0.6409 -7.5572 {"}'S' P -11.6664 0.6146 -7.3204 {"}'S' -11.6704 0.5835 -7.3291 {"}'S' P -11.8132 0.6754 -7.528 {"}'S' -11.8151 0.6444 -7.5321 { CZ PHE 402 A}'S' P -13.3795 -0.2344 -8.5299 {"}'S' -13.3461 -0.2413 -8.5424 {"}'S' P -13.132 0.169 -8.3229 {"}'S' -13.0508 0.1238 -8.3708 {"}'S' P -13.284 0.0089 -8.4737 {"}'S' -13.1909 -0.0281 -8.514 {"}'S' P -13.4105 -0.0838 -8.7706 {"}'S' -13.3432 -0.1037 -8.7852 {"}'S' P -12.8341 0.423 -8.167 {"}'S' -12.8283 0.4167 -8.173 {"}'S' P -12.9971 0.4153 -8.3742 {"}'S' -12.9295 0.3607 -8.4164 {"}'S' P -13.1604 0.319 -8.5584 {"}'S' -13.0466 0.2458 -8.6048 {"}'S' P -13.3036 0.1453 -8.6956 {"}'S' -13.1868 0.0897 -8.7285 {"}'S' P -13.4058 0.0336 -9.0132 {"}'S' -13.3594 0.0167 -9.016 {"}'S' P -12.8469 0.6237 -8.4558 {"}'S' -12.8232 0.598 -8.4705 {"}'S' P -13.0077 0.5595 -8.6455 {"}'S' -12.9401 0.4964 -8.672 {"}'S' P -13.1609 0.4323 -8.8088 {"}'S' -13.0669 0.3629 -8.8302 {"}'S' P -13.2975 0.2535 -8.9342 {"}'S' -13.2079 0.2041 -8.9456 {"}'S' P -12.9635 0.6772 -8.8922 {"}'S' -12.9419 0.6534 -8.8966 {"}'S' P -13.1141 0.5378 -9.0474 {"}'S' -13.0799 0.5092 -9.0489 {"}'S' P -13.2483 0.3551 -9.1703 {"}'S' -13.2255 0.3408 -9.1701 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LEU 229 A}'S' blue -12.8331 0.7142 -7.017 {"}'S' blue -12.8457 0.9012 -7.5007 { CD2 LEU 229 A}'S' blue -13.0602 1.1572 -8.9955 { HB2 LEU 229 A}'S' blue -12.2684 1.1932 -8.0121 {"}'S' sky -12.2339 0.9656 -7.9045 {"}'S' blue -11.3182 0.6979 -6.6465 {"}'S' sky -11.9911 1.0593 -7.9854 {"}'S' blue -11.2118 0.7399 -6.8884 {"}'S' sky -11.7436 1.1685 -8.0017 {"}'S' blue -11.1363 0.8356 -7.1248 {"}'S' blue -11.431 1.0274 -7.7901 {HD13 LEU 229 A}'S' sky -12.6205 1.2654 -9.3198 {"}'S' sky -12.1507 1.3566 -8.7378 {"}'S' sky -12.3513 1.2592 -9.834 {"}'S' sky -11.5949 1.4049 -8.8966 {"}'S' sky -11.4325 1.4229 -9.1009 {"}'S' sky -11.8024 1.3217 -9.9183 {"}'S' sky -11.3262 1.4648 -9.3427 {"}'S' blue -11.563 1.4544 -9.9529 {"}'S' sky -11.4067 1.4652 -9.7537 {"}'S' sky -11.2506 1.5606 -9.5791 {HD22 LEU 229 A}'S' sky -13.8526 -0.047 -9.2569 {"}'S' sky -13.4084 0.5964 -9.3998 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 LEU 229 A}'S' sea -12.6435 0.6219 -7.0649 {"}'S' sea -12.5062 0.5404 -6.8654 {"}'S' sea -12.3542 0.5147 -6.6621 {"}'S' sea -12.5913 0.7214 -7.4571 {"}'S' green -12.4825 0.5807 -7.278 {"}'S' green -12.3518 0.4863 -7.0829 {"}'S' green -12.2045 0.4446 -6.8806 {"}'S' green -12.0489 0.4566 -6.6828 {"}'S' sea -12.4408 0.8421 -7.7285 {"}'S' green -12.3532 0.666 -7.5651 {"}'S' green -11.7887 0.4584 -6.7786 {"}'S' green -12.1628 0.7693 -7.7591 {"}'S' green -11.6264 0.4905 -6.9879 {"}'S' sea -11.4686 0.5665 -6.805 {"}'S' sea -11.9267 0.8503 -7.8427 {"}'S' green -11.5323 0.5725 -7.2557 {"}'S' sea -11.3691 0.6215 -7.0591 {"}'S' sea -11.6885 0.9572 -7.8731 {"}'S' green -11.5859 0.8045 -7.698 {"}'S' green -11.4487 0.7294 -7.4985 {"}'S' sea -11.2924 0.7402 -7.2993 {HD13 LEU 229 A}'S' sea -12.4685 1.2396 -9.1165 {"}'S' sea -12.3091 1.2701 -8.9193 {"}'S' sea -12.4661 1.2113 -9.5373 {"}'S' green -12.3188 1.1696 -9.335 {"}'S' green -12.1632 1.1816 -9.1371 {"}'S' green -12.0046 1.2461 -8.9504 {"}'S' sea -11.8517 1.3621 -8.7849 {"}'S' green -12.2148 1.1778 -9.6339 {"}'S' green -12.0624 1.1529 -9.4302 {"}'S' green -11.903 1.1833 -9.233 {"}'S' green -11.745 1.2691 -9.052 {"}'S' sea -12.0461 1.2407 -9.8433 {"}'S' green -11.8989 1.1977 -9.6407 {"}'S' green -11.7407 1.2154 -9.4422 {"}'S' green -11.583 1.2915 -9.2594 {"}'S' sea -11.6466 1.2975 -9.7101 {"}'S' sea -11.4834 1.3464 -9.5135 {HD22 LEU 229 A}'S' sea -13.6633 -0.2601 -7.7448 {"}'S' green -13.5238 -0.0994 -7.6079 {"}'S' sea -13.4024 0.0975 -7.5073 {"}'S' green -13.5567 -0.3532 -8.0118 {"}'S' green -13.1622 0.1766 -7.65 {"}'S' green -13.0803 0.4158 -7.6097 {"}'S' green -13.5523 -0.4068 -8.4021 {"}'S' green -12.9255 0.4346 -7.8263 {"}'S' green -13.4583 -0.3248 -8.6699 {"}'S' green -12.8183 0.4912 -8.0703 {"}'S' sea -13.6695 0.2712 -9.4159 {"}'S' green -13.6144 0.0599 -9.2873 {"}'S' green -13.5119 -0.0928 -9.1122 {"}'S' green -13.4248 0.3385 -9.3497 {"}'S' green -12.9882 0.7619 -9.0461 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 LEU 229 A}'S' P -12.237 0.5342 -7.3796 {"}'S' -12.2299 0.5683 -7.3657 {"}'S' P -12.1005 0.4529 -7.1795 {"}'S' -12.096 0.5066 -7.1686 {"}'S' P -11.9481 0.4279 -6.9758 {"}'S' -11.9492 0.4547 -6.975 {"}'S' P -12.0603 0.6165 -7.584 {"}'S' -12.0594 0.6421 -7.5665 {"}'S' P -11.9318 0.5157 -7.3889 {"}'S' -11.9354 0.5758 -7.3648 {"}'S' P -11.7845 0.4727 -7.1863 {"}'S' -11.7937 0.5217 -7.1759 {"}'S' P -11.823 0.6916 -7.6648 {"}'S' -11.8225 0.6924 -7.6644 {"}'S' P -11.6881 0.5968 -7.4639 {"}'S' -11.6948 0.6203 -7.4511 {HD22 LEU 229 A}'S' P -13.4066 -0.2174 -7.8565 {"}'S' -13.4137 -0.2053 -7.8621 {"}'S' P -13.2725 -0.0374 -7.7331 {"}'S' -13.2854 -0.0235 -7.7453 {"}'S' P -13.3946 -0.3308 -8.2192 {"}'S' -13.4043 -0.3115 -8.2214 {"}'S' P -13.2442 -0.1994 -8.0607 {"}'S' -13.2861 -0.1455 -8.0791 {"}'S' P -13.1114 -0.0204 -7.9388 {"}'S' -13.1668 0.0276 -7.9675 {"}'S' P -13.0028 0.1946 -7.8583 {"}'S' -13.0377 0.2135 -7.8779 {"}'S' P -13.295 -0.2758 -8.4733 {"}'S' -13.3121 -0.2489 -8.4703 {"}'S' P -13.1378 -0.1574 -8.3026 {"}'S' -13.1876 -0.1034 -8.306 {"}'S' P -12.9988 0.0195 -8.1717 {"}'S' -13.0685 0.0705 -8.1864 {"}'S' P -12.8887 0.2421 -8.0926 {"}'S' -12.9341 0.2614 -8.1044 {"}'S' P -13.3747 -0.1679 -8.9128 {"}'S' -13.3937 -0.1379 -8.8943 {"}'S' P -13.2184 -0.1571 -8.7135 {"}'S' -13.2756 -0.089 -8.6859 {"}'S' P -13.0622 -0.0617 -8.539 {"}'S' -13.1512 0.0155 -8.521 {"}'S' P -12.9251 0.1065 -8.4087 {"}'S' -13.0228 0.1636 -8.4032 {"}'S' P -12.8235 0.3276 -8.3391 {"}'S' -12.8951 0.3519 -8.3399 {"}'S' P -12.7695 0.5755 -8.3373 {"}'S' -12.7846 0.5766 -8.3377 {"}'S' P -13.357 0.1301 -9.2043 {"}'S' -13.3593 0.1322 -9.2011 {"}'S' P -13.2236 0.0273 -9.0037 {"}'S' -13.2757 0.0752 -8.9559 {"}'S' P -13.06 0.0559 -8.8003 {"}'S' -13.163 0.1314 -8.7481 {"}'S' P -12.9094 0.2098 -8.6484 {"}'S' -13.0342 0.2689 -8.6137 {"}'S' P -12.8137 0.4469 -8.5905 {"}'S' -12.9041 0.4674 -8.5718 {"}'S' P -12.7973 0.7048 -8.6406 {"}'S' -12.8135 0.7045 -8.6371 {"}'S' P -13.2036 0.4092 -9.2276 {"}'S' -13.2056 0.4104 -9.2254 {"}'S' P -13.0986 0.2528 -9.0484 {"}'S' -13.1629 0.287 -8.9954 {"}'S' P -12.9382 0.3505 -8.8685 {"}'S' -13.0377 0.3853 -8.8176 {"}'S' P -12.8832 0.6055 -8.8669 {"}'S' -12.9291 0.6095 -8.8452 {"}'S' P -13.0205 0.5022 -9.0651 {"}'S' -13.0572 0.5101 -9.0368 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 402 A}'M' green -9.3388 2.2718 -6.2313 {"}'M' green -9.2696 2.5254 -7.4592 {"}'M' green -9.0282 2.9195 -7.2569 {"}'M' green -9.159 2.7375 -7.3753 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 402 A}'M' greentint -9.4824 2.1641 -6.5038 {"}'M' greentint -9.2401 2.5597 -6.3006 {"}'M' greentint -9.3887 2.4028 -6.449 {"}'M' greentint -9.4924 2.3064 -6.7465 {"}'M' greentint -9.5489 2.0569 -6.7498 {"}'M' greentint -9.0908 2.7898 -6.3627 {"}'M' greentint -9.2494 2.6967 -6.5411 {"}'M' greentint -9.3887 2.5287 -6.6743 {"}'M' greentint -9.462 2.4004 -6.9913 {"}'M' greentint -9.5332 2.1553 -7.0155 {"}'M' greentint -9.064 2.9207 -6.6225 {"}'M' greentint -9.2188 2.7976 -6.7872 {"}'M' greentint -9.3546 2.6201 -6.9134 {"}'M' greentint -9.3841 2.4807 -7.2296 {"}'M' greentint -9.4653 2.2375 -7.268 {"}'M' greentint -8.9832 3.0168 -6.8603 {"}'M' greentint -9.1354 2.8808 -7.0203 {"}'M' greentint -9.2721 2.6992 -7.1451 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H LEU 229 A}'M' green -9.3695 2.2613 -6.2385 {"}'M' green -9.2643 2.4759 -6.1607 {"}'M' green -9.6023 1.9587 -6.855 {"}'M' green -9.0344 2.8724 -6.3745 @dotlist {x} color= sky width= 1 master= {H-bonds} { H LEU 229 A}'M' greentint -9.4416 2.0347 -6.6681 {"}'M' greentint -9.2921 2.1801 -6.5157 {"}'M' greentint -9.1675 2.38 -6.4099 {"}'M' greentint -9.0789 2.6176 -6.3618 {"}'M' greentint -9.5086 2.0696 -7.1076 {"}'M' greentint -9.3463 2.1145 -6.9097 {"}'M' greentint -9.192 2.2471 -6.748 {"}'M' greentint -9.0678 2.4504 -6.6434 {"}'M' greentint -8.9895 2.6961 -6.6112 {"}'M' greentint -8.9685 2.9515 -6.6545 {"}'M' greentint -9.3976 2.253 -7.2781 {"}'M' greentint -9.2366 2.2811 -7.0781 {"}'M' greentint -9.0886 2.433 -6.9292 {"}'M' greentint -8.9938 2.6672 -6.8719 {"}'M' greentint -8.9775 2.9209 -6.9212 {"}'M' greentint -9.2641 2.4709 -7.3316 {"}'M' greentint -9.1041 2.5678 -7.1522 {"}'M' greentint -9.0492 2.8211 -7.152 {"}'M' greentint -9.1824 2.7174 -7.3515 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 402 A}'M' green -9.9922 1.0003 -4.6469 {"}'M' green -9.6731 1.1953 -4.2894 {"}'M' green -10.0194 1.2516 -5.1806 {"}'M' green -9.8151 1.5469 -5.3429 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 402 A}'M' greentint -9.859 1.1039 -4.4474 {"}'M' greentint -9.7773 1.3505 -4.4673 {"}'M' greentint -9.9373 1.2536 -4.6467 {"}'M' greentint -10.0477 1.1542 -4.927 {"}'M' greentint -9.5121 1.4666 -4.3226 {"}'M' greentint -9.6438 1.5683 -4.5208 {"}'M' greentint -9.8048 1.5403 -4.7208 {"}'M' greentint -9.9529 1.3883 -4.8696 {"}'M' greentint -9.3205 1.6433 -4.3865 {"}'M' greentint -9.4554 1.7382 -4.5874 {"}'M' greentint -9.6143 1.7413 -4.7933 {"}'M' greentint -9.7745 1.6503 -4.9762 {"}'M' greentint -9.916 1.4797 -5.1118 {"}'M' greentint -9.2069 1.8374 -4.6378 {"}'M' greentint -9.3585 1.8729 -4.8429 {"}'M' greentint -9.5199 1.8337 -5.0408 {"}'M' greentint -9.6765 1.7217 -5.2122 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LEU 229 A}'M' green -10.0669 1.1058 -4.8926 {"}'M' green -9.4439 1.4288 -4.1764 {"}'M' green -9.246 1.6969 -4.3123 {"}'M' green -9.7154 1.7299 -5.3766 {"}'M' green -9.4698 1.8562 -5.2116 {"}'M' green -9.311 1.9535 -5.0339 @dotlist {x} color= red width= 1 master= {H-bonds} { O LEU 229 A}'M' greentint -9.9097 1.1012 -4.687 {"}'M' greentint -9.7471 1.1569 -4.4928 {"}'M' greentint -9.5893 1.2671 -4.3194 {"}'M' greentint -9.9834 1.2836 -5.1506 {"}'M' greentint -9.8354 1.2366 -4.9461 {"}'M' greentint -9.6762 1.259 -4.7456 {"}'M' greentint -9.5164 1.3476 -4.5646 {"}'M' greentint -9.3697 1.4972 -4.417 {"}'M' greentint -9.8551 1.4953 -5.3021 {"}'M' greentint -9.7167 1.4185 -5.1006 {"}'M' greentint -9.5579 1.4295 -4.8997 {"}'M' greentint -9.4009 1.5254 -4.7223 {"}'M' greentint -9.2624 1.696 -4.5908 {"}'M' greentint -9.5824 1.6264 -5.1764 {"}'M' greentint -9.4193 1.6556 -4.9737 {"}'M' greentint -9.2695 1.8093 -4.8229 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 66 1x7dA_68F_90V}P -11.6291 -1.2826 1.2157 {"}-11.6291 -1.2826 1.2157 { ca tyr A 66 1x7dA_68F_90V}-11.0478 -1.9448 0.0578 { c tyr A 66 1x7dA_68F_90V}-10.699 -0.8212 -0.9113 { o tyr A 66 1x7dA_68F_90V}-11.4584 0.1352 -1.0637 { c tyr A 66 1x7dA_68F_90V}P -10.699 -0.8212 -0.9113 { n ala A 67 1x7dA_68F_90V}-9.5475 -0.928 -1.5602 { ca ala A 67 1x7dA_68F_90V}-9.1524 0.0851 -2.5211 { c ala A 67 1x7dA_68F_90V}-8.4269 -0.5504 -3.6863 { o ala A 67 1x7dA_68F_90V}-7.8235 -1.6071 -3.5517 { c ala A 67 1x7dA_68F_90V}P -8.4269 -0.5504 -3.6863 { n phe A 68 1x7dA_68F_90V}-8.5081 0.0884 -4.8454 { ca phe A 68 1x7dA_68F_90V}-7.7856 -0.4064 -6.0023 { c phe A 68 1x7dA_68F_90V}-7.5533 0.7488 -6.9482 { o phe A 68 1x7dA_68F_90V}-8.3051 1.7312 -6.9576 { c phe A 68 1x7dA_68F_90V}P -7.5533 0.7488 -6.9482 { n lys A 69 1x7dA_68F_90V}-6.4862 0.6316 -7.7221 { ca lys A 69 1x7dA_68F_90V}-6.1594 1.6416 -8.7022 { c lys A 69 1x7dA_68F_90V}-5.9224 0.9992 -10.0515 { o lys A 69 1x7dA_68F_90V}-5.2973 -0.0636 -10.1439 { c lys A 69 1x7dA_68F_90V}P -5.9224 0.9992 -10.0515 { n tyr A 70 1x7dA_68F_90V}-6.4589 1.6379 -11.0861 { ca tyr A 70 1x7dA_68F_90V}-6.2526 1.225 -12.4682 { c tyr A 70 1x7dA_68F_90V}-5.1696 2.1966 -12.9136 { o tyr A 70 1x7dA_68F_90V}-5.2946 3.3996 -12.6771 { n phe A 88 1x7dA_68F_90V}P -6.8455 6.0334 -12.1034 {"}-6.8455 6.0334 -12.1034 { ca phe A 88 1x7dA_68F_90V}-8.0643 6.3596 -11.3744 { c phe A 88 1x7dA_68F_90V}-8.3076 5.1973 -10.4181 { o phe A 88 1x7dA_68F_90V}-7.7838 4.0952 -10.616 { c phe A 88 1x7dA_68F_90V}P -8.3076 5.1973 -10.4181 { n gly A 89 1x7dA_68F_90V}-9.0815 5.4337 -9.3681 { ca gly A 89 1x7dA_68F_90V}-9.3034 4.3658 -8.4159 { c gly A 89 1x7dA_68F_90V}-10.5667 4.4751 -7.5992 { o gly A 89 1x7dA_68F_90V}-11.3084 5.452 -7.6977 { c gly A 89 1x7dA_68F_90V}P -10.5667 4.4751 -7.5992 { n val A 90 1x7dA_68F_90V}-10.7868 3.4654 -6.7656 { ca val A 90 1x7dA_68F_90V}-11.9806 3.3899 -5.9448 { c val A 90 1x7dA_68F_90V}-11.6955 2.9758 -4.5104 { o val A 90 1x7dA_68F_90V}-10.8148 2.1577 -4.2547 { c val A 90 1x7dA_68F_90V}P -11.6955 2.9758 -4.5104 { n leu A 91 1x7dA_68F_90V}-12.441 3.5706 -3.5821 { ca leu A 91 1x7dA_68F_90V}-12.346 3.2298 -2.1697 { c leu A 91 1x7dA_68F_90V}-13.7338 2.6699 -1.8624 { o leu A 91 1x7dA_68F_90V}-14.745 3.3362 -2.103 { c leu A 91 1x7dA_68F_90V}P -13.7338 2.6699 -1.8624 { n ala A 92 1x7dA_68F_90V}-13.7842 1.4504 -1.3403 { ca ala A 92 1x7dA_68F_90V}-15.0589 0.8059 -1.0557 { c ala A 92 1x7dA_68F_90V}-15.1974 0.2484 0.3554 { o ala A 92 1x7dA_68F_90V}-14.2108 0.0246 1.0559 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 66 1x7dA_68F_90V}P -11.6291 -1.2826 1.2157 { ca tyr A 66 1x7dA_68F_90V}P -11.0478 -1.9448 0.0578 { n ala A 67 1x7dA_68F_90V}P -9.5475 -0.928 -1.5602 { ca ala A 67 1x7dA_68F_90V}P -9.1524 0.0851 -2.5211 { n phe A 68 1x7dA_68F_90V}P -8.5081 0.0884 -4.8454 { ca phe A 68 1x7dA_68F_90V}P -7.7856 -0.4064 -6.0023 { n lys A 69 1x7dA_68F_90V}P -6.4862 0.6316 -7.7221 { ca lys A 69 1x7dA_68F_90V}P -6.1594 1.6416 -8.7022 { n tyr A 70 1x7dA_68F_90V}P -6.4589 1.6379 -11.0861 { ca tyr A 70 1x7dA_68F_90V}P -6.2526 1.225 -12.4682 { n phe A 88 1x7dA_68F_90V}P -6.8455 6.0334 -12.1034 { ca phe A 88 1x7dA_68F_90V}P -8.0643 6.3596 -11.3744 { n gly A 89 1x7dA_68F_90V}P -9.0815 5.4337 -9.3681 { ca gly A 89 1x7dA_68F_90V}P -9.3034 4.3658 -8.4159 {"}P -9.3034 4.3658 -8.4159 { n val A 90 1x7dA_68F_90V}P -10.7868 3.4654 -6.7656 { ca val A 90 1x7dA_68F_90V}P -11.9806 3.3899 -5.9448 { n leu A 91 1x7dA_68F_90V}P -12.441 3.5706 -3.5821 { ca leu A 91 1x7dA_68F_90V}P -12.346 3.2298 -2.1697 { n ala A 92 1x7dA_68F_90V}P -13.7842 1.4504 -1.3403 { ca ala A 92 1x7dA_68F_90V}P -15.0589 0.8059 -1.0557 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 66 1x7dA_68F_90V}P -11.0478 -1.9448 0.0578 {"}-11.0478 -1.9448 0.0578 { ca ala A 67 1x7dA_68F_90V}-9.1524 0.0851 -2.5211 { ca phe A 68 1x7dA_68F_90V}-7.7856 -0.4064 -6.0023 { ca lys A 69 1x7dA_68F_90V}-6.1594 1.6416 -8.7022 { ca tyr A 70 1x7dA_68F_90V}-6.2526 1.225 -12.4682 { ca phe A 88 1x7dA_68F_90V}P -8.0643 6.3596 -11.3744 {"}-8.0643 6.3596 -11.3744 { ca gly A 89 1x7dA_68F_90V}-9.3034 4.3658 -8.4159 { ca val A 90 1x7dA_68F_90V}-11.9806 3.3899 -5.9448 { ca leu A 91 1x7dA_68F_90V}-12.346 3.2298 -2.1697 { ca ala A 92 1x7dA_68F_90V}-15.0589 0.8059 -1.0557 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 68 1x7dA_68F_90V}P -7.7856 -0.4064 -6.0023 { cb phe A 68 1x7dA_68F_90V}-8.5551 -1.5362 -6.7055 { cg phe A 68 1x7dA_68F_90V}-9.5274 -1.068 -7.7569 { cd1 phe A 68 1x7dA_68F_90V}-9.0998 -0.7996 -9.0571 { ce1 phe A 68 1x7dA_68F_90V}-10.0033 -0.3743 -10.0353 { cz phe A 68 1x7dA_68F_90V}-11.3458 -0.2144 -9.7142 { cg phe A 68 1x7dA_68F_90V}P -9.5274 -1.068 -7.7569 { cd2 phe A 68 1x7dA_68F_90V}-10.872 -0.9026 -7.4485 { ce2 phe A 68 1x7dA_68F_90V}-11.7823 -0.4791 -8.4185 { cz phe A 68 1x7dA_68F_90V}ghost -11.3458 -0.2144 -9.7142 { ca val A 90 1x7dA_68F_90V}P -11.9806 3.3899 -5.9448 { cb val A 90 1x7dA_68F_90V}-12.9685 2.361 -6.551 { cg1 val A 90 1x7dA_68F_90V}-14.137 2.1137 -5.6035 { cb val A 90 1x7dA_68F_90V}P -12.9685 2.361 -6.551 { cg2 val A 90 1x7dA_68F_90V}-13.4553 2.8522 -7.906 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 68 1x7dA_68F_90V}P -8.5551 -1.5362 -6.7055 {"}P -8.5551 -1.5362 -6.7055 { cd1 phe A 68 1x7dA_68F_90V}P -9.0998 -0.7996 -9.0571 { cd2 phe A 68 1x7dA_68F_90V}P -10.872 -0.9026 -7.4485 { ce1 phe A 68 1x7dA_68F_90V}P -10.0033 -0.3743 -10.0353 { ce2 phe A 68 1x7dA_68F_90V}P -11.7823 -0.4791 -8.4185 { cz phe A 68 1x7dA_68F_90V}P -11.3458 -0.2144 -9.7142 { cb val A 90 1x7dA_68F_90V}P -12.9685 2.361 -6.551 { cg1 val A 90 1x7dA_68F_90V}P -14.137 2.1137 -5.6035 {"}P -14.137 2.1137 -5.6035 {"}P -14.137 2.1137 -5.6035 { cg2 val A 90 1x7dA_68F_90V}P -13.4553 2.8522 -7.906 {"}P -13.4553 2.8522 -7.906 {"}P -13.4553 2.8522 -7.906 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 68 A}'S' sky -11.6469 0.2369 -6.3702 {"}'S' sky -11.4475 0.3973 -6.4283 { CE2 PHE 68 A}'S' blue -12.9743 0.7803 -8.1837 {"}'S' sky -12.7439 0.9744 -8.2567 {"}'S' blue -12.9026 0.8653 -8.4315 {"}'S' sky -12.4797 1.1226 -8.3155 {"}'S' sky -12.6404 1.0442 -8.5002 {"}'S' blue -12.7955 0.9256 -8.668 {"}'S' blue -12.0367 1.2341 -8.1644 {"}'S' blue -12.1944 1.221 -8.365 {"}'S' blue -12.3552 1.1684 -8.5574 {"}'S' blue -12.5125 1.0787 -8.7365 { HE2 PHE 68 A}'S' sky -12.9916 0.1794 -7.3269 {"}'S' sky -13.0847 0.354 -7.4957 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 68 A}'S' sea -11.9346 0.1027 -6.4884 {"}'S' sea -12.0975 0.0949 -6.6957 {"}'S' green -11.7897 0.3034 -6.5737 {"}'S' green -11.9474 0.3034 -6.7773 {"}'S' green -11.5898 0.4677 -6.6302 {"}'S' sea -11.3567 0.5943 -6.6824 {"}'S' green -11.5098 0.6285 -6.8907 {"}'S' sea -11.253 0.7298 -6.9441 {"}'S' green -11.4089 0.7354 -7.1482 { CE2 PHE 68 A}'S' green -12.5984 0.2839 -7.0714 {"}'S' green -12.8449 0.5261 -7.4585 {"}'S' green -12.3018 0.1338 -6.8641 {"}'S' green -12.6544 0.9088 -7.8049 {"}'S' green -12.4201 1.052 -7.8608 {"}'S' green -12.1634 1.1533 -7.9141 {"}'S' green -11.5017 0.9003 -7.3793 {"}'S' green -11.6144 1.0381 -7.563 {"}'S' green -11.7424 1.141 -7.758 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD2 PHE 68 A}'S' P -11.7441 0.4853 -6.8349 {"}'S' -11.743 0.4829 -6.8362 { CE2 PHE 68 A}'S' P -12.7037 0.4451 -7.2521 {"}'S' -12.6948 0.4365 -7.2619 {"}'S' P -12.3512 0.3536 -6.9887 {"}'S' -12.339 0.3353 -7.0191 {"}'S' P -12.4383 0.5336 -7.1505 {"}'S' -12.4032 0.4795 -7.2183 {"}'S' P -12.5572 0.6604 -7.3402 {"}'S' -12.5178 0.6029 -7.3946 {"}'S' P -12.7 0.7268 -7.5438 {"}'S' -12.6862 0.7082 -7.5565 {"}'S' P -12.0742 0.3284 -6.893 {"}'S' -12.0724 0.3248 -6.9 {"}'S' P -12.1396 0.5315 -7.0357 {"}'S' -12.1218 0.4784 -7.1085 {"}'S' P -12.2363 0.6987 -7.206 {"}'S' -12.201 0.6071 -7.3009 {"}'S' P -12.3579 0.8207 -7.3983 {"}'S' -12.3172 0.7275 -7.4701 {"}'S' P -12.5001 0.8911 -7.6003 {"}'S' -12.4738 0.8429 -7.6302 {"}'S' P -11.9061 0.6448 -7.0824 {"}'S' -11.9005 0.5936 -7.1435 {"}'S' P -12.005 0.8105 -7.2571 {"}'S' -11.9904 0.7224 -7.3367 {"}'S' P -12.1272 0.9368 -7.4496 {"}'S' -12.105 0.8461 -7.5113 {"}'S' P -12.2671 1.0178 -7.6524 {"}'S' -12.2509 0.967 -7.6786 {"}'S' P -11.6648 0.7203 -7.1493 {"}'S' -11.6663 0.7078 -7.1622 {"}'S' P -11.7625 0.8842 -7.3219 {"}'S' -11.7629 0.8435 -7.3542 {"}'S' P -11.88 1.0132 -7.5103 {"}'S' -11.8775 0.9701 -7.5363 {"}'S' P -12.0154 1.1035 -7.7091 {"}'S' -12.0139 1.093 -7.7148 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 90 A}'S' blue -13.0368 1.0699 -7.7304 {"}'S' sky -12.8016 1.1544 -7.8076 { CG2 VAL 90 A}'S' blue -13.2055 1.1401 -8.1666 {"}'S' blue -13.0479 1.1518 -7.9658 {"}'S' blue -13.1452 1.2383 -8.5065 {"}'S' sky -12.9924 1.2113 -8.3018 {"}'S' sky -12.8334 1.2282 -8.1003 {"}'S' sky -12.672 1.2871 -7.9084 {"}'S' blue -12.9 1.3336 -8.5742 {"}'S' sky -12.7422 1.3219 -8.3679 {"}'S' sky -12.5801 1.3599 -8.1686 {"}'S' sky -12.4188 1.445 -7.9829 {"}'S' blue -12.6563 1.4658 -8.6148 {"}'S' sky -12.4978 1.4777 -8.4129 {"}'S' blue -12.3366 1.5441 -8.223 { HB VAL 90 A}'S' blue -13.1124 0.7104 -7.3586 {"}'S' sky -12.2287 0.265 -6.5241 {"}'S' sky -12.0707 0.3507 -6.3431 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 90 A}'S' sea -12.5625 1.2562 -7.8458 { HB VAL 90 A}'S' green -12.8808 0.6488 -7.474 {"}'S' green -12.7932 0.4726 -7.3106 {"}'S' green -12.677 0.3409 -7.1252 {"}'S' green -12.5405 0.2595 -6.9251 {"}'S' green -12.0668 0.2963 -6.7338 {"}'S' green -11.9086 0.3731 -6.5506 {"}'S' sea -11.7582 0.5045 -6.392 {"}'S' green -12.4505 1.1082 -7.8229 {"}'S' green -11.8091 0.4281 -6.8047 {"}'S' green -11.6518 0.5465 -6.6339 {"}'S' sea -11.5128 0.7234 -6.503 {"}'S' green -12.1839 1.2193 -7.8155 {"}'S' green -11.5763 0.6422 -6.8703 {"}'S' sea -11.4391 0.8104 -6.74 {"}'S' green -11.574 0.7598 -7.1316 {"}'S' sea -11.4234 0.9137 -6.9797 {"}'S' green -11.7176 1.1131 -7.5589 {"}'S' green -11.6126 0.9567 -7.3797 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 90 A}'S' P -12.6739 0.7723 -7.65 {"}'S' -12.6705 0.7811 -7.6371 {"}'S' P -12.6028 0.5759 -7.5046 {"}'S' -12.5942 0.6224 -7.459 {"}'S' P -12.5003 0.4232 -7.3296 {"}'S' -12.497 0.4921 -7.2844 {"}'S' P -12.3718 0.3224 -7.1344 {"}'S' -12.3759 0.3803 -7.1105 {"}'S' P -12.2245 0.2793 -6.9319 {"}'S' -12.2262 0.2906 -6.9298 {"}'S' P -12.4311 0.8659 -7.7309 {"}'S' -12.4321 0.89 -7.6831 {"}'S' P -12.3667 0.657 -7.5883 {"}'S' -12.3742 0.7289 -7.5022 {"}'S' P -12.263 0.4982 -7.4103 {"}'S' -12.2835 0.6014 -7.3286 {"}'S' P -12.1281 0.4034 -7.2094 {"}'S' -12.1567 0.4953 -7.1618 {"}'S' P -11.9723 0.3792 -7.0012 {"}'S' -11.9884 0.4155 -6.9906 {"}'S' P -12.1836 0.9751 -7.7473 {"}'S' -12.1943 0.9925 -7.7026 {"}'S' P -12.1285 0.7639 -7.6186 {"}'S' -12.1603 0.8269 -7.5261 {"}'S' P -12.0259 0.6111 -7.4435 {"}'S' -12.0741 0.7021 -7.3576 {"}'S' P -11.8887 0.5361 -7.2441 {"}'S' -11.9348 0.6086 -7.1988 {"}'S' P -11.7324 0.5469 -7.0448 {"}'S' -11.7433 0.5595 -7.0404 {"}'S' P -11.9388 1.0425 -7.681 {"}'S' -11.9499 1.0506 -7.6587 {"}'S' P -11.871 0.834 -7.5356 {"}'S' -11.9121 0.8745 -7.4763 {"}'S' P -11.7376 0.7312 -7.335 {"}'S' -11.7753 0.7669 -7.3006 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 68 A}'M' green -9.5371 1.8734 -6.3089 {"}'M' green -9.3183 2.2124 -6.1196 {"}'M' green -9.6346 1.76 -6.5205 {"}'M' green -9.2152 2.4449 -6.1686 {"}'M' green -9.6037 2.0893 -7.3379 {"}'M' green -9.1216 2.8686 -6.9302 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 68 A}'M' greentint -9.4772 2.1237 -6.3012 {"}'M' greentint -9.6208 2.0159 -6.5737 {"}'M' greentint -9.3785 2.4116 -6.3705 {"}'M' greentint -9.5271 2.2546 -6.519 {"}'M' greentint -9.6308 2.1583 -6.8164 {"}'M' greentint -9.6873 1.9088 -6.8197 {"}'M' greentint -9.2292 2.6417 -6.4326 {"}'M' greentint -9.3878 2.5486 -6.611 {"}'M' greentint -9.5271 2.3806 -6.7442 {"}'M' greentint -9.6004 2.2523 -7.0612 {"}'M' greentint -9.6716 2.0072 -7.0854 {"}'M' greentint -9.2025 2.7726 -6.6925 {"}'M' greentint -9.3572 2.6495 -6.8571 {"}'M' greentint -9.493 2.472 -6.9833 {"}'M' greentint -9.5225 2.3325 -7.2995 {"}'M' greentint -9.2738 2.7327 -7.0902 {"}'M' greentint -9.4105 2.5511 -7.215 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H VAL 90 A}'M' green -9.7041 1.8824 -7.0041 {"}'M' green -9.1641 2.7643 -6.551 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 90 A}'M' greentint -9.6372 1.8475 -6.5645 {"}'M' greentint -9.4876 1.9929 -6.4121 {"}'M' greentint -9.3631 2.1929 -6.3063 {"}'M' greentint -9.2745 2.4305 -6.2582 {"}'M' greentint -9.5418 1.9273 -6.8061 {"}'M' greentint -9.3876 2.0599 -6.6444 {"}'M' greentint -9.2633 2.2633 -6.5398 {"}'M' greentint -9.185 2.5089 -6.5077 {"}'M' greentint -9.5931 2.0659 -7.1745 {"}'M' greentint -9.4321 2.0939 -6.9745 {"}'M' greentint -9.2841 2.2459 -6.8257 {"}'M' greentint -9.1893 2.48 -6.7683 {"}'M' greentint -9.173 2.7337 -6.8176 {"}'M' greentint -9.4596 2.2837 -7.228 {"}'M' greentint -9.2997 2.3806 -7.0486 {"}'M' greentint -9.2447 2.6339 -7.0484 {"}'M' greentint -9.378 2.5303 -7.2479 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 68 A}'M' green -9.8254 1.0854 -4.399 {"}'M' green -9.9587 0.9818 -4.5985 {"}'M' green -9.6396 1.1768 -4.241 {"}'M' green -10.0141 1.1357 -4.8786 {"}'M' sea -10.0304 0.882 -4.8293 {"}'M' green -9.4785 1.4481 -4.2743 {"}'M' green -9.9858 1.2332 -5.1322 {"}'M' sea -9.287 1.6249 -4.3382 {"}'M' green -9.4219 1.7197 -4.5391 {"}'M' green -9.8824 1.4613 -5.0634 {"}'M' sea -9.325 1.8544 -4.7945 {"}'M' sea -9.4863 1.8152 -4.9924 {"}'M' sea -9.6429 1.7032 -5.1638 {"}'M' sea -9.7815 1.5285 -5.2945 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 68 A}'M' greentint -9.7438 1.332 -4.4189 {"}'M' greentint -9.9037 1.2351 -4.5983 {"}'M' greentint -9.6103 1.5498 -4.4724 {"}'M' greentint -9.7713 1.5218 -4.6724 {"}'M' greentint -9.9193 1.3698 -4.8212 {"}'M' greentint -9.5807 1.7229 -4.745 {"}'M' greentint -9.741 1.6318 -4.9278 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 90 A}'M' sea -10.0739 0.9756 -4.3667 {"}'M' sea -9.9161 1.0859 -4.1932 {"}'M' green -10.1622 1.0553 -4.8199 {"}'M' green -10.003 1.0778 -4.6194 {"}'M' green -9.8432 1.1663 -4.4384 {"}'M' green -9.6965 1.3159 -4.2909 {"}'M' green -9.5728 1.5157 -4.1861 {"}'M' sea -10.1819 1.3141 -5.1759 {"}'M' green -10.0435 1.2372 -4.9744 {"}'M' green -9.4863 1.7382 -4.3938 {"}'M' sea -10.0422 1.5487 -5.2504 {"}'M' green -9.9092 1.4451 -5.0502 {"}'M' green -9.501 1.8643 -4.6392 {"}'M' green -9.7966 1.6749 -5.0854 {"}'M' green -9.6378 1.7723 -4.9078 {"}'M' sea -9.5825 2.0235 -4.9066 {"}'M' sea -9.7229 1.9228 -5.0994 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 90 A}'M' greentint -9.8847 1.2483 -4.7735 {"}'M' greentint -9.7277 1.3441 -4.5962 {"}'M' greentint -9.5892 1.5147 -4.4646 {"}'M' greentint -9.7461 1.4743 -4.8475 {"}'M' greentint -9.5963 1.628 -4.6967 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 69 1x82A_148F_71T}P -7.5159 5.6725 -12.3563 {"}-7.5159 5.6725 -12.3563 { ca ala A 69 1x82A_148F_71T}-8.5018 6.0295 -11.3365 { c ala A 69 1x82A_148F_71T}-8.3359 5.151 -10.13 { o ala A 69 1x82A_148F_71T}-8.0041 3.9802 -10.2825 { c ala A 69 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0.5374 -7.6123 {"}'S' P -12.1176 0.6945 -7.8204 {"}'S' -12.1222 0.71 -7.8114 {"}'S' P -11.8777 0.8099 -7.8588 {"}'S' -11.8918 0.84 -7.8388 { HB THR 71 A}'S' P -12.5408 0.2925 -6.8801 {"}'S' -12.5072 0.3429 -6.8747 {"}'S' P -12.4035 0.211 -6.6806 {"}'S' -12.3746 0.2725 -6.686 {"}'S' P -12.2515 0.1852 -6.4773 {"}'S' -12.2422 0.2145 -6.4849 {"}'S' P -12.4886 0.3919 -7.2723 {"}'S' -12.4517 0.4474 -7.2397 {"}'S' P -12.3798 0.2512 -7.0932 {"}'S' -12.3261 0.3677 -7.0549 {"}'S' P -12.2491 0.1568 -6.8981 {"}'S' -12.2038 0.3029 -6.8799 {"}'S' P -12.1018 0.1152 -6.6958 {"}'S' -12.081 0.2406 -6.703 {"}'S' P -11.9463 0.1271 -6.498 {"}'S' -11.9433 0.1872 -6.5111 {"}'S' P -12.3382 0.5127 -7.5437 {"}'S' -12.3237 0.5373 -7.5176 {"}'S' P -12.2505 0.3365 -7.3803 {"}'S' -12.2121 0.439 -7.3119 {"}'S' P -12.1343 0.2048 -7.1948 {"}'S' -12.0991 0.3714 -7.1267 {"}'S' P -11.9978 0.1234 -6.9948 {"}'S' -11.9822 0.3109 -6.9564 {"}'S' P -11.8454 0.0984 -6.791 {"}'S' -11.8531 0.2469 -6.7876 {"}'S' P -11.686 0.1289 -6.5938 {"}'S' -11.6984 0.1944 -6.6034 {"}'S' P -12.0602 0.4398 -7.5743 {"}'S' -12.0492 0.4987 -7.5164 {"}'S' P -11.9576 0.2871 -7.3992 {"}'S' -11.951 0.4174 -7.314 {"}'S' P -11.8291 0.1863 -7.2041 {"}'S' -11.8409 0.3537 -7.1353 {"}'S' P -11.6819 0.1432 -7.0015 {"}'S' -11.7114 0.2926 -6.97 {"}'S' P -11.5237 0.161 -6.8031 {"}'S' -11.5513 0.2386 -6.8004 {"}'S' P -11.8885 0.7298 -7.8006 {"}'S' -11.8896 0.7575 -7.7452 {"}'S' P -11.824 0.5209 -7.6579 {"}'S' -11.8336 0.6067 -7.5557 {"}'S' P -11.7203 0.3621 -7.48 {"}'S' -11.7467 0.4942 -7.3754 {"}'S' P -11.5854 0.2673 -7.2791 {"}'S' -11.6291 0.4061 -7.2064 {"}'S' P -11.4296 0.2431 -7.0709 {"}'S' -11.4748 0.3405 -7.0421 {"}'S' P -11.2664 0.292 -6.8743 {"}'S' -11.2815 0.3153 -6.8713 {"}'S' P -11.6409 0.839 -7.8169 {"}'S' -11.6547 0.8629 -7.7576 {"}'S' P -11.5858 0.6278 -7.6883 {"}'S' -11.6248 0.7067 -7.5733 {"}'S' P -11.4832 0.475 -7.5132 {"}'S' -11.5477 0.5964 -7.3984 {"}'S' P -11.346 0.4 -7.3138 {"}'S' -11.4218 0.5178 -7.2391 {"}'S' P -11.1897 0.4107 -7.1145 {"}'S' -11.2454 0.4771 -7.0878 {"}'S' P -11.3961 0.9064 -7.7507 {"}'S' -11.4199 0.9229 -7.705 {"}'S' P -11.3283 0.6979 -7.6053 {"}'S' -11.3901 0.7591 -7.5157 {"}'S' P -11.1949 0.5951 -7.4047 {"}'S' -11.2688 0.6648 -7.3369 {"}'S' P -11.0314 0.6237 -7.2013 {"}'S' -11.0657 0.6489 -7.1839 {"}'S' P -11.175 0.977 -7.6286 {"}'S' -11.1817 0.9793 -7.6212 {"}'S' P -11.07 0.8206 -7.4494 {"}'S' -11.0988 0.8353 -7.4255 @dotlist {x} color= red width= 1 master= {vdw contact} { OG1 THR 71 A}'S' blue -12.4657 1.074 -8.3691 {"}'S' blue -12.3161 1.1231 -8.5894 {"}'S' sky -12.1582 1.147 -8.3926 {"}'S' sky -12.0553 1.2254 -8.6442 {"}'S' sky -11.8927 1.2811 -8.45 { HG1 THR 71 A}'S' sky -11.8825 1.2793 -8.668 {"}'S' sky -11.7258 1.3167 -8.4761 {"}'S' sky -11.5709 1.4139 -8.3037 {"}'S' blue -11.7695 1.2774 -8.9506 {"}'S' sky -11.6151 1.2767 -8.7515 {"}'S' sky -11.4569 1.3404 -8.5652 {"}'S' sky -11.3067 1.4648 -8.4053 {"}'S' blue -11.5646 1.3357 -9.1025 {"}'S' sky -11.4064 1.3379 -8.8988 {"}'S' sky -11.2457 1.4138 -8.7119 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 148 A}'M' green -9.1857 2.3208 -6.1085 {"}'M' green -9.3431 1.9571 -6.3278 {"}'M' green -9.3973 1.8586 -6.5605 {"}'M' green -8.9378 2.8388 -6.2399 {"}'M' green -9.4107 1.9506 -6.8612 {"}'M' green -8.8301 3.0657 -6.7375 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 148 A}'M' greentint -9.3293 2.2131 -6.381 {"}'M' greentint -9.087 2.6087 -6.1777 {"}'M' greentint -9.2356 2.4518 -6.3262 {"}'M' greentint -9.3393 2.3554 -6.6237 {"}'M' greentint -9.3959 2.1059 -6.6269 {"}'M' greentint -9.0964 2.7457 -6.4183 {"}'M' greentint -9.2356 2.5777 -6.5515 {"}'M' greentint -9.309 2.4494 -6.8685 {"}'M' greentint -9.3801 2.2043 -6.8927 {"}'M' greentint -8.911 2.9697 -6.4997 {"}'M' greentint -9.0658 2.8466 -6.6644 {"}'M' greentint -9.2015 2.6691 -6.7906 {"}'M' greentint -9.2311 2.5296 -7.1067 {"}'M' greentint -9.3123 2.2865 -7.1451 {"}'M' greentint -8.9824 2.9298 -6.8975 {"}'M' greentint -9.119 2.7482 -7.0223 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H THR 71 A}'M' green -8.9668 2.8388 -6.2026 {"}'M' green -9.441 2.036 -6.9358 @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 71 A}'M' greentint -9.374 2.0011 -6.4962 {"}'M' greentint -9.2245 2.1465 -6.3438 {"}'M' greentint -9.0999 2.3464 -6.238 {"}'M' greentint -9.0113 2.584 -6.1899 {"}'M' greentint -9.2786 2.0809 -6.7378 {"}'M' greentint -9.1244 2.2135 -6.5761 {"}'M' greentint -9.0002 2.4168 -6.4715 {"}'M' greentint -8.9219 2.6625 -6.4394 {"}'M' greentint -8.9009 2.9179 -6.4827 {"}'M' greentint -9.33 2.2195 -7.1062 {"}'M' greentint -9.169 2.2475 -6.9062 {"}'M' greentint -9.0209 2.3995 -6.7574 {"}'M' greentint -8.9261 2.6336 -6.7 {"}'M' greentint -8.9098 2.8873 -6.7493 {"}'M' greentint -9.1965 2.4373 -7.1597 {"}'M' greentint -9.0365 2.5342 -6.9803 {"}'M' greentint -8.9815 2.7875 -6.9801 {"}'M' greentint -9.1148 2.6839 -7.1796 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 148 A}'M' -9.5479 1.1837 -4.061 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 148 A}'M' sea -9.7338 1.0923 -4.219 {"}'M' green -9.8671 0.9887 -4.4185 {"}'M' green -9.6521 1.3389 -4.2388 {"}'M' green -9.9225 1.1426 -4.6985 {"}'M' sea -9.9388 0.8889 -4.6492 {"}'M' sea -9.3869 1.455 -4.0942 {"}'M' green -9.5186 1.5567 -4.2924 {"}'M' green -9.8942 1.24 -4.9521 {"}'M' sea -9.9446 0.9853 -4.9475 {"}'M' sea -9.3302 1.7266 -4.359 {"}'M' green -9.4891 1.7297 -4.5649 {"}'M' sea -9.7974 1.3143 -5.1921 {"}'M' sea -9.2333 1.8613 -4.6145 {"}'M' green -9.3947 1.8221 -4.8124 {"}'M' green -9.5513 1.7101 -4.9837 {"}'M' green -9.6899 1.5353 -5.1145 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 148 A}'M' greentint -9.8121 1.2419 -4.4183 {"}'M' greentint -9.6796 1.5286 -4.4923 {"}'M' greentint -9.8277 1.3767 -4.6412 {"}'M' greentint -9.6494 1.6387 -4.7478 {"}'M' greentint -9.7908 1.4681 -4.8833 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O THR 71 A}'M' sky -9.4203 2.0492 -4.4788 @dotlist {x} color= red width= 1 master= {vdw contact} { O THR 71 A}'M' sea -10.0623 1.0369 -4.452 {"}'M' green -9.9045 1.1472 -4.2785 {"}'M' green -9.7591 1.3089 -4.1355 {"}'M' sea -9.6345 1.5113 -4.032 {"}'M' sea -10.1506 1.1166 -4.9052 {"}'M' green -9.9914 1.1391 -4.7047 {"}'M' green -9.5612 1.577 -4.2715 {"}'M' sea -9.4694 1.8112 -4.2182 {"}'M' sea -10.0319 1.2986 -5.0597 {"}'M' green -9.4747 1.7995 -4.4791 {"}'M' sea -9.8976 1.5064 -5.1355 {"}'M' green -9.4894 1.9256 -4.7245 {"}'M' sea -9.785 1.7362 -5.1707 {"}'M' green -9.6263 1.8336 -4.9931 @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 71 A}'M' greentint -9.8317 1.2276 -4.5237 {"}'M' greentint -9.6849 1.3772 -4.3762 {"}'M' greentint -9.8731 1.3096 -4.8588 {"}'M' greentint -9.7161 1.4055 -4.6815 {"}'M' greentint -9.5776 1.576 -4.55 {"}'M' greentint -9.7345 1.5356 -4.9329 {"}'M' greentint -9.5847 1.6893 -4.782 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 205 1xcrA_207F_249}P -12.2805 -2.4688 0.2664 {"}-12.2805 -2.4688 0.2664 { ca gly A 205 1xcrA_207F_249}-10.9157 -1.9779 0.2954 { c gly A 205 1xcrA_207F_249}-10.7607 -0.9191 -0.7648 { o gly A 205 1xcrA_207F_249}-11.6138 -0.0388 -0.8997 { c gly A 205 1xcrA_207F_249}P -10.7607 -0.9191 -0.7648 { n thr A 206 1xcrA_207F_249}-9.6672 -0.9952 -1.5154 { ca thr A 206 1xcrA_207F_249}-9.3881 0.0297 -2.5299 { c thr A 206 1xcrA_207F_249}-8.5939 -0.5943 -3.6703 { o thr A 206 1xcrA_207F_249}-7.8705 -1.5666 -3.4628 { c thr A 206 1xcrA_207F_249}P -8.5939 -0.5943 -3.6703 { n phe A 207 1xcrA_207F_249}-8.7692 -0.0633 -4.8771 { ca phe A 207 1xcrA_207F_249}-7.8928 -0.4208 -5.9883 { c phe A 207 1xcrA_207F_249}-7.5895 0.7708 -6.8831 { o phe A 207 1xcrA_207F_249}-8.375 1.7361 -6.9501 { c phe A 207 1xcrA_207F_249}P -7.5895 0.7708 -6.8831 { n ile A 208 1xcrA_207F_249}-6.4336 0.6895 -7.537 { ca ile A 208 1xcrA_207F_249}-5.998 1.6592 -8.5231 { c ile A 208 1xcrA_207F_249}-6.1926 1.0239 -9.8933 { o ile A 208 1xcrA_207F_249}-5.7448 -0.1062 -10.1408 { c ile A 208 1xcrA_207F_249}P -6.1926 1.0239 -9.8933 { n ile A 209 1xcrA_207F_249}-6.8203 1.7773 -10.7847 { ca ile A 209 1xcrA_207F_249}-6.7459 1.5092 -12.2009 { c ile A 209 1xcrA_207F_249}-5.4957 2.2697 -12.6718 { o ile A 209 1xcrA_207F_249}-5.4909 3.4941 -12.7364 { n leu A 247 1xcrA_207F_249}P -6.7986 6.1165 -11.5303 {"}-6.7986 6.1165 -11.5303 { ca leu A 247 1xcrA_207F_249}-8.0304 6.3303 -10.7728 { c leu A 247 1xcrA_207F_249}-7.9807 5.5109 -9.4772 { o leu A 247 1xcrA_207F_249}-7.5941 4.3424 -9.4989 { c leu A 247 1xcrA_207F_249}P -7.9807 5.5109 -9.4772 { n val A 248 1xcrA_207F_249}-8.3664 6.1244 -8.3604 { ca val A 248 1xcrA_207F_249}-8.4004 5.4462 -7.0695 { c val A 248 1xcrA_207F_249}-9.8457 5.0793 -6.7517 { o val A 248 1xcrA_207F_249}-10.7046 5.9604 -6.6126 { c val A 248 1xcrA_207F_249}P -9.8457 5.0793 -6.7517 { n cys A 249 1xcrA_207F_249}-10.0952 3.7707 -6.6521 { ca cys A 249 1xcrA_207F_249}-11.4385 3.1938 -6.6338 { c cys A 249 1xcrA_207F_249}-11.7459 2.5725 -5.2854 { o cys A 249 1xcrA_207F_249}-10.8667 1.9859 -4.647 { c cys A 249 1xcrA_207F_249}P -11.7459 2.5725 -5.2854 { n leu A 250 1xcrA_207F_249}-13.0059 2.7062 -4.8729 { ca leu A 250 1xcrA_207F_249}-13.4863 2.2602 -3.5719 { c leu A 250 1xcrA_207F_249}-14.6867 1.3328 -3.791 { o leu A 250 1xcrA_207F_249}-15.8058 1.8103 -3.9155 { c leu A 250 1xcrA_207F_249}P -14.6867 1.3328 -3.791 { n pro A 251 1xcrA_207F_249}-14.4465 0.0232 -3.9037 { ca pro A 251 1xcrA_207F_249}-15.5265 -0.9324 -4.109 { c pro A 251 1xcrA_207F_249}-16.0594 -1.5746 -2.8367 { o pro A 251 1xcrA_207F_249}-15.3172 -1.7566 -1.8491 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 205 1xcrA_207F_249}P -12.2805 -2.4688 0.2664 { ca gly A 205 1xcrA_207F_249}P -10.9157 -1.9779 0.2954 {"}P -10.9157 -1.9779 0.2954 { n thr A 206 1xcrA_207F_249}P -9.6672 -0.9952 -1.5154 { ca thr A 206 1xcrA_207F_249}P -9.3881 0.0297 -2.5299 { n phe A 207 1xcrA_207F_249}P -8.7692 -0.0633 -4.8771 { ca phe A 207 1xcrA_207F_249}P -7.8928 -0.4208 -5.9883 { n ile A 208 1xcrA_207F_249}P -6.4336 0.6895 -7.537 { ca ile A 208 1xcrA_207F_249}P -5.998 1.6592 -8.5231 { n ile A 209 1xcrA_207F_249}P -6.8203 1.7773 -10.7847 { ca ile A 209 1xcrA_207F_249}P -6.7459 1.5092 -12.2009 { n leu A 247 1xcrA_207F_249}P -6.7986 6.1165 -11.5303 { ca leu A 247 1xcrA_207F_249}P -8.0304 6.3303 -10.7728 { n val A 248 1xcrA_207F_249}P -8.3664 6.1244 -8.3604 { ca val A 248 1xcrA_207F_249}P -8.4004 5.4462 -7.0695 { n cys A 249 1xcrA_207F_249}P -10.0952 3.7707 -6.6521 { ca cys A 249 1xcrA_207F_249}P -11.4385 3.1938 -6.6338 { n leu A 250 1xcrA_207F_249}P -13.0059 2.7062 -4.8729 { ca leu A 250 1xcrA_207F_249}P -13.4863 2.2602 -3.5719 { ca pro A 251 1xcrA_207F_249}P -15.5265 -0.9324 -4.109 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 205 1xcrA_207F_249}P -10.9157 -1.9779 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2.4498 -6.1611 {"}'M' greentint -9.4484 2.4164 -6.3629 {"}'M' greentint -9.597 2.2595 -6.5114 {"}'M' greentint -9.0034 2.5756 -6.0234 {"}'M' greentint -9.1412 2.655 -6.2231 {"}'M' greentint -9.2992 2.6466 -6.4251 {"}'M' greentint -9.4578 2.5534 -6.6035 {"}'M' greentint -9.597 2.3855 -6.7367 {"}'M' greentint -8.817 2.7467 -6.0879 {"}'M' greentint -8.9561 2.825 -6.2891 {"}'M' greentint -9.4272 2.6544 -6.8496 {"}'M' greentint -9.5629 2.4768 -6.9758 {"}'M' greentint -8.5811 2.8498 -6.1275 {"}'M' greentint -8.7161 2.9432 -6.3281 {"}'M' greentint -8.869 2.9791 -6.535 {"}'M' greentint -9.1915 2.8735 -6.9227 {"}'M' greentint -9.3438 2.7376 -7.0827 {"}'M' greentint -9.4804 2.556 -7.2075 {"}'M' greentint -8.4749 3.0201 -6.4022 {"}'M' greentint -8.6203 3.0705 -6.6039 {"}'M' greentint -8.7755 3.0696 -6.8039 {"}'M' greentint -8.9346 3.0185 -6.996 {"}'M' greentint -9.0904 2.9198 -7.1693 {"}'M' greentint -9.2366 2.7762 -7.3192 {"}'M' greentint -9.3674 2.5942 -7.4377 {"}'M' greentint -8.4596 3.1262 -6.8105 {"}'M' greentint -8.6176 3.1137 -7.0117 {"}'M' greentint -8.7779 3.053 -7.2015 {"}'M' greentint -8.9347 2.9471 -7.3746 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H CYS 249 A}'M' P -8.9165 2.2697 -6.9404 {"}'M' -8.9256 2.2859 -6.9326 {"}'M' P -8.7542 2.3147 -6.7425 {"}'M' -8.7779 2.3447 -6.7357 {"}'M' P -8.6445 2.4813 -6.9109 {"}'M' -8.6473 2.4837 -6.9101 @dotlist {x} color= sky width= 1 master= {H-bonds} { H CYS 249 A}'M' greentint -9.6353 2.1246 -6.656 {"}'M' greentint -9.4863 2.1003 -6.457 {"}'M' greentint -9.3296 2.1378 -6.2651 {"}'M' greentint -9.1747 2.2349 -6.0927 {"}'M' greentint -9.0334 2.3857 -5.9511 {"}'M' greentint -9.6304 2.2881 -7.1241 {"}'M' greentint -9.5132 2.1635 -6.9389 {"}'M' greentint -9.3733 2.0984 -6.7396 {"}'M' greentint -9.219 2.0977 -6.5405 {"}'M' greentint -9.0608 2.1614 -6.3542 {"}'M' greentint -8.9105 2.2859 -6.1943 {"}'M' greentint -8.7774 2.4615 -6.0713 {"}'M' greentint -8.6722 2.6761 -5.9935 {"}'M' greentint -9.4223 2.3716 -7.2791 {"}'M' greentint -9.3098 2.2297 -7.0946 {"}'M' greentint -9.1684 2.1567 -6.8915 {"}'M' greentint -9.0102 2.1589 -6.6878 {"}'M' greentint -8.8495 2.2349 -6.5009 {"}'M' greentint -8.7 2.3803 -6.3485 {"}'M' greentint -8.5754 2.5802 -6.2427 {"}'M' greentint -8.4868 2.8178 -6.1946 {"}'M' greentint -9.2484 2.6623 -7.4785 {"}'M' greentint -9.1813 2.4564 -7.3347 {"}'M' greentint -9.0653 2.3194 -7.1466 {"}'M' greentint -8.5999 2.4473 -6.5808 {"}'M' greentint -8.4757 2.6506 -6.4762 {"}'M' greentint -8.3974 2.8963 -6.444 {"}'M' greentint -9.0039 2.7602 -7.4521 {"}'M' greentint -8.9372 2.555 -7.309 {"}'M' greentint -8.8055 2.4532 -7.1109 {"}'M' greentint -8.4965 2.6332 -6.762 {"}'M' greentint -8.4017 2.8673 -6.7047 {"}'M' greentint -8.3854 3.121 -6.754 {"}'M' greentint -8.7762 2.8262 -7.3422 {"}'M' greentint -8.672 2.671 -7.1644 {"}'M' greentint -8.512 2.768 -6.985 {"}'M' greentint -8.4571 3.0213 -6.9848 {"}'M' greentint -8.5903 2.9176 -7.1843 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 207 A}'M' greentint -10.267 0.7628 -4.5016 {"}'M' greentint -10.1853 1.0094 -4.5215 {"}'M' greentint -10.3453 0.9125 -4.7009 {"}'M' greentint -10.4556 0.8131 -4.9812 {"}'M' greentint -9.92 1.1255 -4.3769 {"}'M' greentint -10.0518 1.2272 -4.575 {"}'M' greentint -10.2128 1.1991 -4.775 {"}'M' greentint -10.3608 1.0472 -4.9239 {"}'M' greentint -10.4274 0.9105 -5.2348 {"}'M' greentint -9.7285 1.3022 -4.4408 {"}'M' greentint -9.8634 1.3971 -4.6417 {"}'M' greentint -10.0223 1.4002 -4.8476 {"}'M' greentint -10.1825 1.3092 -5.0304 {"}'M' greentint -10.3239 1.1386 -5.166 {"}'M' greentint -9.6148 1.4963 -4.692 {"}'M' greentint -9.7665 1.5318 -4.8971 {"}'M' greentint -9.9278 1.4926 -5.095 {"}'M' greentint -10.0844 1.3806 -5.2664 {"}'M' greentint -10.223 1.2058 -5.3972 {"}'M' greentint -9.6383 1.5827 -5.1454 {"}'M' greentint -9.7965 1.519 -5.3317 {"}'M' greentint -9.9468 1.3946 -5.4916 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O CYS 249 A}'M' green -10.2338 1.1422 -5.5682 {"}'M' green -9.5382 1.5663 -4.7861 @dotlist {x} color= red width= 1 master= {H-bonds} { O CYS 249 A}'M' greentint -10.3913 0.6696 -4.7016 {"}'M' greentint -10.2332 0.7437 -4.5178 {"}'M' greentint -10.0814 0.8643 -4.3549 {"}'M' greentint -10.4456 0.7526 -5.1588 {"}'M' greentint -10.2884 0.748 -4.9531 {"}'M' greentint -10.1258 0.8037 -4.759 {"}'M' greentint -9.968 0.914 -4.5855 {"}'M' greentint -9.8226 1.0757 -4.4425 {"}'M' greentint -10.3621 0.9304 -5.4167 {"}'M' greentint -10.2141 0.8834 -5.2122 {"}'M' greentint -10.0549 0.9059 -5.0117 {"}'M' greentint -9.8952 0.9944 -4.8307 {"}'M' greentint -9.7485 1.144 -4.6832 {"}'M' greentint -9.6247 1.3438 -4.5784 {"}'M' greentint -10.0954 1.0654 -5.3667 {"}'M' greentint -9.9366 1.0764 -5.1658 {"}'M' greentint -9.7796 1.1723 -4.9885 {"}'M' greentint -9.6411 1.3428 -4.8569 {"}'M' greentint -9.9611 1.2732 -5.4425 {"}'M' greentint -9.798 1.3024 -5.2398 {"}'M' greentint -9.6482 1.4561 -5.089 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 3 1xdfA_5F_117I}P -12.2355 -1.3469 0.6255 {"}-12.2355 -1.3469 0.6255 { ca phe A 3 1xdfA_5F_117I}-11.3161 -2.004 -0.3501 { c phe A 3 1xdfA_5F_117I}-10.8878 -1.0029 -1.3843 { o phe A 3 1xdfA_5F_117I}-11.707 -0.432 -2.0702 { c phe A 3 1xdfA_5F_117I}P -10.8878 -1.0029 -1.3843 { n thr A 4 1xdfA_5F_117I}-9.5912 -0.7218 -1.4432 { ca thr A 4 1xdfA_5F_117I}-9.036 0.3276 -2.2978 { c thr A 4 1xdfA_5F_117I}-8.1386 -0.2919 -3.341 { o thr A 4 1xdfA_5F_117I}-7.274 -1.0858 -3.017 { c thr A 4 1xdfA_5F_117I}P -8.1386 -0.2919 -3.341 { n phe A 5 1xdfA_5F_117I}-8.3296 0.0778 -4.5922 { ca phe A 5 1xdfA_5F_117I}-7.3884 -0.3276 -5.6193 { c phe A 5 1xdfA_5F_117I}-7.2799 0.7028 -6.7075 { o phe A 5 1xdfA_5F_117I}-7.9986 1.6714 -6.7164 { c phe A 5 1xdfA_5F_117I}P -7.2799 0.7028 -6.7075 { n glu A 6 1xdfA_5F_117I}-6.3602 0.4856 -7.6259 { ca glu A 6 1xdfA_5F_117I}-6.0079 1.5184 -8.5952 { c glu A 6 1xdfA_5F_117I}-6.3471 0.9732 -9.9835 { o glu A 6 1xdfA_5F_117I}-6.3363 -0.2586 -10.2071 { c glu A 6 1xdfA_5F_117I}P -6.3471 0.9732 -9.9835 { n asp A 7 1xdfA_5F_117I}-6.7991 1.8476 -10.8778 { ca asp A 7 1xdfA_5F_117I}-7.0702 1.4406 -12.2594 { c asp A 7 1xdfA_5F_117I}-6.4128 2.5212 -13.1539 { o asp A 7 1xdfA_5F_117I}-6.2973 3.6395 -12.7609 { n val A 115 1xdfA_5F_117I}P -7.1479 6.3267 -11.7703 {"}-7.1479 6.3267 -11.7703 { ca val A 115 1xdfA_5F_117I}-8.3258 6.1517 -10.9137 { c val A 115 1xdfA_5F_117I}-8.0114 5.3305 -9.6557 { o val A 115 1xdfA_5F_117I}-7.2886 4.3415 -9.7236 { c val A 115 1xdfA_5F_117I}P -8.0114 5.3305 -9.6557 { n thr A 116 1xdfA_5F_117I}-8.4875 5.8144 -8.5149 { ca thr A 116 1xdfA_5F_117I}-8.469 5.0777 -7.2551 { c thr A 116 1xdfA_5F_117I}-9.9419 4.7612 -6.9642 { o thr A 116 1xdfA_5F_117I}-10.7874 5.6408 -6.9228 { c thr A 116 1xdfA_5F_117I}P -9.9419 4.7612 -6.9642 { n ile A 117 1xdfA_5F_117I}-10.241 3.4966 -6.8333 { ca ile A 117 1xdfA_5F_117I}-11.5591 3.0374 -6.4588 { c ile A 117 1xdfA_5F_117I}-11.5759 2.5843 -5.0062 { o ile A 117 1xdfA_5F_117I}-10.7081 1.8083 -4.5452 { c ile A 117 1xdfA_5F_117I}P -11.5759 2.5843 -5.0062 { n lys A 118 1xdfA_5F_117I}-12.542 3.092 -4.2756 { ca lys A 118 1xdfA_5F_117I}-12.7772 2.6865 -2.9016 { c lys A 118 1xdfA_5F_117I}-14.1965 2.1216 -2.7559 { o lys A 118 1xdfA_5F_117I}-15.2016 2.8486 -2.9558 { c lys A 118 1xdfA_5F_117I}P -14.1965 2.1216 -2.7559 { n ile A 119 1xdfA_5F_117I}-14.2623 0.8341 -2.4205 { ca ile A 119 1xdfA_5F_117I}-15.4756 0.1074 -2.1203 { c ile A 119 1xdfA_5F_117I}-15.6794 -0.0368 -0.6382 { o ile A 119 1xdfA_5F_117I}-14.8716 -0.6651 0.0812 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 3 1xdfA_5F_117I}P -12.2355 -1.3469 0.6255 { ca phe A 3 1xdfA_5F_117I}P -11.3161 -2.004 -0.3501 { n thr A 4 1xdfA_5F_117I}P -9.5912 -0.7218 -1.4432 { ca thr A 4 1xdfA_5F_117I}P -9.036 0.3276 -2.2978 { n phe A 5 1xdfA_5F_117I}P -8.3296 0.0778 -4.5922 { ca phe A 5 1xdfA_5F_117I}P -7.3884 -0.3276 -5.6193 { n glu A 6 1xdfA_5F_117I}P -6.3602 0.4856 -7.6259 { ca glu A 6 1xdfA_5F_117I}P -6.0079 1.5184 -8.5952 { n asp A 7 1xdfA_5F_117I}P -6.7991 1.8476 -10.8778 { ca asp A 7 1xdfA_5F_117I}P -7.0702 1.4406 -12.2594 { n val A 115 1xdfA_5F_117I}P -7.1479 6.3267 -11.7703 { ca val A 115 1xdfA_5F_117I}P -8.3258 6.1517 -10.9137 { n thr A 116 1xdfA_5F_117I}P -8.4875 5.8144 -8.5149 { ca thr A 116 1xdfA_5F_117I}P -8.469 5.0777 -7.2551 { n ile A 117 1xdfA_5F_117I}P -10.241 3.4966 -6.8333 { ca ile A 117 1xdfA_5F_117I}P -11.5591 3.0374 -6.4588 { n lys A 118 1xdfA_5F_117I}P -12.542 3.092 -4.2756 { ca lys A 118 1xdfA_5F_117I}P -12.7772 2.6865 -2.9016 { n ile A 119 1xdfA_5F_117I}P -14.2623 0.8341 -2.4205 { ca ile A 119 1xdfA_5F_117I}P -15.4756 0.1074 -2.1203 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 3 1xdfA_5F_117I}P -11.3161 -2.004 -0.3501 {"}-11.3161 -2.004 -0.3501 { ca thr A 4 1xdfA_5F_117I}-9.036 0.3276 -2.2978 { ca phe A 5 1xdfA_5F_117I}-7.3884 -0.3276 -5.6193 { ca glu A 6 1xdfA_5F_117I}-6.0079 1.5184 -8.5952 { ca asp A 7 1xdfA_5F_117I}-7.0702 1.4406 -12.2594 { ca val A 115 1xdfA_5F_117I}P -8.3258 6.1517 -10.9137 {"}-8.3258 6.1517 -10.9137 { ca thr A 116 1xdfA_5F_117I}-8.469 5.0777 -7.2551 { ca ile A 117 1xdfA_5F_117I}-11.5591 3.0374 -6.4588 { ca lys A 118 1xdfA_5F_117I}-12.7772 2.6865 -2.9016 { ca ile A 119 1xdfA_5F_117I}-15.4756 0.1074 -2.1203 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 5 1xdfA_5F_117I}P -7.3884 -0.3276 -5.6193 { cb phe A 5 1xdfA_5F_117I}-7.7477 -1.698 -6.1649 { cg phe A 5 1xdfA_5F_117I}-9.0418 -1.7495 -6.8386 { cd1 phe A 5 1xdfA_5F_117I}-10.1913 -1.9426 -6.1304 { ce1 phe A 5 1xdfA_5F_117I}-11.3936 -2.0365 -6.7816 { cz phe A 5 1xdfA_5F_117I}-11.4359 -1.9982 -8.1452 { cg phe A 5 1xdfA_5F_117I}P -9.0418 -1.7495 -6.8386 { cd2 phe A 5 1xdfA_5F_117I}-9.0918 -1.7457 -8.2407 { ce2 phe A 5 1xdfA_5F_117I}-10.2881 -1.85 -8.8813 { cz phe A 5 1xdfA_5F_117I}ghost -11.4359 -1.9982 -8.1452 { ca ile A 117 1xdfA_5F_117I}P -11.5591 3.0374 -6.4588 { cb ile A 117 1xdfA_5F_117I}-11.9231 1.8883 -7.3468 { cg1 ile A 117 1xdfA_5F_117I}-11.7379 2.3221 -8.8075 { cd1 ile A 117 1xdfA_5F_117I}-11.9593 1.2821 -9.7101 { cb ile A 117 1xdfA_5F_117I}P -11.9231 1.8883 -7.3468 { cg2 ile A 117 1xdfA_5F_117I}-13.3292 1.4563 -7.0595 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 5 1xdfA_5F_117I}P -7.7477 -1.698 -6.1649 {"}P -7.7477 -1.698 -6.1649 { cd1 phe A 5 1xdfA_5F_117I}P -10.1913 -1.9426 -6.1304 { cd2 phe A 5 1xdfA_5F_117I}P -9.0918 -1.7457 -8.2407 { ce1 phe A 5 1xdfA_5F_117I}P -11.3936 -2.0365 -6.7816 { ce2 phe A 5 1xdfA_5F_117I}P -10.2881 -1.85 -8.8813 { cz phe A 5 1xdfA_5F_117I}P -11.4359 -1.9982 -8.1452 { cb ile A 117 1xdfA_5F_117I}P -11.9231 1.8883 -7.3468 { cg1 ile A 117 1xdfA_5F_117I}P -11.7379 2.3221 -8.8075 {"}P -11.7379 2.3221 -8.8075 { cg2 ile A 117 1xdfA_5F_117I}P -13.3292 1.4563 -7.0595 {"}P 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green -12.0932 0.2911 -6.5329 {"}'S' green -11.9338 0.3215 -6.3356 {"}'S' sea -11.7754 0.4081 -6.1542 {"}'S' green -12.3302 0.4978 -7.3278 {"}'S' green -11.9434 0.221 -6.7514 {"}'S' green -11.7879 0.233 -6.5535 {"}'S' green -11.6293 0.2975 -6.3668 {"}'S' green -12.1798 0.6185 -7.5993 {"}'S' green -11.6871 0.2043 -6.8466 {"}'S' green -11.5277 0.2348 -6.6493 {"}'S' sea -11.3697 0.3205 -6.4683 {"}'S' sea -11.9729 0.742 -7.7752 {"}'S' green -11.9018 0.5457 -7.6299 {"}'S' green -11.5235 0.2491 -7.0571 {"}'S' sea -11.3653 0.2669 -6.8586 {"}'S' green -11.6656 0.6268 -7.7135 {"}'S' green -11.562 0.468 -7.5355 {"}'S' green -11.4271 0.3732 -7.3346 {"}'S' sea -11.2713 0.3489 -7.1264 {"}'S' sea -11.4274 0.7336 -7.7438 {"}'S' green -11.3248 0.5809 -7.5687 {"}'S' sea -11.1877 0.5059 -7.3693 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD1 PHE 99 A}'S' P -11.4608 0.7089 -8.8296 {"}'S' -11.46 0.7219 -8.8332 {"}'S' P -11.4241 0.6408 -9.1963 {"}'S' -11.4241 0.6422 -9.1965 {"}'S' P -11.262 0.6629 -8.9934 {"}'S' -11.2633 0.6902 -8.9979 {"}'S' P -11.0997 0.7237 -8.799 {"}'S' -11.1006 0.7352 -8.803 { HB2 PHE 99 A}'S' P -12.2214 0.3571 -7.1487 {"}'S' -12.208 0.386 -7.1387 {"}'S' P -12.0907 0.2627 -6.9537 {"}'S' -12.0819 0.2912 -6.9499 {"}'S' P -12.0922 0.4424 -7.4358 {"}'S' -12.0847 0.4619 -7.4232 {"}'S' P -11.976 0.3106 -7.2504 {"}'S' -11.9653 0.3609 -7.2301 {"}'S' P -11.8394 0.2293 -7.0503 {"}'S' -11.8364 0.2666 -7.0427 {"}'S' P -11.7992 0.3929 -7.4548 {"}'S' -11.7985 0.4077 -7.4452 {"}'S' P -11.6708 0.2922 -7.2596 {"}'S' -11.6717 0.3093 -7.2528 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O TYR 82 A}'M' P -9.5029 2.6445 -6.8791 {"}'M' -9.5005 2.6431 -6.8789 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 82 A}'M' greentint -9.6196 2.3481 -6.1831 {"}'M' greentint -9.7233 2.2517 -6.4805 {"}'M' greentint -9.3217 2.7351 -6.0967 {"}'M' greentint -9.4803 2.642 -6.2751 {"}'M' greentint -9.6195 2.474 -6.4083 {"}'M' greentint -9.6929 2.3457 -6.7253 {"}'M' greentint -9.764 2.1006 -6.7495 {"}'M' greentint -9.1347 2.9243 -6.1646 {"}'M' greentint -9.2949 2.866 -6.3566 {"}'M' greentint -9.4497 2.7429 -6.5212 {"}'M' greentint -9.5854 2.5654 -6.6474 {"}'M' greentint -9.615 2.4259 -6.9636 {"}'M' greentint -9.6962 2.1828 -7.002 {"}'M' greentint -9.0516 3.0436 -6.408 {"}'M' greentint -9.214 2.9621 -6.5943 {"}'M' greentint -9.3663 2.8261 -6.7543 {"}'M' greentint -9.5005 2.4707 -7.1933 {"}'M' greentint -9.5861 2.2359 -7.2378 {"}'M' greentint -8.9571 3.1071 -6.6677 {"}'M' greentint -9.113 3.0083 -6.841 {"}'M' greentint -9.2591 2.8648 -6.9909 {"}'M' greentint -9.3899 2.6828 -7.1093 {"}'M' greentint -9.3495 2.4925 -7.402 {"}'M' greentint -9.4381 2.2573 -7.4523 {"}'M' greentint -8.8004 3.1415 -6.8731 {"}'M' greentint -8.9572 3.0356 -7.0462 {"}'M' greentint -9.1039 2.8885 -7.196 {"}'M' greentint -9.236 2.7055 -7.316 {"}'M' greentint -8.9289 2.8708 -7.3851 {"}'M' greentint -9.0611 2.685 -7.5045 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 99 A}'M' greentint -9.7338 1.9812 -6.6075 {"}'M' greentint -9.5789 2.0783 -6.435 {"}'M' greentint -9.4376 2.2291 -6.2934 {"}'M' greentint -9.317 2.4234 -6.1917 {"}'M' greentint -9.2245 2.6494 -6.1357 {"}'M' greentint -9.6231 1.9411 -6.8828 {"}'M' greentint -9.4649 2.0048 -6.6965 {"}'M' greentint -9.3147 2.1293 -6.5367 {"}'M' greentint -9.1815 2.3049 -6.4136 {"}'M' greentint -9.0763 2.5195 -6.3358 {"}'M' greentint -9.0028 2.7593 -6.3089 {"}'M' greentint -8.9698 3.0084 -6.3343 {"}'M' greentint -9.5725 2.0001 -7.2338 {"}'M' greentint -9.4143 2.0023 -7.0301 {"}'M' greentint -9.2537 2.0783 -6.8432 {"}'M' greentint -9.1041 2.2237 -6.6908 {"}'M' greentint -8.9796 2.4236 -6.585 {"}'M' greentint -8.891 2.6612 -6.5369 {"}'M' greentint -8.8465 2.916 -6.5496 {"}'M' greentint -9.3206 2.1131 -7.2828 {"}'M' greentint -9.1583 2.1581 -7.0848 {"}'M' greentint -9.0041 2.2907 -6.9231 {"}'M' greentint -8.8798 2.494 -6.8185 {"}'M' greentint -8.8015 2.7397 -6.7864 {"}'M' greentint -8.7806 2.9951 -6.8297 {"}'M' greentint -9.2096 2.2966 -7.4532 {"}'M' greentint -9.0486 2.3247 -7.2532 {"}'M' greentint -8.9006 2.4766 -7.1044 {"}'M' greentint -8.8058 2.7108 -7.047 {"}'M' greentint -8.7895 2.9644 -7.0963 {"}'M' greentint -9.0761 2.5145 -7.5067 {"}'M' greentint -8.9162 2.6114 -7.3273 {"}'M' greentint -8.8612 2.8647 -7.3271 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 82 A}'M' greentint -9.9425 1.0819 -4.0883 {"}'M' greentint -10.0758 0.9783 -4.2878 {"}'M' greentint -9.8608 1.3285 -4.1082 {"}'M' greentint -10.0208 1.2316 -4.2876 {"}'M' greentint -10.1312 1.1322 -4.5679 {"}'M' greentint -9.5956 1.4446 -3.9635 {"}'M' greentint -9.7273 1.5464 -4.1617 {"}'M' greentint -9.8883 1.5183 -4.3617 {"}'M' greentint -10.0364 1.3663 -4.5105 {"}'M' greentint -10.1029 1.2297 -4.8215 {"}'M' greentint -10.1533 0.975 -4.8168 {"}'M' greentint -9.5389 1.7162 -4.2283 {"}'M' greentint -9.6978 1.7194 -4.4342 {"}'M' greentint -9.858 1.6283 -4.6171 {"}'M' greentint -9.9995 1.4578 -4.7527 {"}'M' greentint -10.0061 1.304 -5.0615 {"}'M' greentint -9.442 1.8509 -4.4838 {"}'M' greentint -9.6034 1.8118 -4.6817 {"}'M' greentint -9.76 1.6997 -4.8531 {"}'M' greentint -9.8986 1.525 -4.9838 {"}'M' greentint -9.4721 1.8382 -4.9184 {"}'M' greentint -9.6223 1.7137 -5.0782 {"}'M' greentint -9.7554 1.5381 -5.2013 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 99 A}'M' green -9.3693 1.8909 -4.7643 {"}'M' green -9.5061 1.7988 -5.0329 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 99 A}'M' greentint -10.0496 0.9421 -4.2506 {"}'M' greentint -9.8978 1.0628 -4.0877 {"}'M' greentint -9.7574 1.2248 -3.9517 {"}'M' greentint -10.1048 0.9465 -4.6859 {"}'M' greentint -9.9422 1.0022 -4.4918 {"}'M' greentint -9.7844 1.1124 -4.3183 {"}'M' greentint -9.639 1.2742 -4.1753 {"}'M' greentint -9.5144 1.4766 -4.0717 {"}'M' greentint -10.0304 1.0819 -4.945 {"}'M' greentint -9.8712 1.1043 -4.7445 {"}'M' greentint -9.7115 1.1929 -4.5635 {"}'M' greentint -9.5648 1.3425 -4.4159 {"}'M' greentint -9.4411 1.5423 -4.3112 {"}'M' greentint -9.3492 1.7764 -4.2579 {"}'M' greentint -9.9118 1.2638 -5.0995 {"}'M' greentint -9.753 1.2748 -4.8986 {"}'M' greentint -9.5959 1.3707 -4.7212 {"}'M' greentint -9.4575 1.5413 -4.5897 {"}'M' greentint -9.3545 1.7648 -4.5189 {"}'M' greentint -9.7775 1.4717 -5.1753 {"}'M' greentint -9.6143 1.5009 -4.9726 {"}'M' greentint -9.4646 1.6546 -4.8218 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 111 1xe7A_125F_113}P -7.0429 6.0585 -12.3517 {"}-7.0429 6.0585 -12.3517 { ca gly A 111 1xe7A_125F_113}-7.9114 6.4514 -11.265 { c gly A 111 1xe7A_125F_113}-7.8287 5.4522 -10.131 { o gly A 111 1xe7A_125F_113}-7.0882 4.4726 -10.2111 { c gly A 111 1xe7A_125F_113}P -7.8287 5.4522 -10.131 { n gln A 112 1xe7A_125F_113}-8.5877 5.7031 -9.0742 { ca gln A 112 1xe7A_125F_113}-8.5908 4.8099 -7.9295 { c gln A 112 1xe7A_125F_113}-10.0042 4.6336 -7.3945 { o gln A 112 1xe7A_125F_113}-10.7931 5.5841 -7.3346 { c gln A 112 1xe7A_125F_113}P -10.0042 4.6336 -7.3945 { n tyr A 113 1xe7A_125F_113}-10.3274 3.4039 -7.0173 { ca tyr A 113 1xe7A_125F_113}-11.6398 3.1097 -6.466 { c tyr A 113 1xe7A_125F_113}-11.5537 2.7544 -4.9941 { o tyr A 113 1xe7A_125F_113}-10.5519 2.2092 -4.5292 { c tyr A 113 1xe7A_125F_113}P -11.5537 2.7544 -4.9941 { n val A 114 1xe7A_125F_113}-12.6078 3.0969 -4.2676 { ca val A 114 1xe7A_125F_113}-12.7131 2.7889 -2.8528 { c val A 114 1xe7A_125F_113}-14.0802 2.1383 -2.676 { o val A 114 1xe7A_125F_113}-15.109 2.7139 -3.0566 { c val A 114 1xe7A_125F_113}P -14.0802 2.1383 -2.676 { n leu A 115 1xe7A_125F_113}-14.0877 0.932 -2.1153 { ca leu A 115 1xe7A_125F_113}-15.3279 0.2011 -1.8988 { c leu A 115 1xe7A_125F_113}-15.6021 -0.0096 -0.4175 { o leu A 115 1xe7A_125F_113}-14.6853 -0.2825 0.3595 { n lys A 123 1xe7A_125F_113}P -12.193 -1.4627 0.8347 {"}-12.193 -1.4627 0.8347 { ca lys A 123 1xe7A_125F_113}-11.2203 -1.9631 -0.1225 { c lys A 123 1xe7A_125F_113}-10.8664 -0.8414 -1.0979 { o lys A 123 1xe7A_125F_113}-11.7223 -0.0415 -1.4608 { c lys A 123 1xe7A_125F_113}P -10.8664 -0.8414 -1.0979 { n ser A 124 1xe7A_125F_113}-9.6055 -0.774 -1.5123 { ca ser A 124 1xe7A_125F_113}-9.1944 0.2561 -2.4604 { c ser A 124 1xe7A_125F_113}-8.1538 -0.3033 -3.419 { o ser A 124 1xe7A_125F_113}-7.2437 -1.0372 -3.0141 { c ser A 124 1xe7A_125F_113}P -8.1538 -0.3033 -3.419 { n phe A 125 1xe7A_125F_113}-8.3068 0.0252 -4.6993 { ca phe A 125 1xe7A_125F_113}-7.3895 -0.4372 -5.7273 { c phe A 125 1xe7A_125F_113}-7.2489 0.6203 -6.8122 { o phe A 125 1xe7A_125F_113}-8.1189 1.4795 -6.9773 { c phe A 125 1xe7A_125F_113}P -7.2489 0.6203 -6.8122 { n lys A 126 1xe7A_125F_113}-6.142 0.5543 -7.5416 { ca lys A 126 1xe7A_125F_113}-5.8763 1.5126 -8.6019 { c lys A 126 1xe7A_125F_113}-6.2172 0.9667 -9.9753 { o lys A 126 1xe7A_125F_113}-6.0684 -0.226 -10.2414 { c lys A 126 1xe7A_125F_113}P -6.2172 0.9667 -9.9753 { n val A 127 1xe7A_125F_113}-6.6807 1.8603 -10.8419 { ca val A 127 1xe7A_125F_113}-7.0588 1.5148 -12.2043 { c val A 127 1xe7A_125F_113}-6.0903 2.1566 -13.1939 { o val A 127 1xe7A_125F_113}-5.7955 3.3513 -13.1047 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 111 1xe7A_125F_113}P -7.0429 6.0585 -12.3517 { ca gly A 111 1xe7A_125F_113}P -7.9114 6.4514 -11.265 {"}P -7.9114 6.4514 -11.265 { n gln A 112 1xe7A_125F_113}P -8.5877 5.7031 -9.0742 { ca gln A 112 1xe7A_125F_113}P -8.5908 4.8099 -7.9295 { n tyr A 113 1xe7A_125F_113}P -10.3274 3.4039 -7.0173 { ca tyr A 113 1xe7A_125F_113}P -11.6398 3.1097 -6.466 { n val A 114 1xe7A_125F_113}P -12.6078 3.0969 -4.2676 { ca val A 114 1xe7A_125F_113}P -12.7131 2.7889 -2.8528 { n leu A 115 1xe7A_125F_113}P -14.0877 0.932 -2.1153 { ca leu A 115 1xe7A_125F_113}P -15.3279 0.2011 -1.8988 { n lys A 123 1xe7A_125F_113}P -12.193 -1.4627 0.8347 { ca lys A 123 1xe7A_125F_113}P -11.2203 -1.9631 -0.1225 { n ser A 124 1xe7A_125F_113}P -9.6055 -0.774 -1.5123 { ca ser A 124 1xe7A_125F_113}P -9.1944 0.2561 -2.4604 { n phe A 125 1xe7A_125F_113}P -8.3068 0.0252 -4.6993 { ca phe A 125 1xe7A_125F_113}P -7.3895 -0.4372 -5.7273 { n lys A 126 1xe7A_125F_113}P -6.142 0.5543 -7.5416 { ca lys A 126 1xe7A_125F_113}P -5.8763 1.5126 -8.6019 { n val A 127 1xe7A_125F_113}P -6.6807 1.8603 -10.8419 { ca val A 127 1xe7A_125F_113}P -7.0588 1.5148 -12.2043 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 111 1xe7A_125F_113}P -7.9114 6.4514 -11.265 {"}-7.9114 6.4514 -11.265 { ca gln A 112 1xe7A_125F_113}-8.5908 4.8099 -7.9295 { ca tyr A 113 1xe7A_125F_113}-11.6398 3.1097 -6.466 { ca val A 114 1xe7A_125F_113}-12.7131 2.7889 -2.8528 { ca leu A 115 1xe7A_125F_113}-15.3279 0.2011 -1.8988 { ca lys A 123 1xe7A_125F_113}-11.2203 -1.9631 -0.1225 { ca ser A 124 1xe7A_125F_113}-9.1944 0.2561 -2.4604 { ca phe A 125 1xe7A_125F_113}-7.3895 -0.4372 -5.7273 { ca lys A 126 1xe7A_125F_113}-5.8763 1.5126 -8.6019 { ca val A 127 1xe7A_125F_113}-7.0588 1.5148 -12.2043 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 113 1xe7A_125F_113}P -11.6398 3.1097 -6.466 { cb tyr A 113 1xe7A_125F_113}-12.2979 1.9491 -7.2236 { cg tyr A 113 1xe7A_125F_113}-13.0726 2.4058 -8.4312 { cd1 tyr A 113 1xe7A_125F_113}-12.4087 2.8846 -9.5572 { ce1 tyr A 113 1xe7A_125F_113}-13.1086 3.3974 -10.6393 { cz tyr A 113 1xe7A_125F_113}-14.4919 3.4314 -10.6101 { oh tyr A 113 1xe7A_125F_113}-15.1643 3.9731 -11.6802 { cg tyr A 113 1xe7A_125F_113}P -13.0726 2.4058 -8.4312 { cd2 tyr A 113 1xe7A_125F_113}-14.4695 2.4371 -8.4181 { ce2 tyr A 113 1xe7A_125F_113}-15.1862 2.9511 -9.5082 { cz tyr A 113 1xe7A_125F_113}ghost -14.4919 3.4314 -10.6101 { ca phe A 125 1xe7A_125F_113}P -7.3895 -0.4372 -5.7273 { cb phe A 125 1xe7A_125F_113}-7.8818 -1.763 -6.3317 { cg phe A 125 1xe7A_125F_113}-9.2959 -1.7117 -6.8526 { cd1 phe A 125 1xe7A_125F_113}-9.5578 -1.3734 -8.1782 { ce1 phe A 125 1xe7A_125F_113}-10.8762 -1.3129 -8.6542 { cz phe A 125 1xe7A_125F_113}-11.9361 -1.591 -7.7956 { cg phe A 125 1xe7A_125F_113}P -9.2959 -1.7117 -6.8526 { cd2 phe A 125 1xe7A_125F_113}-10.3666 -1.9875 -6.0059 { ce2 phe A 125 1xe7A_125F_113}-11.681 -1.9293 -6.4675 { cz phe A 125 1xe7A_125F_113}ghost -11.9361 -1.591 -7.7956 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 113 1xe7A_125F_113}P -12.2979 1.9491 -7.2236 {"}P -12.2979 1.9491 -7.2236 { cd1 tyr A 113 1xe7A_125F_113}P -12.4087 2.8846 -9.5572 { cd2 tyr A 113 1xe7A_125F_113}P -14.4695 2.4371 -8.4181 { ce1 tyr A 113 1xe7A_125F_113}P -13.1086 3.3974 -10.6393 { ce2 tyr A 113 1xe7A_125F_113}P -15.1862 2.9511 -9.5082 { oh tyr A 113 1xe7A_125F_113}P -15.1643 3.9731 -11.6802 { cb phe A 125 1xe7A_125F_113}P -7.8818 -1.763 -6.3317 {"}P -7.8818 -1.763 -6.3317 { cd1 phe A 125 1xe7A_125F_113}P -9.5578 -1.3734 -8.1782 { cd2 phe A 125 1xe7A_125F_113}P -10.3666 -1.9875 -6.0059 { ce1 phe A 125 1xe7A_125F_113}P -10.8762 -1.3129 -8.6542 { ce2 phe A 125 1xe7A_125F_113}P -11.681 -1.9293 -6.4675 { cz phe A 125 1xe7A_125F_113}P -11.9361 -1.591 -7.7956 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 125 A}'S' blue -10.4299 0.0144 -7.5646 {"}'S' blue -10.3566 0.1427 -7.8235 { CE1 PHE 125 A}'S' sky -11.8378 0.1406 -8.4923 {"}'S' sky -10.5056 0.2527 -7.9651 {"}'S' sky -10.9434 0.4349 -8.5811 { CZ PHE 125 A}'S' blue -12.281 -0.175 -6.8267 {"}'S' sky -12.4209 -0.0941 -7.0295 {"}'S' sky -12.5739 -0.0599 -7.2379 {"}'S' sky -12.7349 -0.0748 -7.4409 {"}'S' sky -12.0338 -0.0986 -6.8874 {"}'S' sky -12.6334 0.0108 -7.6926 {"}'S' sky -11.7682 -0.0738 -6.9401 {"}'S' sky -12.509 0.0566 -7.9345 {"}'S' sky -12.3288 0.0827 -8.1232 {"}'S' sky -11.2582 -0.1318 -7.1082 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 125 A}'S' sea -11.0988 -0.0232 -7.4927 {"}'S' green -11.2211 0.1031 -7.6852 {"}'S' green -11.675 0.2033 -8.2995 {"}'S' sea -10.8564 0.0504 -7.5575 {"}'S' green -10.9739 0.1795 -7.7459 {"}'S' green -11.4131 0.3251 -8.3539 {"}'S' sea -11.5735 0.2889 -8.5511 {"}'S' sea -10.7083 0.2043 -7.7987 {"}'S' green -10.8362 0.3073 -7.9936 {"}'S' green -10.9787 0.3732 -8.1965 {"}'S' green -11.1306 0.4003 -8.4001 {"}'S' sea -11.2882 0.3872 -8.6006 {"}'S' sea -10.64 0.3511 -8.1661 {"}'S' sea -10.7868 0.4119 -8.3738 { CZ PHE 125 A}'S' sea -12.1692 -0.0084 -7.0862 {"}'S' sea -12.3171 0.0414 -7.2912 {"}'S' sea -12.473 0.047 -7.4953 {"}'S' sea -11.8961 0.0292 -7.1351 {"}'S' green -12.0386 0.0951 -7.338 {"}'S' green -12.1905 0.1222 -7.5415 {"}'S' sea -12.3481 0.1091 -7.7421 {"}'S' sea -11.5655 -0.0254 -7.1065 {"}'S' green -11.6999 0.073 -7.3075 {"}'S' green -12.0033 0.1568 -7.7226 {"}'S' sea -12.1649 0.1394 -7.9275 {"}'S' green -11.3805 -0.0072 -7.3021 {"}'S' green -11.8244 0.1512 -7.9193 {"}'S' sea -11.9865 0.1277 -8.1219 {"}'S' sea -11.1725 -0.0539 -7.4532 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 125 A}'S' P -11.361 0.184 -7.8881 {"}'S' -11.3537 0.163 -7.899 {"}'S' P -11.514 0.2182 -8.0964 {"}'S' -11.5125 0.2138 -8.0968 {"}'S' P -11.1093 0.2697 -7.9448 {"}'S' -11.1069 0.2506 -7.9542 {"}'S' P -11.2572 0.3195 -8.1498 {"}'S' -11.2526 0.3019 -8.1548 { CZ PHE 125 A}'S' P -11.8467 0.1338 -7.5152 {"}'S' -11.8479 0.1236 -7.5162 {"}'S' P -11.5184 0.0839 -7.5045 {"}'S' -11.5203 0.0752 -7.5052 {"}'S' P -11.6675 0.1369 -7.7119 {"}'S' -11.6712 0.113 -7.7131 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 113 A}'S' blue -12.7707 0.2657 -7.1489 {"}'S' blue -12.613 0.2512 -6.942 {"}'S' sky -12.7201 0.2767 -7.5215 {"}'S' sky -12.2521 0.2286 -6.9033 {"}'S' sky -12.5994 0.3266 -7.807 {"}'S' sky -11.9818 0.2446 -6.9869 {"}'S' blue -11.819 0.3204 -6.7971 {"}'S' blue -12.4699 0.4351 -8.0855 { HB2 TYR 113 A}'S' sky -11.1462 0.1841 -7.1913 {"}'S' sky -10.6518 0.4756 -7.7184 {"}'S' sky -10.6496 0.5932 -7.9798 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 113 A}'S' sea -12.5715 0.2229 -7.3146 {"}'S' sea -12.4142 0.2066 -7.1062 {"}'S' sea -12.4573 0.2482 -7.6017 {"}'S' green -12.3049 0.2073 -7.3944 {"}'S' sea -12.1455 0.2066 -7.1866 {"}'S' sea -12.3416 0.3315 -7.8898 {"}'S' green -12.2004 0.2647 -7.6885 { HB2 TYR 113 A}'S' green -12.0217 0.1804 -7.4591 {"}'S' green -11.8697 0.1547 -7.2558 {"}'S' sea -11.7103 0.1851 -7.0586 {"}'S' sea -12.1068 0.3613 -8.0507 {"}'S' green -11.998 0.2207 -7.8716 {"}'S' green -11.5644 0.0966 -7.2764 {"}'S' sea -11.4058 0.1611 -7.0897 {"}'S' sea -11.8687 0.306 -8.1587 {"}'S' green -11.7525 0.1742 -7.9733 {"}'S' green -11.3042 0.0983 -7.3723 {"}'S' sea -11.6783 0.4093 -8.3528 {"}'S' green -11.5758 0.2565 -8.1777 {"}'S' green -11.1423 0.1297 -7.5819 {"}'S' sea -10.9842 0.2065 -7.3987 {"}'S' sea -11.4422 0.4903 -8.4364 {"}'S' green -11.3385 0.3316 -8.2585 {"}'S' green -10.8846 0.2615 -7.6528 {"}'S' sea -11.204 0.5972 -8.4667 {"}'S' green -11.1014 0.4444 -8.2917 {"}'S' green -10.9642 0.3694 -8.0922 {"}'S' green -10.8079 0.3802 -7.893 {"}'S' sea -10.9465 0.6673 -8.3838 {"}'S' sea -10.8131 0.5646 -8.1831 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 113 A}'S' P -11.8673 0.1263 -7.6766 {"}'S' -11.8635 0.1395 -7.6745 {"}'S' P -11.72 0.0846 -7.4743 {"}'S' -11.7183 0.0995 -7.4754 {"}'S' P -11.616 0.0929 -7.7732 {"}'S' -11.6145 0.1107 -7.7701 {"}'S' P -11.4636 0.0679 -7.5695 {"}'S' -11.4638 0.073 -7.5693 {"}'S' P -11.4473 0.1557 -7.9826 {"}'S' -11.4482 0.1729 -7.9758 {"}'S' P -11.3001 0.1127 -7.78 {"}'S' -11.3024 0.1254 -7.7776 {"}'S' P -11.2036 0.2367 -8.0576 {"}'S' -11.2111 0.2618 -8.0444 {"}'S' P -11.0478 0.2125 -7.8494 {"}'S' -11.0516 0.2201 -7.8478 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 125 A}'M' greentint -9.1924 2.1599 -6.3901 {"}'M' greentint -9.341 2.003 -6.5386 {"}'M' greentint -9.4447 1.9066 -6.8361 {"}'M' greentint -9.0431 2.39 -6.4523 {"}'M' greentint -9.2017 2.2969 -6.6307 {"}'M' greentint -9.3409 2.1289 -6.7639 {"}'M' greentint -9.4143 2.0006 -7.0809 {"}'M' greentint -9.4854 1.7555 -7.1051 {"}'M' greentint -9.0163 2.5209 -6.7121 {"}'M' greentint -9.1711 2.3978 -6.8768 {"}'M' greentint -9.3068 2.2203 -7.003 {"}'M' greentint -9.3364 2.0808 -7.3191 {"}'M' greentint -9.4176 1.8376 -7.3575 {"}'M' greentint -8.7734 2.6991 -6.7643 {"}'M' greentint -8.9355 2.6169 -6.9499 {"}'M' greentint -9.0877 2.481 -7.1099 {"}'M' greentint -9.2243 2.2994 -7.2347 {"}'M' greentint -9.2219 2.1256 -7.5488 {"}'M' greentint -9.3075 1.8907 -7.5934 {"}'M' greentint -8.8344 2.6632 -7.1965 {"}'M' greentint -8.9805 2.5196 -7.3464 {"}'M' greentint -9.1113 2.3376 -7.4649 {"}'M' greentint -8.9574 2.3604 -7.6715 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 113 A}'M' greentint -9.4056 1.692 -6.8533 {"}'M' greentint -9.2553 1.8165 -6.6935 {"}'M' greentint -9.1222 1.9921 -6.5704 {"}'M' greentint -9.017 2.2067 -6.4926 {"}'M' greentint -8.9435 2.4465 -6.4657 {"}'M' greentint -9.355 1.6895 -7.1869 {"}'M' greentint -9.1943 1.7655 -7 {"}'M' greentint -9.0448 1.9109 -6.8476 {"}'M' greentint -8.9202 2.1108 -6.7418 {"}'M' greentint -8.8316 2.3484 -6.6938 {"}'M' greentint -8.7871 2.6032 -6.7065 {"}'M' greentint -9.2613 1.8004 -7.4396 {"}'M' greentint -9.099 1.8453 -7.2416 {"}'M' greentint -8.9447 1.9779 -7.0799 {"}'M' greentint -8.8205 2.1812 -6.9753 {"}'M' greentint -8.7422 2.4269 -6.9432 {"}'M' greentint -8.7212 2.6823 -6.9865 {"}'M' greentint -9.1503 1.9838 -7.61 {"}'M' greentint -8.9893 2.0119 -7.41 {"}'M' greentint -8.8413 2.1638 -7.2612 {"}'M' greentint -8.7465 2.398 -7.2038 {"}'M' greentint -8.7302 2.6517 -7.2531 {"}'M' greentint -9.0168 2.2017 -7.6635 {"}'M' greentint -8.8568 2.2986 -7.4841 {"}'M' greentint -8.8019 2.5519 -7.4839 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 125 A}'M' sea -9.8293 0.7703 -4.4367 {"}'M' green -9.7477 1.0169 -4.4565 {"}'M' green -9.9076 0.92 -4.636 {"}'M' green -10.018 0.8206 -4.9162 {"}'M' green -9.4824 1.133 -4.3119 {"}'M' green -9.9897 0.918 -5.1698 {"}'M' sea -9.2909 1.3098 -4.3758 {"}'M' green -9.1772 1.5038 -4.627 {"}'M' green -9.3289 1.5393 -4.8322 {"}'M' green -9.7854 1.2134 -5.3322 {"}'M' sea -9.2007 1.5902 -5.0804 {"}'M' sea -9.3589 1.5265 -5.2668 {"}'M' sea -9.5091 1.4021 -5.4266 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 125 A}'M' greentint -9.6142 1.2347 -4.5101 {"}'M' greentint -9.7752 1.2067 -4.71 {"}'M' greentint -9.9232 1.0547 -4.8589 {"}'M' greentint -9.4258 1.4046 -4.5767 {"}'M' greentint -9.5846 1.4078 -4.7826 {"}'M' greentint -9.7449 1.3167 -4.9655 {"}'M' greentint -9.8863 1.1462 -5.101 {"}'M' greentint -9.4902 1.5001 -5.0301 {"}'M' greentint -9.6468 1.3881 -5.2014 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 113 A}'M' sea -10.0765 0.893 -4.5838 {"}'M' green -9.9184 0.967 -4.4 {"}'M' green -10.1308 0.976 -5.041 {"}'M' green -9.9737 0.9714 -4.8353 {"}'M' green -9.5079 1.299 -4.3247 {"}'M' sea -10.0473 1.1538 -5.2989 {"}'M' sea -9.31 1.5671 -4.4606 {"}'M' sea -9.919 1.3655 -5.4504 {"}'M' green -9.7807 1.2887 -5.2489 {"}'M' green -9.3263 1.5661 -4.7391 {"}'M' green -9.6464 1.4966 -5.3247 {"}'M' green -9.4832 1.5258 -5.1221 {"}'M' green -9.3334 1.6795 -4.9712 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 113 A}'M' greentint -9.811 1.0271 -4.6412 {"}'M' greentint -9.6532 1.1373 -4.4677 {"}'M' greentint -9.8993 1.1068 -5.0944 {"}'M' greentint -9.7401 1.1292 -4.8939 {"}'M' greentint -9.5804 1.2178 -4.7129 {"}'M' greentint -9.4337 1.3674 -4.5654 {"}'M' greentint -9.6218 1.2997 -5.048 {"}'M' greentint -9.4648 1.3956 -4.8707 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n glu A 522 1xkzA_544Y_524}P -6.9163 6.2119 -11.6565 {"}-6.9163 6.2119 -11.6565 { ca glu A 522 1xkzA_544Y_524}-8.2971 6.2332 -11.122 { c glu A 522 1xkzA_544Y_524}-8.1823 5.4358 -9.7988 { o glu A 522 1xkzA_544Y_524}-7.7217 4.2663 -9.8183 { c glu A 522 1xkzA_544Y_524}P -8.1823 5.4358 -9.7988 { n leu A 523 1xkzA_544Y_524}-8.6467 6.0272 -8.6974 { ca leu A 523 1xkzA_544Y_524}-8.6044 5.3669 -7.3832 { c leu A 523 1xkzA_544Y_524}-10.0386 5.0343 -6.9623 { o leu A 523 1xkzA_544Y_524}-10.9071 5.8997 -6.9387 { c leu A 523 1xkzA_544Y_524}P -10.0386 5.0343 -6.9623 { n tyr A 524 1xkzA_544Y_524}-10.2592 3.7777 -6.5788 { ca tyr A 524 1xkzA_544Y_524}-11.5972 3.3133 -6.174 { c tyr A 524 1xkzA_544Y_524}-11.439 2.7319 -4.7792 { o tyr A 524 1xkzA_544Y_524}-10.3361 2.2934 -4.4124 { c tyr A 524 1xkzA_544Y_524}P -11.439 2.7319 -4.7792 { n gly A 525 1xkzA_544Y_524}-12.4786 2.8484 -3.9625 { ca gly A 525 1xkzA_544Y_524}-12.3458 2.2993 -2.6407 { c gly A 525 1xkzA_544Y_524}-13.498 2.5632 -1.7397 { o gly A 525 1xkzA_544Y_524}-14.3626 3.3506 -2.0519 { c gly A 525 1xkzA_544Y_524}P -13.498 2.5632 -1.7397 { n lys A 526 1xkzA_544Y_524}-13.4832 1.8985 -0.5903 { ca lys A 526 1xkzA_544Y_524}-14.5578 2.0707 0.3897 { c lys A 526 1xkzA_544Y_524}-13.951 2.0734 1.7978 { o lys A 526 1xkzA_544Y_524}-13.1903 1.1886 2.1236 { n val A 542 1xkzA_544Y_524}P -10.5014 -0.2612 1.6319 {"}-10.5014 -0.2612 1.6319 { ca val A 542 1xkzA_544Y_524}-10.3272 -1.3415 0.664 { c val A 542 1xkzA_544Y_524}-10.6441 -0.8169 -0.7279 { o val A 542 1xkzA_544Y_524}-11.6971 -0.1613 -0.936 { c val A 542 1xkzA_544Y_524}P -10.6441 -0.8169 -0.7279 { n gly A 543 1xkzA_544Y_524}-9.7602 -1.0839 -1.6906 { ca gly A 543 1xkzA_544Y_524}-10.0566 -0.5982 -3.0183 { c gly A 543 1xkzA_544Y_524}-9.1 -1.123 -4.0774 { o gly A 543 1xkzA_544Y_524}-8.5067 -2.2185 -3.9171 { c gly A 543 1xkzA_544Y_524}P -9.1 -1.123 -4.0774 { n tyr A 544 1xkzA_544Y_524}-9.0377 -0.3703 -5.1791 { ca tyr A 544 1xkzA_544Y_524}-8.15 -0.6837 -6.2919 { c tyr A 544 1xkzA_544Y_524}-7.7779 0.5646 -7.0165 { o tyr A 544 1xkzA_544Y_524}-8.5 1.5608 -6.9254 { c tyr A 544 1xkzA_544Y_524}P -7.7779 0.5646 -7.0165 { n val A 545 1xkzA_544Y_524}-6.6167 0.5155 -7.686 { ca val A 545 1xkzA_544Y_524}-6.1429 1.6493 -8.4831 { c val A 545 1xkzA_544Y_524}-5.8939 1.1556 -9.9013 { o val A 545 1xkzA_544Y_524}-5.3779 0.0604 -10.1132 { c val A 545 1xkzA_544Y_524}P -5.8939 1.1556 -9.9013 { n ile A 546 1xkzA_544Y_524}-6.3345 1.9543 -10.8669 { ca ile A 546 1xkzA_544Y_524}-6.1052 1.6524 -12.2788 { c ile A 546 1xkzA_544Y_524}-5.1743 2.7365 -12.8039 { o ile A 546 1xkzA_544Y_524}-5.457 3.9223 -12.7279 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 522 1xkzA_544Y_524}P -6.9163 6.2119 -11.6565 { ca glu A 522 1xkzA_544Y_524}P -8.2971 6.2332 -11.122 { n leu A 523 1xkzA_544Y_524}P -8.6467 6.0272 -8.6974 { ca leu A 523 1xkzA_544Y_524}P -8.6044 5.3669 -7.3832 { n tyr A 524 1xkzA_544Y_524}P -10.2592 3.7777 -6.5788 { ca tyr A 524 1xkzA_544Y_524}P -11.5972 3.3133 -6.174 { n gly A 525 1xkzA_544Y_524}P -12.4786 2.8484 -3.9625 { ca gly A 525 1xkzA_544Y_524}P -12.3458 2.2993 -2.6407 {"}P -12.3458 2.2993 -2.6407 { n lys A 526 1xkzA_544Y_524}P -13.4832 1.8985 -0.5903 { ca lys A 526 1xkzA_544Y_524}P -14.5578 2.0707 0.3897 { n val A 542 1xkzA_544Y_524}P -10.5014 -0.2612 1.6319 { ca val A 542 1xkzA_544Y_524}P -10.3272 -1.3415 0.664 { n gly A 543 1xkzA_544Y_524}P -9.7602 -1.0839 -1.6906 { ca gly A 543 1xkzA_544Y_524}P -10.0566 -0.5982 -3.0183 {"}P -10.0566 -0.5982 -3.0183 { n tyr A 544 1xkzA_544Y_524}P -9.0377 -0.3703 -5.1791 { ca tyr A 544 1xkzA_544Y_524}P -8.15 -0.6837 -6.2919 { n val A 545 1xkzA_544Y_524}P -6.6167 0.5155 -7.686 { ca val A 545 1xkzA_544Y_524}P -6.1429 1.6493 -8.4831 { n ile A 546 1xkzA_544Y_524}P -6.3345 1.9543 -10.8669 { ca ile A 546 1xkzA_544Y_524}P -6.1052 1.6524 -12.2788 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca glu A 522 1xkzA_544Y_524}P -8.2971 6.2332 -11.122 {"}-8.2971 6.2332 -11.122 { ca leu A 523 1xkzA_544Y_524}-8.6044 5.3669 -7.3832 { ca tyr A 524 1xkzA_544Y_524}-11.5972 3.3133 -6.174 { ca gly A 525 1xkzA_544Y_524}-12.3458 2.2993 -2.6407 { ca lys A 526 1xkzA_544Y_524}-14.5578 2.0707 0.3897 { ca val A 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{"}'S' sky -11.1979 -0.1085 -6.9679 {"}'S' sky -11.3595 -0.1259 -7.1728 {"}'S' blue -10.8621 -0.1284 -6.9572 {"}'S' sky -11.019 -0.1141 -7.1647 {"}'S' blue -11.1811 -0.1375 -7.3673 { CD2 TYR 544 A}'S' blue -10.9125 0.0825 -7.8158 {"}'S' blue -11.0314 0.2092 -8.0055 {"}'S' blue -10.7105 0.2476 -7.8714 {"}'S' blue -10.832 0.3696 -8.0636 {"}'S' blue -10.9743 0.4399 -8.2656 {"}'S' blue -10.4791 0.3594 -7.9224 {"}'S' blue -10.6013 0.4857 -8.1149 {"}'S' blue -10.6375 0.7021 -8.5794 {"}'S' sky -10.7934 0.7077 -8.7835 {"}'S' sky -10.5109 0.7829 -8.8298 {"}'S' blue -10.1671 0.7945 -8.8035 {"}'S' sky -10.3237 0.8175 -9.0108 {"}'S' blue -10.1448 0.8119 -9.2076 {"}'S' sky -10.3069 0.7884 -9.4101 {"}'S' sky -10.4705 0.727 -9.6044 { CE1 TYR 544 A}'S' blue -12.511 0.0445 -6.9878 {"}'S' blue -12.6629 0.0717 -7.1913 {"}'S' blue -12.0379 -0.0759 -6.7564 {"}'S' blue -12.1723 0.0225 -6.9573 {"}'S' blue -12.3191 0.0833 -7.165 {"}'S' blue -12.4757 0.1063 -7.3724 {"}'S' blue -11.7306 -0.1823 -6.758 {"}'S' 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0.6698 -8.914 {"}'S' green -11.9495 0.6979 -8.5586 {"}'S' green -12.0894 0.7788 -8.7615 {"}'S' green -12.2424 0.813 -8.9698 {"}'S' green -12.4035 0.7981 -9.1729 {"}'S' green -11.7024 0.7743 -8.6193 {"}'S' green -12.1416 0.9199 -9.2273 {"}'S' green -12.302 0.8837 -9.4245 {"}'S' sea -11.4368 0.7991 -8.6721 {"}'S' green -11.5647 0.9021 -8.867 {"}'S' green -11.7071 0.968 -9.0699 {"}'S' green -11.859 0.9952 -9.2735 {"}'S' green -12.0167 0.982 -9.474 {"}'S' sea -12.1775 0.9295 -9.6664 {"}'S' sea -11.2341 0.8475 -8.8385 {"}'S' green -11.3685 0.946 -9.0395 {"}'S' green -11.8335 1.0123 -9.6594 {"}'S' sea -11.9974 0.9556 -9.8551 {"}'S' green -11.0491 0.8658 -9.034 {"}'S' green -11.6551 1.0007 -9.8539 {"}'S' sea -11.8187 0.9392 -10.0481 {"}'S' green -10.8411 0.819 -9.1851 {"}'S' green -10.9782 0.9099 -9.3881 {"}'S' green -11.2845 0.9809 -9.8024 {"}'S' green -11.4462 0.9579 -10.0063 {"}'S' green -10.7659 0.8177 -9.5161 {"}'S' green -10.9135 0.8772 -9.7229 {"}'S' green -11.0694 0.8987 -9.9306 {"}'S' sea -11.231 0.8799 -10.1352 { CZ TYR 544 A}'S' sea -12.3795 0.2989 -7.6146 {"}'S' sea -12.4922 0.4367 -7.7984 {"}'S' sea -12.6201 0.5396 -7.9933 {"}'S' sea -12.1709 0.3514 -7.7738 {"}'S' sea -12.2895 0.4851 -7.9648 {"}'S' sea -12.4239 0.5835 -8.1658 {"}'S' sea -12.5707 0.6443 -8.3735 {"}'S' sea -12.7273 0.6672 -8.5808 {"}'S' sea -12.2424 0.5943 -8.3628 {"}'S' green -12.3915 0.6473 -8.5701 {"}'S' sea -12.5484 0.6616 -8.7776 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 544 A}'S' P -11.8378 0.8645 -8.8182 {"}'S' -11.8379 0.8628 -8.8196 {"}'S' P -11.9857 0.9143 -9.0232 {"}'S' -11.9818 0.8996 -9.0281 {"}'S' P -11.5153 1.0067 -9.2472 {"}'S' -11.5164 0.9883 -9.2496 {"}'S' P -11.6719 1.0297 -9.4545 {"}'S' -11.6714 1.0195 -9.455 {"}'S' P -11.187 0.9568 -9.2365 {"}'S' -11.1895 0.9428 -9.2385 {"}'S' P -11.3361 1.0098 -9.4438 {"}'S' -11.3414 0.9735 -9.4462 {"}'S' P -11.493 1.0241 -9.6513 {"}'S' -11.494 1.005 -9.65 {"}'S' P -11.1269 0.9637 -9.595 {"}'S' -11.1305 0.9525 -9.594 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 544 A}'S' blue -13.2641 0.6205 -8.7655 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 544 A}'S' sea -14.1372 0.9596 -8.3309 {"}'S' green -14.2654 1.0687 -8.5276 {"}'S' green -14.4171 1.1042 -8.7327 {"}'S' sea -14.5784 1.065 -8.9306 {"}'S' green -13.8775 0.9647 -8.3974 {"}'S' green -14.4471 1.0914 -9.1673 {"}'S' green -13.6819 0.9804 -8.578 {"}'S' green -14.2568 1.0732 -9.3455 {"}'S' green -13.4737 0.8784 -8.7093 {"}'S' green -14.043 1.0041 -9.4802 {"}'S' green -13.3573 0.7923 -8.9338 {"}'S' green -13.4855 0.9014 -9.1305 {"}'S' green -13.6372 0.9369 -9.3357 {"}'S' green -13.7989 0.897 -9.534 @dotlist {x} color= red width= 1 master= {H-bonds} { HH TYR 544 A}'S' greentint -13.9947 1.0894 -8.5826 {"}'S' greentint -14.1346 1.1544 -8.7819 {"}'S' greentint -14.2889 1.1552 -8.981 {"}'S' greentint -13.8029 1.0932 -8.7656 {"}'S' greentint -13.9456 1.1483 -8.9647 {"}'S' greentint -14.0997 1.1415 -9.1618 {"}'S' greentint -13.5909 1.003 -8.8945 {"}'S' greentint -13.7313 1.0673 -9.0942 {"}'S' greentint -13.8856 1.068 -9.2934 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 524 A}'S' blue -12.9531 0.761 -7.5848 {"}'S' blue -12.83 0.6363 -7.3914 {"}'S' blue -12.5434 0.4931 -6.9807 {"}'S' sky -12.8571 0.8791 -7.9282 {"}'S' sky -12.7521 0.7213 -7.7487 {"}'S' sky -12.6303 0.596 -7.5552 {"}'S' sky -12.4928 0.5041 -7.3532 {"}'S' blue -12.3441 0.4504 -7.1463 {"}'S' blue -12.1869 0.434 -6.9379 {"}'S' sky -12.6086 0.8188 -8.0191 {"}'S' sky -12.2299 0.4756 -7.4335 {"}'S' blue -12.0776 0.4348 -7.2262 {"}'S' sky -11.9731 0.4921 -7.5202 {"}'S' sky -12.0294 0.7394 -8.0535 {"}'S' sky -11.9024 0.6307 -7.8586 {"}'S' sky -11.793 0.822 -8.1286 {"}'S' blue -11.6617 0.7167 -7.9303 {"}'S' blue -11.5545 0.9281 -8.167 { CG TYR 524 A}'S' sky -13.0286 0.9595 -8.4133 {"}'S' sky -12.8766 0.9182 -8.2047 {"}'S' blue -13.0165 0.9878 -8.8339 {"}'S' sky -12.8167 0.9475 -8.9977 {"}'S' sky -12.6852 1.0212 -9.2774 {"}'S' sky -11.9409 0.8236 -8.261 {"}'S' sky -12.5408 1.1534 -9.5425 {"}'S' sky -12.3253 1.2369 -9.6772 { CD1 TYR 524 A}'S' sky -12.022 1.2579 -9.886 {"}'S' sky -11.1296 1.0606 -8.6776 {"}'S' sky -11.821 1.2182 -10.0499 {"}'S' blue -10.77 1.1103 -8.6606 {"}'S' sky -10.6605 1.0448 -8.93 {"}'S' blue -10.5021 1.1586 -8.7566 {"}'S' sky -11.3122 1.1596 -10.2178 {"}'S' sky -10.4136 1.1119 -9.0436 {"}'S' blue -10.2613 1.2362 -8.8809 {"}'S' sky -10.9713 1.1276 -10.1597 {"}'S' sky -10.5175 1.0494 -9.5508 {"}'S' sky -10.3561 1.1083 -9.359 {"}'S' blue -10.1982 1.2083 -9.183 {"}'S' blue -10.2642 1.1811 -9.6191 { CD2 TYR 524 A}'S' blue -12.9267 1.0459 -9.2217 {"}'S' blue -12.8355 1.1396 -9.4893 { CE1 TYR 524 A}'S' blue -11.6308 1.249 -10.4378 {"}'S' blue -11.432 1.2043 -10.6019 {"}'S' blue -11.2699 1.2264 -10.3991 { HB2 TYR 524 A}'S' sky -11.9816 0.3791 -7.1062 {"}'S' sky -11.8442 0.2976 -6.9067 {"}'S' blue -11.6923 0.2718 -6.7034 {"}'S' sky -11.9293 0.4785 -7.4983 {"}'S' sky -11.8205 0.3378 -7.3192 {"}'S' sky -11.6898 0.2434 -7.1242 {"}'S' blue -11.5425 0.2017 -6.9219 {"}'S' blue -11.387 0.2137 -6.724 {"}'S' blue -11.2284 0.2782 -6.5373 {"}'S' sky -11.7789 0.5993 -7.7697 {"}'S' sky -11.6913 0.4231 -7.6063 {"}'S' blue -11.5751 0.2914 -7.4209 {"}'S' sky -11.4385 0.21 -7.2208 {"}'S' sky -11.2861 0.185 -7.0171 {"}'S' sky -11.1268 0.2155 -6.8198 {"}'S' blue -11.572 0.7228 -7.9457 {"}'S' blue -11.5009 0.5264 -7.8003 {"}'S' blue -11.3983 0.3736 -7.6253 {"}'S' blue -11.2699 0.2729 -7.4301 {"}'S' sky -11.1226 0.2298 -7.2276 {"}'S' blue -10.9644 0.2476 -7.0291 {"}'S' blue -11.3292 0.8164 -8.0266 {"}'S' blue -11.2647 0.6075 -7.884 {"}'S' blue -11.1611 0.4487 -7.706 {"}'S' blue -11.0262 0.3539 -7.5051 {"}'S' sky -10.8704 0.3296 -7.2969 {"}'S' blue -10.7071 0.3786 -7.1004 {"}'S' blue -11.0265 0.7144 -7.9143 {"}'S' blue -10.9239 0.5616 -7.7392 {"}'S' blue -10.7868 0.4866 -7.5398 {"}'S' blue -10.6305 0.4973 -7.3405 {"}'S' blue -10.7691 0.7845 -7.8313 {"}'S' blue -10.6357 0.6817 -7.6307 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 524 A}'S' sea -12.4987 0.6697 -7.8349 {"}'S' sea -12.372 0.554 -7.6387 {"}'S' sea -12.3544 0.8019 -8.1001 {"}'S' sea -12.2426 0.6626 -7.9172 {"}'S' sea -12.1142 0.559 -7.7216 { CG TYR 524 A}'S' sea -12.8789 0.8976 -8.6304 {"}'S' sea -12.7298 0.8446 -8.4231 {"}'S' sea -12.5721 0.8302 -8.2162 {"}'S' sea -12.6793 0.8557 -8.7957 {"}'S' green -12.5306 0.8019 -8.5888 {"}'S' sea -12.3733 0.7855 -8.3803 {"}'S' sea -12.2112 0.8076 -8.1775 {"}'S' sea -12.5585 0.9055 -9.0811 {"}'S' green -12.4164 0.8271 -8.8759 {"}'S' green -12.264 0.7863 -8.6686 {"}'S' sea -12.1046 0.7856 -8.4608 {"}'S' sea -12.4291 1.0141 -9.3597 {"}'S' green -12.3007 0.9105 -9.164 {"}'S' green -12.1595 0.8437 -8.9627 {"}'S' green -12.0072 0.8159 -8.7584 {"}'S' green -11.8496 0.8276 -8.5576 {"}'S' sea -11.6893 0.878 -8.3653 {"}'S' sea -12.2158 1.0909 -9.4959 {"}'S' green -12.0889 0.9822 -9.301 {"}'S' green -11.6351 0.9041 -8.692 {"}'S' sea -11.4737 0.963 -8.5002 {"}'S' green -11.8482 1.0682 -9.3727 {"}'S' green -11.7018 1.0095 -9.166 {"}'S' green -11.544 0.9978 -8.9597 {"}'S' sea -11.3818 1.0357 -8.7604 { CD1 TYR 524 A}'S' green -11.8989 1.1332 -9.6926 {"}'S' green -11.7613 1.043 -9.4892 {"}'S' green -11.4545 0.9756 -9.075 {"}'S' green -11.2924 0.999 -8.8724 {"}'S' green -11.6991 1.0929 -9.8564 {"}'S' green -11.0936 0.953 -9.0363 {"}'S' sea -10.9313 1.0138 -8.8419 {"}'S' sea -11.5676 1.1666 -10.1361 {"}'S' green -11.4409 1.0509 -9.9399 {"}'S' green -10.987 0.931 -9.3196 {"}'S' sea -10.8232 0.969 -9.1198 {"}'S' green -11.1831 1.0559 -10.0227 {"}'S' green -11.0419 0.9891 -9.8214 {"}'S' green -10.8896 0.9613 -9.6172 {"}'S' sea -10.732 0.973 -9.4164 {"}'S' sea -10.5717 1.0234 -9.2241 {"}'S' sea -10.8293 1.0595 -9.957 {"}'S' sea -10.6766 1.0326 -9.7523 { CD2 TYR 524 A}'S' sea -14.585 1.2644 -8.9167 {"}'S' green -14.4426 1.1985 -8.7139 {"}'S' green -14.2907 1.1713 -8.5103 {"}'S' sea -14.133 1.1845 -8.3098 {"}'S' green -14.4613 1.1813 -9.1473 {"}'S' green -13.8455 1.0938 -8.3267 {"}'S' green -14.308 1.1296 -9.3635 {"}'S' green -13.7015 0.9955 -8.5433 {"}'S' green -14.1083 1.0893 -9.5273 {"}'S' green -13.5028 0.9494 -8.7071 {"}'S' green -13.85 1.0474 -9.6108 {"}'S' green -13.7079 0.969 -9.4055 {"}'S' green -13.3962 0.9274 -8.9905 {"}'S' sea -13.2324 0.9654 -8.7907 {"}'S' sea -13.4511 0.9855 -9.4923 {"}'S' sea -13.2988 0.9577 -9.288 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG TYR 524 A}'S' P -11.9469 0.9141 -9.0983 {"}'S' -11.9489 0.9266 -9.0935 {"}'S' P -11.7937 0.888 -8.8932 {"}'S' -11.7956 0.8933 -8.8918 { CD1 TYR 524 A}'S' P -11.6122 0.99 -9.2818 {"}'S' -11.609 1.0019 -9.2836 {"}'S' P -11.5616 1.001 -9.6544 {"}'S' -11.5591 1.0136 -9.6521 {"}'S' P -11.413 0.9473 -9.4475 {"}'S' -11.4077 0.9822 -9.4448 {"}'S' P -11.2557 0.9309 -9.2391 {"}'S' -11.2547 0.9515 -9.2406 {"}'S' P -11.2988 0.9725 -9.7346 {"}'S' -11.298 0.9823 -9.7324 {"}'S' P -11.1464 0.9317 -9.5273 {"}'S' -11.1466 0.9508 -9.5251 @dotlist {x} color= white width= 1 master= {H-bonds} { CD2 TYR 524 A}'S' greentint -14.3201 1.1013 -8.943 {"}'S' greentint -14.1681 1.06 -8.7344 {"}'S' greentint -14.0084 1.057 -8.5274 {"}'S' greentint -14.1705 1.0395 -9.1601 {"}'S' greentint -14.0214 0.9865 -8.9527 {"}'S' greentint -13.8637 0.972 -8.7458 {"}'S' greentint -13.9708 0.9975 -9.3253 {"}'S' greentint -13.8221 0.9437 -9.1184 {"}'S' greentint -13.6649 0.9274 -8.91 {"}'S' greentint -13.5556 0.9281 -9.1982 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 544 A}'M' greentint -9.4101 2.2745 -6.1364 {"}'M' greentint -9.5734 2.2412 -6.3382 {"}'M' greentint -9.1284 2.4003 -5.9987 {"}'M' greentint -9.2662 2.4797 -6.1984 {"}'M' greentint -9.4242 2.4713 -6.4004 {"}'M' greentint -9.5827 2.3781 -6.5788 {"}'M' greentint -9.722 2.2102 -6.712 {"}'M' greentint -8.9419 2.5714 -6.0632 {"}'M' greentint -9.081 2.6497 -6.2644 {"}'M' greentint -9.2372 2.6604 -6.4682 {"}'M' greentint -9.3974 2.6022 -6.6602 {"}'M' greentint -9.5521 2.4791 -6.8249 {"}'M' greentint -9.6879 2.3016 -6.9511 {"}'M' greentint -8.841 2.7679 -6.3034 {"}'M' greentint -8.9939 2.8038 -6.5103 {"}'M' greentint -9.1544 2.7804 -6.7123 {"}'M' greentint -9.3165 2.6982 -6.898 {"}'M' greentint -9.4687 2.5623 -7.058 {"}'M' greentint -9.6054 2.3807 -7.1828 {"}'M' greentint -8.5999 2.8448 -6.3775 {"}'M' greentint -8.7452 2.8952 -6.5792 {"}'M' greentint -8.9004 2.8944 -6.7791 {"}'M' greentint -9.0596 2.8432 -6.9713 {"}'M' greentint -9.2154 2.7445 -7.1446 {"}'M' greentint -9.3615 2.6009 -7.2945 {"}'M' greentint -8.7426 2.9384 -6.987 {"}'M' greentint -8.9028 2.8777 -7.1767 {"}'M' greentint -9.0597 2.7718 -7.3499 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 524 A}'M' greentint -9.6651 2.0896 -6.4153 {"}'M' greentint -9.5084 2.127 -6.2234 {"}'M' greentint -9.3535 2.2242 -6.0509 {"}'M' greentint -9.692 2.1528 -6.8971 {"}'M' greentint -9.5521 2.0877 -6.6979 {"}'M' greentint -9.3978 2.087 -6.4987 {"}'M' greentint -9.2396 2.1507 -6.3124 {"}'M' greentint -9.0893 2.2752 -6.1526 {"}'M' greentint -8.9562 2.4507 -6.0295 {"}'M' greentint -9.6011 2.3609 -7.2374 {"}'M' greentint -9.4886 2.219 -7.0528 {"}'M' greentint -9.3472 2.146 -6.8498 {"}'M' greentint -9.189 2.1482 -6.646 {"}'M' greentint -9.0283 2.2242 -6.4592 {"}'M' greentint -8.8788 2.3695 -6.3068 {"}'M' greentint -8.7542 2.5695 -6.2009 {"}'M' greentint -9.3601 2.4457 -7.293 {"}'M' greentint -9.2441 2.3087 -7.1048 {"}'M' greentint -9.0953 2.259 -6.8987 {"}'M' greentint -8.933 2.3039 -6.7008 {"}'M' greentint -8.7787 2.4366 -6.539 {"}'M' greentint -8.6545 2.6399 -6.4344 {"}'M' greentint -9.116 2.5442 -7.2673 {"}'M' greentint -8.9843 2.4425 -7.0691 {"}'M' greentint -8.8233 2.4706 -6.8692 {"}'M' greentint -8.6753 2.6225 -6.7203 {"}'M' greentint -8.5804 2.8566 -6.663 {"}'M' greentint -8.955 2.8155 -7.3005 {"}'M' greentint -8.8508 2.6603 -7.1227 {"}'M' greentint -8.6908 2.7573 -6.9432 {"}'M' greentint -8.7691 2.9069 -7.1425 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 544 A}'M' green -10.2874 0.8677 -4.7347 {"}'M' green -9.7375 0.986 -4.4851 {"}'M' green -10.2846 1.1675 -5.2436 {"}'M' green -9.4955 1.0737 -4.5402 {"}'M' green -10.1866 1.2389 -5.4796 {"}'M' green -9.329 1.2506 -4.775 {"}'M' green -9.7405 1.441 -5.3586 {"}'M' green -9.8987 1.3773 -5.5449 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 544 A}'M' greentint -10.0222 0.9838 -4.5901 {"}'M' greentint -10.1539 1.0855 -4.7882 {"}'M' greentint -10.3149 1.0575 -4.9882 {"}'M' greentint -9.8306 1.1606 -4.654 {"}'M' greentint -9.9655 1.2554 -4.8549 {"}'M' greentint -10.1244 1.2586 -5.0608 {"}'M' greentint -9.5888 1.2455 -4.7085 {"}'M' greentint -9.717 1.3546 -4.9052 {"}'M' greentint -9.8686 1.3901 -5.1103 {"}'M' greentint -10.03 1.3509 -5.3082 {"}'M' greentint -9.4462 1.3753 -4.9602 {"}'M' greentint -9.5861 1.4403 -5.1595 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 524 A}'M' green -10.4688 0.9706 -4.8506 {"}'M' green -10.3236 0.9132 -4.6476 {"}'M' green -10.1683 0.9041 -4.4434 {"}'M' green -10.4263 1.1777 -5.2533 {"}'M' green -9.8608 0.9771 -4.467 {"}'M' green -9.5953 1.1113 -4.5244 {"}'M' green -9.3646 1.302 -4.5962 {"}'M' green -9.7033 1.4497 -5.3337 {"}'M' green -9.4061 1.3839 -4.9313 {"}'M' green -9.4306 1.5807 -5.2079 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 524 A}'M' greentint -10.3077 1.0557 -5.0651 {"}'M' greentint -10.1698 0.9792 -4.8659 {"}'M' greentint -10.0187 0.9532 -4.6637 {"}'M' greentint -10.1859 1.2416 -5.3238 {"}'M' greentint -10.0613 1.1234 -5.13 {"}'M' greentint -9.9151 1.0602 -4.9242 {"}'M' greentint -9.7579 1.0556 -4.7186 {"}'M' greentint -9.9571 1.3504 -5.376 {"}'M' greentint -9.8315 1.238 -5.1821 {"}'M' greentint -9.6835 1.1909 -4.9777 {"}'M' greentint -9.5243 1.2134 -4.7772 {"}'M' greentint -9.5649 1.3729 -5.1321 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 266 1xocA_268Y_417}P -12.239 -3.1051 -0.6613 {"}-12.239 -3.1051 -0.6613 { ca tyr A 266 1xocA_268Y_417}-10.8436 -2.675 -0.7816 { c tyr A 266 1xocA_268Y_417}-10.8074 -1.4726 -1.7208 { o tyr A 266 1xocA_268Y_417}-11.7128 -1.2924 -2.5448 { c tyr A 266 1xocA_268Y_417}P -10.8074 -1.4726 -1.7208 { n val A 267 1xocA_268Y_417}-9.7375 -0.7046 -1.5804 { ca val A 267 1xocA_268Y_417}-9.47 0.4716 -2.4214 { c val A 267 1xocA_268Y_417}-8.2552 0.098 -3.2647 { o val A 267 1xocA_268Y_417}-7.3613 -0.6212 -2.7998 { c val A 267 1xocA_268Y_417}P -8.2552 0.098 -3.2647 { n tyr A 268 1xocA_268Y_417}-8.2284 0.5933 -4.4963 { ca tyr A 268 1xocA_268Y_417}-7.2751 0.1491 -5.4946 { c tyr A 268 1xocA_268Y_417}-7.0368 1.2509 -6.5124 { o tyr A 268 1xocA_268Y_417}-7.7625 2.2056 -6.5772 { c tyr A 268 1xocA_268Y_417}P -7.0368 1.2509 -6.5124 { n ile A 269 1xocA_268Y_417}-5.9867 1.0873 -7.3023 { ca ile A 269 1xocA_268Y_417}-5.8367 1.826 -8.5373 { c ile A 269 1xocA_268Y_417}-6.1325 0.9221 -9.7025 { o ile A 269 1xocA_268Y_417}-5.5057 -0.1048 -9.8605 { c ile A 269 1xocA_268Y_417}P -6.1325 0.9221 -9.7025 { n gly A 270 1xocA_268Y_417}-7.0978 1.3268 -10.5059 { ca gly A 270 1xocA_268Y_417}-7.4173 0.6179 -11.7206 { c gly A 270 1xocA_268Y_417}-6.6466 1.1543 -12.9069 { o gly A 270 1xocA_268Y_417}-6.7815 2.3057 -13.2464 { n met A 415 1xocA_268Y_417}P -7.6715 5.1166 -12.2627 {"}-7.6715 5.1166 -12.2627 { ca met A 415 1xocA_268Y_417}-8.5028 5.7179 -11.2291 { c met A 415 1xocA_268Y_417}-8.2316 5.1524 -9.8664 { o met A 415 1xocA_268Y_417}-7.9023 3.9846 -9.7479 { c met A 415 1xocA_268Y_417}P -8.2316 5.1524 -9.8664 { n val A 416 1xocA_268Y_417}-8.3619 5.9946 -8.8491 { ca val A 416 1xocA_268Y_417}-8.3527 5.5293 -7.4573 { c val A 416 1xocA_268Y_417}-9.8011 5.2627 -7.0777 { o val A 416 1xocA_268Y_417}-10.6302 6.1444 -7.1253 { c val A 416 1xocA_268Y_417}P -9.8011 5.2627 -7.0777 { n met A 417 1xocA_268Y_417}-10.1255 4.0185 -6.6937 { ca met A 417 1xocA_268Y_417}-11.5363 3.6036 -6.6252 { c met A 417 1xocA_268Y_417}-11.6615 2.5224 -5.5875 { o met A 417 1xocA_268Y_417}-10.6479 2.0019 -5.1428 { c met A 417 1xocA_268Y_417}P -11.6615 2.5224 -5.5875 { n gly A 418 1xocA_268Y_417}-12.885 2.2674 -5.1424 { ca gly A 418 1xocA_268Y_417}-13.1161 1.1051 -4.2991 { c gly A 418 1xocA_268Y_417}-14.2173 0.1882 -4.7833 { o gly A 418 1xocA_268Y_417}-15.0969 0.5899 -5.5321 { c gly A 418 1xocA_268Y_417}P -14.2173 0.1882 -4.7833 { n trp A 419 1xocA_268Y_417}-14.1696 -1.0502 -4.3004 { ca trp A 419 1xocA_268Y_417}-15.2901 -2.0129 -4.404 { c trp A 419 1xocA_268Y_417}-15.9268 -2.2573 -3.043 { o trp A 419 1xocA_268Y_417}-15.2251 -2.4626 -2.0781 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 266 1xocA_268Y_417}P -12.239 -3.1051 -0.6613 { ca tyr A 266 1xocA_268Y_417}P -10.8436 -2.675 -0.7816 { n val A 267 1xocA_268Y_417}P -9.7375 -0.7046 -1.5804 { ca val A 267 1xocA_268Y_417}P -9.47 0.4716 -2.4214 { n tyr A 268 1xocA_268Y_417}P -8.2284 0.5933 -4.4963 { ca tyr A 268 1xocA_268Y_417}P -7.2751 0.1491 -5.4946 { n ile A 269 1xocA_268Y_417}P -5.9867 1.0873 -7.3023 { ca ile A 269 1xocA_268Y_417}P -5.8367 1.826 -8.5373 { n gly A 270 1xocA_268Y_417}P -7.0978 1.3268 -10.5059 { ca gly A 270 1xocA_268Y_417}P -7.4173 0.6179 -11.7206 {"}P -7.4173 0.6179 -11.7206 { n met A 415 1xocA_268Y_417}P -7.6715 5.1166 -12.2627 { ca met A 415 1xocA_268Y_417}P -8.5028 5.7179 -11.2291 { n val A 416 1xocA_268Y_417}P -8.3619 5.9946 -8.8491 { ca val A 416 1xocA_268Y_417}P -8.3527 5.5293 -7.4573 { n met A 417 1xocA_268Y_417}P -10.1255 4.0185 -6.6937 { ca met A 417 1xocA_268Y_417}P -11.5363 3.6036 -6.6252 { n gly A 418 1xocA_268Y_417}P -12.885 2.2674 -5.1424 { ca gly A 418 1xocA_268Y_417}P -13.1161 1.1051 -4.2991 {"}P -13.1161 1.1051 -4.2991 { n trp A 419 1xocA_268Y_417}P -14.1696 -1.0502 -4.3004 { ca trp A 419 1xocA_268Y_417}P -15.2901 -2.0129 -4.404 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 266 1xocA_268Y_417}P -10.8436 -2.675 -0.7816 {"}-10.8436 -2.675 -0.7816 { ca val A 267 1xocA_268Y_417}-9.47 0.4716 -2.4214 { ca tyr A 268 1xocA_268Y_417}-7.2751 0.1491 -5.4946 { ca ile A 269 1xocA_268Y_417}-5.8367 1.826 -8.5373 { ca gly A 270 1xocA_268Y_417}-7.4173 0.6179 -11.7206 { ca met A 415 1xocA_268Y_417}P -8.5028 5.7179 -11.2291 {"}-8.5028 5.7179 -11.2291 { ca val A 416 1xocA_268Y_417}-8.3527 5.5293 -7.4573 { ca met A 417 1xocA_268Y_417}-11.5363 3.6036 -6.6252 { ca gly A 418 1xocA_268Y_417}-13.1161 1.1051 -4.2991 { ca trp A 419 1xocA_268Y_417}-15.2901 -2.0129 -4.404 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 268 1xocA_268Y_417}P -7.2751 0.1491 -5.4946 { cb tyr A 268 1xocA_268Y_417}-7.7958 -1.1065 -6.1966 { cg tyr A 268 1xocA_268Y_417}-9.0332 -0.8931 -7.0292 { cd1 tyr A 268 1xocA_268Y_417}-10.2845 -0.9491 -6.4726 { ce1 tyr A 268 1xocA_268Y_417}-11.3988 -0.7542 -7.2352 { cz tyr A 268 1xocA_268Y_417}-11.2774 -0.4779 -8.5712 { oh tyr A 268 1xocA_268Y_417}-12.3905 -0.277 -9.325 { cg tyr A 268 1xocA_268Y_417}P -9.0332 -0.8931 -7.0292 { cd2 tyr A 268 1xocA_268Y_417}-8.9436 -0.6203 -8.377 { ce2 tyr A 268 1xocA_268Y_417}-10.0464 -0.4116 -9.1373 { cz tyr A 268 1xocA_268Y_417}ghost -11.2774 -0.4779 -8.5712 { ca met A 417 1xocA_268Y_417}P -11.5363 3.6036 -6.6252 { cb met A 417 1xocA_268Y_417}-12.0027 3.1003 -7.9749 { cg met A 417 1xocA_268Y_417}-13.4788 2.8149 -8.1757 { sd met A 417 1xocA_268Y_417}-14.6235 4.0162 -7.5434 { ce met A 417 1xocA_268Y_417}-14.0886 5.5105 -8.336 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 268 1xocA_268Y_417}P -7.7958 -1.1065 -6.1966 {"}P -7.7958 -1.1065 -6.1966 { cd1 tyr A 268 1xocA_268Y_417}P -10.2845 -0.9491 -6.4726 { cd2 tyr A 268 1xocA_268Y_417}P -8.9436 -0.6203 -8.377 { ce1 tyr A 268 1xocA_268Y_417}P -11.3988 -0.7542 -7.2352 { ce2 tyr A 268 1xocA_268Y_417}P -10.0464 -0.4116 -9.1373 { oh tyr A 268 1xocA_268Y_417}P -12.3905 -0.277 -9.325 { cb met A 417 1xocA_268Y_417}P -12.0027 3.1003 -7.9749 {"}P -12.0027 3.1003 -7.9749 { cg met A 417 1xocA_268Y_417}P -13.4788 2.8149 -8.1757 {"}P -13.4788 2.8149 -8.1757 { ce met A 417 1xocA_268Y_417}P -14.0886 5.5105 -8.336 {"}P -14.0886 5.5105 -8.336 {"}P -14.0886 5.5105 -8.336 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 268 A}'S' blue -11.4661 0.9936 -7.1622 {"}'S' sky -11.6277 0.9761 -7.3671 {"}'S' sky -11.7916 0.9194 -7.5628 {"}'S' sky -11.2872 0.988 -7.3589 {"}'S' sky -11.0786 0.9448 -7.5101 { CE2 TYR 268 A}'S' blue -10.3913 1.0044 -8.1684 {"}'S' blue -10.2796 1.171 -8.4279 {"}'S' sky -10.4275 1.2208 -8.6329 {"}'S' sky -10.5834 1.2264 -8.837 {"}'S' sky -10.7438 1.1902 -9.0343 {"}'S' blue -10.9045 1.1117 -9.2189 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 268 A}'S' sea -11.4493 0.9645 -7.5615 { CZ TYR 268 A}'S' green -11.7621 1.019 -7.805 {"}'S' green -11.9151 1.0532 -8.0134 {"}'S' green -12.0762 1.0383 -8.2164 {"}'S' green -11.3751 1.0145 -7.6629 {"}'S' green -11.9747 1.1239 -8.4681 {"}'S' green -11.1095 1.0393 -7.7156 {"}'S' green -11.8503 1.1696 -8.71 {"}'S' green -10.9068 1.0877 -7.8821 {"}'S' green -11.6701 1.1958 -8.8987 {"}'S' green -10.7218 1.1059 -8.0776 {"}'S' green -11.3278 1.2408 -8.8974 {"}'S' sea -11.4914 1.1794 -9.0916 {"}'S' sea -10.6509 1.1501 -8.4317 {"}'S' green -10.7996 1.2039 -8.6386 {"}'S' green -10.9572 1.2211 -8.846 {"}'S' sea -11.1189 1.1981 -9.0499 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 268 A}'S' P -11.5105 1.1047 -7.8617 {"}'S' -11.507 1.0831 -7.8725 {"}'S' P -11.6584 1.1545 -8.0667 {"}'S' -11.6444 1.0976 -8.084 {"}'S' P -11.8143 1.1601 -8.2708 {"}'S' -11.8003 1.118 -8.278 {"}'S' P -11.2374 1.1423 -7.9106 {"}'S' -11.2386 1.1056 -7.926 {"}'S' P -11.3799 1.2082 -8.1135 {"}'S' -11.3746 1.1125 -8.1391 {"}'S' P -11.5318 1.2353 -8.317 {"}'S' -11.5165 1.1275 -8.3331 {"}'S' P -11.6894 1.2222 -8.5176 {"}'S' -11.6741 1.156 -8.5191 {"}'S' P -11.0412 1.1861 -8.0831 {"}'S' -11.0475 1.1412 -8.0968 {"}'S' P -11.188 1.2469 -8.2907 {"}'S' -11.1933 1.1477 -8.306 {"}'S' P -11.3446 1.2699 -8.4981 {"}'S' -11.3404 1.1646 -8.5025 {"}'S' P -11.5062 1.2524 -8.703 {"}'S' -11.4986 1.1948 -8.6982 {"}'S' P -10.8597 1.197 -8.2801 {"}'S' -10.8622 1.1844 -8.2823 {"}'S' P -11.0088 1.25 -8.4874 {"}'S' -11.0167 1.1986 -8.4899 {"}'S' P -11.1657 1.2643 -8.6949 {"}'S' -11.1684 1.2182 -8.6914 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 268 A}'S' blue -13.0189 0.5625 -8.3983 {"}'S' blue -13.1567 0.6418 -8.598 {"}'S' blue -12.8324 0.7336 -8.4628 {"}'S' blue -12.9716 0.8119 -8.664 {"}'S' blue -13.1277 0.8226 -8.8679 {"}'S' blue -12.5966 0.8366 -8.5023 {"}'S' sky -12.7315 0.9301 -8.703 {"}'S' sky -12.8845 0.966 -8.9099 {"}'S' blue -13.0449 0.9426 -9.112 {"}'S' blue -12.3606 0.9097 -8.5827 {"}'S' blue -12.4904 1.007 -8.7771 {"}'S' blue -12.6358 1.0574 -8.9788 {"}'S' blue -12.791 1.0565 -9.1787 {"}'S' blue -12.3242 1.0788 -8.9816 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG MET 417 A}'S' blue -13.3813 1.1305 -8.6406 {"}'S' blue -13.3107 1.2691 -8.9789 {"}'S' blue -13.1687 1.201 -8.7762 {"}'S' blue -13.0155 1.1748 -8.5711 {"}'S' blue -12.8569 1.1909 -8.37 {"}'S' blue -13.07 1.3551 -9.0507 {"}'S' sky -12.9236 1.2963 -8.8439 {"}'S' sky -12.7658 1.2846 -8.6376 {"}'S' blue -12.6036 1.3226 -8.4383 {"}'S' blue -12.4423 1.4077 -8.2526 {"}'S' blue -12.83 1.4705 -9.0891 {"}'S' blue -12.6798 1.4285 -8.8845 {"}'S' blue -12.5214 1.4404 -8.6826 { HB3 MET 417 A}'S' blue -11.7047 1.3158 -7.4405 {"}'S' blue -11.3313 1.3459 -7.3762 {"}'S' blue -12.1166 1.482 -8.8617 {"}'S' sky -10.7418 1.5029 -8.8381 {"}'S' sky -10.5782 1.5315 -8.6347 { HG3 MET 417 A}'S' blue -13.3877 0.8466 -8.2274 {"}'S' blue -13.2855 1.0543 -8.4615 {"}'S' blue -13.1484 0.9793 -8.262 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 MET 417 A}'S' green -12.0877 1.2002 -8.3135 {"}'S' green -11.9503 1.1187 -8.1141 {"}'S' green -11.7984 1.093 -7.9108 {"}'S' green -11.639 1.1234 -7.7135 {"}'S' sea -11.4806 1.2099 -7.5321 {"}'S' green -11.9266 1.159 -8.5266 {"}'S' green -11.3345 1.0994 -7.7447 {"}'S' green -11.7974 1.2443 -8.8137 {"}'S' green -11.0749 1.1224 -7.8462 {"}'S' green -11.2672 1.2699 -8.9134 {"}'S' green -10.8132 1.1998 -8.3078 {"}'S' green -10.8929 1.3077 -8.7472 {"}'S' green -10.7366 1.3185 -8.5479 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 MET 417 A}'S' P -11.7959 1.0646 -8.3316 {"}'S' -11.7803 1.1143 -8.3249 {"}'S' P -11.6486 1.0229 -8.1293 {"}'S' -11.6374 1.0924 -8.1332 {"}'S' P -11.4931 1.0349 -7.9314 {"}'S' -11.4914 1.0798 -7.9411 {"}'S' P -11.6812 1.1125 -8.6283 {"}'S' -11.6705 1.1614 -8.6078 {"}'S' P -11.5446 1.0312 -8.4282 {"}'S' -11.5359 1.1342 -8.4072 {"}'S' P -11.3923 1.0062 -8.2245 {"}'S' -11.3979 1.117 -8.2216 {"}'S' P -11.2329 1.0366 -8.0272 {"}'S' -11.2464 1.1042 -8.0372 {"}'S' P -11.5044 1.1948 -8.8327 {"}'S' -11.504 1.2122 -8.8207 {"}'S' P -11.376 1.094 -8.6375 {"}'S' -11.3812 1.1745 -8.6049 {"}'S' P -11.2287 1.051 -8.435 {"}'S' -11.2494 1.1536 -8.4131 {"}'S' P -11.0705 1.0687 -8.2365 {"}'S' -11.0963 1.1413 -8.2335 {"}'S' P -10.9128 1.1448 -8.0537 {"}'S' -10.9147 1.1484 -8.0537 {"}'S' P -11.1323 1.175 -8.7125 {"}'S' -11.1433 1.2114 -8.6932 {"}'S' P -10.9765 1.1508 -8.5043 {"}'S' -10.9949 1.1917 -8.4927 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 268 A}'M' green -8.9346 2.598 -5.9209 {"}'M' green -8.4997 3.3052 -6.1201 {"}'M' green -8.417 3.4252 -6.3642 {"}'M' green -8.8655 2.8516 -7.1488 {"}'M' green -8.4779 3.3893 -6.7965 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 268 A}'M' greentint -9.0782 2.4903 -6.1934 {"}'M' greentint -8.8359 2.8859 -5.9901 {"}'M' greentint -8.9845 2.729 -6.1386 {"}'M' greentint -9.0883 2.6327 -6.4361 {"}'M' greentint -9.1448 2.3832 -6.4393 {"}'M' greentint -8.6867 3.1161 -6.0523 {"}'M' greentint -8.8453 3.0229 -6.2307 {"}'M' greentint -8.9845 2.8549 -6.3639 {"}'M' greentint -9.0579 2.7267 -6.6809 {"}'M' greentint -9.129 2.4816 -6.7051 {"}'M' greentint -8.6599 3.2469 -6.3121 {"}'M' greentint -8.8147 3.1239 -6.4768 {"}'M' greentint -8.9504 2.9463 -6.603 {"}'M' greentint -8.98 2.8069 -6.9191 {"}'M' greentint -9.0612 2.5637 -6.9575 {"}'M' greentint -8.579 3.343 -6.5499 {"}'M' greentint -8.7313 3.207 -6.7099 {"}'M' greentint -8.8679 3.0255 -6.8347 {"}'M' greentint -8.6241 3.2457 -6.9464 {"}'M' greentint -8.7549 3.0637 -7.0648 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H MET 417 A}'M' greentint -9.0056 2.5138 -6.05 {"}'M' greentint -8.8725 2.6894 -5.9269 {"}'M' greentint -9.1053 2.3869 -6.5434 {"}'M' greentint -8.9446 2.4628 -6.3565 {"}'M' greentint -8.7951 2.6082 -6.2041 {"}'M' greentint -8.6705 2.8082 -6.0983 {"}'M' greentint -8.5819 3.0458 -6.0502 {"}'M' greentint -9.0116 2.4977 -6.7961 {"}'M' greentint -8.8493 2.5426 -6.5981 {"}'M' greentint -8.695 2.6752 -6.4364 {"}'M' greentint -8.5708 2.8786 -6.3318 {"}'M' greentint -8.4925 3.1242 -6.2997 {"}'M' greentint -8.4715 3.3797 -6.343 {"}'M' greentint -8.9006 2.6812 -6.9665 {"}'M' greentint -8.7396 2.7092 -6.7665 {"}'M' greentint -8.5916 2.8612 -6.6177 {"}'M' greentint -8.4967 3.0953 -6.5603 {"}'M' greentint -8.4805 3.349 -6.6096 {"}'M' greentint -8.7671 2.899 -7.02 {"}'M' greentint -8.6071 2.9959 -6.8406 {"}'M' greentint -8.5522 3.2492 -6.8404 {"}'M' greentint -8.6854 3.1456 -7.0399 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 268 A}'M' greentint -9.7692 1.3655 -4.4168 {"}'M' greentint -9.7142 1.6188 -4.4166 {"}'M' greentint -9.8246 1.5194 -4.6969 {"}'M' greentint -9.8409 1.2657 -4.6476 {"}'M' greentint -9.5818 1.9055 -4.4907 {"}'M' greentint -9.7298 1.7535 -4.6396 {"}'M' greentint -9.7963 1.6169 -4.9505 {"}'M' greentint -9.8467 1.3622 -4.9459 {"}'M' greentint -9.838 1.1144 -4.8655 {"}'M' greentint -9.3912 2.1066 -4.5633 {"}'M' greentint -9.5515 2.0155 -4.7461 {"}'M' greentint -9.6929 1.845 -4.8817 {"}'M' greentint -9.6995 1.6912 -5.1905 {"}'M' greentint -9.7677 1.4421 -5.2082 {"}'M' greentint -9.7882 1.1889 -5.1647 {"}'M' greentint -9.762 0.9522 -5.0646 {"}'M' greentint -9.4534 2.0869 -4.9821 {"}'M' greentint -9.592 1.9122 -5.1128 {"}'M' greentint -9.5541 1.7107 -5.4081 {"}'M' greentint -9.6276 1.4709 -5.435 {"}'M' greentint -9.6606 1.2218 -5.4096 {"}'M' greentint -9.3157 2.1009 -5.2073 {"}'M' greentint -9.4488 1.9253 -5.3303 {"}'M' greentint -9.3644 1.6967 -5.5865 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O MET 417 A}'M' greentint -9.7471 1.2315 -4.3987 {"}'M' greentint -9.6462 1.4566 -4.3311 {"}'M' greentint -9.5701 1.6997 -4.3013 {"}'M' greentint -9.7223 1.0423 -4.7147 {"}'M' greentint -9.6003 1.2389 -4.6117 {"}'M' greentint -9.502 1.4638 -4.5457 {"}'M' greentint -9.4293 1.7048 -4.5202 {"}'M' greentint -9.3874 1.9548 -4.5354 {"}'M' greentint -9.6038 1.0917 -4.9383 {"}'M' greentint -9.4792 1.2941 -4.8347 {"}'M' greentint -9.3828 1.5272 -4.7749 {"}'M' greentint -9.319 1.779 -4.7623 {"}'M' greentint -9.2917 2.0337 -4.7968 {"}'M' greentint -9.5297 1.16 -5.1789 {"}'M' greentint -9.4059 1.3598 -5.0742 {"}'M' greentint -9.3141 1.594 -5.0209 {"}'M' greentint -9.2621 1.8448 -5.0225 {"}'M' greentint -9.2522 2.095 -5.0798 {"}'M' greentint -9.5608 1.1882 -5.4843 {"}'M' greentint -9.4223 1.3588 -5.3527 {"}'M' greentint -9.3194 1.5823 -5.2819 {"}'M' greentint -9.265 1.832 -5.2816 {"}'M' greentint -9.4294 1.4721 -5.5848 {"}'M' greentint -9.3341 1.7084 -5.5273 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 96 1xqaA_98F_110V}P -11.1171 -0.5433 1.4084 {"}-11.1171 -0.5433 1.4084 { ca tyr A 96 1xqaA_98F_110V}-11.0731 -1.6035 0.417 { c tyr A 96 1xqaA_98F_110V}-10.8963 -0.8914 -0.9325 { o tyr A 96 1xqaA_98F_110V}-11.8029 -0.1953 -1.3838 { c tyr A 96 1xqaA_98F_110V}P -10.8963 -0.8914 -0.9325 { n thr A 97 1xqaA_98F_110V}-9.7141 -1.0641 -1.5364 { ca thr A 97 1xqaA_98F_110V}-9.1981 -0.1575 -2.5812 { c thr A 97 1xqaA_98F_110V}-8.5162 -0.874 -3.7481 { o thr A 97 1xqaA_98F_110V}-7.7975 -1.855 -3.557 { c thr A 97 1xqaA_98F_110V}P -8.5162 -0.874 -3.7481 { n phe A 98 1xqaA_98F_110V}-8.7055 -0.3557 -4.9591 { ca phe A 98 1xqaA_98F_110V}-7.7997 -0.694 -6.0448 { c phe A 98 1xqaA_98F_110V}-7.5321 0.5414 -6.8804 { o phe A 98 1xqaA_98F_110V}-8.2155 1.5633 -6.7388 { c phe A 98 1xqaA_98F_110V}P -7.5321 0.5414 -6.8804 { n tyr A 99 1xqaA_98F_110V}-6.5307 0.4338 -7.7395 { ca tyr A 99 1xqaA_98F_110V}-6.1695 1.5257 -8.616 { c tyr A 99 1xqaA_98F_110V}-6.2538 1.0723 -10.0735 { o tyr A 99 1xqaA_98F_110V}-6.1046 -0.1181 -10.377 { c tyr A 99 1xqaA_98F_110V}P -6.2538 1.0723 -10.0735 { n val A 100 1xqaA_98F_110V}-6.448 2.0362 -10.9655 { ca val A 100 1xqaA_98F_110V}-6.4383 1.7726 -12.3908 { c val A 100 1xqaA_98F_110V}-5.7921 2.9449 -13.1218 { o val A 100 1xqaA_98F_110V}-6.0557 4.1026 -12.803 { n ile A 108 1xqaA_98F_110V}P -6.5814 6.449 -11.2034 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0.4247 -7.749 { CG2 VAL 110 A}'S' sea -12.0114 1.0718 -9.055 {"}'S' sea -11.852 1.0711 -8.8472 {"}'S' sea -11.7546 1.1014 -9.1448 {"}'S' sea -11.597 1.1131 -8.944 {"}'S' sea -11.5416 1.1726 -9.28 { HB VAL 110 A}'S' green -12.368 0.4247 -7.7438 {"}'S' green -12.0499 0.5132 -8.2213 {"}'S' green -11.2398 0.2152 -7.0904 {"}'S' sea -11.0897 0.351 -6.9351 {"}'S' green -11.843 0.6367 -8.3973 {"}'S' green -11.0777 0.2376 -7.2979 {"}'S' sea -10.9273 0.369 -7.1393 {"}'S' green -11.6002 0.7303 -8.4782 {"}'S' sea -10.8209 0.4109 -7.3812 {"}'S' sea -11.3526 0.8396 -8.4946 {"}'S' green -11.2976 0.6283 -8.3659 {"}'S' green -11.195 0.4755 -8.1908 {"}'S' sea -11.0401 0.6984 -8.2829 {HG21 VAL 110 A}'S' sea -12.5709 0.9656 -9.5887 {"}'S' sea -12.4154 0.9776 -9.3908 {"}'S' sea -12.2568 1.0421 -9.2041 {"}'S' sea -12.4669 0.9738 -9.8876 {"}'S' green -12.3146 0.9489 -9.6838 {"}'S' green -12.1552 0.9793 -9.4866 {"}'S' green -11.9972 1.0651 -9.3056 {"}'S' sea -12.151 0.9937 -9.8944 {"}'S' green -11.9928 1.0114 -9.6959 {"}'S' green -11.8351 1.0875 -9.5131 {"}'S' sea -11.8988 1.0935 -9.9637 {"}'S' sea -11.7355 1.1424 -9.7672 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 110 A}'S' P -12.2526 0.293 -7.5578 {"}'S' -12.2332 0.3225 -7.555 {"}'S' P -12.1152 0.2115 -7.3583 {"}'S' -12.0973 0.25 -7.3613 {"}'S' P -11.9633 0.1858 -7.155 {"}'S' -11.9607 0.1926 -7.1563 {"}'S' P -12.2003 0.3924 -7.9499 {"}'S' -12.1806 0.4217 -7.9331 {"}'S' P -12.0916 0.2517 -7.7708 {"}'S' -12.0509 0.3388 -7.7419 {"}'S' P -11.9609 0.1574 -7.5758 {"}'S' -11.9257 0.2715 -7.5606 {"}'S' P -11.8135 0.1157 -7.3735 {"}'S' -11.7983 0.2092 -7.3791 {"}'S' P -11.658 0.1277 -7.1756 {"}'S' -11.6568 0.1559 -7.1821 {"}'S' P -11.9623 0.3371 -8.0579 {"}'S' -11.937 0.4052 -8.0133 {"}'S' P -11.8461 0.2053 -7.8725 {"}'S' -11.8195 0.3324 -7.8207 {"}'S' P -11.7096 0.1239 -7.6724 {"}'S' -11.6976 0.2688 -7.6429 {"}'S' P -11.5572 0.099 -7.4687 {"}'S' -11.5626 0.2061 -7.4663 {"}'S' P -11.3978 0.1294 -7.2714 {"}'S' -11.4035 0.1562 -7.2751 {"}'S' P -11.7719 0.4404 -8.252 {"}'S' -11.7682 0.4631 -8.2299 {"}'S' P -11.6693 0.2876 -8.0769 {"}'S' -11.6648 0.3737 -8.0203 {"}'S' P -11.5409 0.1868 -7.8817 {"}'S' -11.5489 0.3071 -7.833 {"}'S' P -11.3936 0.1438 -7.6792 {"}'S' -11.4135 0.2449 -7.6576 {"}'S' P -11.2355 0.1615 -7.4807 {"}'S' -11.2466 0.1938 -7.4794 {"}'S' P -11.5358 0.5214 -8.3356 {"}'S' -11.5371 0.5335 -8.3213 {"}'S' P -11.4321 0.3627 -8.1576 {"}'S' -11.4386 0.3952 -8.1312 {"}'S' P -11.2972 0.2678 -7.9567 {"}'S' -11.3129 0.3194 -7.9301 {"}'S' P -11.1414 0.2436 -7.7485 {"}'S' -11.1497 0.2621 -7.7436 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 98 A}'M' greentint -9.3876 1.9558 -6.0824 {"}'M' greentint -9.5312 1.848 -6.3549 {"}'M' greentint -9.1257 2.277 -5.9498 {"}'M' greentint -9.2889 2.2437 -6.1516 {"}'M' greentint -9.4375 2.0868 -6.3001 {"}'M' greentint -9.5412 1.9904 -6.5976 {"}'M' greentint -8.9817 2.4822 -6.0118 {"}'M' greentint -9.1397 2.4738 -6.2138 {"}'M' greentint -9.2983 2.3807 -6.3922 {"}'M' greentint -9.4375 2.2127 -6.5254 {"}'M' greentint -9.5108 2.0844 -6.8424 {"}'M' greentint -8.7966 2.6523 -6.0778 {"}'M' greentint -8.9527 2.6629 -6.2816 {"}'M' greentint -9.1129 2.6047 -6.4736 {"}'M' greentint -9.2677 2.4816 -6.6383 {"}'M' greentint -9.4034 2.3041 -6.7645 {"}'M' greentint -9.433 2.1646 -7.0806 {"}'M' greentint -8.7095 2.8063 -6.3237 {"}'M' greentint -8.8699 2.7829 -6.5257 {"}'M' greentint -9.032 2.7007 -6.7114 {"}'M' greentint -9.1843 2.5648 -6.8714 {"}'M' greentint -9.3209 2.3832 -6.9962 {"}'M' greentint -8.7751 2.8458 -6.7847 {"}'M' greentint -8.9309 2.747 -6.958 {"}'M' greentint -9.0771 2.6034 -7.1079 {"}'M' greentint -9.2079 2.4214 -7.2264 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 110 A}'M' greentint -9.5073 1.8061 -6.4476 {"}'M' greentint -9.3491 1.8698 -6.2613 {"}'M' greentint -9.1988 1.9943 -6.1014 {"}'M' greentint -9.0657 2.1699 -5.9783 {"}'M' greentint -8.9604 2.3845 -5.9006 {"}'M' greentint -9.4567 1.8651 -6.7986 {"}'M' greentint -9.2985 1.8673 -6.5948 {"}'M' greentint -9.1378 1.9433 -6.408 {"}'M' greentint -8.9883 2.0887 -6.2556 {"}'M' greentint -8.8637 2.2886 -6.1498 {"}'M' greentint -8.7751 2.5262 -6.1017 {"}'M' greentint -9.3535 2.0278 -7.0536 {"}'M' greentint -9.2048 1.9781 -6.8475 {"}'M' greentint -9.0424 2.0231 -6.6496 {"}'M' greentint -8.8882 2.1557 -6.4879 {"}'M' greentint -8.764 2.359 -6.3832 {"}'M' greentint -8.6857 2.6047 -6.3511 {"}'M' greentint -9.2255 2.2634 -7.2161 {"}'M' greentint -9.0938 2.1616 -7.018 {"}'M' greentint -8.9328 2.1897 -6.818 {"}'M' greentint -8.7847 2.3416 -6.6691 {"}'M' greentint -8.6899 2.5757 -6.6118 {"}'M' greentint -8.6736 2.8294 -6.6611 {"}'M' greentint -9.0645 2.5346 -7.2493 {"}'M' greentint -8.9603 2.3795 -7.0715 {"}'M' greentint -8.8003 2.4764 -6.8921 {"}'M' greentint -8.7454 2.7297 -6.8918 {"}'M' greentint -8.8786 2.626 -7.0913 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 98 A}'M' greentint -10.2238 0.4403 -4.598 {"}'M' greentint -10.357 0.3367 -4.7975 {"}'M' greentint -10.1421 0.6869 -4.6178 {"}'M' greentint -10.3021 0.5899 -4.7973 {"}'M' greentint -10.4125 0.4906 -5.0775 {"}'M' greentint -9.8769 0.803 -4.4732 {"}'M' greentint -10.0086 0.9047 -4.6714 {"}'M' greentint -10.1696 0.8766 -4.8714 {"}'M' greentint -10.3176 0.7247 -5.0202 {"}'M' greentint -10.3842 0.588 -5.3311 {"}'M' greentint -9.6853 0.9797 -4.5371 {"}'M' greentint -9.8202 1.0746 -4.738 {"}'M' greentint -9.9791 1.0777 -4.9439 {"}'M' greentint -10.1393 0.9867 -5.1268 {"}'M' greentint -10.2807 0.8161 -5.2623 {"}'M' greentint -10.2873 0.6623 -5.5712 {"}'M' greentint -9.7233 1.2093 -4.9935 {"}'M' greentint -9.8846 1.1701 -5.1914 {"}'M' greentint -10.0413 1.0581 -5.3628 {"}'M' greentint -10.1798 0.8833 -5.4935 {"}'M' greentint -9.7533 1.1965 -5.4281 {"}'M' greentint -9.9036 1.0721 -5.5879 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 110 A}'M' green -10.2989 0.3118 -4.6646 {"}'M' green -10.1471 0.4325 -4.5017 {"}'M' green -9.5986 1.1461 -4.6719 {"}'M' green -9.6186 1.2606 -5.1783 {"}'M' green -9.9142 1.0712 -5.6245 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 110 A}'M' greentint -10.3542 0.3162 -5.0999 {"}'M' greentint -10.1916 0.3719 -4.9058 {"}'M' greentint -10.0337 0.4822 -4.7323 {"}'M' greentint -9.8884 0.6439 -4.5893 {"}'M' greentint -9.7638 0.8463 -4.4857 {"}'M' greentint -10.2798 0.4516 -5.359 {"}'M' greentint -10.1206 0.474 -5.1585 {"}'M' greentint -9.9609 0.5626 -4.9775 {"}'M' greentint -9.8142 0.7122 -4.8299 {"}'M' greentint -9.6905 0.912 -4.7252 {"}'M' greentint -10.1612 0.6335 -5.5135 {"}'M' greentint -10.0023 0.6445 -5.3126 {"}'M' greentint -9.8453 0.7404 -5.1352 {"}'M' greentint -9.7068 0.911 -5.0037 {"}'M' greentint -9.6039 1.1345 -4.9329 {"}'M' greentint -10.0269 0.8414 -5.5893 {"}'M' greentint -9.8637 0.8706 -5.3866 {"}'M' greentint -9.7139 1.0243 -5.2358 {"}'M' greentint -9.7555 1.1685 -5.4468 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg A 104 1xrkA_106F_118}P -10.7672 -0.3736 1.5865 {"}-10.7672 -0.3736 1.5865 { ca arg A 104 1xrkA_106F_118}-10.5968 -1.4195 0.5799 { c arg A 104 1xrkA_106F_118}-10.6764 -0.7561 -0.7996 { o arg A 104 1xrkA_106F_118}-11.6525 -0.0882 -1.0985 { c arg A 104 1xrkA_106F_118}P -10.6764 -0.7561 -0.7996 { n glu A 105 1xrkA_106F_118}-9.658 -0.9334 -1.6366 { ca glu A 105 1xrkA_106F_118}-9.6062 -0.2255 -2.9048 { c glu A 105 1xrkA_106F_118}-8.7605 -0.9406 -3.9473 { o glu A 105 1xrkA_106F_118}-7.899 -1.7566 -3.6191 { c glu A 105 1xrkA_106F_118}P -8.7605 -0.9406 -3.9473 { n phe A 106 1xrkA_106F_118}-9.0066 -0.6107 -5.2083 { ca phe A 106 1xrkA_106F_118}-8.0751 -0.9291 -6.2873 { c phe A 106 1xrkA_106F_118}-7.6742 0.3627 -6.9604 { o phe A 106 1xrkA_106F_118}-8.3447 1.3785 -6.7997 { c phe A 106 1xrkA_106F_118}P -7.6742 0.3627 -6.9604 { n ala A 107 1xrkA_106F_118}-6.5324 0.3382 -7.6363 { ca ala A 107 1xrkA_106F_118}-6.067 1.4774 -8.4136 { c ala A 107 1xrkA_106F_118}-6.0426 1.1216 -9.8713 { o ala A 107 1xrkA_106F_118}-5.6597 0.0007 -10.2438 { c ala A 107 1xrkA_106F_118}P -6.0426 1.1216 -9.8713 { n leu A 108 1xrkA_106F_118}-6.4077 2.0834 -10.694 { ca leu A 108 1xrkA_106F_118}-6.389 1.9125 -12.1264 { c leu A 108 1xrkA_106F_118}-5.5236 3.011 -12.734 { o leu A 108 1xrkA_106F_118}-5.6848 4.2002 -12.3969 { n val A 116 1xrkA_106F_118}P -6.0753 6.4024 -10.7094 {"}-6.0753 6.4024 -10.7094 { ca val A 116 1xrkA_106F_118}-7.3761 6.633 -10.0912 { c val A 116 1xrkA_106F_118}-7.7 5.4713 -9.1785 { o val A 116 1xrkA_106F_118}-7.7363 4.3019 -9.6089 { c val A 116 1xrkA_106F_118}P -7.7 5.4713 -9.1785 { n his A 117 1xrkA_106F_118}-7.9628 5.7788 -7.9178 { ca his A 117 1xrkA_106F_118}-8.2457 4.7791 -6.8921 { c his A 117 1xrkA_106F_118}-9.7271 4.6683 -6.6836 { o his A 117 1xrkA_106F_118}-10.4116 5.6592 -6.5655 { c his A 117 1xrkA_106F_118}P -9.7271 4.6683 -6.6836 { n phe A 118 1xrkA_106F_118}-10.2229 3.4483 -6.6249 { ca phe A 118 1xrkA_106F_118}-11.6453 3.1769 -6.4273 { c phe A 118 1xrkA_106F_118}-11.7889 2.4711 -5.1006 { o phe A 118 1xrkA_106F_118}-11.2558 1.3872 -4.9225 { c phe A 118 1xrkA_106F_118}P -11.7889 2.4711 -5.1006 { n val A 119 1xrkA_106F_118}-12.5134 3.0966 -4.1709 { ca val A 119 1xrkA_106F_118}-12.5281 2.7048 -2.7705 { c val A 119 1xrkA_106F_118}-13.957 2.3192 -2.3626 { o val A 119 1xrkA_106F_118}-14.9161 3.026 -2.7087 { c val A 119 1xrkA_106F_118}P -13.957 2.3192 -2.3626 { n ala A 120 1xrkA_106F_118}-14.0947 1.2012 -1.6514 { ca ala A 120 1xrkA_106F_118}-15.4003 0.7561 -1.1965 { c ala A 120 1xrkA_106F_118}-15.9669 1.7145 -0.1835 { o ala A 120 1xrkA_106F_118}-15.2807 2.1221 0.7537 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 104 1xrkA_106F_118}P -10.7672 -0.3736 1.5865 { ca arg A 104 1xrkA_106F_118}P -10.5968 -1.4195 0.5799 { n glu A 105 1xrkA_106F_118}P -9.658 -0.9334 -1.6366 { ca glu A 105 1xrkA_106F_118}P -9.6062 -0.2255 -2.9048 { n phe A 106 1xrkA_106F_118}P -9.0066 -0.6107 -5.2083 { ca phe A 106 1xrkA_106F_118}P -8.0751 -0.9291 -6.2873 { n ala A 107 1xrkA_106F_118}P -6.5324 0.3382 -7.6363 { ca ala A 107 1xrkA_106F_118}P -6.067 1.4774 -8.4136 { n leu A 108 1xrkA_106F_118}P -6.4077 2.0834 -10.694 { ca leu A 108 1xrkA_106F_118}P -6.389 1.9125 -12.1264 { n val A 116 1xrkA_106F_118}P -6.0753 6.4024 -10.7094 { ca val A 116 1xrkA_106F_118}P -7.3761 6.633 -10.0912 { n his A 117 1xrkA_106F_118}P -7.9628 5.7788 -7.9178 { ca his A 117 1xrkA_106F_118}P -8.2457 4.7791 -6.8921 { n phe A 118 1xrkA_106F_118}P -10.2229 3.4483 -6.6249 { ca phe A 118 1xrkA_106F_118}P -11.6453 3.1769 -6.4273 { n val A 119 1xrkA_106F_118}P -12.5134 3.0966 -4.1709 { ca val A 119 1xrkA_106F_118}P -12.5281 2.7048 -2.7705 { n ala A 120 1xrkA_106F_118}P -14.0947 1.2012 -1.6514 { ca ala A 120 1xrkA_106F_118}P -15.4003 0.7561 -1.1965 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca arg A 104 1xrkA_106F_118}P -10.5968 -1.4195 0.5799 {"}-10.5968 -1.4195 0.5799 { ca glu A 105 1xrkA_106F_118}-9.6062 -0.2255 -2.9048 { ca phe A 106 1xrkA_106F_118}-8.0751 -0.9291 -6.2873 { ca ala A 107 1xrkA_106F_118}-6.067 1.4774 -8.4136 { ca leu A 108 1xrkA_106F_118}-6.389 1.9125 -12.1264 { ca val A 116 1xrkA_106F_118}P -7.3761 6.633 -10.0912 {"}-7.3761 6.633 -10.0912 { ca his A 117 1xrkA_106F_118}-8.2457 4.7791 -6.8921 { ca phe A 118 1xrkA_106F_118}-11.6453 3.1769 -6.4273 { ca val A 119 1xrkA_106F_118}-12.5281 2.7048 -2.7705 { ca ala A 120 1xrkA_106F_118}-15.4003 0.7561 -1.1965 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 106 1xrkA_106F_118}P -8.0751 -0.9291 -6.2873 { cb phe A 106 1xrkA_106F_118}-8.6481 -1.9347 -7.2903 { cg phe A 106 1xrkA_106F_118}-9.8214 -1.4221 -8.1257 { cd1 phe A 106 1xrkA_106F_118}-9.587 -0.71 -9.294 { ce1 phe A 106 1xrkA_106F_118}-10.6488 -0.2821 -10.0961 { cz phe A 106 1xrkA_106F_118}-11.9491 -0.5909 -9.7574 { cg phe A 106 1xrkA_106F_118}P -9.8214 -1.4221 -8.1257 { cd2 phe A 106 1xrkA_106F_118}-11.132 -1.7815 -7.8237 { ce2 phe A 106 1xrkA_106F_118}-12.2075 -1.3311 -8.6155 { cz phe A 106 1xrkA_106F_118}ghost -11.9491 -0.5909 -9.7574 { ca phe A 118 1xrkA_106F_118}P -11.6453 3.1769 -6.4273 { cb phe A 118 1xrkA_106F_118}-12.1284 2.3364 -7.6015 { cg phe A 118 1xrkA_106F_118}-12.1584 3.1121 -8.8859 { cd1 phe A 118 1xrkA_106F_118}-13.3006 3.8092 -9.2579 { ce1 phe A 118 1xrkA_106F_118}-13.3341 4.5731 -10.4026 { cz phe A 118 1xrkA_106F_118}-12.191 4.6501 -11.2039 { cg phe A 118 1xrkA_106F_118}P -12.1584 3.1121 -8.8859 { cd2 phe A 118 1xrkA_106F_118}-11.0227 3.2162 -9.6781 { ce2 phe A 118 1xrkA_106F_118}-11.0334 3.9769 -10.8404 { cz phe A 118 1xrkA_106F_118}ghost -12.191 4.6501 -11.2039 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 106 1xrkA_106F_118}P -8.6481 -1.9347 -7.2903 {"}P -8.6481 -1.9347 -7.2903 { cd1 phe A 106 1xrkA_106F_118}P -9.587 -0.71 -9.294 { cd2 phe A 106 1xrkA_106F_118}P -11.132 -1.7815 -7.8237 { ce1 phe A 106 1xrkA_106F_118}P -10.6488 -0.2821 -10.0961 { ce2 phe A 106 1xrkA_106F_118}P -12.2075 -1.3311 -8.6155 { cz phe A 106 1xrkA_106F_118}P -11.9491 -0.5909 -9.7574 { cb phe A 118 1xrkA_106F_118}P -12.1284 2.3364 -7.6015 {"}P -12.1284 2.3364 -7.6015 { cd1 phe A 118 1xrkA_106F_118}P -13.3006 3.8092 -9.2579 { cd2 phe A 118 1xrkA_106F_118}P -11.0227 3.2162 -9.6781 { ce1 phe A 118 1xrkA_106F_118}P -13.3341 4.5731 -10.4026 { ce2 phe A 118 1xrkA_106F_118}P -11.0334 3.9769 -10.8404 { cz phe A 118 1xrkA_106F_118}P -12.191 4.6501 -11.2039 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 106 A}'S' blue -10.6202 0.094 -7.771 {"}'S' blue -10.783 0.0314 -7.9639 {"}'S' blue -10.5187 0.1796 -8.0227 { CD1 PHE 106 A}'S' blue -10.5085 0.2142 -8.1276 {"}'S' blue -10.6497 0.2953 -8.334 {"}'S' blue -10.3619 0.4295 -8.2157 {"}'S' blue -10.5048 0.496 -8.4193 {"}'S' blue -10.3049 0.6602 -8.4758 { CD2 PHE 106 A}'S' blue -11.2345 -0.0954 -7.366 {"}'S' blue -11.3864 -0.0683 -7.5696 {"}'S' blue -11.0426 -0.0567 -7.5433 {"}'S' blue -11.1992 -0.0337 -7.7506 {"}'S' blue -11.0203 -0.0393 -7.9474 { CE1 PHE 106 A}'S' sky -10.9071 0.2934 -8.4633 {"}'S' sky -11.2243 1.0177 -9.0759 {"}'S' blue -11.3666 1.0881 -9.2778 {"}'S' blue -11.5209 1.1057 -9.4825 {"}'S' sky -10.7007 0.6418 -8.611 {"}'S' sky -10.8714 1.0075 -8.9347 {"}'S' blue -10.9936 1.1338 -9.1271 {"}'S' sky -11.1335 1.2148 -9.33 {"}'S' sky -11.4476 1.234 -9.7414 {"}'S' blue -11.6104 1.1714 -9.9342 {"}'S' blue -10.4564 0.7225 -8.6765 {"}'S' blue -10.5313 0.9173 -8.8268 {"}'S' blue -10.6289 1.0812 -8.9994 {"}'S' sky -10.7465 1.2102 -9.1878 {"}'S' sky -11.5068 1.2412 -10.1777 {"}'S' blue -10.4809 1.2351 -9.2406 {"}'S' blue -11.3789 1.2757 -10.4141 {"}'S' sky -10.2782 1.2835 -9.407 {"}'S' blue -11.2026 1.2978 -10.6054 {"}'S' blue -10.0932 1.3017 -9.6026 {"}'S' sky -10.8628 1.3751 -10.6166 {"}'S' blue -10.0223 1.3458 -9.9566 {"}'S' sky -10.171 1.3996 -10.1635 {"}'S' sky -10.3286 1.4169 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{"}'S' sea -12.1675 0.289 -7.9549 {"}'S' sea -11.7182 0.1008 -7.7354 {"}'S' green -11.8369 0.2345 -7.9264 {"}'S' green -11.9713 0.3329 -8.1274 {"}'S' sea -11.5296 0.1281 -7.928 {"}'S' green -11.6519 0.2527 -8.1219 {"}'S' sea -11.4439 0.2059 -8.273 { CZ PHE 106 A}'S' green -12.0729 0.533 -8.4213 {"}'S' sea -12.1718 0.6987 -8.596 {"}'S' sea -12.294 0.825 -8.7884 {"}'S' green -11.7567 0.4136 -8.3379 {"}'S' green -11.8316 0.6084 -8.4881 {"}'S' green -11.9293 0.7723 -8.6607 {"}'S' sea -12.0469 0.9014 -8.8492 {"}'S' sea -12.1823 0.9916 -9.048 {"}'S' green -11.5029 0.4242 -8.4034 {"}'S' green -11.5752 0.6195 -8.5503 {"}'S' green -11.6686 0.7885 -8.7182 {"}'S' sea -11.7812 0.9263 -8.9019 {"}'S' sea -11.9092 1.0292 -9.0969 {"}'S' sea -11.224 0.2632 -8.4128 {"}'S' green -11.2807 0.4807 -8.5467 {"}'S' green -11.3598 0.6746 -8.7025 {"}'S' green -11.4599 0.841 -8.8773 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 118 A}'S' blue -12.6881 0.7559 -8.1014 {"}'S' blue -12.5506 0.664 -7.8994 {"}'S' blue -12.402 0.6103 -7.6925 {"}'S' sky -12.6664 0.9787 -8.5653 {"}'S' sky -12.5566 0.8296 -8.3811 {"}'S' sky -12.4298 0.7139 -8.1849 {"}'S' sky -12.2878 0.6355 -7.9796 {"}'S' blue -12.5765 1.3285 -8.9597 {"}'S' sky -12.5051 1.1316 -8.8136 {"}'S' sky -12.2834 1.2244 -8.9437 {"}'S' sky -12.0468 1.3154 -9.0204 {"}'S' sky -11.7224 1.2316 -8.8963 { CG PHE 118 A}'S' blue -12.5807 1.4397 -9.1838 {"}'S' blue -12.4599 1.4896 -9.4693 {"}'S' sky -12.3178 1.4112 -9.2641 {"}'S' blue -12.2021 1.4945 -9.5522 {"}'S' sky -12.061 1.4277 -9.3508 {"}'S' sky -11.9086 1.3999 -9.1466 {"}'S' blue -11.9903 1.5662 -9.6892 {"}'S' blue -11.8483 1.4982 -9.4864 {"}'S' blue -11.6956 1.4712 -9.2818 {"}'S' blue -11.5366 1.4881 -9.0802 { CD2 PHE 118 A}'S' blue -11.6446 1.5858 -9.8107 {"}'S' sky -11.4955 1.5328 -9.6034 {"}'S' sky -11.3378 1.5184 -9.3965 {"}'S' blue -11.1757 1.5418 -9.194 {"}'S' blue -11.5824 1.6357 -10.178 {"}'S' sky -10.8146 1.5566 -9.1635 {"}'S' sky -11.3242 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1.0173 -8.4083 { HD2 PHE 118 A}'S' blue -10.2205 1.7053 -9.257 {"}'S' blue -10.1075 1.7035 -9.5395 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 118 A}'S' sea -12.4122 0.9618 -8.6463 {"}'S' sea -12.3004 0.8225 -8.4634 {"}'S' sea -12.1967 1.0453 -8.7809 {"}'S' green -12.0872 0.8993 -8.5996 {"}'S' sea -11.9615 1.1298 -8.8581 { CD2 PHE 118 A}'S' sea -11.445 1.5438 -9.976 {"}'S' sea -11.2963 1.49 -9.7691 {"}'S' sea -11.139 1.4737 -9.5607 {"}'S' sea -10.977 1.4958 -9.3578 {"}'S' green -11.1821 1.5153 -10.0562 {"}'S' green -11.0298 1.4745 -9.8489 {"}'S' green -10.8703 1.4738 -9.6411 {"}'S' sea -10.7066 1.5118 -9.4413 {"}'S' sea -11.0664 1.5987 -10.3443 {"}'S' green -10.9253 1.5318 -10.143 {"}'S' green -10.7729 1.5041 -9.9387 {"}'S' green -10.6153 1.5158 -9.7379 {"}'S' sea -10.455 1.5662 -9.5457 {"}'S' green -10.7126 1.6023 -10.2786 {"}'S' green -10.5594 1.5761 -10.0735 {"}'S' sea -10.4009 1.5922 -9.8724 {"}'S' sea -10.3097 1.686 -10.14 { HB2 PHE 118 A}'S' sea -12.1069 0.4891 -7.8391 {"}'S' sea -12.1358 0.7709 -8.3872 {"}'S' sea -12.0546 0.5885 -8.2313 {"}'S' green -11.9458 0.4478 -8.0522 {"}'S' green -11.8151 0.3534 -7.8571 {"}'S' sea -11.6678 0.3118 -7.6548 {"}'S' green -11.9606 0.921 -8.6331 {"}'S' green -11.9042 0.7093 -8.5027 {"}'S' green -11.8165 0.5332 -8.3392 {"}'S' green -11.7004 0.4014 -8.1538 {"}'S' green -11.5638 0.32 -7.9537 {"}'S' sea -11.7317 1.0604 -8.7863 {"}'S' green -11.6973 0.8328 -8.6787 {"}'S' green -11.6262 0.6365 -8.5333 {"}'S' green -11.5236 0.4837 -8.3582 {"}'S' sea -11.3952 0.3829 -8.1631 {"}'S' green -11.4545 0.9264 -8.7595 {"}'S' green -11.39 0.7175 -8.6169 {"}'S' green -11.2863 0.5588 -8.439 {"}'S' sea -11.2069 1.0357 -8.7759 {"}'S' green -11.1518 0.8244 -8.6472 {"}'S' sea -11.0492 0.6716 -8.4722 {"}'S' sea -10.9622 1.103 -8.7097 {"}'S' sea -10.8944 0.8945 -8.5643 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 106 A}'M' greentint -9.2549 2.0922 -6.0107 {"}'M' greentint -9.4181 2.0588 -6.2126 {"}'M' greentint -9.5667 1.9019 -6.361 {"}'M' greentint -9.6704 1.8056 -6.6585 {"}'M' greentint -9.1109 2.2973 -6.0727 {"}'M' greentint -9.2689 2.289 -6.2747 {"}'M' greentint -9.4275 2.1958 -6.4531 {"}'M' greentint -9.5667 2.0278 -6.5863 {"}'M' greentint -9.6401 1.8996 -6.9033 {"}'M' greentint -9.7112 1.6545 -6.9275 {"}'M' greentint -8.9258 2.4674 -6.1387 {"}'M' greentint -9.0819 2.4781 -6.3426 {"}'M' greentint -9.2421 2.4198 -6.5346 {"}'M' greentint -9.3969 2.2968 -6.6992 {"}'M' greentint -9.5326 2.1192 -6.8254 {"}'M' greentint -9.5622 1.9798 -7.1416 {"}'M' greentint -8.8387 2.6215 -6.3846 {"}'M' greentint -8.9988 2.5975 -6.586 {"}'M' greentint -9.1612 2.5159 -6.7723 {"}'M' greentint -9.3135 2.3799 -6.9323 {"}'M' greentint -9.4501 2.1984 -7.0571 {"}'M' greentint -9.4477 2.0245 -7.3712 {"}'M' greentint -8.7452 2.712 -6.6535 {"}'M' greentint -8.9043 2.6609 -6.8456 {"}'M' greentint -9.0601 2.5621 -7.019 {"}'M' greentint -9.2063 2.4186 -7.1689 {"}'M' greentint -9.3371 2.2366 -7.2873 {"}'M' greentint -8.7476 2.6953 -7.0511 {"}'M' greentint -8.9044 2.5895 -7.2242 {"}'M' greentint -9.0511 2.4423 -7.374 {"}'M' greentint -9.1832 2.2594 -7.494 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 118 A}'M' greentint -9.6232 1.6754 -6.395 {"}'M' greentint -9.4683 1.7726 -6.2226 {"}'M' greentint -9.327 1.9234 -6.081 {"}'M' greentint -9.6668 1.6361 -6.8695 {"}'M' greentint -9.5125 1.6353 -6.6704 {"}'M' greentint -9.3543 1.699 -6.4841 {"}'M' greentint -9.2041 1.8235 -6.3242 {"}'M' greentint -9.0709 1.9991 -6.2012 {"}'M' greentint -8.9657 2.2137 -6.1234 {"}'M' greentint -8.8922 2.4535 -6.0965 {"}'M' greentint -9.6033 1.7673 -7.2245 {"}'M' greentint -9.4619 1.6943 -7.0214 {"}'M' greentint -9.3037 1.6965 -6.8177 {"}'M' greentint -9.1431 1.7725 -6.6308 {"}'M' greentint -8.9935 1.9179 -6.4784 {"}'M' greentint -8.869 2.1178 -6.3726 {"}'M' greentint -8.7804 2.3554 -6.3245 {"}'M' greentint -8.7359 2.6102 -6.3372 {"}'M' greentint -9.3588 1.857 -7.2764 {"}'M' greentint -9.21 1.8074 -7.0703 {"}'M' greentint -9.0477 1.8523 -6.8724 {"}'M' greentint -8.8935 1.9849 -6.7107 {"}'M' greentint -8.7692 2.1882 -6.6061 {"}'M' greentint -8.6909 2.4339 -6.5739 {"}'M' greentint -8.67 2.6893 -6.6172 {"}'M' greentint -9.2308 2.0926 -7.4389 {"}'M' greentint -9.099 1.9909 -7.2408 {"}'M' greentint -8.938 2.0189 -7.0408 {"}'M' greentint -8.79 2.1709 -6.8919 {"}'M' greentint -8.6952 2.405 -6.8346 {"}'M' greentint -8.6789 2.6587 -6.8839 {"}'M' greentint -9.0697 2.3639 -7.4721 {"}'M' greentint -8.9655 2.2087 -7.2943 {"}'M' greentint -8.8056 2.3056 -7.1149 {"}'M' greentint -8.7506 2.5589 -7.1147 {"}'M' greentint -8.8839 2.4553 -7.3141 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 106 A}'M' green -10.6103 0.039 -4.903 {"}'M' green -10.4244 0.1304 -4.7451 {"}'M' green -10.7989 0.0893 -5.3826 {"}'M' green -10.2633 0.4016 -4.7783 {"}'M' green -10.7707 0.1867 -5.6362 {"}'M' green -10.0718 0.5784 -4.8422 {"}'M' 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{"}'M' green -10.0138 0.7451 -4.854 {"}'M' green -10.6229 0.5435 -5.8438 {"}'M' green -10.0373 0.8575 -5.3646 {"}'M' green -10.2376 0.9044 -5.7532 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 118 A}'M' greentint -10.6775 0.1494 -5.2287 {"}'M' greentint -10.5149 0.2051 -5.0345 {"}'M' greentint -10.3571 0.3153 -4.861 {"}'M' greentint -10.6032 0.2848 -5.4878 {"}'M' greentint -10.444 0.3072 -5.2873 {"}'M' greentint -10.2843 0.3958 -5.1063 {"}'M' greentint -10.1375 0.5454 -4.9587 {"}'M' greentint -10.4845 0.4667 -5.6422 {"}'M' greentint -10.3257 0.4777 -5.4414 {"}'M' greentint -10.1687 0.5736 -5.264 {"}'M' greentint -10.0302 0.7441 -5.1325 {"}'M' greentint -10.3502 0.6745 -5.718 {"}'M' greentint -10.1871 0.7038 -5.5154 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 56 1y12A_58F_125V}P -12.2231 -1.8125 0.5675 {"}-12.2231 -1.8125 0.5675 { ca leu A 56 1y12A_58F_125V}-11.0837 -2.1956 -0.2501 { c leu A 56 1y12A_58F_125V}-10.8134 -1.1023 -1.2854 { o leu A 56 1y12A_58F_125V}-11.7328 -0.6736 -1.9888 { c leu A 56 1y12A_58F_125V}P -10.8134 -1.1023 -1.2854 { n ser A 57 1y12A_58F_125V}-9.555 -0.6664 -1.3653 { ca ser A 57 1y12A_58F_125V}-9.1032 0.3372 -2.3371 { c ser A 57 1y12A_58F_125V}-8.2947 -0.325 -3.4409 { o ser A 57 1y12A_58F_125V}-7.4906 -1.216 -3.1792 { c ser A 57 1y12A_58F_125V}P -8.2947 -0.325 -3.4409 { n phe A 58 1y12A_58F_125V}-8.4927 0.1189 -4.6741 { ca phe A 58 1y12A_58F_125V}-7.6445 -0.3199 -5.7745 { c phe A 58 1y12A_58F_125V}-7.3952 0.8009 -6.785 { o phe A 58 1y12A_58F_125V}-8.1784 1.7618 -6.8905 { c phe A 58 1y12A_58F_125V}P -7.3952 0.8009 -6.785 { n thr A 59 1y12A_58F_125V}-6.292 0.6733 -7.5209 { ca thr A 59 1y12A_58F_125V}-5.9237 1.6372 -8.5481 { c thr A 59 1y12A_58F_125V}-6.0854 0.9662 -9.9079 { o thr A 59 1y12A_58F_125V}-5.7396 -0.1993 -10.08 { c thr A 59 1y12A_58F_125V}P -6.0854 0.9662 -9.9079 { n lys A 60 1y12A_58F_125V}-6.62 1.7199 -10.8636 { ca lys A 60 1y12A_58F_125V}-6.907 1.2257 -12.206 { c lys A 60 1y12A_58F_125V}-6.5904 2.3271 -13.2106 { o lys A 60 1y12A_58F_125V}-6.4305 3.4882 -12.835 { n glu A 123 1y12A_58F_125V}P -6.8903 6.1186 -11.7808 {"}-6.8903 6.1186 -11.7808 { ca glu A 123 1y12A_58F_125V}-7.8309 6.5558 -10.7568 { c glu A 123 1y12A_58F_125V}-7.9155 5.5446 -9.6281 { o glu A 123 1y12A_58F_125V}-7.6067 4.372 -9.8167 { c glu A 123 1y12A_58F_125V}P -7.9155 5.5446 -9.6281 { n asn A 124 1y12A_58F_125V}-8.3363 6.013 -8.4578 { ca asn A 124 1y12A_58F_125V}-8.5087 5.1447 -7.3025 { c asn A 124 1y12A_58F_125V}-9.9853 4.9313 -7.0196 { o asn A 124 1y12A_58F_125V}-10.7773 5.8863 -7.0163 { c asn A 124 1y12A_58F_125V}P -9.9853 4.9313 -7.0196 { n val A 125 1y12A_58F_125V}-10.3431 3.6799 -6.7702 { ca val A 125 1y12A_58F_125V}-11.7165 3.3081 -6.464 { c val A 125 1y12A_58F_125V}-11.7455 2.6326 -5.0969 { o val A 125 1y12A_58F_125V}-10.8123 1.9013 -4.7396 { c val A 125 1y12A_58F_125V}P -11.7455 2.6326 -5.0969 { n thr A 126 1y12A_58F_125V}-12.7978 2.8834 -4.3179 { ca thr A 126 1y12A_58F_125V}-12.9886 2.1293 -3.0754 { c thr A 126 1y12A_58F_125V}-14.3295 1.397 -3.0679 { o thr A 126 1y12A_58F_125V}-15.3239 1.887 -3.6144 { c thr A 126 1y12A_58F_125V}P -14.3295 1.397 -3.0679 { n leu A 127 1y12A_58F_125V}-14.3373 0.212 -2.4595 { ca leu A 127 1y12A_58F_125V}-15.5055 -0.6476 -2.4365 { c leu A 127 1y12A_58F_125V}-15.9048 -0.9573 -0.996 { o leu A 127 1y12A_58F_125V}-15.0646 -1.2762 -0.1576 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 56 1y12A_58F_125V}P -12.2231 -1.8125 0.5675 { ca leu A 56 1y12A_58F_125V}P -11.0837 -2.1956 -0.2501 { n ser A 57 1y12A_58F_125V}P -9.555 -0.6664 -1.3653 { ca ser A 57 1y12A_58F_125V}P -9.1032 0.3372 -2.3371 { n phe A 58 1y12A_58F_125V}P -8.4927 0.1189 -4.6741 { ca phe A 58 1y12A_58F_125V}P -7.6445 -0.3199 -5.7745 { n thr A 59 1y12A_58F_125V}P -6.292 0.6733 -7.5209 { ca thr A 59 1y12A_58F_125V}P -5.9237 1.6372 -8.5481 { n lys A 60 1y12A_58F_125V}P -6.62 1.7199 -10.8636 { ca lys A 60 1y12A_58F_125V}P -6.907 1.2257 -12.206 { n glu A 123 1y12A_58F_125V}P -6.8903 6.1186 -11.7808 { ca glu A 123 1y12A_58F_125V}P -7.8309 6.5558 -10.7568 { n asn A 124 1y12A_58F_125V}P -8.3363 6.013 -8.4578 { ca asn A 124 1y12A_58F_125V}P -8.5087 5.1447 -7.3025 { n val A 125 1y12A_58F_125V}P -10.3431 3.6799 -6.7702 { ca val A 125 1y12A_58F_125V}P -11.7165 3.3081 -6.464 { n thr A 126 1y12A_58F_125V}P -12.7978 2.8834 -4.3179 { ca thr A 126 1y12A_58F_125V}P -12.9886 2.1293 -3.0754 { n leu A 127 1y12A_58F_125V}P -14.3373 0.212 -2.4595 { ca leu A 127 1y12A_58F_125V}P -15.5055 -0.6476 -2.4365 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 56 1y12A_58F_125V}P -11.0837 -2.1956 -0.2501 {"}-11.0837 -2.1956 -0.2501 { ca ser A 57 1y12A_58F_125V}-9.1032 0.3372 -2.3371 { ca phe A 58 1y12A_58F_125V}-7.6445 -0.3199 -5.7745 { ca thr A 59 1y12A_58F_125V}-5.9237 1.6372 -8.5481 { ca lys A 60 1y12A_58F_125V}-6.907 1.2257 -12.206 { ca glu A 123 1y12A_58F_125V}P -7.8309 6.5558 -10.7568 {"}-7.8309 6.5558 -10.7568 { ca asn A 124 1y12A_58F_125V}-8.5087 5.1447 -7.3025 { ca val A 125 1y12A_58F_125V}-11.7165 3.3081 -6.464 { ca thr A 126 1y12A_58F_125V}-12.9886 2.1293 -3.0754 { ca leu A 127 1y12A_58F_125V}-15.5055 -0.6476 -2.4365 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 58 1y12A_58F_125V}P -7.6445 -0.3199 -5.7745 { cb phe A 58 1y12A_58F_125V}-8.1907 -1.6017 -6.4438 { cg phe A 58 1y12A_58F_125V}-9.4378 -1.3888 -7.2725 { cd1 phe A 58 1y12A_58F_125V}-9.351 -1.205 -8.65 { ce1 phe A 58 1y12A_58F_125V}-10.501 -1.0161 -9.4275 { cz phe A 58 1y12A_58F_125V}-11.7524 -1.0075 -8.8261 { cg phe A 58 1y12A_58F_125V}P -9.4378 -1.3888 -7.2725 { cd2 phe A 58 1y12A_58F_125V}-10.6986 -1.3879 -6.6752 { ce2 phe A 58 1y12A_58F_125V}-11.8552 -1.1961 -7.4419 { cz phe A 58 1y12A_58F_125V}ghost -11.7524 -1.0075 -8.8261 { ca val A 125 1y12A_58F_125V}P -11.7165 3.3081 -6.464 { cb val A 125 1y12A_58F_125V}-12.2996 2.3585 -7.5414 { cg1 val A 125 1y12A_58F_125V}-13.7259 1.9085 -7.165 { cb val A 125 1y12A_58F_125V}P -12.2996 2.3585 -7.5414 { cg2 val A 125 1y12A_58F_125V}-12.3054 3.0362 -8.9328 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 58 1y12A_58F_125V}P -8.1907 -1.6017 -6.4438 {"}P -8.1907 -1.6017 -6.4438 { cd1 phe A 58 1y12A_58F_125V}P -9.351 -1.205 -8.65 { cd2 phe A 58 1y12A_58F_125V}P -10.6986 -1.3879 -6.6752 { ce1 phe A 58 1y12A_58F_125V}P -10.501 -1.0161 -9.4275 { ce2 phe A 58 1y12A_58F_125V}P -11.8552 -1.1961 -7.4419 { cz phe A 58 1y12A_58F_125V}P -11.7524 -1.0075 -8.8261 { cb val A 125 1y12A_58F_125V}P -12.2996 2.3585 -7.5414 { cg1 val A 125 1y12A_58F_125V}P -13.7259 1.9085 -7.165 {"}P -13.7259 1.9085 -7.165 {"}P -13.7259 1.9085 -7.165 { cg2 val A 125 1y12A_58F_125V}P -12.3054 3.0362 -8.9328 {"}P -12.3054 3.0362 -8.9328 {"}P -12.3054 3.0362 -8.9328 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 58 A}'S' blue -10.9274 0.3424 -6.807 {"}'S' blue -10.749 0.3308 -7.0015 {"}'S' sky -10.9126 0.2694 -7.1957 {"}'S' blue -10.7033 0.2274 -7.3477 { CE2 PHE 58 A}'S' sky -12.9306 0.0098 -6.7707 {"}'S' sky -13.0913 -0.0545 -6.9604 {"}'S' blue -13.2446 -0.1816 -7.1237 {"}'S' blue -12.573 0.1741 -6.6237 {"}'S' sky -12.7273 0.1917 -6.8283 {"}'S' sky -13.1978 -0.0761 -7.3623 {"}'S' sky -12.4929 0.335 -6.8842 {"}'S' sky -13.1247 -0.0032 -7.6056 {"}'S' sky -13.0139 0.0544 -7.8364 {"}'S' sky -12.5853 0.3617 -7.7599 {"}'S' sky -12.7385 0.2362 -7.9218 { CZ PHE 58 A}'S' blue -12.8278 0.1984 -8.1549 {"}'S' blue -12.9886 0.1341 -8.3445 {"}'S' blue -12.6245 0.3803 -8.2125 {"}'S' blue -12.7858 0.3425 -8.4106 {"}'S' sky -12.5512 0.5086 -8.4714 {"}'S' blue -12.4497 0.5942 -8.723 {"}'S' sky -12.1644 0.6925 -8.7725 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 58 A}'S' sea -12.8886 0.154 -7.0265 {"}'S' sea -13.0471 0.0633 -7.2071 {"}'S' sea -12.654 0.32 -7.0872 {"}'S' green -12.8168 0.2574 -7.2801 {"}'S' sea -12.9754 0.1483 -7.4549 {"}'S' sea -12.5525 0.4056 -7.3389 {"}'S' sea -12.7132 0.3272 -7.5235 {"}'S' sea -12.8683 0.2086 -7.6914 {"}'S' sea -11.8152 0.424 -6.7814 {"}'S' green -11.9577 0.4899 -6.9843 {"}'S' green -12.428 0.4514 -7.5808 {"}'S' green -11.619 0.4679 -6.9538 {"}'S' green -12.2479 0.4775 -7.7695 {"}'S' green -11.2996 0.3877 -6.9484 {"}'S' green -11.0164 0.3396 -7.4304 {"}'S' green -11.164 0.3992 -7.6373 { CZ PHE 58 A}'S' green -12.2372 0.4893 -8.0599 {"}'S' sea -12.3902 0.5235 -8.2683 {"}'S' green -12.1334 0.6248 -8.3217 {"}'S' sea -12.2893 0.6304 -8.5257 {"}'S' green -12.0068 0.7057 -8.572 {"}'S' green -11.2632 0.4244 -7.946 {"}'S' green -11.663 0.7172 -8.5457 {"}'S' sea -11.8196 0.7402 -8.753 {"}'S' sea -10.9695 0.2953 -7.9594 {"}'S' green -11.0745 0.4517 -8.1386 {"}'S' green -11.1968 0.5763 -8.3325 {"}'S' green -11.3347 0.6673 -8.535 {"}'S' sea -11.4838 0.7203 -8.7423 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 58 A}'S' P -12.1096 0.5171 -7.1878 {"}'S' -12.107 0.4979 -7.1902 {"}'S' P -12.2672 0.5039 -7.3884 {"}'S' -12.2665 0.501 -7.3884 {"}'S' P -11.7658 0.5287 -7.1615 {"}'S' -11.7698 0.465 -7.1712 {"}'S' P -11.9224 0.5516 -7.3689 {"}'S' -11.9187 0.4579 -7.3731 {"}'S' P -12.084 0.5342 -7.5738 {"}'S' -12.0751 0.4652 -7.5681 {"}'S' P -11.4375 0.4787 -7.1508 {"}'S' -11.4452 0.4477 -7.156 {"}'S' P -11.5866 0.5317 -7.3582 {"}'S' -11.6018 0.4326 -7.3632 {"}'S' P -11.7435 0.5461 -7.5656 {"}'S' -11.7509 0.4262 -7.557 {"}'S' P -11.9056 0.5226 -7.7682 {"}'S' -11.9036 0.4383 -7.753 {"}'S' P -11.2287 0.4318 -7.3025 {"}'S' -11.2314 0.426 -7.3031 {"}'S' P -11.3774 0.4856 -7.5094 {"}'S' -11.3971 0.4168 -7.5071 {"}'S' P -11.535 0.5029 -7.7168 {"}'S' -11.552 0.4118 -7.7021 {"}'S' P -11.3199 0.4206 -7.8449 {"}'S' -11.3261 0.4029 -7.8408 { CZ PHE 58 A}'S' P -11.9855 0.575 -8.1167 {"}'S' -11.9805 0.5402 -8.1326 {"}'S' P -11.5845 0.5097 -7.9706 {"}'S' -11.5904 0.4519 -8.003 {"}'S' P -11.7124 0.6126 -8.1655 {"}'S' -11.7138 0.551 -8.1909 {"}'S' P -11.8549 0.6785 -8.3684 {"}'S' -11.854 0.6589 -8.373 {"}'S' P -11.3819 0.5581 -8.137 {"}'S' -11.3893 0.5263 -8.1502 {"}'S' P -11.5162 0.6565 -8.338 {"}'S' -11.5197 0.6307 -8.3454 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 125 A}'S' sky -12.4525 0.6841 -7.0573 {"}'S' sky -12.2897 0.7457 -6.8625 {"}'S' blue -12.7278 0.8516 -8.321 {"}'S' sky -12.601 0.736 -8.1248 {"}'S' sky -12.4589 0.6576 -7.9196 {"}'S' blue -12.5834 0.9838 -8.5862 {"}'S' sky -12.4716 0.8445 -8.4033 {"}'S' blue -12.3679 1.0674 -8.7208 {"}'S' sky -12.2584 0.9213 -8.5396 {"}'S' sky -12.022 1.004 -8.6147 { CG1 VAL 125 A}'S' blue -13.4098 0.2041 -6.9283 {"}'S' blue -13.247 0.2799 -6.7385 {"}'S' blue -13.4761 0.1964 -7.4257 {"}'S' sky -13.3185 0.2081 -7.2249 {"}'S' sky -13.0001 0.347 -6.8521 {"}'S' sky -12.8478 0.4713 -6.6894 {"}'S' sky -13.2626 0.2684 -7.5604 {"}'S' sky -12.6337 0.5808 -6.8353 {"}'S' sky -13.1707 0.3899 -7.8333 {"}'S' blue -13.0772 0.5641 -8.0785 {"}'S' sky -12.9269 0.5221 -7.8738 {"}'S' blue -12.9552 0.7723 -8.2497 {"}'S' blue -12.8128 0.7036 -8.0463 { HB VAL 125 A}'S' blue -10.9909 0.7348 -6.9612 {HG11 VAL 125 A}'S' blue -13.401 0.3808 -8.2982 {"}'S' blue -13.2449 0.4762 -8.1236 {"}'S' blue -13.2427 0.5938 -8.385 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 125 A}'S' sea -12.5731 0.6323 -7.6324 {"}'S' sea -12.3432 0.741 -8.2077 { CG1 VAL 125 A}'S' sea -13.1582 0.2585 -7.0326 {"}'S' sea -13.104 0.2845 -7.3593 {"}'S' sea -12.9426 0.3434 -7.1675 {"}'S' sea -12.7847 0.4434 -6.9915 {"}'S' sea -13.0129 0.3782 -7.6269 {"}'S' green -12.8507 0.4162 -7.4277 {"}'S' sea -12.6894 0.5013 -7.2419 {"}'S' sea -12.5344 0.6299 -7.0783 {"}'S' sea -12.7685 0.534 -7.6719 {"}'S' sea -12.6073 0.6005 -7.4821 { HB VAL 125 A}'S' green -12.3677 0.5608 -7.4191 {"}'S' green -12.2205 0.5177 -7.2166 {"}'S' green -12.0631 0.5356 -7.0175 {"}'S' green -12.288 0.4969 -7.7073 {"}'S' green -11.6808 0.5066 -6.9259 {"}'S' green -12.2357 0.5963 -8.0995 {"}'S' green -11.3818 0.5121 -6.973 {"}'S' green -12.0853 0.7171 -8.3709 {"}'S' green -11.8784 0.8406 -8.5469 {"}'S' green -11.1131 0.4414 -7.4474 {"}'S' sea -11.6356 0.9342 -8.6278 {"}'S' green -11.5711 0.7253 -8.4851 {"}'S' green -11.1768 0.4475 -7.8981 {"}'S' sea -11.3329 0.8322 -8.5155 {"}'S' green -11.2303 0.6794 -8.3404 {"}'S' green -11.0932 0.6044 -8.1409 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 125 A}'S' P -12.1506 0.4154 -7.5078 {"}'S' -12.1274 0.4652 -7.5114 {"}'S' P -11.9987 0.3896 -7.3045 {"}'S' -11.9763 0.4604 -7.3226 {"}'S' P -11.8393 0.4201 -7.1073 {"}'S' -11.8317 0.465 -7.1277 {"}'S' P -12.1269 0.4556 -7.9204 {"}'S' -12.1251 0.4588 -7.9187 {"}'S' P -11.9962 0.3612 -7.7253 {"}'S' -11.9726 0.438 -7.7157 {"}'S' P -11.8489 0.3196 -7.523 {"}'S' -11.8297 0.4344 -7.5299 {"}'S' P -11.6934 0.3316 -7.3252 {"}'S' -11.6897 0.4336 -7.3486 {"}'S' P -11.5347 0.3961 -7.1384 {"}'S' -11.5398 0.4409 -7.1573 {"}'S' P -11.9976 0.541 -8.2075 {"}'S' -11.9874 0.5668 -8.1909 {"}'S' P -11.8815 0.4092 -8.022 {"}'S' -11.8707 0.4612 -8.0004 {"}'S' P -11.7449 0.3278 -7.822 {"}'S' -11.738 0.4137 -7.8048 {"}'S' P -11.5925 0.3028 -7.6182 {"}'S' -11.5987 0.4115 -7.6156 {"}'S' P -11.4331 0.3333 -7.421 {"}'S' -11.4483 0.4129 -7.4326 {"}'S' P -11.2752 0.419 -7.24 {"}'S' -11.2786 0.4293 -7.2436 {"}'S' P -11.8073 0.6442 -8.4015 {"}'S' -11.8048 0.66 -8.3863 {"}'S' P -11.7047 0.4915 -8.2264 {"}'S' -11.7016 0.5481 -8.189 {"}'S' P -11.5763 0.3907 -8.0313 {"}'S' -11.5802 0.4517 -8.0062 {"}'S' P -11.429 0.3476 -7.8287 {"}'S' -11.4382 0.3967 -7.8183 {"}'S' P -11.2708 0.3654 -7.6303 {"}'S' -11.2827 0.3992 -7.6286 {"}'S' P -11.4674 0.5666 -8.3072 {"}'S' -11.4726 0.5937 -8.2863 {"}'S' P -11.3326 0.4717 -8.1063 {"}'S' -11.3389 0.4943 -8.0945 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 58 A}'M' greentint -9.3505 2.1543 -6.2342 {"}'M' greentint -9.4941 2.0465 -6.5066 {"}'M' greentint -9.2518 2.4421 -6.3034 {"}'M' greentint -9.4004 2.2852 -6.4519 {"}'M' greentint -9.5041 2.1889 -6.7494 {"}'M' greentint -9.5606 1.9394 -6.7526 {"}'M' greentint -9.1025 2.6723 -6.3656 {"}'M' greentint -9.2611 2.5791 -6.544 {"}'M' greentint -9.4004 2.4112 -6.6771 {"}'M' greentint -9.4737 2.2829 -6.9942 {"}'M' greentint -9.5449 2.0378 -7.0184 {"}'M' greentint -8.9156 2.8614 -6.4334 {"}'M' greentint -9.0758 2.8032 -6.6254 {"}'M' greentint -9.2305 2.6801 -6.7901 {"}'M' greentint -9.3663 2.5026 -6.9162 {"}'M' greentint -9.3958 2.3631 -7.2324 {"}'M' greentint -9.477 2.1199 -7.2708 {"}'M' greentint -8.8328 2.9814 -6.6775 {"}'M' greentint -8.9949 2.8992 -6.8632 {"}'M' greentint -9.1471 2.7633 -7.0232 {"}'M' greentint -9.2838 2.5817 -7.148 {"}'M' greentint -9.2813 2.4079 -7.4621 {"}'M' greentint -8.738 3.0442 -6.9365 {"}'M' greentint -8.8938 2.9455 -7.1098 {"}'M' greentint -9.0399 2.8019 -7.2597 {"}'M' greentint -9.1707 2.6199 -7.3781 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 125 A}'M' greentint -9.5526 1.9225 -6.7344 {"}'M' greentint -9.3944 1.9862 -6.5481 {"}'M' greentint -9.2442 2.1106 -6.3882 {"}'M' greentint -9.1111 2.2862 -6.2651 {"}'M' greentint -9.0058 2.5008 -6.1874 {"}'M' greentint -9.502 1.9814 -7.0854 {"}'M' greentint -9.3438 1.9836 -6.8816 {"}'M' greentint -9.1832 2.0596 -6.6948 {"}'M' greentint -9.0336 2.205 -6.5424 {"}'M' greentint -8.9091 2.405 -6.4366 {"}'M' greentint -8.8205 2.6425 -6.3885 {"}'M' greentint -8.776 2.8973 -6.4012 {"}'M' greentint -9.3989 2.1441 -7.3404 {"}'M' greentint -9.2501 2.0945 -7.1343 {"}'M' greentint -9.0878 2.1394 -6.9364 {"}'M' greentint -8.9336 2.272 -6.7747 {"}'M' greentint -8.8094 2.4753 -6.67 {"}'M' greentint -8.7311 2.721 -6.6379 {"}'M' greentint -8.7101 2.9764 -6.6812 {"}'M' greentint -9.2709 2.3797 -7.5029 {"}'M' greentint -9.1392 2.278 -7.3048 {"}'M' greentint -8.9782 2.306 -7.1048 {"}'M' greentint -8.8301 2.458 -6.9559 {"}'M' greentint -8.7353 2.6921 -6.8986 {"}'M' greentint -8.719 2.9458 -6.9479 {"}'M' greentint -9.0057 2.4958 -7.3583 {"}'M' greentint -8.8457 2.5927 -7.1789 {"}'M' greentint -8.7907 2.846 -7.1787 {"}'M' greentint -8.924 2.7424 -7.3781 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 58 A}'M' greentint -9.9903 0.9326 -4.3298 {"}'M' greentint -10.1236 0.829 -4.5293 {"}'M' greentint -9.9087 1.1792 -4.3497 {"}'M' greentint -10.0686 1.0823 -4.5291 {"}'M' greentint -10.179 0.9829 -4.8094 {"}'M' greentint -10.1953 0.7292 -4.76 {"}'M' greentint -9.7752 1.3971 -4.4032 {"}'M' greentint -9.9362 1.369 -4.6032 {"}'M' greentint -10.0842 1.217 -4.752 {"}'M' greentint -10.1508 1.0804 -5.063 {"}'M' greentint -10.2012 0.8257 -5.0583 {"}'M' greentint -9.5868 1.5669 -4.4698 {"}'M' greentint -9.7456 1.5701 -4.6757 {"}'M' greentint -9.9059 1.479 -4.8586 {"}'M' greentint -10.0473 1.3085 -4.9942 {"}'M' greentint -10.0539 1.1546 -5.303 {"}'M' greentint -10.1222 0.9056 -5.3207 {"}'M' greentint -9.4899 1.7016 -4.7253 {"}'M' greentint -9.6512 1.6625 -4.9232 {"}'M' greentint -9.8078 1.5504 -5.0946 {"}'M' greentint -9.9464 1.3757 -5.2253 {"}'M' greentint -9.9085 1.1742 -5.5206 {"}'M' greentint -9.5199 1.6889 -5.1599 {"}'M' greentint -9.6701 1.5644 -5.3197 {"}'M' greentint -9.8033 1.3888 -5.4428 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 125 A}'M' green -10.041 0.9808 -5.4593 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 125 A}'M' greentint -10.027 0.7797 -4.4476 {"}'M' greentint -9.8867 0.9417 -4.3115 {"}'M' greentint -9.7647 1.1383 -4.2085 {"}'M' greentint -10.0714 0.7192 -4.8516 {"}'M' greentint -9.9136 0.8294 -4.6781 {"}'M' greentint -9.7682 0.9911 -4.5351 {"}'M' greentint -9.6436 1.1935 -4.4315 {"}'M' greentint -9.5472 1.4266 -4.3717 {"}'M' greentint -10.0005 0.8213 -5.1043 {"}'M' greentint -9.8408 0.9099 -4.9233 {"}'M' greentint -9.694 1.0595 -4.7758 {"}'M' greentint -9.5703 1.2592 -4.671 {"}'M' greentint -9.4785 1.4934 -4.6177 {"}'M' greentint -9.8822 0.9918 -5.2584 {"}'M' greentint -9.7252 1.0877 -5.0811 {"}'M' greentint -9.5867 1.2582 -4.9495 {"}'M' greentint -9.4838 1.4817 -4.8787 {"}'M' greentint -9.4294 1.7315 -4.8784 {"}'M' greentint -9.7436 1.2179 -5.3324 {"}'M' greentint -9.5938 1.3716 -5.1816 {"}'M' greentint -9.4985 1.6079 -5.1241 {"}'M' greentint -9.6354 1.5158 -5.3927 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 36 1y4jA_38F_57A}P -11.9103 -3.3425 -1.2395 {"}-11.9103 -3.3425 -1.2395 { ca gly A 36 1y4jA_38F_57A}-11.1656 -2.2223 -0.6448 { c gly A 36 1y4jA_38F_57A}-10.7737 -1.2363 -1.7303 { o gly A 36 1y4jA_38F_57A}-11.4633 -1.1216 -2.7538 { c gly A 36 1y4jA_38F_57A}P -10.7737 -1.2363 -1.7303 { n arg A 37 1y4jA_38F_57A}-9.6606 -0.533 -1.5178 { ca arg A 37 1y4jA_38F_57A}-9.2014 0.4508 -2.475 { c arg A 37 1y4jA_38F_57A}-8.1801 -0.168 -3.3884 { o arg A 37 1y4jA_38F_57A}-7.3662 -0.9559 -2.9454 { c arg A 37 1y4jA_38F_57A}P -8.1801 -0.168 -3.3884 { n phe A 38 1y4jA_38F_57A}-8.1972 0.2239 -4.6599 { ca phe A 38 1y4jA_38F_57A}-7.1819 -0.2046 -5.6112 { c phe A 38 1y4jA_38F_57A}-7.0372 0.8021 -6.7471 { o phe A 38 1y4jA_38F_57A}-7.938 1.603 -6.9974 { c phe A 38 1y4jA_38F_57A}P -7.0372 0.8021 -6.7471 { n leu A 39 1y4jA_38F_57A}-5.8771 0.7603 -7.4009 { ca leu A 39 1y4jA_38F_57A}-5.5667 1.6351 -8.5314 { c leu A 39 1y4jA_38F_57A}-6.1089 1.0022 -9.8046 { o leu A 39 1y4jA_38F_57A}-5.6369 -0.0488 -10.2628 { c leu A 39 1y4jA_38F_57A}P -6.1089 1.0022 -9.8046 { n met A 40 1y4jA_38F_57A}-7.1359 1.6446 -10.3383 { ca met A 40 1y4jA_38F_57A}-7.7733 1.2015 -11.544 { c met A 40 1y4jA_38F_57A}-7.2203 1.9552 -12.7409 { o met A 40 1y4jA_38F_57A}-6.9042 3.1619 -12.6493 { n arg A 55 1y4jA_38F_57A}P -6.6843 5.8519 -11.4726 {"}-6.6843 5.8519 -11.4726 { ca arg A 55 1y4jA_38F_57A}-7.4274 6.4205 -10.3555 { c arg A 55 1y4jA_38F_57A}-7.8142 5.3701 -9.3508 { o arg A 55 1y4jA_38F_57A}-8.1524 4.2251 -9.702 { c arg A 55 1y4jA_38F_57A}P -7.8142 5.3701 -9.3508 { n glu A 56 1y4jA_38F_57A}-7.8055 5.7973 -8.0967 { ca glu A 56 1y4jA_38F_57A}-8.1404 4.9238 -7.0016 { c glu A 56 1y4jA_38F_57A}-9.6582 4.7509 -6.945 { o glu A 56 1y4jA_38F_57A}-10.4069 5.7202 -6.9967 { c glu A 56 1y4jA_38F_57A}P -9.6582 4.7509 -6.945 { n ala A 57 1y4jA_38F_57A}-10.0886 3.4981 -6.9242 { ca ala A 57 1y4jA_38F_57A}-11.4905 3.1324 -6.773 { c ala A 57 1y4jA_38F_57A}-11.6467 2.3126 -5.5108 { o ala A 57 1y4jA_38F_57A}-10.6859 1.7026 -5.029 { c ala A 57 1y4jA_38F_57A}P -11.6467 2.3126 -5.5108 { n thr A 58 1y4jA_38F_57A}-12.8764 2.2742 -5.0211 { ca thr A 58 1y4jA_38F_57A}-13.2554 1.526 -3.8372 { c thr A 58 1y4jA_38F_57A}-14.2978 0.4978 -4.2309 { o thr A 58 1y4jA_38F_57A}-15.2339 0.8264 -4.9291 { c thr A 58 1y4jA_38F_57A}P -14.2978 0.4978 -4.2309 { n val A 59 1y4jA_38F_57A}-14.1208 -0.7386 -3.7973 { ca val A 59 1y4jA_38F_57A}-15.1779 -1.7413 -3.9093 { c val A 59 1y4jA_38F_57A}-15.4307 -2.4048 -2.5586 { o val A 59 1y4jA_38F_57A}-14.4966 -2.7079 -1.8398 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 36 1y4jA_38F_57A}P -11.9103 -3.3425 -1.2395 { ca gly A 36 1y4jA_38F_57A}P -11.1656 -2.2223 -0.6448 {"}P -11.1656 -2.2223 -0.6448 { n arg A 37 1y4jA_38F_57A}P -9.6606 -0.533 -1.5178 { ca arg A 37 1y4jA_38F_57A}P -9.2014 0.4508 -2.475 { n phe A 38 1y4jA_38F_57A}P -8.1972 0.2239 -4.6599 { ca phe A 38 1y4jA_38F_57A}P -7.1819 -0.2046 -5.6112 { n leu A 39 1y4jA_38F_57A}P -5.8771 0.7603 -7.4009 { ca leu A 39 1y4jA_38F_57A}P -5.5667 1.6351 -8.5314 { n met A 40 1y4jA_38F_57A}P -7.1359 1.6446 -10.3383 { ca met A 40 1y4jA_38F_57A}P -7.7733 1.2015 -11.544 { n arg A 55 1y4jA_38F_57A}P -6.6843 5.8519 -11.4726 { ca arg A 55 1y4jA_38F_57A}P -7.4274 6.4205 -10.3555 { n glu A 56 1y4jA_38F_57A}P -7.8055 5.7973 -8.0967 { ca glu A 56 1y4jA_38F_57A}P -8.1404 4.9238 -7.0016 { n ala A 57 1y4jA_38F_57A}P -10.0886 3.4981 -6.9242 { ca ala A 57 1y4jA_38F_57A}P -11.4905 3.1324 -6.773 { n thr A 58 1y4jA_38F_57A}P -12.8764 2.2742 -5.0211 { ca thr A 58 1y4jA_38F_57A}P -13.2554 1.526 -3.8372 { n val A 59 1y4jA_38F_57A}P -14.1208 -0.7386 -3.7973 { ca val A 59 1y4jA_38F_57A}P -15.1779 -1.7413 -3.9093 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 36 1y4jA_38F_57A}P -11.1656 -2.2223 -0.6448 {"}-11.1656 -2.2223 -0.6448 { ca arg A 37 1y4jA_38F_57A}-9.2014 0.4508 -2.475 { ca phe A 38 1y4jA_38F_57A}-7.1819 -0.2046 -5.6112 { ca leu A 39 1y4jA_38F_57A}-5.5667 1.6351 -8.5314 { ca met A 40 1y4jA_38F_57A}-7.7733 1.2015 -11.544 { ca arg A 55 1y4jA_38F_57A}P -7.4274 6.4205 -10.3555 {"}-7.4274 6.4205 -10.3555 { ca glu A 56 1y4jA_38F_57A}-8.1404 4.9238 -7.0016 { ca ala A 57 1y4jA_38F_57A}-11.4905 3.1324 -6.773 { ca thr A 58 1y4jA_38F_57A}-13.2554 1.526 -3.8372 { ca val A 59 1y4jA_38F_57A}-15.1779 -1.7413 -3.9093 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 38 1y4jA_38F_57A}P -7.1819 -0.2046 -5.6112 { cb phe A 38 1y4jA_38F_57A}-7.5154 -1.6027 -6.17 { cg phe A 38 1y4jA_38F_57A}-8.6137 -1.6006 -7.1931 { cd1 phe A 38 1y4jA_38F_57A}-8.3218 -1.7575 -8.5441 { ce1 phe A 38 1y4jA_38F_57A}-9.3341 -1.7311 -9.5048 { cz phe A 38 1y4jA_38F_57A}-10.6498 -1.5676 -9.1222 { cg phe A 38 1y4jA_38F_57A}P -8.6137 -1.6006 -7.1931 { cd2 phe A 38 1y4jA_38F_57A}-9.9468 -1.4219 -6.8088 { ce2 phe A 38 1y4jA_38F_57A}-10.97 -1.4192 -7.7635 { cz phe A 38 1y4jA_38F_57A}ghost -10.6498 -1.5676 -9.1222 { ca ala A 57 1y4jA_38F_57A}P -11.4905 3.1324 -6.773 { cb ala A 57 1y4jA_38F_57A}-11.9346 2.2999 -7.9674 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 38 1y4jA_38F_57A}P -7.5154 -1.6027 -6.17 {"}P -7.5154 -1.6027 -6.17 { cd1 phe A 38 1y4jA_38F_57A}P -8.3218 -1.7575 -8.5441 { cd2 phe A 38 1y4jA_38F_57A}P -9.9468 -1.4219 -6.8088 { ce1 phe A 38 1y4jA_38F_57A}P -9.3341 -1.7311 -9.5048 { ce2 phe A 38 1y4jA_38F_57A}P -10.97 -1.4192 -7.7635 { cz phe A 38 1y4jA_38F_57A}P -10.6498 -1.5676 -9.1222 { cb ala A 57 1y4jA_38F_57A}P -11.9346 2.2999 -7.9674 {"}P -11.9346 2.2999 -7.9674 {"}P -11.9346 2.2999 -7.9674 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 38 A}'S' sky -11.6793 0.031 -8.4386 {"}'S' sky -10.5523 0.2557 -7.4724 {"}'S' sky -11.1359 0.0996 -8.6173 {"}'S' sky -10.5963 0.1787 -8.3712 { CZ PHE 38 A}'S' blue -11.1867 0.0704 -8.8219 {"}'S' blue -10.7523 0.1185 -8.6646 {"}'S' blue -10.9042 0.1456 -8.8681 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 38 A}'S' sea -11.351 0.2132 -7.2591 {"}'S' green -11.5069 0.2188 -7.4632 {"}'S' green -11.6673 0.1826 -7.6605 {"}'S' sea -11.828 0.1041 -7.8451 {"}'S' sea -11.0724 0.2669 -7.3059 {"}'S' green -11.2243 0.294 -7.5094 {"}'S' green -11.5428 0.2283 -7.9024 {"}'S' green -11.7001 0.1386 -8.0815 {"}'S' green -10.8806 0.3056 -7.4831 {"}'S' green -11.5238 0.1607 -8.2728 {"}'S' green -10.7014 0.3087 -7.6798 {"}'S' green -11.184 0.2381 -8.284 {"}'S' sea -11.3449 0.1396 -8.4643 {"}'S' sea -10.4922 0.2625 -7.831 {"}'S' green -10.6498 0.2798 -8.0384 {"}'S' green -10.8115 0.2568 -8.2422 {"}'S' green -10.9747 0.1961 -8.436 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 38 A}'S' P -11.382 0.2809 -7.71 {"}'S' -11.3803 0.2714 -7.7106 {"}'S' P -11.0372 0.3286 -7.6905 {"}'S' -11.0364 0.3161 -7.6917 {"}'S' P -11.1988 0.3111 -7.8954 {"}'S' -11.1939 0.2721 -7.8917 {"}'S' P -11.3627 0.2545 -8.0911 {"}'S' -11.3583 0.2376 -8.088 {"}'S' P -10.8583 0.323 -7.8872 {"}'S' -10.8583 0.323 -7.8872 {"}'S' P -11.0204 0.2995 -8.0898 {"}'S' -11.0202 0.2799 -8.0867 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 57 A}'S' sky -11.736 0.4515 -7.4552 {"}'S' blue -11.1404 0.4824 -8.7449 {"}'S' sky -10.5292 0.5307 -7.9685 {"}'S' blue -10.7661 0.5202 -8.5787 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 57 A}'S' sea -11.8235 0.3312 -7.9455 {"}'S' green -11.6716 0.3055 -7.7422 {"}'S' green -11.5122 0.3359 -7.545 {"}'S' sea -11.3538 0.4225 -7.3636 {"}'S' green -11.6691 0.2771 -8.1631 {"}'S' green 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-12.1431 0.3424 -7.7065 {"}'S' green -12.0277 0.2108 -7.5204 {"}'S' green -11.4206 0.2205 -6.739 {"}'S' green -11.9755 0.3102 -7.9126 {"}'S' green -11.8667 0.1695 -7.7335 {"}'S' green -11.1216 0.226 -6.7861 {"}'S' green -11.8251 0.431 -8.184 {"}'S' sea -10.8648 0.2688 -6.8978 {"}'S' sea -11.6181 0.5545 -8.36 {"}'S' green -11.5471 0.3581 -8.2146 {"}'S' green -10.8529 0.1553 -7.2606 {"}'S' sea -10.7024 0.2867 -7.102 {"}'S' green -11.3109 0.4392 -8.2983 {"}'S' green -11.2072 0.2804 -8.1203 {"}'S' green -11.0723 0.1856 -7.9194 {"}'S' green -10.9165 0.1614 -7.7112 {"}'S' sea -10.9701 0.3933 -8.1535 {"}'S' sea -10.833 0.3183 -7.9541 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 109 A}'S' P -11.8904 0.1293 -7.321 {"}'S' -11.8759 0.1607 -7.3237 {"}'S' P -11.7384 0.1035 -7.1177 {"}'S' -11.7188 0.1661 -7.1341 {"}'S' P -11.5791 0.134 -6.9204 {"}'S' -11.5706 0.1829 -6.9422 {"}'S' P -11.736 0.0751 -7.5385 {"}'S' -11.7235 0.1169 -7.5326 {"}'S' P -11.5887 0.0335 -7.3362 {"}'S' -11.574 0.1234 -7.3417 {"}'S' P -11.4332 0.0454 -7.1383 {"}'S' -11.4294 0.1371 -7.1592 {"}'S' P -11.2745 0.1099 -6.9516 {"}'S' -11.2795 0.1561 -6.9707 {"}'S' P -11.7374 0.2548 -8.0206 {"}'S' -11.7342 0.2621 -8.0162 {"}'S' P -11.6212 0.1231 -7.8352 {"}'S' -11.6129 0.1649 -7.818 {"}'S' P -11.4847 0.0417 -7.6351 {"}'S' -11.4814 0.0849 -7.6268 {"}'S' P -11.3323 0.0167 -7.4314 {"}'S' -11.3366 0.0943 -7.4293 {"}'S' P -11.1729 0.0472 -7.2341 {"}'S' -11.1858 0.1091 -7.2436 {"}'S' P -11.0149 0.1329 -7.0531 {"}'S' -11.0164 0.137 -7.0544 {"}'S' P -11.4445 0.2054 -8.0396 {"}'S' -11.4428 0.2325 -8.0212 {"}'S' P -11.316 0.1046 -7.8444 {"}'S' -11.3189 0.1444 -7.8283 {"}'S' P -11.1688 0.0615 -7.6419 {"}'S' -11.1701 0.0691 -7.6403 {"}'S' P -11.0106 0.0793 -7.4434 {"}'S' -11.0121 0.0837 -7.443 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 173 A}'M' greentint -9.2047 2.327 -6.4794 {"}'M' greentint -9.3533 2.17 -6.6279 {"}'M' greentint -9.457 2.0737 -6.9253 {"}'M' greentint -9.0555 2.5571 -6.5415 {"}'M' greentint -9.2141 2.4639 -6.7199 {"}'M' greentint -9.3533 2.296 -6.8531 {"}'M' greentint -9.4267 2.1677 -7.1701 {"}'M' greentint -9.4978 1.9226 -7.1943 {"}'M' greentint -8.8685 2.7462 -6.6094 {"}'M' greentint -9.0287 2.688 -6.8014 {"}'M' greentint -9.1835 2.5649 -6.966 {"}'M' greentint -9.3192 2.3874 -7.0922 {"}'M' greentint -9.3488 2.2479 -7.4084 {"}'M' greentint -9.43 2.0047 -7.4468 {"}'M' greentint -8.6253 2.8896 -6.6514 {"}'M' greentint -8.7858 2.8662 -6.8535 {"}'M' greentint -8.9478 2.784 -7.0391 {"}'M' greentint -9.1001 2.6481 -7.1991 {"}'M' greentint -9.2367 2.4665 -7.3239 {"}'M' greentint -9.2343 2.2927 -7.6381 {"}'M' greentint -8.5318 2.9802 -6.9203 {"}'M' greentint -8.6909 2.929 -7.1125 {"}'M' greentint -8.8467 2.8303 -7.2858 {"}'M' greentint -8.9929 2.6867 -7.4357 {"}'M' greentint -9.1237 2.5047 -7.5541 {"}'M' greentint -8.5342 2.9635 -7.3179 {"}'M' greentint -8.691 2.8576 -7.491 {"}'M' greentint -8.8377 2.7105 -7.6408 {"}'M' greentint -8.9698 2.5275 -7.7608 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 109 A}'M' greentint -9.4456 1.9272 -6.7959 {"}'M' greentint -9.2906 2.0244 -6.6234 {"}'M' greentint -9.1493 2.1752 -6.4818 {"}'M' greentint -9.0287 2.3694 -6.3801 {"}'M' greentint -9.4892 1.8879 -7.2703 {"}'M' greentint -9.3349 1.8871 -7.0712 {"}'M' greentint -9.1767 1.9508 -6.8849 {"}'M' greentint -9.0264 2.0753 -6.7251 {"}'M' greentint -8.8933 2.2509 -6.602 {"}'M' greentint -8.7881 2.4655 -6.5242 {"}'M' greentint -8.7146 2.7053 -6.4973 {"}'M' greentint -9.2843 1.9461 -7.4222 {"}'M' greentint -9.1261 1.9483 -7.2185 {"}'M' greentint -8.9654 2.0243 -7.0316 {"}'M' greentint -8.8159 2.1697 -6.8792 {"}'M' greentint -8.6913 2.3696 -6.7734 {"}'M' greentint -8.6027 2.6072 -6.7254 {"}'M' greentint -8.5582 2.862 -6.7381 {"}'M' greentint -9.1812 2.1088 -7.6773 {"}'M' greentint -9.0324 2.0592 -7.4712 {"}'M' greentint -8.8701 2.1041 -7.2732 {"}'M' greentint -8.7158 2.2367 -7.1115 {"}'M' greentint -8.5916 2.44 -7.0069 {"}'M' greentint -8.5133 2.6857 -6.9748 {"}'M' greentint -8.4923 2.9411 -7.0181 {"}'M' greentint -9.0532 2.3444 -7.8398 {"}'M' greentint -8.9214 2.2426 -7.6416 {"}'M' greentint -8.7604 2.2707 -7.4416 {"}'M' greentint -8.6124 2.4227 -7.2928 {"}'M' greentint -8.5176 2.6568 -7.2354 {"}'M' greentint -8.5013 2.9105 -7.2847 {"}'M' greentint -8.7879 2.4605 -7.6951 {"}'M' greentint -8.6279 2.5574 -7.5157 {"}'M' greentint -8.573 2.8107 -7.5155 {"}'M' greentint -8.7062 2.7071 -7.715 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 173 A}'M' greentint -9.8687 1.0429 -4.3904 {"}'M' greentint -10.002 0.9393 -4.5899 {"}'M' greentint -9.7871 1.2895 -4.4103 {"}'M' greentint -9.947 1.1926 -4.5897 {"}'M' greentint -10.0574 1.0932 -4.87 {"}'M' greentint -10.0737 0.8395 -4.8207 {"}'M' greentint -9.6536 1.5074 -4.4638 {"}'M' greentint -9.8146 1.4793 -4.6638 {"}'M' greentint -9.9626 1.3274 -4.8126 {"}'M' greentint -10.0291 1.1907 -5.1236 {"}'M' greentint -10.0795 0.936 -5.1189 {"}'M' greentint -10.0708 0.6882 -5.0385 {"}'M' greentint -9.4652 1.6772 -4.5304 {"}'M' greentint -9.624 1.6804 -4.7363 {"}'M' greentint -9.7843 1.5893 -4.9192 {"}'M' greentint -9.9257 1.4188 -5.0548 {"}'M' greentint -9.9323 1.265 -5.3636 {"}'M' greentint -10.0006 1.016 -5.3813 {"}'M' greentint -9.5296 1.7728 -4.9838 {"}'M' greentint -9.6862 1.6607 -5.1552 {"}'M' greentint -9.8248 1.486 -5.2859 {"}'M' greentint -9.6817 1.4991 -5.5034 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 109 A}'M' green -9.5026 1.5715 -4.402 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 109 A}'M' greentint -9.9328 0.7225 -4.721 {"}'M' greentint -9.7874 0.8843 -4.578 {"}'M' greentint -9.6628 1.0867 -4.4744 {"}'M' greentint -9.5663 1.3198 -4.4146 {"}'M' greentint -10.0197 0.7144 -5.1472 {"}'M' greentint -9.8599 0.803 -4.9662 {"}'M' greentint -9.7132 0.9526 -4.8186 {"}'M' greentint -9.5895 1.1524 -4.7139 {"}'M' greentint -9.4977 1.3865 -4.6606 {"}'M' greentint -9.4457 1.6374 -4.6622 {"}'M' greentint -9.9014 0.8849 -5.3013 {"}'M' greentint -9.7444 0.9808 -5.1239 {"}'M' greentint -9.6059 1.1514 -4.9924 {"}'M' greentint -9.503 1.3749 -4.9215 {"}'M' greentint -9.4485 1.6246 -4.9212 {"}'M' greentint -9.7628 1.111 -5.3753 {"}'M' greentint -9.613 1.2647 -5.2245 {"}'M' greentint -9.5177 1.501 -5.167 {"}'M' greentint -9.5013 1.7575 -5.2168 {"}'M' greentint -9.6546 1.4089 -5.4355 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n pro A 58 1yb3A_60F_68V}P -11.2268 -1.0485 1.6934 {"}-11.2268 -1.0485 1.6934 { ca pro A 58 1yb3A_60F_68V}-10.7418 -1.6344 0.4222 { c pro A 58 1yb3A_60F_68V}-10.6267 -0.6072 -0.7161 { o pro A 58 1yb3A_60F_68V}-11.4481 0.2996 -0.8204 { c pro A 58 1yb3A_60F_68V}P -10.6267 -0.6072 -0.7161 { n ala A 59 1yb3A_60F_68V}-9.5897 -0.7454 -1.5416 { ca ala A 59 1yb3A_60F_68V}-9.451 0.1121 -2.7287 { c ala A 59 1yb3A_60F_68V}-8.6032 -0.6118 -3.7526 { o ala A 59 1yb3A_60F_68V}-7.7684 -1.4383 -3.4005 { c ala A 59 1yb3A_60F_68V}P -8.6032 -0.6118 -3.7526 { n phe A 60 1yb3A_60F_68V}-8.792 -0.2801 -5.0296 { ca phe A 60 1yb3A_60F_68V}-7.9402 -0.8487 -6.0887 { c phe A 60 1yb3A_60F_68V}-7.5303 0.2465 -7.0619 { o phe A 60 1yb3A_60F_68V}-8.334 1.1292 -7.3673 { c phe A 60 1yb3A_60F_68V}P -7.5303 0.2465 -7.0619 { n ala A 61 1yb3A_60F_68V}-6.2734 0.1925 -7.5104 { ca ala A 61 1yb3A_60F_68V}-5.7301 1.1557 -8.4796 { c ala A 61 1yb3A_60F_68V}-6.3014 0.9535 -9.8823 { o ala A 61 1yb3A_60F_68V}-6.5427 -0.1917 -10.3267 { c ala A 61 1yb3A_60F_68V}P -6.3014 0.9535 -9.8823 { n val A 62 1yb3A_60F_68V}-6.5067 2.0802 -10.5619 { ca val A 62 1yb3A_60F_68V}-6.821 2.1286 -11.9937 { c val A 62 1yb3A_60F_68V}-5.8031 3.1014 -12.5914 { o val A 62 1yb3A_60F_68V}-5.8526 4.283 -12.3308 { n gly A 66 1yb3A_60F_68V}P -5.3994 6.6089 -10.7932 {"}-5.3994 6.6089 -10.7932 { ca gly A 66 1yb3A_60F_68V}-6.7469 6.3722 -10.274 { c gly A 66 1yb3A_60F_68V}-6.8255 5.3517 -9.1367 { o gly A 66 1yb3A_60F_68V}-5.953 4.4758 -9.0209 { c gly A 66 1yb3A_60F_68V}P -6.8255 5.3517 -9.1367 { n glu A 67 1yb3A_60F_68V}-7.8739 5.4952 -8.316 { ca glu A 67 1yb3A_60F_68V}-8.2327 4.5512 -7.2393 { c glu A 67 1yb3A_60F_68V}-9.7447 4.4725 -7.1518 { o glu A 67 1yb3A_60F_68V}-10.4292 5.4914 -7.2399 { c glu A 67 1yb3A_60F_68V}P -9.7447 4.4725 -7.1518 { n val A 68 1yb3A_60F_68V}-10.2701 3.2597 -6.9795 { ca val A 68 1yb3A_60F_68V}-11.694 3.0773 -6.7105 { c val A 68 1yb3A_60F_68V}-11.7858 2.2976 -5.4018 { o val A 68 1yb3A_60F_68V}-11.047 1.336 -5.1997 { c val A 68 1yb3A_60F_68V}P -11.7858 2.2976 -5.4018 { n gly A 69 1yb3A_60F_68V}-12.7015 2.6923 -4.5339 { ca gly A 69 1yb3A_60F_68V}-12.8023 1.9817 -3.2263 { c gly A 69 1yb3A_60F_68V}-14.1246 2.1916 -2.5267 { o gly A 69 1yb3A_60F_68V}-15.0767 2.7339 -3.1059 { c gly A 69 1yb3A_60F_68V}P -14.1246 2.1916 -2.5267 { n ala A 70 1yb3A_60F_68V}-14.206 1.7374 -1.2765 { ca ala A 70 1yb3A_60F_68V}-15.4182 1.9682 -0.4911 { c ala A 70 1yb3A_60F_68V}-14.9988 2.2276 0.9287 { o ala A 70 1yb3A_60F_68V}-13.9654 1.6988 1.3937 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { ca pro A 58 1yb3A_60F_68V}P -10.7418 -1.6344 0.4222 { n ala A 59 1yb3A_60F_68V}P -9.5897 -0.7454 -1.5416 { ca ala A 59 1yb3A_60F_68V}P -9.451 0.1121 -2.7287 { n phe A 60 1yb3A_60F_68V}P -8.792 -0.2801 -5.0296 { ca phe A 60 1yb3A_60F_68V}P -7.9402 -0.8487 -6.0887 { n ala A 61 1yb3A_60F_68V}P -6.2734 0.1925 -7.5104 { ca ala A 61 1yb3A_60F_68V}P -5.7301 1.1557 -8.4796 { n val A 62 1yb3A_60F_68V}P -6.5067 2.0802 -10.5619 { ca val A 62 1yb3A_60F_68V}P -6.821 2.1286 -11.9937 { n gly A 66 1yb3A_60F_68V}P -5.3994 6.6089 -10.7932 { ca gly A 66 1yb3A_60F_68V}P -6.7469 6.3722 -10.274 {"}P -6.7469 6.3722 -10.274 { n glu A 67 1yb3A_60F_68V}P -7.8739 5.4952 -8.316 { ca glu A 67 1yb3A_60F_68V}P -8.2327 4.5512 -7.2393 { n val A 68 1yb3A_60F_68V}P -10.2701 3.2597 -6.9795 { ca val A 68 1yb3A_60F_68V}P -11.694 3.0773 -6.7105 { n gly A 69 1yb3A_60F_68V}P -12.7015 2.6923 -4.5339 { ca gly A 69 1yb3A_60F_68V}P -12.8023 1.9817 -3.2263 {"}P -12.8023 1.9817 -3.2263 { n ala A 70 1yb3A_60F_68V}P -14.206 1.7374 -1.2765 { ca ala A 70 1yb3A_60F_68V}P -15.4182 1.9682 -0.4911 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca pro A 58 1yb3A_60F_68V}P -10.7418 -1.6344 0.4222 {"}-10.7418 -1.6344 0.4222 { ca ala A 59 1yb3A_60F_68V}-9.451 0.1121 -2.7287 { ca phe A 60 1yb3A_60F_68V}-7.9402 -0.8487 -6.0887 { ca ala A 61 1yb3A_60F_68V}-5.7301 1.1557 -8.4796 { ca val A 62 1yb3A_60F_68V}-6.821 2.1286 -11.9937 { ca gly A 66 1yb3A_60F_68V}-6.7469 6.3722 -10.274 { ca glu A 67 1yb3A_60F_68V}-8.2327 4.5512 -7.2393 { ca val A 68 1yb3A_60F_68V}-11.694 3.0773 -6.7105 { ca gly A 69 1yb3A_60F_68V}-12.8023 1.9817 -3.2263 { ca ala A 70 1yb3A_60F_68V}-15.4182 1.9682 -0.4911 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 60 1yb3A_60F_68V}P -7.9402 -0.8487 -6.0887 { cb phe A 60 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-5.0779 {"}'M' greentint -9.6613 1.179 -5.0795 {"}'M' greentint -10.2758 0.4155 -5.9194 {"}'M' greentint -10.117 0.4265 -5.7186 {"}'M' greentint -9.9599 0.5224 -5.5412 {"}'M' greentint -9.8215 0.693 -5.4097 {"}'M' greentint -9.7185 0.9165 -5.3388 {"}'M' greentint -9.6641 1.1662 -5.3385 {"}'M' greentint -10.1415 0.6234 -5.9952 {"}'M' greentint -9.9783 0.6526 -5.7926 {"}'M' greentint -9.8286 0.8063 -5.6418 {"}'M' greentint -9.7333 1.0426 -5.5842 {"}'M' greentint -10.0288 0.8532 -6.0304 {"}'M' greentint -9.8701 0.9505 -5.8528 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 332 1yc9A_334F_354}P -11.2977 -1.4161 1.4359 {"}-11.2977 -1.4161 1.4359 { ca ser A 332 1yc9A_334F_354}-10.8635 -1.9261 0.1243 { c ser A 332 1yc9A_334F_354}-10.531 -0.7545 -0.7499 { o ser A 332 1yc9A_334F_354}-11.0807 0.343 -0.6221 { c ser A 332 1yc9A_334F_354}P -10.531 -0.7545 -0.7499 { n ala A 333 1yc9A_334F_354}-9.653 -0.9922 -1.7068 { ca ala A 333 1yc9A_334F_354}-9.3221 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{"}'S' sky -12.6197 1.5076 -7.5523 {"}'S' sky -12.0174 1.2101 -7.0492 {"}'S' sky -12.1151 1.374 -7.2218 {"}'S' sky -12.2326 1.5031 -7.4102 {"}'S' blue -12.368 1.5933 -7.609 { HD2 PHE 334 A}'S' blue -11.8192 0.1528 -5.9422 { HE2 PHE 334 A}'S' blue -13.2736 0.4469 -7.0095 {"}'S' blue -13.3122 0.6763 -7.1232 {"}'S' blue -13.4054 0.8509 -7.2921 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 334 A}'S' sea -12.2434 0.2139 -6.2438 {"}'S' sea -12.3806 0.3152 -6.4493 {"}'S' green -12.1078 0.4549 -6.2929 {"}'S' green -12.249 0.5359 -6.4992 {"}'S' sea -11.8424 0.5434 -6.1913 {"}'S' green -11.9613 0.6701 -6.381 {"}'S' green -12.1041 0.7366 -6.5846 {"}'S' sea -11.762 0.8305 -6.4391 {"}'S' green -11.9042 0.9009 -6.6411 { CE2 PHE 334 A}'S' green -12.8958 0.5525 -6.8385 {"}'S' green -12.951 0.7738 -6.9713 {"}'S' sea -13.0563 0.9349 -7.152 {"}'S' sea -12.6473 0.3782 -6.6864 {"}'S' green -12.6544 0.6236 -6.764 {"}'S' green -12.7909 1.0234 -7.0504 {"}'S' sea -12.9098 1.1502 -7.2401 {"}'S' green -12.3932 0.5862 -6.6856 {"}'S' green -12.5889 1.1885 -7.1059 {"}'S' sea -12.7105 1.3105 -7.2982 {"}'S' green -12.1868 0.9346 -6.8333 {"}'S' green -12.2587 1.1346 -6.9823 {"}'S' sea -12.3575 1.3003 -7.157 {"}'S' sea -12.4798 1.4266 -7.3495 {"}'S' sea -11.9425 1.0153 -6.8989 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 334 A}'S' P -12.7038 0.8434 -6.8886 {"}'S' -12.7038 0.8434 -6.8886 {"}'S' P -12.4267 0.8182 -6.7929 {"}'S' -12.4261 0.816 -6.7967 {"}'S' P -12.4922 1.0214 -6.9356 {"}'S' -12.4922 1.0214 -6.9356 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 354 A}'S' blue -13.3029 1.3797 -7.1634 {"}'S' sky -13.2162 1.2006 -7.0006 {"}'S' blue -13.1238 1.6853 -7.3746 {"}'S' sky -13.0663 1.4707 -7.2401 {"}'S' blue -12.8762 1.7903 -7.4019 {"}'S' sky -12.8247 1.5717 -7.2747 {"}'S' blue -12.6295 1.8862 -7.3787 {"}'S' sky -12.5813 1.6654 -7.2557 {"}'S' sky -12.3294 1.7223 -7.1636 {"}'S' sky -12.2228 1.5635 -6.9817 { HB3 ALA 354 A}'S' sky -13.2438 0.6939 -6.6765 {"}'S' sky -12.7347 0.3675 -6.3369 {"}'S' sky -12.5875 0.3244 -6.1344 {"}'S' blue -12.4293 0.3422 -5.9359 {"}'S' blue -12.0148 0.5916 -5.8364 {"}'S' blue -11.8021 0.8555 -5.9425 {"}'S' sky -11.7864 0.9589 -6.1822 {"}'S' sky -12.0252 1.4123 -6.7608 {"}'S' sky -11.8974 1.2513 -6.599 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 354 A}'S' sea -12.981 1.2851 -7.0777 {"}'S' sea -12.7419 1.3869 -7.116 {"}'S' sea -12.4951 1.4838 -7.0947 { HB3 ALA 354 A}'S' sea -13.0713 1.045 -6.9601 {"}'S' sea -13.0368 0.8174 -6.8525 {"}'S' sea -12.9658 0.621 -6.7071 {"}'S' sea -12.8632 0.4683 -6.5321 {"}'S' green -12.8134 1.1534 -7.0254 {"}'S' green -12.7941 0.911 -6.9334 {"}'S' green -12.7296 0.7021 -6.7908 {"}'S' green -12.6259 0.5434 -6.6128 {"}'S' sea -12.491 0.4485 -6.4119 {"}'S' sea -12.3353 0.4243 -6.2037 {"}'S' sea -12.172 0.4732 -6.0072 {"}'S' green -12.5469 1.2644 -7.018 {"}'S' green -12.3888 0.6562 -6.646 {"}'S' 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{"}'S' P -11.8615 0.5891 -6.5508 {"}'S' -11.8629 0.5826 -6.5513 {"}'S' P -12.0184 0.6035 -6.7582 {"}'S' -12.0233 0.539 -6.7536 {"}'S' P -12.1805 0.58 -6.9608 {"}'S' -12.1778 0.5048 -6.9468 {"}'S' P -12.3441 0.5185 -7.155 {"}'S' -12.3393 0.4831 -7.1438 {"}'S' P -11.6522 0.543 -6.702 {"}'S' -11.6591 0.521 -6.7012 {"}'S' P -11.8099 0.5603 -6.9094 {"}'S' -11.8254 0.4754 -6.896 {"}'S' P -11.9716 0.5372 -7.1132 {"}'S' -11.9811 0.4413 -7.0855 {"}'S' P -11.5948 0.478 -7.0375 {"}'S' -11.6109 0.4288 -7.0261 {"}'S' P -11.7564 0.4592 -7.2422 {"}'S' -11.7715 0.3945 -7.2172 { CZ TYR 88 A}'S' P -12.4914 0.5491 -7.3018 {"}'S' -12.4892 0.534 -7.309 {"}'S' P -12.2183 0.5867 -7.3506 {"}'S' -12.2209 0.4955 -7.3881 {"}'S' P -12.3607 0.6526 -7.5535 {"}'S' -12.3567 0.5774 -7.5736 {"}'S' P -12.5126 0.6797 -7.7571 {"}'S' -12.5106 0.6679 -7.7584 {"}'S' P -11.8877 0.5321 -7.3221 {"}'S' -11.9103 0.4347 -7.3649 {"}'S' P -12.0221 0.6305 -7.5231 {"}'S' -12.0402 0.5032 -7.5598 {"}'S' P -12.1689 0.6913 -7.7308 {"}'S' -12.1738 0.5898 -7.7468 {"}'S' P -12.3255 0.7143 -7.9381 {"}'S' -12.3244 0.6875 -7.939 {"}'S' P -11.5803 0.4257 -7.3237 {"}'S' -11.5953 0.3922 -7.3399 {"}'S' P -11.7027 0.5503 -7.5176 {"}'S' -11.7344 0.4603 -7.5457 {"}'S' P -11.8406 0.6414 -7.7201 {"}'S' -11.867 0.5343 -7.7386 {"}'S' P -11.9897 0.6944 -7.9274 {"}'S' -12.0003 0.6235 -7.9308 {"}'S' P -11.4947 0.5036 -7.6687 {"}'S' -11.5084 0.4763 -7.6743 {"}'S' P -11.6318 0.5945 -7.8717 {"}'S' -11.6466 0.5548 -7.8744 {"}'S' P -11.7804 0.6483 -8.0786 {"}'S' -11.7827 0.6405 -8.0783 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 104 A}'S' blue -12.7815 0.8566 -6.8765 {"}'S' blue -13.0811 0.9291 -7.7127 {"}'S' sky -12.9436 0.839 -7.5092 {"}'S' sky -12.7945 0.786 -7.3019 {"}'S' sky -12.8814 0.8889 -7.8765 {"}'S' sky -12.7499 0.9626 -8.1561 {"}'S' sky -12.4945 0.9556 -8.2379 {"}'S' sky -12.2805 1.0323 -8.3747 { CD2 TYR 104 A}'S' blue -11.676 0.9466 -9.2736 {"}'S' sky -11.5163 0.9437 -9.0666 {"}'S' sky -11.3533 0.9804 -8.866 {"}'S' blue -11.1898 1.056 -8.6768 {"}'S' sky -11.5292 0.8731 -9.492 {"}'S' sky -11.0465 0.9437 -8.8877 {"}'S' blue -10.8861 1.0414 -8.7079 {"}'S' sky -11.33 0.8303 -9.6577 {"}'S' sky -11.0634 0.8147 -9.7375 {"}'S' sky -10.904 0.8141 -9.5297 {"}'S' sky -10.7402 0.8521 -9.3299 {"}'S' blue -10.8066 0.8444 -9.8273 {"}'S' blue -10.649 0.8561 -9.6265 {"}'S' blue -10.4886 0.9065 -9.4342 { HB2 TYR 104 A}'S' blue -11.1833 0.747 -6.6595 {"}'S' blue -11.2678 0.9144 -8.1308 {"}'S' sky -11.1344 0.8117 -7.9301 { HD2 TYR 104 A}'S' blue -10.5608 0.9783 -8.7751 {"}'S' sky -10.4248 0.8937 -9.004 {"}'S' blue -10.2682 0.9311 -8.8122 {"}'S' blue -10.3118 0.8918 -9.2866 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 104 A}'S' sea -12.7439 0.797 -7.6744 {"}'S' sea -12.6231 0.8469 -7.9599 { CD2 TYR 104 A}'S' sea -11.3715 0.8586 -9.2851 {"}'S' sea -11.2094 0.8821 -9.0825 {"}'S' sea -11.1727 0.814 -9.4492 {"}'S' sea -11.0106 0.8361 -9.2464 {"}'S' sea -10.8482 0.8969 -9.052 { HB2 TYR 104 A}'S' green -12.506 0.7046 -6.7165 {"}'S' sea -12.3436 0.7537 -6.5193 {"}'S' green -12.5601 0.5729 -7.1174 {"}'S' green -12.0973 0.6246 -6.5325 {"}'S' sea -11.9465 0.755 -6.375 {"}'S' green -12.5957 0.6406 -7.5916 {"}'S' green -11.7239 0.6547 -6.4682 {"}'S' green -12.5092 0.7908 -7.9538 {"}'S' green -11.5741 0.5242 -6.6713 {"}'S' green -12.2776 0.7292 -8.0692 {"}'S' green -11.3174 0.567 -6.783 {"}'S' green -11.4632 0.3775 -7.3286 {"}'S' green -11.3054 0.4536 -7.1457 {"}'S' green -11.7635 0.7374 -8.1834 {"}'S' green -11.3691 0.4596 -7.5964 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 104 A}'S' P -12.4128 0.5299 -6.9149 {"}'S' -12.4043 0.5444 -6.9202 {"}'S' P -12.2554 0.5478 -6.7158 {"}'S' -12.2456 0.5701 -6.7297 {"}'S' P -12.4803 0.509 -7.4056 {"}'S' -12.4583 0.5415 -7.4018 {"}'S' P -12.3429 0.4275 -7.2061 {"}'S' -12.3263 0.464 -7.2087 {"}'S' P -12.191 0.4017 -7.0028 {"}'S' -12.1664 0.4786 -7.0227 {"}'S' P -12.0316 0.4322 -6.8056 {"}'S' -12.0184 0.5076 -6.8389 {"}'S' P -11.8732 0.5187 -6.6242 {"}'S' -11.8722 0.5486 -6.6451 {"}'S' P -12.428 0.6084 -7.7978 {"}'S' -12.4065 0.6408 -7.7792 {"}'S' P -12.3193 0.4677 -7.6187 {"}'S' -12.2794 0.5532 -7.5906 {"}'S' P -12.1886 0.3734 -7.4236 {"}'S' -12.1557 0.4794 -7.4098 {"}'S' P -12.0412 0.3317 -7.2213 {"}'S' -12.0281 0.4123 -7.2269 {"}'S' P -11.8857 0.3437 -7.0235 {"}'S' -11.8822 0.4401 -7.0458 {"}'S' P -11.7271 0.4082 -6.8367 {"}'S' -11.7345 0.4725 -6.8633 {"}'S' P -12.19 0.5531 -7.9058 {"}'S' -12.1665 0.6164 -7.8643 {"}'S' P -12.0738 0.4213 -7.7203 {"}'S' -12.0497 0.5368 -7.6728 {"}'S' P -11.9373 0.3399 -7.5202 {"}'S' -11.9268 0.4653 -7.4953 {"}'S' P -11.7849 0.315 -7.3165 {"}'S' -11.7891 0.3953 -7.315 {"}'S' P -11.6255 0.3454 -7.1193 {"}'S' -11.6361 0.3989 -7.1273 {"}'S' P -11.4675 0.4312 -6.9383 {"}'S' -11.4705 0.4394 -6.9409 {"}'S' P -11.9996 0.6564 -8.0998 {"}'S' -11.9972 0.6704 -8.0861 {"}'S' P -11.897 0.5036 -7.9247 {"}'S' -11.8937 0.5742 -7.8781 {"}'S' P -11.7686 0.4028 -7.7296 {"}'S' -11.7752 0.4982 -7.6903 {"}'S' P -11.6213 0.3598 -7.527 {"}'S' -11.6342 0.4291 -7.5127 {"}'S' P -11.6598 0.5787 -8.0055 {"}'S' -11.6625 0.5905 -7.9965 {"}'S' P -11.5249 0.4838 -7.8046 {"}'S' -11.5312 0.5064 -7.7928 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 88 A}'M' greentint -9.2991 2.2468 -5.8963 {"}'M' greentint -9.458 2.1581 -6.0779 {"}'M' greentint -9.6016 2.0504 -6.3503 {"}'M' greentint -9.1961 2.4793 -5.9453 {"}'M' greentint -9.3593 2.446 -6.1471 {"}'M' greentint -9.5079 2.2891 -6.2956 {"}'M' greentint -9.6117 2.1927 -6.5931 {"}'M' greentint -9.0522 2.6845 -6.0073 {"}'M' greentint -9.2101 2.6761 -6.2093 {"}'M' greentint -9.3687 2.583 -6.3877 {"}'M' greentint -9.5079 2.415 -6.5208 {"}'M' greentint -9.5813 2.2867 -6.8379 {"}'M' greentint -8.867 2.8546 -6.0733 {"}'M' greentint -9.0231 2.8652 -6.2771 {"}'M' greentint -9.1833 2.807 -6.4691 {"}'M' greentint -9.3381 2.6839 -6.6338 {"}'M' greentint -9.4738 2.5064 -6.7599 {"}'M' greentint -9.5034 2.3669 -7.0761 {"}'M' greentint -8.7799 3.0086 -6.3192 {"}'M' greentint -8.9404 2.9852 -6.5212 {"}'M' greentint -9.1024 2.903 -6.7069 {"}'M' greentint -9.2547 2.7671 -6.8669 {"}'M' greentint -9.3913 2.5855 -6.9917 {"}'M' greentint -8.8455 3.0481 -6.7802 {"}'M' greentint -9.0014 2.9493 -6.9535 {"}'M' greentint -9.1475 2.8057 -7.1034 {"}'M' greentint -9.2783 2.6237 -7.2218 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 104 A}'M' greentint -9.5625 1.9951 -6.3663 {"}'M' greentint -9.4043 2.0588 -6.18 {"}'M' greentint -9.2541 2.1832 -6.0202 {"}'M' greentint -9.121 2.3588 -5.8971 {"}'M' greentint -9.512 2.0541 -6.7174 {"}'M' greentint -9.3538 2.0563 -6.5136 {"}'M' greentint -9.1931 2.1323 -6.3267 {"}'M' greentint -9.0436 2.2776 -6.1743 {"}'M' greentint -8.919 2.4776 -6.0685 {"}'M' greentint -8.8304 2.7152 -6.0205 {"}'M' greentint -9.4088 2.2168 -6.9724 {"}'M' greentint -9.2601 2.1671 -6.7663 {"}'M' greentint -9.0977 2.212 -6.5683 {"}'M' greentint -8.9435 2.3447 -6.4066 {"}'M' greentint -8.8193 2.548 -6.302 {"}'M' greentint -8.741 2.7937 -6.2699 {"}'M' greentint -9.2808 2.4523 -7.1349 {"}'M' greentint -9.1491 2.3506 -6.9367 {"}'M' greentint -8.9881 2.3787 -6.7367 {"}'M' greentint -8.84 2.5306 -6.5879 {"}'M' greentint -8.7452 2.7647 -6.5306 {"}'M' greentint -8.7289 3.0184 -6.5799 {"}'M' greentint -9.1198 2.7236 -7.1681 {"}'M' greentint -9.0156 2.5684 -6.9903 {"}'M' greentint -8.8556 2.6653 -6.8108 {"}'M' greentint -8.8006 2.9186 -6.8106 {"}'M' greentint -8.9339 2.815 -7.0101 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 88 A}'M' green -10.1016 0.9447 -4.1685 {"}'M' green -10.2349 0.8411 -4.368 {"}'M' green -10.2903 0.995 -4.6481 {"}'M' green -9.7547 1.3074 -4.0437 {"}'M' green -10.262 1.0924 -4.9017 {"}'M' green -10.1652 1.1667 -5.1417 {"}'M' green -9.6012 1.7137 -4.564 {"}'M' green -9.6312 1.7009 -4.9986 {"}'M' green -9.7814 1.5765 -5.1584 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 88 A}'M' greentint -10.0199 1.1913 -4.1883 {"}'M' greentint -10.1799 1.0944 -4.3678 {"}'M' greentint -9.8864 1.4091 -4.2419 {"}'M' greentint -10.0474 1.3811 -4.4419 {"}'M' greentint -10.1955 1.2291 -4.5907 {"}'M' greentint -9.698 1.579 -4.3085 {"}'M' greentint -9.8569 1.5821 -4.5144 {"}'M' greentint -10.0172 1.4911 -4.6973 {"}'M' greentint -10.1586 1.3206 -4.8328 {"}'M' greentint -9.7625 1.6745 -4.7619 {"}'M' greentint -9.9191 1.5625 -4.9333 {"}'M' greentint -10.0577 1.3878 -5.064 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 104 A}'M' sea -10.4317 0.9042 -4.4225 {"}'M' green -10.2736 0.9782 -4.2387 {"}'M' green -10.1218 1.0988 -4.0758 {"}'M' sea -9.9815 1.2608 -3.9398 {"}'M' green -10.3289 0.9826 -4.674 {"}'M' green -9.7385 1.5126 -4.0598 {"}'M' green -10.2545 1.118 -4.9331 {"}'M' green -10.1359 1.2999 -5.0876 {"}'M' green -9.5786 1.8008 -4.507 {"}'M' green -10.0016 1.5078 -5.1634 {"}'M' sea -9.7302 1.8349 -5.021 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 104 A}'M' greentint -10.1663 1.0383 -4.4799 {"}'M' greentint -10.0084 1.1485 -4.3064 {"}'M' greentint -9.8631 1.3102 -4.1634 {"}'M' greentint -10.0953 1.1404 -4.7326 {"}'M' greentint -9.9356 1.229 -4.5516 {"}'M' greentint -9.7889 1.3786 -4.404 {"}'M' greentint -9.6652 1.5783 -4.2993 {"}'M' greentint -9.977 1.3109 -4.8867 {"}'M' greentint -9.82 1.4068 -4.7094 {"}'M' greentint -9.6815 1.5774 -4.5778 {"}'M' greentint -9.8384 1.537 -4.9607 {"}'M' greentint -9.6886 1.6907 -4.8099 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n glu A 93 1yleA_95F_108I}P -12.3647 -2.1434 0.3299 {"}-12.3647 -2.1434 0.3299 { ca glu A 93 1yleA_95F_108I}-10.9675 -1.9995 -0.0558 { c glu A 93 1yleA_95F_108I}-10.8307 -1.1154 -1.2737 { o glu A 93 1yleA_95F_108I}-11.8048 -0.861 -1.9897 { c glu A 93 1yleA_95F_108I}P -10.8307 -1.1154 -1.2737 { n thr A 94 1yleA_95F_108I}-9.6127 -0.6372 -1.4902 { ca thr A 94 1yleA_95F_108I}-9.3441 0.2002 -2.6419 { c thr A 94 1yleA_95F_108I}-8.4289 -0.5044 -3.6261 { o thr A 94 1yleA_95F_108I}-7.6192 -1.352 -3.2675 { c thr A 94 1yleA_95F_108I}P -8.4289 -0.5044 -3.6261 { n phe A 95 1yleA_95F_108I}-8.5683 -0.1453 -4.8879 { ca phe A 95 1yleA_95F_108I}-7.5578 -0.5221 -5.8406 { c phe A 95 1yleA_95F_108I}-7.4076 0.6549 -6.7789 { o phe A 95 1yleA_95F_108I}-8.2328 1.581 -6.7698 { c phe A 95 1yleA_95F_108I}P -7.4076 0.6549 -6.7789 { n val A 96 1yleA_95F_108I}-6.3357 0.6209 -7.5498 { ca val A 96 1yleA_95F_108I}-6.0083 1.6928 -8.4645 { c val A 96 1yleA_95F_108I}-6.0171 1.1127 -9.865 { o val A 96 1yleA_95F_108I}-5.2753 0.1707 -10.1656 { c val A 96 1yleA_95F_108I}P -6.0171 1.1127 -9.865 { n his A 97 1yleA_95F_108I}-6.8835 1.6645 -10.7053 { ca his A 97 1yleA_95F_108I}-6.8966 1.3386 -12.1252 { c his A 97 1yleA_95F_108I}-6.0687 2.3724 -12.8906 { o his A 97 1yleA_95F_108I}-6.4295 3.5448 -12.9474 { n asn A 106 1yleA_95F_108I}P -6.5087 6.0553 -10.944 {"}-6.5087 6.0553 -10.944 { ca asn A 106 1yleA_95F_108I}-7.7498 6.3419 -10.2757 { c asn A 106 1yleA_95F_108I}-7.9693 5.3481 -9.1442 { o asn A 106 1yleA_95F_108I}-8.0489 4.14 -9.3857 { c asn A 106 1yleA_95F_108I}P -7.9693 5.3481 -9.1442 { n lys A 107 1yleA_95F_108I}-8.029 5.8645 -7.9202 { ca lys A 107 1yleA_95F_108I}-8.2291 5.0355 -6.7245 { c lys A 107 1yleA_95F_108I}-9.7244 4.8862 -6.4632 { o lys A 107 1yleA_95F_108I}-10.4275 5.8833 -6.2692 { c lys A 107 1yleA_95F_108I}P -9.7244 4.8862 -6.4632 { n ile A 108 1yleA_95F_108I}-10.1835 3.6319 -6.4284 { ca ile A 108 1yleA_95F_108I}-11.6048 3.2819 -6.4523 { c ile A 108 1yleA_95F_108I}-11.8811 2.3547 -5.27 { o ile A 108 1yleA_95F_108I}-11.0619 1.4728 -5.0034 { c ile A 108 1yleA_95F_108I}P -11.8811 2.3547 -5.27 { n his A 109 1yleA_95F_108I}-13.0076 2.5571 -4.5798 { ca his A 109 1yleA_95F_108I}-13.4718 1.6253 -3.5353 { c his A 109 1yleA_95F_108I}-14.3453 0.507 -4.0979 { o his A 109 1yleA_95F_108I}-15.2133 0.7369 -4.954 { c his A 109 1yleA_95F_108I}P -14.3453 0.507 -4.0979 { n val A 110 1yleA_95F_108I}-14.1245 -0.698 -3.5827 { ca val A 110 1yleA_95F_108I}-14.9812 -1.8437 -3.8803 { c val A 110 1yleA_95F_108I}-15.33 -2.5828 -2.5973 { o val A 110 1yleA_95F_108I}-14.5905 -2.5102 -1.6152 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 93 1yleA_95F_108I}P -12.3647 -2.1434 0.3299 { ca glu A 93 1yleA_95F_108I}P -10.9675 -1.9995 -0.0558 { n thr A 94 1yleA_95F_108I}P -9.6127 -0.6372 -1.4902 { ca thr A 94 1yleA_95F_108I}P -9.3441 0.2002 -2.6419 { n phe A 95 1yleA_95F_108I}P -8.5683 -0.1453 -4.8879 { ca phe A 95 1yleA_95F_108I}P -7.5578 -0.5221 -5.8406 { n val A 96 1yleA_95F_108I}P -6.3357 0.6209 -7.5498 { ca val A 96 1yleA_95F_108I}P -6.0083 1.6928 -8.4645 { n his A 97 1yleA_95F_108I}P -6.8835 1.6645 -10.7053 { ca his A 97 1yleA_95F_108I}P -6.8966 1.3386 -12.1252 { n asn A 106 1yleA_95F_108I}P -6.5087 6.0553 -10.944 { ca asn A 106 1yleA_95F_108I}P -7.7498 6.3419 -10.2757 { n lys A 107 1yleA_95F_108I}P -8.029 5.8645 -7.9202 { ca lys A 107 1yleA_95F_108I}P -8.2291 5.0355 -6.7245 { n ile A 108 1yleA_95F_108I}P -10.1835 3.6319 -6.4284 { ca ile A 108 1yleA_95F_108I}P -11.6048 3.2819 -6.4523 { n his A 109 1yleA_95F_108I}P -13.0076 2.5571 -4.5798 { ca his A 109 1yleA_95F_108I}P -13.4718 1.6253 -3.5353 { n val A 110 1yleA_95F_108I}P -14.1245 -0.698 -3.5827 { ca val A 110 1yleA_95F_108I}P -14.9812 -1.8437 -3.8803 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca glu A 93 1yleA_95F_108I}P -10.9675 -1.9995 -0.0558 {"}-10.9675 -1.9995 -0.0558 { ca thr A 94 1yleA_95F_108I}-9.3441 0.2002 -2.6419 { ca phe A 95 1yleA_95F_108I}-7.5578 -0.5221 -5.8406 { ca val A 96 1yleA_95F_108I}-6.0083 1.6928 -8.4645 { ca his A 97 1yleA_95F_108I}-6.8966 1.3386 -12.1252 { ca asn A 106 1yleA_95F_108I}P -7.7498 6.3419 -10.2757 {"}-7.7498 6.3419 -10.2757 { ca lys A 107 1yleA_95F_108I}-8.2291 5.0355 -6.7245 { ca ile A 108 1yleA_95F_108I}-11.6048 3.2819 -6.4523 { ca his A 109 1yleA_95F_108I}-13.4718 1.6253 -3.5353 { ca val A 110 1yleA_95F_108I}-14.9812 -1.8437 -3.8803 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 95 1yleA_95F_108I}P -7.5578 -0.5221 -5.8406 { cb phe A 95 1yleA_95F_108I}-7.9288 -1.8207 -6.5605 { cg phe A 95 1yleA_95F_108I}-8.9308 -1.6433 -7.6509 { cd1 phe A 95 1yleA_95F_108I}-8.512 -1.5479 -8.9766 { ce1 phe A 95 1yleA_95F_108I}-9.4319 -1.3745 -10.0069 { cz phe A 95 1yleA_95F_108I}-10.7881 -1.2948 -9.7085 { cg phe A 95 1yleA_95F_108I}P -8.9308 -1.6433 -7.6509 { cd2 phe A 95 1yleA_95F_108I}-10.2856 -1.5751 -7.3634 { ce2 phe A 95 1yleA_95F_108I}-11.2199 -1.4022 -8.3944 { cz phe A 95 1yleA_95F_108I}ghost -10.7881 -1.2948 -9.7085 { ca ile A 108 1yleA_95F_108I}P -11.6048 3.2819 -6.4523 { cb ile A 108 1yleA_95F_108I}-11.911 2.5331 -7.7851 { cg1 ile A 108 1yleA_95F_108I}-11.7197 3.4877 -8.9719 { cd1 ile A 108 1yleA_95F_108I}-11.4443 2.7841 -10.2855 { cb ile A 108 1yleA_95F_108I}P -11.911 2.5331 -7.7851 { cg2 ile A 108 1yleA_95F_108I}-13.3162 1.9302 -7.8113 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 95 1yleA_95F_108I}P -7.9288 -1.8207 -6.5605 {"}P -7.9288 -1.8207 -6.5605 { cd1 phe A 95 1yleA_95F_108I}P -8.512 -1.5479 -8.9766 { cd2 phe A 95 1yleA_95F_108I}P -10.2856 -1.5751 -7.3634 { ce1 phe A 95 1yleA_95F_108I}P -9.4319 -1.3745 -10.0069 { ce2 phe A 95 1yleA_95F_108I}P -11.2199 -1.4022 -8.3944 { cz phe A 95 1yleA_95F_108I}P -10.7881 -1.2948 -9.7085 { cb ile A 108 1yleA_95F_108I}P -11.911 2.5331 -7.7851 { cg1 ile A 108 1yleA_95F_108I}P -11.7197 3.4877 -8.9719 {"}P -11.7197 3.4877 -8.9719 { cg2 ile A 108 1yleA_95F_108I}P -13.3162 1.9302 -7.8113 {"}P -13.3162 1.9302 -7.8113 {"}P -13.3162 1.9302 -7.8113 { cd1 ile A 108 1yleA_95F_108I}P -11.4443 2.7841 -10.2855 {"}P -11.4443 2.7841 -10.2855 {"}P -11.4443 2.7841 -10.2855 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 95 A}'S' blue -12.0187 0.114 -8.0397 {"}'S' blue -12.1815 0.0513 -8.2325 {"}'S' blue -11.453 0.1804 -7.685 {"}'S' sky -11.6009 0.2302 -7.8899 {"}'S' blue -11.7568 0.2358 -8.094 {"}'S' sky -11.1799 0.218 -7.7338 {"}'S' sky -11.4743 0.311 -8.1403 {"}'S' blue -11.6319 0.2979 -8.3408 {"}'S' blue -10.8493 0.1634 -7.7053 {"}'S' sky -10.9837 0.2618 -7.9063 {"}'S' sky -11.2871 0.3456 -8.3213 {"}'S' blue -11.4487 0.3281 -8.5262 {"}'S' sky -10.8022 0.2727 -8.1033 {"}'S' sky -10.9513 0.3257 -8.3106 {"}'S' sky -11.1082 0.34 -8.5181 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 95 A}'S' sea -11.3224 0.2839 -7.9367 {"}'S' sea -11.1305 0.3226 -8.114 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 ILE 108 A}'S' blue -12.441 0.4379 -8.0739 { HB ILE 108 A}'S' blue -11.6786 0.6789 -8.1942 {"}'S' sky -11.5479 0.5845 -7.9992 {"}'S' sky -11.4006 0.5429 -7.7969 {"}'S' blue -11.2451 0.5549 -7.599 {"}'S' sky -11.4332 0.6325 -8.2959 {"}'S' sky -10.9848 0.5566 -7.6948 {"}'S' blue -11.2564 0.7148 -8.5003 {"}'S' sky -11.1279 0.614 -8.3051 {"}'S' sky -10.9807 0.571 -8.1026 {"}'S' sky -10.8225 0.5887 -7.9041 {"}'S' blue -10.8842 0.695 -8.3801 {"}'S' blue -10.7285 0.6708 -8.172 @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 108 A}'S' sea -11.2966 0.5511 -8.0958 {"}'S' sea -11.1442 0.5261 -7.8921 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 95 A}'M' greentint -9.2459 2.0622 -5.9319 {"}'M' greentint -9.4049 1.9735 -6.1134 {"}'M' greentint -9.5485 1.8657 -6.3859 {"}'M' greentint -9.1429 2.2947 -5.9808 {"}'M' greentint -9.3062 2.2613 -6.1827 {"}'M' greentint -9.4548 2.1044 -6.3312 {"}'M' greentint -9.5585 2.0081 -6.6286 {"}'M' greentint -8.8612 2.4205 -5.8432 {"}'M' greentint -8.999 2.4999 -6.0428 {"}'M' greentint -9.1569 2.4915 -6.2448 {"}'M' greentint -9.3155 2.3983 -6.4232 {"}'M' greentint -9.4548 2.2304 -6.5564 {"}'M' greentint -9.5281 2.1021 -6.8734 {"}'M' greentint -8.8138 2.6699 -6.1088 {"}'M' greentint -8.97 2.6806 -6.3127 {"}'M' greentint -9.1301 2.6224 -6.5047 {"}'M' greentint -9.2849 2.4993 -6.6693 {"}'M' greentint -9.4207 2.3218 -6.7955 {"}'M' greentint -9.4502 2.1823 -7.1117 {"}'M' greentint -8.7267 2.824 -6.3547 {"}'M' greentint -8.8868 2.8 -6.5561 {"}'M' greentint -9.0493 2.7184 -6.7424 {"}'M' greentint -9.2015 2.5825 -6.9024 {"}'M' greentint -9.3382 2.4009 -7.0272 {"}'M' greentint -8.6332 2.9145 -6.6236 {"}'M' greentint -8.7924 2.8634 -6.8158 {"}'M' greentint -8.9482 2.7647 -6.9891 {"}'M' greentint -9.0943 2.6211 -7.139 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 108 A}'M' greentint -9.5839 1.8485 -6.5398 {"}'M' greentint -9.4296 1.8478 -6.3406 {"}'M' greentint -9.2714 1.9115 -6.1543 {"}'M' greentint -9.1211 2.036 -5.9945 {"}'M' greentint -8.988 2.2116 -5.8714 {"}'M' greentint -9.5204 1.9798 -6.8947 {"}'M' greentint -9.379 1.9068 -6.6917 {"}'M' greentint -9.2208 1.909 -6.4879 {"}'M' greentint -9.0601 1.985 -6.3011 {"}'M' greentint -8.9106 2.1303 -6.1487 {"}'M' greentint -8.786 2.3303 -6.0428 {"}'M' greentint -8.6974 2.5679 -5.9948 {"}'M' greentint -9.3919 2.2065 -7.1349 {"}'M' greentint -9.2758 2.0695 -6.9467 {"}'M' greentint -9.1271 2.0198 -6.7406 {"}'M' greentint -8.9647 2.0647 -6.5427 {"}'M' greentint -8.8105 2.1974 -6.3809 {"}'M' greentint -8.6863 2.4007 -6.2763 {"}'M' greentint -8.608 2.6464 -6.2442 {"}'M' greentint -9.1478 2.305 -7.1092 {"}'M' greentint -9.0161 2.2033 -6.911 {"}'M' greentint -8.8551 2.2314 -6.7111 {"}'M' greentint -8.7071 2.3833 -6.5622 {"}'M' greentint -8.6122 2.6174 -6.5049 {"}'M' greentint -8.596 2.8711 -6.5542 {"}'M' greentint -8.9868 2.5763 -7.1424 {"}'M' greentint -8.8826 2.4211 -6.9646 {"}'M' greentint -8.7226 2.5181 -6.7851 {"}'M' greentint -8.6677 2.7713 -6.7849 {"}'M' greentint -8.8009 2.6677 -6.9844 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 95 A}'M' green -10.2458 0.5199 -5.6443 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 95 A}'M' greentint -10.114 0.5469 -4.6534 {"}'M' greentint -10.2473 0.4432 -4.8529 {"}'M' greentint -10.0324 0.7934 -4.6733 {"}'M' greentint -10.1923 0.6965 -4.8527 {"}'M' greentint -10.3027 0.5971 -5.133 {"}'M' greentint -10.319 0.3434 -5.0837 {"}'M' greentint -9.8989 1.0113 -4.7268 {"}'M' greentint -10.0599 0.9832 -4.9268 {"}'M' greentint -10.2079 0.8313 -5.0757 {"}'M' greentint -10.2744 0.6946 -5.3866 {"}'M' greentint -10.3248 0.4399 -5.382 {"}'M' greentint -9.7104 1.1811 -4.7935 {"}'M' greentint -9.8693 1.1843 -4.9994 {"}'M' greentint -10.0296 1.0932 -5.1822 {"}'M' greentint -10.171 0.9227 -5.3178 {"}'M' greentint -10.1776 0.7689 -5.6266 {"}'M' greentint -9.7749 1.2767 -5.2468 {"}'M' greentint -9.9315 1.1646 -5.4182 {"}'M' greentint -10.0701 0.9899 -5.549 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 108 A}'M' green -10.1363 0.5133 -4.5754 {"}'M' green -10.321 0.2907 -5.1154 {"}'M' green -9.6761 1.3158 -4.8832 {"}'M' green -10.2906 0.5523 -5.7232 {"}'M' green -10.1563 0.7602 -5.799 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 108 A}'M' greentint -10.1632 0.401 -4.942 {"}'M' greentint -10.0178 0.5627 -4.799 {"}'M' greentint -9.8932 0.7651 -4.6954 {"}'M' greentint -9.7968 0.9982 -4.6356 {"}'M' greentint -10.2501 0.3929 -5.3682 {"}'M' greentint -10.0904 0.4814 -5.1872 {"}'M' greentint -9.9437 0.631 -5.0396 {"}'M' greentint -9.8199 0.8308 -4.9349 {"}'M' greentint -9.7281 1.065 -4.8816 {"}'M' greentint -10.1318 0.5634 -5.5223 {"}'M' greentint -9.9748 0.6592 -5.3449 {"}'M' greentint -9.8363 0.8298 -5.2134 {"}'M' greentint -9.7334 1.0533 -5.1425 {"}'M' greentint -9.679 1.303 -5.1422 {"}'M' greentint -9.9932 0.7894 -5.5963 {"}'M' greentint -9.8434 0.9431 -5.4455 {"}'M' greentint -9.7481 1.1794 -5.388 {"}'M' greentint -9.885 1.0874 -5.6565 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg A 123 1yq2A_125F_182}P -12.2245 -2.1972 0.2108 {"}-12.2245 -2.1972 0.2108 { ca arg A 123 1yq2A_125F_182}-10.9736 -2.414 -0.5096 { c arg A 123 1yq2A_125F_182}-10.7972 -1.1984 -1.4106 { o arg A 123 1yq2A_125F_182}-11.7283 -0.8131 -2.1132 { c arg A 123 1yq2A_125F_182}P -10.7972 -1.1984 -1.4106 { n arg A 124 1yq2A_125F_182}-9.6285 -0.5679 -1.3277 { ca arg A 124 1yq2A_125F_182}-9.2479 0.5055 -2.2418 { c arg A 124 1yq2A_125F_182}-8.2794 -0.0777 -3.2457 { o arg A 124 1yq2A_125F_182}-7.4606 -0.9541 -2.916 { c arg A 124 1yq2A_125F_182}P -8.2794 -0.0777 -3.2457 { n phe A 125 1yq2A_125F_182}-8.3767 0.3976 -4.48 { ca phe A 125 1yq2A_125F_182}-7.5502 -0.1403 -5.5482 { c phe A 125 1yq2A_125F_182}-7.3706 0.8863 -6.6683 { o phe A 125 1yq2A_125F_182}-8.1341 1.8593 -6.7908 { c phe A 125 1yq2A_125F_182}P -7.3706 0.8863 -6.6683 { n asp A 126 1yq2A_125F_182}-6.3313 0.6636 -7.4527 { ca asp A 126 1yq2A_125F_182}-5.9494 1.5624 -8.5287 { c asp A 126 1yq2A_125F_182}-6.2378 0.8925 -9.8568 { o asp A 126 1yq2A_125F_182}-5.8607 -0.2549 -10.0808 { c asp A 126 1yq2A_125F_182}P -6.2378 0.8925 -9.8568 { n val A 127 1yq2A_125F_182}-6.9139 1.616 -10.7341 { ca val A 127 1yq2A_125F_182}-7.1275 1.1439 -12.0974 { c val A 127 1yq2A_125F_182}-6.3276 2.0063 -13.0772 { o val A 127 1yq2A_125F_182}-6.5235 3.2341 -13.1126 { n gly A 180 1yq2A_125F_182}P -7.6313 5.6818 -11.9351 {"}-7.6313 5.6818 -11.9351 { ca gly A 180 1yq2A_125F_182}-7.0467 6.0326 -10.6471 { c gly A 180 1yq2A_125F_182}-7.6616 5.3235 -9.4563 { o gly A 180 1yq2A_125F_182}-7.7348 4.1045 -9.4455 { c gly A 180 1yq2A_125F_182}P -7.6616 5.3235 -9.4563 { n ser A 181 1yq2A_125F_182}-8.0805 6.1109 -8.457 { ca ser A 181 1yq2A_125F_182}-8.5254 5.6276 -7.1383 { c ser A 181 1yq2A_125F_182}-9.9668 5.1543 -7.1855 { o ser A 181 1yq2A_125F_182}-10.8458 5.9003 -7.624 { c ser A 181 1yq2A_125F_182}P -9.9668 5.1543 -7.1855 { n asn A 182 1yq2A_125F_182}-10.194 3.931 -6.7023 { ca asn A 182 1yq2A_125F_182}-11.5307 3.3339 -6.6534 { c asn A 182 1yq2A_125F_182}-11.7567 2.6184 -5.326 { o asn A 182 1yq2A_125F_182}-10.8005 2.2485 -4.6335 { c asn A 182 1yq2A_125F_182}P -11.7567 2.6184 -5.326 { n leu A 183 1yq2A_125F_182}-13.0297 2.4045 -4.9989 { ca leu A 183 1yq2A_125F_182}-13.4359 1.7654 -3.7677 { c leu A 183 1yq2A_125F_182}-14.3695 0.6211 -4.1451 { o leu A 183 1yq2A_125F_182}-15.2366 0.801 -4.9919 { c leu A 183 1yq2A_125F_182}P -14.3695 0.6211 -4.1451 { n leu A 184 1yq2A_125F_182}-14.1446 -0.5368 -3.529 { ca leu A 184 1yq2A_125F_182}-15.0239 -1.7105 -3.6273 { c leu A 184 1yq2A_125F_182}-15.4952 -2.0279 -2.215 { o leu A 184 1yq2A_125F_182}-14.6702 -2.1102 -1.2891 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 123 1yq2A_125F_182}P -12.2245 -2.1972 0.2108 { ca arg A 123 1yq2A_125F_182}P -10.9736 -2.414 -0.5096 { n arg A 124 1yq2A_125F_182}P -9.6285 -0.5679 -1.3277 { ca arg A 124 1yq2A_125F_182}P -9.2479 0.5055 -2.2418 { n phe A 125 1yq2A_125F_182}P -8.3767 0.3976 -4.48 { ca phe A 125 1yq2A_125F_182}P -7.5502 -0.1403 -5.5482 { n asp A 126 1yq2A_125F_182}P -6.3313 0.6636 -7.4527 { ca asp A 126 1yq2A_125F_182}P -5.9494 1.5624 -8.5287 { n val A 127 1yq2A_125F_182}P -6.9139 1.616 -10.7341 { ca val A 127 1yq2A_125F_182}P -7.1275 1.1439 -12.0974 { n gly A 180 1yq2A_125F_182}P -7.6313 5.6818 -11.9351 { ca gly A 180 1yq2A_125F_182}P -7.0467 6.0326 -10.6471 {"}P -7.0467 6.0326 -10.6471 { n ser A 181 1yq2A_125F_182}P -8.0805 6.1109 -8.457 { ca ser A 181 1yq2A_125F_182}P -8.5254 5.6276 -7.1383 { n asn A 182 1yq2A_125F_182}P -10.194 3.931 -6.7023 { ca asn A 182 1yq2A_125F_182}P -11.5307 3.3339 -6.6534 { n leu A 183 1yq2A_125F_182}P -13.0297 2.4045 -4.9989 { ca leu A 183 1yq2A_125F_182}P -13.4359 1.7654 -3.7677 { n leu A 184 1yq2A_125F_182}P -14.1446 -0.5368 -3.529 { ca leu A 184 1yq2A_125F_182}P -15.0239 -1.7105 -3.6273 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca arg A 123 1yq2A_125F_182}P -10.9736 -2.414 -0.5096 {"}-10.9736 -2.414 -0.5096 { ca arg A 124 1yq2A_125F_182}-9.2479 0.5055 -2.2418 { ca phe A 125 1yq2A_125F_182}-7.5502 -0.1403 -5.5482 { ca asp A 126 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-1.2343 -6.0969 { cd2 tyr A 179 1yr2A_179Y_192}P -9.8897 -1.2794 -8.2687 { ce1 tyr A 179 1yr2A_179Y_192}P -12.126 -1.0673 -6.6675 { ce2 tyr A 179 1yr2A_179Y_192}P -11.1203 -1.0854 -8.8176 { oh tyr A 179 1yr2A_179Y_192}P -13.4758 -0.8424 -8.5774 { cb lys A 192 1yr2A_179Y_192}P -12.2694 2.5543 -7.7654 {"}P -12.2694 2.5543 -7.7654 { cg lys A 192 1yr2A_179Y_192}P -12.3409 3.345 -9.0415 {"}P -12.3409 3.345 -9.0415 { cd lys A 192 1yr2A_179Y_192}P -12.9521 2.5671 -10.1745 {"}P -12.9521 2.5671 -10.1745 { ce lys A 192 1yr2A_179Y_192}P -12.6938 3.3 -11.4737 {"}P -12.6938 3.3 -11.4737 { nz lys A 192 1yr2A_179Y_192}P -13.4577 2.7386 -12.6084 {"}P -13.4577 2.7386 -12.6084 {"}P -13.4577 2.7386 -12.6084 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 179 A}'S' blue -12.3548 0.663 -6.7993 {"}'S' blue -12.5187 0.6063 -6.995 {"}'S' blue -12.6798 0.5126 -7.1768 {"}'S' blue -12.0143 0.6749 -6.7912 {"}'S' sky -12.1764 0.6514 -6.9937 {"}'S' sky -12.34 0.5899 -7.188 {"}'S' sky -11.8058 0.6317 -6.9423 {"}'S' blue -11.4348 0.528 -6.8628 {"}'S' sky -11.3788 0.4309 -7.1776 { CE2 TYR 179 A}'S' sky -11.6931 0.5621 -8.9564 {"}'S' blue -12.0036 0.3469 -9.2974 {"}'S' blue -12.1472 0.1883 -9.4387 {"}'S' sky -10.7497 0.4802 -8.1285 {"}'S' sky -11.3491 0.6449 -8.9494 {"}'S' blue -11.6741 0.4945 -9.3268 {"}'S' blue -11.8296 0.3648 -9.4926 {"}'S' blue -11.9758 0.2029 -9.6367 {"}'S' blue -10.7026 0.5894 -8.5265 {"}'S' blue -10.8517 0.6424 -8.7338 {"}'S' blue -11.6494 0.3418 -9.682 {"}'S' blue -11.7944 0.1781 -9.824 { CZ TYR 179 A}'S' blue -12.866 0.5199 -7.4602 {"}'S' sky -12.4614 0.5714 -7.3086 {"}'S' sky -12.9256 0.5906 -7.9149 {"}'S' sky -12.8011 0.6364 -8.1569 {"}'S' sky -12.621 0.6625 -8.3455 {"}'S' blue -12.3359 0.304 -9.1677 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 179 A}'S' sea -11.9675 0.6087 -7.1462 {"}'S' sea -11.5907 0.5494 -7.0705 {"}'S' green -11.7523 0.5306 -7.2751 { CE2 TYR 179 A}'S' sea -10.9524 0.4318 -7.962 {"}'S' green -11.0803 0.5348 -8.157 {"}'S' green -11.2227 0.6006 -8.3599 {"}'S' green -11.3747 0.6278 -8.5635 {"}'S' sea -11.5323 0.6147 -8.764 {"}'S' sea -10.8841 0.5786 -8.3295 {"}'S' sea -11.0309 0.6394 -8.5371 {"}'S' sea -11.1875 0.6624 -8.7445 { CZ TYR 179 A}'S' sea -12.6093 0.6212 -7.5136 {"}'S' sea -12.7652 0.6268 -7.7177 {"}'S' sea -12.1883 0.609 -7.3574 {"}'S' green -12.3307 0.6749 -7.5603 {"}'S' green -12.4826 0.702 -7.7639 {"}'S' sea -12.6403 0.6889 -7.9644 {"}'S' green -11.8577 0.5544 -7.3289 {"}'S' green -12.4571 0.7192 -8.1498 {"}'S' sea -11.5503 0.4481 -7.3305 {"}'S' green -12.2787 0.7075 -8.3443 {"}'S' sea -11.3424 0.3996 -7.483 {"}'S' green -11.4647 0.5259 -7.6755 {"}'S' green -12.0698 0.6648 -8.4967 {"}'S' green -11.2547 0.427 -7.8051 {"}'S' green -11.3895 0.5246 -8.0065 {"}'S' green -11.693 0.6056 -8.421 {"}'S' green -11.8546 0.5868 -8.6256 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 179 A}'S' P -11.9921 0.6529 -7.5299 {"}'S' -11.9933 0.6423 -7.5326 {"}'S' P -12.1389 0.7136 -7.7376 {"}'S' -12.141 0.6782 -7.7426 {"}'S' P -12.2955 0.7366 -7.9449 {"}'S' -12.2947 0.7227 -7.9459 {"}'S' P -11.6727 0.5727 -7.5244 {"}'S' -11.6727 0.5727 -7.5244 {"}'S' P -11.8106 0.6637 -7.7269 {"}'S' -11.8259 0.6017 -7.7371 {"}'S' P -11.9597 0.7167 -7.9342 {"}'S' -11.9722 0.6357 -7.938 {"}'S' P -12.1166 0.731 -8.1417 {"}'S' -12.1197 0.6842 -8.1387 {"}'S' P -11.6018 0.6168 -7.8785 {"}'S' -11.6224 0.5633 -7.8826 {"}'S' P -11.7504 0.6706 -8.0854 {"}'S' -11.7715 0.5983 -8.0824 {"}'S' P -11.9081 0.6878 -8.2928 {"}'S' -11.9154 0.6453 -8.2864 {"}'S' P -11.5371 0.5841 -8.2133 {"}'S' -11.5451 0.5646 -8.2112 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 179 A}'S' blue -13.0569 0.2334 -9.3697 { HH TYR 179 A}'S' blue -12.9865 0.0818 -9.7276 {"}'S' blue -13.1408 0.0825 -9.9267 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 192 A}'S' blue -12.889 0.9445 -7.4724 {"}'S' blue -12.7293 0.9415 -7.2654 {"}'S' blue -12.5663 0.9783 -7.0647 {"}'S' blue -12.4028 1.0539 -6.8755 {"}'S' sky -12.8913 0.9239 -7.898 {"}'S' sky -12.4224 0.8799 -7.2813 {"}'S' sky -12.2596 0.9415 -7.0865 {"}'S' blue -12.0992 1.0392 -6.9066 {"}'S' sky -12.8291 0.9738 -8.2653 {"}'S' sky -12.5709 0.9318 -8.3488 {"}'S' blue -12.4415 1.0404 -8.6273 { HB2 LYS 192 A}'S' sky -11.7379 0.9419 -7.0161 {"}'S' sky -11.5153 0.8416 -7.1093 {"}'S' sky -11.3656 0.7111 -7.3123 {"}'S' sky -11.0968 0.6404 -7.7868 {"}'S' sky -11.5549 0.9243 -8.8245 {"}'S' blue -11.3167 1.0311 -8.8548 {"}'S' blue -10.9258 0.9985 -8.5712 { HD2 LYS 192 A}'S' blue -13.0887 0.6023 -9.846 {"}'S' blue -12.9313 0.6202 -9.647 {"}'S' blue -12.8669 0.4742 -9.934 {"}'S' blue -12.3998 0.7271 -9.3994 {"}'S' blue -12.2501 0.5967 -9.6024 {"}'S' blue -12.1106 0.7574 -9.4656 {"}'S' blue -12.1434 0.5036 -9.8695 {"}'S' blue -11.9933 0.6394 -9.7141 {"}'S' blue -11.8592 0.8194 -9.5907 {"}'S' blue -11.8309 0.6574 -9.9184 @dotlist {x} color= white width= 1 master= {vdw contact} { CB LYS 192 A}'S' sea -12.7422 0.8709 -7.6907 {"}'S' sea -12.5845 0.8565 -7.4838 {"}'S' sea -12.6917 0.8819 -8.0633 {"}'S' green -12.543 0.8282 -7.8564 {"}'S' green -12.3857 0.8118 -7.648 { HB2 LYS 192 A}'S' green -12.3515 0.7598 -7.7585 {"}'S' green -12.2042 0.7167 -7.5559 {"}'S' green -12.0468 0.7346 -7.3568 {"}'S' sea -11.8887 0.8114 -7.1736 {"}'S' green -12.3871 0.8275 -8.2327 {"}'S' green -11.823 0.619 -7.4466 {"}'S' sea -11.6646 0.7056 -7.2652 {"}'S' green -12.2195 0.7953 -8.4388 {"}'S' green -11.5185 0.595 -7.4778 {"}'S' green -11.9814 0.7399 -8.5468 {"}'S' green -11.4169 0.5323 -7.7603 {"}'S' sea -11.2589 0.618 -7.5793 {"}'S' green -11.6885 0.6904 -8.5658 {"}'S' green -11.56 0.5897 -8.3706 {"}'S' green -11.4127 0.5466 -8.1681 {"}'S' green -11.255 0.5636 -7.97 {"}'S' green -11.4512 0.7655 -8.6465 {"}'S' green -11.3163 0.6707 -8.4456 {"}'S' green -11.1605 0.6464 -8.2374 {"}'S' sea -10.9973 0.6954 -8.0409 {"}'S' sea -11.2141 0.8784 -8.6797 {"}'S' sea -11.0769 0.8034 -8.4803 {"}'S' sea -10.9206 0.8141 -8.281 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 LYS 192 A}'S' P -12.2717 0.6959 -8.0467 {"}'S' -12.26 0.7138 -8.0451 {"}'S' P -12.1344 0.6144 -7.8472 {"}'S' -12.1103 0.6654 -7.8516 {"}'S' P -11.9824 0.5886 -7.6439 {"}'S' -11.9694 0.6301 -7.6544 {"}'S' P -12.1107 0.6546 -8.2597 {"}'S' -12.0981 0.6819 -8.2505 {"}'S' P -11.98 0.5602 -8.0647 {"}'S' -11.9564 0.6355 -8.0548 {"}'S' P -11.8327 0.5185 -7.8624 {"}'S' -11.8191 0.5986 -7.8672 {"}'S' P -11.6771 0.5305 -7.6645 {"}'S' -11.6757 0.5671 -7.6726 {"}'S' P -11.8652 0.6081 -8.3614 {"}'S' -11.8601 0.6329 -8.3515 {"}'S' P -11.7287 0.5268 -8.1613 {"}'S' -11.7231 0.5894 -8.1491 {"}'S' P -11.5763 0.5018 -7.9576 {"}'S' -11.5795 0.5525 -7.9564 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 179 A}'M' greentint -9.4147 2.095 -6.2759 {"}'M' greentint -9.5582 1.9872 -6.5483 {"}'M' greentint -9.1527 2.4162 -6.1432 {"}'M' greentint -9.316 2.3829 -6.3451 {"}'M' greentint -9.4646 2.2259 -6.4936 {"}'M' greentint -9.5683 2.1296 -6.7911 {"}'M' greentint -9.6248 1.8801 -6.7943 {"}'M' greentint -9.0088 2.6214 -6.2053 {"}'M' greentint -9.1667 2.613 -6.4073 {"}'M' greentint -9.3253 2.5199 -6.5857 {"}'M' greentint -9.4645 2.3519 -6.7188 {"}'M' greentint -9.5379 2.2236 -7.0359 {"}'M' greentint -9.609 1.9785 -7.0601 {"}'M' greentint -8.9797 2.8021 -6.4751 {"}'M' greentint -9.1399 2.7439 -6.6671 {"}'M' greentint -9.2947 2.6208 -6.8318 {"}'M' greentint -9.4304 2.4433 -6.9579 {"}'M' greentint -9.46 2.3038 -7.2741 {"}'M' greentint -9.5412 2.0606 -7.3125 {"}'M' greentint -8.897 2.9221 -6.7192 {"}'M' greentint -9.0591 2.8399 -6.9049 {"}'M' greentint -9.2113 2.704 -7.0649 {"}'M' greentint -9.3479 2.5224 -7.1896 {"}'M' greentint -9.3455 2.3486 -7.5038 {"}'M' greentint -8.8022 2.985 -6.9782 {"}'M' greentint -8.958 2.8862 -7.1515 {"}'M' greentint -9.1041 2.7426 -7.3014 {"}'M' greentint -9.2349 2.5606 -7.4198 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 192 A}'M' greentint -9.5752 1.8307 -6.7853 {"}'M' greentint -9.417 1.8944 -6.5989 {"}'M' greentint -9.2667 2.0189 -6.4391 {"}'M' greentint -9.1336 2.1945 -6.316 {"}'M' greentint -9.0284 2.4091 -6.2383 {"}'M' greentint -8.9549 2.6489 -6.2114 {"}'M' greentint -9.5246 1.8897 -7.1363 {"}'M' greentint -9.3664 1.8919 -6.9325 {"}'M' greentint -9.2057 1.9679 -6.7457 {"}'M' greentint -9.0562 2.1133 -6.5933 {"}'M' greentint -8.9316 2.3132 -6.4874 {"}'M' greentint -8.843 2.5508 -6.4394 {"}'M' greentint -8.7985 2.8056 -6.4521 {"}'M' greentint -9.4215 2.0524 -7.3913 {"}'M' greentint -9.2727 2.0028 -7.1852 {"}'M' greentint -9.1104 2.0477 -6.9873 {"}'M' greentint -8.9561 2.1803 -6.8255 {"}'M' greentint -8.8319 2.3836 -6.7209 {"}'M' greentint -8.7536 2.6293 -6.6888 {"}'M' greentint -8.7326 2.8847 -6.7321 {"}'M' greentint -9.2934 2.288 -7.5538 {"}'M' greentint -9.1617 2.1862 -7.3556 {"}'M' greentint -9.0007 2.2143 -7.1557 {"}'M' greentint -8.8527 2.3662 -7.0068 {"}'M' greentint -8.7579 2.6004 -6.9495 {"}'M' greentint -8.7416 2.8541 -6.9988 {"}'M' greentint -9.1324 2.5592 -7.587 {"}'M' greentint -9.0282 2.4041 -7.4092 {"}'M' greentint -8.8682 2.501 -7.2297 {"}'M' greentint -8.8133 2.7543 -7.2295 {"}'M' greentint -8.9465 2.6506 -7.429 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 179 A}'M' greentint -10.0154 1.0952 -4.285 {"}'M' greentint -10.1487 0.9915 -4.4845 {"}'M' greentint -9.9338 1.3417 -4.3049 {"}'M' greentint -10.0937 1.2448 -4.4843 {"}'M' greentint -10.2041 1.1454 -4.7646 {"}'M' greentint -10.2204 0.8917 -4.7152 {"}'M' greentint -9.8003 1.5596 -4.3584 {"}'M' greentint -9.9613 1.5315 -4.5584 {"}'M' greentint -10.1093 1.3796 -4.7072 {"}'M' greentint -10.1759 1.2429 -5.0182 {"}'M' greentint -10.2263 0.9882 -5.0135 {"}'M' greentint -10.2176 0.7404 -4.9331 {"}'M' greentint -9.6119 1.7294 -4.425 {"}'M' greentint -9.7707 1.7326 -4.6309 {"}'M' greentint -9.931 1.6415 -4.8138 {"}'M' greentint -10.0724 1.471 -4.9494 {"}'M' greentint -10.079 1.3172 -5.2582 {"}'M' greentint -10.1473 1.0682 -5.2759 {"}'M' greentint -9.515 1.8641 -4.6805 {"}'M' greentint -9.6763 1.825 -4.8784 {"}'M' greentint -9.8329 1.7129 -5.0498 {"}'M' greentint -9.9715 1.5382 -5.1805 {"}'M' greentint -9.9336 1.3367 -5.4758 {"}'M' greentint -10.0071 1.0969 -5.5027 {"}'M' greentint -9.545 1.8514 -5.1151 {"}'M' greentint -9.6952 1.7269 -5.2749 {"}'M' greentint -9.8284 1.5513 -5.398 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 192 A}'M' greentint -10.162 0.7602 -4.6669 {"}'M' greentint -10.0102 0.8809 -4.5041 {"}'M' greentint -9.8699 1.0429 -4.368 {"}'M' greentint -9.7479 1.2395 -4.265 {"}'M' greentint -9.6496 1.4644 -4.199 {"}'M' greentint -10.0546 0.8203 -4.9081 {"}'M' greentint -9.8968 0.9306 -4.7346 {"}'M' greentint -9.7514 1.0923 -4.5917 {"}'M' greentint -9.6268 1.2947 -4.4881 {"}'M' greentint -9.5304 1.5278 -4.4282 {"}'M' greentint -9.9837 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-6.3548 {"}'M' greentint -9.019 2.8064 -6.5195 {"}'M' greentint -9.1547 2.6289 -6.6457 {"}'M' greentint -9.1843 2.4894 -6.9618 {"}'M' greentint -9.2655 2.2462 -7.0002 {"}'M' greentint -8.7833 3.0255 -6.5926 {"}'M' greentint -8.9356 2.8896 -6.7526 {"}'M' greentint -9.0722 2.708 -6.8774 {"}'M' greentint -9.0698 2.5342 -7.1915 {"}'M' greentint -9.1553 2.2993 -7.236 {"}'M' greentint -8.6822 3.0718 -6.8392 {"}'M' greentint -8.8284 2.9282 -6.9891 {"}'M' greentint -8.9592 2.7462 -7.1075 {"}'M' greentint -8.8053 2.769 -7.3142 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TRP 246 A}'M' greentint -9.3026 2.0721 -6.5515 {"}'M' greentint -9.1524 2.1966 -6.3917 {"}'M' greentint -9.0192 2.3722 -6.2686 {"}'M' greentint -8.914 2.5868 -6.1909 {"}'M' greentint -8.8405 2.8266 -6.164 {"}'M' greentint -9.252 2.0696 -6.8851 {"}'M' greentint -9.0913 2.1456 -6.6982 {"}'M' greentint -8.9418 2.291 -6.5459 {"}'M' greentint -8.8172 2.4909 -6.44 {"}'M' greentint -8.7287 2.7285 -6.392 {"}'M' greentint -8.6841 2.9833 -6.4047 {"}'M' greentint -9.1583 2.1805 -7.1378 {"}'M' greentint -8.996 2.2254 -6.9398 {"}'M' greentint -8.8418 2.358 -6.7781 {"}'M' greentint -8.7175 2.5613 -6.6735 {"}'M' greentint -8.6392 2.807 -6.6414 {"}'M' greentint -8.6183 3.0624 -6.6847 {"}'M' greentint -9.0473 2.3639 -7.3082 {"}'M' greentint -8.8863 2.392 -7.1083 {"}'M' greentint -8.7383 2.5439 -6.9594 {"}'M' greentint -8.6435 2.7781 -6.9021 {"}'M' greentint -8.6272 3.0318 -6.9514 {"}'M' greentint -8.9138 2.5818 -7.3618 {"}'M' greentint -8.7539 2.6787 -7.1823 {"}'M' greentint -8.6989 2.932 -7.1821 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 224 A}'M' green -9.675 1.1961 -4.1555 {"}'M' green -9.5934 1.4427 -4.1754 {"}'M' green -9.4599 1.6606 -4.2289 {"}'M' green -9.8772 0.8414 -4.8036 {"}'M' green -9.4303 1.8336 -4.5014 {"}'M' green -9.8274 0.9159 -5.1029 {"}'M' green -9.3359 1.926 -4.7489 {"}'M' green -9.5932 1.4377 -5.3463 {"}'M' green -9.6667 1.1979 -5.3732 {"}'M' green -9.3548 1.8279 -5.1454 {"}'M' green -9.488 1.6523 -5.2685 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 224 A}'M' greentint -9.8083 1.0925 -4.355 {"}'M' greentint -9.7533 1.3458 -4.3548 {"}'M' greentint -9.8637 1.2464 -4.6351 {"}'M' greentint -9.88 0.9927 -4.5858 {"}'M' greentint -9.6209 1.6325 -4.4289 {"}'M' greentint -9.7689 1.4805 -4.5777 {"}'M' greentint -9.8354 1.3439 -4.8887 {"}'M' greentint -9.8859 1.0892 -4.8841 {"}'M' greentint -9.5906 1.7425 -4.6843 {"}'M' greentint -9.732 1.572 -4.8199 {"}'M' greentint -9.7386 1.4182 -5.1287 {"}'M' greentint -9.8069 1.1692 -5.1464 {"}'M' greentint -9.4925 1.8139 -4.9203 {"}'M' greentint -9.6311 1.6392 -5.051 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TRP 246 A}'M' green -9.8722 1.028 -4.3405 {"}'M' green -9.7503 1.2246 -4.2375 {"}'M' green -9.6519 1.4495 -4.1715 {"}'M' green -9.5792 1.6905 -4.1459 {"}'M' green -9.8991 0.9157 -4.7071 {"}'M' green -9.4689 1.7647 -4.3881 {"}'M' green -9.8677 1.0781 -5.2874 {"}'M' green -9.7291 1.3041 -5.3614 @dotlist {x} color= red width= 1 master= {H-bonds} { O TRP 246 A}'M' greentint -9.7538 1.0774 -4.5641 {"}'M' greentint -9.6292 1.2798 -4.4605 {"}'M' greentint -9.5327 1.5129 -4.4007 {"}'M' greentint -9.8263 0.9961 -4.9523 {"}'M' greentint -9.6796 1.1457 -4.8047 {"}'M' greentint -9.5559 1.3455 -4.7 {"}'M' greentint -9.464 1.5797 -4.6467 {"}'M' greentint -9.412 1.8305 -4.6483 {"}'M' greentint -9.7107 1.1739 -5.11 {"}'M' greentint -9.5722 1.3445 -4.9785 {"}'M' greentint -9.4693 1.568 -4.9076 {"}'M' greentint -9.4149 1.8177 -4.9073 {"}'M' greentint -9.5793 1.4578 -5.2106 {"}'M' greentint -9.484 1.6941 -5.1531 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly X1097 1z70X_1099F_11}P -12.2224 -3.0581 -0.5895 {"}-12.2224 -3.0581 -0.5895 { ca gly X1097 1z70X_1099F_11}-10.9446 -2.3919 -0.6133 { c gly X1097 1z70X_1099F_11}-10.8971 -1.1897 -1.5405 { o gly X1097 1z70X_1099F_11}-11.8797 -0.8378 -2.1795 { c gly X1097 1z70X_1099F_11}P -10.8971 -1.1897 -1.5405 { n val X1098 1z70X_1099F_11}-9.7282 -0.581 -1.5839 { ca val X1098 1z70X_1099F_11}-9.4212 0.5035 -2.5004 { c val X1098 1z70X_1099F_11}-8.2856 -0.0071 -3.3763 { o val X1098 1z70X_1099F_11}-7.3548 -0.6672 -2.9018 { c val X1098 1z70X_1099F_11}P -8.2856 -0.0071 -3.3763 { n phe X1099 1z70X_1099F_11}-8.3428 0.3531 -4.6577 { ca phe X1099 1z70X_1099F_11}-7.3106 -0.0834 -5.5722 { c phe X1099 1z70X_1099F_11}-7.079 0.9467 -6.6356 { o phe X1099 1z70X_1099F_11}-7.8673 1.8554 -6.82 { c phe X1099 1z70X_1099F_11}P -7.079 0.9467 -6.6356 { n thr X1100 1z70X_1099F_11}-5.9672 0.7929 -7.3298 { ca thr X1100 1z70X_1099F_11}-5.6366 1.6133 -8.4818 { c thr X1100 1z70X_1099F_11}-6.1064 0.9027 -9.7478 { o thr X1100 1z70X_1099F_11}-5.6557 -0.1687 -10.1228 { c thr X1100 1z70X_1099F_11}P -6.1064 0.9027 -9.7478 { n met X1101 1z70X_1099F_11}-7.1007 1.5207 -10.3712 { ca met X1101 1z70X_1099F_11}-7.6335 1.0923 -11.6356 { c met X1101 1z70X_1099F_11}-6.9042 1.7878 -12.7748 { o met X1101 1z70X_1099F_11}-6.5616 2.9599 -12.668 { n arg X1117 1z70X_1099F_11}P -6.2793 5.6335 -11.3971 {"}-6.2793 5.6335 -11.3971 { ca arg X1117 1z70X_1099F_11}-7.2559 6.2837 -10.5274 { c arg X1117 1z70X_1099F_11}-7.6691 5.3614 -9.3897 { o arg X1117 1z70X_1099F_11}-7.8308 4.1655 -9.5565 { c arg X1117 1z70X_1099F_11}P -7.6691 5.3614 -9.3897 { n arg X1118 1z70X_1099F_11}-7.8432 5.9544 -8.2045 { ca arg X1118 1z70X_1099F_11}-8.1823 5.1752 -7.0189 { c arg X1118 1z70X_1099F_11}-9.6913 4.9939 -6.9022 { o arg X1118 1z70X_1099F_11}-10.4595 5.9463 -6.8673 { c arg X1118 1z70X_1099F_11}P -9.6913 4.9939 -6.9022 { n val X1119 1z70X_1099F_11}-10.0613 3.7316 -6.7814 { ca val X1119 1z70X_1099F_11}-11.4333 3.2582 -6.7765 { c val X1119 1z70X_1099F_11}-11.7151 2.4286 -5.5436 { o val X1119 1z70X_1099F_11}-10.9417 1.5437 -5.2006 { c val X1119 1z70X_1099F_11}P -11.7151 2.4286 -5.5436 { n thr X1120 1z70X_1099F_11}-12.8139 2.7507 -4.8479 { ca thr X1120 1z70X_1099F_11}-13.246 1.9647 -3.6819 { c thr X1120 1z70X_1099F_11}-14.3549 1.007 -4.097 { o thr X1120 1z70X_1099F_11}-15.317 1.4134 -4.7803 { c thr X1120 1z70X_1099F_11}P -14.3549 1.007 -4.097 { n ile X1121 1z70X_1099F_11}-14.2213 -0.2613 -3.7326 { ca ile X1121 1z70X_1099F_11}-15.159 -1.3228 -4.0731 { c ile X1121 1z70X_1099F_11}-15.674 -1.9587 -2.7725 { o ile X1121 1z70X_1099F_11}-14.9021 -2.3832 -1.9094 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly X1097 1z70X_1099F_11}P -12.2224 -3.0581 -0.5895 { ca gly X1097 1z70X_1099F_11}P -10.9446 -2.3919 -0.6133 {"}P -10.9446 -2.3919 -0.6133 { n val X1098 1z70X_1099F_11}P -9.7282 -0.581 -1.5839 { ca val X1098 1z70X_1099F_11}P -9.4212 0.5035 -2.5004 { n phe X1099 1z70X_1099F_11}P -8.3428 0.3531 -4.6577 { ca phe X1099 1z70X_1099F_11}P -7.3106 -0.0834 -5.5722 { n thr X1100 1z70X_1099F_11}P -5.9672 0.7929 -7.3298 { ca thr X1100 1z70X_1099F_11}P -5.6366 1.6133 -8.4818 { n met X1101 1z70X_1099F_11}P -7.1007 1.5207 -10.3712 { ca met X1101 1z70X_1099F_11}P -7.6335 1.0923 -11.6356 { n arg X1117 1z70X_1099F_11}P -6.2793 5.6335 -11.3971 { ca arg X1117 1z70X_1099F_11}P -7.2559 6.2837 -10.5274 { n arg X1118 1z70X_1099F_11}P -7.8432 5.9544 -8.2045 { ca arg X1118 1z70X_1099F_11}P -8.1823 5.1752 -7.0189 { n val X1119 1z70X_1099F_11}P -10.0613 3.7316 -6.7814 { ca val X1119 1z70X_1099F_11}P -11.4333 3.2582 -6.7765 { n thr X1120 1z70X_1099F_11}P -12.8139 2.7507 -4.8479 { ca thr X1120 1z70X_1099F_11}P -13.246 1.9647 -3.6819 { n ile X1121 1z70X_1099F_11}P -14.2213 -0.2613 -3.7326 { ca ile X1121 1z70X_1099F_11}P -15.159 -1.3228 -4.0731 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly X1097 1z70X_1099F_11}P -10.9446 -2.3919 -0.6133 {"}-10.9446 -2.3919 -0.6133 { ca val X1098 1z70X_1099F_11}-9.4212 0.5035 -2.5004 { ca phe X1099 1z70X_1099F_11}-7.3106 -0.0834 -5.5722 { ca thr X1100 1z70X_1099F_11}-5.6366 1.6133 -8.4818 { ca met X1101 1z70X_1099F_11}-7.6335 1.0923 -11.6356 { ca arg X1117 1z70X_1099F_11}P -7.2559 6.2837 -10.5274 {"}-7.2559 6.2837 -10.5274 { ca arg X1118 1z70X_1099F_11}-8.1823 5.1752 -7.0189 { ca val X1119 1z70X_1099F_11}-11.4333 3.2582 -6.7765 { ca thr X1120 1z70X_1099F_11}-13.246 1.9647 -3.6819 { ca ile X1121 1z70X_1099F_11}-15.159 -1.3228 -4.0731 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe X1099 1z70X_1099F_11}P -7.3106 -0.0834 -5.5722 { cb phe X1099 1z70X_1099F_11}-7.6492 -1.4496 -6.2032 { cg phe X1099 1z70X_1099F_11}-8.6153 -1.4032 -7.3753 { cd1 phe X1099 1z70X_1099F_11}-9.9794 -1.1057 -7.2246 { ce1 phe X1099 1z70X_1099F_11}-10.7917 -1.0766 -8.3278 { cz phe X1099 1z70X_1099F_11}-10.2844 -1.3678 -9.5639 { cg phe X1099 1z70X_1099F_11}P -8.6153 -1.4032 -7.3753 { cd2 phe X1099 1z70X_1099F_11}-8.1131 -1.6632 -8.6682 { ce2 phe X1099 1z70X_1099F_11}-8.9752 -1.6486 -9.7491 { cz phe X1099 1z70X_1099F_11}ghost -10.2844 -1.3678 -9.5639 { ca val X1119 1z70X_1099F_11}P -11.4333 3.2582 -6.7765 { cb val X1119 1z70X_1099F_11}-11.7653 2.4515 -8.0577 { cg1 val X1119 1z70X_1099F_11}-13.1829 1.9718 -7.9821 { cb val X1119 1z70X_1099F_11}P -11.7653 2.4515 -8.0577 { cg2 val X1119 1z70X_1099F_11}-11.4849 3.2942 -9.2783 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe X1099 1z70X_1099F_11}P -7.6492 -1.4496 -6.2032 {"}P -7.6492 -1.4496 -6.2032 { cd1 phe X1099 1z70X_1099F_11}P -9.9794 -1.1057 -7.2246 { cd2 phe X1099 1z70X_1099F_11}P -8.1131 -1.6632 -8.6682 { ce1 phe X1099 1z70X_1099F_11}P -10.7917 -1.0766 -8.3278 { ce2 phe X1099 1z70X_1099F_11}P -8.9752 -1.6486 -9.7491 { cz phe X1099 1z70X_1099F_11}P -10.2844 -1.3678 -9.5639 { cb val X1119 1z70X_1099F_11}P -11.7653 2.4515 -8.0577 { cg1 val X1119 1z70X_1099F_11}P -13.1829 1.9718 -7.9821 {"}P -13.1829 1.9718 -7.9821 {"}P -13.1829 1.9718 -7.9821 { cg2 val X1119 1z70X_1099F_11}P -11.4849 3.2942 -9.2783 {"}P -11.4849 3.2942 -9.2783 {"}P -11.4849 3.2942 -9.2783 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE1099 X}'S' blue -10.6767 0.4961 -7.1215 {"}'S' sky -10.8374 0.4177 -7.3062 {"}'S' blue -10.3914 0.5944 -7.171 {"}'S' blue -10.2082 0.6247 -7.3564 {"}'S' blue -10.0299 0.613 -7.5509 {"}'S' sky -10.1935 0.5516 -7.7451 {"}'S' blue -9.9841 0.5097 -7.8971 { CE1 PHE1099 X}'S' blue -11.9837 0.1828 -8.093 {"}'S' blue -11.912 0.2678 -8.3408 { HE1 PHE1099 X}'S' blue -12.3893 -0.0139 -7.9616 {"}'S' blue -12.5496 -0.105 -8.1445 {"}'S' blue -12.1336 0.1176 -8.0112 {"}'S' blue -12.2949 0.0784 -8.2091 {"}'S' blue -12.4515 -0.0336 -8.3805 {"}'S' blue -12.1636 0.1048 -8.4458 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE1099 X}'S' sea -10.5523 0.5419 -7.3634 {"}'S' sea -10.3721 0.568 -7.5521 { CE1 PHE1099 X}'S' green -11.2765 0.4203 -7.5617 {"}'S' green -11.4295 0.4545 -7.77 {"}'S' green -11.5905 0.4395 -7.9731 {"}'S' green -11.0249 0.506 -7.6184 {"}'S' green -11.6498 0.4467 -8.4094 {"}'S' green -10.7518 0.5436 -7.6672 {"}'S' green -11.5219 0.4812 -8.6458 {"}'S' green -11.3456 0.5033 -8.8371 {"}'S' green -10.374 0.5982 -8.0367 {"}'S' green -11.0058 0.5807 -8.8483 {"}'S' green -10.3139 0.6051 -8.3952 {"}'S' green -10.4715 0.6224 -8.6027 {"}'S' green -10.6333 0.5994 -8.8065 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE1099 X}'S' P -11.1728 0.5558 -7.8234 {"}'S' -11.1602 0.5019 -7.84 {"}'S' P -11.3287 0.5614 -8.0275 {"}'S' -11.3067 0.4936 -8.04 {"}'S' P -11.4891 0.5252 -8.2248 {"}'S' -11.4759 0.4934 -8.2268 {"}'S' P -10.8942 0.6094 -7.8701 {"}'S' -10.8902 0.5343 -7.8902 {"}'S' P -11.0461 0.6366 -8.0737 {"}'S' -11.0287 0.5183 -8.0913 {"}'S' P -11.2038 0.6235 -8.2742 {"}'S' -11.1787 0.5171 -8.2773 {"}'S' P -11.3646 0.5709 -8.4667 {"}'S' -11.3481 0.5237 -8.4624 {"}'S' P -10.5556 0.5874 -7.8397 {"}'S' -10.556 0.5852 -7.8399 {"}'S' P -10.7023 0.6482 -8.0474 {"}'S' -10.7068 0.5697 -8.0595 {"}'S' P -10.859 0.6712 -8.2547 {"}'S' -10.8544 0.5543 -8.2593 {"}'S' P -11.0205 0.6537 -8.4596 {"}'S' -11.0078 0.5533 -8.4517 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245 A}'S' blue -13.7553 0.6908 -6.1343 {"}'S' blue -13.6174 0.6142 -5.9352 {"}'S' sky -13.3627 0.6952 -5.9935 {"}'S' blue -13.2055 0.6906 -5.7878 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 259 A}'M' green -9.5385 2.3967 -5.9894 {"}'M' green -9.6974 2.308 -6.171 {"}'M' green -9.851 2.3426 -6.6862 {"}'M' green -9.1537 2.755 -5.9007 {"}'M' green -8.9673 2.9261 -5.9652 {"}'M' green -9.6307 2.7354 -7.0848 {"}'M' green -9.0849 3.1979 -6.8733 {"}'M' green -9.2407 3.0992 -7.0466 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 259 A}'M' greentint -9.4355 2.6292 -6.0383 {"}'M' greentint -9.5987 2.5958 -6.2402 {"}'M' greentint -9.7473 2.4389 -6.3887 {"}'M' greentint -9.2915 2.8344 -6.1004 {"}'M' greentint -9.4495 2.826 -6.3024 {"}'M' greentint -9.6081 2.7328 -6.4808 {"}'M' greentint -9.7473 2.5649 -6.6139 {"}'M' greentint -9.1064 3.0044 -6.1664 {"}'M' greentint -9.2625 3.0151 -6.3702 {"}'M' greentint -9.4227 2.9569 -6.5622 {"}'M' greentint -9.5775 2.8338 -6.7269 {"}'M' greentint -9.7132 2.6563 -6.853 {"}'M' greentint -9.0193 3.1585 -6.4123 {"}'M' greentint -9.1798 3.1351 -6.6143 {"}'M' greentint -9.3418 3.0529 -6.8 {"}'M' greentint -9.4941 2.917 -6.96 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ASER 245 A}'M' green -9.6286 2.3904 -6.0291 {"}'M' green -9.1433 2.8091 -5.9176 {"}'M' green -9.3441 3.0552 -7.0172 {"}'M' green -9.025 3.2502 -6.6597 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ASER 245 A}'M' greentint -9.7363 2.3856 -6.5665 {"}'M' greentint -9.5781 2.3878 -6.3627 {"}'M' greentint -9.4174 2.4638 -6.1759 {"}'M' greentint -9.2679 2.6092 -6.0235 {"}'M' greentint -9.6331 2.5483 -6.8215 {"}'M' greentint -9.4844 2.4987 -6.6154 {"}'M' greentint -9.322 2.5436 -6.4174 {"}'M' greentint -9.1678 2.6762 -6.2557 {"}'M' greentint -9.0436 2.8795 -6.1511 {"}'M' greentint -9.5051 2.7839 -6.984 {"}'M' greentint -9.3734 2.6822 -6.7858 {"}'M' greentint -9.2124 2.7102 -6.5859 {"}'M' 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{"}'M' greentint -9.499 1.7758 -4.4522 {"}'M' greentint -9.6506 1.8112 -4.6573 {"}'M' greentint -9.812 1.7721 -4.8552 {"}'M' greentint -9.9686 1.66 -5.0266 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 245 A}'M' green -10.3461 1.1737 -4.5566 {"}'M' green -10.195 1.1477 -4.3545 {"}'M' green -10.0371 1.1716 -4.1577 {"}'M' green -9.879 1.2457 -3.974 {"}'M' green -9.6138 1.416 -4.0417 {"}'M' green -10.1334 1.5449 -5.0667 {"}'M' green -9.3942 1.6461 -4.1393 {"}'M' green -9.2869 1.8448 -4.3131 {"}'M' green -9.7399 1.8788 -5.0989 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 245 A}'M' greentint -10.2377 1.3179 -4.8207 {"}'M' greentint -10.0914 1.2547 -4.6149 {"}'M' greentint -9.9342 1.25 -4.4093 {"}'M' greentint -9.7716 1.3058 -4.2151 {"}'M' greentint -10.0079 1.4325 -4.8728 {"}'M' greentint -9.8599 1.3854 -4.6684 {"}'M' greentint -9.7007 1.4079 -4.4679 {"}'M' greentint -9.5409 1.4965 -4.2869 {"}'M' greentint -9.8796 1.6442 -5.0244 {"}'M' greentint -9.7412 1.5674 -4.8229 {"}'M' greentint -9.5824 1.5784 -4.622 {"}'M' greentint -9.4254 1.6743 -4.4446 {"}'M' greentint -9.6069 1.7752 -4.8986 {"}'M' greentint -9.4438 1.8044 -4.696 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n asp A 107 2afzA_109F_120}P -12.0963 -1.6874 0.3688 {"}-12.0963 -1.6874 0.3688 { ca asp A 107 2afzA_109F_120}-11.2151 -2.3205 -0.5926 { c asp A 107 2afzA_109F_120}-10.8179 -1.263 -1.6189 { o asp A 107 2afzA_109F_120}-11.5584 -1.0043 -2.5739 { c asp A 107 2afzA_109F_120}P -10.8179 -1.263 -1.6189 { n thr A 108 2afzA_109F_120}-9.6457 -0.66 -1.4139 { ca thr A 108 2afzA_109F_120}-9.1653 0.4311 -2.2725 { c thr A 108 2afzA_109F_120}-8.09 -0.0188 -3.2327 { o thr A 108 2afzA_109F_120}-7.1323 -0.7022 -2.8393 { c thr A 108 2afzA_109F_120}P -8.09 -0.0188 -3.2327 { n phe A 109 2afzA_109F_120}-8.2169 0.3927 -4.4894 { ca phe A 109 2afzA_109F_120}-7.285 -0.0405 -5.5092 { c phe A 109 2afzA_109F_120}-7.1884 0.9588 -6.6495 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{ ca asn A 122 2afzA_109F_120}P -15.4185 -0.947 -2.6936 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca asp A 107 2afzA_109F_120}P -11.2151 -2.3205 -0.5926 {"}-11.2151 -2.3205 -0.5926 { ca thr A 108 2afzA_109F_120}-9.1653 0.4311 -2.2725 { ca phe A 109 2afzA_109F_120}-7.285 -0.0405 -5.5092 { ca leu A 110 2afzA_109F_120}-5.9894 1.621 -8.6514 { ca ser A 111 2afzA_109F_120}-7.1094 1.0366 -12.19 { ca arg A 118 2afzA_109F_120}P -7.5771 6.4811 -10.6747 {"}-7.5771 6.4811 -10.6747 { ca ser A 119 2afzA_109F_120}-8.4001 5.1401 -7.2265 { ca phe A 120 2afzA_109F_120}-11.6137 3.2634 -6.3645 { ca ser A 121 2afzA_109F_120}-13.0039 1.9571 -3.0861 { ca asn A 122 2afzA_109F_120}-15.4185 -0.947 -2.6936 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 109 2afzA_109F_120}P -7.285 -0.0405 -5.5092 { cb phe A 109 2afzA_109F_120}-7.7537 -1.3804 -6.1004 { cg phe A 109 2afzA_109F_120}-9.1036 -1.3032 -6.8061 { cd1 phe A 109 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greentint -10.3259 0.6801 -5.8449 {"}'M' greentint -10.1761 0.8338 -5.6941 {"}'M' greentint -10.0808 1.0701 -5.6366 {"}'M' greentint -10.2177 0.9781 -5.9052 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n asn A 29 2b8mA_95F_31I}P -7.5353 5.3676 -12.5746 {"}-7.5353 5.3676 -12.5746 { ca asn A 29 2b8mA_95F_31I}-8.6425 5.6382 -11.6651 { c asn A 29 2b8mA_95F_31I}-8.3091 5.1498 -10.2657 { o asn A 29 2b8mA_95F_31I}-7.4891 4.2437 -10.0933 { c asn A 29 2b8mA_95F_31I}P -8.3091 5.1498 -10.2657 { n his A 30 2b8mA_95F_31I}-8.956 5.7603 -9.2626 { ca his A 30 2b8mA_95F_31I}-8.8197 5.3689 -7.8865 { c his A 30 2b8mA_95F_31I}-10.1965 4.9879 -7.3657 { o his A 30 2b8mA_95F_31I}-11.1451 5.752 -7.4866 { c his A 30 2b8mA_95F_31I}P -10.1965 4.9879 -7.3657 { n ile A 31 2b8mA_95F_31I}-10.3037 3.7917 -6.8205 { ca ile A 31 2b8mA_95F_31I}-11.5945 3.2712 -6.3777 { c ile A 31 2b8mA_95F_31I}-11.52 2.7915 -4.9104 { o ile A 31 2b8mA_95F_31I}-10.5797 2.1152 -4.5166 { c ile A 31 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-0.0628 -6.9799 { CE2 PHE 95 A}'S' sky -10.6585 0.0883 -7.5896 {"}'S' sky -11.2152 0.363 -8.386 {"}'S' sky -10.5104 0.2422 -7.8308 {"}'S' sky -10.6383 0.3452 -8.0257 {"}'S' sky -10.7808 0.4111 -8.2286 {"}'S' blue -10.9327 0.4382 -8.4322 { CZ PHE 95 A}'S' blue -12.8225 -0.3997 -6.8679 {"}'S' blue -12.9854 -0.4074 -7.0751 {"}'S' sky -13.1487 -0.5037 -7.2593 {"}'S' sky -12.6776 -0.199 -6.9532 {"}'S' sky -13.2859 -0.5692 -7.6351 {"}'S' sky -13.2366 -0.4677 -7.8712 {"}'S' blue -13.1629 -0.3987 -8.1125 {"}'S' sky -12.6179 0.1184 -7.9095 {"}'S' sky -12.773 -0.0002 -8.0774 {"}'S' blue -12.9186 -0.1544 -8.2224 {"}'S' sky -12.3327 0.2426 -7.9668 {"}'S' blue -12.49 0.1529 -8.1459 {"}'S' blue -12.6432 0.0274 -8.3078 {"}'S' sky -12.1526 0.2687 -8.1555 {"}'S' sky -12.3137 0.175 -8.3372 {"}'S' sky -12.4692 0.0453 -8.503 {"}'S' sky -12.6154 -0.1166 -8.6471 {"}'S' sky -11.9739 0.2523 -8.3484 {"}'S' sky -12.434 -0.1414 -8.8344 {"}'S' blue -12.5667 -0.3332 -8.9515 {"}'S' sky -12.3585 -0.3705 -9.1061 {"}'S' sky -12.1453 -0.4442 -9.2388 { HE2 PHE 95 A}'S' sky -11.5775 -0.5669 -10.0616 {"}'S' sky -10.9607 -0.272 -10.1744 { HZ PHE 95 A}'S' blue -13.3208 -0.5793 -7.9642 {"}'S' blue -13.2264 -0.4869 -8.2117 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 95 A}'S' sea -11.6021 0.1867 -6.3967 {"}'S' sea -11.7637 0.1693 -6.6016 {"}'S' sea -11.9276 0.1126 -6.7973 {"}'S' sea -11.2663 0.1668 -6.386 {"}'S' green -11.4232 0.1811 -6.5934 {"}'S' green -11.5853 0.1576 -6.796 {"}'S' sea -11.0571 0.1207 -6.5372 {"}'S' green -11.2147 0.1379 -6.7446 {"}'S' green -11.3764 0.1149 -6.9484 {"}'S' sea -10.9996 0.0557 -6.8727 { CE2 PHE 95 A}'S' sea -10.776 0.2174 -7.778 {"}'S' sea -10.9114 0.3076 -7.9769 {"}'S' sea -11.0594 0.3574 -8.1819 {"}'S' green -11.9692 -0.2102 -9.2002 {"}'S' green -11.7839 -0.392 -9.7154 {"}'S' green -10.683 0.3403 -9.3588 {"}'S' green -11.277 -0.2406 -9.9645 {"}'S' green -10.786 0.0402 -9.836 { CZ PHE 95 A}'S' sea -12.8353 -0.199 -7.1567 {"}'S' sea -12.996 -0.2633 -7.3464 {"}'S' sea -13.1493 -0.3904 -7.5098 {"}'S' sea -12.4777 -0.0347 -7.0097 {"}'S' green -12.632 -0.017 -7.2143 {"}'S' sea -12.7933 -0.0548 -7.4125 {"}'S' green -12.9518 -0.1455 -7.5931 {"}'S' sea -13.1024 -0.2849 -7.7483 {"}'S' sea -12.2446 0.092 -7.0618 {"}'S' sea -12.3976 0.1262 -7.2702 {"}'S' green -12.5587 0.1112 -7.4732 {"}'S' sea -12.7215 0.0486 -7.6661 {"}'S' sea -12.8801 -0.0605 -7.8409 {"}'S' sea -13.0294 -0.212 -7.9915 {"}'S' green -11.993 0.1777 -7.1185 {"}'S' green -12.1409 0.2275 -7.3235 {"}'S' sea -12.2968 0.233 -7.5276 {"}'S' sea -12.4572 0.1968 -7.7249 {"}'S' green -12.0142 0.3083 -7.5738 {"}'S' sea -12.1719 0.2952 -7.7744 {"}'S' sea -11.9887 0.3254 -7.9598 {"}'S' green -11.082 0.0543 -7.1405 {"}'S' green -11.6482 0.3373 -7.9516 {"}'S' sea -11.8103 0.3138 -8.1542 {"}'S' sea -12.1348 0.1539 -8.5287 {"}'S' sea -12.289 0.0223 -8.6924 {"}'S' sea -10.8741 0.0058 -7.293 {"}'S' green -10.9963 0.1321 -7.4855 {"}'S' green -11.1334 0.223 -7.6885 {"}'S' green -11.282 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-0.1457 -10.0377 { c lys A 43 2bbhA_42F_31V}P -6.0819 1.0541 -10.0103 { n thr A 44 2bbhA_42F_31V}-6.5631 1.681 -11.0759 { ca thr A 44 2bbhA_42F_31V}-6.7307 0.9891 -12.3416 { c thr A 44 2bbhA_42F_31V}-6.7565 1.9917 -13.4755 { o thr A 44 2bbhA_42F_31V}-7.079 3.1748 -13.2756 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 29 2bbhA_42F_31V}P -7.6545 5.823 -12.2742 { ca ile A 29 2bbhA_42F_31V}P -8.906 5.7556 -11.4881 { n glu A 30 2bbhA_42F_31V}P -9.0499 5.6083 -9.0486 { ca glu A 30 2bbhA_42F_31V}P -8.8269 5.0344 -7.7258 { n val A 31 2bbhA_42F_31V}P -10.4483 3.622 -6.6547 { ca val A 31 2bbhA_42F_31V}P -11.7173 3.2595 -6.0576 { n mse A 32 2bbhA_42F_31V}P -12.3583 3.4815 -3.6982 { ca mse A 32 2bbhA_42F_31V}P -12.3611 3.0937 -2.2635 { n asn A 33 2bbhA_42F_31V}P -14.0652 1.5517 -1.5442 { ca asn A 33 2bbhA_42F_31V}P -15.419 1.1128 -1.2471 { n glu A 41 2bbhA_42F_31V}P -9.6749 -0.8754 -1.5413 { ca glu A 41 2bbhA_42F_31V}P -9.1694 0.2132 -2.4283 { n phe A 42 2bbhA_42F_31V}P 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{ cg2 val A 31 2bbhA_42F_31V}P -12.6839 2.3702 -8.2592 {"}P -12.6839 2.3702 -8.2592 {"}P -12.6839 2.3702 -8.2592 { cb phe A 42 2bbhA_42F_31V}P -7.9464 -1.4758 -6.5249 {"}P -7.9464 -1.4758 -6.5249 { cd1 phe A 42 2bbhA_42F_31V}P -9.3908 -1.0322 -8.5456 { cd2 phe A 42 2bbhA_42F_31V}P -10.4659 -1.6763 -6.493 { ce1 phe A 42 2bbhA_42F_31V}P -10.6281 -0.9886 -9.194 { ce2 phe A 42 2bbhA_42F_31V}P -11.7163 -1.6233 -7.117 { cz phe A 42 2bbhA_42F_31V}P -11.8107 -1.2692 -8.482 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 42 A}'S' blue -11.2647 -0.1601 -6.1383 {"}'S' blue -11.0028 -0.0383 -6.1927 {"}'S' sky -11.1632 -0.0745 -6.39 {"}'S' blue -10.7203 0.0369 -6.2389 {"}'S' sky -10.8779 0.0238 -6.4394 {"}'S' sky -10.6947 0.0541 -6.6248 {"}'S' sky -10.8586 -0.0026 -6.8205 {"}'S' blue -10.68 -0.019 -7.0135 { CE2 PHE 42 A}'S' blue -12.634 -0.4173 -6.2422 {"}'S' blue -12.7917 -0.4174 -6.4458 {"}'S' blue -12.9524 -0.4816 -6.6355 {"}'S' blue -13.1057 -0.6088 -6.7988 {"}'S' blue -12.4341 -0.2531 -6.2987 {"}'S' sky -12.5884 -0.2354 -6.5034 {"}'S' blue -12.7497 -0.2732 -6.7015 {"}'S' blue -12.9082 -0.3639 -6.8822 {"}'S' blue -13.0589 -0.5033 -7.0374 {"}'S' blue -12.201 -0.1264 -6.3509 {"}'S' blue -12.354 -0.0922 -6.5592 {"}'S' sky -12.5151 -0.1072 -6.7623 {"}'S' blue -12.6779 -0.1698 -6.9551 {"}'S' blue -12.8365 -0.2788 -7.1299 {"}'S' sky -11.814 -0.1309 -6.2087 {"}'S' sky -12.4136 -0.0215 -7.014 {"}'S' blue -12.5743 -0.1 -7.1986 {"}'S' sky -11.5484 -0.1061 -6.2615 {"}'S' sky -12.2891 0.0242 -7.2559 {"}'S' sky -11.0251 -0.028 -7.3123 { CZ PHE 42 A}'S' blue -12.3862 0.0306 -7.4618 {"}'S' blue -12.5285 0.101 -7.6637 {"}'S' blue -13.0026 -0.0098 -8.2472 {"}'S' sky -12.1555 0.1468 -7.513 {"}'S' sky -12.2954 0.2277 -7.7159 {"}'S' blue -12.4484 0.2619 -7.9243 {"}'S' sky -12.6095 0.2469 -8.1273 {"}'S' sky -12.9309 0.0753 -8.495 {"}'S' blue -13.0802 -0.0763 -8.6456 {"}'S' sky -12.0438 0.3134 -7.7726 {"}'S' sky -12.1917 0.3632 -7.9776 {"}'S' sky -12.3476 0.3688 -8.1817 {"}'S' sky -12.9694 -0.0187 -8.8764 {"}'S' sky -11.9131 0.4169 -8.0243 {"}'S' sky -12.065 0.444 -8.2279 {"}'S' sky -12.2227 0.4309 -8.4284 {"}'S' blue -12.8376 0.0046 -9.1031 {"}'S' sky -11.5745 0.3948 -7.9939 {"}'S' blue -11.7213 0.4556 -8.2016 {"}'S' sky -11.8779 0.4786 -8.4089 {"}'S' sky -12.0395 0.4611 -8.6138 {"}'S' sky -12.2034 0.4045 -8.8095 {"}'S' sky -12.3645 0.3107 -8.9913 {"}'S' sky -12.52 0.181 -9.157 {"}'S' blue -11.1327 0.19 -7.7946 {"}'S' blue -11.2551 0.3146 -7.9885 {"}'S' blue -11.699 0.473 -8.6057 {"}'S' blue -11.8611 0.4495 -8.8083 {"}'S' blue -12.0247 0.3881 -9.0025 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 42 A}'S' sea -11.0388 -0.0287 -6.6319 { CE2 PHE 42 A}'S' sea -11.9494 -0.0407 -6.4076 {"}'S' sea -12.0973 0.0091 -6.6126 {"}'S' sea -12.2532 0.0147 -6.8167 {"}'S' green -11.6763 -0.0031 -6.4564 {"}'S' green -11.8188 0.0628 -6.6593 {"}'S' green -11.9707 0.0899 -6.8629 {"}'S' green -12.1283 0.0768 -7.0634 {"}'S' sea -11.3457 -0.0577 -6.4279 {"}'S' green -11.4801 0.0407 -6.6289 {"}'S' green -11.9451 0.107 -7.2488 {"}'S' sea -11.1607 -0.0395 -6.6235 {"}'S' green -11.2986 0.0516 -6.8259 {"}'S' green -11.4477 0.1046 -7.0332 {"}'S' green -11.6046 0.1189 -7.2407 {"}'S' sea -11.0898 0.0047 -6.9775 {"}'S' green -11.2385 0.0585 -7.1844 {"}'S' sea -11.3961 0.0757 -7.3919 { CZ PHE 42 A}'S' sea -12.7723 0.1843 -8.3201 {"}'S' sea -11.9084 0.2232 -7.5738 {"}'S' sea -12.508 0.3326 -8.379 {"}'S' sea -12.6687 0.2541 -8.5636 {"}'S' sea -12.8238 0.1355 -8.7315 {"}'S' green -11.5301 0.1103 -7.4428 {"}'S' green -11.6427 0.248 -7.6265 {"}'S' sea -11.7707 0.351 -7.8215 {"}'S' sea -12.3835 0.3783 -8.6209 {"}'S' sea -12.5408 0.2886 -8.8 {"}'S' sea -12.694 0.1631 -8.9619 {"}'S' sea -11.3214 0.1627 -7.6019 {"}'S' sea -11.4401 0.2964 -7.7929 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 42 A}'S' P -11.6269 0.1015 -6.8366 {"}'S' -11.6278 0.0876 -6.8381 {"}'S' P -11.7835 0.1245 -7.0439 {"}'S' -11.7828 0.1216 -7.044 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 31 A}'S' blue -12.6194 0.3136 -6.8795 {"}'S' blue -12.4621 0.2973 -6.6711 {"}'S' blue -12.3 0.3193 -6.4683 {"}'S' blue -12.6472 0.4173 -7.3719 {"}'S' blue -12.5052 0.3389 -7.1667 {"}'S' sky -12.3528 0.298 -6.9594 {"}'S' blue -12.5178 0.5258 -7.6504 {"}'S' sky -12.3895 0.4222 -7.4548 {"}'S' sky -12.2483 0.3554 -7.2534 {"}'S' sky -12.3046 0.6026 -7.7867 {"}'S' sky -12.1777 0.4939 -7.5918 {"}'S' sky -12.0682 0.6853 -7.8618 {"}'S' blue -11.8298 0.7913 -7.9002 { CG1 VAL 31 A}'S' blue -13.1418 -0.0877 -6.4767 {"}'S' blue -12.9832 -0.0716 -6.2756 {"}'S' blue -12.8218 -0.0127 -6.0838 {"}'S' blue -13.0499 0.0338 -6.7496 {"}'S' blue -12.8921 0.0221 -6.5432 {"}'S' blue -12.7299 0.0601 -6.3439 {"}'S' blue -12.5686 0.1452 -6.1582 {"}'S' blue -12.8061 0.166 -6.7901 {"}'S' sky -12.6477 0.1779 -6.5882 {"}'S' blue -12.4864 0.2443 -6.3984 { CG2 VAL 31 A}'S' blue -12.6382 0.6498 -7.9389 {"}'S' sky -12.3678 0.6658 -8.0224 {"}'S' sky -12.2765 0.6698 -8.319 {"}'S' sky -12.1162 0.7202 -8.1267 {"}'S' sky -12.2211 0.7293 -8.655 {"}'S' sky -12.0621 0.7462 -8.4534 {"}'S' sky -11.9006 0.8051 -8.2616 {"}'S' blue -12.1287 0.8516 -8.9274 {"}'S' blue -11.9709 0.8399 -8.721 {"}'S' blue -11.8088 0.8779 -8.5218 { HB VAL 31 A}'S' sky -12.1606 0.287 -6.3968 {"}'S' sky -12.1758 0.3656 -7.2797 {"}'S' blue -11.3219 0.2814 -6.1532 {"}'S' sky -11.2153 0.1883 -6.4202 {"}'S' blue -11.0652 0.3242 -6.2649 {"}'S' sky -11.8185 0.6099 -7.7271 {"}'S' sky -10.9028 0.3421 -6.4692 {"}'S' sky -11.5757 0.7035 -7.808 {"}'S' sky -10.9536 0.2657 -6.8818 {"}'S' sky -10.7964 0.3841 -6.711 {"}'S' sky -11.273 0.6015 -7.6957 {"}'S' sky -11.1705 0.4487 -7.5206 {HG11 VAL 31 A}'S' blue -13.3832 -0.282 -6.7384 {"}'S' blue -13.226 -0.1636 -6.5676 {"}'S' blue -13.3066 -0.1633 -6.9785 {"}'S' blue -13.1504 -0.0679 -6.804 {"}'S' blue -13.1482 0.0498 -7.0654 {HG21 VAL 31 A}'S' blue -13.1672 0.3463 -8.4799 {"}'S' sky -13.0085 0.4108 -8.2931 {"}'S' blue -12.8556 0.5268 -8.1277 {"}'S' sky -13.0663 0.3175 -8.7729 {"}'S' sky -12.5988 0.5696 -8.2394 {"}'S' sky -12.9028 0.3623 -8.9834 {"}'S' sky -12.6505 0.4622 -9.0528 {"}'S' sky -12.4106 0.6299 -9.0964 {"}'S' sky -12.2545 0.7252 -8.9219 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 31 A}'S' sea -12.2281 0.2662 -6.8876 {"}'S' green -12.0907 0.1847 -6.6881 {"}'S' sea -11.9388 0.1589 -6.4848 {"}'S' sea -11.7794 0.1894 -6.2875 {"}'S' green -12.067 0.2249 -7.1006 {"}'S' green -11.9363 0.1305 -6.9056 {"}'S' green -11.789 0.0889 -6.7033 {"}'S' green -11.6335 0.1009 -6.5054 {"}'S' sea -11.4749 0.1654 -6.3187 {"}'S' sea -12.0254 0.4864 -7.5512 {"}'S' sea -11.9378 0.3103 -7.3877 {"}'S' green -11.8216 0.1785 -7.2023 {"}'S' green -11.3733 0.1026 -6.6012 {"}'S' sea -11.7474 0.4135 -7.5818 {"}'S' green -11.6448 0.2608 -7.4067 {"}'S' green -11.5164 0.16 -7.2115 {"}'S' green -11.3691 0.1169 -7.009 {"}'S' green -11.2109 0.1347 -6.8105 {"}'S' sea -11.0532 0.2107 -6.6277 {"}'S' sea -11.5112 0.4946 -7.6654 {"}'S' sea -11.4076 0.3359 -7.4874 {"}'S' sea -11.2727 0.241 -7.2865 {"}'S' sea -11.1169 0.2168 -7.0784 {HG21 VAL 31 A}'S' sea -12.9069 0.348 -8.5757 {"}'S' sea -12.7489 0.4337 -8.3947 {"}'S' sea -12.7446 0.3801 -8.785 {"}'S' green -12.5869 0.4561 -8.6021 {"}'S' sea -12.4364 0.5875 -8.4436 {"}'S' sea -12.4873 0.5111 -8.8562 {"}'S' sea -12.3301 0.6295 -8.6855 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 31 A}'S' P -11.685 0.0971 -7.0022 {"}'S' -11.6837 0.1105 -7 {"}'S' P -11.5326 0.0721 -6.7985 {"}'S' -11.5328 0.08 -6.7988 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 42 A}'M' greentint -9.3252 2.2549 -6.1627 {"}'M' greentint -9.4687 2.1471 -6.4352 {"}'M' greentint -9.2265 2.5427 -6.2319 {"}'M' greentint -9.3751 2.3858 -6.3804 {"}'M' greentint -9.4788 2.2895 -6.6779 {"}'M' greentint -9.5353 2.04 -6.6811 {"}'M' greentint -9.0772 2.7729 -6.2941 {"}'M' greentint -9.2358 2.6797 -6.4725 {"}'M' greentint -9.375 2.5118 -6.6057 {"}'M' greentint -9.4484 2.3835 -6.9227 {"}'M' greentint -9.5195 2.1384 -6.9469 {"}'M' greentint -8.8902 2.962 -6.362 {"}'M' greentint -9.0504 2.9038 -6.5539 {"}'M' greentint -9.2052 2.7807 -6.7186 {"}'M' greentint -9.3409 2.6031 -6.8448 {"}'M' greentint -9.3705 2.4637 -7.1609 {"}'M' greentint -9.4517 2.2205 -7.1993 {"}'M' greentint -8.9696 2.9998 -6.7917 {"}'M' greentint -9.1218 2.8639 -6.9517 {"}'M' greentint -9.2584 2.6823 -7.0765 {"}'M' greentint -9.256 2.5085 -7.3906 {"}'M' greentint -9.0146 2.9025 -7.1882 {"}'M' greentint -9.1454 2.7205 -7.3067 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 31 A}'M' greentint -9.4916 1.9383 -6.4923 {"}'M' greentint -9.3414 2.0628 -6.3324 {"}'M' greentint -9.2082 2.2384 -6.2093 {"}'M' greentint -9.103 2.453 -6.1316 {"}'M' greentint -9.441 1.9358 -6.8258 {"}'M' greentint -9.2804 2.0118 -6.639 {"}'M' greentint -9.1308 2.1572 -6.4866 {"}'M' greentint -9.0063 2.3571 -6.3807 {"}'M' greentint -8.9177 2.5947 -6.3327 {"}'M' greentint -8.8732 2.8494 -6.3454 {"}'M' greentint -9.3473 2.0467 -7.0785 {"}'M' greentint -9.185 2.0916 -6.8806 {"}'M' greentint -9.0308 2.2242 -6.7188 {"}'M' greentint -8.9065 2.4275 -6.6142 {"}'M' greentint -8.8282 2.6732 -6.5821 {"}'M' greentint -8.8073 2.9286 -6.6254 {"}'M' greentint -9.2363 2.2301 -7.2489 {"}'M' greentint -9.0753 2.2582 -7.049 {"}'M' greentint -8.9273 2.4101 -6.9001 {"}'M' greentint -8.8325 2.6443 -6.8428 {"}'M' greentint -8.8162 2.8979 -6.8921 {"}'M' greentint -9.1028 2.448 -7.3025 {"}'M' greentint -8.9429 2.5449 -7.123 {"}'M' greentint -8.8879 2.7982 -7.1228 {"}'M' greentint -9.0212 2.6945 -7.3223 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 42 A}'M' green -9.9023 1.0207 -4.5628 {"}'M' green -9.3555 1.2818 -4.0954 {"}'M' green -9.9294 1.2721 -5.0964 {"}'M' green -9.2305 1.6638 -4.3024 {"}'M' green -9.1169 1.8579 -4.5537 {"}'M' green -9.2686 1.8934 -4.7588 {"}'M' green -9.5865 1.7421 -5.1281 {"}'M' green -9.7251 1.5674 -5.2588 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 42 A}'M' greentint -9.769 1.1244 -4.3633 {"}'M' greentint -9.5831 1.2158 -4.2053 {"}'M' greentint -9.6873 1.3709 -4.3831 {"}'M' greentint -9.8473 1.274 -4.5626 {"}'M' greentint -9.9577 1.1747 -4.8428 {"}'M' greentint -9.4221 1.487 -4.2385 {"}'M' greentint -9.5539 1.5888 -4.4367 {"}'M' greentint -9.7149 1.5607 -4.6366 {"}'M' greentint -9.8629 1.4088 -4.7855 {"}'M' greentint -9.3654 1.7587 -4.5033 {"}'M' greentint -9.5243 1.7618 -4.7092 {"}'M' greentint -9.6846 1.6707 -4.8921 {"}'M' greentint -9.826 1.5002 -5.0276 {"}'M' greentint -9.4299 1.8542 -4.9567 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 31 A}'M' green -9.9478 1.0018 -4.5062 {"}'M' green -9.7852 1.0575 -4.3121 {"}'M' green -9.6274 1.1677 -4.1386 {"}'M' green -10.0215 1.1842 -4.9698 {"}'M' green -9.2841 1.5975 -4.1315 {"}'M' green -9.8932 1.3959 -5.1213 {"}'M' green -9.1976 1.8201 -4.3392 {"}'M' green -9.7535 1.6305 -5.1958 {"}'M' green -9.2123 1.9462 -4.5846 {"}'M' green -9.4342 2.0047 -5.0448 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 31 A}'M' greentint -9.8735 1.1372 -4.7653 {"}'M' greentint -9.7143 1.1596 -4.5648 {"}'M' greentint -9.5546 1.2482 -4.3838 {"}'M' greentint -9.4078 1.3978 -4.2362 {"}'M' greentint -9.7548 1.3191 -4.9198 {"}'M' greentint -9.596 1.3301 -4.7189 {"}'M' greentint -9.439 1.426 -4.5416 {"}'M' greentint -9.3005 1.5966 -4.41 {"}'M' greentint -9.6205 1.527 -4.9956 {"}'M' greentint -9.4574 1.5562 -4.7929 {"}'M' greentint -9.3076 1.7099 -4.6421 {"}'M' greentint -9.5079 1.7568 -5.0308 {"}'M' greentint -9.3492 1.8541 -4.8532 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n his H 81 2bbkH_97Y_83S}P -8.0455 5.3939 -12.3877 {"}-8.0455 5.3939 -12.3877 { ca his H 81 2bbkH_97Y_83S}-8.8055 5.9611 -11.2951 { c his H 81 2bbkH_97Y_83S}-8.4434 5.2644 -10.0072 { o his H 81 2bbkH_97Y_83S}-7.9519 4.1396 -10.0595 { c his H 81 2bbkH_97Y_83S}P -8.4434 5.2644 -10.0072 { n ala H 82 2bbkH_97Y_83S}-8.63 5.9524 -8.8812 { ca ala H 82 2bbkH_97Y_83S}-8.45 5.3576 -7.5733 { c ala H 82 2bbkH_97Y_83S}-9.8803 5.0971 -7.1395 { o ala H 82 2bbkH_97Y_83S}-10.702 5.9988 -7.2552 { c ala H 82 2bbkH_97Y_83S}P -9.8803 5.0971 -7.1395 { n ser H 83 2bbkH_97Y_83S}-10.1998 3.9111 -6.6408 { ca ser H 83 2bbkH_97Y_83S}-11.5893 3.5842 -6.4079 { c ser H 83 2bbkH_97Y_83S}-11.7591 2.7131 -5.168 { o ser H 83 2bbkH_97Y_83S}-10.7712 2.287 -4.5852 { c ser H 83 2bbkH_97Y_83S}P -11.7591 2.7131 -5.168 { n thr H 84 2bbkH_97Y_83S}-12.991 2.4803 -4.748 { ca thr H 84 2bbkH_97Y_83S}-13.2283 1.7278 -3.5232 { c thr H 84 2bbkH_97Y_83S}-14.4493 0.82 -3.6913 { o thr H 84 2bbkH_97Y_83S}-15.4699 1.2869 -4.1657 { c thr H 84 2bbkH_97Y_83S}P -14.4493 0.82 -3.6913 { n val H 85 2bbkH_97Y_83S}-14.343 -0.455 -3.3472 { ca val H 85 2bbkH_97Y_83S}-15.4864 -1.3782 -3.4552 { c val H 85 2bbkH_97Y_83S}-15.6461 -2.0896 -2.1269 { o val H 85 2bbkH_97Y_83S}-14.7292 -2.0564 -1.3222 { n thr H 95 2bbkH_97Y_83S}P -12.1397 -2.5246 -0.065 {"}-12.1397 -2.5246 -0.065 { ca thr H 95 2bbkH_97Y_83S}-10.9241 -2.65 -0.8562 { c thr H 95 2bbkH_97Y_83S}-10.7577 -1.3724 -1.6553 { o thr H 95 2bbkH_97Y_83S}-11.6323 -1.0475 -2.4668 { c thr H 95 2bbkH_97Y_83S}P -10.7577 -1.3724 -1.6553 { n asp H 96 2bbkH_97Y_83S}-9.6547 -0.6697 -1.4171 { ca asp H 96 2bbkH_97Y_83S}-9.2847 0.5158 -2.1851 { c asp H 96 2bbkH_97Y_83S}-8.3083 0.0509 -3.2514 { o asp H 96 2bbkH_97Y_83S}-7.5047 -0.8384 -2.9736 { c asp H 96 2bbkH_97Y_83S}P -8.3083 0.0509 -3.2514 { n tyr H 97 2bbkH_97Y_83S}-8.3616 0.5969 -4.4673 { ca tyr H 97 2bbkH_97Y_83S}-7.4335 0.12 -5.4823 { c tyr H 97 2bbkH_97Y_83S}-7.2894 1.1538 -6.574 { o tyr H 97 2bbkH_97Y_83S}-8.0775 2.0918 -6.6298 { c tyr H 97 2bbkH_97Y_83S}P -7.2894 1.1538 -6.574 { n val H 98 2bbkH_97Y_83S}-6.2725 0.9911 -7.406 { ca val H 98 2bbkH_97Y_83S}-6.1196 1.8437 -8.5708 { c val H 98 2bbkH_97Y_83S}-6.2782 0.9593 -9.8024 { o val H 98 2bbkH_97Y_83S}-5.7638 -0.1354 -9.7722 { c val H 98 2bbkH_97Y_83S}P -6.2782 0.9593 -9.8024 { n glu H 99 2bbkH_97Y_83S}-6.9686 1.3879 -10.8678 { ca glu H 99 2bbkH_97Y_83S}-7.0274 0.5772 -12.0789 { c glu H 99 2bbkH_97Y_83S}-6.5645 1.4764 -13.186 { o glu H 99 2bbkH_97Y_83S}-6.909 2.6599 -13.1513 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n his H 81 2bbkH_97Y_83S}P -8.0455 5.3939 -12.3877 { ca his H 81 2bbkH_97Y_83S}P -8.8055 5.9611 -11.2951 { n ala H 82 2bbkH_97Y_83S}P -8.63 5.9524 -8.8812 { ca ala H 82 2bbkH_97Y_83S}P -8.45 5.3576 -7.5733 { n ser H 83 2bbkH_97Y_83S}P -10.1998 3.9111 -6.6408 { ca ser H 83 2bbkH_97Y_83S}P -11.5893 3.5842 -6.4079 { n thr H 84 2bbkH_97Y_83S}P -12.991 2.4803 -4.748 { ca thr H 84 2bbkH_97Y_83S}P -13.2283 1.7278 -3.5232 { n val H 85 2bbkH_97Y_83S}P -14.343 -0.455 -3.3472 { ca val H 85 2bbkH_97Y_83S}P -15.4864 -1.3782 -3.4552 { n thr H 95 2bbkH_97Y_83S}P -12.1397 -2.5246 -0.065 { ca thr H 95 2bbkH_97Y_83S}P -10.9241 -2.65 -0.8562 { n asp H 96 2bbkH_97Y_83S}P -9.6547 -0.6697 -1.4171 { ca asp H 96 2bbkH_97Y_83S}P -9.2847 0.5158 -2.1851 { n tyr H 97 2bbkH_97Y_83S}P -8.3616 0.5969 -4.4673 { ca tyr H 97 2bbkH_97Y_83S}P -7.4335 0.12 -5.4823 { n val H 98 2bbkH_97Y_83S}P -6.2725 0.9911 -7.406 { ca val H 98 2bbkH_97Y_83S}P -6.1196 1.8437 -8.5708 { n glu H 99 2bbkH_97Y_83S}P -6.9686 1.3879 -10.8678 { ca glu H 99 2bbkH_97Y_83S}P -7.0274 0.5772 -12.0789 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca his H 81 2bbkH_97Y_83S}P -8.8055 5.9611 -11.2951 {"}-8.8055 5.9611 -11.2951 { ca ala H 82 2bbkH_97Y_83S}-8.45 5.3576 -7.5733 { ca ser H 83 2bbkH_97Y_83S}-11.5893 3.5842 -6.4079 { ca thr H 84 2bbkH_97Y_83S}-13.2283 1.7278 -3.5232 { ca val H 85 2bbkH_97Y_83S}-15.4864 -1.3782 -3.4552 { ca thr H 95 2bbkH_97Y_83S}P -10.9241 -2.65 -0.8562 {"}-10.9241 -2.65 -0.8562 { ca asp H 96 2bbkH_97Y_83S}-9.2847 0.5158 -2.1851 { ca tyr H 97 2bbkH_97Y_83S}-7.4335 0.12 -5.4823 { ca val H 98 2bbkH_97Y_83S}-6.1196 1.8437 -8.5708 { ca glu H 99 2bbkH_97Y_83S}-7.0274 0.5772 -12.0789 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser H 83 2bbkH_97Y_83S}P -11.5893 3.5842 -6.4079 { cb ser H 83 2bbkH_97Y_83S}-12.0568 2.8538 -7.6679 { og ser H 83 2bbkH_97Y_83S}-13.4116 2.4524 -7.5653 { ca tyr H 97 2bbkH_97Y_83S}P -7.4335 0.12 -5.4823 { cb tyr H 97 2bbkH_97Y_83S}-7.9747 -1.1851 -6.0951 { cg tyr H 97 2bbkH_97Y_83S}-9.3437 -0.9795 -6.7297 { cd1 tyr H 97 2bbkH_97Y_83S}-10.5006 -0.9993 -5.9516 { ce1 tyr H 97 2bbkH_97Y_83S}-11.7563 -0.7674 -6.5092 { cz tyr H 97 2bbkH_97Y_83S}-11.8671 -0.571 -7.8847 { oh tyr H 97 2bbkH_97Y_83S}-13.1186 -0.3084 -8.4093 { cg tyr H 97 2bbkH_97Y_83S}P -9.3437 -0.9795 -6.7297 { cd2 tyr H 97 2bbkH_97Y_83S}-9.4821 -0.8098 -8.1094 { ce2 tyr H 97 2bbkH_97Y_83S}-10.7256 -0.5551 -8.6862 { cz tyr H 97 2bbkH_97Y_83S}ghost -11.8671 -0.571 -7.8847 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser H 83 2bbkH_97Y_83S}P -12.0568 2.8538 -7.6679 {"}P -12.0568 2.8538 -7.6679 { og ser H 83 2bbkH_97Y_83S}P -13.4116 2.4524 -7.5653 { cb tyr H 97 2bbkH_97Y_83S}P -7.9747 -1.1851 -6.0951 {"}P -7.9747 -1.1851 -6.0951 { cd1 tyr H 97 2bbkH_97Y_83S}P -10.5006 -0.9993 -5.9516 { cd2 tyr H 97 2bbkH_97Y_83S}P -9.4821 -0.8098 -8.1094 { ce1 tyr H 97 2bbkH_97Y_83S}P -11.7563 -0.7674 -6.5092 { ce2 tyr H 97 2bbkH_97Y_83S}P -10.7256 -0.5551 -8.6862 { oh tyr H 97 2bbkH_97Y_83S}P -13.1186 -0.3084 -8.4093 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 97 H}'S' blue -11.9851 0.963 -6.641 {"}'S' blue -12.149 0.9063 -6.8367 {"}'S' blue -11.6446 0.9748 -6.6329 {"}'S' sky -11.8067 0.9513 -6.8355 {"}'S' sky -11.4361 0.9316 -6.7841 {"}'S' sky -11.221 0.8494 -6.9122 {"}'S' blue -11.0091 0.7309 -7.0193 { CZ TYR 97 H}'S' sky -12.3519 0.9259 -7.1185 {"}'S' sky -12.421 1.009 -8.3939 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 97 H}'S' sea -11.5978 0.9086 -6.9879 { CE2 TYR 97 H}'S' sea -10.7058 0.8081 -7.5896 {"}'S' green -10.8233 0.9372 -7.778 {"}'S' green -11.4229 1.0466 -8.5832 {"}'S' sea -11.5836 0.9682 -8.7678 {"}'S' sea -10.5577 0.9621 -7.8307 {"}'S' green -10.6856 1.065 -8.0257 {"}'S' green -11.1376 1.1449 -8.6327 {"}'S' sea -11.2985 1.0924 -8.8251 {"}'S' sea -10.4894 1.1089 -8.1982 {"}'S' green -10.6362 1.1696 -8.4058 {"}'S' green -10.7928 1.1926 -8.6132 {"}'S' sea -10.9544 1.1752 -8.8181 { CZ TYR 97 H}'S' sea -12.9426 0.6349 -7.2135 {"}'S' green -12.7393 0.8169 -7.271 {"}'S' sea -12.5049 0.9601 -7.3269 {"}'S' green -12.666 0.9452 -7.5299 {"}'S' sea -12.1003 1.0116 -7.1752 {"}'S' green -12.2482 1.0614 -7.3802 {"}'S' green -12.4041 1.067 -7.5843 {"}'S' green -12.5645 1.0308 -7.7816 {"}'S' green -11.8272 1.0492 -7.2241 {"}'S' green -12.44 1.0765 -8.0235 {"}'S' green -12.5973 0.9868 -8.2026 {"}'S' green -11.4966 0.9946 -7.1956 {"}'S' green -12.2599 1.1027 -8.2122 {"}'S' green -12.0812 1.0863 -8.4052 {"}'S' green -11.8719 1.0443 -8.5572 {"}'S' green -10.8936 0.8672 -7.6718 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 97 H}'S' P -10.9587 1.0274 -7.9768 {"}'S' -10.951 0.9783 -7.9995 {"}'S' P -11.1066 1.0772 -8.1818 {"}'S' -11.0888 1.0011 -8.205 {"}'S' P -11.2625 1.0828 -8.3859 {"}'S' -11.2449 1.03 -8.3959 {"}'S' P -10.8281 1.1309 -8.2286 {"}'S' -10.8261 1.0976 -8.2371 {"}'S' P -10.98 1.1581 -8.4321 {"}'S' -10.9751 1.1233 -8.4363 { CZ TYR 97 H}'S' P -11.9696 1.1151 -7.427 {"}'S' -11.9678 1.0786 -7.4367 {"}'S' P -12.1215 1.1422 -7.6306 {"}'S' -12.1166 1.1089 -7.635 {"}'S' P -12.2792 1.1291 -7.8311 {"}'S' -12.2792 1.1277 -7.8308 {"}'S' P -11.631 1.093 -7.3966 {"}'S' -11.6423 1.0141 -7.4196 {"}'S' P -11.7778 1.1538 -7.6042 {"}'S' -11.7839 1.0308 -7.6239 {"}'S' P -11.9344 1.1768 -7.8116 {"}'S' -11.9297 1.0641 -7.817 {"}'S' P -12.096 1.1594 -8.0165 {"}'S' -12.089 1.1088 -8.0125 {"}'S' P -11.3116 1.0128 -7.3911 {"}'S' -11.329 0.9645 -7.4056 {"}'S' P -11.4495 1.1039 -7.5936 {"}'S' -11.4812 0.9753 -7.6161 {"}'S' P -11.5986 1.1569 -7.8009 {"}'S' -11.6247 0.9906 -7.8089 {"}'S' P -11.7555 1.1712 -8.0084 {"}'S' -11.7649 1.0279 -7.9988 {"}'S' P -11.9176 1.1477 -8.2109 {"}'S' -11.9159 1.0788 -8.198 {"}'S' P -11.1036 0.9661 -7.5422 {"}'S' -11.12 0.9327 -7.5501 {"}'S' P -11.2407 1.057 -7.7452 {"}'S' -11.2829 0.9485 -7.7542 {"}'S' P -11.3893 1.1108 -7.9521 {"}'S' -11.4308 0.9661 -7.9467 {"}'S' P -11.547 1.128 -8.1595 {"}'S' -11.5707 1.0022 -8.1393 {"}'S' P -11.7087 1.105 -8.3634 {"}'S' -11.7139 1.0484 -8.3473 {"}'S' P -11.0284 0.9648 -7.8732 {"}'S' -11.0497 0.9259 -7.8729 {"}'S' P -11.176 1.0243 -8.08 {"}'S' -11.2077 0.9507 -8.0706 {"}'S' P -11.3319 1.0458 -8.2877 {"}'S' -11.3528 0.9822 -8.2728 {"}'S' P -11.4935 1.0269 -8.4923 {"}'S' -11.4962 1.0176 -8.4887 @dotlist {x} color= white width= 1 master= {H-bonds} { CZ TYR 97 H}'S' greentint -12.9005 0.7791 -7.4692 {"}'S' greentint -12.8288 0.8825 -7.7228 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 97 H}'S' sky -13.5566 1.0141 -9.0022 {"}'S' sky -13.3008 1.1456 -9.0518 {"}'S' sky -12.8784 1.1308 -8.9017 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 97 H}'S' green -13.3977 1.0109 -8.7963 {"}'S' sea -13.1492 1.1101 -8.8467 @dotlist {x} color= red width= 1 master= {H-bonds} { OH TYR 97 H}'S' greentint -13.8848 0.6104 -7.6823 {"}'S' greentint -13.5606 0.7021 -7.5471 {"}'S' greentint -13.6997 0.7805 -7.7483 {"}'S' greentint -13.8558 0.7911 -7.9522 {"}'S' greentint -14.016 0.7329 -8.1442 {"}'S' greentint -13.2131 0.6603 -7.4028 {"}'S' greentint -13.3247 0.8052 -7.5867 {"}'S' greentint -13.4597 0.8986 -7.7873 {"}'S' greentint -13.6126 0.9345 -7.9943 {"}'S' greentint -13.7731 0.9111 -8.1963 {"}'S' greentint -13.9351 0.8289 -8.382 {"}'S' greentint -12.9808 0.7363 -7.4871 {"}'S' greentint -13.0887 0.8782 -7.667 {"}'S' greentint -13.2185 0.9756 -7.8615 {"}'S' greentint -13.3639 1.0259 -8.0631 {"}'S' greentint -13.5191 1.0251 -8.2631 {"}'S' greentint -13.6782 0.974 -8.4553 {"}'S' greentint -12.9158 0.966 -7.8659 {"}'S' greentint -13.0523 1.0474 -8.066 {"}'S' greentint -13.2032 1.0816 -8.2697 {"}'S' greentint -13.3612 1.0691 -8.4709 {"}'S' greentint -13.5215 1.0084 -8.6607 {"}'S' greentint -12.7321 0.9896 -8.0559 {"}'S' greentint -12.8735 1.0612 -8.2587 {"}'S' greentint -13.0267 1.0874 -8.4639 {"}'S' greentint -13.1858 1.0664 -8.6646 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 83 H}'S' sky -12.5166 1.241 -7.1678 {"}'S' blue -12.1901 1.3534 -6.778 {"}'S' sky -12.0469 1.241 -6.9889 {"}'S' blue -11.8865 1.3387 -6.8091 {"}'S' blue -12.5948 1.4961 -8.6316 {"}'S' sky -12.2288 1.3399 -8.5297 { HB3 SER 83 H}'S' sky -11.5262 1.2427 -6.927 {"}'S' blue -11.0144 1.1726 -7.0863 @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 83 H}'S' green -12.5296 1.1704 -7.5932 {"}'S' green -12.3719 1.156 -7.3863 {"}'S' sea -12.2097 1.1794 -7.1837 {"}'S' green -12.479 1.1814 -7.9657 {"}'S' green -12.3303 1.1277 -7.7588 {"}'S' sea -12.3582 1.2313 -8.2512 { HB3 SER 83 H}'S' green -11.4529 1.0064 -7.1761 {"}'S' green -10.8851 0.9412 -7.6977 {"}'S' green -11.3432 1.2251 -8.7354 {"}'S' sea -10.6283 1.1146 -7.781 {"}'S' sea -11.105 1.332 -8.7657 {"}'S' green -11.0024 1.1792 -8.5906 {"}'S' green -10.5528 1.2103 -8.0174 {"}'S' sea -10.8475 1.4021 -8.6827 {"}'S' green -10.7141 1.2993 -8.4821 {"}'S' sea -10.5506 1.3279 -8.2787 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB SER 83 H}'S' P -12.1731 1.1113 -7.5504 {"}'S' -12.173 1.1155 -7.5512 { HB3 SER 83 H}'S' P -12.1398 1.0606 -7.6693 {"}'S' -12.1147 1.0926 -7.6749 {"}'S' P -11.9925 1.0175 -7.4668 {"}'S' -11.9674 1.0591 -7.4829 {"}'S' P -11.8351 1.0354 -7.2677 {"}'S' -11.83 1.0468 -7.2753 {"}'S' P -12.1754 1.1283 -8.1436 {"}'S' -12.1737 1.1297 -8.1433 {"}'S' P -12.06 0.9967 -7.9575 {"}'S' -12.0138 1.0666 -7.9497 {"}'S' P -11.9227 0.9152 -7.7581 {"}'S' -11.8683 1.0315 -7.7668 {"}'S' P -11.7707 0.8894 -7.5548 {"}'S' -11.7332 1.0051 -7.5846 {"}'S' P -11.6113 0.9199 -7.3575 {"}'S' -11.5996 0.9866 -7.3874 {"}'S' P -12.0078 1.0961 -8.3497 {"}'S' -12.0047 1.1016 -8.3467 {"}'S' P -11.899 0.9554 -8.1706 {"}'S' -11.8592 1.0409 -8.1426 {"}'S' P -11.7683 0.861 -7.9756 {"}'S' -11.7225 1.0093 -7.9571 {"}'S' P -11.621 0.8193 -7.7733 {"}'S' -11.5928 0.9838 -7.7826 {"}'S' P -11.4654 0.8313 -7.5754 {"}'S' -11.4607 0.9574 -7.6045 {"}'S' P -11.3068 0.8958 -7.3887 {"}'S' -11.3122 0.944 -7.4087 {"}'S' P -11.7697 1.0407 -8.4577 {"}'S' -11.7641 1.0553 -8.4483 {"}'S' P -11.6535 0.909 -8.2723 {"}'S' -11.6336 1.0027 -8.234 {"}'S' P -11.517 0.8276 -8.0722 {"}'S' -11.505 0.9725 -8.0427 {"}'S' P -11.3646 0.8026 -7.8684 {"}'S' -11.372 0.946 -7.8652 {"}'S' P -11.2052 0.8331 -7.6712 {"}'S' -11.2225 0.9225 -7.6846 {"}'S' P -11.0472 0.9188 -7.4902 {"}'S' -11.0476 0.9208 -7.4912 {"}'S' P -11.4768 0.9912 -8.4767 {"}'S' -11.4761 1.006 -8.4671 {"}'S' P -11.3483 0.8905 -8.2815 {"}'S' -11.3528 0.9592 -8.2538 {"}'S' P -11.201 0.8474 -8.079 {"}'S' -11.2171 0.9296 -8.0616 {"}'S' P -11.0429 0.8652 -7.8805 {"}'S' -11.0589 0.9099 -7.8785 {"}'S' P -11.2395 1.0663 -8.5574 {"}'S' -11.2427 1.0834 -8.5435 {"}'S' P -11.1046 0.9715 -8.3565 {"}'S' -11.1235 1.0321 -8.3245 {"}'S' P -10.9488 0.9473 -8.1483 {"}'S' -10.9766 1.0076 -8.1301 {"}'S' P -10.7856 0.9962 -7.9518 {"}'S' -10.7944 1.0104 -7.9501 {"}'S' P -10.8652 1.1042 -8.3912 {"}'S' -10.8789 1.1259 -8.3772 {"}'S' P -10.7089 1.1149 -8.1919 {"}'S' -10.7112 1.1181 -8.1907 @dotlist {x} color= red width= 1 master= {vdw contact} { HG SER 83 H}'S' sky -13.6462 1.2074 -8.7621 {"}'S' sky -13.3816 1.3112 -8.7932 {"}'S' sky -13.1109 1.4157 -8.7359 @dotlist {x} color= red width= 1 master= {vdw contact} { HG SER 83 H}'S' green -12.9015 0.8634 -7.3052 {"}'S' green -12.6995 0.9821 -7.4766 {"}'S' green -12.5998 1.0525 -7.7101 {"}'S' green -12.6205 1.0351 -7.9959 @dotlist {x} color= red width= 1 master= {H-bonds} { HG SER 83 H}'S' greentint -14.0005 0.7509 -8.2638 {"}'S' greentint -13.8921 0.6108 -8.0854 {"}'S' greentint -13.7594 0.5266 -7.8899 {"}'S' greentint -13.6104 0.5022 -7.6909 {"}'S' greentint -13.4537 0.5397 -7.4991 {"}'S' greentint -13.8392 0.8661 -8.5174 {"}'S' greentint -13.7545 0.69 -8.358 {"}'S' greentint -13.6373 0.5654 -8.1728 {"}'S' greentint -13.4974 0.5003 -7.9735 {"}'S' greentint -13.3431 0.4996 -7.7744 {"}'S' greentint -13.1849 0.5633 -7.5881 {"}'S' greentint -13.6195 0.9715 -8.6616 {"}'S' greentint -13.5464 0.7735 -8.513 {"}'S' greentint -13.4338 0.6316 -8.3285 {"}'S' greentint -13.2925 0.5586 -8.1254 {"}'S' greentint -13.1343 0.5608 -7.9217 {"}'S' greentint -12.9736 0.6368 -7.7348 {"}'S' greentint -12.8241 0.7822 -7.5824 {"}'S' greentint -13.3054 0.8583 -8.5687 {"}'S' greentint -13.1893 0.7213 -8.3805 {"}'S' greentint -13.0406 0.6717 -8.1743 {"}'S' greentint -12.8782 0.7166 -7.9764 {"}'S' greentint -12.724 0.8492 -7.8147 {"}'S' greentint -13.0613 0.9569 -8.5429 {"}'S' greentint -12.9296 0.8551 -8.3448 {"}'S' greentint -12.7686 0.8832 -8.1448 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 97 H}'M' greentint -9.0907 2.5729 -5.7919 {"}'M' greentint -9.2497 2.4842 -5.9734 {"}'M' greentint -9.3932 2.3765 -6.2459 {"}'M' greentint -8.9877 2.8055 -5.8408 {"}'M' greentint -9.151 2.7721 -6.0427 {"}'M' greentint -9.2996 2.6152 -6.1912 {"}'M' greentint -9.4033 2.5188 -6.4887 {"}'M' greentint -9.4598 2.2693 -6.4919 {"}'M' greentint -8.8438 3.0106 -5.9028 {"}'M' greentint -9.0017 3.0022 -6.1048 {"}'M' greentint -9.1603 2.9091 -6.2833 {"}'M' greentint -9.2996 2.7411 -6.4164 {"}'M' greentint -9.3729 2.6128 -6.7334 {"}'M' greentint -9.444 2.3677 -6.7577 {"}'M' greentint -8.6586 3.1807 -5.9688 {"}'M' greentint -8.8147 3.1913 -6.1727 {"}'M' greentint -8.9749 3.1331 -6.3647 {"}'M' greentint -9.1297 3.01 -6.5293 {"}'M' greentint -9.2654 2.8325 -6.6555 {"}'M' greentint -9.295 2.693 -6.9717 {"}'M' greentint -9.3762 2.4499 -7.0101 {"}'M' greentint -8.732 3.3113 -6.4168 {"}'M' greentint -8.8941 3.2291 -6.6025 {"}'M' greentint -9.0463 3.0932 -6.7624 {"}'M' greentint -9.183 2.9116 -6.8872 {"}'M' greentint -9.1805 2.7378 -7.2014 {"}'M' greentint -8.6372 3.3742 -6.6758 {"}'M' greentint -8.793 3.2754 -6.8491 {"}'M' greentint -8.9391 3.1318 -6.999 {"}'M' greentint -9.0699 2.9499 -7.1174 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 83 H}'M' greentint -9.3945 2.2058 -6.3607 {"}'M' greentint -9.2363 2.2695 -6.1744 {"}'M' greentint -9.086 2.394 -6.0146 {"}'M' greentint -8.9529 2.5696 -5.8915 {"}'M' greentint -8.8477 2.7842 -5.8138 {"}'M' greentint -9.3439 2.2648 -6.7118 {"}'M' greentint -9.1857 2.267 -6.508 {"}'M' greentint -9.025 2.343 -6.3211 {"}'M' greentint -8.8755 2.4884 -6.1687 {"}'M' greentint -8.7509 2.6883 -6.0629 {"}'M' greentint -8.6623 2.9259 -6.0149 {"}'M' greentint -8.6178 3.1807 -6.0276 {"}'M' greentint -9.2408 2.4275 -6.9668 {"}'M' greentint -9.092 2.3779 -6.7607 {"}'M' greentint -8.9297 2.4228 -6.5627 {"}'M' greentint -8.7754 2.5554 -6.401 {"}'M' greentint -8.6512 2.7587 -6.2964 {"}'M' greentint -8.5729 3.0044 -6.2643 {"}'M' greentint -8.5519 3.2598 -6.3076 {"}'M' greentint -9.1128 2.6631 -7.1293 {"}'M' greentint -8.981 2.5613 -6.9311 {"}'M' greentint -8.82 2.5894 -6.7311 {"}'M' greentint -8.672 2.7413 -6.5823 {"}'M' greentint -8.5772 2.9755 -6.525 {"}'M' greentint -8.5609 3.2292 -6.5743 {"}'M' greentint -8.9517 2.9343 -7.1625 {"}'M' greentint -8.8475 2.7792 -6.9847 {"}'M' greentint -8.6875 2.8761 -6.8052 {"}'M' greentint -8.6326 3.1294 -6.805 {"}'M' greentint -8.7658 3.0257 -7.0045 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 97 H}'M' green -9.5849 1.9418 -5.2638 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 97 H}'M' greentint -9.772 1.4856 -4.1508 {"}'M' greentint -9.9053 1.382 -4.3503 {"}'M' greentint -9.6903 1.7322 -4.1706 {"}'M' greentint -9.8503 1.6353 -4.3501 {"}'M' greentint -9.9607 1.5359 -4.6303 {"}'M' greentint -9.977 1.2822 -4.581 {"}'M' greentint -9.5568 1.9501 -4.2242 {"}'M' greentint -9.7178 1.922 -4.4241 {"}'M' greentint -9.8659 1.77 -4.573 {"}'M' greentint -9.9324 1.6334 -4.8839 {"}'M' greentint -9.9828 1.3787 -4.8793 {"}'M' greentint -9.5273 2.1231 -4.4967 {"}'M' greentint -9.6876 2.032 -4.6796 {"}'M' greentint -9.829 1.8615 -4.8151 {"}'M' greentint -9.8356 1.7076 -5.1239 {"}'M' greentint -9.9038 1.4586 -5.1416 {"}'M' greentint -9.4329 2.2155 -4.7442 {"}'M' greentint -9.5895 2.1034 -4.9155 {"}'M' greentint -9.7281 1.9287 -5.0463 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 83 H}'M' green -9.8456 1.3275 -4.1572 {"}'M' green -9.7237 1.5241 -4.0542 {"}'M' green -9.4423 2.0641 -4.2048 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 83 H}'M' greentint -9.8725 1.2151 -4.5238 {"}'M' greentint -9.7271 1.3769 -4.3808 {"}'M' greentint -9.6025 1.5793 -4.2772 {"}'M' greentint -9.5061 1.8124 -4.2173 {"}'M' greentint -9.9594 1.207 -4.95 {"}'M' greentint -9.7997 1.2956 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-8.9101 {"}'S' sky -10.7601 1.069 -9.557 {"}'S' sky -10.6058 1.0682 -9.3579 {"}'S' blue -10.4476 1.132 -9.1716 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 79 A}'S' sea -12.5951 0.7725 -7.7628 {"}'S' sea -12.453 0.6941 -7.5575 {"}'S' sea -12.3373 0.7774 -7.8456 { CD2 PHE 79 A}'S' sea -11.6079 0.9425 -9.2736 {"}'S' sea -11.4455 1.0033 -9.0792 {"}'S' sea -11.5013 0.9205 -9.5569 {"}'S' sea -11.3375 0.9585 -9.3571 {"}'S' sea -11.1747 1.0343 -9.1674 {"}'S' sea -11.2463 0.9625 -9.6537 {"}'S' sea -11.0859 1.0129 -9.4615 { HB2 PHE 79 A}'S' sea -12.1859 0.5774 -6.8685 {"}'S' green -12.2534 0.5566 -7.3593 {"}'S' green -12.116 0.4751 -7.1598 {"}'S' green -11.9641 0.4493 -6.9565 {"}'S' sea -11.8047 0.4797 -6.7592 {"}'S' green -12.2011 0.656 -7.7514 {"}'S' green -11.8143 0.3792 -7.175 {"}'S' green -11.6588 0.3912 -6.9771 {"}'S' sea -11.5002 0.4557 -6.7904 {"}'S' green -12.0507 0.7767 -8.0228 {"}'S' green -11.558 0.3625 -7.2702 {"}'S' sea -11.3986 0.393 -7.0729 {"}'S' green -11.7727 0.7039 -8.0535 {"}'S' green -11.3944 0.4073 -7.4807 {"}'S' sea -11.2363 0.4251 -7.2822 {"}'S' sea -11.5366 0.785 -8.1371 {"}'S' green -11.4329 0.6262 -7.9591 {"}'S' green -11.298 0.5314 -7.7582 {"}'S' sea -11.2984 0.8918 -8.1674 {"}'S' sea -11.1958 0.7391 -7.9923 {"}'S' sea -11.0586 0.6641 -7.7929 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 PHE 79 A}'S' P -12.0924 0.5153 -7.5723 {"}'S' -12.0878 0.5259 -7.5686 {"}'S' P -11.9617 0.4209 -7.3773 {"}'S' -11.9589 0.4298 -7.3755 {"}'S' P -11.9631 0.6006 -7.8594 {"}'S' -11.9608 0.6063 -7.8558 {"}'S' P -11.8469 0.4688 -7.674 {"}'S' -11.8397 0.5029 -7.66 {"}'S' P -11.7104 0.3875 -7.4739 {"}'S' -11.7087 0.4098 -7.4699 {"}'S' P -11.6701 0.5511 -7.8784 {"}'S' -11.67 0.5546 -7.8755 {"}'S' P -11.5417 0.4504 -7.6832 {"}'S' -11.5414 0.4565 -7.6809 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 34 A}'M' greentint -9.3042 2.2722 -6.0713 {"}'M' greentint -9.4631 2.1835 -6.2529 {"}'M' greentint -9.2011 2.5048 -6.1203 {"}'M' greentint -9.3644 2.4714 -6.3222 {"}'M' greentint -9.513 2.3145 -6.4707 {"}'M' greentint -9.6167 2.2181 -6.7681 {"}'M' greentint -8.9194 2.6306 -5.9827 {"}'M' greentint -9.0572 2.7099 -6.1823 {"}'M' greentint -9.2152 2.7015 -6.3843 {"}'M' greentint -9.3738 2.6084 -6.5627 {"}'M' greentint -9.513 2.4404 -6.6959 {"}'M' greentint -9.5863 2.3121 -7.0129 {"}'M' greentint -8.8721 2.88 -6.2483 {"}'M' greentint -9.0282 2.8906 -6.4522 {"}'M' greentint -9.1884 2.8324 -6.6442 {"}'M' greentint -9.3432 2.7093 -6.8088 {"}'M' greentint -9.4789 2.5318 -6.935 {"}'M' greentint -8.785 3.0341 -6.4942 {"}'M' greentint -8.9454 3.0106 -6.6963 {"}'M' greentint -9.1075 2.9284 -6.8819 {"}'M' greentint -9.2598 2.7925 -7.0419 {"}'M' greentint -9.3964 2.6109 -7.1667 {"}'M' greentint -8.8506 3.0735 -6.9552 {"}'M' greentint -9.0064 2.9747 -7.1286 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 79 A}'M' greentint -9.484 2.0952 -6.3844 {"}'M' greentint -9.3258 2.1589 -6.1981 {"}'M' greentint -9.1756 2.2834 -6.0383 {"}'M' greentint -9.5748 2.2272 -6.9385 {"}'M' greentint -9.4334 2.1542 -6.7355 {"}'M' greentint -9.2753 2.1564 -6.5317 {"}'M' greentint -9.1146 2.2324 -6.3448 {"}'M' greentint -8.9651 2.3778 -6.1924 {"}'M' greentint -8.8405 2.5777 -6.0866 {"}'M' greentint -9.4464 2.4539 -7.1787 {"}'M' greentint -9.3303 2.3169 -6.9905 {"}'M' greentint -9.1816 2.2673 -6.7844 {"}'M' greentint -9.0192 2.3122 -6.5864 {"}'M' greentint -8.865 2.4448 -6.4247 {"}'M' greentint -8.7408 2.6481 -6.3201 {"}'M' greentint -8.6625 2.8938 -6.288 {"}'M' greentint -9.2023 2.5525 -7.153 {"}'M' greentint -9.0706 2.4507 -6.9548 {"}'M' greentint -8.9096 2.4788 -6.7548 {"}'M' greentint -8.7615 2.6307 -6.606 {"}'M' greentint -8.6667 2.8649 -6.5487 {"}'M' greentint -9.0413 2.8238 -7.1862 {"}'M' greentint -8.9371 2.6686 -7.0083 {"}'M' greentint -8.7771 2.7655 -6.8289 {"}'M' greentint -8.7222 3.0188 -6.8287 {"}'M' greentint -8.8554 2.9151 -7.0282 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 34 A}'M' green -9.9889 1.0531 -4.4083 {"}'M' green -10.1222 0.9495 -4.6078 {"}'M' green -9.803 1.1445 -4.2503 {"}'M' green -10.1493 1.2008 -5.1415 {"}'M' green -9.4504 1.5926 -4.3474 {"}'M' green -9.3368 1.7866 -4.5987 {"}'M' green -9.945 1.4962 -5.3038 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 34 A}'M' greentint -9.9072 1.2997 -4.4282 {"}'M' greentint -10.0672 1.2028 -4.6076 {"}'M' greentint -10.1776 1.1034 -4.8879 {"}'M' greentint -9.642 1.4158 -4.2835 {"}'M' greentint -9.7737 1.5175 -4.4817 {"}'M' greentint -9.9347 1.4895 -4.6817 {"}'M' greentint -10.0828 1.3375 -4.8305 {"}'M' greentint -9.5853 1.6874 -4.5483 {"}'M' greentint -9.7442 1.6906 -4.7542 {"}'M' greentint -9.9045 1.5995 -4.9371 {"}'M' greentint -10.0459 1.429 -5.0727 {"}'M' greentint -9.4885 1.8221 -4.8038 {"}'M' greentint -9.6498 1.7829 -5.0017 {"}'M' greentint -9.8064 1.6709 -5.1731 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 79 A}'M' green -10.3311 1.0096 -4.9088 {"}'M' green -10.1739 1.005 -4.7032 {"}'M' green -9.7081 1.3326 -4.1926 {"}'M' green -10.2476 1.1874 -5.1667 {"}'M' green -9.5102 1.6007 -4.3285 {"}'M' green -10.1193 1.3991 -5.3183 {"}'M' green -9.4237 1.8232 -4.5361 {"}'M' green -9.9796 1.6337 -5.3928 {"}'M' green -9.4384 1.9494 -4.7816 {"}'M' green -9.734 1.76 -5.2277 {"}'M' green -9.5753 1.8573 -5.0501 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 79 A}'M' greentint -10.0113 1.0607 -4.509 {"}'M' greentint -9.8535 1.1709 -4.3356 {"}'M' greentint -10.0996 1.1404 -4.9623 {"}'M' greentint -9.9404 1.1628 -4.7618 {"}'M' greentint -9.7806 1.2514 -4.5808 {"}'M' greentint -9.6339 1.401 -4.4332 {"}'M' greentint -9.9809 1.3223 -5.1168 {"}'M' greentint -9.8221 1.3333 -4.9159 {"}'M' greentint -9.6651 1.4292 -4.7385 {"}'M' greentint -9.5266 1.5998 -4.607 {"}'M' greentint -9.8466 1.5302 -5.1925 {"}'M' greentint -9.6835 1.5594 -4.9899 {"}'M' greentint -9.5337 1.7131 -4.8391 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n glu A 168 2bhqA_170F_510}P -12.136 -2.0301 0.4731 {"}-12.136 -2.0301 0.4731 { ca glu A 168 2bhqA_170F_510}-11.0437 -2.2895 -0.444 { c glu A 168 2bhqA_170F_510}-10.8296 -1.1672 -1.4414 { o glu A 168 2bhqA_170F_510}-11.7207 -0.8439 -2.2257 { c glu A 168 2bhqA_170F_510}P -10.8296 -1.1672 -1.4414 { n ser A 169 2bhqA_170F_510}-9.6451 -0.571 -1.4077 { ca ser A 169 2bhqA_170F_510}-9.3175 0.4857 -2.346 { c ser A 169 2bhqA_170F_510}-8.2271 -0.041 -3.2646 { o ser A 169 2bhqA_170F_510}-7.3035 -0.7366 -2.8227 { c ser A 169 2bhqA_170F_510}P -8.2271 -0.041 -3.2646 { n phe A 170 2bhqA_170F_510}-8.3419 0.2809 -4.5442 { ca phe A 170 2bhqA_170F_510}-7.3774 -0.1961 -5.5197 { c phe A 170 2bhqA_170F_510}-7.2429 0.7601 -6.6923 { o phe A 170 2bhqA_170F_510}-8.1007 1.6209 -6.9197 { c phe A 170 2bhqA_170F_510}P -7.2429 0.7601 -6.6923 { n tyr A 171 2bhqA_170F_510}-6.1588 0.5982 -7.4412 { ca tyr A 171 2bhqA_170F_510}-5.8991 1.4456 -8.5904 { c tyr A 171 2bhqA_170F_510}-6.3354 0.8289 -9.9073 { o tyr A 171 2bhqA_170F_510}-6.3151 -0.3891 -10.0868 { c tyr A 171 2bhqA_170F_510}P -6.3354 0.8289 -9.9073 { n val A 172 2bhqA_170F_510}-6.7364 1.6965 -10.8259 { ca val A 172 2bhqA_170F_510}-7.129 1.2778 -12.1625 { c val A 172 2bhqA_170F_510}-6.5477 2.274 -13.1571 { o val A 172 2bhqA_170F_510}-6.3792 3.4548 -12.8479 { n glu A 508 2bhqA_170F_510}P -5.994 5.8964 -11.3218 {"}-5.994 5.8964 -11.3218 { ca glu A 508 2bhqA_170F_510}-6.9935 6.5685 -10.5037 { c glu A 508 2bhqA_170F_510}-7.4149 5.5283 -9.47 { o glu A 508 2bhqA_170F_510}-7.189 4.3336 -9.6626 { c glu A 508 2bhqA_170F_510}P -7.4149 5.5283 -9.47 { n met A 509 2bhqA_170F_510}-7.9872 5.9756 -8.3584 { ca met A 509 2bhqA_170F_510}-8.3546 5.0507 -7.2891 { c met A 509 2bhqA_170F_510}-9.8446 4.8502 -7.0959 { o met A 509 2bhqA_170F_510}-10.6274 5.7925 -7.2121 { c met A 509 2bhqA_170F_510}P -9.8446 4.8502 -7.0959 { n lys A 510 2bhqA_170F_510}-10.2253 3.6116 -6.7901 { ca lys A 510 2bhqA_170F_510}-11.6124 3.2683 -6.5177 { c lys A 510 2bhqA_170F_510}-11.6674 2.6672 -5.1109 { o lys A 510 2bhqA_170F_510}-10.761 1.9254 -4.7109 { c lys A 510 2bhqA_170F_510}P -11.6674 2.6672 -5.1109 { n ala A 511 2bhqA_170F_510}-12.7124 2.9981 -4.3607 { ca ala A 511 2bhqA_170F_510}-12.8896 2.4735 -3.0101 { c ala A 511 2bhqA_170F_510}-14.2185 1.741 -2.9794 { o ala A 511 2bhqA_170F_510}-15.2626 2.3334 -3.2463 { c ala A 511 2bhqA_170F_510}P -14.2185 1.741 -2.9794 { n val A 512 2bhqA_170F_510}-14.1779 0.4536 -2.654 { ca val A 512 2bhqA_170F_510}-15.386 -0.3605 -2.6173 { c val A 512 2bhqA_170F_510}-15.6181 -0.9686 -1.2406 { o val A 512 2bhqA_170F_510}-14.7546 -1.6545 -0.6882 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 168 2bhqA_170F_510}P -12.136 -2.0301 0.4731 { ca glu A 168 2bhqA_170F_510}P -11.0437 -2.2895 -0.444 { n ser A 169 2bhqA_170F_510}P -9.6451 -0.571 -1.4077 { ca ser A 169 2bhqA_170F_510}P -9.3175 0.4857 -2.346 { n phe A 170 2bhqA_170F_510}P -8.3419 0.2809 -4.5442 { ca phe A 170 2bhqA_170F_510}P -7.3774 -0.1961 -5.5197 { n tyr A 171 2bhqA_170F_510}P -6.1588 0.5982 -7.4412 { ca tyr A 171 2bhqA_170F_510}P -5.8991 1.4456 -8.5904 { n val A 172 2bhqA_170F_510}P -6.7364 1.6965 -10.8259 { ca val A 172 2bhqA_170F_510}P -7.129 1.2778 -12.1625 { n glu A 508 2bhqA_170F_510}P -5.994 5.8964 -11.3218 { ca glu A 508 2bhqA_170F_510}P -6.9935 6.5685 -10.5037 { n met A 509 2bhqA_170F_510}P -7.9872 5.9756 -8.3584 { ca met A 509 2bhqA_170F_510}P -8.3546 5.0507 -7.2891 { n lys A 510 2bhqA_170F_510}P -10.2253 3.6116 -6.7901 { ca lys A 510 2bhqA_170F_510}P -11.6124 3.2683 -6.5177 { n ala A 511 2bhqA_170F_510}P -12.7124 2.9981 -4.3607 { ca ala A 511 2bhqA_170F_510}P -12.8896 2.4735 -3.0101 { n val A 512 2bhqA_170F_510}P -14.1779 0.4536 -2.654 { ca val A 512 2bhqA_170F_510}P -15.386 -0.3605 -2.6173 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca glu A 168 2bhqA_170F_510}P -11.0437 -2.2895 -0.444 {"}-11.0437 -2.2895 -0.444 { ca ser A 169 2bhqA_170F_510}-9.3175 0.4857 -2.346 { ca phe A 170 2bhqA_170F_510}-7.3774 -0.1961 -5.5197 { ca tyr A 171 2bhqA_170F_510}-5.8991 1.4456 -8.5904 { ca val A 172 2bhqA_170F_510}-7.129 1.2778 -12.1625 { ca glu A 508 2bhqA_170F_510}P -6.9935 6.5685 -10.5037 {"}-6.9935 6.5685 -10.5037 { ca met A 509 2bhqA_170F_510}-8.3546 5.0507 -7.2891 { ca lys A 510 2bhqA_170F_510}-11.6124 3.2683 -6.5177 { ca ala A 511 2bhqA_170F_510}-12.8896 2.4735 -3.0101 { ca val A 512 2bhqA_170F_510}-15.386 -0.3605 -2.6173 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 170 2bhqA_170F_510}P -7.3774 -0.1961 -5.5197 { cb phe A 170 2bhqA_170F_510}-7.7738 -1.5954 -6.0224 { cg phe A 170 2bhqA_170F_510}-9.1914 -1.6918 -6.5367 { cd1 phe A 170 2bhqA_170F_510}-10.2407 -2.0082 -5.6771 { ce1 phe A 170 2bhqA_170F_510}-11.5499 -2.114 -6.1556 { cz phe A 170 2bhqA_170F_510}-11.8154 -1.8996 -7.5089 { cg phe A 170 2bhqA_170F_510}P -9.1914 -1.6918 -6.5367 { cd2 phe A 170 2bhqA_170F_510}-9.4727 -1.478 -7.8841 { ce2 phe A 170 2bhqA_170F_510}-10.7784 -1.581 -8.3738 { cz phe A 170 2bhqA_170F_510}ghost -11.8154 -1.8996 -7.5089 { ca lys A 510 2bhqA_170F_510}P -11.6124 3.2683 -6.5177 { cb lys A 510 2bhqA_170F_510}-12.1259 2.2401 -7.5317 { cg lys A 510 2bhqA_170F_510}-13.6151 1.9326 -7.4019 { cd lys A 510 2bhqA_170F_510}-14.0728 1.007 -8.5202 { ce lys A 510 2bhqA_170F_510}-15.581 0.801 -8.5112 { nz lys A 510 2bhqA_170F_510}-15.9997 -0.1485 -9.5862 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 170 2bhqA_170F_510}P -7.7738 -1.5954 -6.0224 {"}P -7.7738 -1.5954 -6.0224 { cd1 phe A 170 2bhqA_170F_510}P -10.2407 -2.0082 -5.6771 { cd2 phe A 170 2bhqA_170F_510}P -9.4727 -1.478 -7.8841 { ce1 phe A 170 2bhqA_170F_510}P -11.5499 -2.114 -6.1556 { ce2 phe A 170 2bhqA_170F_510}P -10.7784 -1.581 -8.3738 { cz phe A 170 2bhqA_170F_510}P -11.8154 -1.8996 -7.5089 { cb lys A 510 2bhqA_170F_510}P -12.1259 2.2401 -7.5317 {"}P -12.1259 2.2401 -7.5317 { cg lys A 510 2bhqA_170F_510}P -13.6151 1.9326 -7.4019 {"}P -13.6151 1.9326 -7.4019 { cd lys A 510 2bhqA_170F_510}P -14.0728 1.007 -8.5202 {"}P -14.0728 1.007 -8.5202 { ce lys A 510 2bhqA_170F_510}P -15.581 0.801 -8.5112 {"}P -15.581 0.801 -8.5112 { nz lys A 510 2bhqA_170F_510}P -15.9997 -0.1485 -9.5862 {"}P -15.9997 -0.1485 -9.5862 {"}P -15.9997 -0.1485 -9.5862 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 170 A}'S' blue -11.1232 -0.165 -7.4049 {"}'S' sky -11.2631 -0.0841 -7.6077 {"}'S' sky -11.4161 -0.0499 -7.8161 {"}'S' sky -11.5772 -0.0648 -8.0191 {"}'S' blue -12.0479 -0.3881 -8.5375 {"}'S' blue -12.1814 -0.5748 -8.6584 {"}'S' blue -10.8761 -0.0886 -7.4656 {"}'S' sky -11.0115 0.0016 -7.6644 {"}'S' sky -11.3153 0.057 -8.0735 {"}'S' blue -11.4757 0.0208 -8.2708 {"}'S' blue -10.7384 0.0392 -7.7133 {"}'S' sky -10.8808 0.1051 -7.9162 {"}'S' sky -11.0327 0.1323 -8.1197 {"}'S' blue -11.1904 0.1191 -8.3203 { CZ PHE 170 A}'S' blue -11.9178 -0.2135 -7.0512 {"}'S' blue -12.0697 -0.1864 -7.2548 {"}'S' blue -11.5792 -0.2356 -7.0208 {"}'S' sky -11.726 -0.1748 -7.2285 {"}'S' sky -11.8826 -0.1518 -7.4358 {"}'S' blue -12.0442 -0.1692 -7.6407 {"}'S' blue -11.3977 -0.2247 -7.2178 {"}'S' sky -11.5468 -0.1717 -7.4251 {"}'S' sky -11.7037 -0.1574 -7.6326 {"}'S' blue -11.8658 -0.1809 -7.8352 { HZ PHE 170 A}'S' sky -13.5401 -1.2681 -7.8145 {"}'S' sky -13.5806 -1.3714 -8.1812 {"}'S' sky -13.2454 -1.3748 -8.575 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 170 A}'S' sea -11.1594 0.0514 -7.8694 { CZ PHE 170 A}'S' sea -13.1579 -0.7796 -7.4293 {"}'S' sea -13.2921 -0.9623 -7.5522 {"}'S' green -12.9356 -0.5551 -7.5219 {"}'S' green -13.2184 -0.8934 -7.7935 {"}'S' green -13.2202 -1.0476 -8.1112 {"}'S' green -12.6734 -0.3762 -7.5905 {"}'S' green -12.5455 -0.3418 -7.8269 {"}'S' green -12.921 -1.0166 -8.5381 {"}'S' sea -13.0191 -1.2501 -8.6001 {"}'S' green -12.3692 -0.3196 -8.0182 {"}'S' green -12.5247 -0.4494 -8.1839 {"}'S' sea -12.7388 -1.0426 -8.724 {"}'S' sea -12.3445 -0.4723 -8.3734 {"}'S' green -12.4895 -0.636 -8.5154 {"}'S' green -12.6222 -0.8278 -8.6325 { HZ PHE 170 A}'S' green -13.442 -1.1967 -8.0505 {"}'S' green -13.3043 -1.1827 -8.2756 {"}'S' sea -13.4375 -1.3583 -8.3987 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 170 A}'S' P -13.0849 -0.7067 -7.6725 {"}'S' -13.0801 -0.711 -7.6718 {"}'S' P -12.8285 -0.4949 -7.7584 {"}'S' -12.8156 -0.5127 -7.7554 {"}'S' P -12.9741 -0.649 -7.9033 {"}'S' -12.9316 -0.6945 -7.8895 {"}'S' P -13.1063 -0.8348 -8.0228 {"}'S' -13.0661 -0.8674 -8.0066 {"}'S' P -13.0859 -1.0238 -8.3346 {"}'S' -13.0838 -1.0243 -8.3334 {"}'S' P -12.6987 -0.4672 -7.9888 {"}'S' -12.6791 -0.499 -7.9787 {"}'S' P -12.8423 -0.6258 -8.13 {"}'S' -12.7985 -0.6784 -8.1044 {"}'S' P -12.9719 -0.8124 -8.2459 {"}'S' -12.9326 -0.8492 -8.2213 {"}'S' P -12.6709 -0.6113 -8.328 {"}'S' -12.6561 -0.6327 -8.3133 {"}'S' P -12.8044 -0.8018 -8.4465 {"}'S' -12.7943 -0.8126 -8.4372 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 LYS 510 A}'S' blue -12.0554 0.2505 -7.3332 {"}'S' blue -11.9034 0.2247 -7.1299 {"}'S' sky -11.901 0.1964 -7.5507 {"}'S' sky -11.7537 0.1547 -7.3484 {"}'S' blue -11.5982 0.1667 -7.1505 {"}'S' blue -11.7862 0.2443 -7.8474 {"}'S' sky -11.6497 0.1629 -7.6473 {"}'S' sky -11.4973 0.138 -7.4436 {"}'S' blue -11.3379 0.1684 -7.2464 {"}'S' blue -11.6095 0.3266 -8.0518 {"}'S' sky -11.481 0.2258 -7.8567 {"}'S' sky -11.1756 0.2005 -7.4556 {"}'S' blue -11.0179 0.2766 -7.2728 {"}'S' sky -11.3722 0.4017 -8.1326 {"}'S' sky -10.9183 0.3315 -7.5269 {"}'S' blue -11.1351 0.5145 -8.1658 {"}'S' sky -10.998 0.4395 -7.9663 {"}'S' blue -10.8416 0.4503 -7.7671 { HD3 LYS 510 A}'S' sky -13.758 -1.0165 -7.9373 {"}'S' sky -13.7676 -1.117 -8.353 {"}'S' sky -13.3477 -1.0889 -8.6587 {"}'S' blue -12.4508 -0.2174 -8.6486 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 LYS 510 A}'S' sea -11.3338 0.1828 -7.6541 {"}'S' sea -11.2373 0.3068 -7.9317 {"}'S' sea -11.0815 0.2826 -7.7235 { HD3 LYS 510 A}'S' sea -13.4502 -0.794 -7.5999 {"}'S' sea -13.3158 -0.615 -7.4775 {"}'S' sea -13.6121 -1.105 -8.1552 {"}'S' green -13.4534 -1.0405 -7.9684 {"}'S' green -13.3005 -0.9245 -7.803 {"}'S' green -13.161 -0.7637 -7.6661 {"}'S' green -13.0395 -0.5668 -7.5655 {"}'S' sea -12.9436 -0.3411 -7.5031 {"}'S' sea -13.5112 -1.1337 -8.4482 {"}'S' green -13.3518 -1.1033 -8.251 {"}'S' green -12.7175 -0.2485 -7.6679 {"}'S' green -13.1895 -1.0712 -8.4603 {"}'S' green -12.5627 -0.2298 -7.8845 {"}'S' green -12.9322 -0.9402 -8.5315 {"}'S' green -12.5259 -0.4222 -8.1508 {"}'S' sea -12.4555 -0.1731 -8.1285 {"}'S' sea -12.8555 -0.8214 -8.7717 {"}'S' green -12.6994 -0.726 -8.5972 {"}'S' green -12.5623 -0.5578 -8.4669 {"}'S' sea -12.4607 -0.3367 -8.3973 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HD3 LYS 510 A}'S' P -13.1938 -1.0175 -8.07 {"}'S' -13.1973 -1.0087 -8.0733 {"}'S' P -13.0437 -0.8817 -7.9147 {"}'S' -13.067 -0.8413 -7.9369 {"}'S' P -12.9096 -0.7017 -7.7912 {"}'S' -12.9398 -0.6695 -7.8194 {"}'S' P -12.7994 -0.4877 -7.7082 {"}'S' -12.8047 -0.4834 -7.713 {"}'S' P -13.0318 -0.9951 -8.2774 {"}'S' -13.0433 -0.9722 -8.2797 {"}'S' P -12.8813 -0.8637 -8.1189 {"}'S' -12.9232 -0.8085 -8.1375 {"}'S' P -12.7485 -0.6848 -7.997 {"}'S' -12.7987 -0.6413 -8.0226 {"}'S' P -12.64 -0.4697 -7.9165 {"}'S' -12.6599 -0.4589 -7.9274 {"}'S' P -12.775 -0.8218 -8.3608 {"}'S' -12.8007 -0.7948 -8.3628 {"}'S' P -12.6359 -0.6449 -8.2299 {"}'S' -12.67 -0.6202 -8.2376 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 170 A}'M' greentint -9.2728 2.0134 -6.2634 {"}'M' greentint -9.4164 1.9056 -6.5358 {"}'M' greentint -9.0109 2.3346 -6.1307 {"}'M' greentint -9.1742 2.3012 -6.3326 {"}'M' greentint -9.3228 2.1443 -6.4811 {"}'M' greentint -9.4265 2.048 -6.7786 {"}'M' greentint -8.867 2.5397 -6.1927 {"}'M' greentint -9.0249 2.5314 -6.3948 {"}'M' greentint -9.1835 2.4382 -6.5732 {"}'M' greentint -9.3227 2.2702 -6.7063 {"}'M' greentint -9.3961 2.142 -7.0234 {"}'M' greentint -8.8379 2.7205 -6.4626 {"}'M' greentint -8.9981 2.6622 -6.6546 {"}'M' greentint -9.1529 2.5392 -6.8193 {"}'M' greentint -9.2886 2.3616 -6.9454 {"}'M' greentint -9.3182 2.2222 -7.2616 {"}'M' greentint -8.7552 2.8405 -6.7067 {"}'M' greentint -8.9173 2.7583 -6.8924 {"}'M' greentint -9.0695 2.6223 -7.0523 {"}'M' greentint -9.2061 2.4408 -7.1771 {"}'M' greentint -8.6603 2.9033 -6.9657 {"}'M' greentint -8.8162 2.8046 -7.139 {"}'M' greentint -8.9623 2.661 -7.2889 {"}'M' greentint -9.0931 2.479 -7.4073 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 510 A}'M' greentint -9.442 1.8506 -6.6864 {"}'M' greentint -9.2838 1.9143 -6.5001 {"}'M' greentint -9.1336 2.0387 -6.3402 {"}'M' greentint -9.0004 2.2143 -6.2171 {"}'M' greentint -8.8952 2.429 -6.1394 {"}'M' greentint -9.3914 1.9095 -7.0374 {"}'M' greentint -9.2332 1.9118 -6.8337 {"}'M' greentint -9.0726 1.9877 -6.6468 {"}'M' greentint -8.923 2.1331 -6.4944 {"}'M' greentint -8.7984 2.3331 -6.3886 {"}'M' greentint -8.7099 2.5707 -6.3405 {"}'M' greentint -9.2883 2.0722 -7.2924 {"}'M' greentint -9.1395 2.0226 -7.0863 {"}'M' greentint -8.9772 2.0675 -6.8884 {"}'M' greentint -8.823 2.2001 -6.7267 {"}'M' greentint -8.6987 2.4035 -6.6221 {"}'M' greentint -8.6204 2.6491 -6.5899 {"}'M' greentint -9.1603 2.3078 -7.4549 {"}'M' greentint -9.0285 2.2061 -7.2568 {"}'M' greentint -8.8675 2.2341 -7.0568 {"}'M' greentint -8.7195 2.3861 -6.9079 {"}'M' greentint -8.6247 2.6202 -6.8506 {"}'M' greentint -8.6084 2.8739 -6.8999 {"}'M' greentint -8.895 2.4239 -7.3103 {"}'M' greentint -8.7351 2.5208 -7.1309 {"}'M' greentint -8.6801 2.7741 -7.1307 {"}'M' greentint -8.8134 2.6705 -7.3301 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 170 A}'M' greentint -9.8502 1.0212 -4.3157 {"}'M' greentint -9.9835 0.9176 -4.5152 {"}'M' greentint -9.7686 1.2678 -4.3356 {"}'M' greentint -9.9285 1.1709 -4.515 {"}'M' greentint -10.0389 1.0715 -4.7953 {"}'M' greentint -10.0552 0.8178 -4.746 {"}'M' greentint -9.6351 1.4856 -4.3891 {"}'M' greentint -9.7961 1.4576 -4.5891 {"}'M' greentint -9.9441 1.3056 -4.738 {"}'M' greentint -10.0106 1.169 -5.0489 {"}'M' greentint -10.061 0.9143 -5.0443 {"}'M' greentint -9.4467 1.6555 -4.4558 {"}'M' greentint -9.6055 1.6587 -4.6617 {"}'M' greentint -9.7658 1.5676 -4.8445 {"}'M' greentint -9.9072 1.3971 -4.9801 {"}'M' greentint -9.9138 1.2432 -5.2889 {"}'M' greentint -9.9821 0.9942 -5.3066 {"}'M' greentint -9.5111 1.7511 -4.9091 {"}'M' greentint -9.6677 1.639 -5.0805 {"}'M' greentint -9.8063 1.4643 -5.2113 {"}'M' greentint -9.53 1.653 -5.3057 {"}'M' greentint -9.6632 1.4774 -5.4287 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LYS 510 A}'M' green -9.9757 0.8038 -4.4189 {"}'M' green -9.8354 0.9658 -4.2828 {"}'M' green -9.7135 1.1624 -4.1798 {"}'M' green -9.3752 1.7684 -4.5907 @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 510 A}'M' greentint -10.0201 0.7433 -4.8229 {"}'M' greentint -9.8623 0.8535 -4.6494 {"}'M' greentint -9.717 1.0152 -4.5064 {"}'M' greentint -9.5923 1.2176 -4.4029 {"}'M' greentint -9.4959 1.4507 -4.343 {"}'M' greentint -9.9492 0.8454 -5.0756 {"}'M' greentint -9.7895 0.934 -4.8946 {"}'M' greentint -9.6428 1.0836 -4.7471 {"}'M' greentint -9.5191 1.2833 -4.6424 {"}'M' greentint -9.4272 1.5175 -4.589 {"}'M' greentint -9.8309 1.0159 -5.2297 {"}'M' greentint -9.6739 1.1118 -5.0524 {"}'M' greentint -9.5354 1.2823 -4.9209 {"}'M' greentint -9.4325 1.5058 -4.85 {"}'M' greentint -9.3781 1.7555 -4.8497 {"}'M' greentint -9.6923 1.242 -5.3038 {"}'M' greentint -9.5425 1.3957 -5.1529 {"}'M' greentint -9.4472 1.632 -5.0954 {"}'M' greentint -9.5841 1.5399 -5.364 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 43 2bjdA_45Y_57V}P -9.6845 -0.264 1.3683 {"}-9.6845 -0.264 1.3683 { ca lys A 43 2bjdA_45Y_57V}-9.8627 -1.3047 0.366 { c lys A 43 2bjdA_45Y_57V}-10.3508 -0.6825 -0.9319 { o lys A 43 2bjdA_45Y_57V}-10.8932 0.4137 -0.9357 { c lys A 43 2bjdA_45Y_57V}P -10.3508 -0.6825 -0.9319 { n gly A 44 2bjdA_45Y_57V}-10.1513 -1.3768 -2.0318 { ca gly A 44 2bjdA_45Y_57V}-10.4654 -0.8046 -3.3317 { c gly A 44 2bjdA_45Y_57V}-9.3898 -1.1235 -4.3606 { o gly A 44 2bjdA_45Y_57V}-8.809 -2.2152 -4.3652 { c gly A 44 2bjdA_45Y_57V}P -9.3898 -1.1235 -4.3606 { n tyr A 45 2bjdA_45Y_57V}-9.1368 -0.1832 -5.2479 { ca tyr A 45 2bjdA_45Y_57V}-8.1863 -0.4351 -6.3076 { c tyr A 45 2bjdA_45Y_57V}-7.6327 0.8211 -6.8937 { o tyr A 45 2bjdA_45Y_57V}-8.2178 1.8986 -6.7365 { c tyr A 45 2bjdA_45Y_57V}P -7.6327 0.8211 -6.8937 { n ala A 46 2bjdA_45Y_57V}-6.4505 0.6782 -7.5079 { ca ala A 46 2bjdA_45Y_57V}-5.8822 1.7064 -8.3278 { c ala A 46 2bjdA_45Y_57V}-5.5975 1.1197 -9.6725 { o ala A 46 2bjdA_45Y_57V}-4.9554 0.1009 -9.7654 { c ala A 46 2bjdA_45Y_57V}P -5.5975 1.1197 -9.6725 { n glu A 55 2bjdA_45Y_57V}P -7.1177 5.716 -11.9843 {"}-7.1177 5.716 -11.9843 { ca glu A 55 2bjdA_45Y_57V}-8.425 5.6873 -11.3261 { c glu A 55 2bjdA_45Y_57V}-8.2925 4.9653 -10.0129 { o glu A 55 2bjdA_45Y_57V}-7.7365 3.8673 -9.9474 { n glu A 55 2bjdA_45Y_57V}P -7.1177 5.716 -11.9843 {"}-7.1177 5.716 -11.9843 { c glu A 55 2bjdA_45Y_57V}P -8.2925 4.9653 -10.0129 { n val A 56 2bjdA_45Y_57V}-8.7685 5.6026 -8.9515 { ca val A 56 2bjdA_45Y_57V}-8.7558 5.023 -7.6381 { c val A 56 2bjdA_45Y_57V}-10.2131 4.942 -7.1233 { o val A 56 2bjdA_45Y_57V}-10.9533 5.9309 -7.1731 { c val A 56 2bjdA_45Y_57V}P -10.2131 4.942 -7.1233 { n val A 57 2bjdA_45Y_57V}-10.6007 3.7656 -6.6838 { ca val A 57 2bjdA_45Y_57V}-11.8368 3.5815 -5.9185 { c val A 57 2bjdA_45Y_57V}-11.398 3.0479 -4.5783 { o val A 57 2bjdA_45Y_57V}-10.609 2.0914 -4.4795 { c val A 57 2bjdA_45Y_57V}P -11.398 3.0479 -4.5783 { n ala A 58 2bjdA_45Y_57V}-11.8708 3.6997 -3.5396 { ca ala A 58 2bjdA_45Y_57V}-11.4145 3.4172 -2.2124 { c ala A 58 2bjdA_45Y_57V}-12.5729 3.4466 -1.2425 { o ala A 58 2bjdA_45Y_57V}-13.4187 4.3181 -1.3313 { c ala A 58 2bjdA_45Y_57V}P -12.5729 3.4466 -1.2425 { n glu A 59 2bjdA_45Y_57V}-12.5794 2.4942 -0.3317 { ca glu A 59 2bjdA_45Y_57V}-13.554 2.4631 0.746 { c glu A 59 2bjdA_45Y_57V}-12.8319 2.3735 2.0524 { o glu A 59 2bjdA_45Y_57V}-11.8661 1.6394 2.2053 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 43 2bjdA_45Y_57V}P -9.6845 -0.264 1.3683 { ca lys A 43 2bjdA_45Y_57V}P -9.8627 -1.3047 0.366 { n gly A 44 2bjdA_45Y_57V}P -10.1513 -1.3768 -2.0318 { ca gly A 44 2bjdA_45Y_57V}P -10.4654 -0.8046 -3.3317 {"}P -10.4654 -0.8046 -3.3317 { n tyr A 45 2bjdA_45Y_57V}P -9.1368 -0.1832 -5.2479 { ca tyr A 45 2bjdA_45Y_57V}P -8.1863 -0.4351 -6.3076 { n ala A 46 2bjdA_45Y_57V}P -6.4505 0.6782 -7.5079 { ca ala A 46 2bjdA_45Y_57V}P -5.8822 1.7064 -8.3278 { n glu A 55 2bjdA_45Y_57V}P -7.1177 5.716 -11.9843 { ca glu A 55 2bjdA_45Y_57V}P -8.425 5.6873 -11.3261 { n val A 56 2bjdA_45Y_57V}P -8.7685 5.6026 -8.9515 { ca val A 56 2bjdA_45Y_57V}P -8.7558 5.023 -7.6381 { n val A 57 2bjdA_45Y_57V}P -10.6007 3.7656 -6.6838 { ca val A 57 2bjdA_45Y_57V}P -11.8368 3.5815 -5.9185 { n ala A 58 2bjdA_45Y_57V}P -11.8708 3.6997 -3.5396 { ca ala A 58 2bjdA_45Y_57V}P -11.4145 3.4172 -2.2124 { n glu A 59 2bjdA_45Y_57V}P -12.5794 2.4942 -0.3317 { ca glu A 59 2bjdA_45Y_57V}P -13.554 2.4631 0.746 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 43 2bjdA_45Y_57V}P -9.8627 -1.3047 0.366 {"}-9.8627 -1.3047 0.366 { ca gly A 44 2bjdA_45Y_57V}-10.4654 -0.8046 -3.3317 { ca tyr A 45 2bjdA_45Y_57V}-8.1863 -0.4351 -6.3076 { ca ala A 46 2bjdA_45Y_57V}-5.8822 1.7064 -8.3278 {"}P -5.8822 1.7064 -8.3278 { ca glu A 55 2bjdA_45Y_57V}P -8.425 5.6873 -11.3261 {"}-8.425 5.6873 -11.3261 {"}-8.425 5.6873 -11.3261 { ca val A 56 2bjdA_45Y_57V}-8.7558 5.023 -7.6381 { ca val A 57 2bjdA_45Y_57V}-11.8368 3.5815 -5.9185 { ca ala A 58 2bjdA_45Y_57V}-11.4145 3.4172 -2.2124 { ca glu A 59 2bjdA_45Y_57V}-13.554 2.4631 0.746 @subgroup {sidechain} off @vectorlist {sc} color= green alpha= 0.2353 master= {sidechain} { ca tyr A 45 2bjdA_45Y_57V}P -8.1863 -0.4351 -6.3076 { ca val A 57 2bjdA_45Y_57V}P -11.8368 3.5815 -5.9185 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 45 A}'S' sky -12.1421 0.1409 -6.8747 {"}'S' sky -12.2832 0.2219 -7.081 {"}'S' sky -11.8766 0.2294 -6.773 {"}'S' sky -11.4433 0.5063 -6.8796 {"}'S' sky -11.3184 0.709 -7.1328 {"}'S' blue -11.1807 0.8368 -7.3805 {"}'S' sky -11.3231 0.9027 -7.5834 { CE2 TYR 45 A}'S' sky -13.0604 1.0563 -7.9663 {"}'S' blue -13.2182 1.0563 -8.1699 {"}'S' blue -13.3789 0.992 -8.3596 {"}'S' sky -13.1761 1.2005 -8.4256 {"}'S' sky -13.3347 1.1098 -8.6063 {"}'S' blue -13.4853 0.9703 -8.7615 {"}'S' sky -13.263 1.1948 -8.8541 {"}'S' sky -12.1028 1.4705 -8.1806 { CZ TYR 45 A}'S' sky -13.0998 1.4178 -9.0322 {"}'S' blue -13.2518 1.2577 -9.183 {"}'S' sky -13.1282 1.5678 -9.2677 {"}'S' blue -11.6218 1.866 -8.567 {"}'S' 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{"}'S' green -12.2241 2.1635 -9.0702 {"}'S' green -12.3771 2.1977 -9.2786 {"}'S' sea -12.5381 2.1827 -9.4816 {"}'S' sea -11.7195 2.0299 -8.7396 {"}'S' green -11.837 2.159 -8.9281 {"}'S' green -11.9725 2.2492 -9.1269 {"}'S' green -12.1204 2.299 -9.3319 {"}'S' sea -12.2763 2.3046 -9.536 {"}'S' sea -11.5714 2.1838 -8.9808 {"}'S' green -11.6994 2.2868 -9.1758 {"}'S' green -11.8418 2.3527 -9.3786 {"}'S' sea -11.9937 2.3798 -9.5822 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 45 A}'S' P -12.4346 0.6579 -7.3156 {"}'S' -12.4315 0.65 -7.3301 {"}'S' P -12.5 0.861 -7.4583 {"}'S' -12.4901 0.8307 -7.4993 {"}'S' P -12.5967 1.0282 -7.6286 {"}'S' -12.5878 1.0055 -7.6522 {"}'S' P -12.1946 0.7743 -7.356 {"}'S' -12.1924 0.7473 -7.3998 {"}'S' P -12.2665 0.9743 -7.505 {"}'S' -12.261 0.923 -7.566 {"}'S' P -12.3654 1.14 -7.6797 {"}'S' -12.359 1.0991 -7.7162 {"}'S' P -11.9503 0.8549 -7.4216 {"}'S' -11.9539 0.8371 -7.4481 {"}'S' P -12.0252 1.0498 -7.5718 {"}'S' -12.0289 1.0136 -7.6114 {"}'S' P -12.1229 1.2136 -7.7444 {"}'S' -12.1237 1.1891 -7.7639 { CZ TYR 45 A}'S' P -12.5142 1.8061 -8.758 {"}'S' -12.507 1.7961 -8.768 {"}'S' P -12.657 1.8726 -8.9615 {"}'S' -12.6505 1.8633 -8.9676 {"}'S' P -12.3149 1.9664 -8.8161 {"}'S' -12.3098 1.9545 -8.8251 {"}'S' P -12.4572 2.0368 -9.018 {"}'S' -12.45 2.0243 -9.0259 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 45 A}'S' sky -13.581 1.6179 -9.6245 {"}'S' blue -13.6808 1.7796 -9.7978 {"}'S' blue -13.3872 1.4519 -9.4448 {"}'S' sky -13.5778 2.0121 -9.8468 {"}'S' sky -13.296 2.1379 -9.7092 {"}'S' blue -13.4338 2.2173 -9.9088 {"}'S' sky -13.1095 2.309 -9.7736 {"}'S' blue -13.2487 2.3873 -9.9748 {"}'S' sky -12.8737 2.4121 -9.8131 {"}'S' sky -12.5298 2.3432 -9.7135 {"}'S' blue -12.6377 2.4851 -9.8935 {"}'S' blue -12.345 2.4474 -9.9035 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 45 A}'S' sea -13.3734 1.7078 -9.498 {"}'S' sea -13.4434 1.9123 -9.6455 {"}'S' sea -13.141 1.767 -9.4041 {"}'S' sea -13.1943 1.9825 -9.533 {"}'S' sea -12.9215 1.9762 -9.4372 {"}'S' sea -12.9986 2.1684 -9.5899 {"}'S' sea -12.7621 2.2672 -9.6292 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 57 A}'S' blue -13.2091 1.4106 -7.8283 {"}'S' sky -13.1163 1.2408 -7.6609 { CG2 VAL 57 A}'S' sky -13.2072 1.4183 -8.1231 {"}'S' sky -13.0478 1.4176 -7.9153 {"}'S' blue -13.4562 2.4837 -9.5457 {"}'S' sky -13.2032 2.5915 -9.6072 {"}'S' sky -12.1636 1.7528 -8.0291 {"}'S' blue -12.9453 2.7001 -9.6214 {"}'S' sky -12.6817 2.5545 -9.5098 { HB VAL 57 A}'S' sky -12.2843 0.4701 -6.7768 {"}'S' sky -11.8048 0.6087 -6.606 {"}'S' sky -11.548 0.7821 -6.6893 {"}'S' sky -11.4724 0.8778 -6.9257 {HG21 VAL 57 A}'S' blue -13.6839 1.3521 -8.6878 {"}'S' sky -13.5257 1.3699 -8.4893 {"}'S' sky -13.368 1.4459 -8.3065 {"}'S' blue -13.8905 1.9387 -9.4868 {"}'S' blue -13.8261 1.7298 -9.3442 {"}'S' blue -13.5875 1.4762 -8.9654 {"}'S' sky -13.4317 1.4519 -8.7572 {"}'S' sky -13.2684 1.5009 -8.5606 {"}'S' blue -13.6433 2.292 -9.5714 {"}'S' sky -13.6429 2.0479 -9.5032 {"}'S' sky -13.5879 1.8366 -9.3745 {"}'S' sky -13.4853 1.6839 -9.1994 {"}'S' sky -13.3481 1.6089 -9 {"}'S' sky -13.1918 1.6196 -8.8007 {HG23 VAL 57 A}'S' sky -12.5227 2.6313 -9.5287 {"}'S' blue -11.7574 2.2321 -8.4292 {"}'S' blue -12.2799 2.7249 -9.6096 {"}'S' sky -11.7198 2.693 -9.4143 {"}'S' sky -11.5864 2.5902 -9.2136 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 57 A}'S' sea -12.9007 1.3244 -7.7956 {"}'S' sea -12.6655 1.4088 -7.8727 {"}'S' sea -12.4264 1.5106 -7.911 { CG2 VAL 57 A}'S' sea -13.1027 1.4756 -8.4171 {"}'S' green -12.9504 1.4479 -8.2129 {"}'S' sea -12.7928 1.4596 -8.0121 {"}'S' sea -13.159 1.7229 -8.9504 {"}'S' sea -13.032 1.6142 -8.7555 {"}'S' green -12.8901 1.5461 -8.5527 {"}'S' green -12.7373 1.5192 -8.3481 {"}'S' green -12.5783 1.536 -8.1465 {"}'S' sea -13.1761 2.3536 -9.5056 {"}'S' sea -13.1185 2.139 -9.3712 {"}'S' sea -13.0333 1.9534 -9.2088 {"}'S' green -12.9226 1.8055 -9.0255 {"}'S' green -12.7913 1.7002 -8.8272 {"}'S' green -12.6449 1.6414 -8.6205 {"}'S' green -12.4871 1.6298 -8.4141 {"}'S' sea -12.325 1.6677 -8.2149 {"}'S' sea -12.9285 2.4586 -9.533 {"}'S' sea -12.877 2.24 -9.4058 {"}'S' green -12.7942 2.0552 -9.247 {"}'S' green -12.2427 1.7855 -8.4591 {"}'S' sea -12.0815 1.852 -8.2693 {"}'S' sea -12.6336 2.3337 -9.3868 {"}'S' green -12.5474 2.1521 -9.2258 {"}'S' green -12.1298 1.953 -8.6301 {"}'S' sea -11.9687 2.0153 -8.4395 { HB VAL 57 A}'S' green -12.8334 1.0961 -7.6599 {"}'S' green -12.777 0.8844 -7.5295 {"}'S' green -12.6894 0.7082 -7.366 {"}'S' green -12.5732 0.5765 -7.1806 {"}'S' green -12.6046 1.2355 -7.8131 {"}'S' green -12.268 0.558 -7.1899 {"}'S' green -12.1207 0.5149 -6.9873 {"}'S' sea -11.963 0.5319 -6.7893 {"}'S' green -12.3467 1.3438 -7.8783 {"}'S' green -12.0243 0.639 -7.2649 {"}'S' green -11.8685 0.6148 -7.0567 {"}'S' sea -11.7052 0.6637 -6.8601 {"}'S' green -12.0801 1.4549 -7.8709 {"}'S' green -11.7849 0.7717 -7.2995 {"}'S' green -11.6286 0.7825 -7.1003 {"}'S' green -11.835 1.2781 -7.7365 {"}'S' green -11.7672 1.0696 -7.5911 {"}'S' green -11.6338 0.9669 -7.3904 {"}'S' sea -11.4702 0.9955 -7.1871 {HG21 VAL 57 A}'S' sea -13.3982 2.1152 -9.437 {"}'S' sea -13.3304 1.9068 -9.2916 {"}'S' sea -13.197 1.804 -9.0909 {HG23 VAL 57 A}'S' sea -12.4516 2.4349 -9.3833 {"}'S' green -12.3491 2.2821 -9.2082 {"}'S' sea -11.9152 2.1561 -8.6121 {"}'S' sea -12.2155 2.516 -9.4669 {"}'S' green -12.1118 2.3572 -9.289 {"}'S' green -11.9769 2.2624 -9.0881 {"}'S' green -11.8211 2.2381 -8.8799 {"}'S' sea -11.6579 2.2871 -8.6833 {"}'S' sea -11.9773 2.6229 -9.4973 {"}'S' green -11.8747 2.4701 -9.3222 {"}'S' green -11.7375 2.3951 -9.1227 {"}'S' sea -11.5812 2.4058 -8.9235 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 VAL 57 A}'S' P -12.6842 1.9116 -9.0639 {"}'S' -12.6853 1.9141 -9.0626 {"}'S' P -12.5514 1.8156 -8.8657 {"}'S' -12.5588 1.8321 -8.8556 {"}'S' P -12.4012 1.7736 -8.661 {"}'S' -12.4028 1.7753 -8.6601 {"}'S' P -12.4294 2.0238 -9.0369 {"}'S' -12.4363 2.0329 -9.0279 {"}'S' P -12.287 1.9551 -8.8335 {"}'S' -12.2944 1.9645 -8.8269 { HB VAL 57 A}'S' P -12.5701 1.0079 -7.7055 {"}'S' -12.5622 1.0277 -7.6753 {"}'S' P -12.499 0.8115 -7.5601 {"}'S' -12.492 0.8503 -7.5217 {"}'S' P -12.3964 0.6588 -7.385 {"}'S' -12.3947 0.6859 -7.3666 {"}'S' P -12.3273 1.1015 -7.7863 {"}'S' -12.3284 1.1253 -7.7402 {"}'S' P -12.2629 0.8926 -7.6437 {"}'S' -12.268 0.943 -7.5837 {"}'S' P -12.1592 0.7339 -7.4658 {"}'S' -12.1679 0.779 -7.4299 {"}'S' P -12.0797 1.2108 -7.8027 {"}'S' -12.0836 1.2177 -7.7857 {"}'S' P -12.0247 0.9995 -7.674 {"}'S' -12.0395 1.0289 -7.631 {"}'S' P -11.9221 0.8467 -7.499 {"}'S' -11.9336 0.8689 -7.4787 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 45 A}'M' green -9.5335 2.1833 -6.3526 {"}'M' green -9.2913 2.5789 -6.1493 {"}'M' green -9.6001 2.0762 -6.5985 {"}'M' green -9.6149 1.9208 -6.8328 {"}'M' green -9.1152 2.9399 -6.4713 {"}'M' green -9.5639 2.0023 -7.1064 {"}'M' green -9.0344 3.036 -6.7091 {"}'M' green -9.4064 2.3098 -7.3526 {"}'M' green -9.0794 2.9387 -7.1056 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 45 A}'M' greentint -9.4399 2.422 -6.2978 {"}'M' greentint -9.5436 2.3257 -6.5953 {"}'M' greentint -9.3006 2.7159 -6.3899 {"}'M' greentint -9.4398 2.5479 -6.5231 {"}'M' greentint -9.5132 2.4197 -6.8401 {"}'M' greentint -9.5843 2.1746 -6.8643 {"}'M' greentint -9.27 2.8169 -6.636 {"}'M' greentint -9.4057 2.6393 -6.7622 {"}'M' greentint -9.4353 2.4999 -7.0783 {"}'M' greentint -9.5165 2.2567 -7.1167 {"}'M' greentint -9.1866 2.9 -6.8691 {"}'M' greentint -9.3232 2.7185 -6.9939 {"}'M' greentint -9.3208 2.5446 -7.308 {"}'M' greentint -9.2102 2.7567 -7.2241 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H VAL 57 A}'M' green -9.6272 2.122 -6.4512 {"}'M' green -9.3889 2.5123 -6.2504 {"}'M' green -9.3154 2.7521 -6.2235 {"}'M' green -9.159 2.9087 -6.4642 {"}'M' green -9.6332 2.1059 -7.1973 {"}'M' green -9.5222 2.2894 -7.3678 {"}'M' green -9.102 2.9572 -7.0109 {"}'M' green -9.3887 2.5072 -7.4213 {"}'M' green -9.1738 2.8574 -7.2417 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 57 A}'M' greentint -9.4941 2.2976 -6.3282 {"}'M' greentint -9.5662 2.071 -6.7578 {"}'M' greentint -9.4167 2.2164 -6.6054 {"}'M' greentint -9.2921 2.4164 -6.4996 {"}'M' greentint -9.2035 2.654 -6.4515 {"}'M' greentint -9.4708 2.1508 -6.9994 {"}'M' greentint -9.3166 2.2834 -6.8377 {"}'M' greentint -9.1924 2.4868 -6.7331 {"}'M' greentint -9.1141 2.7324 -6.7009 {"}'M' greentint -9.0931 2.9879 -6.7442 {"}'M' greentint -9.3612 2.3174 -7.1678 {"}'M' greentint -9.2131 2.4694 -7.0189 {"}'M' greentint -9.1183 2.7035 -6.9616 {"}'M' greentint -9.2287 2.6041 -7.2419 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 45 A}'M' greentint -10.3363 0.8917 -4.6532 {"}'M' greentint -10.4696 0.7881 -4.8527 {"}'M' greentint -10.1504 0.9831 -4.4952 {"}'M' greentint -10.2546 1.1383 -4.673 {"}'M' greentint -10.4146 1.0413 -4.8525 {"}'M' greentint -10.525 0.942 -5.1327 {"}'M' greentint -9.9228 1.0491 -4.3853 {"}'M' greentint -9.9894 1.2544 -4.5284 {"}'M' greentint -10.1211 1.3561 -4.7266 {"}'M' greentint -10.2821 1.328 -4.9266 {"}'M' greentint -10.4302 1.1761 -5.0754 {"}'M' greentint -10.4967 1.0394 -5.3863 {"}'M' greentint -9.7047 1.2566 -4.4235 {"}'M' greentint -9.7978 1.4311 -4.5923 {"}'M' greentint -9.9327 1.526 -4.7932 {"}'M' greentint -10.0916 1.5291 -4.9991 {"}'M' greentint -10.2519 1.4381 -5.182 {"}'M' greentint -10.3933 1.2675 -5.3175 {"}'M' greentint -9.4628 1.3443 -4.4785 {"}'M' greentint -9.556 1.5161 -4.6468 {"}'M' greentint -9.6842 1.6252 -4.8436 {"}'M' greentint -9.8359 1.6607 -5.0487 {"}'M' greentint -9.9972 1.6215 -5.2466 {"}'M' greentint -10.1538 1.5095 -5.418 {"}'M' greentint -10.2924 1.3347 -5.5487 {"}'M' greentint -9.4134 1.6458 -4.8986 {"}'M' greentint -9.5534 1.7109 -5.0979 {"}'M' greentint -9.7077 1.7116 -5.297 {"}'M' greentint -9.8659 1.6479 -5.4833 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 57 A}'M' greentint -10.4427 0.7771 -4.9331 {"}'M' greentint -10.2916 0.7512 -4.7309 {"}'M' greentint -10.1337 0.7751 -4.5342 {"}'M' greentint -10.4588 1.0396 -5.391 {"}'M' greentint -10.3342 0.9214 -5.1972 {"}'M' greentint -10.188 0.8581 -4.9913 {"}'M' greentint -10.0308 0.8535 -4.7857 {"}'M' greentint -9.8682 0.9092 -4.5916 {"}'M' greentint -9.7104 1.0195 -4.4181 {"}'M' greentint -10.23 1.1484 -5.4432 {"}'M' greentint -10.1044 1.036 -5.2493 {"}'M' greentint -9.9564 0.9889 -5.0448 {"}'M' greentint -9.7973 1.0114 -4.8443 {"}'M' greentint -9.6375 1.0999 -4.6633 {"}'M' greentint -9.4908 1.2495 -4.5157 {"}'M' greentint -10.0796 1.4016 -5.5773 {"}'M' greentint -9.9762 1.2477 -5.4008 {"}'M' greentint -9.8378 1.1708 -5.1993 {"}'M' greentint -9.679 1.1819 -4.9984 {"}'M' greentint -9.522 1.2777 -4.8211 {"}'M' greentint -9.3835 1.4483 -4.6895 {"}'M' greentint -9.8365 1.4823 -5.4753 {"}'M' greentint -9.7035 1.3787 -5.2751 {"}'M' greentint -9.5404 1.4079 -5.0724 {"}'M' greentint -9.3906 1.5616 -4.9216 {"}'M' greentint -9.5908 1.6085 -5.3103 {"}'M' greentint -9.4321 1.7059 -5.1327 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 133 2bjqA_135Y_144}P -10.7095 -1.1367 1.6413 {"}-10.7095 -1.1367 1.6413 { ca leu A 133 2bjqA_135Y_144}-9.8651 -1.5958 0.5283 { c leu A 133 2bjqA_135Y_144}-10.5818 -1.4952 -0.8297 { o leu A 133 2bjqA_135Y_144}-11.636 -2.0939 -1.0129 { c leu A 133 2bjqA_135Y_144}P -10.5818 -1.4952 -0.8297 { n gly A 134 2bjqA_135Y_144}-9.9955 -0.741 -1.7555 { ca gly A 134 2bjqA_135Y_144}-10.4315 -0.7366 -3.1762 { c gly A 134 2bjqA_135Y_144}-9.2448 -0.9861 -4.1066 { o gly A 134 2bjqA_135Y_144}-8.3825 -1.8593 -3.8447 { c gly A 134 2bjqA_135Y_144}P -9.2448 -0.9861 -4.1066 { n tyr A 135 2bjqA_135Y_144}-9.1894 -0.2592 -5.2239 { ca tyr A 135 2bjqA_135Y_144}-8.0989 -0.4892 -6.1724 { c tyr A 135 2bjqA_135Y_144}-7.6159 0.7787 -6.868 { o tyr A 135 2bjqA_135Y_144}-8.3611 1.7637 -6.9733 { c tyr A 135 2bjqA_135Y_144}P -7.6159 0.7787 -6.868 { n ile A 136 2bjqA_135Y_144}-6.3613 0.7314 -7.3195 { ca ile A 136 2bjqA_135Y_144}-5.8416 1.6836 -8.3047 { c ile A 136 2bjqA_135Y_144}-5.8471 1.0145 -9.6804 { o ile A 136 2bjqA_135Y_144}-5.277 -0.0728 -9.8577 { c ile A 136 2bjqA_135Y_144}P -5.8471 1.0145 -9.6804 { n asp A 137 2bjqA_135Y_144}-6.5191 1.6638 -10.6496 { ca asp A 137 2bjqA_135Y_144}-6.3522 1.3331 -12.0514 { c asp A 137 2bjqA_135Y_144}-5.0689 2.0803 -12.4315 { o asp A 137 2bjqA_135Y_144}-5.0644 3.3254 -12.5198 { n val A 142 2bjqA_135Y_144}P -6.2785 6.2393 -11.3071 {"}-6.2785 6.2393 -11.3071 { ca val A 142 2bjqA_135Y_144}-7.4584 6.6132 -10.5289 { c val A 142 2bjqA_135Y_144}-7.644 5.4944 -9.5089 { o val A 142 2bjqA_135Y_144}-7.5427 4.3165 -9.8722 { c val A 142 2bjqA_135Y_144}P -7.644 5.4944 -9.5089 { n ala A 143 2bjqA_135Y_144}-7.8643 5.8777 -8.2518 { ca ala A 143 2bjqA_135Y_144}-8.2342 4.9391 -7.164 { c ala A 143 2bjqA_135Y_144}-9.7349 5.0131 -6.9063 { o ala A 143 2bjqA_135Y_144}-10.3055 6.1119 -6.8246 { c ala A 143 2bjqA_135Y_144}P -9.7349 5.0131 -6.9063 { n ala A 144 2bjqA_135Y_144}-10.3523 3.8553 -6.693 { ca ala A 144 2bjqA_135Y_144}-11.7905 3.7968 -6.4034 { c ala A 144 2bjqA_135Y_144}-12.13 2.7372 -5.3489 { o ala A 144 2bjqA_135Y_144}-11.4607 1.7099 -5.2694 { c ala A 144 2bjqA_135Y_144}P -12.13 2.7372 -5.3489 { n val A 145 2bjqA_135Y_144}-13.1938 2.9929 -4.5765 { ca val A 145 2bjqA_135Y_144}-13.7096 2.0299 -3.6058 { c val A 145 2bjqA_135Y_144}-15.2298 2.1762 -3.5057 { o val A 145 2bjqA_135Y_144}-15.7507 3.2609 -3.7236 { c val A 145 2bjqA_135Y_144}P -15.2298 2.1762 -3.5057 { n gly A 146 2bjqA_135Y_144}-15.9249 1.0808 -3.1838 { ca gly A 146 2bjqA_135Y_144}-17.3751 1.1086 -2.9917 { c gly A 146 2bjqA_135Y_144}-17.7727 1.0542 -1.5251 { o gly A 146 2bjqA_135Y_144}-17.1376 0.3498 -0.7202 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 133 2bjqA_135Y_144}P -10.7095 -1.1367 1.6413 { ca leu A 133 2bjqA_135Y_144}P -9.8651 -1.5958 0.5283 { n gly A 134 2bjqA_135Y_144}P -9.9955 -0.741 -1.7555 { ca gly A 134 2bjqA_135Y_144}P -10.4315 -0.7366 -3.1762 {"}P -10.4315 -0.7366 -3.1762 { n tyr A 135 2bjqA_135Y_144}P -9.1894 -0.2592 -5.2239 { ca tyr A 135 2bjqA_135Y_144}P -8.0989 -0.4892 -6.1724 { n ile A 136 2bjqA_135Y_144}P -6.3613 0.7314 -7.3195 { ca ile A 136 2bjqA_135Y_144}P -5.8416 1.6836 -8.3047 { n asp A 137 2bjqA_135Y_144}P -6.5191 1.6638 -10.6496 { ca asp A 137 2bjqA_135Y_144}P -6.3522 1.3331 -12.0514 { n val A 142 2bjqA_135Y_144}P -6.2785 6.2393 -11.3071 { ca val A 142 2bjqA_135Y_144}P -7.4584 6.6132 -10.5289 { n ala A 143 2bjqA_135Y_144}P -7.8643 5.8777 -8.2518 { ca ala A 143 2bjqA_135Y_144}P -8.2342 4.9391 -7.164 { n ala A 144 2bjqA_135Y_144}P -10.3523 3.8553 -6.693 { ca ala A 144 2bjqA_135Y_144}P -11.7905 3.7968 -6.4034 { n val A 145 2bjqA_135Y_144}P -13.1938 2.9929 -4.5765 { ca val A 145 2bjqA_135Y_144}P -13.7096 2.0299 -3.6058 { n gly A 146 2bjqA_135Y_144}P -15.9249 1.0808 -3.1838 { ca gly A 146 2bjqA_135Y_144}P -17.3751 1.1086 -2.9917 {"}P -17.3751 1.1086 -2.9917 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 133 2bjqA_135Y_144}P -9.8651 -1.5958 0.5283 {"}-9.8651 -1.5958 0.5283 { ca gly A 134 2bjqA_135Y_144}-10.4315 -0.7366 -3.1762 { ca tyr A 135 2bjqA_135Y_144}-8.0989 -0.4892 -6.1724 { ca ile A 136 2bjqA_135Y_144}-5.8416 1.6836 -8.3047 { ca asp A 137 2bjqA_135Y_144}-6.3522 1.3331 -12.0514 { ca val A 142 2bjqA_135Y_144}P -7.4584 6.6132 -10.5289 {"}-7.4584 6.6132 -10.5289 { ca ala A 143 2bjqA_135Y_144}-8.2342 4.9391 -7.164 { ca ala A 144 2bjqA_135Y_144}-11.7905 3.7968 -6.4034 { ca val A 145 2bjqA_135Y_144}-13.7096 2.0299 -3.6058 { ca gly A 146 2bjqA_135Y_144}-17.3751 1.1086 -2.9917 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 135 2bjqA_135Y_144}P -8.0989 -0.4892 -6.1724 { cb tyr A 135 2bjqA_135Y_144}-8.4764 -1.559 -7.2183 { cg tyr A 135 2bjqA_135Y_144}-9.2705 -1.0734 -8.4213 { cd1 tyr A 135 2bjqA_135Y_144}-8.7954 -1.2769 -9.7317 { ce1 tyr A 135 2bjqA_135Y_144}-9.5639 -0.8345 -10.8539 { cz tyr A 135 2bjqA_135Y_144}-10.7883 -0.2006 -10.6352 { oh tyr A 135 2bjqA_135Y_144}-11.5638 0.2312 -11.6929 { cg tyr A 135 2bjqA_135Y_144}P -9.2705 -1.0734 -8.4213 { cd2 tyr A 135 2bjqA_135Y_144}-10.5117 -0.4342 -8.249 { ce2 tyr A 135 2bjqA_135Y_144}-11.2727 -0.0009 -9.3503 { cz tyr A 135 2bjqA_135Y_144}ghost -10.7883 -0.2006 -10.6352 { ca ala A 144 2bjqA_135Y_144}P -11.7905 3.7968 -6.4034 { cb ala A 144 2bjqA_135Y_144}-12.5825 3.5447 -7.6811 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 135 2bjqA_135Y_144}P -8.4764 -1.559 -7.2183 {"}P -8.4764 -1.559 -7.2183 { cd1 tyr A 135 2bjqA_135Y_144}P -8.7954 -1.2769 -9.7317 { cd2 tyr A 135 2bjqA_135Y_144}P -10.5117 -0.4342 -8.249 { ce1 tyr A 135 2bjqA_135Y_144}P -9.5639 -0.8345 -10.8539 { ce2 tyr A 135 2bjqA_135Y_144}P -11.2727 -0.0009 -9.3503 { oh tyr A 135 2bjqA_135Y_144}P -11.5638 0.2312 -11.6929 { cb ala A 144 2bjqA_135Y_144}P -12.5825 3.5447 -7.6811 {"}P -12.5825 3.5447 -7.6811 {"}P -12.5825 3.5447 -7.6811 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 135 A}'S' sky -12.0475 1.1385 -8.2719 {"}'S' sky -12.1904 1.205 -8.4755 {"}'S' sky -11.7267 1.1769 -8.1378 {"}'S' sky -11.4953 1.2887 -8.1888 {"}'S' sky -11.3704 1.4914 -8.442 {"}'S' blue -11.97 1.6008 -9.2472 {"}'S' blue -11.2327 1.6192 -8.6897 {"}'S' sky -11.3751 1.6851 -8.8926 {"}'S' sky -11.527 1.7123 -9.0962 { HE2 TYR 135 A}'S' sky -12.4847 1.1983 -8.5294 {"}'S' sky -12.6196 1.2932 -8.7303 {"}'S' sky -12.5227 1.4279 -8.9858 {"}'S' sky -12.2403 1.4781 -9.0349 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 135 A}'S' sea -11.8482 1.2989 -8.33 {"}'S' green -11.9905 1.3693 -8.532 {"}'S' sea -12.1448 1.3869 -8.7367 {"}'S' sea -11.6175 1.415 -8.3813 {"}'S' green -11.7574 1.4959 -8.5841 {"}'S' green -11.9104 1.5301 -8.7925 {"}'S' sea -12.0715 1.5152 -8.9956 {"}'S' sea -11.5058 1.5816 -8.6409 {"}'S' sea -11.6537 1.6314 -8.8459 {"}'S' sea -11.8096 1.637 -9.0499 { HE2 TYR 135 A}'S' sea -12.2429 1.2833 -8.5839 {"}'S' sea -12.3711 1.3924 -8.7806 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 144 A}'S' blue -12.7441 1.5741 -8.4587 {"}'S' sky -12.6148 1.6594 -8.7458 {"}'S' sky -12.3621 1.4463 -8.3603 {"}'S' sky -12.2097 1.4213 -8.1565 {"}'S' sky -12.4245 1.7627 -8.9398 {"}'S' blue -11.7303 1.5599 -7.9857 {"}'S' sky -12.1883 1.8437 -9.0234 {"}'S' sky -11.9501 1.9506 -9.0538 {"}'S' blue -11.3979 1.829 -8.3055 {"}'S' sky -11.6926 2.0207 -8.9708 {"}'S' sky -11.5592 1.918 -8.7701 {"}'S' blue -11.3957 1.9466 -8.5668 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 144 A}'S' sea -12.4986 1.5276 -8.5603 {"}'S' sea -12.3219 1.6099 -8.7647 {"}'S' sea -12.1934 1.5091 -8.5696 {"}'S' sea -12.0462 1.4661 -8.367 {"}'S' sea -11.888 1.4839 -8.1686 {"}'S' sea -12.0846 1.685 -8.8455 {"}'S' green -11.9497 1.5902 -8.6446 {"}'S' green -11.7939 1.5659 -8.4364 {"}'S' sea -11.6307 1.6149 -8.2398 {"}'S' sea -11.8475 1.7979 -8.8787 {"}'S' sea -11.7103 1.7228 -8.6792 {"}'S' sea -11.554 1.7336 -8.48 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 135 A}'M' greentint -9.5332 2.1562 -6.3169 {"}'M' greentint -9.6768 2.0484 -6.5894 {"}'M' greentint -9.2713 2.4774 -6.1843 {"}'M' greentint -9.4345 2.4441 -6.3862 {"}'M' greentint -9.5832 2.2871 -6.5346 {"}'M' greentint -9.6869 2.1908 -6.8321 {"}'M' greentint -9.1274 2.6826 -6.2463 {"}'M' greentint -9.2853 2.6742 -6.4483 {"}'M' greentint -9.4439 2.581 -6.6267 {"}'M' greentint -9.5831 2.4131 -6.7599 {"}'M' greentint -9.6565 2.2848 -7.0769 {"}'M' greentint -9.0983 2.8633 -6.5162 {"}'M' greentint -9.2585 2.8051 -6.7082 {"}'M' greentint -9.4133 2.682 -6.8728 {"}'M' greentint -9.549 2.5045 -6.999 {"}'M' greentint -9.5786 2.365 -7.3152 {"}'M' greentint -9.0156 2.9833 -6.7603 {"}'M' greentint -9.1776 2.9011 -6.9459 {"}'M' greentint -9.3299 2.7652 -7.1059 {"}'M' greentint -9.4665 2.5836 -7.2307 {"}'M' greentint -9.0766 2.9474 -7.1926 {"}'M' greentint -9.2227 2.8038 -7.3425 {"}'M' greentint -9.3535 2.6218 -7.4609 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 144 A}'M' greentint -9.5878 2.0412 -6.4883 {"}'M' greentint -9.4376 2.1656 -6.3285 {"}'M' greentint -9.3044 2.3412 -6.2054 {"}'M' greentint -9.6954 2.0365 -7.0256 {"}'M' greentint -9.5372 2.0387 -6.8219 {"}'M' greentint -9.3766 2.1147 -6.635 {"}'M' greentint -9.227 2.26 -6.4826 {"}'M' greentint -9.1025 2.46 -6.3768 {"}'M' greentint -9.0139 2.6976 -6.3287 {"}'M' greentint -9.5923 2.1991 -7.2807 {"}'M' greentint -9.4435 2.1495 -7.0746 {"}'M' greentint -9.2812 2.1944 -6.8766 {"}'M' greentint -9.127 2.327 -6.7149 {"}'M' greentint -9.0027 2.5304 -6.6103 {"}'M' greentint -8.9244 2.776 -6.5782 {"}'M' greentint -9.4643 2.4347 -7.4432 {"}'M' greentint -9.3325 2.333 -7.245 {"}'M' greentint -9.1715 2.361 -7.045 {"}'M' greentint -9.0235 2.513 -6.8962 {"}'M' greentint -8.9287 2.7471 -6.8388 {"}'M' greentint -8.9124 3.0008 -6.8881 {"}'M' greentint -9.199 2.5508 -7.2985 {"}'M' greentint -9.0391 2.6477 -7.1191 {"}'M' greentint -8.9841 2.901 -7.1189 {"}'M' greentint -9.1174 2.7974 -7.3184 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 135 A}'M' green -10.6228 0.6192 -4.8783 {"}'M' green -10.8278 0.4158 -5.3086 {"}'M' green -10.1524 1.3754 -5.7084 {"}'M' green -10.4357 1.0754 -5.9913 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 135 A}'M' greentint -10.7561 0.5156 -5.0778 {"}'M' greentint -10.5411 0.8658 -4.8982 {"}'M' greentint -10.7011 0.7689 -5.0776 {"}'M' greentint -10.8115 0.6695 -5.3579 {"}'M' greentint -10.4076 1.0836 -4.9517 {"}'M' greentint -10.5686 1.0555 -5.1517 {"}'M' greentint -10.7167 0.9036 -5.3005 {"}'M' greentint -10.7832 0.7669 -5.6115 {"}'M' greentint -10.8336 0.5123 -5.6069 {"}'M' greentint -10.2192 1.2535 -5.0183 {"}'M' greentint -10.3781 1.2566 -5.2242 {"}'M' greentint -10.5384 1.1656 -5.4071 {"}'M' greentint -10.6798 0.995 -5.5427 {"}'M' greentint -10.6864 0.8412 -5.8515 {"}'M' greentint -10.1223 1.3882 -5.2738 {"}'M' greentint -10.2837 1.349 -5.4717 {"}'M' greentint -10.4403 1.237 -5.6431 {"}'M' greentint -10.5789 1.0622 -5.7738 {"}'M' greentint -10.3026 1.251 -5.8682 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 144 A}'M' green -10.8272 0.4677 -5.1403 {"}'M' green -10.4132 0.9469 -4.7384 {"}'M' green -10.8825 0.4721 -5.5756 {"}'M' green -10.1956 1.2352 -4.9016 {"}'M' green -10.8081 0.6075 -5.8347 {"}'M' green -10.6895 0.7894 -5.9892 {"}'M' green -10.5552 0.9972 -6.0649 {"}'M' green -10.147 1.4165 -5.654 {"}'M' green -10.2838 1.3244 -5.9225 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 144 A}'M' greentint -10.6754 0.5883 -4.9774 {"}'M' greentint -10.5351 0.7503 -4.8414 {"}'M' greentint -10.7199 0.5278 -5.3814 {"}'M' greentint -10.562 0.638 -5.208 {"}'M' greentint -10.4167 0.7997 -5.065 {"}'M' greentint -10.2921 1.0021 -4.9614 {"}'M' greentint -10.6489 0.6299 -5.6342 {"}'M' greentint -10.4892 0.7185 -5.4532 {"}'M' greentint -10.3425 0.8681 -5.3056 {"}'M' greentint -10.2188 1.0678 -5.2009 {"}'M' greentint -10.1269 1.302 -5.1476 {"}'M' greentint -10.5306 0.8004 -5.7883 {"}'M' greentint -10.3736 0.8963 -5.6109 {"}'M' greentint -10.2352 1.0668 -5.4794 {"}'M' greentint -10.1322 1.2903 -5.4085 {"}'M' greentint -10.392 1.0265 -5.8623 {"}'M' greentint -10.2422 1.1802 -5.7115 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 131 2bjrA_133Y_142}P -10.6173 -0.8297 1.5998 {"}-10.6173 -0.8297 1.5998 { ca leu A 131 2bjrA_133Y_142}-9.7979 -1.4568 0.5884 { c leu A 131 2bjrA_133Y_142}-10.5223 -1.2887 -0.7409 { o leu A 131 2bjrA_133Y_142}-11.7229 -1.5722 -0.8593 { c leu A 131 2bjrA_133Y_142}P -10.5223 -1.2887 -0.7409 { n gly A 132 2bjrA_133Y_142}-9.7937 -0.8098 -1.7306 { ca gly A 132 2bjrA_133Y_142}-10.3214 -0.6306 -3.0858 { c gly A 132 2bjrA_133Y_142}-9.2979 -1.0356 -4.1405 { o gly A 132 2bjrA_133Y_142}-8.4147 -1.8474 -3.8589 { c gly A 132 2bjrA_133Y_142}P -9.2979 -1.0356 -4.1405 { n tyr A 133 2bjrA_133Y_142}-9.3727 -0.4403 -5.3152 { ca tyr A 133 2bjrA_133Y_142}-8.3842 -0.6936 -6.3721 { c tyr A 133 2bjrA_133Y_142}-7.9466 0.5342 -7.0472 { o tyr A 133 2bjrA_133Y_142}-8.7087 1.4949 -7.1768 { c tyr A 133 2bjrA_133Y_142}P -7.9466 0.5342 -7.0472 { n ala A 134 2bjrA_133Y_142}-6.6946 0.4894 -7.4891 { ca ala A 134 2bjrA_133Y_142}-6.1188 1.5434 -8.2893 { c ala A 134 2bjrA_133Y_142}-5.9243 1.0049 -9.7204 { o ala A 134 2bjrA_133Y_142}-5.6102 -0.1712 -9.9267 { c ala A 134 2bjrA_133Y_142}P -5.9243 1.0049 -9.7204 { n asp A 135 2bjrA_133Y_142}-6.1493 1.8804 -10.6773 { ca asp A 135 2bjrA_133Y_142}-5.987 1.5417 -12.1109 { c asp A 135 2bjrA_133Y_142}-4.6302 2.0431 -12.5309 { o asp A 135 2bjrA_133Y_142}-4.299 3.2264 -12.4047 { n ile A 140 2bjrA_133Y_142}P -6.1441 6.3751 -10.8263 {"}-6.1441 6.3751 -10.8263 { ca ile A 140 2bjrA_133Y_142}-7.2842 6.7104 -9.9832 { c ile A 140 2bjrA_133Y_142}-7.5258 5.4994 -9.1023 { o ile A 140 2bjrA_133Y_142}-7.5339 4.3553 -9.5853 { c ile A 140 2bjrA_133Y_142}P -7.5258 5.4994 -9.1023 { n ala A 141 2bjrA_133Y_142}-7.7356 5.7632 -7.8208 { ca ala A 141 2bjrA_133Y_142}-8.1874 4.7656 -6.8554 { c ala A 141 2bjrA_133Y_142}-9.7006 4.8692 -6.5993 { o ala A 141 2bjrA_133Y_142}-10.2457 5.9384 -6.4452 { c ala A 141 2bjrA_133Y_142}P -9.7006 4.8692 -6.5993 { n arg A 142 2bjrA_133Y_142}-10.3609 3.7382 -6.5174 { ca arg A 142 2bjrA_133Y_142}-11.7701 3.6869 -6.311 { c arg A 142 2bjrA_133Y_142}-12.1042 2.7827 -5.1343 { o arg A 142 2bjrA_133Y_142}-11.5414 1.6974 -5.0009 { c arg A 142 2bjrA_133Y_142}P -12.1042 2.7827 -5.1343 { n phe A 143 2bjrA_133Y_142}-13.0634 3.2339 -4.344 { ca phe A 143 2bjrA_133Y_142}-13.4964 2.5503 -3.1272 { c phe A 143 2bjrA_133Y_142}-14.9984 2.4935 -3.0859 { o phe A 143 2bjrA_133Y_142}-15.6627 3.523 -3.2752 { c phe A 143 2bjrA_133Y_142}P -14.9984 2.4935 -3.0859 { n ser A 144 2bjrA_133Y_142}-15.5622 1.316 -2.8545 { ca ser A 144 2bjrA_133Y_142}-17.0108 1.1801 -2.8468 { c ser A 144 2bjrA_133Y_142}-17.5216 1.1125 -1.3951 { o ser A 144 2bjrA_133Y_142}-16.9583 0.3937 -0.5825 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 131 2bjrA_133Y_142}P -10.6173 -0.8297 1.5998 { ca leu A 131 2bjrA_133Y_142}P -9.7979 -1.4568 0.5884 { n gly A 132 2bjrA_133Y_142}P -9.7937 -0.8098 -1.7306 { ca gly A 132 2bjrA_133Y_142}P -10.3214 -0.6306 -3.0858 {"}P -10.3214 -0.6306 -3.0858 { n tyr A 133 2bjrA_133Y_142}P -9.3727 -0.4403 -5.3152 { ca tyr A 133 2bjrA_133Y_142}P -8.3842 -0.6936 -6.3721 { n ala A 134 2bjrA_133Y_142}P -6.6946 0.4894 -7.4891 { ca ala A 134 2bjrA_133Y_142}P -6.1188 1.5434 -8.2893 { n asp A 135 2bjrA_133Y_142}P -6.1493 1.8804 -10.6773 { ca asp A 135 2bjrA_133Y_142}P -5.987 1.5417 -12.1109 { n ile A 140 2bjrA_133Y_142}P -6.1441 6.3751 -10.8263 { ca ile A 140 2bjrA_133Y_142}P -7.2842 6.7104 -9.9832 { n ala A 141 2bjrA_133Y_142}P -7.7356 5.7632 -7.8208 { ca ala A 141 2bjrA_133Y_142}P -8.1874 4.7656 -6.8554 { n arg A 142 2bjrA_133Y_142}P -10.3609 3.7382 -6.5174 { ca arg A 142 2bjrA_133Y_142}P -11.7701 3.6869 -6.311 { n phe A 143 2bjrA_133Y_142}P -13.0634 3.2339 -4.344 { ca phe A 143 2bjrA_133Y_142}P -13.4964 2.5503 -3.1272 { n ser A 144 2bjrA_133Y_142}P -15.5622 1.316 -2.8545 { ca ser A 144 2bjrA_133Y_142}P -17.0108 1.1801 -2.8468 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 131 2bjrA_133Y_142}P -9.7979 -1.4568 0.5884 {"}-9.7979 -1.4568 0.5884 { ca gly A 132 2bjrA_133Y_142}-10.3214 -0.6306 -3.0858 { ca tyr A 133 2bjrA_133Y_142}-8.3842 -0.6936 -6.3721 { ca ala A 134 2bjrA_133Y_142}-6.1188 1.5434 -8.2893 { ca asp A 135 2bjrA_133Y_142}-5.987 1.5417 -12.1109 { ca ile A 140 2bjrA_133Y_142}P -7.2842 6.7104 -9.9832 {"}-7.2842 6.7104 -9.9832 { ca ala A 141 2bjrA_133Y_142}-8.1874 4.7656 -6.8554 { ca arg A 142 2bjrA_133Y_142}-11.7701 3.6869 -6.311 { ca phe A 143 2bjrA_133Y_142}-13.4964 2.5503 -3.1272 { ca ser A 144 2bjrA_133Y_142}-17.0108 1.1801 -2.8468 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 133 2bjrA_133Y_142}P -8.3842 -0.6936 -6.3721 { cb tyr A 133 2bjrA_133Y_142}-8.8404 -1.7398 -7.3891 { cg tyr A 133 2bjrA_133Y_142}-9.7039 -1.229 -8.5338 { cd1 tyr A 133 2bjrA_133Y_142}-9.1368 -0.8996 -9.7683 { ce1 tyr A 133 2bjrA_133Y_142}-9.9166 -0.4037 -10.8415 { cz tyr A 133 2bjrA_133Y_142}-11.2519 -0.2234 -10.6707 { oh tyr A 133 2bjrA_133Y_142}-12.0306 0.2594 -11.7068 { cg tyr A 133 2bjrA_133Y_142}P -9.7039 -1.229 -8.5338 { cd2 tyr A 133 2bjrA_133Y_142}-11.067 -1.0127 -8.3632 { ce2 tyr A 133 2bjrA_133Y_142}-11.856 -0.5044 -9.4449 { cz tyr A 133 2bjrA_133Y_142}ghost -11.2519 -0.2234 -10.6707 { ca arg A 142 2bjrA_133Y_142}P -11.7701 3.6869 -6.311 { cb arg A 142 2bjrA_133Y_142}-12.4479 3.0791 -7.5105 { cg arg A 142 2bjrA_133Y_142}-12.5081 4.0258 -8.6599 { cd arg A 142 2bjrA_133Y_142}-13.1055 3.3291 -9.8608 { ne arg A 142 2bjrA_133Y_142}-13.3838 4.309 -10.9057 { cz arg A 142 2bjrA_133Y_142}-12.5063 4.6982 -11.8099 { nh1 arg A 142 2bjrA_133Y_142}-11.2863 4.206 -11.8125 { cz arg A 142 2bjrA_133Y_142}P -12.5063 4.6982 -11.8099 { nh2 arg A 142 2bjrA_133Y_142}-12.8493 5.6078 -12.7187 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 133 2bjrA_133Y_142}P -8.8404 -1.7398 -7.3891 {"}P -8.8404 -1.7398 -7.3891 { cd1 tyr A 133 2bjrA_133Y_142}P -9.1368 -0.8996 -9.7683 { cd2 tyr A 133 2bjrA_133Y_142}P -11.067 -1.0127 -8.3632 { ce1 tyr A 133 2bjrA_133Y_142}P -9.9166 -0.4037 -10.8415 { ce2 tyr A 133 2bjrA_133Y_142}P -11.856 -0.5044 -9.4449 { oh tyr A 133 2bjrA_133Y_142}P -12.0306 0.2594 -11.7068 { cb arg A 142 2bjrA_133Y_142}P -12.4479 3.0791 -7.5105 {"}P -12.4479 3.0791 -7.5105 { cg arg A 142 2bjrA_133Y_142}P -12.5081 4.0258 -8.6599 {"}P -12.5081 4.0258 -8.6599 { cd arg A 142 2bjrA_133Y_142}P -13.1055 3.3291 -9.8608 {"}P -13.1055 3.3291 -9.8608 { ne arg A 142 2bjrA_133Y_142}P -13.3838 4.309 -10.9057 { nh1 arg A 142 2bjrA_133Y_142}P -11.2863 4.206 -11.8125 {"}P -11.2863 4.206 -11.8125 { nh2 arg A 142 2bjrA_133Y_142}P -12.8493 5.6078 -12.7187 {"}P -12.8493 5.6078 -12.7187 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 133 A}'S' blue -11.448 0.6197 -7.8587 {"}'S' blue -11.6039 0.6253 -8.0628 {"}'S' blue -11.3214 0.7005 -8.1091 { CE2 TYR 133 A}'S' blue -12.4316 0.7954 -8.4246 {"}'S' blue -11.9798 0.6195 -8.1087 {"}'S' sky -12.0787 0.7852 -8.2834 {"}'S' sky -12.2009 0.9115 -8.4759 {"}'S' blue -12.3408 0.9925 -8.6787 {"}'S' blue -11.7385 0.695 -8.1756 {"}'S' sky -12.0892 1.0782 -8.7354 {"}'S' blue -12.2371 1.128 -8.9404 {"}'S' blue -11.4821 0.7061 -8.2378 {"}'S' sky -11.5754 0.8751 -8.4056 {"}'S' sky -11.8161 1.1158 -8.7843 {"}'S' blue -11.9585 1.1816 -8.9872 {"}'S' blue -12.2681 1.1957 -9.3913 {"}'S' blue -12.4289 1.1431 -9.5837 {"}'S' blue -12.5862 1.0534 -9.7628 {"}'S' blue -11.3668 0.9275 -8.5648 {"}'S' sky -11.4855 1.0612 -8.7558 {"}'S' blue -11.6199 1.1596 -8.9568 {"}'S' blue -12.0849 1.2259 -9.5767 {"}'S' sky -12.2488 1.1692 -9.7724 {"}'S' sky -12.4099 1.0755 -9.9541 {"}'S' sky -11.9065 1.2143 -9.7711 { CZ TYR 133 A}'S' sky -12.124 1.1645 -10.0571 {"}'S' sky -12.2853 1.1267 -10.2552 {"}'S' blue -12.4439 1.036 -10.4359 {"}'S' sky -11.7367 1.2735 -9.9046 {"}'S' blue -11.4851 1.3592 -9.9613 {"}'S' blue -11.3544 1.4626 -10.213 {"}'S' blue -11.3192 1.5244 -10.5976 {"}'S' sky -11.4808 1.5069 -10.8025 {"}'S' blue -11.6447 1.4502 -10.9982 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 133 A}'S' sea -11.8362 0.8589 -8.3482 {"}'S' sea -11.9538 0.988 -8.5366 {"}'S' sea -11.6881 1.0128 -8.5893 { CZ TYR 133 A}'S' sea -11.8897 1.3077 -10.113 {"}'S' sea -12.0507 1.2927 -10.316 {"}'S' sea -12.2135 1.2301 -10.5088 {"}'S' sea -11.633 1.409 -10.1663 {"}'S' green -11.7889 1.4145 -10.3704 {"}'S' green -11.9493 1.3783 -10.5677 {"}'S' sea -12.11 1.2999 -10.7523 {"}'S' sea -11.5063 1.4898 -10.4166 {"}'S' sea -11.664 1.4767 -10.6171 {"}'S' sea -11.8248 1.4241 -10.8096 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 133 A}'S' sky -12.4725 1.2699 -10.8446 {"}'S' sky -12.5246 1.5023 -11.2917 {"}'S' sky -12.2759 1.5937 -11.3606 {"}'S' sky -11.8278 1.5338 -11.1633 {"}'S' blue -11.9643 1.6152 -11.3634 { HH TYR 133 A}'S' blue -12.839 1.1306 -10.5788 {"}'S' sky -12.9322 1.3023 -10.7472 {"}'S' sky -13.0604 1.4114 -10.9439 {"}'S' sky -12.5877 1.1314 -10.6542 {"}'S' blue -12.9296 1.4972 -11.1982 {"}'S' sky -12.5979 1.4359 -11.1819 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 133 A}'S' sea -12.2367 1.373 -10.8841 {"}'S' sea -12.3716 1.4664 -11.0848 {"}'S' sea -12.0007 1.446 -10.9645 {"}'S' sea -12.1305 1.5434 -11.1589 { HH TYR 133 A}'S' sea -12.6724 1.3075 -10.8137 {"}'S' sea -12.7897 1.4321 -10.9989 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ARG 142 A}'S' blue -12.383 1.1551 -8.148 {"}'S' blue -12.3414 1.4165 -8.5986 {"}'S' sky -12.2537 1.2404 -8.4351 {"}'S' sky -12.1375 1.1086 -8.2497 {"}'S' sky -12.001 1.0273 -8.0496 {"}'S' blue -11.8486 1.0023 -7.8459 {"}'S' blue -12.1344 1.54 -8.7745 {"}'S' sky -12.0633 1.3437 -8.6292 {"}'S' sky -11.685 1.0471 -8.0564 {"}'S' blue -11.5269 1.0649 -7.8579 {"}'S' sky -11.8272 1.4247 -8.7128 {"}'S' sky -11.5886 1.1711 -8.3339 {"}'S' blue -11.4328 1.1469 -8.1257 {"}'S' blue -11.589 1.5316 -8.7431 {"}'S' blue -11.4864 1.3789 -8.568 {"}'S' blue -11.3492 1.3038 -8.3686 { HD2 ARG 142 A}'S' blue -12.6003 1.5127 -9.7571 {"}'S' blue -12.4418 1.5993 -9.5756 {"}'S' sky -12.9967 1.6889 -10.7492 {"}'S' sky -12.8879 1.5483 -10.5701 {"}'S' blue -12.7572 1.4539 -10.3751 {"}'S' blue -12.6099 1.4122 -10.1728 {"}'S' sky -12.4544 1.4242 -9.9749 {"}'S' sky -12.2957 1.4887 -9.7882 {"}'S' blue -12.1428 1.6048 -9.6227 {"}'S' sky -12.8463 1.8097 -11.0207 {"}'S' sky -12.5059 1.4205 -10.4717 {"}'S' sky -12.0361 1.5117 -9.8898 {"}'S' blue -11.886 1.6475 -9.7344 {"}'S' sky -12.5683 1.7369 -11.0513 {"}'S' sky -11.7237 1.6655 -9.9387 {"}'S' sky -12.3321 1.8179 -11.1349 {"}'S' sky -11.6173 1.7075 -10.1805 {"}'S' blue -12.0939 1.9248 -11.1652 {"}'S' sky -11.9913 1.7721 -10.9901 {"}'S' sky -11.8542 1.697 -10.7907 {"}'S' sky -11.5417 1.8032 -10.4169 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 ARG 142 A}'S' sea -11.9608 1.1909 -8.4541 {"}'S' sea -11.8323 1.0901 -8.2589 {"}'S' sea -11.7235 1.266 -8.5348 { HD2 ARG 142 A}'S' sea -12.7586 1.6336 -10.8572 {"}'S' sea -12.6425 1.5018 -10.6718 {"}'S' sea -12.3535 1.3955 -10.268 {"}'S' sea -12.1941 1.4259 -10.0708 {"}'S' sea -12.4657 1.5841 -10.8762 {"}'S' sea -12.3373 1.4833 -10.681 {"}'S' sea -12.19 1.4403 -10.4785 {"}'S' green -12.0318 1.4581 -10.28 {"}'S' sea -11.8741 1.5341 -10.0972 {"}'S' sea -12.2284 1.6592 -10.9569 {"}'S' sea -12.0935 1.5644 -10.7561 {"}'S' green -11.9378 1.5401 -10.5479 {"}'S' sea -11.7745 1.5891 -10.3513 {"}'S' sea -11.6978 1.7078 -10.5914 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 133 A}'M' greentint -9.7219 1.9761 -6.3389 {"}'M' greentint -9.8808 1.8874 -6.5205 {"}'M' greentint -9.4845 2.1088 -6.1866 {"}'M' greentint -9.6189 2.2086 -6.3878 {"}'M' greentint -9.7821 2.1752 -6.5897 {"}'M' greentint -9.9307 2.0183 -6.7382 {"}'M' greentint -9.3371 2.3344 -6.2502 {"}'M' greentint -9.475 2.4138 -6.4498 {"}'M' greentint -9.6329 2.4054 -6.6518 {"}'M' greentint -9.7915 2.3122 -6.8303 {"}'M' greentint -9.9307 2.1443 -6.9634 {"}'M' greentint -9.1507 2.5055 -6.3146 {"}'M' greentint -9.2898 2.5838 -6.5158 {"}'M' greentint -9.4459 2.5945 -6.7197 {"}'M' greentint -9.6061 2.5363 -6.9117 {"}'M' greentint -9.7609 2.4132 -7.0764 {"}'M' greentint -9.8966 2.2356 -7.2025 {"}'M' greentint -9.0498 2.702 -6.5548 {"}'M' greentint -9.2027 2.7379 -6.7618 {"}'M' greentint -9.3632 2.7145 -6.9638 {"}'M' greentint -9.5252 2.6323 -7.1495 {"}'M' greentint -9.6775 2.4964 -7.3094 {"}'M' greentint -9.8141 2.3148 -7.4342 {"}'M' greentint -9.1092 2.8284 -7.0306 {"}'M' greentint -9.2683 2.7773 -7.2228 {"}'M' greentint -9.4241 2.6786 -7.3961 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 142 A}'M' greentint -9.9325 1.8516 -6.7521 {"}'M' greentint -9.7782 1.8509 -6.5529 {"}'M' greentint -9.62 1.9146 -6.3666 {"}'M' greentint -9.4697 2.0391 -6.2068 {"}'M' greentint -9.869 1.9829 -7.107 {"}'M' greentint -9.7276 1.9099 -6.904 {"}'M' greentint -9.5694 1.9121 -6.7002 {"}'M' greentint -9.4087 1.9881 -6.5134 {"}'M' greentint -9.2592 2.1335 -6.361 {"}'M' greentint -9.1346 2.3334 -6.2551 {"}'M' greentint -9.7405 2.2096 -7.3472 {"}'M' greentint -9.6244 2.0726 -7.159 {"}'M' greentint -9.4757 2.023 -6.9529 {"}'M' greentint -9.3133 2.0679 -6.7549 {"}'M' greentint -9.1591 2.2005 -6.5932 {"}'M' greentint -9.0349 2.4038 -6.4886 {"}'M' greentint -8.9566 2.6495 -6.4565 {"}'M' greentint -9.5631 2.5135 -7.4646 {"}'M' 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2.1807 -6.6812 {"}'M' greentint -8.9123 2.6725 -6.0953 {"}'M' greentint -9.0703 2.6641 -6.2973 {"}'M' greentint -9.2289 2.5709 -6.4758 {"}'M' greentint -9.3681 2.403 -6.6089 {"}'M' greentint -9.4414 2.2747 -6.9259 {"}'M' greentint -9.5126 2.0296 -6.9502 {"}'M' greentint -8.7272 2.8425 -6.1613 {"}'M' greentint -8.8833 2.8532 -6.3652 {"}'M' greentint -9.0435 2.795 -6.5572 {"}'M' greentint -9.1983 2.6719 -6.7219 {"}'M' greentint -9.334 2.4943 -6.848 {"}'M' greentint -9.3635 2.3549 -7.1642 {"}'M' greentint -8.64 2.9966 -6.4073 {"}'M' greentint -8.8001 2.9726 -6.6086 {"}'M' greentint -8.9626 2.891 -6.795 {"}'M' greentint -9.1149 2.7551 -6.9549 {"}'M' greentint -9.2515 2.5735 -7.0797 {"}'M' greentint -8.7057 3.036 -6.8683 {"}'M' greentint -8.8615 2.9373 -7.0416 {"}'M' greentint -9.0077 2.7937 -7.1915 {"}'M' greentint -9.1384 2.6117 -7.3099 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H HIS 150 A}'M' greentint -9.4217 1.958 -6.5755 {"}'M' greentint -9.2635 2.0217 -6.3892 {"}'M' greentint -9.1133 2.1462 -6.2294 {"}'M' greentint -8.9801 2.3218 -6.1063 {"}'M' greentint -8.8749 2.5364 -6.0285 {"}'M' greentint -9.3711 2.017 -6.9265 {"}'M' greentint -9.2129 2.0192 -6.7228 {"}'M' greentint -9.0523 2.0952 -6.5359 {"}'M' greentint -8.9027 2.2406 -6.3835 {"}'M' greentint -8.7782 2.4405 -6.2777 {"}'M' greentint -8.6896 2.6781 -6.2296 {"}'M' greentint -9.268 2.1797 -7.1816 {"}'M' greentint -9.1192 2.1301 -6.9755 {"}'M' greentint -8.9569 2.175 -6.7775 {"}'M' greentint -8.8027 2.3076 -6.6158 {"}'M' greentint -8.6784 2.5109 -6.5112 {"}'M' greentint -8.6001 2.7566 -6.4791 {"}'M' greentint -8.5792 3.012 -6.5224 {"}'M' greentint -9.14 2.4153 -7.3441 {"}'M' greentint -9.0082 2.3135 -7.1459 {"}'M' greentint -8.8472 2.3416 -6.9459 {"}'M' greentint -8.6992 2.4935 -6.7971 {"}'M' greentint -8.6044 2.7277 -6.7397 {"}'M' greentint -8.5881 2.9814 -6.789 {"}'M' greentint -8.9789 2.6865 -7.3773 {"}'M' greentint -8.8747 2.5314 -7.1994 {"}'M' greentint -8.7148 2.6283 -7.02 {"}'M' greentint -8.6598 2.8816 -7.0198 {"}'M' greentint -8.7931 2.7779 -7.2193 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 137 A}'M' greentint -9.7802 1.3496 -4.1326 {"}'M' greentint -9.9134 1.246 -4.3321 {"}'M' greentint -9.6985 1.5962 -4.1525 {"}'M' greentint -9.8585 1.4993 -4.3319 {"}'M' greentint -9.9689 1.3999 -4.6122 {"}'M' greentint -9.9852 1.1462 -4.5629 {"}'M' greentint -9.565 1.8141 -4.206 {"}'M' greentint -9.726 1.786 -4.406 {"}'M' greentint -9.8741 1.634 -4.5548 {"}'M' greentint -9.9406 1.4974 -4.8658 {"}'M' greentint -9.991 1.2427 -4.8612 {"}'M' greentint -9.9823 0.9949 -4.7807 {"}'M' greentint -9.5355 1.9871 -4.4785 {"}'M' greentint -9.6957 1.896 -4.6614 {"}'M' greentint -9.8372 1.7255 -4.797 {"}'M' greentint -9.8437 1.5717 -5.1058 {"}'M' greentint -9.912 1.3226 -5.1235 {"}'M' greentint -9.441 2.0795 -4.726 {"}'M' greentint -9.5977 1.9674 -4.8974 {"}'M' greentint -9.7362 1.7927 -5.0281 {"}'M' greentint -9.6984 1.5912 -5.3234 {"}'M' greentint -9.46 1.9814 -5.1225 {"}'M' greentint -9.5931 1.8058 -5.2456 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O HIS 150 A}'M' green -9.5938 1.5995 -4.0426 @dotlist {x} color= red width= 1 master= {H-bonds} { O HIS 150 A}'M' greentint -9.8142 1.1781 -4.2117 {"}'M' greentint -9.6922 1.3747 -4.1087 {"}'M' greentint -9.8411 1.0657 -4.5782 {"}'M' greentint -9.6957 1.2275 -4.4353 {"}'M' greentint -9.5711 1.4298 -4.3317 {"}'M' greentint -9.4746 1.663 -4.2718 {"}'M' greentint -9.4109 1.9147 -4.2593 {"}'M' greentint -9.928 1.0576 -5.0045 {"}'M' greentint -9.7682 1.1462 -4.8235 {"}'M' greentint -9.6215 1.2958 -4.6759 {"}'M' greentint -9.4978 1.4955 -4.5712 {"}'M' greentint -9.4059 1.7297 -4.5179 {"}'M' greentint -9.354 1.9806 -4.5195 {"}'M' greentint -9.8097 1.2281 -5.1586 {"}'M' greentint -9.6527 1.324 -4.9812 {"}'M' greentint -9.5142 1.4946 -4.8497 {"}'M' greentint -9.4113 1.7181 -4.7788 {"}'M' greentint -9.3568 1.9678 -4.7785 {"}'M' greentint -9.6711 1.4542 -5.2326 {"}'M' greentint -9.5213 1.6079 -5.0818 {"}'M' greentint -9.426 1.8442 -5.0243 {"}'M' greentint -9.5628 1.7521 -5.2928 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 182 2bklA_184Y_205}P -12.3059 -2.9609 -0.7429 {"}-12.3059 -2.9609 -0.7429 { ca phe A 182 2bklA_184Y_205}-10.9324 -2.4915 -0.7841 { c phe A 182 2bklA_184Y_205}-10.7623 -1.3114 -1.7489 { o phe A 182 2bklA_184Y_205}-11.491 -1.1705 -2.7497 { c phe A 182 2bklA_184Y_205}P -10.7623 -1.3114 -1.7489 { n tyr A 183 2bklA_184Y_205}-9.821 -0.4378 -1.4119 { ca tyr A 183 2bklA_184Y_205}-9.3222 0.597 -2.3216 { c tyr A 183 2bklA_184Y_205}-8.3197 -0.0042 -3.2783 { o tyr A 183 2bklA_184Y_205}-7.5489 -0.8833 -2.9127 { c tyr A 183 2bklA_184Y_205}P -8.3197 -0.0042 -3.2783 { n tyr A 184 2bklA_184Y_205}-8.2883 0.4801 -4.5062 { ca tyr A 184 2bklA_184Y_205}-7.3341 -0.0371 -5.4832 { c tyr A 184 2bklA_184Y_205}-7.1402 0.9455 -6.6284 { o tyr A 184 2bklA_184Y_205}-7.9565 1.8323 -6.8648 { c tyr A 184 2bklA_184Y_205}P -7.1402 0.9455 -6.6284 { n glu A 185 2bklA_184Y_205}-6.0434 0.7419 -7.3369 { ca glu A 185 2bklA_184Y_205}-5.6189 1.5276 -8.4945 { c glu A 185 2bklA_184Y_205}-6.1348 0.8456 -9.7463 { o glu A 185 2bklA_184Y_205}-5.8886 -0.3382 -9.9615 { c glu A 185 2bklA_184Y_205}P -6.1348 0.8456 -9.7463 { n trp A 186 2bklA_184Y_205}-6.8757 1.5979 -10.5649 { ca trp A 186 2bklA_184Y_205}-7.6264 1.0592 -11.6918 { c trp A 186 2bklA_184Y_205}-7.262 1.7774 -12.9949 { o trp A 186 2bklA_184Y_205}-7.12 2.9967 -13.0123 { n thr A 203 2bklA_184Y_205}P -6.7591 5.5639 -11.8354 {"}-6.7591 5.5639 -11.8354 { ca thr A 203 2bklA_184Y_205}-7.7053 6.1489 -10.933 { c thr A 203 2bklA_184Y_205}-7.7296 5.3534 -9.6398 { o thr A 203 2bklA_184Y_205}-7.4998 4.1534 -9.6464 { c thr A 203 2bklA_184Y_205}P -7.7296 5.3534 -9.6398 { n ile A 204 2bklA_184Y_205}-8.0197 5.9955 -8.5252 { ca ile A 204 2bklA_184Y_205}-8.2767 5.2426 -7.3051 { c ile A 204 2bklA_184Y_205}-9.7655 5.0045 -7.1701 { o ile A 204 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{"}'S' -11.3965 0.2293 -7.436 {"}'S' P -11.5057 0.3904 -7.6101 {"}'S' -11.5287 0.2922 -7.6533 {"}'S' P -11.6401 0.4888 -7.8111 {"}'S' -11.6589 0.3545 -7.8506 {"}'S' P -11.7869 0.5496 -8.0188 {"}'S' -11.7927 0.4356 -8.0365 {"}'S' P -11.9435 0.5726 -8.2261 {"}'S' -11.9413 0.5282 -8.2284 {"}'S' P -11.1983 0.284 -7.6117 {"}'S' -11.2047 0.2699 -7.6189 {"}'S' P -11.3207 0.4086 -7.8056 {"}'S' -11.3464 0.3375 -7.828 {"}'S' P -11.4586 0.4997 -8.0081 {"}'S' -11.4816 0.4081 -8.0237 {"}'S' P -11.6077 0.5527 -8.2154 {"}'S' -11.6168 0.4897 -8.2186 {"}'S' P -11.2498 0.4528 -8.1597 {"}'S' -11.253 0.4434 -8.1602 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 379 A}'S' blue -12.8805 0.8758 -9.7264 {"}'S' blue -12.9737 1.0504 -9.8953 {"}'S' blue -12.6386 0.9636 -9.7815 {"}'S' sky -12.7318 1.1353 -9.9498 {"}'S' blue -12.86 1.2444 -10.1465 {"}'S' blue -12.3873 0.9644 -9.8569 {"}'S' sky -12.472 1.1405 -10.0163 {"}'S' sky -12.5893 1.2651 -10.2016 {"}'S' blue -12.7292 1.3302 -10.4008 {"}'S' sky -12.1844 0.9917 -10.0317 {"}'S' blue -12.5402 1.324 -10.5837 {"}'S' blue -11.9836 0.878 -10.1688 {"}'S' sky -12.0683 1.0541 -10.3282 {"}'S' sky -12.1855 1.1787 -10.5135 {"}'S' blue -12.3259 1.243 -10.7132 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 379 A}'S' sea -12.2765 1.1561 -10.197 {"}'S' sea -12.3975 1.2689 -10.3846 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 391 A}'S' blue -12.7989 0.4921 -7.3382 {"}'S' sky -12.8858 0.5949 -7.9128 {"}'S' sky -12.7543 0.6686 -8.1924 {"}'S' blue -12.6099 0.8008 -8.4576 {"}'S' blue -12.3944 0.8844 -8.5923 {"}'S' blue -12.1592 0.9688 -8.6694 {"}'S' blue -11.9201 1.0706 -8.7077 { CG TYR 391 A}'S' blue -13.094 1.4555 -9.7165 {"}'S' blue -12.9842 1.3064 -9.5323 {"}'S' blue -12.9326 1.6084 -9.9649 {"}'S' sky -12.8398 1.4386 -9.7975 {"}'S' sky -12.728 1.2993 -9.6146 {"}'S' blue -12.5996 1.1957 -9.4189 {"}'S' blue -12.4585 1.1289 -9.2176 {"}'S' blue -12.3062 1.1011 -9.0134 {"}'S' blue 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{"}'S' blue -11.684 1.2162 -10.0434 {"}'S' sky -11.5317 1.1754 -9.8361 {"}'S' sky -11.3723 1.1747 -9.6283 {"}'S' blue -11.2085 1.2127 -9.4285 {"}'S' blue -11.4272 1.2327 -10.1302 {"}'S' blue -11.2749 1.205 -9.9259 {"}'S' blue -11.1173 1.2167 -9.7251 { HB2 TYR 391 A}'S' sky -11.6628 0.3637 -6.8566 {"}'S' sky -10.9729 0.5919 -6.892 {"}'S' sky -11.8948 0.9252 -8.5853 {"}'S' sky -10.8118 0.6089 -7.0978 {"}'S' blue -11.6369 1.0336 -8.6505 {"}'S' sky -11.37 0.9005 -8.5749 {"}'S' sky -10.7627 0.5676 -7.6979 {"}'S' sky -11.0574 0.7594 -8.3632 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 391 A}'S' sea -12.7483 0.5031 -7.7108 {"}'S' sea -12.5997 0.4493 -7.5039 {"}'S' sea -12.4424 0.433 -7.2954 {"}'S' sea -12.6275 0.553 -7.9962 {"}'S' green -12.4854 0.4746 -7.791 {"}'S' sea -12.4981 0.6615 -8.2748 {"}'S' green -12.3697 0.5579 -8.0791 {"}'S' sea -12.2849 0.7383 -8.411 { HB2 TYR 391 A}'S' green -11.9806 0.2467 -7.2353 {"}'S' green -11.5167 0.2531 -7.0692 {"}'S' sea -11.3638 0.3692 -6.9037 {"}'S' green -12.0673 0.5741 -8.3017 {"}'S' green -11.2571 0.2761 -7.1707 {"}'S' sea -11.107 0.4119 -7.0154 {"}'S' green -11.0951 0.2985 -7.3782 {"}'S' green -10.9446 0.4299 -7.2197 {"}'S' sea -11.6175 0.7913 -8.5585 {"}'S' green -11.5531 0.5823 -8.4159 {"}'S' green -10.9955 0.3535 -7.6323 {"}'S' sea -10.8383 0.4719 -7.4615 {"}'S' sea -11.3149 0.6892 -8.4462 {"}'S' green -11.2123 0.5365 -8.2711 {"}'S' green -11.0751 0.4614 -8.0717 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 391 A}'S' P -12.2699 0.3539 -7.6381 {"}'S' -12.2595 0.3699 -7.6361 {"}'S' P -12.1326 0.2724 -7.4386 {"}'S' -12.1229 0.2934 -7.4404 {"}'S' P -12.2177 0.4534 -8.0302 {"}'S' -12.2023 0.4778 -8.0165 {"}'S' P -12.1089 0.3127 -7.8511 {"}'S' -12.0731 0.39 -7.8249 {"}'S' P -11.9782 0.2183 -7.6561 {"}'S' -11.9472 0.3184 -7.6434 {"}'S' P -11.8309 0.1766 -7.4538 {"}'S' -11.8178 0.2531 -7.4585 {"}'S' P -11.6753 0.1886 -7.2559 {"}'S' -11.6751 0.1983 -7.2577 {"}'S' P 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-9.3087 2.3012 -6.3917 {"}'M' greentint -9.4573 2.1442 -6.5401 {"}'M' greentint -9.561 2.0479 -6.8376 {"}'M' greentint -9.6175 1.7984 -6.8409 {"}'M' greentint -9.1594 2.5313 -6.4538 {"}'M' greentint -9.318 2.4382 -6.6322 {"}'M' greentint -9.4572 2.2702 -6.7654 {"}'M' greentint -9.5306 2.1419 -7.0824 {"}'M' greentint -9.6017 1.8968 -7.1066 {"}'M' greentint -8.9724 2.7204 -6.5217 {"}'M' greentint -9.1326 2.6622 -6.7137 {"}'M' greentint -9.2874 2.5391 -6.8783 {"}'M' greentint -9.4231 2.3616 -7.0045 {"}'M' greentint -9.4527 2.2221 -7.3207 {"}'M' greentint -9.5339 1.9789 -7.3591 {"}'M' greentint -8.8897 2.8404 -6.7658 {"}'M' greentint -9.0517 2.7582 -6.9514 {"}'M' greentint -9.204 2.6223 -7.1114 {"}'M' greentint -9.3406 2.4407 -7.2362 {"}'M' greentint -9.3382 2.2669 -7.5503 {"}'M' greentint -8.9507 2.8045 -7.1981 {"}'M' greentint -9.0968 2.6609 -7.348 {"}'M' greentint -9.2276 2.4789 -7.4664 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 391 A}'M' greentint -9.4877 1.8053 -6.6701 {"}'M' greentint -9.3374 1.9297 -6.5103 {"}'M' greentint -9.2043 2.1053 -6.3872 {"}'M' greentint -9.0991 2.32 -6.3094 {"}'M' greentint -9.5953 1.8006 -7.2074 {"}'M' greentint -9.4371 1.8028 -7.0037 {"}'M' greentint -9.2764 1.8788 -6.8168 {"}'M' greentint -9.1269 2.0241 -6.6644 {"}'M' greentint -9.0023 2.2241 -6.5586 {"}'M' greentint -8.9137 2.4617 -6.5106 {"}'M' greentint -8.8692 2.7164 -6.5233 {"}'M' greentint -9.4922 1.9632 -7.4625 {"}'M' greentint -9.3434 1.9136 -7.2564 {"}'M' greentint -9.1811 1.9585 -7.0584 {"}'M' greentint -9.0268 2.0911 -6.8967 {"}'M' greentint -8.9026 2.2945 -6.7921 {"}'M' greentint -8.8243 2.5401 -6.76 {"}'M' greentint -8.8033 2.7956 -6.8033 {"}'M' greentint -9.2324 2.0971 -7.4268 {"}'M' greentint -9.0714 2.1251 -7.2268 {"}'M' greentint -8.9234 2.2771 -7.078 {"}'M' greentint -8.8286 2.5112 -7.0206 {"}'M' greentint -8.8123 2.7649 -7.0699 {"}'M' greentint -9.0989 2.3149 -7.4803 {"}'M' greentint -8.9389 2.4118 -7.3009 {"}'M' greentint -8.884 2.6651 -7.3007 {"}'M' greentint -9.0172 2.5615 -7.5002 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 379 A}'M' green -10.3341 0.6162 -4.789 {"}'M' green -10.015 0.8112 -4.4315 {"}'M' green -9.6624 1.2593 -4.5286 {"}'M' green -9.5487 1.4533 -4.7798 {"}'M' green -10.1569 1.1629 -5.485 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 379 A}'M' greentint -10.2009 0.7198 -4.5895 {"}'M' greentint -10.1192 0.9664 -4.6093 {"}'M' greentint -10.2792 0.8695 -4.7887 {"}'M' greentint -10.3895 0.7701 -5.069 {"}'M' greentint -9.8539 1.0825 -4.4647 {"}'M' greentint -9.9857 1.1842 -4.6628 {"}'M' greentint -10.1467 1.1562 -4.8628 {"}'M' greentint -10.2947 1.0042 -5.0117 {"}'M' greentint -10.3613 0.8676 -5.3226 {"}'M' greentint -9.7973 1.3541 -4.7295 {"}'M' greentint -9.9562 1.3573 -4.9354 {"}'M' greentint -10.1164 1.2662 -5.1183 {"}'M' greentint -10.2578 1.0957 -5.2538 {"}'M' greentint -9.7004 1.4888 -4.985 {"}'M' greentint -9.8617 1.4496 -5.1828 {"}'M' greentint -10.0183 1.3376 -5.3542 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 391 A}'M' green -10.5351 0.652 -5.0838 {"}'M' green -10.378 0.6474 -4.8782 {"}'M' green -9.9121 0.9751 -4.3676 {"}'M' green -10.4516 0.8298 -5.3418 {"}'M' green -9.7143 1.2432 -4.5035 {"}'M' green -10.3233 1.0416 -5.4933 {"}'M' green -9.6277 1.4657 -4.7112 {"}'M' green -10.1836 1.2761 -5.5678 {"}'M' green -9.6424 1.5918 -4.9566 {"}'M' green -9.938 1.4024 -5.4028 {"}'M' green -9.7793 1.4997 -5.2252 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 391 A}'M' greentint -10.2153 0.7031 -4.6841 {"}'M' greentint -10.0575 0.8134 -4.5106 {"}'M' greentint -10.3036 0.7828 -5.1373 {"}'M' greentint -10.1444 0.8052 -4.9368 {"}'M' greentint -9.9847 0.8938 -4.7558 {"}'M' greentint -9.838 1.0434 -4.6082 {"}'M' greentint -10.185 0.9647 -5.2918 {"}'M' greentint -10.0261 0.9758 -5.0909 {"}'M' greentint -9.8691 1.0716 -4.9135 {"}'M' greentint -9.7306 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-9.3636 2.2641 -7.4392 {"}'M' greentint -8.6611 2.9516 -6.7214 {"}'M' greentint -8.8203 2.9005 -6.9136 {"}'M' greentint -8.9761 2.8017 -7.0869 {"}'M' greentint -9.1222 2.6582 -7.2368 {"}'M' greentint -9.253 2.4762 -7.3552 {"}'M' greentint -8.5033 2.9956 -6.9293 {"}'M' greentint -8.6635 2.9349 -7.119 {"}'M' greentint -8.8204 2.829 -7.2922 {"}'M' greentint -8.967 2.6819 -7.442 {"}'M' greentint -9.0991 2.4989 -7.5619 {"}'M' greentint -8.6453 2.8152 -7.4837 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 97 A}'M' greentint -9.5616 2.0168 -6.8194 {"}'M' greentint -9.405 2.0542 -6.6276 {"}'M' greentint -9.25 2.1514 -6.4551 {"}'M' greentint -9.1087 2.3022 -6.3135 {"}'M' greentint -8.9881 2.4965 -6.2117 {"}'M' greentint -9.4486 2.0149 -7.102 {"}'M' greentint -9.2943 2.0142 -6.9029 {"}'M' greentint -9.1361 2.0779 -6.7166 {"}'M' greentint -8.9858 2.2024 -6.5568 {"}'M' greentint -8.8527 2.3779 -6.4337 {"}'M' greentint -8.7475 2.5926 -6.3559 {"}'M' greentint -8.674 2.8324 -6.329 {"}'M' greentint -9.3851 2.1462 -7.457 {"}'M' greentint -9.2437 2.0732 -7.2539 {"}'M' greentint -9.0855 2.0754 -7.0502 {"}'M' greentint -8.9248 2.1514 -6.8633 {"}'M' greentint -8.7753 2.2967 -6.7109 {"}'M' greentint -8.6507 2.4967 -6.6051 {"}'M' greentint -8.5621 2.7343 -6.557 {"}'M' greentint -9.1406 2.2359 -7.509 {"}'M' greentint -8.9918 2.1862 -7.3029 {"}'M' greentint -8.8295 2.2311 -7.1049 {"}'M' greentint -8.6752 2.3638 -6.9432 {"}'M' greentint -8.551 2.5671 -6.8386 {"}'M' greentint -8.4727 2.8128 -6.8064 {"}'M' greentint -9.0126 2.4714 -7.6715 {"}'M' greentint -8.8808 2.3697 -7.4733 {"}'M' greentint -8.7198 2.3978 -7.2733 {"}'M' greentint -8.5718 2.5497 -7.1245 {"}'M' greentint -8.477 2.7838 -7.0671 {"}'M' greentint -8.7473 2.5875 -7.5268 {"}'M' greentint -8.5873 2.6845 -7.3474 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 84 A}'M' green -9.523 1.3402 -4.1087 {"}'M' green -9.6562 1.2366 -4.3082 {"}'M' green -9.7279 1.1368 -4.539 {"}'M' green -9.3078 1.8047 -4.1821 {"}'M' green -9.6548 1.3132 -5.0996 {"}'M' green -9.1838 2.0701 -4.7021 {"}'M' green -9.4411 1.5818 -5.2995 {"}'M' green -9.2028 1.972 -5.0987 {"}'M' green -9.3359 1.7964 -5.2217 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 84 A}'M' greentint -9.4413 1.5868 -4.1286 {"}'M' greentint -9.6013 1.4899 -4.308 {"}'M' greentint -9.7117 1.3905 -4.5883 {"}'M' greentint -9.4688 1.7766 -4.3821 {"}'M' greentint -9.6168 1.6246 -4.531 {"}'M' greentint -9.6834 1.488 -4.8419 {"}'M' greentint -9.7338 1.2333 -4.8373 {"}'M' greentint -9.2783 1.9777 -4.4547 {"}'M' greentint -9.4385 1.8866 -4.6375 {"}'M' greentint -9.5799 1.7161 -4.7731 {"}'M' greentint -9.5865 1.5622 -5.0819 {"}'M' greentint -9.3405 1.958 -4.8735 {"}'M' greentint -9.479 1.7833 -5.0042 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 97 A}'M' green -9.7827 1.1393 -4.3205 {"}'M' green -9.6424 1.3013 -4.1844 {"}'M' green -9.5204 1.4979 -4.0814 {"}'M' green -9.4221 1.7228 -4.0154 {"}'M' green -9.8271 1.0788 -4.7245 {"}'M' green -9.2391 2.038 -4.232 {"}'M' green -9.7562 1.1809 -4.9772 {"}'M' green -9.1822 2.1039 -4.4923 {"}'M' green -9.6379 1.3514 -5.1313 {"}'M' green -9.185 2.091 -4.7513 {"}'M' green -9.3911 1.8754 -5.2656 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 97 A}'M' greentint -9.6693 1.189 -4.551 {"}'M' greentint -9.5239 1.3507 -4.4081 {"}'M' greentint -9.3993 1.5531 -4.3045 {"}'M' greentint -9.3028 1.7862 -4.2446 {"}'M' greentint -9.5964 1.2695 -4.7962 {"}'M' greentint -9.4497 1.4191 -4.6487 {"}'M' greentint -9.326 1.6188 -4.544 {"}'M' greentint -9.2342 1.853 -4.4907 {"}'M' greentint -9.4809 1.4473 -4.954 {"}'M' greentint -9.3424 1.6178 -4.8225 {"}'M' greentint -9.2395 1.8413 -4.7516 {"}'M' greentint -9.4993 1.5775 -5.2054 {"}'M' greentint -9.3495 1.7312 -5.0545 {"}'M' greentint -9.2542 1.9675 -4.997 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 37 2bm3A_39F_97L}P -10.043 -3.3917 -0.0089 {"}-10.043 -3.3917 -0.0089 { ca ala A 37 2bm3A_39F_97L}-10.7164 -2.1315 0.3551 { c ala A 37 2bm3A_39F_97L}-10.58 -1.0411 -0.7276 { o ala A 37 2bm3A_39F_97L}-11.1427 0.0491 -0.5681 { c ala A 37 2bm3A_39F_97L}P -10.58 -1.0411 -0.7276 { n gly A 38 2bm3A_39F_97L}-9.8221 -1.3027 -1.78 { ca gly A 38 2bm3A_39F_97L}-9.6951 -0.2572 -2.831 { c gly A 38 2bm3A_39F_97L}-8.7521 -0.661 -3.9448 { o gly A 38 2bm3A_39F_97L}-8.029 -1.6718 -3.8229 { c gly A 38 2bm3A_39F_97L}P -8.7521 -0.661 -3.9448 { n phe A 39 2bm3A_39F_97L}-8.7003 0.1726 -4.9974 { ca phe A 39 2bm3A_39F_97L}-7.8279 -0.1195 -6.129 { c phe A 39 2bm3A_39F_97L}-7.5675 1.153 -6.918 { o phe A 39 2bm3A_39F_97L}-8.3247 2.1423 -6.7963 { c phe A 39 2bm3A_39F_97L}P -7.5675 1.153 -6.918 { n gln A 40 2bm3A_39F_97L}-6.5217 1.0786 -7.7393 { ca gln A 40 2bm3A_39F_97L}-6.3001 2.0055 -8.8477 { c gln A 40 2bm3A_39F_97L}-5.8527 1.164 -10.0298 { o gln A 40 2bm3A_39F_97L}-5.0446 0.2428 -9.8548 { c gln A 40 2bm3A_39F_97L}P -5.8527 1.164 -10.0298 { n val A 41 2bm3A_39F_97L}-6.3916 1.4305 -11.2253 { ca val A 41 2bm3A_39F_97L}-5.9034 0.7203 -12.4226 { c val A 41 2bm3A_39F_97L}-5.6886 1.7139 -13.5675 { o val A 41 2bm3A_39F_97L}-6.2853 2.8065 -13.5643 { n phe A 95 2bm3A_39F_97L}P -8.4389 5.1211 -13.1263 {"}-8.4389 5.1211 -13.1263 { ca phe A 95 2bm3A_39F_97L}-9.4676 5.3984 -12.1467 { c phe A 95 2bm3A_39F_97L}-9.2129 4.5779 -10.8749 { o phe A 95 2bm3A_39F_97L}-8.4501 3.5919 -10.8939 { c phe A 95 2bm3A_39F_97L}P -9.2129 4.5779 -10.8749 { n ala A 96 2bm3A_39F_97L}-9.7393 5.0531 -9.7616 { ca ala A 96 2bm3A_39F_97L}-9.4495 4.4621 -8.4581 { c ala A 96 2bm3A_39F_97L}-10.6746 4.5925 -7.57 { o ala A 96 2bm3A_39F_97L}-11.4988 5.4966 -7.746 { c ala A 96 2bm3A_39F_97L}P -10.6746 4.5925 -7.57 { n leu A 97 2bm3A_39F_97L}-10.7998 3.6976 -6.609 { ca leu A 97 2bm3A_39F_97L}-11.9365 3.7736 -5.7055 { c leu A 97 2bm3A_39F_97L}-11.4875 3.0426 -4.4637 { o leu A 97 2bm3A_39F_97L}-10.8673 1.9688 -4.5773 { c leu A 97 2bm3A_39F_97L}P -11.4875 3.0426 -4.4637 { n ala A 98 2bm3A_39F_97L}-11.7703 3.6081 -3.2925 { ca ala A 98 2bm3A_39F_97L}-11.4151 2.9453 -2.0508 { c ala A 98 2bm3A_39F_97L}-12.3751 3.4181 -0.9742 { o ala A 98 2bm3A_39F_97L}-12.9332 4.5277 -1.0659 { c ala A 98 2bm3A_39F_97L}P -12.3751 3.4181 -0.9742 { n tyr A 99 2bm3A_39F_97L}-12.5626 2.5714 0.0377 { ca tyr A 99 2bm3A_39F_97L}-13.2721 2.9963 1.242 { c tyr A 99 2bm3A_39F_97L}-12.3456 3.8898 2.0634 { o tyr A 99 2bm3A_39F_97L}-11.1897 3.5202 2.3417 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 37 2bm3A_39F_97L}P -10.043 -3.3917 -0.0089 { ca ala A 37 2bm3A_39F_97L}P -10.7164 -2.1315 0.3551 { n gly A 38 2bm3A_39F_97L}P -9.8221 -1.3027 -1.78 { ca gly A 38 2bm3A_39F_97L}P -9.6951 -0.2572 -2.831 {"}P -9.6951 -0.2572 -2.831 { n phe A 39 2bm3A_39F_97L}P -8.7003 0.1726 -4.9974 { ca phe A 39 2bm3A_39F_97L}P -7.8279 -0.1195 -6.129 { n gln A 40 2bm3A_39F_97L}P -6.5217 1.0786 -7.7393 { ca gln A 40 2bm3A_39F_97L}P -6.3001 2.0055 -8.8477 { n val A 41 2bm3A_39F_97L}P -6.3916 1.4305 -11.2253 { ca val A 41 2bm3A_39F_97L}P -5.9034 0.7203 -12.4226 { n phe A 95 2bm3A_39F_97L}P -8.4389 5.1211 -13.1263 { ca phe A 95 2bm3A_39F_97L}P -9.4676 5.3984 -12.1467 { n ala A 96 2bm3A_39F_97L}P -9.7393 5.0531 -9.7616 { ca ala A 96 2bm3A_39F_97L}P -9.4495 4.4621 -8.4581 { n leu A 97 2bm3A_39F_97L}P -10.7998 3.6976 -6.609 { ca leu A 97 2bm3A_39F_97L}P -11.9365 3.7736 -5.7055 { n ala A 98 2bm3A_39F_97L}P -11.7703 3.6081 -3.2925 { ca ala A 98 2bm3A_39F_97L}P -11.4151 2.9453 -2.0508 { n tyr A 99 2bm3A_39F_97L}P -12.5626 2.5714 0.0377 { ca tyr A 99 2bm3A_39F_97L}P -13.2721 2.9963 1.242 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 37 2bm3A_39F_97L}P -10.7164 -2.1315 0.3551 {"}-10.7164 -2.1315 0.3551 { ca gly A 38 2bm3A_39F_97L}-9.6951 -0.2572 -2.831 { ca phe A 39 2bm3A_39F_97L}-7.8279 -0.1195 -6.129 { ca gln A 40 2bm3A_39F_97L}-6.3001 2.0055 -8.8477 { ca val A 41 2bm3A_39F_97L}-5.9034 0.7203 -12.4226 { ca phe A 95 2bm3A_39F_97L}P -9.4676 5.3984 -12.1467 {"}-9.4676 5.3984 -12.1467 { ca ala A 96 2bm3A_39F_97L}-9.4495 4.4621 -8.4581 { ca leu A 97 2bm3A_39F_97L}-11.9365 3.7736 -5.7055 { ca ala A 98 2bm3A_39F_97L}-11.4151 2.9453 -2.0508 { ca tyr A 99 2bm3A_39F_97L}-13.2721 2.9963 1.242 @subgroup {sidechain} off @vectorlist {sc} color= green alpha= 0.2353 master= {sidechain} { ca phe A 39 2bm3A_39F_97L}P -7.8279 -0.1195 -6.129 { ca leu A 97 2bm3A_39F_97L}P -11.9365 3.7736 -5.7055 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 39 A}'S' blue -13.4572 0.7857 -7.413 { CZ PHE 39 A}'S' blue -13.0876 1.3433 -8.1817 {"}'S' sky -12.9559 1.564 -8.2316 {"}'S' sky -12.8111 1.7647 -8.3169 {"}'S' sky -12.6112 1.929 -8.3734 {"}'S' sky -12.2382 1.9747 -8.2227 {"}'S' blue -12.3781 2.0557 -8.4256 {"}'S' sky -11.7758 1.7582 -7.9224 {"}'S' blue -11.8735 1.9221 -8.095 { HE2 PHE 39 A}'S' blue -13.8564 -0.0421 -6.9511 {"}'S' blue -13.9896 -0.1457 -7.1506 {"}'S' sky -13.7747 0.2045 -6.9709 {"}'S' sky -13.9347 0.1075 -7.1504 {"}'S' sky -14.0451 0.0082 -7.4306 {"}'S' sky -13.6412 0.4223 -7.0245 {"}'S' sky -13.6117 0.5953 -7.297 {"}'S' sky -13.7719 0.5043 -7.4799 {"}'S' sky -13.9134 0.3337 -7.6154 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 39 A}'S' green -12.8432 1.0239 -6.9033 {"}'S' green -12.986 1.0904 -7.1068 {"}'S' green -13.1437 1.0904 -7.3104 {"}'S' green -12.5223 1.0623 -6.7691 {"}'S' green -13.1017 1.2346 -7.5661 {"}'S' green -12.291 1.1741 -6.8202 {"}'S' green -13.0299 1.3379 -7.8197 {"}'S' green -12.0485 1.2477 -6.8849 {"}'S' green -12.7657 1.4862 -7.8786 {"}'S' green -11.9004 1.4017 -7.1261 {"}'S' sea -11.8321 1.5485 -7.4935 {"}'S' green -11.9789 1.6093 -7.7012 { CZ PHE 39 A}'S' sea -12.8148 1.483 -8.0253 {"}'S' green -12.5493 1.5715 -7.9236 {"}'S' green -12.6682 1.6982 -8.1133 {"}'S' green -12.3473 1.7366 -7.9792 {"}'S' sea -12.4689 1.8586 -8.1714 {"}'S' sea -12.0171 1.6827 -7.8556 {"}'S' sea -12.116 1.8484 -8.0302 { HE2 PHE 39 A}'S' sea -13.8022 0.3942 -7.2244 {"}'S' sea -13.9503 0.2423 -7.3733 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 39 A}'S' P -12.6439 1.1843 -6.9614 {"}'S' -12.6307 1.1537 -6.9842 {"}'S' P -12.7861 1.2547 -7.1633 {"}'S' -12.7564 1.1992 -7.1972 {"}'S' P -12.9404 1.2723 -7.368 {"}'S' -12.9167 1.2353 -7.3852 {"}'S' P -12.4132 1.3004 -7.0126 {"}'S' -12.4005 1.2497 -7.0469 {"}'S' P -12.5531 1.3813 -7.2155 {"}'S' -12.5232 1.2901 -7.2632 {"}'S' P -12.7061 1.4155 -7.4239 {"}'S' -12.6704 1.3295 -7.4545 {"}'S' P -12.8671 1.4006 -7.6269 {"}'S' -12.8488 1.3668 -7.6352 {"}'S' P -12.166 1.3768 -7.0734 {"}'S' -12.1648 1.3507 -7.0896 {"}'S' P -12.3014 1.467 -7.2722 {"}'S' -12.2904 1.3918 -7.3066 {"}'S' P -12.4494 1.5168 -7.4772 {"}'S' -12.4287 1.4298 -7.5043 {"}'S' P -12.6053 1.5224 -7.6813 {"}'S' -12.5884 1.4712 -7.6909 {"}'S' P -12.0284 1.5046 -7.3211 {"}'S' -12.029 1.499 -7.3241 {"}'S' P -12.1708 1.5705 -7.5239 {"}'S' -12.1691 1.5409 -7.5319 {"}'S' P -12.3227 1.5977 -7.7275 {"}'S' -12.3204 1.5807 -7.7291 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 LEU 97 A}'S' blue -13.0891 1.855 -8.0187 {"}'S' sky -12.8312 1.9633 -8.0839 {"}'S' sky -12.3031 2.1555 -7.9921 {HD23 LEU 97 A}'S' blue -14.3059 0.0846 -6.9399 {"}'S' blue -14.1487 0.203 -6.7691 {"}'S' blue -14.3855 0.1926 -7.3793 {"}'S' sky -14.2292 0.2033 -7.18 {"}'S' sky -13.9359 0.4669 -6.8752 {"}'S' blue -13.8344 0.688 -6.8057 {"}'S' sky -14.2344 0.3877 -7.4702 {"}'S' blue -13.8245 0.8073 -7.057 {"}'S' sky -14.1095 0.6132 -7.5149 {"}'S' sky -13.949 0.7109 -7.3351 {"}'S' blue -13.894 0.9659 -7.3334 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 LEU 97 A}'S' sea -13.1725 1.148 -7.0895 {"}'S' green -13.0252 1.1064 -6.8872 {"}'S' green -13.1739 1.3278 -7.5716 {"}'S' green -12.6094 1.1201 -6.7851 {"}'S' green -12.9836 1.431 -7.7657 {"}'S' green -12.2894 1.2282 -6.8116 {"}'S' sea -12.8119 1.721 -7.9919 {"}'S' green -12.7474 1.5121 -7.8493 {"}'S' green -12.0326 1.4016 -6.8949 {"}'S' sea -12.5647 2.0744 -8.0765 {"}'S' green -12.5643 1.8303 -8.0083 {"}'S' green -12.5092 1.619 -7.8796 {"}'S' green -11.957 1.4973 -7.1313 {"}'S' green -12.3195 1.8976 -7.942 {"}'S' green -12.2517 1.6891 -7.7966 {"}'S' green -11.9548 1.615 -7.3927 {"}'S' sea -12.0984 1.9682 -7.8199 {HD23 LEU 97 A}'S' sea -14.0731 0.2987 -7.0055 {"}'S' sea -14.0709 0.4163 -7.2668 {"}'S' sea -13.9202 0.5702 -7.1149 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 LEU 97 A}'S' P -13.0577 1.196 -7.3862 {"}'S' -13.0581 1.1969 -7.3852 {"}'S' P -12.9212 1.1146 -7.1861 {"}'S' -12.9189 1.1422 -7.1808 {"}'S' P -12.7688 1.0896 -6.9824 {"}'S' -12.7699 1.1069 -6.9826 {"}'S' P -12.881 1.2783 -7.5906 {"}'S' -12.8792 1.316 -7.566 {"}'S' P -12.7525 1.1775 -7.3954 {"}'S' -12.7577 1.258 -7.3628 {"}'S' P -12.6053 1.1344 -7.1929 {"}'S' -12.6217 1.2203 -7.1751 {"}'S' P -12.4471 1.1522 -6.9944 {"}'S' -12.4639 1.1985 -6.992 {"}'S' P -12.6437 1.3534 -7.6713 {"}'S' -12.6548 1.4081 -7.6272 {"}'S' P -12.5088 1.2585 -7.4704 {"}'S' -12.5381 1.3522 -7.4208 {"}'S' P -12.3531 1.2343 -7.2623 {"}'S' -12.3921 1.3195 -7.236 {"}'S' P -12.1898 1.2832 -7.0657 {"}'S' -12.2095 1.314 -7.0621 {"}'S' P -12.4066 1.4662 -7.7045 {"}'S' -12.4263 1.5029 -7.6697 {"}'S' P -12.2695 1.3912 -7.5051 {"}'S' -12.3068 1.4496 -7.4686 {"}'S' P -12.1131 1.402 -7.3058 {"}'S' -12.1396 1.434 -7.2929 {"}'S' P -12.1183 1.5863 -7.596 {"}'S' -12.1195 1.5874 -7.5944 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 39 A}'M' green -9.4166 2.3773 -5.9516 {"}'M' green -9.3379 2.6235 -5.9583 {"}'M' green -9.2348 2.856 -6.0073 {"}'M' green -9.7218 2.1645 -6.8926 {"}'M' green -9.6233 2.5004 -7.1766 {"}'M' green -9.2935 3.1438 -6.9289 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 39 A}'M' greentint -9.5567 2.2846 -6.1476 {"}'M' greentint -9.4968 2.5348 -6.1399 {"}'M' greentint 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{"}'S' sea -12.046 -0.4447 -6.3466 {"}'S' green -12.1928 -0.3839 -6.5542 {"}'S' green -12.3494 -0.3609 -6.7616 {"}'S' green -12.511 -0.3783 -6.9665 {"}'S' sea -12.6749 -0.435 -7.1622 {"}'S' sea -12.0136 -0.3808 -6.7509 {"}'S' green -12.1705 -0.3665 -6.9583 {"}'S' sea -12.3326 -0.39 -7.1609 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 95 A}'S' P -12.5365 -0.3955 -6.5805 {"}'S' -12.5363 -0.3992 -6.581 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 41 A}'S' sky -13.3074 -0.3749 -6.2923 {"}'S' sky -13.1497 -0.3894 -6.0854 {"}'S' blue -12.9876 -0.3659 -5.8828 {"}'S' sky -13.2569 -0.3639 -6.6648 {"}'S' sky -12.6265 -0.3512 -5.8523 {"}'S' blue -12.4653 -0.2547 -5.6711 {"}'S' sky -12.3557 -0.3202 -5.9404 {"}'S' blue -12.1973 -0.2064 -5.7671 {"}'S' sky -13.0067 -0.2055 -7.2288 {"}'S' sky -12.1088 -0.253 -6.0541 {"}'S' blue -11.9565 -0.1288 -5.8913 {"}'S' blue -12.7934 -0.1287 -7.3651 {"}'S' sky -11.8934 -0.1567 -6.1934 {"}'S' blue -12.557 -0.046 -7.4402 {"}'S' sky -12.4258 -0.1513 -7.2419 {"}'S' blue -11.7981 -0.0987 -6.4438 {"}'S' sky -12.3186 0.0601 -7.4786 {"}'S' sky -12.1859 -0.0359 -7.2804 {"}'S' sky -11.8772 -0.066 -6.8738 {"}'S' blue -11.716 0.0004 -6.684 {HG21 VAL 41 A}'S' blue -13.617 -0.422 -6.8295 {"}'S' sky -13.4577 -0.3915 -6.6322 {"}'S' blue -13.4535 -0.3772 -7.04 {"}'S' sky -13.2958 -0.3602 -6.8419 {"}'S' sky -13.2013 -0.2774 -7.1093 {HG22 VAL 41 A}'S' sky -11.8809 -0.0069 -7.0188 {"}'S' blue -11.7215 0.0236 -6.8216 {"}'S' sky -11.993 0.1817 -7.627 {"}'S' sky -11.5592 0.0557 -7.0309 {"}'S' sky -11.7558 0.2568 -7.7078 {"}'S' sky -11.4651 0.1377 -7.2987 {"}'S' blue -11.3019 0.1867 -7.1021 {"}'S' blue -11.5187 0.3697 -7.741 {"}'S' blue -11.3815 0.2947 -7.5416 {HG23 VAL 41 A}'S' blue -12.5778 -0.222 -5.3778 {"}'S' blue -12.4184 -0.1915 -5.1806 {"}'S' blue -12.2561 -0.1594 -5.3899 @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 41 A}'S' sea -13.1082 -0.4177 -6.4579 {"}'S' green -12.9509 -0.434 -6.2495 {"}'S' sea -12.7888 -0.4119 -6.0467 {"}'S' sea -13.1361 -0.314 -6.9503 {"}'S' green -12.994 -0.3924 -6.7451 {"}'S' green -12.8416 -0.4333 -6.5378 {"}'S' green -12.6822 -0.4339 -6.33 {"}'S' green -12.5185 -0.3959 -6.1302 {"}'S' sea -12.8783 -0.309 -7.0332 {"}'S' green -12.7371 -0.3759 -6.8318 {"}'S' green -12.4272 -0.3919 -6.4268 {"}'S' green -12.2669 -0.3415 -6.2345 {"}'S' sea -12.6665 -0.2374 -7.1702 {"}'S' green -12.5245 -0.3054 -6.9675 {"}'S' green -12.3713 -0.3316 -6.7624 {"}'S' green -12.2127 -0.3155 -6.5612 {"}'S' sea -12.0513 -0.2566 -6.3694 {"}'S' sea -12.2794 -0.2101 -7.0352 {"}'S' green -12.1216 -0.2218 -6.8288 {"}'S' sea -11.9594 -0.1838 -6.6296 {"}'S' sea -12.0356 -0.078 -7.0757 {HG22 VAL 41 A}'S' sea -11.8646 0.081 -7.4319 {"}'S' sea -11.7173 0.0379 -7.2293 {"}'S' sea -11.6209 0.162 -7.5069 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 VAL 41 A}'S' P -12.5848 -0.4037 -6.6276 {"}'S' -12.5856 -0.4007 -6.6275 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 95 A}'M' green -9.6982 2.0257 -6.0991 {"}'M' green -9.2661 2.6335 -6.2761 {"}'M' green -9.9025 2.1458 -7.2789 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 95 A}'M' greentint -9.8572 1.937 -6.2807 {"}'M' greentint -10.0007 1.8292 -6.5532 {"}'M' greentint -9.5952 2.2582 -6.1481 {"}'M' greentint -9.7585 2.2249 -6.3499 {"}'M' greentint -9.9071 2.0679 -6.4984 {"}'M' greentint -10.0108 1.9716 -6.7959 {"}'M' greentint -9.4513 2.4634 -6.2101 {"}'M' greentint -9.6092 2.455 -6.4121 {"}'M' greentint -9.7678 2.3618 -6.5905 {"}'M' greentint -9.907 2.1939 -6.7236 {"}'M' greentint -9.9804 2.0656 -7.0407 {"}'M' greentint -9.4222 2.6441 -6.4799 {"}'M' greentint -9.5824 2.5859 -6.6719 {"}'M' greentint -9.7372 2.4628 -6.8366 {"}'M' greentint -9.8729 2.2853 -6.9628 {"}'M' greentint -9.3391 2.7635 -6.7233 {"}'M' greentint -9.5016 2.6819 -6.9097 {"}'M' greentint -9.6538 2.546 -7.0697 {"}'M' greentint -9.7904 2.3644 -7.1945 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H VAL 41 A}'M' green -10.0939 1.8381 -6.8448 {"}'M' green -9.4124 2.4992 -6.148 {"}'M' green -9.8628 2.2363 -7.2624 {"}'M' green -9.3109 2.8024 -6.7074 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 41 A}'M' greentint -9.9357 1.8403 -6.6411 {"}'M' greentint -9.775 1.9162 -6.4542 {"}'M' greentint -9.6255 2.0616 -6.3018 {"}'M' greentint -9.5009 2.2616 -6.196 {"}'M' greentint -9.9908 2.0007 -7.0999 {"}'M' greentint -9.842 1.9511 -6.8938 {"}'M' greentint -9.6797 1.996 -6.6958 {"}'M' greentint -9.5255 2.1286 -6.5341 {"}'M' greentint -9.4012 2.332 -6.4295 {"}'M' greentint -9.3229 2.5776 -6.3974 {"}'M' greentint -9.731 2.1346 -7.0642 {"}'M' greentint -9.57 2.1626 -6.8642 {"}'M' greentint -9.422 2.3146 -6.7154 {"}'M' greentint -9.3272 2.5487 -6.658 {"}'M' greentint -9.5975 2.3524 -7.1177 {"}'M' greentint -9.4376 2.4493 -6.9383 {"}'M' greentint -9.3826 2.7026 -6.9381 {"}'M' greentint -9.5159 2.599 -7.1376 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 95 A}'M' -9.4871 1.7011 -5.0597 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 95 A}'M' sea -9.9575 0.9449 -4.2296 {"}'M' sea -10.0908 0.8412 -4.4291 {"}'M' sea -9.7716 1.0362 -4.0716 {"}'M' green -9.8758 1.1914 -4.2495 {"}'M' green -10.0358 1.0945 -4.4289 {"}'M' sea -10.1462 0.9951 -4.7092 {"}'M' green -9.6106 1.3075 -4.1048 {"}'M' sea -10.1179 1.0926 -4.9628 {"}'M' sea -9.419 1.4843 -4.1687 {"}'M' green -9.5539 1.5791 -4.3696 {"}'M' green -10.0145 1.3207 -4.894 {"}'M' sea -9.3054 1.6783 -4.42 {"}'M' green -9.457 1.7138 -4.6251 {"}'M' green -9.6184 1.6747 -4.823 {"}'M' green -9.775 1.5626 -4.9944 {"}'M' sea -9.9136 1.3879 -5.1251 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 95 A}'M' greentint -9.7423 1.4093 -4.303 {"}'M' greentint -9.9033 1.3812 -4.503 {"}'M' greentint -10.0514 1.2293 -4.6518 {"}'M' greentint -9.7128 1.5823 -4.5755 {"}'M' greentint -9.8731 1.4912 -4.7584 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 41 A}'M' sky -10.252 1.0204 -4.229 @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 41 A}'M' sea -10.3063 1.1034 -4.6862 {"}'M' green -10.1491 1.0988 -4.4806 {"}'M' green -9.9865 1.1545 -4.2864 {"}'M' green -9.8287 1.2648 -4.113 {"}'M' sea -9.6833 1.4265 -3.97 {"}'M' sea -10.2228 1.2813 -4.9441 {"}'M' green -10.0748 1.2342 -4.7397 {"}'M' green -9.6092 1.4948 -4.2106 {"}'M' sea -9.4855 1.6946 -4.1059 {"}'M' sea -10.0945 1.493 -5.0957 {"}'M' green -9.9562 1.4162 -4.8941 {"}'M' green -9.5018 1.6936 -4.3844 {"}'M' green -9.8218 1.624 -4.9699 {"}'M' green -9.6587 1.6532 -4.7673 {"}'M' green -9.5089 1.807 -4.6165 {"}'M' sea -9.7092 1.8538 -5.0051 {"}'M' sea -9.5505 1.9512 -4.8275 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 41 A}'M' greentint -9.9156 1.2567 -4.5392 {"}'M' greentint -9.7559 1.3452 -4.3582 {"}'M' greentint -9.7973 1.4272 -4.6933 {"}'M' greentint -9.6403 1.5231 -4.5159 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu B 54 2bo9B_56F_70C}P -12.3116 -2.477 -0.152 {"}-12.3116 -2.477 -0.152 { ca leu B 54 2bo9B_56F_70C}-11.0876 -2.4006 -0.952 { c leu B 54 2bo9B_56F_70C}-10.8128 -0.9889 -1.4131 { o leu B 54 2bo9B_56F_70C}-11.7346 -0.2646 -1.76 { c leu B 54 2bo9B_56F_70C}P -10.8128 -0.9889 -1.4131 { n lys B 55 2bo9B_56F_70C}-9.5367 -0.6268 -1.4314 { ca lys B 55 2bo9B_56F_70C}-9.0852 0.5659 -2.122 { c lys B 55 2bo9B_56F_70C}-8.0454 0.1134 -3.1319 { o lys B 55 2bo9B_56F_70C}-7.052 -0.5186 -2.7697 { c lys B 55 2bo9B_56F_70C}P -8.0454 0.1134 -3.1319 { n phe B 56 2bo9B_56F_70C}-8.2728 0.4202 -4.3978 { ca phe B 56 2bo9B_56F_70C}-7.3752 -0.0644 -5.4323 { c phe B 56 2bo9B_56F_70C}-7.2684 0.911 -6.5906 { o phe B 56 2bo9B_56F_70C}-8.1633 1.7291 -6.8061 { c phe B 56 2bo9B_56F_70C}P -7.2684 0.911 -6.5906 { n ala B 57 2bo9B_56F_70C}-6.1707 0.8076 -7.3327 { ca ala B 57 2bo9B_56F_70C}-5.9335 1.6518 -8.4948 { c ala B 57 2bo9B_56F_70C}-6.3425 0.8861 -9.7386 { o ala B 57 2bo9B_56F_70C}-6.0227 -0.3014 -9.8712 { c ala B 57 2bo9B_56F_70C}P -6.3425 0.8861 -9.7386 { n val B 58 2bo9B_56F_70C}-7.0714 1.5498 -10.6402 { ca val B 58 2bo9B_56F_70C}-7.3901 0.9689 -11.9395 { c val B 58 2bo9B_56F_70C}-6.8193 1.8066 -13.0663 { o val B 58 2bo9B_56F_70C}-6.5539 2.9928 -12.8889 { n val B 68 2bo9B_56F_70C}P -6.9525 5.9372 -12.0346 {"}-6.9525 5.9372 -12.0346 { ca val B 68 2bo9B_56F_70C}-7.7193 6.4764 -10.9278 { c val B 68 2bo9B_56F_70C}-7.8698 5.4677 -9.796 { o val B 68 2bo9B_56F_70C}-7.8333 4.2463 -10.0141 { c val B 68 2bo9B_56F_70C}P -7.8698 5.4677 -9.796 { n asn B 69 2bo9B_56F_70C}-8.0361 5.9834 -8.5841 { ca asn B 69 2bo9B_56F_70C}-8.343 5.1347 -7.4445 { c asn B 69 2bo9B_56F_70C}-9.8269 4.8841 -7.3291 { o asn B 69 2bo9B_56F_70C}-10.6514 5.7319 -7.689 { c asn B 69 2bo9B_56F_70C}P -9.8269 4.8841 -7.3291 { n cys B 70 2bo9B_56F_70C}-10.1479 3.7173 -6.7939 { ca 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56 2bo9B_56F_70C}P -7.3752 -0.0644 -5.4323 { n ala B 57 2bo9B_56F_70C}P -6.1707 0.8076 -7.3327 { ca ala B 57 2bo9B_56F_70C}P -5.9335 1.6518 -8.4948 { n val B 58 2bo9B_56F_70C}P -7.0714 1.5498 -10.6402 { ca val B 58 2bo9B_56F_70C}P -7.3901 0.9689 -11.9395 { n val B 68 2bo9B_56F_70C}P -6.9525 5.9372 -12.0346 { ca val B 68 2bo9B_56F_70C}P -7.7193 6.4764 -10.9278 { n asn B 69 2bo9B_56F_70C}P -8.0361 5.9834 -8.5841 { ca asn B 69 2bo9B_56F_70C}P -8.343 5.1347 -7.4445 { n cys B 70 2bo9B_56F_70C}P -10.1479 3.7173 -6.7939 { ca cys B 70 2bo9B_56F_70C}P -11.5076 3.2689 -6.6395 { n thr B 71 2bo9B_56F_70C}P -12.7867 2.9 -4.6176 { ca thr B 71 2bo9B_56F_70C}P -13.1602 2.2252 -3.383 { n ala B 72 2bo9B_56F_70C}P -14.2499 0.0648 -3.2224 { ca ala B 72 2bo9B_56F_70C}P -15.3585 -0.8508 -3.4486 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu B 54 2bo9B_56F_70C}P -11.0876 -2.4006 -0.952 {"}-11.0876 -2.4006 -0.952 { ca lys B 55 2bo9B_56F_70C}-9.0852 0.5659 -2.122 { ca phe B 56 2bo9B_56F_70C}-7.3752 -0.0644 -5.4323 { ca ala B 57 2bo9B_56F_70C}-5.9335 1.6518 -8.4948 { ca val B 58 2bo9B_56F_70C}-7.3901 0.9689 -11.9395 { ca val B 68 2bo9B_56F_70C}P -7.7193 6.4764 -10.9278 {"}-7.7193 6.4764 -10.9278 { ca asn B 69 2bo9B_56F_70C}-8.343 5.1347 -7.4445 { ca cys B 70 2bo9B_56F_70C}-11.5076 3.2689 -6.6395 { ca thr B 71 2bo9B_56F_70C}-13.1602 2.2252 -3.383 { ca ala B 72 2bo9B_56F_70C}-15.3585 -0.8508 -3.4486 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe B 56 2bo9B_56F_70C}P -7.3752 -0.0644 -5.4323 { cb phe B 56 2bo9B_56F_70C}-7.8004 -1.464 -5.9212 { cg phe B 56 2bo9B_56F_70C}-9.2156 -1.5378 -6.4374 { cd1 phe B 56 2bo9B_56F_70C}-9.4747 -1.4721 -7.7994 { ce1 phe B 56 2bo9B_56F_70C}-10.7851 -1.5459 -8.2885 { cz phe B 56 2bo9B_56F_70C}-11.8547 -1.6734 -7.4075 { cg phe B 56 2bo9B_56F_70C}P -9.2156 -1.5378 -6.4374 { cd2 phe B 56 2bo9B_56F_70C}-10.2851 -1.6875 -5.5598 { ce2 phe B 56 2bo9B_56F_70C}-11.6096 -1.7454 -6.0427 { cz phe B 56 2bo9B_56F_70C}ghost -11.8547 -1.6734 -7.4075 { ca cys B 70 2bo9B_56F_70C}P -11.5076 3.2689 -6.6395 { cb cys B 70 2bo9B_56F_70C}-11.829 2.2242 -7.7152 { sg cys B 70 2bo9B_56F_70C}-13.5855 1.8123 -7.768 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe B 56 2bo9B_56F_70C}P -7.8004 -1.464 -5.9212 {"}P -7.8004 -1.464 -5.9212 { cd1 phe B 56 2bo9B_56F_70C}P -9.4747 -1.4721 -7.7994 { cd2 phe B 56 2bo9B_56F_70C}P -10.2851 -1.6875 -5.5598 { ce1 phe B 56 2bo9B_56F_70C}P -10.7851 -1.5459 -8.2885 { ce2 phe B 56 2bo9B_56F_70C}P -11.6096 -1.7454 -6.0427 { cz phe B 56 2bo9B_56F_70C}P -11.8547 -1.6734 -7.4075 { cb cys B 70 2bo9B_56F_70C}P -11.829 2.2242 -7.7152 {"}P -11.829 2.2242 -7.7152 { sg cys B 70 2bo9B_56F_70C}P -13.5855 1.8123 -7.768 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 56 B}'S' blue -10.2735 0.0441 -7.4447 {"}'S' blue -10.172 0.1297 -7.6964 { CE1 PHE 56 B}'S' sky -11.4825 0.0558 -8.1855 {"}'S' sky -10.6172 -0.0287 -7.433 {"}'S' sky -11.358 0.1016 -8.4274 {"}'S' blue -10.4146 0.0196 -7.5995 {"}'S' sky -11.014 0.1844 -8.4204 {"}'S' blue -10.3675 0.1289 -7.9975 {"}'S' sky -10.5165 0.1819 -8.2048 {"}'S' blue -10.6734 0.1962 -8.4122 { CZ PHE 56 B}'S' blue -12.8163 -0.2199 -7.2456 {"}'S' blue -12.9749 -0.329 -7.4205 {"}'S' blue -12.552 -0.0717 -7.3045 {"}'S' blue -12.7127 -0.1501 -7.4891 {"}'S' blue -12.8678 -0.2687 -7.6569 {"}'S' blue -12.2667 0.0267 -7.3539 {"}'S' blue -12.4275 -0.0259 -7.5464 {"}'S' blue -12.5848 -0.1156 -7.7255 {"}'S' blue -12.738 -0.2411 -7.8874 {"}'S' sky -11.6185 -0.0094 -6.9194 {"}'S' sky -11.9219 0.0744 -7.3344 {"}'S' sky -12.0835 0.0569 -7.5393 {"}'S' blue -12.2474 0.0003 -7.735 {"}'S' blue -12.4085 -0.0935 -7.9168 {"}'S' blue -11.2991 -0.0896 -6.914 {"}'S' sky -11.9051 0.0453 -7.7338 {"}'S' blue -11.0911 -0.1364 -7.065 {"}'S' sky -11.6962 0.0026 -7.8862 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 56 B}'S' sea -10.8829 -0.0536 -7.3803 {"}'S' green -11.0183 0.0366 -7.5791 {"}'S' green -11.1662 0.0864 -7.7841 {"}'S' green -11.3221 0.092 -7.9882 {"}'S' sea -10.7452 0.0742 -7.628 {"}'S' green -10.8876 0.1401 -7.8309 {"}'S' green -11.0395 0.1673 -8.0344 {"}'S' sea -11.1972 0.1541 -8.235 {"}'S' sea -10.549 0.1181 -7.8005 {"}'S' sea -10.6958 0.1788 -8.0081 {"}'S' sea -10.8524 0.2018 -8.2155 { CZ PHE 56 B}'S' sea -11.7653 0.0514 -7.1271 {"}'S' sea -11.437 0.0014 -7.1164 {"}'S' green -11.5861 0.0545 -7.3237 {"}'S' sea -11.743 0.0688 -7.5312 {"}'S' sea -11.2282 -0.0455 -7.2681 {"}'S' green -11.3769 0.0083 -7.4749 {"}'S' sea -11.5345 0.0256 -7.6824 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 70 B}'S' blue -12.1441 0.5264 -7.4337 {"}'S' blue -12.1026 0.4981 -7.8062 { HB3 CYS 70 B}'S' sky -11.9622 0.4014 -7.3548 {"}'S' sky -11.8149 0.3584 -7.1522 {"}'S' blue -11.6576 0.3763 -6.9532 {"}'S' sky -11.8824 0.3375 -7.643 {"}'S' sky -11.4338 0.2607 -7.043 {"}'S' sky -11.7214 0.2962 -7.8561 {"}'S' sky -11.1292 0.2367 -7.0741 {"}'S' sky -11.5921 0.3816 -8.1431 {"}'S' blue -10.8696 0.2597 -7.1757 {"}'S' blue -11.4018 0.4848 -8.3372 {"}'S' sky -10.7076 0.282 -7.3831 {"}'S' sky -10.608 0.337 -7.6372 {"}'S' blue -10.4508 0.4554 -7.4664 {"}'S' sky -10.8248 0.52 -8.2761 {"}'S' sky -10.6876 0.445 -8.0766 {"}'S' sky -10.5313 0.4558 -7.8774 {"}'S' blue -10.3752 0.5512 -7.7028 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 CYS 70 B}'S' sea -11.7451 0.256 -7.4435 {"}'S' sea -11.5931 0.2302 -7.2402 {"}'S' sea -11.5907 0.2018 -7.661 {"}'S' green -11.4434 0.1602 -7.4587 {"}'S' sea -11.2879 0.1722 -7.2608 {"}'S' sea -11.4759 0.2498 -7.9577 {"}'S' green -11.3394 0.1684 -7.7576 {"}'S' green -11.187 0.1434 -7.5539 {"}'S' sea -11.0276 0.1739 -7.3567 {"}'S' sea -11.2992 0.3321 -8.1621 {"}'S' green -11.1707 0.2313 -7.967 {"}'S' green -11.0235 0.1883 -7.7644 {"}'S' green -10.8653 0.206 -7.5659 {"}'S' sea -11.0619 0.4072 -8.2429 {"}'S' green -10.927 0.3123 -8.042 {"}'S' green -10.7712 0.2881 -7.8338 @dotlist {x} color= yellow width= 1 master= {vdw contact} { SG CYS 70 B}'S' blue -13.1429 0.0802 -7.5555 {"}'S' blue -12.9863 0.1608 -7.3752 {"}'S' blue -12.8339 0.2747 -7.21 {"}'S' blue -13.0942 0.0852 -7.8916 {"}'S' blue -12.933 0.1357 -7.6982 {"}'S' blue -12.7745 0.225 -7.5173 {"}'S' blue -12.62 0.3501 -7.3536 {"}'S' blue -12.8862 0.1733 -8.0222 {"}'S' blue -12.726 0.2315 -7.8302 {"}'S' blue -12.568 0.3314 -7.6542 {"}'S' blue -12.4175 0.4695 -7.4987 {"}'S' blue -12.5473 0.3567 -7.9751 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 56 B}'M' greentint -9.0734 2.4428 -6.0171 {"}'M' greentint -9.2367 2.4094 -6.2189 {"}'M' greentint -9.3853 2.2525 -6.3674 {"}'M' greentint -9.489 2.1562 -6.6649 {"}'M' greentint -8.9295 2.6479 -6.0791 {"}'M' greentint -9.0875 2.6396 -6.2811 {"}'M' greentint -9.2461 2.5464 -6.4595 {"}'M' greentint -9.3853 2.3785 -6.5927 {"}'M' greentint -9.4586 2.2502 -6.9097 {"}'M' greentint -8.7444 2.818 -6.1451 {"}'M' greentint -8.9005 2.8287 -6.3489 {"}'M' greentint -9.0607 2.7705 -6.5409 {"}'M' greentint -9.2155 2.6474 -6.7056 {"}'M' greentint -9.3512 2.4698 -6.8318 {"}'M' greentint -8.6573 2.9721 -6.391 {"}'M' greentint -8.8177 2.9487 -6.593 {"}'M' greentint -8.9798 2.8665 -6.7787 {"}'M' greentint -9.1321 2.7306 -6.9387 {"}'M' greentint -9.2687 2.549 -7.0635 {"}'M' greentint -8.5638 3.0626 -6.6598 {"}'M' greentint -8.7229 3.0115 -6.852 {"}'M' greentint -8.8787 2.9128 -7.0253 {"}'M' greentint -9.0249 2.7692 -7.1752 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H CYS 70 B}'M' greentint -9.4722 2.0762 -6.6169 {"}'M' greentint -9.3179 2.0755 -6.4177 {"}'M' greentint -9.1597 2.1392 -6.2314 {"}'M' greentint -9.0095 2.2637 -6.0716 {"}'M' greentint -8.8763 2.4393 -5.9485 {"}'M' greentint -9.4087 2.2075 -6.9718 {"}'M' greentint -9.2673 2.1345 -6.7688 {"}'M' greentint -9.1091 2.1367 -6.565 {"}'M' greentint -8.9485 2.2127 -6.3782 {"}'M' greentint -8.7989 2.358 -6.2258 {"}'M' greentint -8.6744 2.558 -6.1199 {"}'M' greentint -8.5858 2.7956 -6.0719 {"}'M' greentint -9.2803 2.4342 -7.212 {"}'M' greentint -9.1642 2.2972 -7.0238 {"}'M' greentint -9.0154 2.2475 -6.8177 {"}'M' greentint -8.8531 2.2924 -6.6198 {"}'M' greentint -8.6989 2.4251 -6.458 {"}'M' greentint -8.5746 2.6284 -6.3534 {"}'M' greentint -8.4963 2.8741 -6.3213 {"}'M' greentint -9.0362 2.5327 -7.1863 {"}'M' greentint -8.9044 2.431 -6.9881 {"}'M' greentint -8.7434 2.4591 -6.7882 {"}'M' greentint -8.5954 2.611 -6.6393 {"}'M' greentint -8.5006 2.8451 -6.582 {"}'M' greentint -8.8751 2.804 -7.2195 {"}'M' greentint -8.7709 2.6488 -7.0417 {"}'M' greentint -8.611 2.7458 -6.8622 {"}'M' greentint -8.556 2.999 -6.862 {"}'M' greentint -8.6893 2.8954 -7.0615 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 56 B}'M' greentint -9.8169 1.1459 -4.1192 {"}'M' greentint -9.9501 1.0423 -4.3186 {"}'M' greentint -9.7352 1.3925 -4.139 {"}'M' greentint -9.8952 1.2956 -4.3184 {"}'M' greentint -10.0055 1.1962 -4.5987 {"}'M' greentint -10.0218 0.9425 -4.5494 {"}'M' greentint -9.6017 1.6103 -4.1925 {"}'M' greentint -9.7627 1.5823 -4.3925 {"}'M' greentint -9.9107 1.4303 -4.5414 {"}'M' greentint -9.9773 1.2937 -4.8523 {"}'M' greentint -10.0277 1.039 -4.8477 {"}'M' greentint -10.019 0.7911 -4.7673 {"}'M' greentint -9.5722 1.7834 -4.4651 {"}'M' greentint -9.7324 1.6923 -4.6479 {"}'M' greentint -9.8738 1.5218 -4.7835 {"}'M' greentint -9.8804 1.3679 -5.0923 {"}'M' greentint -9.9487 1.1189 -5.11 {"}'M' greentint -9.9692 0.8657 -5.0665 {"}'M' greentint -9.4777 1.8757 -4.7125 {"}'M' greentint -9.6343 1.7637 -4.8839 {"}'M' greentint -9.7729 1.589 -5.0147 {"}'M' greentint -9.735 1.3874 -5.3099 {"}'M' greentint -9.8085 1.1477 -5.3368 {"}'M' greentint -9.4967 1.7777 -5.1091 {"}'M' greentint -9.6298 1.6021 -5.2322 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O CYS 70 B}'M' greentint -9.9476 0.8525 -4.477 {"}'M' greentint -9.8073 1.0145 -4.341 {"}'M' greentint -9.6853 1.2111 -4.238 {"}'M' greentint -9.587 1.436 -4.1719 {"}'M' greentint -9.992 0.7919 -4.881 {"}'M' greentint -9.8342 0.9022 -4.7076 {"}'M' greentint -9.6888 1.0639 -4.5646 {"}'M' greentint -9.5642 1.2663 -4.461 {"}'M' greentint -9.4678 1.4994 -4.4011 {"}'M' greentint -9.404 1.7512 -4.3886 {"}'M' greentint -9.9211 0.8941 -5.1338 {"}'M' greentint -9.7614 0.9827 -4.9528 {"}'M' greentint -9.6147 1.1323 -4.8052 {"}'M' greentint -9.4909 1.332 -4.7005 {"}'M' greentint -9.3991 1.5662 -4.6472 {"}'M' greentint -9.3471 1.817 -4.6488 {"}'M' greentint -9.8028 1.0646 -5.2879 {"}'M' greentint -9.6458 1.1605 -5.1105 {"}'M' greentint -9.5073 1.331 -4.979 {"}'M' greentint -9.4044 1.5545 -4.9081 {"}'M' greentint -9.35 1.8042 -4.9078 {"}'M' greentint -9.6642 1.2906 -5.3619 {"}'M' greentint -9.5144 1.4444 -5.2111 {"}'M' greentint -9.4191 1.6807 -5.1536 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val B 378 2buuB_439F_380}P -7.137 6.4388 -11.9603 {"}-7.137 6.4388 -11.9603 { ca val B 378 2buuB_439F_380}-8.1928 6.5524 -10.9481 { c val B 378 2buuB_439F_380}-8.058 5.5073 -9.8281 { o val B 378 2buuB_439F_380}-7.6221 4.3661 -10.045 { c val B 378 2buuB_439F_380}P -8.058 5.5073 -9.8281 { n ile B 379 2buuB_439F_380}-8.43 5.9276 -8.6313 { ca ile B 379 2buuB_439F_380}-8.4377 5.0742 -7.4593 { c ile B 379 2buuB_439F_380}-9.9181 4.8158 -7.209 { o ile B 379 2buuB_439F_380}-10.7186 5.7554 -7.4188 { c ile B 379 2buuB_439F_380}P -9.9181 4.8158 -7.209 { n val B 380 2buuB_439F_380}-10.285 3.5944 -6.7875 { ca val B 380 2buuB_439F_380}-11.694 3.2907 -6.4532 { c val B 380 2buuB_439F_380}-11.5791 2.6866 -5.0441 { o val B 380 2buuB_439F_380}-10.6663 1.9087 -4.7809 { c val B 380 2buuB_439F_380}P -11.5791 2.6866 -5.0441 { n his B 381 2buuB_439F_380}-12.4424 3.0966 -4.1183 { ca his B 381 2buuB_439F_380}-12.3978 2.5606 -2.7594 { c his B 381 2buuB_439F_380}-13.8333 2.6347 -2.2279 { o his B 381 2buuB_439F_380}-14.7005 3.3015 -2.8136 { c his B 381 2buuB_439F_380}P -13.8333 2.6347 -2.2279 { n gly B 382 2buuB_439F_380}-14.0495 1.9568 -1.1042 { ca gly B 382 2buuB_439F_380}-15.3508 1.9761 -0.5033 { c gly B 382 2buuB_439F_380}-15.399 0.9178 0.5643 { o gly B 382 2buuB_439F_380}-14.3548 0.3625 0.9477 { n tyr B 437 2buuB_439F_380}P -12.0593 -1.435 1.059 {"}-12.0593 -1.435 1.059 { ca tyr B 437 2buuB_439F_380}-11.1796 -1.9829 0.0076 { c tyr B 437 2buuB_439F_380}-10.7188 -0.7923 -0.8339 { o tyr B 437 2buuB_439F_380}-11.3813 0.2589 -0.8429 { c tyr B 437 2buuB_439F_380}P -10.7188 -0.7923 -0.8339 { n val B 438 2buuB_439F_380}-9.6027 -0.948 -1.5526 { ca val B 438 2buuB_439F_380}-9.0697 0.1258 -2.4106 { c val B 438 2buuB_439F_380}-8.233 -0.5317 -3.5195 { o val B 438 2buuB_439F_380}-7.5083 -1.4904 -3.2705 { c val B 438 2buuB_439F_380}P -8.233 -0.5317 -3.5195 { n phe B 439 2buuB_439F_380}-8.3733 -0.0446 -4.7402 { ca phe B 439 2buuB_439F_380}-7.5621 -0.5188 -5.8541 { c phe B 439 2buuB_439F_380}-7.3416 0.6807 -6.8039 { o phe B 439 2buuB_439F_380}-7.9951 1.7218 -6.6702 { c phe B 439 2buuB_439F_380}P -7.3416 0.6807 -6.8039 { n arg B 440 2buuB_439F_380}-6.3684 0.5787 -7.6908 { ca arg B 440 2buuB_439F_380}-6.1231 1.683 -8.5799 { c arg B 440 2buuB_439F_380}-6.2028 1.0879 -9.9679 { o arg B 440 2buuB_439F_380}-5.8123 -0.0802 -10.1467 { c arg B 440 2buuB_439F_380}P -6.2028 1.0879 -9.9679 { n thr B 441 2buuB_439F_380}-6.6363 1.8907 -10.9487 { ca thr B 441 2buuB_439F_380}-6.7501 1.3933 -12.2895 { c thr B 441 2buuB_439F_380}-6.7695 2.5235 -13.3071 { o thr B 441 2buuB_439F_380}-6.5051 3.6464 -12.9696 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val B 378 2buuB_439F_380}P -7.137 6.4388 -11.9603 { ca val B 378 2buuB_439F_380}P -8.1928 6.5524 -10.9481 { n ile B 379 2buuB_439F_380}P -8.43 5.9276 -8.6313 { ca ile B 379 2buuB_439F_380}P -8.4377 5.0742 -7.4593 { n val B 380 2buuB_439F_380}P -10.285 3.5944 -6.7875 { ca val B 380 2buuB_439F_380}P -11.694 3.2907 -6.4532 { n his B 381 2buuB_439F_380}P -12.4424 3.0966 -4.1183 { ca his B 381 2buuB_439F_380}P -12.3978 2.5606 -2.7594 { n gly B 382 2buuB_439F_380}P -14.0495 1.9568 -1.1042 { ca gly B 382 2buuB_439F_380}P -15.3508 1.9761 -0.5033 {"}P -15.3508 1.9761 -0.5033 { n tyr B 437 2buuB_439F_380}P -12.0593 -1.435 1.059 { ca tyr B 437 2buuB_439F_380}P -11.1796 -1.9829 0.0076 { n val B 438 2buuB_439F_380}P -9.6027 -0.948 -1.5526 { ca val B 438 2buuB_439F_380}P -9.0697 0.1258 -2.4106 { n phe B 439 2buuB_439F_380}P -8.3733 -0.0446 -4.7402 { ca phe B 439 2buuB_439F_380}P -7.5621 -0.5188 -5.8541 { n arg B 440 2buuB_439F_380}P -6.3684 0.5787 -7.6908 { ca arg B 440 2buuB_439F_380}P -6.1231 1.683 -8.5799 { n thr B 441 2buuB_439F_380}P -6.6363 1.8907 -10.9487 { ca thr B 441 2buuB_439F_380}P -6.7501 1.3933 -12.2895 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val B 378 2buuB_439F_380}P -8.1928 6.5524 -10.9481 {"}-8.1928 6.5524 -10.9481 { ca ile B 379 2buuB_439F_380}-8.4377 5.0742 -7.4593 { ca val B 380 2buuB_439F_380}-11.694 3.2907 -6.4532 { ca his B 381 2buuB_439F_380}-12.3978 2.5606 -2.7594 { ca gly B 382 2buuB_439F_380}-15.3508 1.9761 -0.5033 { ca tyr B 437 2buuB_439F_380}P -11.1796 -1.9829 0.0076 {"}-11.1796 -1.9829 0.0076 { ca val B 438 2buuB_439F_380}-9.0697 0.1258 -2.4106 { ca phe B 439 2buuB_439F_380}-7.5621 -0.5188 -5.8541 { ca arg B 440 2buuB_439F_380}-6.1231 1.683 -8.5799 { ca thr B 441 2buuB_439F_380}-6.7501 1.3933 -12.2895 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val B 380 2buuB_439F_380}P -11.694 3.2907 -6.4532 { cb val B 380 2buuB_439F_380}-12.331 2.2389 -7.3982 { cg1 val B 380 2buuB_439F_380}-13.7801 1.8576 -6.8977 { cb val B 380 2buuB_439F_380}P -12.331 2.2389 -7.3982 { cg2 val B 380 2buuB_439F_380}-12.4089 2.8158 -8.8308 { ca phe B 439 2buuB_439F_380}P -7.5621 -0.5188 -5.8541 { cb phe B 439 2buuB_439F_380}-8.1868 -1.7454 -6.5903 { cg phe B 439 2buuB_439F_380}-9.4241 -1.4499 -7.373 { cd1 phe B 439 2buuB_439F_380}-10.664 -1.5627 -6.7914 { ce1 phe B 439 2buuB_439F_380}-11.8229 -1.4868 -7.5622 { cz phe B 439 2buuB_439F_380}-11.7826 -1.2949 -8.8923 { cg phe B 439 2buuB_439F_380}P -9.4241 -1.4499 -7.373 { cd2 phe B 439 2buuB_439F_380}-9.3649 -1.2365 -8.7506 { ce2 phe B 439 2buuB_439F_380}-10.5413 -1.1581 -9.522 { cz phe B 439 2buuB_439F_380}ghost -11.7826 -1.2949 -8.8923 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val B 380 2buuB_439F_380}P -12.331 2.2389 -7.3982 { cg1 val B 380 2buuB_439F_380}P -13.7801 1.8576 -6.8977 {"}P -13.7801 1.8576 -6.8977 {"}P -13.7801 1.8576 -6.8977 { cg2 val B 380 2buuB_439F_380}P -12.4089 2.8158 -8.8308 {"}P -12.4089 2.8158 -8.8308 {"}P -12.4089 2.8158 -8.8308 { cb phe B 439 2buuB_439F_380}P -8.1868 -1.7454 -6.5903 {"}P -8.1868 -1.7454 -6.5903 { cd1 phe B 439 2buuB_439F_380}P -10.664 -1.5627 -6.7914 { cd2 phe B 439 2buuB_439F_380}P -9.3649 -1.2365 -8.7506 { ce1 phe B 439 2buuB_439F_380}P -11.8229 -1.4868 -7.5622 { ce2 phe B 439 2buuB_439F_380}P -10.5413 -1.1581 -9.522 { cz phe B 439 2buuB_439F_380}P -11.7826 -1.2949 -8.8923 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 439 B}'S' sky -11.3614 0.039 -6.6884 {"}'S' sky -11.0761 0.1373 -6.7378 {"}'S' sky -10.8928 0.1676 -6.9232 {"}'S' blue -10.7145 0.156 -7.1177 {"}'S' sky -10.8781 0.0945 -7.3119 { CE1 PHE 439 B}'S' blue -12.8563 -0.1367 -7.1467 {"}'S' blue -12.6217 0.0293 -7.2074 {"}'S' blue -12.7845 -0.0333 -7.4003 {"}'S' sky -12.5202 0.1149 -7.4591 { CZ PHE 439 B}'S' sky -12.2673 0.202 -8.1262 {"}'S' blue -12.4203 0.2362 -8.3345 {"}'S' sky -12.1636 0.3375 -8.3879 {"}'S' blue -12.0369 0.4183 -8.6382 {"}'S' sky -11.6932 0.4299 -8.6119 {"}'S' blue -11.1046 0.1643 -8.2048 {"}'S' blue -11.227 0.2889 -8.3987 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 439 B}'S' sea -11.2369 0.0848 -6.9303 {"}'S' sea -11.0567 0.1109 -7.1189 { CE1 PHE 439 B}'S' sea -12.056 0.0957 -6.8528 {"}'S' sea -12.204 0.1456 -7.0577 {"}'S' sea -12.3598 0.1511 -7.2618 {"}'S' green -11.7829 0.1333 -6.9016 {"}'S' green -11.9254 0.1992 -7.1045 {"}'S' green -12.0773 0.2264 -7.3081 {"}'S' green -12.2349 0.2132 -7.5086 {"}'S' sea -12.3958 0.1607 -7.701 {"}'S' sea -11.4524 0.0788 -6.8731 {"}'S' green -11.5867 0.1772 -7.0741 {"}'S' green -12.0517 0.2435 -7.694 {"}'S' sea -12.2156 0.1868 -7.8897 {"}'S' sea -11.2673 0.097 -7.0686 {"}'S' green -11.4052 0.188 -7.2711 {"}'S' green -11.8734 0.2319 -7.8884 {"}'S' green -11.1964 0.1411 -7.4227 {"}'S' green -11.3451 0.1949 -7.6296 {"}'S' green -11.5027 0.2122 -7.837 {"}'S' sea -11.1318 0.1085 -7.7575 {"}'S' sea -11.2876 0.1299 -7.9652 { CZ PHE 439 B}'S' sea -12.0157 0.2877 -8.1829 {"}'S' green -11.6146 0.2223 -8.0368 {"}'S' green -11.7426 0.3253 -8.2317 {"}'S' sea -11.885 0.3912 -8.4346 {"}'S' sea -11.2933 0.137 -8.0122 {"}'S' sea -11.412 0.2707 -8.2032 {"}'S' sea -11.5464 0.3691 -8.4042 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 439 B}'S' P -11.7335 0.238 -7.2818 {"}'S' -11.7356 0.2039 -7.2871 {"}'S' P -11.8901 0.2609 -7.4891 {"}'S' -11.8882 0.2216 -7.4912 {"}'S' P -11.5543 0.241 -7.4784 {"}'S' -11.5595 0.2092 -7.4799 {"}'S' P -11.7112 0.2553 -7.6859 {"}'S' -11.7133 0.2277 -7.6841 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 380 B}'S' blue -12.6046 0.5127 -7.4892 {"}'S' blue -12.4904 0.538 -7.7763 {"}'S' blue -12.3747 0.6213 -8.0644 {"}'S' blue -12.2898 0.8017 -8.3963 { CG1 VAL 380 B}'S' blue -13.1583 0.2336 -7.092 {"}'S' blue -12.9968 0.2925 -6.9002 {"}'S' blue -13.0671 0.3273 -7.3596 {"}'S' blue -12.905 0.3653 -7.1603 {"}'S' blue -12.7436 0.4504 -6.9746 {"}'S' blue -12.8227 0.4831 -7.4046 { HB VAL 380 B}'S' sky -12.4237 0.4225 -7.2299 {"}'S' sky -11.7368 0.3683 -6.7367 {"}'S' sky -12.2917 0.458 -7.9103 {"}'S' sky -12.1413 0.5788 -8.1817 {"}'S' sky -11.181 0.4166 -6.8955 {"}'S' sky -11.9343 0.7023 -8.3577 {"}'S' sky -11.0186 0.4345 -7.0997 {"}'S' blue -11.6916 0.7959 -8.4386 {"}'S' blue -10.9123 0.4765 -7.3416 {"}'S' blue -11.3889 0.6939 -8.3263 {"}'S' sky -11.2863 0.5411 -8.1512 {"}'S' sky -11.1492 0.4661 -7.9517 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 380 B}'S' sea -12.2765 0.3794 -7.0274 {"}'S' sea -12.3439 0.3586 -7.5181 {"}'S' green -12.2066 0.2771 -7.3186 {"}'S' green -12.0546 0.2513 -7.1153 {"}'S' green -11.8953 0.2818 -6.9181 {"}'S' green -12.1829 0.3173 -7.7312 {"}'S' green -11.5907 0.2577 -6.9492 {"}'S' sea -12.0536 0.4026 -8.0183 {"}'S' green -11.9374 0.2709 -7.8328 {"}'S' sea -11.3311 0.2807 -7.0508 {"}'S' sea -11.8633 0.5059 -8.2123 {"}'S' green -11.7607 0.3531 -8.0372 {"}'S' green -11.6322 0.2524 -7.8421 {"}'S' green -11.3268 0.2271 -7.4411 {"}'S' sea -11.1691 0.3031 -7.2582 {"}'S' sea -11.6271 0.587 -8.2959 {"}'S' sea -11.5234 0.4282 -8.118 {"}'S' sea -11.3885 0.3334 -7.9171 {"}'S' green -11.2327 0.3092 -7.7089 {"}'S' sea -11.0695 0.3581 -7.5123 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 380 B}'S' P -12.0522 0.2229 -7.5361 {"}'S' -12.0485 0.2348 -7.5338 {"}'S' P -11.9049 0.1813 -7.3338 {"}'S' -11.9002 0.213 -7.3364 {"}'S' P -11.7494 0.1932 -7.136 {"}'S' -11.7492 0.2002 -7.1373 {"}'S' P -11.8009 0.1895 -7.6328 {"}'S' -11.7975 0.2245 -7.6259 {"}'S' P -11.6485 0.1645 -7.429 {"}'S' -11.6512 0.2064 -7.4286 {"}'S' P -11.4891 0.195 -7.2318 {"}'S' -11.4903 0.1971 -7.2322 {"}'S' P -11.485 0.2093 -7.6395 {"}'S' -11.4863 0.2182 -7.6382 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 439 B}'M' greentint -9.3108 2.0065 -6.2863 {"}'M' greentint -9.0685 2.4021 -6.083 {"}'M' greentint -9.2171 2.2452 -6.2315 {"}'M' greentint -9.3208 2.1489 -6.529 {"}'M' greentint -9.3773 1.8994 -6.5322 {"}'M' greentint -8.9192 2.6323 -6.1452 {"}'M' greentint -9.0778 2.5391 -6.3236 {"}'M' greentint -9.2171 2.3712 -6.4568 {"}'M' greentint -9.2904 2.2429 -6.7738 {"}'M' greentint -9.3616 1.9978 -6.798 {"}'M' greentint -8.8925 2.7632 -6.405 {"}'M' greentint -9.0472 2.6401 -6.5697 {"}'M' greentint -9.183 2.4625 -6.6959 {"}'M' greentint -9.2125 2.3231 -7.012 {"}'M' greentint -9.2937 2.0799 -7.0504 {"}'M' greentint -8.8116 2.8592 -6.6428 {"}'M' greentint -8.9638 2.7233 -6.8028 {"}'M' greentint -9.1005 2.5417 -6.9276 {"}'M' greentint -9.098 2.3679 -7.2417 {"}'M' greentint -8.7105 2.9055 -6.8894 {"}'M' greentint -8.8566 2.7619 -7.0393 {"}'M' greentint -8.9874 2.5799 -7.1578 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 380 B}'M' greentint -9.3455 1.9024 -6.4467 {"}'M' greentint -9.1953 2.0268 -6.2869 {"}'M' greentint -9.0622 2.2024 -6.1638 {"}'M' greentint -8.9569 2.4171 -6.086 {"}'M' greentint -9.2949 1.8999 -6.7803 {"}'M' greentint -9.1343 1.9758 -6.5934 {"}'M' greentint -8.9847 2.1212 -6.441 {"}'M' greentint -8.8602 2.3212 -6.3352 {"}'M' greentint -8.7716 2.5588 -6.2872 {"}'M' greentint -8.7271 2.8135 -6.2999 {"}'M' greentint -9.2012 2.0107 -7.033 {"}'M' greentint -9.0389 2.0556 -6.835 {"}'M' greentint -8.8847 2.1882 -6.6733 {"}'M' greentint -8.7604 2.3915 -6.5687 {"}'M' greentint -8.6822 2.6372 -6.5366 {"}'M' greentint -8.6612 2.8926 -6.5799 {"}'M' greentint -9.0903 2.1942 -7.2034 {"}'M' greentint -8.9293 2.2222 -7.0034 {"}'M' greentint -8.7812 2.3742 -6.8546 {"}'M' greentint -8.6864 2.6083 -6.7972 {"}'M' greentint -8.6701 2.862 -6.8466 {"}'M' greentint -8.9568 2.412 -7.2569 {"}'M' greentint -8.7968 2.5089 -7.0775 {"}'M' greentint -8.7418 2.7622 -7.0773 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 439 B}'M' green -9.8112 0.8351 -4.3806 {"}'M' green -10.0162 0.6317 -4.8108 {"}'M' green -9.9431 0.8081 -5.3715 {"}'M' green -9.3408 1.5913 -5.2107 {"}'M' green -9.6242 1.2913 -5.4936 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 439 B}'M' greentint -9.9445 0.7315 -4.5801 {"}'M' greentint -9.7296 1.0817 -4.4005 {"}'M' greentint -9.8895 0.9848 -4.5799 {"}'M' greentint -9.9999 0.8854 -4.8602 {"}'M' greentint -9.5961 1.2995 -4.454 {"}'M' greentint -9.7571 1.2715 -4.654 {"}'M' greentint -9.9051 1.1195 -4.8028 {"}'M' greentint -9.9717 0.9828 -5.1138 {"}'M' greentint -10.0221 0.7282 -5.1091 {"}'M' greentint -9.4077 1.4694 -4.5206 {"}'M' greentint -9.5665 1.4725 -4.7265 {"}'M' greentint -9.7268 1.3815 -4.9094 {"}'M' greentint -9.8682 1.2109 -5.0449 {"}'M' greentint -9.8748 1.0571 -5.3538 {"}'M' greentint -9.3108 1.6041 -4.7761 {"}'M' greentint -9.4721 1.5649 -4.974 {"}'M' greentint -9.6287 1.4529 -5.1454 {"}'M' greentint -9.7673 1.2781 -5.2761 {"}'M' greentint -9.491 1.4669 -5.3705 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 380 B}'M' green -10.0328 0.6665 -4.6518 {"}'M' green -9.6187 1.1457 -4.2499 {"}'M' green -10.088 0.6709 -5.0871 {"}'M' green -9.4011 1.4341 -4.4131 {"}'M' green -10.0137 0.8063 -5.3462 {"}'M' green -9.895 0.9882 -5.5007 {"}'M' green -9.7607 1.1961 -5.5765 {"}'M' green -9.3525 1.6153 -5.1655 {"}'M' green -9.4894 1.5232 -5.434 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 380 B}'M' greentint -9.881 0.7871 -4.4889 {"}'M' greentint -9.7407 0.9491 -4.3529 {"}'M' greentint -9.9254 0.7266 -4.893 {"}'M' greentint -9.7676 0.8368 -4.7195 {"}'M' greentint -9.6222 0.9985 -4.5765 {"}'M' greentint -9.4976 1.2009 -4.4729 {"}'M' greentint -9.8545 0.8287 -5.1457 {"}'M' greentint -9.6947 0.9173 -4.9647 {"}'M' greentint -9.548 1.0669 -4.8171 {"}'M' greentint -9.4243 1.2666 -4.7124 {"}'M' greentint -9.3325 1.5008 -4.6591 {"}'M' greentint -9.7362 0.9992 -5.2998 {"}'M' greentint -9.5792 1.0951 -5.1224 {"}'M' greentint -9.4407 1.2657 -4.9909 {"}'M' greentint -9.3378 1.4891 -4.9201 {"}'M' greentint -9.5976 1.2253 -5.3738 {"}'M' greentint -9.4478 1.379 -5.223 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 7 2bycA_9Y_51Q}P -12.0819 -1.83 0.645 {"}-12.0819 -1.83 0.645 { ca leu A 7 2bycA_9Y_51Q}-11.0302 -2.1361 -0.3428 { c leu A 7 2bycA_9Y_51Q}-10.7632 -0.949 -1.2246 { o 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0.5065 -7.2576 {"}'S' P -12.2622 0.2762 -7.0953 {"}'S' -12.2721 0.4783 -7.0901 {"}'S' P -12.2459 0.3641 -7.5084 {"}'S' -12.2607 0.5753 -7.4213 {"}'S' P -12.0986 0.321 -7.3058 {"}'S' -12.144 0.5488 -7.2575 {"}'S' P -12.0022 0.4451 -7.5834 {"}'S' -12.0584 0.6233 -7.4907 @dotlist {x} color= red width= 1 master= {vdw contact} { OE1 GLN 51 A}'S' sky -14.1446 -0.3551 -7.2309 {"}'S' blue -14.012 -0.17 -7.1107 {"}'S' sky -14.1849 -0.5694 -7.6437 {"}'S' sky -13.6703 0.1515 -7.1784 {"}'S' sky -14.0386 -0.5455 -7.861 {"}'S' sky -13.9312 -0.4854 -8.1022 {"}'S' blue -13.3159 0.7286 -7.6442 {"}'S' sky -13.2764 0.7899 -7.9272 @dotlist {x} color= red width= 1 master= {vdw contact} { OE1 GLN 51 A}'S' sea -14.0333 -0.4412 -7.4829 {"}'S' sea -13.8937 -0.2738 -7.349 {"}'S' sea -13.7712 -0.0736 -7.2461 {"}'S' green -13.8867 -0.4248 -7.6981 {"}'S' green -13.7464 -0.2628 -7.5621 {"}'S' green -13.6245 -0.0662 -7.4591 {"}'S' sea -13.5261 0.1586 -7.3931 {"}'S' sea -13.4534 0.3996 -7.3675 {"}'S' green -13.7733 -0.3752 -7.9287 {"}'S' green -13.628 -0.2134 -7.7857 {"}'S' green -13.5034 -0.011 -7.6821 {"}'S' green -13.4069 0.2221 -7.6223 {"}'S' sea -13.3431 0.4738 -7.6097 {"}'S' green -13.7005 -0.2947 -8.1739 {"}'S' green -13.5538 -0.1451 -8.0263 {"}'S' green -13.4301 0.0547 -7.9216 {"}'S' green -13.3382 0.2888 -7.8683 {"}'S' sea -13.2862 0.5397 -7.8699 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { OE1 GLN 51 A}'S' P -13.758 0.3691 -8.9987 {"}'S' -13.8073 0.3873 -8.9437 {"}'S' P -13.6538 0.2139 -8.8209 {"}'S' -13.67 0.222 -8.8072 {"}'S' P -13.7027 0.6204 -8.9975 {"}'S' -13.7218 0.6218 -8.9779 {"}'S' P -13.5801 0.4618 -8.8349 {"}'S' -13.6089 0.4683 -8.8124 @dotlist {x} color= red width= 1 master= {H-bonds} { OE1 GLN 51 A}'S' greentint -14.3505 0.8782 -9.3403 {"}'S' greentint -14.4234 0.6327 -9.3668 {"}'S' greentint -14.4548 0.3801 -9.3366 {"}'S' greentint -14.4426 0.1372 -9.2525 {"}'S' greentint -14.3875 -0.0765 -9.1217 {"}'S' greentint -14.293 -0.2462 -8.9538 {"}'S' greentint -14.1447 0.7167 -9.287 {"}'S' greentint -14.1983 0.4669 -9.2879 {"}'S' greentint -14.1988 0.2201 -9.2186 {"}'S' greentint -14.1425 0.007 -9.0879 {"}'S' greentint -14.0391 -0.147 -8.9114 {"}'S' greentint -13.9008 -0.2238 -8.7099 {"}'S' greentint -13.7419 -0.2128 -8.509 {"}'S' greentint -13.5849 -0.1169 -8.3316 {"}'S' greentint -13.4465 0.0537 -8.2001 {"}'S' greentint -13.5875 1.2177 -8.7064 {"}'S' greentint -13.7455 1.2065 -8.9079 {"}'S' greentint -13.9033 1.1108 -9.0846 {"}'S' greentint -14.0418 0.9402 -9.2162 {"}'S' greentint -13.9497 0.5518 -9.181 {"}'S' greentint -13.9668 0.2955 -9.1306 {"}'S' greentint -13.8994 0.0876 -8.9859 {"}'S' greentint -13.7665 -0.0159 -8.7857 {"}'S' greentint -13.6033 0.0133 -8.583 {"}'S' greentint -13.4535 0.167 -8.4322 {"}'S' greentint -13.3583 0.4033 -8.3747 {"}'S' greentint -13.3419 0.6598 -8.4245 {"}'S' greentint -13.4093 0.8677 -8.5692 {"}'S' greentint -13.5415 0.9711 -8.7701 {"}'S' greentint -13.7046 0.9419 -8.9727 {"}'S' greentint -13.8544 0.7881 -9.1235 {"}'S' greentint -13.4951 0.3112 -8.6432 {"}'S' greentint -13.4398 0.5625 -8.6421 {"}'S' greentint -13.544 0.7177 -8.8199 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 9 A}'M' green -9.2724 2.2129 -6.0605 {"}'M' green -9.0245 2.7309 -6.1919 {"}'M' green -9.4974 1.8426 -6.8132 {"}'M' green -9.4464 1.9241 -7.0868 {"}'M' green -8.9168 2.9578 -6.6895 {"}'M' green -9.2888 2.2316 -7.333 {"}'M' green -8.9619 2.8605 -7.086 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 9 A}'M' greentint -9.416 2.1051 -6.333 {"}'M' greentint -9.1737 2.5008 -6.1297 {"}'M' greentint -9.3223 2.3438 -6.2782 {"}'M' greentint -9.426 2.2475 -6.5757 {"}'M' greentint -9.4826 1.998 -6.5789 {"}'M' greentint -9.1831 2.6377 -6.3703 {"}'M' greentint -9.3223 2.4698 -6.5035 {"}'M' greentint -9.3956 2.3415 -6.8205 {"}'M' greentint -9.4668 2.0964 -6.8447 {"}'M' greentint -8.9977 2.8618 -6.4517 {"}'M' greentint -9.1525 2.7387 -6.6164 {"}'M' greentint -9.2882 2.5612 -6.7426 {"}'M' greentint -9.3177 2.4217 -7.0587 {"}'M' greentint -9.3989 2.1785 -7.0971 {"}'M' greentint -9.069 2.8219 -6.8495 {"}'M' greentint -9.2057 2.6403 -6.9743 {"}'M' greentint -9.2032 2.4665 -7.2884 {"}'M' greentint -9.0927 2.6785 -7.2045 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLN 51 A}'M' green -9.4642 1.9844 -6.3013 {"}'M' green -9.4702 1.9683 -7.0474 {"}'M' green -9.144 2.6161 -7.2912 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLN 51 A}'M' greentint -9.3311 2.16 -6.1782 {"}'M' greentint -9.2258 2.3746 -6.1004 {"}'M' greentint -9.4032 1.9334 -6.6078 {"}'M' greentint -9.2537 2.0788 -6.4554 {"}'M' greentint -9.1291 2.2787 -6.3496 {"}'M' greentint -9.0405 2.5163 -6.3016 {"}'M' greentint -8.996 2.7711 -6.3143 {"}'M' greentint -9.3078 2.0132 -6.8494 {"}'M' greentint -9.1536 2.1458 -6.6877 {"}'M' greentint -9.0294 2.3491 -6.5831 {"}'M' greentint -8.9511 2.5948 -6.551 {"}'M' greentint -8.9301 2.8502 -6.5943 {"}'M' greentint -9.3592 2.1517 -7.2178 {"}'M' greentint -9.1982 2.1798 -7.0178 {"}'M' greentint -9.0501 2.3317 -6.869 {"}'M' greentint -8.9553 2.5659 -6.8116 {"}'M' greentint -8.939 2.8196 -6.861 {"}'M' greentint -9.2257 2.3696 -7.2713 {"}'M' greentint -9.0657 2.4665 -7.0919 {"}'M' greentint -9.0108 2.7198 -7.0917 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 9 A}'M' green -9.8644 0.9069 -4.2868 {"}'M' green -10.2553 0.6121 -4.875 {"}'M' green -9.5118 1.3549 -4.3839 {"}'M' green -9.5498 1.5845 -4.8403 {"}'M' green -10.0063 1.2585 -5.3403 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 9 A}'M' greentint -10.0503 0.8155 -4.4448 {"}'M' greentint -10.1835 0.7119 -4.6443 {"}'M' greentint -9.9686 1.0621 -4.4646 {"}'M' greentint -10.1286 0.9652 -4.6441 {"}'M' greentint -10.239 0.8658 -4.9243 {"}'M' greentint -9.7034 1.1782 -4.32 {"}'M' greentint -9.8351 1.2799 -4.5182 {"}'M' greentint -9.9961 1.2518 -4.7182 {"}'M' greentint -10.1442 1.0999 -4.867 {"}'M' greentint -10.2107 0.9632 -5.1779 {"}'M' greentint -9.6467 1.4498 -4.5848 {"}'M' greentint -9.8056 1.4529 -4.7907 {"}'M' greentint -9.9658 1.3619 -4.9736 {"}'M' greentint -10.1072 1.1913 -5.1091 {"}'M' greentint -9.7111 1.5453 -5.0382 {"}'M' greentint -9.8678 1.4333 -5.2096 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLN 51 A}'M' green -10.3284 0.6305 -4.716 {"}'M' green -10.1658 0.6862 -4.5218 {"}'M' green -10.0079 0.7965 -4.3484 {"}'M' green -9.8626 0.9582 -4.2054 {"}'M' green -10.2737 1.0247 -5.3311 {"}'M' green -10.134 1.2593 -5.4056 {"}'M' green -9.5928 1.5749 -4.7944 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLN 51 A}'M' greentint -10.254 0.7659 -4.9751 {"}'M' greentint -10.0948 0.7884 -4.7746 {"}'M' greentint -9.9351 0.8769 -4.5936 {"}'M' greentint -9.7884 1.0265 -4.446 {"}'M' greentint -9.6647 1.2263 -4.3413 {"}'M' greentint -10.1354 0.9478 -5.1296 {"}'M' greentint -9.9765 0.9589 -4.9287 {"}'M' greentint -9.8195 1.0547 -4.7513 {"}'M' greentint -9.681 1.2253 -4.6198 {"}'M' greentint -9.5781 1.4488 -4.549 {"}'M' greentint -10.0011 1.1557 -5.2054 {"}'M' greentint -9.8379 1.1849 -5.0027 {"}'M' greentint -9.6881 1.3386 -4.8519 {"}'M' greentint -9.8884 1.3855 -5.2406 {"}'M' greentint -9.7297 1.4829 -5.0629 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 57 2c0zA_121F_59R}P -8.1334 5.7352 -12.256 {"}-8.1334 5.7352 -12.256 { ca val A 57 2c0zA_121F_59R}-9.2866 5.7191 -11.3506 { c val A 57 2c0zA_121F_59R}-8.8137 5.1315 -10.0164 { o val A 57 2c0zA_121F_59R}-8.1856 4.0957 -10.0305 { c val A 57 2c0zA_121F_59R}P -8.8137 5.1315 -10.0164 { n val A 58 2c0zA_121F_59R}-9.0176 5.8305 -8.8997 { ca val A 58 2c0zA_121F_59R}-8.7821 5.2653 -7.5636 { c val A 58 2c0zA_121F_59R}-10.1749 5.1355 -6.958 { o val A 58 2c0zA_121F_59R}-10.9147 6.1196 -6.8729 { c val A 58 2c0zA_121F_59R}P -10.1749 5.1355 -6.958 { n arg A 59 2c0zA_121F_59R}-10.5392 3.9287 -6.5311 { ca arg A 59 2c0zA_121F_59R}-11.8178 3.6621 -5.9159 { c arg A 59 2c0zA_121F_59R}-11.5708 3.1046 -4.5335 { o arg A 59 2c0zA_121F_59R}-10.6485 2.3086 -4.3147 { c arg A 59 2c0zA_121F_59R}P -11.5708 3.1046 -4.5335 { n gly A 60 2c0zA_121F_59R}-12.3738 3.5423 -3.5881 { ca gly A 60 2c0zA_121F_59R}-12.2379 3.0597 -2.2377 { c gly A 60 2c0zA_121F_59R}-12.1705 4.2304 -1.2731 { o gly A 60 2c0zA_121F_59R}-12.4023 5.3712 -1.7102 { c gly A 60 2c0zA_121F_59R}P -12.1705 4.2304 -1.2731 { n ile A 61 2c0zA_121F_59R}-11.8454 4.0098 -0.0008 { ca ile A 61 2c0zA_121F_59R}-11.6573 2.7047 0.6652 { c ile A 61 2c0zA_121F_59R}-13.0083 2.2927 1.2351 { o ile A 61 2c0zA_121F_59R}-13.5573 2.9836 2.0957 { n his A 119 2c0zA_121F_59R}P -11.309 -1.9005 1.3927 {"}-11.309 -1.9005 1.3927 { ca his A 119 2c0zA_121F_59R}-10.7631 -2.2695 0.0938 { c his A 119 2c0zA_121F_59R}-10.7792 -1.0659 -0.8284 { o his A 119 2c0zA_121F_59R}-11.7457 -0.2978 -0.896 { c his A 119 2c0zA_121F_59R}P -10.7792 -1.0659 -0.8284 { n gly A 120 2c0zA_121F_59R}-9.7387 -0.951 -1.6163 { ca gly A 120 2c0zA_121F_59R}-9.663 0.0033 -2.6893 { c gly A 120 2c0zA_121F_59R}-8.7081 -0.4742 -3.7684 { o gly A 120 2c0zA_121F_59R}-7.9893 -1.4684 -3.6049 { c gly A 120 2c0zA_121F_59R}P -8.7081 -0.4742 -3.7684 { n phe A 121 2c0zA_121F_59R}-8.6816 0.2432 -4.8872 { ca phe A 121 2c0zA_121F_59R}-7.7248 -0.0851 -5.9345 { c phe A 121 2c0zA_121F_59R}-7.544 1.0691 -6.8976 { o phe A 121 2c0zA_121F_59R}-8.372 1.9738 -6.9678 { c phe A 121 2c0zA_121F_59R}P -7.544 1.0691 -6.8976 { n cys A 122 2c0zA_121F_59R}-6.4645 0.9799 -7.6659 { ca cys A 122 2c0zA_121F_59R}-6.1433 1.9183 -8.7399 { c cys A 122 2c0zA_121F_59R}-5.8986 1.0852 -10.0078 { o cys A 122 2c0zA_121F_59R}-5.0508 0.2194 -9.9877 { c cys A 122 2c0zA_121F_59R}P -5.8986 1.0852 -10.0078 { n ala A 123 2c0zA_121F_59R}-6.5705 1.3822 -11.1118 { ca ala A 123 2c0zA_121F_59R}-6.267 0.7627 -12.3945 { c ala A 123 2c0zA_121F_59R}-4.9168 1.2489 -12.9224 { o ala A 123 2c0zA_121F_59R}-4.7044 2.4506 -13.0414 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 57 2c0zA_121F_59R}P -8.1334 5.7352 -12.256 { ca val A 57 2c0zA_121F_59R}P -9.2866 5.7191 -11.3506 { n val A 58 2c0zA_121F_59R}P -9.0176 5.8305 -8.8997 { ca val A 58 2c0zA_121F_59R}P -8.7821 5.2653 -7.5636 { n arg A 59 2c0zA_121F_59R}P -10.5392 3.9287 -6.5311 { ca arg A 59 2c0zA_121F_59R}P -11.8178 3.6621 -5.9159 { n gly A 60 2c0zA_121F_59R}P -12.3738 3.5423 -3.5881 { ca gly A 60 2c0zA_121F_59R}P -12.2379 3.0597 -2.2377 {"}P -12.2379 3.0597 -2.2377 { n ile A 61 2c0zA_121F_59R}P -11.8454 4.0098 -0.0008 { ca ile A 61 2c0zA_121F_59R}P -11.6573 2.7047 0.6652 { n his A 119 2c0zA_121F_59R}P -11.309 -1.9005 1.3927 { ca his A 119 2c0zA_121F_59R}P -10.7631 -2.2695 0.0938 { n gly A 120 2c0zA_121F_59R}P -9.7387 -0.951 -1.6163 { ca gly A 120 2c0zA_121F_59R}P -9.663 0.0033 -2.6893 {"}P -9.663 0.0033 -2.6893 { n phe A 121 2c0zA_121F_59R}P -8.6816 0.2432 -4.8872 { ca phe A 121 2c0zA_121F_59R}P -7.7248 -0.0851 -5.9345 { n cys A 122 2c0zA_121F_59R}P -6.4645 0.9799 -7.6659 { ca cys A 122 2c0zA_121F_59R}P -6.1433 1.9183 -8.7399 { n ala A 123 2c0zA_121F_59R}P -6.5705 1.3822 -11.1118 { ca ala A 123 2c0zA_121F_59R}P -6.267 0.7627 -12.3945 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 57 2c0zA_121F_59R}P -9.2866 5.7191 -11.3506 {"}-9.2866 5.7191 -11.3506 { ca val A 58 2c0zA_121F_59R}-8.7821 5.2653 -7.5636 { ca arg A 59 2c0zA_121F_59R}-11.8178 3.6621 -5.9159 { ca gly A 60 2c0zA_121F_59R}-12.2379 3.0597 -2.2377 { ca ile A 61 2c0zA_121F_59R}-11.6573 2.7047 0.6652 { ca his A 119 2c0zA_121F_59R}P -10.7631 -2.2695 0.0938 {"}-10.7631 -2.2695 0.0938 { ca gly A 120 2c0zA_121F_59R}-9.663 0.0033 -2.6893 { ca phe A 121 2c0zA_121F_59R}-7.7248 -0.0851 -5.9345 { ca cys A 122 2c0zA_121F_59R}-6.1433 1.9183 -8.7399 { ca ala A 123 2c0zA_121F_59R}-6.267 0.7627 -12.3945 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 59 2c0zA_121F_59R}P -11.8178 3.6621 -5.9159 { cb arg A 59 2c0zA_121F_59R}-12.6077 2.6173 -6.694 { cg arg A 59 2c0zA_121F_59R}-12.8812 2.9851 -8.1018 { cd arg A 59 2c0zA_121F_59R}-13.8702 2.0524 -8.7553 { ca phe A 121 2c0zA_121F_59R}P -7.7248 -0.0851 -5.9345 { cb phe A 121 2c0zA_121F_59R}-8.1896 -1.3258 -6.7172 { cg phe A 121 2c0zA_121F_59R}-9.4037 -1.0985 -7.5484 { cd1 phe A 121 2c0zA_121F_59R}-10.6662 -1.2253 -7.0064 { ce1 phe A 121 2c0zA_121F_59R}-11.8081 -1.0527 -7.7811 { cz phe A 121 2c0zA_121F_59R}-11.6892 -0.7639 -9.1234 { cg phe A 121 2c0zA_121F_59R}P -9.4037 -1.0985 -7.5484 { cd2 phe A 121 2c0zA_121F_59R}-9.2848 -0.8262 -8.9023 { ce2 phe A 121 2c0zA_121F_59R}-10.4277 -0.6462 -9.6989 { cz phe A 121 2c0zA_121F_59R}ghost -11.6892 -0.7639 -9.1234 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 59 2c0zA_121F_59R}P -12.6077 2.6173 -6.694 {"}P -12.6077 2.6173 -6.694 { cg arg A 59 2c0zA_121F_59R}P -12.8812 2.9851 -8.1018 {"}P -12.8812 2.9851 -8.1018 { cb phe A 121 2c0zA_121F_59R}P -8.1896 -1.3258 -6.7172 {"}P -8.1896 -1.3258 -6.7172 { cd1 phe A 121 2c0zA_121F_59R}P -10.6662 -1.2253 -7.0064 { cd2 phe A 121 2c0zA_121F_59R}P -9.2848 -0.8262 -8.9023 { ce1 phe A 121 2c0zA_121F_59R}P -11.8081 -1.0527 -7.7811 { ce2 phe A 121 2c0zA_121F_59R}P -10.4277 -0.6462 -9.6989 { cz phe A 121 2c0zA_121F_59R}P -11.6892 -0.7639 -9.1234 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 121 A}'S' blue -11.5383 0.1626 -6.3928 {"}'S' blue -11.3039 0.3058 -6.4486 {"}'S' sky -11.465 0.2908 -6.6517 {"}'S' sky -11.2031 0.4126 -6.706 {"}'S' blue -11.0782 0.4748 -6.9528 { CE1 PHE 121 A}'S' sky -12.3836 0.2471 -6.7609 {"}'S' sky -12.5259 0.3175 -6.9628 {"}'S' blue -12.6802 0.3351 -7.1675 {"}'S' sky -12.0307 0.2369 -6.6197 {"}'S' blue -12.6069 0.4634 -7.4264 {"}'S' blue -12.9283 0.2917 -7.7941 {"}'S' blue -12.6661 0.4706 -7.8627 {"}'S' blue -12.8212 0.352 -8.0305 {"}'S' blue -12.9668 0.1978 -8.1755 {"}'S' sky -11.5275 0.3267 -6.7419 {"}'S' sky -12.2201 0.6473 -7.7275 {"}'S' blue -12.5382 0.5051 -8.0991 {"}'S' sky -11.8753 0.695 -7.708 {"}'S' sky -11.2525 0.5311 -7.2876 {"}'S' sky -11.3904 0.6221 -7.49 {"}'S' sky -11.5395 0.6751 -7.6973 { CZ PHE 121 A}'S' sky -12.9148 0.2336 -8.3706 {"}'S' sky -13.0781 0.1373 -8.5548 {"}'S' blue -12.6069 0.4421 -8.2487 {"}'S' sky -13.2152 0.0718 -8.9306 {"}'S' blue -12.407 0.6063 -8.3052 {"}'S' sky -13.166 0.1734 -9.1667 {"}'S' sky -12.327 0.7672 -8.5657 {"}'S' sky -13.0922 0.2423 -9.408 {"}'S' blue -12.0702 0.8685 -8.619 {"}'S' sky -12.2261 0.8741 -8.8231 {"}'S' sky -12.8479 0.4867 -9.5179 {"}'S' blue -12.9801 0.3009 -9.6373 {"}'S' blue -12.1012 0.9362 -9.0698 {"}'S' sky -12.2621 0.8837 -9.2623 {"}'S' sky -12.4193 0.7939 -9.4414 {"}'S' sky -12.5725 0.6684 -9.6033 { HZ PHE 121 A}'S' blue -13.1253 0.179 -9.4816 {"}'S' blue -13.0309 0.2714 -9.729 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 121 A}'S' green -12.1529 0.3632 -6.8121 {"}'S' green -12.2928 0.4441 -7.015 {"}'S' sea -12.4458 0.4783 -7.2233 {"}'S' sea -11.7882 0.3105 -6.6844 {"}'S' green -11.9058 0.4396 -6.8729 {"}'S' green -12.0412 0.5298 -7.0717 {"}'S' green -12.1891 0.5796 -7.2767 {"}'S' sea -12.345 0.5852 -7.4808 {"}'S' green -11.6401 0.4645 -6.9256 {"}'S' green -11.7681 0.5674 -7.1206 {"}'S' green -11.9105 0.6333 -7.3234 {"}'S' green -12.0624 0.6605 -7.527 {"}'S' sea -11.4375 0.5129 -7.092 {"}'S' green -11.5719 0.6113 -7.293 {"}'S' sea -11.7187 0.6721 -7.5007 { CZ PHE 121 A}'S' sea -12.7646 0.4421 -8.4522 {"}'S' sea -12.9254 0.3778 -8.6419 {"}'S' sea -13.0786 0.2506 -8.8052 {"}'S' sea -12.5613 0.624 -8.5098 {"}'S' green -12.7226 0.5862 -8.708 {"}'S' green -12.8812 0.4955 -8.8886 {"}'S' sea -13.0318 0.3561 -9.0438 {"}'S' green -12.488 0.7523 -8.7687 {"}'S' green -12.6508 0.6896 -8.9615 {"}'S' green -12.8094 0.5806 -9.1364 {"}'S' sea -12.9587 0.429 -9.287 {"}'S' sea -12.3865 0.8379 -9.0204 {"}'S' sea -12.5472 0.7594 -9.205 {"}'S' sea -12.7024 0.6408 -9.3729 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD ARG 59 A}'S' blue -13.2329 0.5375 -8.1555 {"}'S' blue -13.0817 0.6847 -8.0011 {"}'S' blue -13.4628 0.352 -8.8152 {"}'S' sky -13.3025 0.4024 -8.6229 {"}'S' sky -13.1444 0.4909 -8.4424 {"}'S' sky -12.9921 0.6151 -8.2797 {"}'S' blue -12.8485 0.7723 -8.1382 {"}'S' sky -13.4074 0.4115 -9.1512 {"}'S' sky -12.6395 0.8966 -8.2944 {"}'S' blue -13.315 0.5338 -9.4236 {"}'S' blue -12.4111 1.1446 -8.425 {"}'S' sky -13.0712 0.6659 -9.4641 {"}'S' blue -12.3306 1.2264 -8.6619 {"}'S' blue -12.9571 0.8475 -9.6366 {"}'S' sky -12.3486 1.2105 -8.951 {"}'S' sky -12.6391 1.0568 -9.501 {"}'S' sky -12.4766 1.1557 -9.3185 { HB2 ARG 59 A}'S' blue -12.6377 0.7936 -7.1884 {"}'S' sky -12.5289 0.6529 -7.0093 {"}'S' sky -12.2509 0.5168 -6.612 {"}'S' blue -12.0954 0.5288 -6.4141 {"}'S' blue -12.4873 0.9143 -7.4599 {"}'S' sky -11.8351 0.5306 -6.5099 {"}'S' blue -11.5151 0.6387 -6.5364 {"}'S' sky -11.4155 0.6937 -6.7905 {"}'S' blue -11.2583 0.8121 -6.6197 {"}'S' sky -11.7349 1.0294 -7.6044 {"}'S' sky -11.3388 0.8124 -7.0306 @dotlist {x} color= white width= 1 master= {vdw contact} { CD ARG 59 A}'S' sea -13.2484 0.4284 -8.9496 {"}'S' sea -13.0869 0.4873 -8.7578 {"}'S' sea -12.929 0.5872 -8.5818 {"}'S' sea -12.778 0.7246 -8.4256 {"}'S' sea -13.1572 0.5221 -9.2172 {"}'S' green -12.995 0.5601 -9.018 {"}'S' green -12.8337 0.6452 -8.8322 {"}'S' green -12.6788 0.7738 -8.6686 {"}'S' sea -12.5361 0.9425 -8.531 {"}'S' green -12.9128 0.6779 -9.2622 {"}'S' green -12.7515 0.7443 -9.0724 {"}'S' green -12.5965 0.8615 -8.9043 {"}'S' sea -12.454 1.0247 -8.7656 {"}'S' sea -12.7999 0.8453 -9.4332 {"}'S' sea -12.6388 0.9076 -9.2426 {"}'S' sea -12.4851 1.0328 -9.0783 { HB2 ARG 59 A}'S' sea -12.3982 0.5585 -6.8143 {"}'S' sea -12.3996 0.7382 -7.2964 {"}'S' green -12.2835 0.6064 -7.111 {"}'S' green -12.1469 0.5251 -6.9109 {"}'S' green -11.9945 0.5001 -6.7072 {"}'S' sea -12.2093 0.8415 -7.4905 {"}'S' green -12.1067 0.6887 -7.3154 {"}'S' green -11.9782 0.588 -7.1202 {"}'S' green -11.831 0.5449 -6.9177 {"}'S' sea -11.6732 0.5619 -6.7196 {"}'S' sea -11.9731 0.9226 -7.5741 {"}'S' green -11.8694 0.7638 -7.3961 {"}'S' green -11.7345 0.669 -7.1952 {"}'S' green -11.5788 0.6447 -6.987 {"}'S' sea -11.6323 0.8767 -7.4293 {"}'S' sea -11.4952 0.8017 -7.2299 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 121 A}'M' green -9.7543 2.1514 -6.8299 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 121 A}'M' greentint -9.3852 2.455 -6.1299 {"}'M' greentint -9.5442 2.3663 -6.3114 {"}'M' greentint -9.6877 2.2585 -6.5839 {"}'M' greentint -9.2822 2.6875 -6.1788 {"}'M' greentint -9.4455 2.6542 -6.3807 {"}'M' greentint -9.5941 2.4973 -6.5292 {"}'M' greentint -9.6978 2.4009 -6.8267 {"}'M' greentint -9.1383 2.8927 -6.2408 {"}'M' greentint -9.2962 2.8843 -6.4428 {"}'M' greentint -9.4548 2.7912 -6.6212 {"}'M' greentint -9.594 2.6232 -6.7544 {"}'M' greentint -9.6674 2.4949 -7.0714 {"}'M' greentint -9.1092 3.0734 -6.5107 {"}'M' greentint -9.2694 3.0152 -6.7027 {"}'M' greentint -9.4242 2.8921 -6.8673 {"}'M' greentint -9.5599 2.7146 -6.9935 {"}'M' greentint -9.5895 2.5751 -7.3097 {"}'M' greentint -9.0261 3.1928 -6.7541 {"}'M' greentint -9.1886 3.1112 -6.9404 {"}'M' greentint -9.3408 2.9753 -7.1004 {"}'M' greentint -9.4774 2.7937 -7.2252 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 59 A}'M' greentint -9.4933 2.3223 -6.22 {"}'M' greentint -9.7512 2.1932 -6.9172 {"}'M' greentint -9.593 2.1954 -6.7134 {"}'M' greentint -9.4323 2.2714 -6.5265 {"}'M' greentint -9.2828 2.4167 -6.3741 {"}'M' greentint -9.1582 2.6167 -6.2683 {"}'M' greentint -9.0696 2.8543 -6.2203 {"}'M' greentint -9.6481 2.3558 -7.1722 {"}'M' greentint -9.4993 2.3062 -6.9661 {"}'M' greentint -9.337 2.3511 -6.7681 {"}'M' greentint -9.1827 2.4837 -6.6064 {"}'M' greentint -9.0585 2.6871 -6.5018 {"}'M' greentint -8.9802 2.9327 -6.4697 {"}'M' greentint -9.52 2.5914 -7.3347 {"}'M' greentint -9.3883 2.4897 -7.1365 {"}'M' greentint -9.2273 2.5177 -6.9365 {"}'M' greentint -9.0793 2.6697 -6.7877 {"}'M' greentint -8.9845 2.9038 -6.7304 {"}'M' greentint -8.9682 3.1575 -6.7797 {"}'M' greentint -9.359 2.8627 -7.3679 {"}'M' greentint -9.2548 2.7075 -7.19 {"}'M' greentint -9.0948 2.8044 -7.0106 {"}'M' greentint -9.0399 3.0577 -7.0104 {"}'M' greentint -9.1731 2.9541 -7.2099 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 121 A}'M' green -10.0178 1.6291 -5.3773 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 121 A}'M' greentint -10.0617 1.1861 -4.4818 {"}'M' greentint -10.195 1.0824 -4.6813 {"}'M' greentint -9.8759 1.2775 -4.3238 {"}'M' greentint -9.9801 1.4326 -4.5016 {"}'M' greentint -10.14 1.3357 -4.6811 {"}'M' greentint -10.2504 1.2363 -4.9613 {"}'M' greentint -9.6482 1.3434 -4.2139 {"}'M' greentint -9.7148 1.5487 -4.357 {"}'M' greentint -9.8466 1.6505 -4.5552 {"}'M' greentint -10.0076 1.6224 -4.7552 {"}'M' greentint -10.1556 1.4705 -4.904 {"}'M' greentint -10.2221 1.3338 -5.2149 {"}'M' greentint -9.5232 1.7255 -4.4209 {"}'M' greentint -9.6581 1.8203 -4.6218 {"}'M' greentint -9.817 1.8235 -4.8277 {"}'M' greentint -9.9773 1.7324 -5.0106 {"}'M' greentint -10.1187 1.5619 -5.1461 {"}'M' greentint -9.4096 1.9195 -4.6722 {"}'M' greentint -9.5613 1.955 -4.8773 {"}'M' greentint -9.7226 1.9159 -5.0752 {"}'M' greentint -9.8792 1.8038 -5.2466 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 59 A}'M' greentint -10.2274 1.0754 -4.8266 {"}'M' greentint -10.0702 1.0708 -4.6209 {"}'M' greentint -9.9076 1.1265 -4.4268 {"}'M' greentint -9.7498 1.2367 -4.2533 {"}'M' greentint -10.1439 1.2532 -5.0845 {"}'M' greentint -9.9959 1.2062 -4.88 {"}'M' greentint -9.8367 1.2286 -4.6795 {"}'M' greentint -9.677 1.3172 -4.4985 {"}'M' greentint -9.5303 1.4668 -4.3509 {"}'M' greentint -10.0156 1.4649 -5.236 {"}'M' greentint -9.8772 1.3881 -5.0345 {"}'M' greentint -9.7184 1.3991 -4.8336 {"}'M' greentint -9.5614 1.495 -4.6563 {"}'M' greentint -9.4229 1.6656 -4.5247 {"}'M' greentint -9.8759 1.6995 -5.3105 {"}'M' greentint -9.7429 1.596 -5.1103 {"}'M' greentint -9.5798 1.6252 -4.9076 {"}'M' greentint -9.43 1.7789 -4.7568 {"}'M' greentint -9.6303 1.8258 -5.1455 {"}'M' greentint -9.4716 1.9231 -4.9679 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 65 2c1sA_67F_80F}P -12.0017 -1.7451 1.1145 {"}-12.0017 -1.7451 1.1145 { ca phe A 65 2c1sA_67F_80F}-10.9537 -2.0516 0.1663 { c phe A 65 2c1sA_67F_80F}-10.7883 -0.9226 -0.8445 { o phe A 65 2c1sA_67F_80F}-11.6568 -0.0544 -0.9737 { c phe A 65 2c1sA_67F_80F}P -10.7883 -0.9226 -0.8445 { n gly A 66 2c1sA_67F_80F}-9.6892 -0.946 -1.5858 { ca gly A 66 2c1sA_67F_80F}-9.4219 0.0755 -2.5557 { c gly A 66 2c1sA_67F_80F}-8.5977 -0.5093 -3.678 { o gly A 66 2c1sA_67F_80F}-7.8889 -1.5232 -3.491 { c gly A 66 2c1sA_67F_80F}P -8.5977 -0.5093 -3.678 { n phe A 67 2c1sA_67F_80F}-8.6633 0.1104 -4.8369 { ca phe A 67 2c1sA_67F_80F}-7.7677 -0.262 -5.9476 { c phe A 67 2c1sA_67F_80F}-7.4197 0.8907 -6.8852 { o phe A 67 2c1sA_67F_80F}-8.1517 1.8567 -6.9902 { c phe A 67 2c1sA_67F_80F}P -7.4197 0.8907 -6.8852 { n thr A 68 2c1sA_67F_80F}-6.3064 0.7222 -7.5961 { ca thr A 68 2c1sA_67F_80F}-5.8756 1.6366 -8.6276 { c thr A 68 2c1sA_67F_80F}-6.0213 0.9933 -9.987 { o thr A 68 2c1sA_67F_80F}-5.6272 -0.1793 -10.1821 { c thr A 68 2c1sA_67F_80F}P -6.0213 0.9933 -9.987 { n val A 69 2c1sA_67F_80F}-6.5946 1.7356 -10.9213 { ca val A 69 2c1sA_67F_80F}-6.6585 1.3014 -12.316 { c val A 69 2c1sA_67F_80F}-5.6947 2.0573 -13.244 { o val A 69 2c1sA_67F_80F}-5.8175 3.2769 -13.4338 { n thr A 78 2c1sA_67F_80F}P -7.1854 6.0779 -12.1903 {"}-7.1854 6.0779 -12.1903 { ca thr A 78 2c1sA_67F_80F}-8.3477 6.1229 -11.2873 { c thr A 78 2c1sA_67F_80F}-8.0687 5.3162 -10.0452 { o thr A 78 2c1sA_67F_80F}-7.4757 4.2348 -10.1191 { c thr A 78 2c1sA_67F_80F}P -8.0687 5.3162 -10.0452 { n val A 79 2c1sA_67F_80F}-8.5393 5.8176 -8.9025 { ca val A 79 2c1sA_67F_80F}-8.5924 5.0184 -7.6871 { c val A 79 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-15.4714 0.9894 -1.1196 {"}P -15.4714 0.9894 -1.1196 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 65 2c1sA_67F_80F}P -10.9537 -2.0516 0.1663 {"}-10.9537 -2.0516 0.1663 { ca gly A 66 2c1sA_67F_80F}-9.4219 0.0755 -2.5557 { ca phe A 67 2c1sA_67F_80F}-7.7677 -0.262 -5.9476 { ca thr A 68 2c1sA_67F_80F}-5.8756 1.6366 -8.6276 { ca val A 69 2c1sA_67F_80F}-6.6585 1.3014 -12.316 { ca thr A 78 2c1sA_67F_80F}P -8.3477 6.1229 -11.2873 {"}-8.3477 6.1229 -11.2873 { ca val A 79 2c1sA_67F_80F}-8.5924 5.0184 -7.6871 { ca phe A 80 2c1sA_67F_80F}-11.7016 3.2918 -6.2998 { ca val A 81 2c1sA_67F_80F}-12.4674 2.7738 -2.64 { ca gly A 82 2c1sA_67F_80F}-15.4714 0.9894 -1.1196 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 67 2c1sA_67F_80F}P -7.7677 -0.262 -5.9476 { cb phe A 67 2c1sA_67F_80F}-8.2651 -1.4966 -6.7335 { cg phe A 67 2c1sA_67F_80F}-9.6357 -1.3501 -7.3535 { cd1 phe A 67 2c1sA_67F_80F}-9.7891 -0.8337 -8.638 { ce1 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-6.7335 { cd1 phe A 67 2c1sA_67F_80F}P -9.7891 -0.8337 -8.638 { cd2 phe A 67 2c1sA_67F_80F}P -10.7712 -1.7901 -6.6587 { ce1 phe A 67 2c1sA_67F_80F}P -11.0421 -0.7242 -9.2068 { ce2 phe A 67 2c1sA_67F_80F}P -12.0331 -1.6953 -7.2379 { cz phe A 67 2c1sA_67F_80F}P -12.1749 -1.1426 -8.4773 { cb phe A 80 2c1sA_67F_80F}P -12.3023 2.1128 -7.0738 {"}P -12.3023 2.1128 -7.0738 { cd1 phe A 80 2c1sA_67F_80F}P -14.0804 2.6911 -8.7407 { cd2 phe A 80 2c1sA_67F_80F}P -11.823 2.4246 -9.5402 { ce1 phe A 80 2c1sA_67F_80F}P -14.4993 2.9669 -10.0478 { ce2 phe A 80 2c1sA_67F_80F}P -12.2452 2.7084 -10.8281 { cz phe A 80 2c1sA_67F_80F}P -13.5889 2.9775 -11.0957 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 67 A}'S' blue -10.6691 -0 -6.938 {"}'S' blue -10.8276 -0.0907 -7.1186 {"}'S' blue -10.4345 0.166 -6.9988 {"}'S' blue -10.5973 0.1034 -7.1916 {"}'S' blue -10.7559 -0.0057 -7.3664 {"}'S' blue -10.333 0.2516 -7.2505 { CD1 PHE 67 A}'S' blue -10.7105 0.0905 -7.4716 {"}'S' sky -10.8517 0.1715 -7.678 {"}'S' sky -10.564 0.3058 -7.5597 {"}'S' blue -10.3647 0.4661 -7.6178 {"}'S' sky -10.5069 0.5365 -7.8198 {"}'S' sky -10.6612 0.5542 -8.0244 { CD2 PHE 67 A}'S' blue -11.1832 -0.0901 -6.6051 {"}'S' sky -11.344 -0.1426 -6.7975 {"}'S' blue -10.8384 -0.0424 -6.5856 {"}'S' sky -11 -0.0598 -6.7905 {"}'S' sky -11.1639 -0.1165 -6.9862 {"}'S' blue -10.8216 -0.0714 -6.9849 {"}'S' blue -10.9852 -0.1329 -7.1792 { CE1 PHE 67 A}'S' sky -11.76 0.646 -8.3885 {"}'S' sky -11.0495 -0.0273 -7.6021 {"}'S' sky -10.7616 0.6553 -8.1675 {"}'S' sky -10.8742 0.7931 -8.3512 {"}'S' blue -10.4157 0.9038 -9.0673 {"}'S' blue -10.351 0.8711 -9.4021 { CE2 PHE 67 A}'S' blue -12.4141 -0.0629 -6.7335 {"}'S' blue -12.57 -0.0573 -6.9376 {"}'S' blue -11.9931 -0.0751 -6.5774 {"}'S' sky -12.1355 -0.0092 -6.7802 {"}'S' sky -12.2874 0.0179 -6.9838 {"}'S' blue -11.6625 -0.1297 -6.5488 {"}'S' sky -11.4775 -0.1115 -6.7444 {"}'S' sky -11.1943 -0.1595 -7.2264 { CZ PHE 67 A}'S' blue -12.6289 0.0352 -7.2648 {"}'S' sky -12.7505 0.1572 -7.4571 {"}'S' sky -12.8927 0.2276 -7.659 {"}'S' blue -12.9737 0.3736 -8.1226 {"}'S' blue -13.1365 0.3109 -8.3154 {"}'S' sky -13.0329 0.3807 -8.5589 {"}'S' sky -12.905 0.4152 -8.7952 {"}'S' sky -12.7288 0.4374 -8.9866 {"}'S' sky -11.9063 0.5853 -8.3935 {"}'S' sky -12.389 0.5147 -8.9978 {"}'S' blue -12.5498 0.4162 -9.1781 { HE1 PHE 67 A}'S' blue -11.7541 0.4724 -10.383 {"}'S' sky -11.4662 0.6109 -10.4483 {"}'S' blue -11.1188 0.6609 -10.4428 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 67 A}'S' sea -10.7068 0.3722 -7.7633 { CE1 PHE 67 A}'S' green -11.3995 0.2865 -7.8239 {"}'S' green -11.4961 0.4537 -7.9943 {"}'S' green -11.6177 0.5757 -8.1865 {"}'S' sea -11.9142 0.6637 -8.5932 {"}'S' sea -12.0755 0.6259 -8.7913 {"}'S' sea -11.094 0.1998 -7.7217 {"}'S' green -11.1659 0.3998 -7.8706 {"}'S' green -11.2648 0.5655 -8.0453 {"}'S' green -11.387 0.6918 -8.2378 {"}'S' green -11.6799 0.8069 -8.649 {"}'S' green -11.8409 0.792 -8.852 {"}'S' 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-10.262 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 67 A}'S' P -11.5791 0.9138 -8.9064 {"}'S' -11.5643 0.8702 -8.9139 {"}'S' P -11.7395 0.8776 -9.1037 {"}'S' -11.7119 0.8134 -9.1077 {"}'S' P -11.9002 0.7992 -9.2884 {"}'S' -11.8746 0.7542 -9.2859 {"}'S' P -11.2965 0.9891 -8.9527 {"}'S' -11.2887 0.9341 -8.9602 {"}'S' P -11.4542 0.9759 -9.1532 {"}'S' -11.4306 0.8753 -9.1561 {"}'S' P -11.615 0.9234 -9.3456 {"}'S' -11.5782 0.8189 -9.3365 {"}'S' P -11.7723 0.8336 -9.5247 {"}'S' -11.74 0.7634 -9.5107 {"}'S' P -11.9255 0.7082 -9.6866 {"}'S' -11.92 0.6985 -9.6838 {"}'S' P -11.1094 1.0236 -9.1337 {"}'S' -11.107 0.9604 -9.1366 {"}'S' P -11.271 1.0062 -9.3386 {"}'S' -11.2575 0.9001 -9.3302 {"}'S' P -11.4349 0.9495 -9.5343 {"}'S' -11.4093 0.842 -9.5125 {"}'S' P -11.596 0.8558 -9.7161 {"}'S' -11.5717 0.7858 -9.6942 {"}'S' P -11.7514 0.726 -9.8818 {"}'S' -11.7487 0.7201 -9.8784 {"}'S' P -10.9305 1.018 -9.3305 {"}'S' -10.9332 0.9826 -9.3278 {"}'S' P -11.0926 0.9946 -9.533 {"}'S' -11.0914 0.9235 -9.5203 {"}'S' P -11.2562 0.9331 -9.7273 {"}'S' -11.2474 0.8648 -9.7064 {"}'S' P -11.4171 0.8346 -9.9075 {"}'S' -11.4096 0.8039 -9.8938 { CZ PHE 67 A}'S' P -11.8943 0.2369 -7.438 {"}'S' -11.894 0.2342 -7.4405 {"}'S' P -12.007 0.3746 -7.6218 {"}'S' -12.0074 0.365 -7.627 {"}'S' P -11.6857 0.2893 -7.5972 {"}'S' -11.6909 0.2725 -7.6074 {"}'S' P -11.8044 0.423 -7.7882 {"}'S' -11.8079 0.4068 -7.7945 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 80 A}'S' sky -12.9839 0.6576 -7.7672 {"}'S' sky -12.862 0.5322 -7.5737 {"}'S' sky -12.7245 0.4404 -7.3717 {"}'S' sky -12.5759 0.3866 -7.1648 {"}'S' blue -12.4186 0.3703 -6.9564 {"}'S' blue -12.2565 0.3924 -6.7536 {"}'S' sky -11.7863 0.8644 -8.1855 { CG PHE 80 A}'S' blue -13.2087 0.749 -8.3928 {"}'S' sky -13.051 0.7346 -8.1859 {"}'S' blue -13.1581 0.76 -8.7653 {"}'S' sky -13.0095 0.7062 -8.5584 {"}'S' sky -12.8953 0.7315 -8.8456 {"}'S' blue -12.7796 0.8149 -9.1337 {"}'S' sky -12.4258 0.8185 -9.0679 { CD2 PHE 80 A}'S' sky -11.6548 0.8787 -10.3434 {"}'S' sky -11.4141 0.9648 -10.4152 { HB2 PHE 80 A}'S' blue -12.1294 0.349 -6.7425 {"}'S' sky -11.7482 0.2514 -6.6333 {"}'S' sky -11.4437 0.2273 -6.6644 {"}'S' sky -11.3421 0.1646 -6.947 {"}'S' sky -11.1841 0.2503 -6.766 {"}'S' blue -11.034 0.3862 -6.6106 {"}'S' sky -11.1797 0.1967 -7.1563 {"}'S' blue -11.022 0.2727 -6.9734 {"}'S' blue -10.8716 0.4041 -6.8149 {"}'S' sky -11.5639 1.0078 -8.2458 {"}'S' sky -11.0857 0.2788 -7.4241 {"}'S' blue -10.9224 0.3277 -7.2275 {"}'S' blue -10.7652 0.4461 -7.0568 {"}'S' sky -11.2973 1.1189 -8.2383 {"}'S' sky -10.8458 0.4464 -7.4677 {"}'S' blue -10.6896 0.5418 -7.2931 {"}'S' sky -10.6874 0.6594 -7.5545 {"}'S' blue -10.726 0.8563 -7.8026 { HD2 PHE 80 A}'S' blue -10.57 1.3409 -8.8654 {"}'S' sky -10.456 1.2673 -9.1269 {"}'S' blue -10.4055 1.2648 -9.4604 @dotlist {x} color= white width= 1 master= {vdw contact} { CB PHE 80 A}'S' sea -12.7305 0.6059 -7.8534 {"}'S' green -12.6037 0.4903 -7.6572 {"}'S' green -12.4616 0.4119 -7.452 {"}'S' sea -12.3093 0.371 -7.2447 {"}'S' green -12.4743 0.5988 -7.9357 {"}'S' green -12.3459 0.4953 -7.7401 {"}'S' green -12.2611 0.6757 -8.0719 {"}'S' green -12.1341 0.567 -7.877 {"}'S' sea -12.0247 0.7583 -8.1471 { CG PHE 80 A}'S' sea -12.8522 0.6899 -8.35 {"}'S' sea -12.6901 0.712 -8.1472 {"}'S' sea -12.7429 0.6907 -8.6383 {"}'S' green -12.5835 0.69 -8.4305 {"}'S' sea -12.4197 0.728 -8.2307 {"}'S' sea -12.6384 0.748 -8.9323 {"}'S' sea -12.4861 0.7203 -8.7281 {"}'S' green -12.3285 0.732 -8.5273 {"}'S' sea -12.1682 0.7824 -8.335 {"}'S' sea -12.2726 0.7923 -8.8628 {"}'S' sea -12.114 0.8084 -8.6617 {"}'S' sea -11.9526 0.8673 -8.4699 { CD2 PHE 80 A}'S' green -12.1381 0.7267 -9.2586 {"}'S' green -11.9759 0.7502 -9.0561 {"}'S' green -11.8131 0.8118 -8.8613 {"}'S' green -11.6527 0.9095 -8.6814 {"}'S' green -12.0966 0.6984 -9.6312 {"}'S' green -11.2986 0.9928 -8.6812 {"}'S' green -11.9823 0.7237 -9.9183 {"}'S' green -11.0344 1.0569 -8.7859 {"}'S' green -11.7255 0.7402 -10.0051 {"}'S' sea -10.8013 1.1445 -8.923 {"}'S' green -11.5129 0.8107 -10.1407 {"}'S' green -10.7307 1.0968 -9.2105 {"}'S' green -11.1099 0.8943 -10.0021 {"}'S' green -10.9478 0.9322 -9.8028 {"}'S' green -10.7864 1.0174 -9.6171 { HB2 PHE 80 A}'S' sea -12.1969 0.3282 -7.2333 {"}'S' sea -12.0595 0.2467 -7.0338 {"}'S' sea -11.9076 0.2209 -6.8305 {"}'S' green -12.1446 0.4276 -7.6255 {"}'S' green -12.0358 0.2869 -7.4464 {"}'S' green -11.9051 0.1925 -7.2513 {"}'S' green -11.7578 0.1509 -7.049 {"}'S' sea -11.6023 0.1628 -6.8512 {"}'S' green -11.9942 0.5484 -7.8969 {"}'S' green -11.6538 0.1591 -7.3479 {"}'S' sea -11.5015 0.1341 -7.1442 {"}'S' green -11.7873 0.6719 -8.0729 {"}'S' green -11.7162 0.4755 -7.9275 {"}'S' green -11.4852 0.222 -7.5573 {"}'S' sea -11.3379 0.1789 -7.3547 {"}'S' green -11.5445 0.7655 -8.1538 {"}'S' green -11.48 0.5566 -8.0111 {"}'S' green -11.3764 0.3978 -7.8332 {"}'S' green -11.2415 0.303 -7.6323 {"}'S' sea -11.2969 0.8747 -8.1701 {"}'S' green -11.2418 0.6635 -8.0415 {"}'S' green -11.1393 0.5107 -7.8664 {"}'S' sea -11.0021 0.4357 -7.6669 {"}'S' sea -11.0522 0.9421 -8.1039 {"}'S' sea -10.9844 0.7336 -7.9585 {"}'S' sea -10.851 0.6308 -7.7578 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CD2 PHE 80 A}'S' P -11.9393 0.6821 -9.4228 {"}'S' -11.9366 0.7161 -9.4251 {"}'S' P -11.7772 0.7041 -9.2199 {"}'S' -11.7796 0.7745 -9.2325 {"}'S' P -11.6148 0.7649 -9.0255 {"}'S' -11.6228 0.8331 -9.047 {"}'S' P -11.4536 0.8614 -8.8443 {"}'S' -11.4614 0.8941 -8.8591 {"}'S' P -11.83 0.6828 -9.711 {"}'S' -11.8302 0.7129 -9.7079 {"}'S' P -11.6706 0.6821 -9.5032 {"}'S' -11.6783 0.7727 -9.5053 {"}'S' P -11.5068 0.7202 -9.3035 {"}'S' -11.528 0.8317 -9.3185 {"}'S' P -11.344 0.7959 -9.1137 {"}'S' -11.3714 0.8879 -9.1378 {"}'S' P -11.1857 0.9097 -8.9403 {"}'S' -11.2019 0.9476 -8.9558 {"}'S' P -11.5732 0.7124 -9.8008 {"}'S' -11.5811 0.7646 -9.7928 {"}'S' P -11.4156 0.7242 -9.6 {"}'S' -11.4392 0.8234 -9.5969 {"}'S' P -11.2552 0.7745 -9.4078 {"}'S' -11.2916 0.8798 -9.4165 {"}'S' P -11.0971 0.8631 -9.2273 {"}'S' -11.1306 0.9355 -9.2417 {"}'S' P -10.9448 0.9873 -9.0645 {"}'S' -10.9518 0.9997 -9.0684 {"}'S' P -11.3597 0.7845 -9.9356 {"}'S' -11.3658 0.8052 -9.9299 {"}'S' P -11.2011 0.8006 -9.7345 {"}'S' -11.2235 0.8601 -9.7274 {"}'S' P -11.0397 0.8595 -9.5427 {"}'S' -11.0688 0.9179 -9.5428 {"}'S' P -10.8817 0.9594 -9.3667 {"}'S' -10.8949 0.9809 -9.3692 { HB2 PHE 80 A}'S' P -11.9066 0.3722 -7.7335 {"}'S' -11.9001 0.3884 -7.7232 {"}'S' P -11.7904 0.2405 -7.548 {"}'S' -11.7868 0.2584 -7.5403 {"}'S' P -11.6136 0.3228 -7.7524 {"}'S' -11.6136 0.3319 -7.7459 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 67 A}'M' greentint -9.3238 2.2492 -6.3339 {"}'M' greentint -9.4674 2.1414 -6.6063 {"}'M' greentint -9.0618 2.5704 -6.2012 {"}'M' greentint -9.2251 2.537 -6.4031 {"}'M' greentint -9.3737 2.3801 -6.5516 {"}'M' greentint -9.4774 2.2838 -6.8491 {"}'M' greentint -9.534 2.0343 -6.8523 {"}'M' greentint -9.0759 2.7672 -6.4653 {"}'M' greentint -9.2345 2.674 -6.6437 {"}'M' greentint -9.3737 2.5061 -6.7768 {"}'M' greentint -9.447 2.3778 -7.0938 {"}'M' greentint -9.5182 2.1327 -7.1181 {"}'M' greentint -8.8889 2.9563 -6.5331 {"}'M' greentint -9.0491 2.8981 -6.7251 {"}'M' greentint -9.2039 2.775 -6.8898 {"}'M' greentint -9.3396 2.5974 -7.0159 {"}'M' greentint -9.3691 2.458 -7.3321 {"}'M' greentint -9.4504 2.2148 -7.3705 {"}'M' greentint -8.8057 3.0757 -6.7765 {"}'M' greentint -8.9682 2.9941 -6.9629 {"}'M' greentint -9.1205 2.8582 -7.1228 {"}'M' greentint -9.2571 2.6766 -7.2476 {"}'M' greentint -9.2547 2.5027 -7.5618 {"}'M' greentint -8.8671 3.0404 -7.2095 {"}'M' greentint -9.0133 2.8968 -7.3594 {"}'M' greentint -9.1441 2.7148 -7.4778 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 80 A}'M' greentint -9.4367 1.9285 -6.6389 {"}'M' greentint -9.2865 2.0529 -6.479 {"}'M' greentint -9.1534 2.2285 -6.356 {"}'M' greentint -9.0481 2.4432 -6.2782 {"}'M' greentint -8.9747 2.683 -6.2513 {"}'M' greentint -9.3862 1.926 -6.9725 {"}'M' greentint -9.2255 2.002 -6.7856 {"}'M' greentint -9.076 2.1473 -6.6332 {"}'M' greentint -8.9514 2.3473 -6.5274 {"}'M' greentint -8.8628 2.5849 -6.4793 {"}'M' greentint -8.8183 2.8396 -6.492 {"}'M' greentint -9.4412 2.0864 -7.4312 {"}'M' greentint -9.2925 2.0368 -7.2251 {"}'M' greentint -9.1301 2.0817 -7.0272 {"}'M' greentint -8.9759 2.2143 -6.8655 {"}'M' greentint -8.8517 2.4177 -6.7609 {"}'M' greentint -8.7734 2.6633 -6.7287 {"}'M' greentint -8.7524 2.9188 -6.772 {"}'M' greentint -9.3132 2.322 -7.5937 {"}'M' greentint -9.1815 2.2203 -7.3956 {"}'M' greentint -9.0205 2.2483 -7.1956 {"}'M' greentint -8.8724 2.4003 -7.0467 {"}'M' greentint -8.7776 2.6344 -6.9894 {"}'M' greentint -8.7613 2.8881 -7.0387 {"}'M' greentint -9.1522 2.5933 -7.6269 {"}'M' greentint -9.048 2.4381 -7.4491 {"}'M' greentint -8.888 2.535 -7.2697 {"}'M' greentint -8.8331 2.7883 -7.2695 {"}'M' greentint -8.9663 2.6847 -7.469 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 67 A}'M' greentint -10.081 1.0201 -4.4412 {"}'M' greentint -10.2143 0.9164 -4.6407 {"}'M' greentint -9.8952 1.1115 -4.2832 {"}'M' greentint -9.9994 1.2666 -4.4611 {"}'M' greentint -10.1593 1.1697 -4.6405 {"}'M' greentint -10.2697 1.0703 -4.9208 {"}'M' greentint -10.286 0.8166 -4.8715 {"}'M' greentint -9.6675 1.1774 -4.1734 {"}'M' greentint -9.7341 1.3827 -4.3164 {"}'M' greentint -9.8659 1.4845 -4.5146 {"}'M' greentint -10.0269 1.4564 -4.7146 {"}'M' greentint -10.1749 1.3045 -4.8634 {"}'M' greentint -10.2414 1.1678 -5.1744 {"}'M' greentint -9.5425 1.5595 -4.3804 {"}'M' greentint -9.6774 1.6543 -4.5812 {"}'M' greentint -9.8363 1.6575 -4.7872 {"}'M' greentint -9.9966 1.5664 -4.97 {"}'M' greentint -10.138 1.3959 -5.1056 {"}'M' greentint -10.1446 1.2421 -5.4144 {"}'M' greentint -9.4289 1.7535 -4.6316 {"}'M' greentint -9.5806 1.789 -4.8367 {"}'M' greentint -9.7419 1.7499 -5.0346 {"}'M' greentint -9.8985 1.6378 -5.206 {"}'M' greentint -10.0371 1.4631 -5.3367 {"}'M' greentint -9.4524 1.84 -5.085 {"}'M' greentint -9.6106 1.7763 -5.2713 {"}'M' greentint -9.7608 1.6518 -5.4311 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 80 A}'M' greentint -10.1485 0.7959 -4.5523 {"}'M' greentint -9.9904 0.8699 -4.3686 {"}'M' greentint -10.2028 0.8789 -5.0095 {"}'M' greentint -10.0456 0.8743 -4.8039 {"}'M' greentint -9.883 0.93 -4.6097 {"}'M' greentint -9.7252 1.0402 -4.4363 {"}'M' greentint -9.5798 1.2019 -4.2933 {"}'M' greentint -10.1193 1.0567 -5.2674 {"}'M' greentint -9.9713 1.0097 -5.063 {"}'M' greentint -9.8121 1.0321 -4.8625 {"}'M' greentint -9.6524 1.1207 -4.6815 {"}'M' greentint -9.5057 1.2703 -4.5339 {"}'M' greentint -9.3819 1.47 -4.4292 {"}'M' greentint -9.991 1.2684 -5.419 {"}'M' greentint -9.8526 1.1916 -5.2175 {"}'M' greentint -9.6938 1.2026 -5.0166 {"}'M' greentint -9.5368 1.2985 -4.8392 {"}'M' greentint -9.3983 1.4691 -4.7077 {"}'M' greentint -9.2954 1.6926 -4.6368 {"}'M' greentint -9.8513 1.503 -5.4935 {"}'M' greentint -9.7183 1.3995 -5.2932 {"}'M' greentint -9.5552 1.4287 -5.0906 {"}'M' greentint -9.4054 1.5824 -4.9398 {"}'M' greentint -9.3101 1.8187 -4.8823 {"}'M' greentint -9.6057 1.6293 -5.3285 {"}'M' greentint -9.447 1.7266 -5.1508 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 314 2c78A_316F_372}P -10.306 -3.2352 -0.3494 {"}-10.306 -3.2352 -0.3494 { ca thr A 314 2c78A_316F_372}-11.3511 -2.2715 -0.6632 { c thr A 314 2c78A_316F_372}-10.8507 -1.0854 -1.4838 { o thr A 314 2c78A_316F_372}-11.6503 -0.3722 -2.073 { c thr A 314 2c78A_316F_372}P -10.8507 -1.0854 -1.4838 { n lys A 315 2c78A_316F_372}-9.5387 -0.866 -1.5316 { ca lys A 315 2c78A_316F_372}-9.0189 0.2877 -2.2585 { c lys A 315 2c78A_316F_372}-7.9732 -0.1119 -3.2808 { o lys A 315 2c78A_316F_372}-7.0131 -0.8104 -2.9557 { c lys A 315 2c78A_316F_372}P -7.9732 -0.1119 -3.2808 { n phe A 316 2c78A_316F_372}-8.1512 0.3675 -4.5136 { ca phe A 316 2c78A_316F_372}-7.2467 0.0328 -5.607 { c phe A 316 2c78A_316F_372}-7.1827 1.0946 -6.6881 { o phe A 316 2c78A_316F_372}-8.0209 1.9949 -6.749 { c phe A 316 2c78A_316F_372}P -7.1827 1.0946 -6.6881 { n glu A 317 2c78A_316F_372}-6.1486 0.9934 -7.5158 { ca glu A 317 2c78A_316F_372}-5.9871 1.8634 -8.6676 { c glu A 317 2c78A_316F_372}-6.2812 0.9734 -9.8696 { o glu A 317 2c78A_316F_372}-6.0318 -0.2405 -9.836 { c glu A 317 2c78A_316F_372}P -6.2812 0.9734 -9.8696 { n ala A 318 2c78A_316F_372}-6.8103 1.5716 -10.9308 { ca ala A 318 2c78A_316F_372}-7.1334 0.813 -12.1273 { c ala A 318 2c78A_316F_372}-6.9898 1.6101 -13.4048 { o ala A 318 2c78A_316F_372}-7.0891 2.8354 -13.3931 { n phe A 370 2c78A_316F_372}P -7.601 5.7708 -12.3976 {"}-7.601 5.7708 -12.3976 { ca phe A 370 2c78A_316F_372}-8.1768 6.3713 -11.2113 { c phe A 370 2c78A_316F_372}-8.2155 5.3717 -10.0791 { o phe A 370 2c78A_316F_372}-7.8681 4.1974 -10.2555 { c phe A 370 2c78A_316F_372}P -8.2155 5.3717 -10.0791 { n thr A 371 2c78A_316F_372}-8.59 5.8684 -8.9083 { ca thr A 371 2c78A_316F_372}-8.657 5.0731 -7.6973 { c thr A 371 2c78A_316F_372}-10.1011 4.7968 -7.3302 { o thr A 371 2c78A_316F_372}-11.009 5.5698 -7.6572 { c thr A 371 2c78A_316F_372}P -10.1011 4.7968 -7.3302 { n val A 372 2c78A_316F_372}-10.3122 3.6689 -6.6674 { ca val A 372 2c78A_316F_372}-11.6418 3.2666 -6.2568 { c val A 372 2c78A_316F_372}-11.6363 2.7408 -4.827 { o val A 372 2c78A_316F_372}-10.7027 2.0431 -4.4102 { c val A 372 2c78A_316F_372}P -11.6363 2.7408 -4.827 { n glu A 373 2c78A_316F_372}-12.6691 3.1045 -4.0728 { ca glu A 373 2c78A_316F_372}-12.8393 2.5591 -2.7284 { c glu A 373 2c78A_316F_372}-14.1901 1.8403 -2.7309 { o glu A 373 2c78A_316F_372}-15.2376 2.4584 -2.9502 { c glu A 373 2c78A_316F_372}P -14.1901 1.8403 -2.7309 { n leu A 374 2c78A_316F_372}-14.1509 0.5297 -2.5062 { ca leu A 374 2c78A_316F_372}-15.3569 -0.3033 -2.4931 { c leu A 374 2c78A_316F_372}-16.0312 -0.2649 -1.1302 { o leu A 374 2c78A_316F_372}-15.3616 -0.0699 -0.1091 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greentint -8.7941 2.5239 -6.0708 {"}'M' greentint -8.7055 2.7615 -6.0227 {"}'M' greentint -9.284 2.2631 -6.9746 {"}'M' greentint -9.1352 2.2135 -6.7685 {"}'M' greentint -8.9729 2.2584 -6.5706 {"}'M' greentint -8.8186 2.391 -6.4089 {"}'M' greentint -8.6944 2.5943 -6.3043 {"}'M' greentint -8.6161 2.84 -6.2721 {"}'M' greentint -8.5951 3.0954 -6.3154 {"}'M' greentint -9.1559 2.4987 -7.1371 {"}'M' greentint -9.0242 2.397 -6.939 {"}'M' greentint -8.8632 2.425 -6.739 {"}'M' greentint -8.7152 2.577 -6.5901 {"}'M' greentint -8.6204 2.8111 -6.5328 {"}'M' greentint -8.6041 3.0648 -6.5821 {"}'M' greentint -8.9949 2.77 -7.1703 {"}'M' greentint -8.8907 2.6148 -6.9925 {"}'M' greentint -8.7307 2.7117 -6.8131 {"}'M' greentint -8.6758 2.965 -6.8129 {"}'M' greentint -8.78 3.1202 -6.9907 {"}'M' greentint -8.809 2.8614 -7.0124 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 316 A}'M' green -9.2762 1.7814 -4.3079 {"}'M' green -9.8116 1.1202 -5.1588 {"}'M' green 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-6.5832 {"}'S' sky -12.6879 0.335 -6.3492 {"}'S' sky -13.1529 0.4014 -6.9691 {"}'S' blue -12.3685 0.2548 -6.3437 {"}'S' blue -13.1381 0.3283 -7.3578 {"}'S' blue -12.1605 0.2081 -6.4948 {"}'S' sky -12.0853 0.2068 -6.8258 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 88 A}'S' sea -12.7725 0.3514 -7.3965 {"}'S' sea -12.2325 0.3127 -7.046 {"}'S' green -12.3679 0.4029 -7.2449 {"}'S' green -12.5158 0.4527 -7.4499 {"}'S' sea -12.6717 0.4583 -7.654 {"}'S' sea -11.9668 0.3376 -7.0988 {"}'S' green -12.0948 0.4405 -7.2937 {"}'S' green -12.2372 0.5064 -7.4966 {"}'S' sea -12.3891 0.5336 -7.7002 {"}'S' sea -11.8986 0.4844 -7.4662 {"}'S' sea -12.0454 0.5451 -7.6739 { CZ PHE 88 A}'S' sea -12.8347 0.3958 -6.5569 {"}'S' sea -12.9913 0.4188 -6.7642 {"}'S' sea -12.5064 0.3459 -6.5462 {"}'S' green -12.6555 0.3989 -6.7535 {"}'S' green -12.8124 0.4132 -6.961 {"}'S' sea -12.9745 0.3897 -7.1635 {"}'S' sea -12.2976 0.299 -6.6978 {"}'S' green -12.4462 0.3528 -6.9047 {"}'S' green -12.6039 0.37 -7.1121 {"}'S' sea -12.7656 0.347 -7.316 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 162 A}'S' sky -13.1346 0.7353 -6.7914 {"}'S' sky -12.9874 0.6922 -6.5889 {"}'S' sky -12.83 0.7101 -6.3898 {"}'S' sky -13.0549 0.6714 -7.0796 {"}'S' blue -12.4477 0.6811 -6.2982 {"}'S' sky -12.8938 0.6301 -7.2927 {"}'S' sky -12.3016 0.5705 -6.5107 {"}'S' sky -12.7645 0.7154 -7.5798 {"}'S' blue -12.042 0.5935 -6.6123 {"}'S' sky -12.5742 0.8187 -7.7738 {"}'S' blue -11.88 0.6159 -6.8197 {"}'S' sky -12.338 0.8998 -7.8574 {"}'S' sky -11.7804 0.6709 -7.0738 {"}'S' sky -11.9972 0.8539 -7.7127 {"}'S' sky -11.8601 0.7789 -7.5132 {"}'S' blue -11.7037 0.7896 -7.314 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 162 A}'S' sea -12.9175 0.5899 -6.8801 {"}'S' sea -12.7656 0.5641 -6.6768 {"}'S' sea -12.6062 0.5946 -6.4796 {"}'S' green -12.7631 0.5357 -7.0976 {"}'S' green -12.6158 0.4941 -6.8953 {"}'S' green -12.4603 0.506 -6.6975 {"}'S' sea -12.6484 0.5837 -7.3943 {"}'S' green -12.5118 0.5023 -7.1943 {"}'S' green -12.3594 0.4773 -6.9905 {"}'S' sea -12.2 0.5078 -6.7933 {"}'S' sea -12.4716 0.666 -7.5987 {"}'S' green -12.3432 0.5652 -7.4036 {"}'S' green -12.1959 0.5221 -7.201 {"}'S' sea -12.0377 0.5399 -7.0026 {"}'S' sea -12.2343 0.741 -7.6795 {"}'S' green -12.0994 0.6462 -7.4786 {"}'S' sea -11.9437 0.622 -7.2704 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 88 A}'M' greentint -9.7233 1.9338 -6.1893 {"}'M' greentint -9.8634 1.8411 -6.3853 {"}'M' greentint -9.5448 2.0184 -6.0227 {"}'M' greentint -9.6446 2.1801 -6.196 {"}'M' greentint -9.8035 2.0914 -6.3776 {"}'M' greentint -9.9471 1.9836 -6.6501 {"}'M' greentint -9.4072 2.3128 -6.0437 {"}'M' greentint -9.5416 2.4126 -6.245 {"}'M' greentint -9.7048 2.3792 -6.4468 {"}'M' greentint -9.8534 2.2223 -6.5953 {"}'M' greentint -9.9571 2.126 -6.8928 {"}'M' greentint -9.2598 2.5384 -6.1073 {"}'M' greentint -9.3976 2.6177 -6.307 {"}'M' greentint -9.5556 2.6094 -6.509 {"}'M' greentint -9.7142 2.5162 -6.6874 {"}'M' greentint -9.8534 2.3482 -6.8206 {"}'M' greentint -9.9267 2.22 -7.1376 {"}'M' greentint -9.0734 2.7095 -6.1718 {"}'M' greentint -9.2125 2.7878 -6.373 {"}'M' greentint -9.3686 2.7985 -6.5769 {"}'M' greentint -9.5288 2.7402 -6.7688 {"}'M' greentint -9.6836 2.6172 -6.9335 {"}'M' greentint -9.8193 2.4396 -7.0597 {"}'M' greentint -9.1254 2.9419 -6.6189 {"}'M' greentint -9.2859 2.9185 -6.821 {"}'M' greentint -9.4479 2.8363 -7.0066 {"}'M' greentint -9.6002 2.7003 -7.1666 {"}'M' greentint -9.7368 2.5188 -7.2914 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 162 A}'M' greentint -9.8208 1.8356 -6.389 {"}'M' greentint -9.6626 1.8993 -6.2027 {"}'M' greentint -9.5124 2.0237 -6.0429 {"}'M' greentint -9.9116 1.9676 -6.9431 {"}'M' greentint -9.7702 1.8946 -6.74 {"}'M' greentint -9.612 1.8968 -6.5363 {"}'M' greentint -9.4514 1.9728 -6.3494 {"}'M' greentint -9.3018 2.1181 -6.197 {"}'M' greentint -9.1773 2.3181 -6.0912 {"}'M' greentint -9.0887 2.5557 -6.0431 {"}'M' greentint -9.7832 2.1943 -7.1833 {"}'M' greentint -9.6671 2.0572 -6.9951 {"}'M' greentint -9.5183 2.0076 -6.789 {"}'M' greentint -9.356 2.0525 -6.591 {"}'M' greentint -9.2018 2.1851 -6.4293 {"}'M' greentint -9.0775 2.3885 -6.3247 {"}'M' greentint -8.9992 2.6341 -6.2926 {"}'M' greentint -9.6057 2.4981 -7.3006 {"}'M' greentint -9.5391 2.2928 -7.1576 {"}'M' greentint -9.4073 2.1911 -6.9594 {"}'M' greentint -9.2463 2.2191 -6.7594 {"}'M' greentint -9.0983 2.3711 -6.6106 {"}'M' greentint -9.0035 2.6052 -6.5532 {"}'M' greentint -8.9872 2.8589 -6.6025 {"}'M' greentint -9.378 2.5641 -7.1908 {"}'M' greentint -9.2738 2.4089 -7.0129 {"}'M' greentint -9.1139 2.5058 -6.8335 {"}'M' greentint -9.0589 2.7591 -6.8333 {"}'M' greentint -9.1631 2.9143 -7.0111 {"}'M' greentint -9.3231 2.8174 -7.1905 {"}'M' greentint -9.1922 2.6555 -7.0328 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 88 A}'M' green -9.8754 1.2086 -4.1434 {"}'M' green -10.2662 0.9137 -4.7316 {"}'M' green -9.5228 1.6566 -4.2405 {"}'M' green -9.5608 1.8861 -4.6969 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 88 A}'M' greentint -10.0612 1.1172 -4.3014 {"}'M' greentint -10.1945 1.0135 -4.5009 {"}'M' greentint -9.9796 1.3637 -4.3212 {"}'M' greentint -10.1395 1.2668 -4.5006 {"}'M' greentint -10.2499 1.1674 -4.7809 {"}'M' greentint -9.7143 1.4798 -4.1766 {"}'M' greentint -9.8461 1.5816 -4.3747 {"}'M' greentint -10.0071 1.5535 -4.5747 {"}'M' greentint -10.1551 1.4016 -4.7236 {"}'M' greentint -10.2217 1.2649 -5.0345 {"}'M' greentint -9.6577 1.7514 -4.4414 {"}'M' greentint -9.8165 1.7546 -4.6473 {"}'M' greentint -9.9768 1.6635 -4.8302 {"}'M' greentint -10.1182 1.493 -4.9657 {"}'M' greentint -9.7221 1.847 -4.8948 {"}'M' greentint -9.8787 1.7349 -5.0661 {"}'M' greentint -10.0173 1.5602 -5.1969 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 162 A}'M' green -10.3239 0.9221 -4.6005 {"}'M' green -10.1613 0.9779 -4.4064 {"}'M' green -9.8581 1.2498 -4.0899 {"}'M' green -10.2693 1.3163 -5.2156 {"}'M' green -10.1296 1.5509 -5.2901 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 162 A}'M' greentint -10.0035 1.0881 -4.2329 {"}'M' greentint -10.2496 1.0575 -4.8596 {"}'M' greentint -10.0904 1.08 -4.6591 {"}'M' greentint -9.9307 1.1686 -4.4781 {"}'M' greentint -9.784 1.3182 -4.3305 {"}'M' greentint -9.6602 1.5179 -4.2258 {"}'M' greentint -10.1309 1.2395 -5.0141 {"}'M' greentint -9.9721 1.2505 -4.8132 {"}'M' greentint -9.8151 1.3464 -4.6358 {"}'M' greentint -9.6766 1.5169 -4.5043 {"}'M' greentint -9.5737 1.7404 -4.4335 {"}'M' greentint -9.9966 1.4473 -5.0899 {"}'M' greentint -9.8335 1.4766 -4.8872 {"}'M' greentint -9.6837 1.6303 -4.7364 {"}'M' greentint -9.5884 1.8666 -4.6789 {"}'M' greentint -9.884 1.6772 -5.1251 {"}'M' greentint -9.7253 1.7745 -4.9474 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 77 2c9qA_99F_79Y}P -7.712 5.5711 -12.3893 {"}-7.712 5.5711 -12.3893 { ca gly A 77 2c9qA_99F_79Y}-7.9369 6.3095 -11.1547 { c gly A 77 2c9qA_99F_79Y}-7.9192 5.4084 -9.9609 { o gly A 77 2c9qA_99F_79Y}-7.5 4.2562 -10.0513 { c gly A 77 2c9qA_99F_79Y}P -7.9192 5.4084 -9.9609 { n thr A 78 2c9qA_99F_79Y}-8.4227 5.9275 -8.8401 { ca thr A 78 2c9qA_99F_79Y}-8.5074 5.1769 -7.6088 { c thr A 78 2c9qA_99F_79Y}-9.977 4.9451 -7.2575 { o thr A 78 2c9qA_99F_79Y}-10.8064 5.8548 -7.3821 { c thr A 78 2c9qA_99F_79Y}P -9.977 4.9451 -7.2575 { n tyr A 79 2c9qA_99F_79Y}-10.2461 3.7106 -6.8105 { ca tyr A 79 2c9qA_99F_79Y}-11.5959 3.2842 -6.4424 { c tyr A 79 2c9qA_99F_79Y}-11.591 2.6982 -5.046 { o tyr A 79 2c9qA_99F_79Y}-10.5801 2.1312 -4.5995 { c tyr A 79 2c9qA_99F_79Y}P -11.591 2.6982 -5.046 { n lys A 80 2c9qA_99F_79Y}-12.737 2.7913 -4.3846 { ca lys A 80 2c9qA_99F_79Y}-12.9651 2.042 -3.1566 { c lys A 80 2c9qA_99F_79Y}-14.2967 1.3219 -3.2093 { o lys A 80 2c9qA_99F_79Y}-15.3015 1.8359 -3.7447 { c lys A 80 2c9qA_99F_79Y}P -14.2967 1.3219 -3.2093 { n val A 81 2c9qA_99F_79Y}-14.2837 0.0944 -2.7081 { ca val A 81 2c9qA_99F_79Y}-15.5074 -0.7034 -2.5494 { c val A 81 2c9qA_99F_79Y}-15.8105 -0.7346 -1.0716 { o val A 81 2c9qA_99F_79Y}-15.032 -1.301 -0.3072 { n val A 97 2c9qA_99F_79Y}P -12.3277 -1.7593 0.4517 {"}-12.3277 -1.7593 0.4517 { ca val A 97 2c9qA_99F_79Y}-11.1786 -2.1996 -0.3243 { c val A 97 2c9qA_99F_79Y}-10.8164 -1.094 -1.3069 { o val A 97 2c9qA_99F_79Y}-11.7059 -0.5949 -2.0026 { c val A 97 2c9qA_99F_79Y}P -10.8164 -1.094 -1.3069 { n thr A 98 2c9qA_99F_79Y}-9.5537 -0.6789 -1.3248 { ca thr A 98 2c9qA_99F_79Y}-9.0943 0.3407 -2.2522 { c thr A 98 2c9qA_99F_79Y}-8.1545 -0.2598 -3.2761 { o thr A 98 2c9qA_99F_79Y}-7.2833 -1.0863 -2.9409 { c thr A 98 2c9qA_99F_79Y}P -8.1545 -0.2598 -3.2761 { n phe A 99 2c9qA_99F_79Y}-8.3354 0.1553 -4.5255 { ca phe A 99 2c9qA_99F_79Y}-7.4738 -0.2864 -5.5899 { c phe A 99 2c9qA_99F_79Y}-7.3908 0.7789 -6.6646 { o phe A 99 2c9qA_99F_79Y}-8.1994 1.717 -6.6852 { c phe A 99 2c9qA_99F_79Y}P -7.3908 0.7789 -6.6646 { n lys A 100 2c9qA_99F_79Y}-6.4165 0.6279 -7.5559 { ca lys A 100 2c9qA_99F_79Y}-6.214 1.5956 -8.6262 { c lys A 100 2c9qA_99F_79Y}-6.3339 0.9023 -9.9834 { o lys A 100 2c9qA_99F_79Y}-6.0349 -0.2962 -10.1351 { c lys A 100 2c9qA_99F_79Y}P -6.3339 0.9023 -9.9834 { n val A 101 2c9qA_99F_79Y}-6.8485 1.6508 -10.9482 { ca val A 101 2c9qA_99F_79Y}-6.8224 1.2574 -12.3454 { c val A 101 2c9qA_99F_79Y}-5.7416 2.0748 -13.0285 { o val A 101 2c9qA_99F_79Y}-5.7748 3.3006 -12.9811 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 77 2c9qA_99F_79Y}P -7.712 5.5711 -12.3893 { ca gly A 77 2c9qA_99F_79Y}P -7.9369 6.3095 -11.1547 {"}P -7.9369 6.3095 -11.1547 { n thr A 78 2c9qA_99F_79Y}P -8.4227 5.9275 -8.8401 { ca thr A 78 2c9qA_99F_79Y}P -8.5074 5.1769 -7.6088 { n tyr A 79 2c9qA_99F_79Y}P -10.2461 3.7106 -6.8105 { ca tyr A 79 2c9qA_99F_79Y}P -11.5959 3.2842 -6.4424 { n lys A 80 2c9qA_99F_79Y}P -12.737 2.7913 -4.3846 { ca lys A 80 2c9qA_99F_79Y}P -12.9651 2.042 -3.1566 { n val A 81 2c9qA_99F_79Y}P -14.2837 0.0944 -2.7081 { ca val A 81 2c9qA_99F_79Y}P -15.5074 -0.7034 -2.5494 { n val A 97 2c9qA_99F_79Y}P -12.3277 -1.7593 0.4517 { ca val A 97 2c9qA_99F_79Y}P -11.1786 -2.1996 -0.3243 { n thr A 98 2c9qA_99F_79Y}P -9.5537 -0.6789 -1.3248 { ca thr A 98 2c9qA_99F_79Y}P -9.0943 0.3407 -2.2522 { n phe A 99 2c9qA_99F_79Y}P -8.3354 0.1553 -4.5255 { ca phe A 99 2c9qA_99F_79Y}P -7.4738 -0.2864 -5.5899 { n lys A 100 2c9qA_99F_79Y}P -6.4165 0.6279 -7.5559 { ca lys A 100 2c9qA_99F_79Y}P -6.214 1.5956 -8.6262 { n val A 101 2c9qA_99F_79Y}P -6.8485 1.6508 -10.9482 { ca val A 101 2c9qA_99F_79Y}P -6.8224 1.2574 -12.3454 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 77 2c9qA_99F_79Y}P -7.9369 6.3095 -11.1547 {"}-7.9369 6.3095 -11.1547 { ca thr A 78 2c9qA_99F_79Y}-8.5074 5.1769 -7.6088 { ca tyr A 79 2c9qA_99F_79Y}-11.5959 3.2842 -6.4424 { ca lys A 80 2c9qA_99F_79Y}-12.9651 2.042 -3.1566 { ca val A 81 2c9qA_99F_79Y}-15.5074 -0.7034 -2.5494 { ca val A 97 2c9qA_99F_79Y}P -11.1786 -2.1996 -0.3243 {"}-11.1786 -2.1996 -0.3243 { ca thr A 98 2c9qA_99F_79Y}-9.0943 0.3407 -2.2522 { ca phe A 99 2c9qA_99F_79Y}-7.4738 -0.2864 -5.5899 { ca lys A 100 2c9qA_99F_79Y}-6.214 1.5956 -8.6262 { ca val A 101 2c9qA_99F_79Y}-6.8224 1.2574 -12.3454 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 79 2c9qA_99F_79Y}P -11.5959 3.2842 -6.4424 { cb tyr A 79 2c9qA_99F_79Y}-12.1619 2.2717 -7.4309 { cg tyr A 79 2c9qA_99F_79Y}-12.2752 2.8165 -8.8259 { cd1 tyr A 79 2c9qA_99F_79Y}-11.1767 2.8552 -9.6694 { ce1 tyr A 79 2c9qA_99F_79Y}-11.2744 3.4012 -10.9375 { cz tyr A 79 2c9qA_99F_79Y}-12.4752 3.8908 -11.3764 { oh tyr A 79 2c9qA_99F_79Y}-12.5825 4.3967 -12.6638 { cg tyr A 79 2c9qA_99F_79Y}P -12.2752 2.8165 -8.8259 { cd2 tyr A 79 2c9qA_99F_79Y}-13.4697 3.3401 -9.2896 { ce2 tyr A 79 2c9qA_99F_79Y}-13.5818 3.8627 -10.5465 { cz tyr A 79 2c9qA_99F_79Y}ghost -12.4752 3.8908 -11.3764 { ca phe A 99 2c9qA_99F_79Y}P -7.4738 -0.2864 -5.5899 { cb phe A 99 2c9qA_99F_79Y}-7.9637 -1.6269 -6.1534 { cg phe A 99 2c9qA_99F_79Y}-9.2734 -1.5356 -6.8963 { cd1 phe A 99 2c9qA_99F_79Y}-10.4779 -1.6724 -6.2301 { ce1 phe A 99 2c9qA_99F_79Y}-11.684 -1.6 -6.9125 { cz phe A 99 2c9qA_99F_79Y}-11.6866 -1.3609 -8.2779 { cg phe A 99 2c9qA_99F_79Y}P -9.2734 -1.5356 -6.8963 { cd2 phe A 99 2c9qA_99F_79Y}-9.3063 -1.3095 -8.2625 { ce2 phe A 99 2c9qA_99F_79Y}-10.4998 -1.2077 -8.9396 { cz phe A 99 2c9qA_99F_79Y}ghost -11.6866 -1.3609 -8.2779 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 79 2c9qA_99F_79Y}P -12.1619 2.2717 -7.4309 {"}P -12.1619 2.2717 -7.4309 { cd1 tyr A 79 2c9qA_99F_79Y}P -11.1767 2.8552 -9.6694 { cd2 tyr A 79 2c9qA_99F_79Y}P -13.4697 3.3401 -9.2896 { ce1 tyr A 79 2c9qA_99F_79Y}P -11.2744 3.4012 -10.9375 { ce2 tyr A 79 2c9qA_99F_79Y}P -13.5818 3.8627 -10.5465 { oh tyr A 79 2c9qA_99F_79Y}P -12.5825 4.3967 -12.6638 { cb phe A 99 2c9qA_99F_79Y}P -7.9637 -1.6269 -6.1534 {"}P -7.9637 -1.6269 -6.1534 { cd1 phe A 99 2c9qA_99F_79Y}P -10.4779 -1.6724 -6.2301 { cd2 phe A 99 2c9qA_99F_79Y}P -9.3063 -1.3095 -8.2625 { ce1 phe A 99 2c9qA_99F_79Y}P -11.684 -1.6 -6.9125 { ce2 phe A 99 2c9qA_99F_79Y}P -10.4998 -1.2077 -8.9396 { cz phe A 99 2c9qA_99F_79Y}P -11.6866 -1.3609 -8.2779 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 99 A}'S' blue -11.9384 0.1132 -6.6584 {"}'S' blue -12.0961 0.1001 -6.8589 {"}'S' blue -12.2569 0.0475 -7.0513 {"}'S' sky -11.5947 0.1248 -6.6321 {"}'S' sky -12.0767 0.0736 -7.24 {"}'S' blue -11.2664 0.0748 -6.6214 {"}'S' sky -10.9929 -0.0047 -7.1078 { CE2 PHE 99 A}'S' blue -10.7225 0.0819 -7.7782 {"}'S' sky -10.8447 0.2082 -7.9707 {"}'S' sky -11.1376 0.3234 -8.3819 {"}'S' blue -10.5976 0.2846 -8.0314 {"}'S' sky -10.733 0.3748 -8.2302 {"}'S' sky -10.8809 0.4247 -8.4352 {"}'S' blue -11.0368 0.4302 -8.6393 { CZ PHE 99 A}'S' sky -12.3244 0.1701 -7.7201 {"}'S' blue -12.4854 0.1552 -7.9231 {"}'S' blue -12.384 0.2408 -8.1748 {"}'S' sky -12.0987 0.3391 -8.2243 {"}'S' sky -11.9154 0.3694 -8.4097 {"}'S' sky -10.923 0.1761 -7.9354 {"}'S' sky -11.2088 0.3208 -8.3453 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 99 A}'S' sea -11.7513 0.1478 -6.8394 {"}'S' sea -11.9129 0.1303 -7.0443 {"}'S' sea -11.4154 0.1278 -6.8287 {"}'S' green -11.5723 0.1422 -7.0362 {"}'S' green -11.7345 0.1187 -7.2387 {"}'S' sea -11.2062 0.0817 -6.9799 {"}'S' green -11.3638 0.099 -7.1873 {"}'S' sea -11.1488 0.0167 -7.3155 { CE2 PHE 99 A}'S' sea -10.9846 0.2892 -8.1735 { CZ PHE 99 A}'S' sea -12.1714 0.1359 -7.5117 {"}'S' green -11.7843 0.1314 -7.3696 {"}'S' green -11.9198 0.2216 -7.5684 {"}'S' green -12.0677 0.2714 -7.7734 {"}'S' sea -12.2236 0.277 -7.9775 {"}'S' green -11.5187 0.1563 -7.4223 {"}'S' green -11.941 0.3523 -8.0238 {"}'S' sea -11.1974 0.071 -7.3978 {"}'S' green -11.3161 0.2047 -7.5888 {"}'S' green -11.7539 0.3868 -8.2048 {"}'S' sea -11.0087 0.0983 -7.5904 {"}'S' green -11.131 0.2229 -7.7843 {"}'S' green -11.2689 0.3139 -7.9868 {"}'S' green -11.418 0.3669 -8.1941 {"}'S' sea -11.5749 0.3812 -8.4016 {"}'S' sea -11.0602 0.267 -8.1384 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 99 A}'S' P -11.6467 0.2592 -7.6173 {"}'S' -11.6468 0.2459 -7.623 {"}'S' P -11.7891 0.3251 -7.8202 {"}'S' -11.7894 0.3161 -7.822 {"}'S' P -11.4505 0.3031 -7.7898 {"}'S' -11.4532 0.2857 -7.7947 {"}'S' P -11.5972 0.3639 -7.9974 {"}'S' -11.5978 0.3589 -7.9971 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 79 A}'S' blue -12.4355 0.5455 -7.5219 {"}'S' blue -12.4633 0.6492 -8.0143 {"}'S' sky -12.3213 0.5708 -7.809 {"}'S' sky -12.2056 0.6542 -8.0971 { HB2 TYR 79 A}'S' sky -12.0879 0.4262 -7.0709 {"}'S' sky -11.9305 0.4441 -6.8718 {"}'S' blue -11.7724 0.5209 -6.6886 {"}'S' sky -12.2708 0.537 -7.7477 {"}'S' sky -11.5483 0.4151 -6.7802 {"}'S' sky -11.2492 0.4206 -6.8273 {"}'S' 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-7.1008 {"}'M' greentint -8.6385 2.9362 -7.1006 {"}'M' greentint -8.7718 2.8326 -7.3001 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 99 A}'M' greentint -9.7579 1.1974 -4.2263 {"}'M' greentint -9.9178 1.1005 -4.4057 {"}'M' greentint -10.0282 1.0011 -4.686 {"}'M' greentint -9.6244 1.4153 -4.2798 {"}'M' greentint -9.7854 1.3872 -4.4798 {"}'M' greentint -9.9334 1.2353 -4.6287 {"}'M' greentint -9.9999 1.0986 -4.9396 {"}'M' greentint -9.436 1.5851 -4.3465 {"}'M' greentint -9.5948 1.5883 -4.5524 {"}'M' greentint -9.7551 1.4972 -4.7352 {"}'M' greentint -9.8965 1.3267 -4.8708 {"}'M' greentint -9.9031 1.1729 -5.1796 {"}'M' greentint -9.3391 1.7198 -4.6019 {"}'M' greentint -9.5004 1.6807 -4.7998 {"}'M' greentint -9.657 1.5686 -4.9712 {"}'M' greentint -9.7956 1.3939 -5.102 {"}'M' greentint -9.3691 1.7071 -5.0365 {"}'M' greentint -9.5193 1.5826 -5.1964 {"}'M' greentint -9.6525 1.407 -5.3194 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= 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-9.3923 2.0676 -6.574 {"}'M' greentint -9.251 2.2184 -6.4324 {"}'M' greentint -9.1304 2.4126 -6.3307 {"}'M' greentint -9.4365 1.9304 -7.0218 {"}'M' greentint -9.2783 1.9941 -6.8355 {"}'M' greentint -9.1281 2.1185 -6.6757 {"}'M' greentint -8.995 2.2941 -6.5526 {"}'M' greentint -8.8897 2.5087 -6.4748 {"}'M' greentint -8.8163 2.7485 -6.4479 {"}'M' greentint -9.386 1.9893 -7.3728 {"}'M' greentint -9.2278 1.9915 -7.1691 {"}'M' greentint -9.0671 2.0675 -6.9822 {"}'M' greentint -8.9176 2.2129 -6.8298 {"}'M' greentint -8.793 2.4128 -6.724 {"}'M' greentint -8.7044 2.6504 -6.676 {"}'M' greentint -8.6599 2.9052 -6.6887 {"}'M' greentint -9.1341 2.1024 -7.4218 {"}'M' greentint -8.9717 2.1473 -7.2238 {"}'M' greentint -8.8175 2.2799 -7.0621 {"}'M' greentint -8.6933 2.4832 -6.9575 {"}'M' greentint -8.615 2.7289 -6.9254 {"}'M' greentint -9.0231 2.2859 -7.5922 {"}'M' greentint -8.8621 2.3139 -7.3922 {"}'M' greentint -8.714 2.4659 -7.2434 {"}'M' greentint -8.6192 2.7 -7.186 {"}'M' greentint -8.7296 2.6006 -7.4663 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE1125 A}'M' greentint -10.0425 0.7664 -4.3717 {"}'M' greentint -10.1758 0.6628 -4.5712 {"}'M' greentint -9.9609 1.013 -4.3916 {"}'M' greentint -10.1208 0.9161 -4.571 {"}'M' greentint -10.2312 0.8167 -4.8513 {"}'M' greentint -9.6956 1.1291 -4.247 {"}'M' greentint -9.8274 1.2308 -4.4451 {"}'M' greentint -9.9884 1.2028 -4.6451 {"}'M' greentint -10.1364 1.0508 -4.7939 {"}'M' greentint -10.2029 0.9142 -5.1049 {"}'M' greentint -10.2533 0.6595 -5.1003 {"}'M' greentint -9.5041 1.3059 -4.3109 {"}'M' greentint -9.6389 1.4007 -4.5117 {"}'M' greentint -9.7978 1.4039 -4.7177 {"}'M' greentint -9.9581 1.3128 -4.9005 {"}'M' greentint -10.0995 1.1423 -5.0361 {"}'M' greentint -10.1061 0.9884 -5.3449 {"}'M' greentint -9.3904 1.4999 -4.5621 {"}'M' greentint -9.5421 1.5354 -4.7672 {"}'M' greentint -9.7034 1.4962 -4.9651 {"}'M' greentint -9.86 1.3842 -5.1365 {"}'M' greentint -9.9986 1.2095 -5.2672 {"}'M' greentint -9.4139 1.5863 -5.0155 {"}'M' greentint -9.5721 1.5226 -5.2018 {"}'M' greentint -9.7223 1.3982 -5.3617 {"}'M' greentint -9.8555 1.2226 -5.4847 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL1074 A}'M' green -9.3879 1.4842 -4.5193 {"}'M' green -9.408 1.5987 -5.0256 {"}'M' green -9.5448 1.5066 -5.2942 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL1074 A}'M' greentint -10.0883 0.6499 -4.5119 {"}'M' greentint -9.9365 0.7705 -4.3491 {"}'M' greentint -9.7962 0.9325 -4.213 {"}'M' greentint -10.1435 0.6542 -4.9472 {"}'M' greentint -9.9809 0.7099 -4.7531 {"}'M' greentint -9.8231 0.8202 -4.5796 {"}'M' greentint -9.6777 0.9819 -4.4367 {"}'M' greentint -9.5531 1.1843 -4.3331 {"}'M' greentint -10.0692 0.7896 -5.2063 {"}'M' greentint -9.91 0.8121 -5.0058 {"}'M' greentint -9.7502 0.9007 -4.8248 {"}'M' greentint -9.6035 1.0502 -4.6773 {"}'M' greentint -9.4798 1.25 -4.5726 {"}'M' greentint -9.9505 0.9716 -5.3608 {"}'M' greentint -9.7917 0.9826 -5.1599 {"}'M' greentint -9.6347 1.0785 -4.9826 {"}'M' greentint -9.4962 1.249 -4.8511 {"}'M' greentint -9.3933 1.4725 -4.7802 {"}'M' greentint -9.8162 1.1794 -5.4366 {"}'M' greentint -9.6531 1.2086 -5.234 {"}'M' greentint -9.5033 1.3624 -5.0831 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 39 2cn3A_755Y_41D}P -6.6381 5.8813 -11.6075 {"}-6.6381 5.8813 -11.6075 { ca lys A 39 2cn3A_755Y_41D}-7.9939 6.0665 -11.0969 { c lys A 39 2cn3A_755Y_41D}-8.1721 5.1765 -9.8744 { o lys A 39 2cn3A_755Y_41D}-7.8777 3.9732 -9.9304 { c lys A 39 2cn3A_755Y_41D}P -8.1721 5.1765 -9.8744 { n trp A 40 2cn3A_755Y_41D}-8.6558 5.774 -8.7853 { ca trp A 40 2cn3A_755Y_41D}-8.8111 5.0808 -7.5046 { c trp A 40 2cn3A_755Y_41D}-10.2771 4.9917 -7.1179 { o trp A 40 2cn3A_755Y_41D}-11.0388 5.9326 -7.3449 { c trp A 40 2cn3A_755Y_41D}P -10.2771 4.9917 -7.1179 { n asp A 41 2cn3A_755Y_41D}-10.6665 3.8556 -6.5449 { ca asp A 41 2cn3A_755Y_41D}-12.0261 3.6652 -6.0493 { c asp A 41 2cn3A_755Y_41D}-12.0275 2.5917 -4.9672 { o asp A 41 2cn3A_755Y_41D}-11.0206 1.9084 -4.7491 { c asp A 41 2cn3A_755Y_41D}P -12.0275 2.5917 -4.9672 { n asn A 42 2cn3A_755Y_41D}-13.1543 2.4573 -4.2807 { ca asn A 42 2cn3A_755Y_41D}-13.3686 1.3217 -3.4036 { c asn A 42 2cn3A_755Y_41D}-13.8477 0.1201 -4.1874 { o asn A 42 2cn3A_755Y_41D}-14.6276 0.2551 -5.1286 { c asn A 42 2cn3A_755Y_41D}P -13.8477 0.1201 -4.1874 { n val A 43 2cn3A_755Y_41D}-13.3527 -1.0537 -3.8086 { ca val A 43 2cn3A_755Y_41D}-14.0176 -2.2988 -4.1529 { c val A 43 2cn3A_755Y_41D}-15.2366 -2.2917 -3.2265 { o val A 43 2cn3A_755Y_41D}-15.0973 -2.0699 -2.0221 { n ile A 753 2cn3A_755Y_41D}P -11.5289 -1.6962 1.0455 {"}-11.5289 -1.6962 1.0455 { ca ile A 753 2cn3A_755Y_41D}-10.5947 -2.1606 0.0292 { c ile A 753 2cn3A_755Y_41D}-10.5672 -1.1259 -1.0717 { o ile A 753 2cn3A_755Y_41D}-11.6016 -0.8036 -1.6466 { c ile A 753 2cn3A_755Y_41D}P -10.5672 -1.1259 -1.0717 { n val A 754 2cn3A_755Y_41D}-9.3853 -0.6099 -1.3719 { ca val A 754 2cn3A_755Y_41D}-9.2696 0.2954 -2.5038 { c val A 754 2cn3A_755Y_41D}-8.5424 -0.4043 -3.6435 { o val A 754 2cn3A_755Y_41D}-7.6948 -1.284 -3.4222 { c val A 754 2cn3A_755Y_41D}P -8.5424 -0.4043 -3.6435 { n tyr A 755 2cn3A_755Y_41D}-8.8992 -0.0264 -4.8615 { ca tyr A 755 2cn3A_755Y_41D}-8.2047 -0.527 -6.023 { c tyr A 755 2cn3A_755Y_41D}-7.936 0.6028 -7.0022 { o tyr A 755 2cn3A_755Y_41D}-8.7194 1.5581 -7.1067 { c tyr A 755 2cn3A_755Y_41D}P -7.936 0.6028 -7.0022 { n gly A 756 2cn3A_755Y_41D}-6.8084 0.4933 -7.6917 { ca gly A 756 2cn3A_755Y_41D}-6.3869 1.5058 -8.6438 { c gly A 756 2cn3A_755Y_41D}-6.0581 0.8664 -9.9674 { o gly A 756 2cn3A_755Y_41D}-5.627 -0.2872 -10.0138 { c gly A 756 2cn3A_755Y_41D}P -6.0581 0.8664 -9.9674 { n glu A 757 2cn3A_755Y_41D}-6.2738 1.6209 -11.0411 { ca glu A 757 2cn3A_755Y_41D}-5.8974 1.2122 -12.39 { c glu A 757 2cn3A_755Y_41D}-5.3214 2.4328 -13.0929 { o glu A 757 2cn3A_755Y_41D}-5.7107 3.5563 -12.7724 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 39 2cn3A_755Y_41D}P -6.6381 5.8813 -11.6075 { ca lys A 39 2cn3A_755Y_41D}P -7.9939 6.0665 -11.0969 { n trp A 40 2cn3A_755Y_41D}P -8.6558 5.774 -8.7853 { ca trp A 40 2cn3A_755Y_41D}P -8.8111 5.0808 -7.5046 { n asp A 41 2cn3A_755Y_41D}P -10.6665 3.8556 -6.5449 { ca asp A 41 2cn3A_755Y_41D}P -12.0261 3.6652 -6.0493 { n asn A 42 2cn3A_755Y_41D}P -13.1543 2.4573 -4.2807 { ca asn A 42 2cn3A_755Y_41D}P -13.3686 1.3217 -3.4036 { n val A 43 2cn3A_755Y_41D}P -13.3527 -1.0537 -3.8086 { ca val A 43 2cn3A_755Y_41D}P -14.0176 -2.2988 -4.1529 { n ile A 753 2cn3A_755Y_41D}P -11.5289 -1.6962 1.0455 { ca ile A 753 2cn3A_755Y_41D}P -10.5947 -2.1606 0.0292 { n val A 754 2cn3A_755Y_41D}P -9.3853 -0.6099 -1.3719 { ca val A 754 2cn3A_755Y_41D}P -9.2696 0.2954 -2.5038 { n tyr A 755 2cn3A_755Y_41D}P -8.8992 -0.0264 -4.8615 { ca tyr A 755 2cn3A_755Y_41D}P -8.2047 -0.527 -6.023 { n gly A 756 2cn3A_755Y_41D}P -6.8084 0.4933 -7.6917 { ca gly A 756 2cn3A_755Y_41D}P -6.3869 1.5058 -8.6438 {"}P -6.3869 1.5058 -8.6438 { n glu A 757 2cn3A_755Y_41D}P -6.2738 1.6209 -11.0411 { ca glu A 757 2cn3A_755Y_41D}P -5.8974 1.2122 -12.39 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 39 2cn3A_755Y_41D}P -7.9939 6.0665 -11.0969 {"}-7.9939 6.0665 -11.0969 { ca trp A 40 2cn3A_755Y_41D}-8.8111 5.0808 -7.5046 { ca asp A 41 2cn3A_755Y_41D}-12.0261 3.6652 -6.0493 { ca asn A 42 2cn3A_755Y_41D}-13.3686 1.3217 -3.4036 { ca val A 43 2cn3A_755Y_41D}-14.0176 -2.2988 -4.1529 { ca ile A 753 2cn3A_755Y_41D}P -10.5947 -2.1606 0.0292 {"}-10.5947 -2.1606 0.0292 { ca val A 754 2cn3A_755Y_41D}-9.2696 0.2954 -2.5038 { ca tyr A 755 2cn3A_755Y_41D}-8.2047 -0.527 -6.023 { ca gly A 756 2cn3A_755Y_41D}-6.3869 1.5058 -8.6438 { ca glu A 757 2cn3A_755Y_41D}-5.8974 1.2122 -12.39 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca asp A 41 2cn3A_755Y_41D}P -12.0261 3.6652 -6.0493 { cb asp A 41 2cn3A_755Y_41D}-12.9593 3.256 -7.1972 { cg asp A 41 2cn3A_755Y_41D}-14.4172 3.6819 -6.9681 { od1 asp A 41 2cn3A_755Y_41D}-14.7708 4.1795 -5.8698 { cg asp A 41 2cn3A_755Y_41D}P -14.4172 3.6819 -6.9681 { od2 asp A 41 2cn3A_755Y_41D}-15.2172 3.5074 -7.9123 { ca tyr A 755 2cn3A_755Y_41D}P -8.2047 -0.527 -6.023 { cb tyr A 755 2cn3A_755Y_41D}-8.9644 -1.6885 -6.6595 { cg tyr A 755 2cn3A_755Y_41D}-10.0881 -1.3044 -7.5926 { cd1 tyr A 755 2cn3A_755Y_41D}-9.9188 -1.392 -8.9767 { ce1 tyr A 755 2cn3A_755Y_41D}-10.9484 -1.0561 -9.8487 { cz tyr A 755 2cn3A_755Y_41D}-12.1646 -0.6374 -9.3424 { oh tyr A 755 2cn3A_755Y_41D}-13.174 -0.3081 -10.2161 { cg tyr A 755 2cn3A_755Y_41D}P -10.0881 -1.3044 -7.5926 { cd2 tyr A 755 2cn3A_755Y_41D}-11.3268 -0.8769 -7.1002 { ce2 tyr A 755 2cn3A_755Y_41D}-12.3693 -0.5415 -7.9694 { cz tyr A 755 2cn3A_755Y_41D}ghost -12.1646 -0.6374 -9.3424 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb asp A 41 2cn3A_755Y_41D}P -12.9593 3.256 -7.1972 {"}P -12.9593 3.256 -7.1972 { cb tyr A 755 2cn3A_755Y_41D}P -8.9644 -1.6885 -6.6595 {"}P -8.9644 -1.6885 -6.6595 { cd1 tyr A 755 2cn3A_755Y_41D}P -9.9188 -1.392 -8.9767 { cd2 tyr A 755 2cn3A_755Y_41D}P -11.3268 -0.8769 -7.1002 { ce1 tyr A 755 2cn3A_755Y_41D}P -10.9484 -1.0561 -9.8487 { ce2 tyr A 755 2cn3A_755Y_41D}P -12.3693 -0.5415 -7.9694 { oh tyr A 755 2cn3A_755Y_41D}P -13.174 -0.3081 -10.2161 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 755 A}'S' sky -12.9449 0.7583 -6.9492 {"}'S' sky -13.4027 0.8086 -7.554 {"}'S' sky -13.2274 0.9818 -8.051 {"}'S' sky -11.9988 1.0241 -7.2804 {"}'S' sky -12.7621 1.1321 -8.297 {"}'S' sky -11.9517 1.1333 -7.6783 {"}'S' sky -12.4198 1.1772 -8.2957 { HE2 TYR 755 A}'S' blue -13.4673 0.6948 -7.1599 {"}'S' blue -13.4908 0.7812 -7.6133 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 755 A}'S' sea -13.0872 0.8287 -7.1512 {"}'S' sea -13.2415 0.8464 -7.3558 {"}'S' sea -12.7142 0.8744 -7.0005 {"}'S' green -12.8541 0.9554 -7.2033 {"}'S' green -13.0071 0.9896 -7.4117 {"}'S' green -13.1682 0.9746 -7.6147 {"}'S' sea -13.331 0.912 -7.8076 {"}'S' green -12.4671 0.9509 -7.0612 {"}'S' green -13.0667 1.0602 -7.8664 {"}'S' sea -12.2014 0.9757 -7.1139 {"}'S' green -12.3294 1.0787 -7.3089 {"}'S' green -12.7814 1.1586 -7.9159 {"}'S' green -12.9422 1.106 -8.1083 {"}'S' green -12.1332 1.1225 -7.4814 {"}'S' green -12.28 1.1833 -7.689 {"}'S' green -12.4366 1.2063 -7.8964 {"}'S' green -12.5982 1.1888 -8.1013 {"}'S' sea -12.1008 1.1863 -7.8857 {"}'S' sea -12.2577 1.2007 -8.0931 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 755 A}'S' P -12.6025 1.0411 -7.26 {"}'S' -12.6021 1.0401 -7.261 {"}'S' P -12.7504 1.0909 -7.465 {"}'S' -12.742 1.0554 -7.4762 {"}'S' P -12.9063 1.0964 -7.6691 {"}'S' -12.899 1.074 -7.6727 {"}'S' P -12.4718 1.1445 -7.5118 {"}'S' -12.4714 1.1241 -7.5168 {"}'S' P -12.6237 1.1717 -7.7153 {"}'S' -12.6196 1.1398 -7.7195 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ASP 41 A}'S' blue -13.5552 1.1896 -7.4426 {"}'S' sky -13.3942 1.1484 -7.6557 {"}'S' sky -12.802 1.0888 -6.8737 {"}'S' sky -13.0745 1.337 -8.1368 {"}'S' sky -12.8384 1.418 -8.2204 {"}'S' sky -12.048 1.4033 -7.5025 {"}'S' sky -12.2093 1.4923 -7.9671 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ASP 41 A}'S' green -13.2635 1.054 -7.4606 {"}'S' green -13.1162 1.0123 -7.2583 {"}'S' sea -12.9606 1.0243 -7.0605 {"}'S' sea -13.2649 1.2337 -7.9428 {"}'S' green -13.1487 1.1019 -7.7573 {"}'S' green -12.7004 1.026 -7.1563 {"}'S' sea -12.5424 1.1118 -6.9753 {"}'S' green -12.972 1.1842 -7.9617 {"}'S' green -12.3803 1.1342 -7.1827 {"}'S' green -12.7347 1.2593 -8.0425 {"}'S' green -12.2808 1.1892 -7.4368 {"}'S' sea -12.1235 1.3076 -7.2661 {"}'S' sea -12.4976 1.3721 -8.0757 {"}'S' green -12.3604 1.2971 -7.8762 {"}'S' green -12.2041 1.3079 -7.677 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ASP 41 A}'S' P -13.0122 1.0206 -7.5572 {"}'S' -13.012 1.0264 -7.5566 {"}'S' P -12.8598 0.9956 -7.3535 {"}'S' -12.8602 1.0071 -7.3533 {"}'S' P -12.8435 1.0834 -7.7666 {"}'S' -12.8447 1.1046 -7.7576 {"}'S' P -12.6962 1.0404 -7.564 {"}'S' -12.7045 1.0811 -7.5556 {"}'S' P -12.5381 1.0582 -7.3656 {"}'S' -12.5441 1.0728 -7.3652 {"}'S' P -12.5998 1.1645 -7.8416 {"}'S' -12.6026 1.1743 -7.8357 {"}'S' P -12.444 1.1402 -7.6334 {"}'S' -12.4512 1.1548 -7.6295 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 755 A}'M' green -9.7326 2.0393 -6.2688 {"}'M' green -9.8915 1.9506 -6.4503 {"}'M' green -9.4952 2.172 -6.1165 {"}'M' green -9.9414 2.0815 -6.6681 {"}'M' green -9.3478 2.3977 -6.1801 {"}'M' green -9.1613 2.5687 -6.2445 {"}'M' green -9.9073 2.2989 -7.1324 {"}'M' green -9.0604 2.7652 -6.4847 {"}'M' green -9.6881 2.5596 -7.2393 {"}'M' green -9.1199 2.8917 -6.9605 {"}'M' green -9.279 2.8405 -7.1527 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 755 A}'M' greentint -9.6295 2.2718 -6.3177 {"}'M' 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color= red width= 1 master= {H-bonds} { HG1 THR 165 A}'S' greentint -11.6603 0.8708 -8.8761 {"}'S' greentint -11.6734 0.8105 -9.304 {"}'S' greentint -11.5244 0.7862 -9.105 {"}'S' greentint -11.3677 0.8236 -8.9131 {"}'S' greentint -11.2128 0.9208 -8.7406 {"}'S' greentint -11.4113 0.7843 -9.3876 {"}'S' greentint -11.257 0.7836 -9.1884 {"}'S' greentint -11.0988 0.8473 -9.0021 {"}'S' greentint -11.2064 0.8426 -9.5395 {"}'S' greentint -11.0483 0.8448 -9.3357 {"}'S' greentint -10.8876 0.9208 -9.1489 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 184 A}'M' greentint -9.2669 2.4521 -5.8752 {"}'M' greentint -9.4259 2.3634 -6.0568 {"}'M' greentint -9.5694 2.2557 -6.3293 {"}'M' greentint -9.1639 2.6847 -5.9242 {"}'M' greentint -9.3272 2.6513 -6.1261 {"}'M' greentint -9.4758 2.4944 -6.2746 {"}'M' greentint -9.5795 2.398 -6.572 {"}'M' greentint -8.8822 2.8105 -5.7866 {"}'M' greentint -9.02 2.8898 -5.9862 {"}'M' greentint -9.1779 2.8814 -6.1882 {"}'M' greentint -9.3365 2.7883 -6.3666 {"}'M' greentint -9.4758 2.6203 -6.4998 {"}'M' greentint -9.5491 2.4921 -6.8168 {"}'M' greentint -8.8348 3.0599 -6.0522 {"}'M' greentint -8.991 3.0706 -6.2561 {"}'M' greentint -9.1511 3.0123 -6.4481 {"}'M' greentint -9.3059 2.8892 -6.6127 {"}'M' greentint -9.4416 2.7117 -6.7389 {"}'M' greentint -9.4712 2.5723 -7.0551 {"}'M' greentint -8.5948 3.1781 -6.0912 {"}'M' greentint -8.7477 3.214 -6.2981 {"}'M' greentint -8.9082 3.1905 -6.5002 {"}'M' greentint -9.0703 3.1084 -6.6858 {"}'M' greentint -9.2225 2.9724 -6.8458 {"}'M' greentint -9.3592 2.7908 -6.9706 {"}'M' greentint -8.499 3.3054 -6.367 {"}'M' greentint -8.6542 3.3045 -6.567 {"}'M' greentint -8.8134 3.2534 -6.7592 {"}'M' greentint -8.9692 3.1546 -6.9325 {"}'M' greentint -9.1153 3.0111 -7.0824 {"}'M' greentint -9.2461 2.8291 -7.2008 {"}'M' greentint -8.6566 3.2878 -6.9646 {"}'M' greentint -8.8135 3.1819 -7.1377 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H THR 165 A}'M' P -8.8721 2.4633 -6.6061 {"}'M' -8.8728 2.4648 -6.6058 @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 165 A}'M' greentint -9.4476 2.2864 -6.1287 {"}'M' greentint -9.2927 2.3836 -5.9563 {"}'M' greentint -9.1513 2.5344 -5.8146 {"}'M' greentint -9.4912 2.2471 -6.6032 {"}'M' greentint -9.3369 2.2464 -6.4041 {"}'M' greentint -9.1787 2.3101 -6.2178 {"}'M' greentint -9.0285 2.4345 -6.0579 {"}'M' greentint -8.8953 2.6101 -5.9348 {"}'M' greentint -8.7901 2.8248 -5.8571 {"}'M' greentint -9.4277 2.3784 -6.9582 {"}'M' greentint -9.2863 2.3053 -6.7551 {"}'M' greentint -9.1281 2.3075 -6.5513 {"}'M' greentint -8.9674 2.3835 -6.3645 {"}'M' greentint -8.8179 2.5289 -6.2121 {"}'M' greentint -8.6933 2.7289 -6.1063 {"}'M' greentint -8.6047 2.9664 -6.0582 {"}'M' greentint -9.2992 2.605 -7.1983 {"}'M' greentint -9.1832 2.468 -7.0101 {"}'M' greentint -9.0344 2.4184 -6.804 {"}'M' greentint -8.7179 2.5959 -6.4444 {"}'M' greentint -8.5936 2.7992 -6.3397 {"}'M' greentint -8.5153 3.0449 -6.3076 {"}'M' greentint -8.4943 3.3003 -6.3509 {"}'M' greentint -9.0552 2.7036 -7.1726 {"}'M' greentint -8.9234 2.6019 -6.9745 {"}'M' greentint -8.7624 2.6299 -6.7745 {"}'M' greentint -8.6144 2.7819 -6.6256 {"}'M' greentint -8.5196 3.016 -6.5683 {"}'M' greentint -8.5033 3.2697 -6.6176 {"}'M' greentint -8.8941 2.9749 -7.2058 {"}'M' greentint -8.7899 2.8197 -7.028 {"}'M' greentint -8.63 2.9166 -6.8486 {"}'M' greentint -8.575 3.1699 -6.8483 {"}'M' greentint -8.7083 3.0663 -7.0478 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 184 A}'M' greentint -10.178 1.0269 -4.1071 {"}'M' greentint -10.3113 0.9233 -4.3066 {"}'M' greentint -9.9922 1.1183 -3.9492 {"}'M' greentint -10.0964 1.2735 -4.127 {"}'M' greentint -10.2563 1.1766 -4.3064 {"}'M' greentint -10.3667 1.0772 -4.5867 {"}'M' greentint -10.383 0.8235 -4.5374 {"}'M' greentint -9.8311 1.3896 -3.9824 {"}'M' greentint -9.9629 1.4913 -4.1805 {"}'M' greentint -10.1239 1.4632 -4.3805 {"}'M' greentint -10.2719 1.3113 -4.5294 {"}'M' greentint -10.3384 1.1746 -4.8403 {"}'M' greentint -10.3888 0.92 -4.8357 {"}'M' greentint -9.6395 1.5663 -4.0463 {"}'M' greentint -9.7744 1.6612 -4.2472 {"}'M' greentint -9.9333 1.6643 -4.4531 {"}'M' greentint -10.0936 1.5733 -4.6359 {"}'M' greentint -10.235 1.4027 -4.7715 {"}'M' greentint -10.2416 1.2489 -5.0803 {"}'M' greentint -10.3099 0.9999 -5.098 {"}'M' greentint -9.5259 1.7604 -4.2975 {"}'M' greentint -9.6776 1.7959 -4.5027 {"}'M' greentint -9.8389 1.7567 -4.7005 {"}'M' greentint -9.9955 1.6447 -4.8719 {"}'M' greentint -10.1341 1.4699 -5.0027 {"}'M' greentint -10.0962 1.2684 -5.2979 {"}'M' greentint -9.3951 1.8461 -4.5518 {"}'M' greentint -9.5494 1.8468 -4.7509 {"}'M' greentint -9.7076 1.7831 -4.9372 {"}'M' greentint -9.8578 1.6587 -5.0971 {"}'M' greentint -9.991 1.4831 -5.2201 {"}'M' greentint -9.5172 1.7648 -5.1155 {"}'M' greentint -9.6666 1.6406 -5.2742 {"}'M' greentint -9.7989 1.4665 -5.3964 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 165 A}'M' greentint -10.2272 0.8495 -4.2346 {"}'M' greentint -10.0755 0.9777 -4.0738 {"}'M' greentint -9.9359 1.145 -3.9399 {"}'M' greentint -10.2389 0.7993 -4.6356 {"}'M' greentint -10.0808 0.8733 -4.4519 {"}'M' greentint -9.929 0.994 -4.289 {"}'M' greentint -9.7887 1.156 -4.153 {"}'M' greentint -9.6667 1.3526 -4.05 {"}'M' greentint -10.2932 0.8823 -5.0928 {"}'M' greentint -10.136 0.8777 -4.8872 {"}'M' greentint -9.9734 0.9334 -4.693 {"}'M' greentint -9.8156 1.0437 -4.5196 {"}'M' greentint -9.6702 1.2054 -4.3766 {"}'M' greentint -9.5456 1.4078 -4.273 {"}'M' greentint -9.4491 1.6409 -4.2132 {"}'M' greentint -10.0617 1.0131 -5.1463 {"}'M' greentint -9.9025 1.0356 -4.9458 {"}'M' greentint -9.7427 1.1241 -4.7648 {"}'M' greentint -9.596 1.2737 -4.6172 {"}'M' greentint -9.4723 1.4735 -4.5125 {"}'M' greentint -9.3805 1.7077 -4.4592 {"}'M' greentint -9.943 1.1951 -5.3008 {"}'M' greentint -9.7842 1.2061 -5.0999 {"}'M' greentint -9.6272 1.3019 -4.9225 {"}'M' greentint -9.4887 1.4725 -4.791 {"}'M' greentint -9.3858 1.696 -4.7201 {"}'M' greentint -9.8087 1.4029 -5.3766 {"}'M' greentint -9.6456 1.4321 -5.1739 {"}'M' greentint -9.4958 1.5858 -5.0231 {"}'M' greentint -9.4005 1.8221 -4.9656 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 26 2cu9A_28F_70N}P -12.2483 -2.0498 0.336 {"}-12.2483 -2.0498 0.336 { ca ile A 26 2cu9A_28F_70N}-11.1254 -2.3018 -0.5563 { c ile A 26 2cu9A_28F_70N}-10.8725 -1.0479 -1.3804 { o ile A 26 2cu9A_28F_70N}-11.8068 -0.4671 -1.9321 { c ile A 26 2cu9A_28F_70N}P -10.8725 -1.0479 -1.3804 { n thr A 27 2cu9A_28F_70N}-9.6129 -0.6521 -1.4204 { ca thr A 27 2cu9A_28F_70N}-9.1608 0.4735 -2.2265 { c thr A 27 2cu9A_28F_70N}-8.1917 -0.0555 -3.2676 { o thr A 27 2cu9A_28F_70N}-7.265 -0.7774 -2.9418 { c thr A 27 2cu9A_28F_70N}P -8.1917 -0.0555 -3.2676 { n phe A 28 2cu9A_28F_70N}-8.4106 0.2952 -4.5321 { ca phe A 28 2cu9A_28F_70N}-7.5164 -0.1598 -5.5778 { c phe A 28 2cu9A_28F_70N}-7.3362 0.9267 -6.6169 { o phe A 28 2cu9A_28F_70N}-8.134 1.8579 -6.6877 { c phe A 28 2cu9A_28F_70N}P -7.3362 0.9267 -6.6169 { n glu A 29 2cu9A_28F_70N}-6.2879 0.8101 -7.4098 { ca glu A 29 2cu9A_28F_70N}-6.12 1.7118 -8.5378 { c glu A 29 2cu9A_28F_70N}-6.2413 0.9483 -9.8742 { o glu A 29 2cu9A_28F_70N}-5.7985 -0.2045 -9.9833 { c glu A 29 2cu9A_28F_70N}P -6.2413 0.9483 -9.8742 { n cys A 30 2cu9A_28F_70N}-6.9078 1.5811 -10.8494 { ca cys A 30 2cu9A_28F_70N}-7.0144 1.0677 -12.2244 { c cys A 30 2cu9A_28F_70N}-6.2507 2.0199 -13.1495 { o cys A 30 2cu9A_28F_70N}-6.6305 3.1741 -13.2981 { n gly A 68 2cu9A_28F_70N}P -8.2956 5.21 -12.2638 {"}-8.2956 5.21 -12.2638 { ca gly A 68 2cu9A_28F_70N}-7.8403 5.9381 -11.09 { c gly A 68 2cu9A_28F_70N}-8.1326 5.184 -9.7981 { o gly A 68 2cu9A_28F_70N}-8.2505 3.943 -9.8008 { c gly A 68 2cu9A_28F_70N}P -8.1326 5.184 -9.7981 { n ile A 69 2cu9A_28F_70N}-8.2623 5.9264 -8.6957 { ca ile A 69 2cu9A_28F_70N}-8.4686 5.3352 -7.3629 { c ile A 69 2cu9A_28F_70N}-9.9074 4.9517 -7.2084 { o ile A 69 2cu9A_28F_70N}-10.8038 5.7508 -7.5325 { c ile A 69 2cu9A_28F_70N}P -9.9074 4.9517 -7.2084 { n asn A 70 2cu9A_28F_70N}-10.1275 3.7372 -6.6971 { ca asn A 70 2cu9A_28F_70N}-11.4429 3.2007 -6.4569 { c asn A 70 2cu9A_28F_70N}-11.5387 2.6747 -5.0289 { o asn A 70 2cu9A_28F_70N}-10.598 2.0741 -4.5083 { c asn A 70 2cu9A_28F_70N}P -11.5387 2.6747 -5.0289 { n lys A 71 2cu9A_28F_70N}-12.6735 2.92 -4.4024 { ca lys A 71 2cu9A_28F_70N}-12.9057 2.4255 -3.057 { c lys A 71 2cu9A_28F_70N}-14.3113 1.8842 -3.009 { o lys A 71 2cu9A_28F_70N}-15.2483 2.533 -3.4911 { c lys A 71 2cu9A_28F_70N}P -14.3113 1.8842 -3.009 { n phe A 72 2cu9A_28F_70N}-14.4742 0.6866 -2.4526 { ca phe A 72 2cu9A_28F_70N}-15.7903 0.1046 -2.3054 { c phe A 72 2cu9A_28F_70N}-15.8278 -0.8642 -1.1238 { o phe A 72 2cu9A_28F_70N}-14.7884 -1.199 -0.5684 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 26 2cu9A_28F_70N}P -12.2483 -2.0498 0.336 { ca ile A 26 2cu9A_28F_70N}P -11.1254 -2.3018 -0.5563 { n thr A 27 2cu9A_28F_70N}P -9.6129 -0.6521 -1.4204 { ca thr A 27 2cu9A_28F_70N}P -9.1608 0.4735 -2.2265 { n phe A 28 2cu9A_28F_70N}P -8.4106 0.2952 -4.5321 { ca phe A 28 2cu9A_28F_70N}P -7.5164 -0.1598 -5.5778 { n glu A 29 2cu9A_28F_70N}P -6.2879 0.8101 -7.4098 { ca glu A 29 2cu9A_28F_70N}P -6.12 1.7118 -8.5378 { n cys A 30 2cu9A_28F_70N}P -6.9078 1.5811 -10.8494 { ca cys A 30 2cu9A_28F_70N}P -7.0144 1.0677 -12.2244 { n gly A 68 2cu9A_28F_70N}P -8.2956 5.21 -12.2638 { ca gly A 68 2cu9A_28F_70N}P -7.8403 5.9381 -11.09 {"}P -7.8403 5.9381 -11.09 { n ile A 69 2cu9A_28F_70N}P -8.2623 5.9264 -8.6957 { ca ile A 69 2cu9A_28F_70N}P -8.4686 5.3352 -7.3629 { n asn A 70 2cu9A_28F_70N}P -10.1275 3.7372 -6.6971 { ca asn A 70 2cu9A_28F_70N}P -11.4429 3.2007 -6.4569 { n lys A 71 2cu9A_28F_70N}P -12.6735 2.92 -4.4024 { ca lys A 71 2cu9A_28F_70N}P -12.9057 2.4255 -3.057 { n phe A 72 2cu9A_28F_70N}P -14.4742 0.6866 -2.4526 { ca phe A 72 2cu9A_28F_70N}P -15.7903 0.1046 -2.3054 @subgroup {mainchain} @vectorlist 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-6.0563 {"}'M' greentint -8.7972 2.4866 -5.9332 {"}'M' greentint -8.692 2.7013 -5.8555 {"}'M' greentint -9.3296 2.2549 -6.9565 {"}'M' greentint -9.1882 2.1819 -6.7535 {"}'M' greentint -9.03 2.1841 -6.5497 {"}'M' greentint -8.8693 2.2601 -6.3629 {"}'M' greentint -8.7198 2.4054 -6.2105 {"}'M' greentint -8.5952 2.6054 -6.1046 {"}'M' greentint -8.5067 2.843 -6.0566 {"}'M' greentint -9.2011 2.4816 -7.1967 {"}'M' greentint -9.0851 2.3446 -7.0085 {"}'M' greentint -8.9363 2.2949 -6.8024 {"}'M' greentint -8.774 2.3398 -6.6044 {"}'M' greentint -8.6198 2.4725 -6.4427 {"}'M' greentint -8.4955 2.6758 -6.3381 {"}'M' greentint -8.4172 2.9215 -6.306 {"}'M' greentint -8.3962 3.1769 -6.3493 {"}'M' greentint -8.9571 2.5801 -7.171 {"}'M' greentint -8.8253 2.4784 -6.9728 {"}'M' greentint -8.6643 2.5065 -6.7729 {"}'M' greentint -8.5163 2.6584 -6.624 {"}'M' greentint -8.4215 2.8925 -6.5667 {"}'M' greentint -8.4052 3.1462 -6.616 {"}'M' greentint -8.796 2.8514 -7.2042 {"}'M' greentint -8.6918 2.6962 -7.0264 {"}'M' greentint -8.5319 2.7932 -6.8469 {"}'M' greentint -8.4769 3.0464 -6.8467 {"}'M' greentint -8.6102 2.9428 -7.0462 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 28 A}'M' greentint -9.9485 1.0358 -4.2381 {"}'M' greentint -10.0818 0.9322 -4.4376 {"}'M' greentint -9.7627 1.1272 -4.0802 {"}'M' greentint -9.8669 1.2824 -4.258 {"}'M' greentint -10.0268 1.1855 -4.4374 {"}'M' greentint -10.1372 1.0861 -4.7177 {"}'M' greentint -10.1535 0.8324 -4.6684 {"}'M' greentint -9.6016 1.3985 -4.1134 {"}'M' greentint -9.7334 1.5003 -4.3115 {"}'M' greentint -9.8944 1.4722 -4.5115 {"}'M' greentint -10.0424 1.3202 -4.6604 {"}'M' greentint -10.109 1.1836 -4.9713 {"}'M' greentint -10.1594 0.9289 -4.9667 {"}'M' greentint -9.4101 1.5753 -4.1773 {"}'M' greentint -9.545 1.6701 -4.3782 {"}'M' greentint -9.7038 1.6733 -4.5841 {"}'M' greentint -9.8641 1.5822 -4.7669 {"}'M' greentint -10.0055 1.4117 -4.9025 {"}'M' greentint -10.0121 1.2578 -5.2113 {"}'M' greentint -10.0804 1.0088 -5.229 {"}'M' greentint -9.2964 1.7693 -4.4285 {"}'M' greentint -9.4481 1.8048 -4.6336 {"}'M' greentint -9.6094 1.7657 -4.8315 {"}'M' greentint -9.766 1.6536 -5.0029 {"}'M' greentint -9.9046 1.4789 -5.1337 {"}'M' greentint -9.3199 1.8558 -4.8819 {"}'M' greentint -9.4781 1.7921 -5.0682 {"}'M' greentint -9.6284 1.6676 -5.2281 {"}'M' greentint -9.7615 1.492 -5.3511 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ASN 70 A}'M' greentint -10.1226 0.7578 -4.563 {"}'M' greentint -9.9645 0.8319 -4.3792 {"}'M' greentint -9.8127 0.9525 -4.2163 {"}'M' greentint -9.6724 1.1145 -4.0803 {"}'M' greentint -10.0197 0.8363 -4.8145 {"}'M' greentint -9.8571 0.892 -4.6204 {"}'M' greentint -9.6993 1.0022 -4.4469 {"}'M' greentint -9.5539 1.1639 -4.3039 {"}'M' greentint -9.4293 1.3663 -4.2003 {"}'M' greentint -9.9454 0.9716 -5.0736 {"}'M' greentint -9.7862 0.9941 -4.8731 {"}'M' greentint -9.6265 1.0827 -4.6921 {"}'M' greentint -9.4798 1.2323 -4.5445 {"}'M' greentint -9.356 1.432 -4.4398 {"}'M' greentint -9.2642 1.6662 -4.3865 {"}'M' greentint -9.8268 1.1536 -5.2281 {"}'M' greentint -9.6679 1.1646 -5.0272 {"}'M' greentint -9.5109 1.2605 -4.8499 {"}'M' greentint -9.3724 1.431 -4.7183 {"}'M' greentint -9.2695 1.6545 -4.6475 {"}'M' greentint -9.6924 1.3614 -5.3039 {"}'M' greentint -9.5293 1.3907 -5.1012 {"}'M' greentint -9.3795 1.5444 -4.9504 {"}'M' greentint -9.2842 1.7807 -4.8929 {"}'M' greentint -9.5798 1.5913 -5.3391 {"}'M' greentint -9.4211 1.6886 -5.1615 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 161 2culA_180Y_163}P -6.0869 5.7583 -11.3849 {"}-6.0869 5.7583 -11.3849 { ca val A 161 2culA_180Y_163}-7.0943 6.5022 -10.6417 { c val A 161 2culA_180Y_163}-7.522 5.6176 -9.4744 { o val A 161 2culA_180Y_163}-7.4891 4.3933 -9.5755 { c val A 161 2culA_180Y_163}P -7.522 5.6176 -9.4744 { n glu A 162 2culA_180Y_163}-7.9044 6.2356 -8.3643 { ca glu A 162 2culA_180Y_163}-8.3189 5.4825 -7.1885 { c glu A 162 2culA_180Y_163}-9.7851 5.0844 -7.2339 { o glu A 162 2culA_180Y_163}-10.6483 5.8804 -7.6077 { c glu A 162 2culA_180Y_163}P -9.7851 5.0844 -7.2339 { n arg A 163 2culA_180Y_163}-10.0555 3.8419 -6.8482 { ca arg A 163 2culA_180Y_163}-11.4109 3.3096 -6.8174 { c arg A 163 2culA_180Y_163}-11.6 2.5511 -5.51 { o arg A 163 2culA_180Y_163}-10.6341 2.2826 -4.7898 { c arg A 163 2culA_180Y_163}P -11.6 2.5511 -5.51 { n glu A 164 2culA_180Y_163}-12.8457 2.2168 -5.1951 { ca glu A 164 2culA_180Y_163}-13.1297 1.4846 -3.9687 { c glu A 164 2culA_180Y_163}-14.3125 0.5496 -4.138 { o glu A 164 2culA_180Y_163}-15.2898 0.8765 -4.8136 { c glu A 164 2culA_180Y_163}P -14.3125 0.5496 -4.138 { n gly A 165 2culA_180Y_163}-14.205 -0.6246 -3.5266 { ca gly A 165 2culA_180Y_163}-15.2799 -1.5929 -3.5734 { c gly A 165 2culA_180Y_163}-15.6005 -1.9412 -2.1343 { o gly A 165 2culA_180Y_163}-14.7932 -1.6858 -1.2413 { n val A 178 2culA_180Y_163}P -12.2035 -2.3306 -0.0615 {"}-12.2035 -2.3306 -0.0615 { ca val A 178 2culA_180Y_163}-10.9215 -2.4824 -0.7303 { c val A 178 2culA_180Y_163}-10.6898 -1.2874 -1.6485 { o val A 178 2culA_180Y_163}-11.4493 -1.0638 -2.594 { c val A 178 2culA_180Y_163}P -10.6898 -1.2874 -1.6485 { n arg A 179 2culA_180Y_163}-9.6619 -0.5029 -1.3472 { ca arg A 179 2culA_180Y_163}-9.3164 0.6263 -2.1921 { c arg A 179 2culA_180Y_163}-8.2356 0.0988 -3.1202 { o arg A 179 2culA_180Y_163}-7.2992 -0.5763 -2.6825 { c arg A 179 2culA_180Y_163}P -8.2356 0.0988 -3.1202 { n tyr A 180 2culA_180Y_163}-8.3738 0.3855 -4.4067 { ca tyr A 180 2culA_180Y_163}-7.4187 -0.1079 -5.3794 { c tyr A 180 2culA_180Y_163}-7.2051 0.9011 -6.4883 { o tyr A 180 2culA_180Y_163}-7.8771 1.9335 -6.5487 { c tyr A 180 2culA_180Y_163}P -7.2051 0.9011 -6.4883 { n leu A 181 2culA_180Y_163}-6.258 0.5964 -7.3628 { ca leu A 181 2culA_180Y_163}-5.9504 1.4742 -8.4774 { c leu A 181 2culA_180Y_163}-6.33 0.8377 -9.8027 { o leu A 181 2culA_180Y_163}-6.0599 -0.3387 -10.04 { c leu A 181 2culA_180Y_163}P -6.33 0.8377 -9.8027 { n ala A 182 2culA_180Y_163}-6.9658 1.6288 -10.6592 { ca ala A 182 2culA_180Y_163}-7.3619 1.1722 -11.9832 { c ala A 182 2culA_180Y_163}-6.6251 2.0523 -12.9817 { o ala A 182 2culA_180Y_163}-6.3233 3.2115 -12.6868 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 161 2culA_180Y_163}P -6.0869 5.7583 -11.3849 { ca val A 161 2culA_180Y_163}P -7.0943 6.5022 -10.6417 { n glu A 162 2culA_180Y_163}P -7.9044 6.2356 -8.3643 { ca glu A 162 2culA_180Y_163}P -8.3189 5.4825 -7.1885 { n arg A 163 2culA_180Y_163}P -10.0555 3.8419 -6.8482 { ca arg A 163 2culA_180Y_163}P -11.4109 3.3096 -6.8174 { n glu A 164 2culA_180Y_163}P -12.8457 2.2168 -5.1951 { ca glu A 164 2culA_180Y_163}P -13.1297 1.4846 -3.9687 { n gly A 165 2culA_180Y_163}P -14.205 -0.6246 -3.5266 { ca gly A 165 2culA_180Y_163}P -15.2799 -1.5929 -3.5734 {"}P -15.2799 -1.5929 -3.5734 { n val A 178 2culA_180Y_163}P -12.2035 -2.3306 -0.0615 { ca val A 178 2culA_180Y_163}P -10.9215 -2.4824 -0.7303 { n arg A 179 2culA_180Y_163}P -9.6619 -0.5029 -1.3472 { ca arg A 179 2culA_180Y_163}P -9.3164 0.6263 -2.1921 { n tyr A 180 2culA_180Y_163}P -8.3738 0.3855 -4.4067 { ca tyr A 180 2culA_180Y_163}P -7.4187 -0.1079 -5.3794 { n leu A 181 2culA_180Y_163}P -6.258 0.5964 -7.3628 { ca leu A 181 2culA_180Y_163}P -5.9504 1.4742 -8.4774 { n ala A 182 2culA_180Y_163}P -6.9658 1.6288 -10.6592 { ca ala A 182 2culA_180Y_163}P -7.3619 1.1722 -11.9832 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 161 2culA_180Y_163}P -7.0943 6.5022 -10.6417 {"}-7.0943 6.5022 -10.6417 { ca glu A 162 2culA_180Y_163}-8.3189 5.4825 -7.1885 { ca arg A 163 2culA_180Y_163}-11.4109 3.3096 -6.8174 { ca glu A 164 2culA_180Y_163}-13.1297 1.4846 -3.9687 { ca gly A 165 2culA_180Y_163}-15.2799 -1.5929 -3.5734 { ca val A 178 2culA_180Y_163}P -10.9215 -2.4824 -0.7303 {"}-10.9215 -2.4824 -0.7303 { ca arg A 179 2culA_180Y_163}-9.3164 0.6263 -2.1921 { ca tyr A 180 2culA_180Y_163}-7.4187 -0.1079 -5.3794 { ca leu A 181 2culA_180Y_163}-5.9504 1.4742 -8.4774 { ca ala A 182 2culA_180Y_163}-7.3619 1.1722 -11.9832 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 163 2culA_180Y_163}P -11.4109 3.3096 -6.8174 { cb arg A 163 2culA_180Y_163}-11.6456 2.361 -7.9965 { cg arg A 163 2culA_180Y_163}-11.6152 3.0314 -9.3674 { cd arg A 163 2culA_180Y_163}-12.734 4.0453 -9.5029 { ne arg A 163 2culA_180Y_163}-12.817 4.6086 -10.8487 { cz arg A 163 2culA_180Y_163}-13.6226 5.613 -11.1846 { nh1 arg A 163 2culA_180Y_163}-14.4124 6.1646 -10.271 { cz arg A 163 2culA_180Y_163}P -13.6226 5.613 -11.1846 { nh2 arg A 163 2culA_180Y_163}-13.6399 6.0681 -12.4297 { ca tyr A 180 2culA_180Y_163}P -7.4187 -0.1079 -5.3794 { cb tyr A 180 2culA_180Y_163}-7.9285 -1.4298 -5.9657 { cg tyr A 180 2culA_180Y_163}-9.2163 -1.2893 -6.7497 { cd1 tyr A 180 2culA_180Y_163}-9.1962 -1.1068 -8.1327 { ce1 tyr A 180 2culA_180Y_163}-10.3749 -0.9316 -8.8575 { cz tyr A 180 2culA_180Y_163}-11.5927 -0.9359 -8.197 { oh tyr A 180 2culA_180Y_163}-12.7578 -0.7504 -8.9106 { cg tyr A 180 2culA_180Y_163}P -9.2163 -1.2893 -6.7497 { cd2 tyr A 180 2culA_180Y_163}-10.4557 -1.2931 -6.1051 { ce2 tyr A 180 2culA_180Y_163}-11.6424 -1.1166 -6.8241 { cz tyr A 180 2culA_180Y_163}ghost -11.5927 -0.9359 -8.197 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 163 2culA_180Y_163}P -11.6456 2.361 -7.9965 {"}P -11.6456 2.361 -7.9965 { cg arg A 163 2culA_180Y_163}P -11.6152 3.0314 -9.3674 {"}P -11.6152 3.0314 -9.3674 { cd arg A 163 2culA_180Y_163}P -12.734 4.0453 -9.5029 {"}P -12.734 4.0453 -9.5029 { ne arg A 163 2culA_180Y_163}P -12.817 4.6086 -10.8487 { nh1 arg A 163 2culA_180Y_163}P -14.4124 6.1646 -10.271 {"}P -14.4124 6.1646 -10.271 { nh2 arg A 163 2culA_180Y_163}P -13.6399 6.0681 -12.4297 {"}P -13.6399 6.0681 -12.4297 { cb tyr A 180 2culA_180Y_163}P -7.9285 -1.4298 -5.9657 {"}P -7.9285 -1.4298 -5.9657 { cd1 tyr A 180 2culA_180Y_163}P -9.1962 -1.1068 -8.1327 { cd2 tyr A 180 2culA_180Y_163}P -10.4557 -1.2931 -6.1051 { ce1 tyr A 180 2culA_180Y_163}P -10.3749 -0.9316 -8.8575 { ce2 tyr A 180 2culA_180Y_163}P -11.6424 -1.1166 -6.8241 { oh tyr A 180 2culA_180Y_163}P -12.7578 -0.7504 -8.9106 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 180 A}'S' blue -10.0683 0.2811 -7.5191 {"}'S' blue -9.834 0.4243 -7.575 {"}'S' sky -9.995 0.4094 -7.778 {"}'S' blue -9.7332 0.5312 -7.8324 { CE1 TYR 180 A}'S' blue -11.1051 0.6262 -9.1755 { CE2 TYR 180 A}'S' blue -12.2153 0.5309 -6.9629 {"}'S' blue -12.3725 0.4412 -7.142 {"}'S' blue -11.7096 0.6312 -6.751 {"}'S' sky -11.8712 0.6137 -6.9559 {"}'S' sky -12.0351 0.557 -7.1516 {"}'S' sky -12.1963 0.4633 -7.3334 {"}'S' blue -11.3738 0.6112 -6.7403 {"}'S' sky -11.5307 0.6256 -6.9478 {"}'S' sky -11.1646 0.5651 -6.8915 {"}'S' sky -10.9513 0.4787 -7.0194 {"}'S' sky -10.7434 0.3531 -7.1304 { CZ TYR 180 A}'S' blue -12.3106 0.4343 -7.3787 {"}'S' sky -12.4649 0.452 -7.5834 {"}'S' sky -12.6261 0.4142 -7.7815 {"}'S' blue -12.7847 0.3235 -7.9622 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 180 A}'S' green -10.3551 0.4316 -7.7609 {"}'S' green -11.0723 0.6701 -8.7545 {"}'S' green -10.207 0.5856 -8.002 {"}'S' sea -10.9478 0.7159 -8.9964 {"}'S' green -10.0044 0.634 -8.1685 {"}'S' green -10.1388 0.7324 -8.3694 {"}'S' green -10.4422 0.8161 -8.7845 {"}'S' green -10.6037 0.7987 -8.9894 {"}'S' sea -10.1063 0.7962 -8.7738 { CE2 TYR 180 A}'S' sea -11.6929 0.6021 -7.1504 {"}'S' sea -11.3222 0.5824 -7.0989 {"}'S' sea -11.1071 0.5001 -7.2271 { CZ TYR 180 A}'S' sea -12.0775 0.561 -7.4309 {"}'S' green -12.2305 0.5952 -7.6393 {"}'S' green -12.3916 0.5802 -7.8423 {"}'S' sea -12.5544 0.5176 -8.0351 {"}'S' green -11.8259 0.6467 -7.4876 {"}'S' green -12.2901 0.6659 -8.094 {"}'S' sea -12.4508 0.5874 -8.2786 {"}'S' green -12.1656 0.7116 -8.3359 {"}'S' sea -12.3229 0.6219 -8.515 {"}'S' green -11.1035 0.496 -7.3169 {"}'S' sea -12.1466 0.644 -8.7063 {"}'S' green -11.8068 0.7214 -8.7175 {"}'S' green -11.4343 0.7401 -8.6757 {"}'S' green -11.5975 0.6794 -8.8695 {"}'S' green -11.2191 0.662 -8.8046 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 180 A}'S' P -10.4726 0.5607 -7.9493 {"}'S' -10.471 0.5265 -7.9699 {"}'S' P -10.6081 0.6509 -8.1481 {"}'S' -10.5955 0.5639 -8.1879 {"}'S' P -10.756 0.7007 -8.3531 {"}'S' -10.7321 0.6022 -8.3834 {"}'S' P -10.9119 0.7063 -8.5572 {"}'S' -10.8932 0.6483 -8.568 {"}'S' P -10.335 0.6885 -8.197 {"}'S' -10.3371 0.6386 -8.2175 {"}'S' P -10.4774 0.7544 -8.3999 {"}'S' -10.4731 0.6755 -8.4204 {"}'S' P -10.6293 0.7816 -8.6034 {"}'S' -10.6206 0.7183 -8.6129 {"}'S' P -10.787 0.7684 -8.804 {"}'S' -10.7867 0.7633 -8.8042 {"}'S' P -10.2855 0.7932 -8.5771 {"}'S' -10.2863 0.7837 -8.5777 { CZ TYR 180 A}'S' P -11.9738 0.6965 -7.6926 {"}'S' -11.971 0.6842 -7.6962 {"}'S' P -12.1297 0.7021 -7.8967 {"}'S' -12.1271 0.6938 -7.8981 {"}'S' P -11.5528 0.6843 -7.5365 {"}'S' -11.5534 0.6804 -7.5381 {"}'S' P -11.6952 0.7501 -7.7393 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@dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 132 A}'M' greentint -9.3606 2.1286 -6.3566 {"}'M' greentint -9.5042 2.0208 -6.6291 {"}'M' greentint -9.0986 2.4498 -6.224 {"}'M' greentint -9.2619 2.4165 -6.4258 {"}'M' greentint -9.4105 2.2595 -6.5743 {"}'M' greentint -9.5142 2.1632 -6.8718 {"}'M' greentint -9.5707 1.9137 -6.875 {"}'M' greentint -8.9547 2.655 -6.286 {"}'M' greentint -9.1126 2.6466 -6.488 {"}'M' greentint -9.2712 2.5535 -6.6664 {"}'M' greentint -9.4105 2.3855 -6.7995 {"}'M' greentint -9.4838 2.2572 -7.1166 {"}'M' greentint -9.5549 2.0121 -7.1408 {"}'M' greentint -8.9257 2.8357 -6.5558 {"}'M' greentint -9.0858 2.7775 -6.7478 {"}'M' greentint -9.2406 2.6544 -6.9125 {"}'M' greentint -9.3763 2.4769 -7.0387 {"}'M' greentint -9.4059 2.3374 -7.3548 {"}'M' greentint -9.4871 2.0942 -7.3932 {"}'M' greentint -8.8425 2.9551 -6.7992 {"}'M' greentint -9.005 2.8735 -6.9856 {"}'M' greentint -9.1572 2.7376 -7.1456 {"}'M' greentint -9.2939 2.556 -7.2704 {"}'M' greentint -9.2914 2.3822 -7.5845 {"}'M' greentint -8.7481 3.0186 -7.0589 {"}'M' greentint -8.9039 2.9198 -7.2322 {"}'M' greentint -9.05 2.7762 -7.3821 {"}'M' greentint -9.1808 2.5942 -7.5005 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 164 A}'M' greentint -9.5325 1.7875 -6.8248 {"}'M' greentint -9.3743 1.8512 -6.6385 {"}'M' greentint -9.2241 1.9756 -6.4786 {"}'M' greentint -9.091 2.1512 -6.3555 {"}'M' greentint -8.9857 2.3659 -6.2778 {"}'M' greentint -8.9122 2.6057 -6.2509 {"}'M' greentint -9.4819 1.8465 -7.1758 {"}'M' greentint -9.3237 1.8487 -6.972 {"}'M' greentint -9.1631 1.9246 -6.7852 {"}'M' greentint -9.0136 2.07 -6.6328 {"}'M' greentint -8.889 2.27 -6.5269 {"}'M' greentint -8.8004 2.5076 -6.4789 {"}'M' greentint -8.7559 2.7623 -6.4916 {"}'M' greentint -9.3788 2.0091 -7.4308 {"}'M' greentint -9.2301 1.9595 -7.2247 {"}'M' greentint -9.0677 2.0044 -7.0268 {"}'M' greentint -8.9135 2.137 -6.865 {"}'M' greentint -8.7892 2.3404 -6.7604 {"}'M' greentint -8.711 2.586 -6.7283 {"}'M' greentint -8.69 2.8415 -6.7716 {"}'M' greentint -9.2508 2.2447 -7.5933 {"}'M' greentint -9.1191 2.143 -7.3951 {"}'M' greentint -8.9581 2.171 -7.1952 {"}'M' greentint -8.81 2.323 -7.0463 {"}'M' greentint -8.7152 2.5571 -6.989 {"}'M' greentint -8.6989 2.8108 -7.0383 {"}'M' greentint -9.0898 2.516 -7.6265 {"}'M' greentint -8.9856 2.3608 -7.4487 {"}'M' greentint -8.8256 2.4577 -7.2692 {"}'M' greentint -8.7706 2.711 -7.269 {"}'M' greentint -8.8748 2.8662 -7.4469 {"}'M' greentint -8.9039 2.6074 -7.4685 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 132 A}'M' green -9.4982 1.3216 -4.1236 {"}'M' green -9.8949 1.1233 -5.0101 {"}'M' green -9.7476 1.4522 -5.2547 {"}'M' green -9.1836 1.9992 -4.6771 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 132 A}'M' greentint -9.684 1.2302 -4.2816 {"}'M' greentint -9.8173 1.1266 -4.4811 {"}'M' greentint -9.6024 1.4768 -4.3014 {"}'M' greentint -9.7623 1.3799 -4.4808 {"}'M' greentint -9.8727 1.2805 -4.7611 {"}'M' greentint -9.889 1.0268 -4.7118 {"}'M' greentint -9.3371 1.5929 -4.1568 {"}'M' greentint -9.4689 1.6946 -4.3549 {"}'M' greentint -9.6299 1.6666 -4.5549 {"}'M' greentint -9.7779 1.5146 -4.7038 {"}'M' greentint -9.8445 1.3779 -5.0147 {"}'M' greentint -9.2805 1.8645 -4.4216 {"}'M' greentint -9.4393 1.8676 -4.6275 {"}'M' greentint -9.5996 1.7766 -4.8103 {"}'M' greentint -9.741 1.6061 -4.9459 {"}'M' greentint -9.3449 1.96 -4.8749 {"}'M' greentint -9.5015 1.848 -5.0463 {"}'M' greentint -9.6401 1.6733 -5.1771 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 164 A}'M' green -9.3862 1.5043 -4.0806 {"}'M' green -9.9022 1.1096 -4.9538 {"}'M' green -9.221 1.8042 -4.2668 {"}'M' green -9.1719 2.0422 -4.5274 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 164 A}'M' greentint -9.814 1.0299 -4.5006 {"}'M' greentint -9.6562 1.1402 -4.3271 {"}'M' greentint -9.5108 1.3019 -4.1842 {"}'M' greentint -9.743 1.1321 -4.7533 {"}'M' greentint -9.5833 1.2206 -4.5723 {"}'M' greentint -9.4366 1.3702 -4.4248 {"}'M' greentint -9.3129 1.57 -4.3201 {"}'M' greentint -9.7836 1.2916 -5.1083 {"}'M' greentint -9.6248 1.3026 -4.9074 {"}'M' greentint -9.4677 1.3985 -4.7301 {"}'M' greentint -9.3293 1.569 -4.5986 {"}'M' greentint -9.2264 1.7925 -4.5277 {"}'M' greentint -9.6493 1.4994 -5.1841 {"}'M' greentint -9.4861 1.5286 -4.9815 {"}'M' greentint -9.3364 1.6824 -4.8306 {"}'M' greentint -9.2411 1.9187 -4.7731 {"}'M' greentint -9.5366 1.7292 -5.2193 {"}'M' greentint -9.3779 1.8266 -5.0417 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gln A 189 2cwsA_278Y_191}P -7.3403 6.2479 -11.3898 {"}-7.3403 6.2479 -11.3898 { ca gln A 189 2cwsA_278Y_191}-8.2586 6.2602 -10.2331 { c gln A 189 2cwsA_278Y_191}-7.6412 5.5097 -9.0693 { o gln A 189 2cwsA_278Y_191}-6.7921 4.6265 -9.2247 { c gln A 189 2cwsA_278Y_191}P -7.6412 5.5097 -9.0693 { n ile A 190 2cwsA_278Y_191}-8.18 5.8215 -7.8809 { ca ile A 190 2cwsA_278Y_191}-8.2772 4.8503 -6.7941 { c ile A 190 2cwsA_278Y_191}-9.775 4.5777 -6.6635 { o ile A 190 2cwsA_278Y_191}-10.5253 5.5354 -6.4415 { c ile A 190 2cwsA_278Y_191}P -9.775 4.5777 -6.6635 { n his A 191 2cwsA_278Y_191}-10.1727 3.3088 -6.75 { ca his A 191 2cwsA_278Y_191}-11.5715 2.9925 -6.6416 { c his A 191 2cwsA_278Y_191}-11.8417 2.2168 -5.3539 { o his A 191 2cwsA_278Y_191}-11.0625 1.2899 -5.0002 { c his A 191 2cwsA_278Y_191}P -11.8417 2.2168 -5.3539 { n gly A 192 2cwsA_278Y_191}-12.9194 2.5886 -4.6476 { ca gly A 192 2cwsA_278Y_191}-13.348 1.7867 -3.538 { c gly A 192 2cwsA_278Y_191}-14.0395 0.5132 -3.9685 { o gly A 192 2cwsA_278Y_191}-14.5546 0.3888 -5.0765 { c gly A 192 2cwsA_278Y_191}P -14.0395 0.5132 -3.9685 { n ile A 193 2cwsA_278Y_191}-14.0922 -0.4301 -3.0169 { ca ile A 193 2cwsA_278Y_191}-14.8139 -1.6998 -3.2521 { c ile A 193 2cwsA_278Y_191}-15.157 -2.238 -1.8654 { o ile A 193 2cwsA_278Y_191}-14.4155 -2.0133 -0.8896 { n lys A 276 2cwsA_278Y_191}P -12.3566 -1.2896 0.9032 {"}-12.3566 -1.2896 0.9032 { ca lys A 276 2cwsA_278Y_191}-11.0289 -1.5657 0.3645 { c lys A 276 2cwsA_278Y_191}-10.9004 -0.8225 -0.9453 { o lys A 276 2cwsA_278Y_191}-11.8225 -0.1088 -1.3825 { c lys A 276 2cwsA_278Y_191}P -10.9004 -0.8225 -0.9453 { n tyr A 277 2cwsA_278Y_191}-9.7233 -0.9291 -1.5815 { ca tyr A 277 2cwsA_278Y_191}-9.3519 -0.0524 -2.6924 { c tyr A 277 2cwsA_278Y_191}-8.5115 -0.7855 -3.7055 { o tyr A 277 2cwsA_278Y_191}-7.8024 -1.7599 -3.3855 { c tyr A 277 2cwsA_278Y_191}P -8.5115 -0.7855 -3.7055 { n tyr A 278 2cwsA_278Y_191}-8.5506 -0.3072 -4.9379 { ca tyr A 278 2cwsA_278Y_191}-7.6535 -0.7604 -5.9853 { c tyr A 278 2cwsA_278Y_191}-7.3786 0.4167 -6.9225 { o tyr A 278 2cwsA_278Y_191}-8.2089 1.3309 -7.092 { c tyr A 278 2cwsA_278Y_191}P -7.3786 0.4167 -6.9225 { n phe A 279 2cwsA_278Y_191}-6.1913 0.3921 -7.5309 { ca phe A 279 2cwsA_278Y_191}-5.8324 1.3991 -8.5177 { c phe A 279 2cwsA_278Y_191}-6.4392 1.0797 -9.8757 { o phe A 279 2cwsA_278Y_191}-6.7059 -0.0891 -10.2127 { c phe A 279 2cwsA_278Y_191}P -6.4392 1.0797 -9.8757 { n lys A 280 2cwsA_278Y_191}-6.5935 2.1325 -10.7062 { ca lys A 280 2cwsA_278Y_191}-6.9404 1.9792 -12.1092 { c lys A 280 2cwsA_278Y_191}-6.1172 2.9704 -12.9105 { o lys A 280 2cwsA_278Y_191}-5.7546 4.052 -12.3953 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gln A 189 2cwsA_278Y_191}P -7.3403 6.2479 -11.3898 { ca gln A 189 2cwsA_278Y_191}P -8.2586 6.2602 -10.2331 { n ile A 190 2cwsA_278Y_191}P -8.18 5.8215 -7.8809 { ca ile A 190 2cwsA_278Y_191}P -8.2772 4.8503 -6.7941 { n his A 191 2cwsA_278Y_191}P -10.1727 3.3088 -6.75 { ca his A 191 2cwsA_278Y_191}P -11.5715 2.9925 -6.6416 { n gly A 192 2cwsA_278Y_191}P -12.9194 2.5886 -4.6476 { ca gly A 192 2cwsA_278Y_191}P -13.348 1.7867 -3.538 {"}P -13.348 1.7867 -3.538 { n ile A 193 2cwsA_278Y_191}P -14.0922 -0.4301 -3.0169 { ca ile A 193 2cwsA_278Y_191}P -14.8139 -1.6998 -3.2521 { n lys A 276 2cwsA_278Y_191}P -12.3566 -1.2896 0.9032 { ca lys A 276 2cwsA_278Y_191}P -11.0289 -1.5657 0.3645 { n tyr A 277 2cwsA_278Y_191}P -9.7233 -0.9291 -1.5815 { ca tyr A 277 2cwsA_278Y_191}P -9.3519 -0.0524 -2.6924 { n tyr A 278 2cwsA_278Y_191}P -8.5506 -0.3072 -4.9379 { ca tyr A 278 2cwsA_278Y_191}P -7.6535 -0.7604 -5.9853 { n phe A 279 2cwsA_278Y_191}P -6.1913 0.3921 -7.5309 { ca phe A 279 2cwsA_278Y_191}P -5.8324 1.3991 -8.5177 { n lys A 280 2cwsA_278Y_191}P -6.5935 2.1325 -10.7062 { ca lys A 280 2cwsA_278Y_191}P -6.9404 1.9792 -12.1092 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gln A 189 2cwsA_278Y_191}P -8.2586 6.2602 -10.2331 {"}-8.2586 6.2602 -10.2331 { ca ile A 190 2cwsA_278Y_191}-8.2772 4.8503 -6.7941 { ca his A 191 2cwsA_278Y_191}-11.5715 2.9925 -6.6416 { ca gly A 192 2cwsA_278Y_191}-13.348 1.7867 -3.538 { ca ile A 193 2cwsA_278Y_191}-14.8139 -1.6998 -3.2521 { ca lys A 276 2cwsA_278Y_191}P -11.0289 -1.5657 0.3645 {"}-11.0289 -1.5657 0.3645 { ca tyr A 277 2cwsA_278Y_191}-9.3519 -0.0524 -2.6924 { ca tyr A 278 2cwsA_278Y_191}-7.6535 -0.7604 -5.9853 { ca phe A 279 2cwsA_278Y_191}-5.8324 1.3991 -8.5177 { ca lys A 280 2cwsA_278Y_191}-6.9404 1.9792 -12.1092 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca his A 191 2cwsA_278Y_191}P -11.5715 2.9925 -6.6416 { cb his A 191 2cwsA_278Y_191}-11.9573 2.1263 -7.8648 { cg his A 191 2cwsA_278Y_191}-13.4002 2.2657 -8.1975 { nd1 his A 191 2cwsA_278Y_191}-14.4388 1.7721 -7.4366 { ce1 his A 191 2cwsA_278Y_191}-15.5913 2.0768 -8.0202 { ne2 his A 191 2cwsA_278Y_191}ghost -15.3508 2.7702 -9.1417 { cg his A 191 2cwsA_278Y_191}P -13.4002 2.2657 -8.1975 { cd2 his A 191 2cwsA_278Y_191}-13.9665 2.8997 -9.2392 { ne2 his A 191 2cwsA_278Y_191}-15.3508 2.7702 -9.1417 { ca tyr A 278 2cwsA_278Y_191}P -7.6535 -0.7604 -5.9853 { cb tyr A 278 2cwsA_278Y_191}-8.2285 -1.959 -6.7523 { cg tyr A 278 2cwsA_278Y_191}-9.5521 -1.7324 -7.4168 { cd1 tyr A 278 2cwsA_278Y_191}-10.7315 -2.0744 -6.7515 { ce1 tyr A 278 2cwsA_278Y_191}-11.9672 -1.8847 -7.3199 { cz tyr A 278 2cwsA_278Y_191}-12.066 -1.3003 -8.5829 { oh tyr A 278 2cwsA_278Y_191}-13.275 -1.0956 -9.1902 { cg tyr A 278 2cwsA_278Y_191}P -9.5521 -1.7324 -7.4168 { cd2 tyr A 278 2cwsA_278Y_191}-9.68 -1.1789 -8.6767 { ce2 tyr A 278 2cwsA_278Y_191}-10.8952 -0.9649 -9.2621 { cz tyr A 278 2cwsA_278Y_191}ghost -12.066 -1.3003 -8.5829 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb his A 191 2cwsA_278Y_191}P -11.9573 2.1263 -7.8648 {"}P -11.9573 2.1263 -7.8648 { nd1 his A 191 2cwsA_278Y_191}P -14.4388 1.7721 -7.4366 { cd2 his A 191 2cwsA_278Y_191}P -13.9665 2.8997 -9.2392 { ce1 his A 191 2cwsA_278Y_191}P -15.5913 2.0768 -8.0202 { ne2 his A 191 2cwsA_278Y_191}P -15.3508 2.7702 -9.1417 { cb tyr A 278 2cwsA_278Y_191}P -8.2285 -1.959 -6.7523 {"}P -8.2285 -1.959 -6.7523 { cd1 tyr A 278 2cwsA_278Y_191}P -10.7315 -2.0744 -6.7515 { cd2 tyr A 278 2cwsA_278Y_191}P -9.68 -1.1789 -8.6767 { ce1 tyr A 278 2cwsA_278Y_191}P -11.9672 -1.8847 -7.3199 { ce2 tyr A 278 2cwsA_278Y_191}P -10.8952 -0.9649 -9.2621 { oh tyr A 278 2cwsA_278Y_191}P -13.275 -1.0956 -9.1902 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 278 A}'S' blue -10.5978 0.027 -7.802 {"}'S' blue -10.3979 0.1913 -7.8585 { CE1 TYR 278 A}'S' blue -12.0697 -0.1987 -6.8623 {"}'S' sky -12.2216 -0.1715 -7.0658 {"}'S' sky -12.3792 -0.1846 -7.2664 {"}'S' blue -11.731 -0.2207 -6.8319 {"}'S' sky -11.5495 -0.2099 -7.0288 {"}'S' sky -11.3407 -0.2568 -7.1805 { CE2 TYR 278 A}'S' sky -11.8569 0.4886 -9.1002 {"}'S' sky -11.5926 0.6369 -9.159 {"}'S' sky -11.3073 0.7352 -9.2085 {"}'S' blue -10.6591 0.6991 -8.774 {"}'S' blue -10.8059 0.7599 -8.9816 {"}'S' blue -10.9625 0.7829 -9.189 { CZ TYR 278 A}'S' blue -12.8648 0.2158 -8.2282 {"}'S' blue -13.0276 0.1532 -8.4211 {"}'S' sky -12.7633 0.3015 -8.4799 {"}'S' blue -12.924 0.223 -8.6646 {"}'S' sky -12.6389 0.3472 -8.7218 {"}'S' blue -12.7961 0.2575 -8.9009 {"}'S' blue -12.4587 0.3734 -8.9105 {"}'S' sky -12.1165 0.4184 -8.9092 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 278 A}'S' sea -11.8778 -0.1599 -7.0395 {"}'S' green -12.0344 -0.1369 -7.2469 {"}'S' green -11.6986 -0.1569 -7.2362 { CE2 TYR 278 A}'S' green -11.7674 0.423 -8.6484 {"}'S' sea -10.9472 -0.0409 -7.777 {"}'S' green -11.019 0.1591 -7.9259 {"}'S' green -11.533 0.5662 -8.7043 {"}'S' sea -11.6941 0.5513 -8.9073 {"}'S' green -10.7777 0.2345 -7.9928 {"}'S' green -10.8754 0.3984 -8.1654 {"}'S' green -11.2763 0.6675 -8.7576 {"}'S' green -11.4322 0.6731 -8.9617 {"}'S' sea -10.7273 0.5523 -8.4065 {"}'S' sea -10.8553 0.6553 -8.6015 {"}'S' sea -10.9977 0.7212 -8.8044 {"}'S' sea -11.1496 0.7483 -9.008 { CZ TYR 278 A}'S' green -12.2886 -0.0106 -7.4215 {"}'S' green -12.4109 0.1156 -7.614 {"}'S' green -12.5508 0.1966 -7.8168 {"}'S' green -11.9485 -0.1009 -7.3137 {"}'S' green -11.6921 -0.0898 -7.3759 {"}'S' sea -12.2948 0.43 -8.7148 {"}'S' green -11.9543 0.4419 -8.7067 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 278 A}'S' P -11.3493 0.213 -8.0496 {"}'S' -11.3297 0.1612 -8.1033 {"}'S' P -11.4708 0.3349 -8.2418 {"}'S' -11.4389 0.2623 -8.2978 {"}'S' P -11.6131 0.4053 -8.4438 {"}'S' -11.5856 0.3533 -8.4748 {"}'S' P -11.1179 0.3248 -8.1006 {"}'S' -11.111 0.2846 -8.1368 {"}'S' P -11.2401 0.4511 -8.2931 {"}'S' -11.2248 0.3871 -8.3362 {"}'S' P -11.38 0.532 -8.4959 {"}'S' -11.3642 0.4836 -8.5214 {"}'S' P -10.993 0.5275 -8.3538 {"}'S' -10.993 0.5187 -8.3586 {"}'S' P -11.1284 0.6177 -8.5526 {"}'S' -11.1284 0.6177 -8.5526 { CZ TYR 278 A}'S' P -12.0462 0.063 -7.4863 {"}'S' -12.0469 0.0247 -7.5178 {"}'S' P -12.1637 0.1921 -7.6747 {"}'S' -12.1593 0.1121 -7.7239 {"}'S' P -12.2991 0.2823 -7.8735 {"}'S' -12.2878 0.2048 -7.9087 {"}'S' P -12.4471 0.3321 -8.0785 {"}'S' -12.4407 0.306 -8.0861 {"}'S' P -11.7854 0.0792 -7.5437 {"}'S' -11.7985 0.0124 -7.5943 {"}'S' P -11.8981 0.2169 -7.7274 {"}'S' -11.9113 0.0884 -7.7999 {"}'S' P -12.026 0.3199 -7.9224 {"}'S' -12.0302 0.1724 -7.9833 {"}'S' P -12.1685 0.3858 -8.1253 {"}'S' -12.1622 0.2749 -8.1546 {"}'S' P -12.3204 0.4129 -8.3288 {"}'S' -12.3169 0.384 -8.3329 {"}'S' P -11.4767 -0.0348 -7.5281 {"}'S' -11.4821 -0.0449 -7.5366 {"}'S' P -11.5768 0.1316 -7.7029 {"}'S' -11.6067 0.0423 -7.7575 {"}'S' P -11.6955 0.2653 -7.8939 {"}'S' -11.73 0.118 -7.9587 {"}'S' P -11.8298 0.3637 -8.0949 {"}'S' -11.8524 0.2059 -8.141 {"}'S' P -11.9766 0.4245 -8.3025 {"}'S' -11.9823 0.3149 -8.3194 {"}'S' P -12.1332 0.4475 -8.5099 {"}'S' -12.1323 0.4285 -8.5111 {"}'S' P -11.2831 0.0026 -7.7163 {"}'S' -11.2853 -0.0014 -7.7184 {"}'S' P -11.3881 0.1589 -7.8955 {"}'S' -11.4201 0.0895 -7.9286 {"}'S' P -11.5104 0.2835 -8.0894 {"}'S' -11.5491 0.173 -8.124 {"}'S' P -11.6483 0.3746 -8.2919 {"}'S' -11.6747 0.2674 -8.3104 {"}'S' P -11.7974 0.4276 -8.4992 {"}'S' -11.8058 0.374 -8.5018 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 278 A}'S' blue -13.6161 0.1115 -8.5682 {"}'S' blue -13.2452 0.0911 -8.4479 {"}'S' blue -13.3749 0.1884 -8.6424 {"}'S' blue -13.5203 0.2388 -8.844 {"}'S' blue -13.6755 0.2379 -9.044 {"}'S' blue -13.0722 0.1788 -8.6468 {"}'S' blue -13.2087 0.2602 -8.8469 { HH TYR 278 A}'S' blue -13.4473 0.3899 -9.1495 {"}'S' blue -13.5822 0.4848 -9.3504 {"}'S' blue -13.1122 0.3031 -9.0357 {"}'S' sky -13.2054 0.4749 -9.2041 {"}'S' sky -13.3336 0.584 -9.4008 {"}'S' blue -13.4853 0.6195 -9.6059 {"}'S' blue -12.9457 0.48 -9.2705 {"}'S' blue -13.0629 0.6046 -9.4558 {"}'S' blue -13.2028 0.6697 -9.6551 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB HIS 191 A}'S' sky -12.7167 0.586 -8.2009 {"}'S' sky -12.6389 0.6711 -8.5582 {"}'S' blue -12.4953 0.7685 -8.8286 {"}'S' sky -12.2411 0.7517 -8.9096 {"}'S' blue -12.0256 0.8352 -9.0442 {"}'S' sky -11.7904 0.9197 -9.1214 {"}'S' sky -11.5513 1.0214 -9.1596 {"}'S' blue -11.3045 1.1184 -9.1384 {"}'S' sky -11.1865 0.9901 -8.9495 {"}'S' sky -10.8869 0.9193 -8.5427 {"}'S' blue -10.8888 1.1193 -8.8182 { CG HIS 191 A}'S' blue -13.7017 0.6432 -8.7809 {"}'S' blue -13.5596 0.5648 -8.5757 {"}'S' blue -13.4072 0.524 -8.3684 {"}'S' blue -13.0841 0.5613 -7.9608 {"}'S' blue -13.684 0.8911 -9.2423 {"}'S' blue -13.5722 0.7518 -9.0594 {"}'S' blue -13.4439 0.6482 -8.8638 {"}'S' blue -13.3027 0.5814 -8.6624 {"}'S' blue -13.1504 0.5536 -8.4582 {"}'S' blue -12.9928 0.5653 -8.2574 {"}'S' blue -12.8325 0.6157 -8.0651 {"}'S' blue -13.4685 0.9746 -9.3769 {"}'S' sky -13.359 0.8286 -9.1957 {"}'S' sky -13.2321 0.7199 -9.0008 {"}'S' blue -13.0901 0.6518 -8.798 {"}'S' blue -12.9374 0.6249 -8.5934 {"}'S' sky -12.7783 0.6417 -8.3918 {"}'S' blue -13.2333 1.0591 -9.4541 {"}'S' sky -13.1226 0.9113 -9.2708 {"}'S' blue -12.9914 0.8059 -9.0725 {"}'S' blue -12.845 0.7471 -8.8658 {"}'S' blue -12.6872 0.7355 -8.6594 { HB3 HIS 191 A}'S' sky -12.1391 0.1361 -7.0866 {"}'S' blue -11.981 0.2129 -6.9033 {"}'S' sky -11.7569 0.107 -6.995 {"}'S' sky -11.4578 0.1125 -7.0421 {"}'S' blue -10.7196 0.4792 -7.706 @dotlist {x} color= white width= 1 master= {vdw contact} { CB HIS 191 A}'S' sea -12.517 0.5457 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{"}'S' -11.526 0.053 -7.8752 {"}'S' P -11.3468 -0.0342 -7.6994 {"}'S' -11.3551 -0.0122 -7.6986 {"}'S' P -11.6471 0.3257 -8.5542 {"}'S' -11.6502 0.3572 -8.5177 {"}'S' P -11.5435 0.167 -8.3763 {"}'S' -11.5567 0.236 -8.3213 {"}'S' P -11.4086 0.0721 -8.1754 {"}'S' -11.4314 0.1464 -8.1364 {"}'S' P -11.2528 0.0479 -7.9672 {"}'S' -11.2663 0.0773 -7.9582 {"}'S' P -11.4089 0.4326 -8.5846 {"}'S' -11.4245 0.4639 -8.5395 {"}'S' P -11.3064 0.2798 -8.4095 {"}'S' -11.3397 0.3425 -8.3498 {"}'S' P -11.1692 0.2048 -8.21 {"}'S' -11.2057 0.2617 -8.1738 {"}'S' P -11.0129 0.2156 -8.0108 {"}'S' -11.0211 0.2245 -8.0069 {"}'S' P -11.1515 0.5027 -8.5016 {"}'S' -11.1707 0.5215 -8.474 {"}'S' P -11.0181 0.4 -8.3009 {"}'S' -11.0414 0.4219 -8.2797 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 278 A}'M' greentint -9.381 1.7234 -6.4356 {"}'M' greentint -9.5246 1.6156 -6.7081 {"}'M' greentint -9.1191 2.0446 -6.303 {"}'M' greentint -9.2823 2.0112 -6.5048 {"}'M' greentint -9.4309 1.8543 -6.6533 {"}'M' greentint -9.5346 1.758 -6.9508 {"}'M' greentint -8.9751 2.2498 -6.365 {"}'M' greentint -9.1331 2.2414 -6.567 {"}'M' greentint -9.2917 2.1482 -6.7454 {"}'M' greentint -9.4309 1.9803 -6.8786 {"}'M' greentint -9.5043 1.852 -7.1956 {"}'M' greentint -9.5754 1.6069 -7.2198 {"}'M' greentint -8.79 2.4198 -6.431 {"}'M' greentint -8.9461 2.4305 -6.6348 {"}'M' greentint -9.1063 2.3723 -6.8268 {"}'M' greentint -9.2611 2.2492 -6.9915 {"}'M' greentint -9.3968 2.0716 -7.1177 {"}'M' greentint -9.4264 1.9322 -7.4338 {"}'M' greentint -8.7029 2.5739 -6.6769 {"}'M' greentint -8.863 2.5499 -6.8782 {"}'M' greentint -9.0254 2.4683 -7.0646 {"}'M' greentint -9.1777 2.3324 -7.2246 {"}'M' greentint -9.3143 2.1508 -7.3494 {"}'M' greentint -9.3119 1.977 -7.6635 {"}'M' greentint -8.6094 2.6644 -6.9457 {"}'M' greentint -8.7685 2.6133 -7.1379 {"}'M' greentint -8.9243 2.5146 -7.3112 {"}'M' greentint -9.0705 2.371 -7.4611 {"}'M' greentint -9.2013 2.189 -7.5795 @subgroup {2->1} dominant @dotlist 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-7.4187 {"}'M' greentint -8.8406 1.922 -7.2187 {"}'M' greentint -8.6925 2.074 -7.0698 {"}'M' greentint -8.5977 2.3081 -7.0125 {"}'M' greentint -8.5814 2.5618 -7.0618 {"}'M' greentint -8.9723 2.267 -7.65 {"}'M' greentint -8.8681 2.1118 -7.4722 {"}'M' greentint -8.7081 2.2087 -7.2928 {"}'M' greentint -8.6531 2.462 -7.2926 {"}'M' greentint -8.7864 2.3584 -7.492 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 278 A}'M' green -10.1778 0.2097 -5.2788 {"}'M' green -9.6365 1.2943 -5.2241 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 278 A}'M' greentint -9.9757 0.5644 -4.6307 {"}'M' greentint -10.1089 0.4608 -4.8302 {"}'M' greentint -9.894 0.811 -4.6505 {"}'M' greentint -10.054 0.7141 -4.83 {"}'M' greentint -10.1643 0.6147 -5.1102 {"}'M' greentint -10.1806 0.361 -5.0609 {"}'M' greentint -9.7605 1.0289 -4.7041 {"}'M' greentint -9.9215 1.0008 -4.904 {"}'M' greentint -10.0695 0.8488 -5.0529 {"}'M' greentint -10.1361 0.7122 -5.3638 {"}'M' 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0.2331 -6.3646 {"}'S' sky -10.4983 0.1062 -6.9134 {"}'S' sky -10.6596 0.0097 -7.0947 { CD2 TYR 441 A}'S' blue -10.6633 -0.1185 -7.3132 {"}'S' sky -10.5317 0.1022 -7.3631 {"}'S' blue -10.3868 0.3029 -7.4484 {"}'S' sky -10.5445 0.3029 -7.652 {"}'S' blue -10.1869 0.4672 -7.5049 {"}'S' blue -10.3412 0.4848 -7.7095 { CE1 TYR 441 A}'S' sky -12.8281 -0.2768 -6.1756 {"}'S' sky -12.9888 -0.341 -6.3652 {"}'S' blue -13.1421 -0.4682 -6.5286 {"}'S' blue -12.4705 -0.1125 -6.0285 {"}'S' sky -13.0952 -0.3627 -6.7672 {"}'S' sky -13.2294 -0.5454 -6.8901 {"}'S' blue -12.2374 0.0142 -6.0807 {"}'S' sky -13.1556 -0.4765 -7.1314 {"}'S' sky -12.7658 -0.078 -7.0962 { CE2 TYR 441 A}'S' sky -10.7813 0.052 -7.4536 {"}'S' sky -11.2141 0.625 -8.1725 {"}'S' sky -10.6119 0.3275 -7.6694 {"}'S' sky -10.7095 0.4914 -7.842 {"}'S' sky -10.8271 0.6204 -8.0304 {"}'S' blue -10.9625 0.7106 -8.2292 {"}'S' sky -12.0203 0.1929 -9.4525 {"}'S' sky -10.8319 0.8141 -8.481 {"}'S' sky -11.6127 0.5604 -9.4185 {"}'S' sky -11.7563 0.4018 -9.5598 {"}'S' blue -10.7966 0.8759 -8.8656 {"}'S' sky -10.9582 0.8584 -9.0705 {"}'S' sky -11.1221 0.8017 -9.2662 {"}'S' blue -11.2832 0.708 -9.4479 { CZ TYR 441 A}'S' sky -13.2239 -0.4169 -7.3904 {"}'S' blue -13.376 -0.577 -7.5412 {"}'S' sky -12.8969 0.1821 -7.779 {"}'S' sky -13.0554 0.0913 -7.9597 {"}'S' sky -12.3299 0.0563 -9.3541 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 441 A}'S' sea -11.191 0.0926 -6.1379 {"}'S' sea -10.9057 0.191 -6.1874 {"}'S' green -11.0665 0.1384 -6.3798 {"}'S' green -10.7224 0.2212 -6.3728 {"}'S' green -10.8863 0.1645 -6.5685 {"}'S' sea -10.5441 0.2096 -6.5672 {"}'S' green -10.7077 0.1482 -6.7614 {"}'S' green -10.8685 0.0497 -6.9417 { CE1 TYR 441 A}'S' sea -12.6248 -0.0948 -6.2332 {"}'S' sea -12.786 -0.1326 -6.4313 {"}'S' sea -12.9446 -0.2233 -6.6119 {"}'S' sea -12.3904 0.0484 -6.289 {"}'S' sea -12.5515 0.0334 -6.4921 {"}'S' green -12.7143 -0.0292 -6.6849 {"}'S' sea -12.8729 -0.1382 -6.8597 {"}'S' sea -13.0222 -0.2898 -7.0104 {"}'S' 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-13.089 -0.1706 -7.4417 {"}'S' sea -13.2524 -0.2668 -7.6259 {"}'S' sea -12.7812 0.0379 -7.3197 {"}'S' sea -12.9389 0.0379 -7.5233 {"}'S' sea -13.0997 -0.0264 -7.713 {"}'S' sea -12.439 0.1318 -7.1743 {"}'S' sea -12.5813 0.2022 -7.3762 {"}'S' sea -12.7356 0.2198 -7.5809 {"}'S' green -12.2084 0.2479 -7.2255 {"}'S' green -12.3482 0.3288 -7.4284 {"}'S' green -12.5012 0.363 -7.6368 {"}'S' sea -12.6623 0.3481 -7.8398 {"}'S' green -12.4004 0.4699 -7.8942 {"}'S' sea -12.5608 0.4337 -8.0915 {"}'S' sea -12.7215 0.3553 -8.2761 {"}'S' sea -12.8766 0.2367 -8.444 {"}'S' green -12.1179 0.5452 -7.9404 {"}'S' green -12.2755 0.532 -8.1409 {"}'S' green -12.4364 0.4795 -8.3334 {"}'S' green -12.5936 0.3898 -8.5125 {"}'S' green -12.7468 0.2643 -8.6744 {"}'S' green -11.7741 0.5567 -7.9141 {"}'S' green -11.9307 0.5797 -8.1214 {"}'S' green -12.0923 0.5623 -8.3263 {"}'S' green -12.5728 0.2822 -8.8695 {"}'S' green -11.0806 0.1348 -7.3278 {"}'S' green -11.4458 0.5068 -7.9034 {"}'S' sea -11.5949 0.5598 -8.1107 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-7.7053 {"}'S' P -12.2384 0.3907 -8.8953 {"}'S' -12.2384 0.3893 -8.895 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 441 A}'S' blue -13.8816 -0.5602 -7.8004 {"}'S' sky -13.6325 -0.49 -7.6878 {"}'S' sky -13.7342 -0.3346 -7.864 {"}'S' sky -13.872 -0.2552 -8.0636 {"}'S' sky -13.4368 -0.3041 -7.7447 {"}'S' sky -13.6869 -0.0852 -8.1296 {"}'S' sky -13.3119 -0.0605 -7.968 {"}'S' sky -13.4469 0.033 -8.1686 {"}'S' sky -13.0395 0.1817 -8.4473 {"}'S' sky -13.3484 0.2035 -8.8522 {"}'S' blue -13.5086 0.1428 -9.042 {"}'S' sky -13.3338 0.1337 -9.235 {"}'S' sky -13.1281 0.0929 -9.3854 {"}'S' sky -12.7563 0.0742 -9.3207 {"}'S' blue -12.5286 -0.0487 -9.3916 { HH TYR 441 A}'S' blue -13.0104 0.0611 -9.5967 {"}'S' blue -12.6787 -0.0001 -9.5804 {"}'S' blue -12.8214 0.055 -9.7795 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 441 A}'S' sea -13.5477 -0.1635 -7.9284 {"}'S' sea -13.1904 0.216 -8.651 {"}'S' green -13.0139 0.2218 -8.8451 {"}'S' sea -13.173 0.2007 -9.0459 {"}'S' 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CG2 VAL 372 A}'S' green -12.2255 0.615 -8.182 {"}'S' green -12.1189 0.593 -8.4654 {"}'S' green -11.9551 0.631 -8.2656 {"}'S' green -11.8639 0.635 -8.5621 {"}'S' green -11.7035 0.6854 -8.3699 {"}'S' sea -11.5454 0.7739 -8.1894 {"}'S' green -11.6494 0.7114 -8.6966 {"}'S' green -11.4879 0.7703 -8.5048 {"}'S' sea -11.33 0.8702 -8.3288 {"}'S' green -11.5582 0.8051 -8.9642 {"}'S' green -11.3961 0.8431 -8.7649 {"}'S' sea -11.2347 0.9282 -8.5792 {"}'S' sea -11.4723 0.949 -9.2111 {"}'S' sea -11.3138 0.9609 -9.0092 {"}'S' sea -11.1526 1.0273 -8.8194 { HB VAL 372 A}'S' green -12.2082 0.2614 -6.7003 {"}'S' green -12.0609 0.2183 -6.4978 {"}'S' green -11.9035 0.2362 -6.2987 {"}'S' green -11.5213 0.2072 -6.2071 {"}'S' green -11.2222 0.2127 -6.2542 {"}'S' sea -11.0828 0.3734 -6.1173 {"}'S' green -11.1156 0.1196 -6.5212 {"}'S' green -10.9655 0.2555 -6.3659 {"}'S' sea -10.8314 0.4354 -6.2425 {"}'S' green -11.7188 0.5412 -7.8281 {"}'S' green -10.9535 0.142 -6.7286 {"}'S' green -10.8031 0.2734 -6.5701 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{"}'S' P -11.4116 0.4259 -7.7663 {"}'S' -11.4129 0.4379 -7.7521 {"}'S' P -11.3079 0.2671 -7.5884 {"}'S' -11.315 0.3046 -7.5588 {"}'S' P -11.173 0.1723 -7.3875 {"}'S' -11.1775 0.1892 -7.3788 {HG21 VAL 372 A}'S' P -12.5646 0.387 -8.5798 {"}'S' -12.5645 0.3884 -8.58 {"}'S' P -12.463 0.3243 -8.8623 {"}'S' -12.4641 0.3278 -8.863 {"}'S' P -12.305 0.41 -8.6813 {"}'S' -12.3114 0.4285 -8.6876 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O TYR 441 A}'M' P -9.3956 2.6435 -6.9748 {"}'M' -9.3936 2.6427 -6.9753 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 441 A}'M' greentint -9.3798 2.2952 -6.2927 {"}'M' greentint -9.5234 2.1875 -6.5652 {"}'M' greentint -9.2811 2.5831 -6.362 {"}'M' greentint -9.4297 2.4262 -6.5105 {"}'M' greentint -9.5334 2.3299 -6.808 {"}'M' greentint -9.59 2.0804 -6.8112 {"}'M' greentint -9.1319 2.8133 -6.4241 {"}'M' greentint -9.2905 2.7201 -6.6025 {"}'M' greentint -9.4297 2.5521 -6.7357 {"}'M' greentint 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{H-bonds} { H VAL 372 A}'M' greentint -9.4617 2.0889 -6.4567 {"}'M' greentint -9.3204 2.2396 -6.3151 {"}'M' greentint -9.1998 2.4339 -6.2134 {"}'M' greentint -9.506 1.9516 -6.9045 {"}'M' greentint -9.3478 2.0153 -6.7182 {"}'M' greentint -9.1975 2.1398 -6.5584 {"}'M' greentint -9.0644 2.3154 -6.4353 {"}'M' greentint -8.9592 2.53 -6.3576 {"}'M' greentint -8.8857 2.7698 -6.3307 {"}'M' greentint -9.4554 2.0106 -7.2556 {"}'M' greentint -9.2972 2.0128 -7.0518 {"}'M' greentint -9.1365 2.0888 -6.865 {"}'M' greentint -8.987 2.2342 -6.7126 {"}'M' greentint -8.8624 2.4341 -6.6067 {"}'M' greentint -8.7738 2.6717 -6.5587 {"}'M' greentint -8.7293 2.9265 -6.5714 {"}'M' greentint -9.3523 2.1733 -7.5106 {"}'M' greentint -9.2035 2.1237 -7.3045 {"}'M' greentint -9.0412 2.1686 -7.1066 {"}'M' greentint -8.7627 2.5045 -6.8402 {"}'M' greentint -8.6844 2.7502 -6.8081 {"}'M' greentint -8.6634 3.0056 -6.8514 {"}'M' greentint -9.2243 2.4089 -7.6731 {"}'M' greentint -9.0925 2.3071 -7.4749 {"}'M' greentint -8.9315 2.3352 -7.275 {"}'M' greentint -8.7835 2.4871 -7.1261 {"}'M' greentint -8.6887 2.7213 -7.0688 {"}'M' greentint -8.6724 2.975 -7.1181 {"}'M' greentint -9.0632 2.6801 -7.7063 {"}'M' greentint -8.959 2.525 -7.5285 {"}'M' greentint -8.799 2.6219 -7.349 {"}'M' greentint -8.7441 2.8752 -7.3488 {"}'M' greentint -8.8773 2.7715 -7.5483 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 441 A}'M' greentint -9.7513 1.2745 -4.1904 {"}'M' greentint -9.8845 1.1709 -4.3899 {"}'M' greentint -9.5654 1.3659 -4.0324 {"}'M' greentint -9.6696 1.5211 -4.2103 {"}'M' greentint -9.8295 1.4242 -4.3897 {"}'M' greentint -9.9399 1.3248 -4.67 {"}'M' greentint -9.9562 1.0711 -4.6207 {"}'M' greentint -9.4043 1.6372 -4.0656 {"}'M' greentint -9.5361 1.739 -4.2638 {"}'M' greentint -9.6971 1.7109 -4.4638 {"}'M' greentint -9.8451 1.5589 -4.6126 {"}'M' greentint -9.9117 1.4223 -4.9236 {"}'M' greentint -9.9621 1.1676 -4.919 {"}'M' greentint -9.2128 1.814 -4.1296 {"}'M' greentint -9.3477 1.9088 -4.3304 {"}'M' greentint -9.5066 1.912 -4.5364 {"}'M' greentint -9.6668 1.8209 -4.7192 {"}'M' greentint -9.8082 1.6504 -4.8548 {"}'M' greentint -9.8148 1.4966 -5.1636 {"}'M' greentint -9.8831 1.2476 -5.1813 {"}'M' greentint -9.2508 2.0435 -4.5859 {"}'M' greentint -9.4121 2.0044 -4.7838 {"}'M' greentint -9.5687 1.8923 -4.9552 {"}'M' greentint -9.7073 1.7176 -5.0859 {"}'M' greentint -9.2808 2.0308 -5.0205 {"}'M' greentint -9.4311 1.9063 -5.1803 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 372 A}'M' greentint -9.9359 0.9664 -4.6921 {"}'M' greentint -9.7733 1.0221 -4.4979 {"}'M' greentint -9.6155 1.1323 -4.3245 {"}'M' greentint -9.4701 1.294 -4.1815 {"}'M' greentint -9.3455 1.4964 -4.0779 {"}'M' greentint -9.8616 1.1018 -4.9512 {"}'M' greentint -9.7024 1.1242 -4.7507 {"}'M' greentint -9.5427 1.2128 -4.5697 {"}'M' greentint -9.396 1.3624 -4.4221 {"}'M' greentint -9.2722 1.5621 -4.3174 {"}'M' greentint -9.1804 1.7963 -4.2641 {"}'M' greentint -9.7429 1.2837 -5.1057 {"}'M' greentint -9.5841 1.2947 -4.9048 {"}'M' greentint -9.4271 1.3906 -4.7274 {"}'M' greentint -9.2886 1.5611 -4.5959 {"}'M' greentint -9.1857 1.7846 -4.525 {"}'M' greentint -9.1313 2.0344 -4.5247 {"}'M' greentint -9.6086 1.4916 -5.1814 {"}'M' greentint -9.4455 1.5208 -4.9788 {"}'M' greentint -9.2957 1.6745 -4.828 {"}'M' greentint -9.2004 1.9108 -4.7705 {"}'M' greentint -9.496 1.7214 -5.2166 {"}'M' greentint -9.3373 1.8187 -5.039 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 104 2d73A_124Y_106}P -8.8421 4.7341 -13.0798 {"}-8.8421 4.7341 -13.0798 { ca ala A 104 2d73A_124Y_106}-9.7802 5.0948 -12.0297 { c ala A 104 2d73A_124Y_106}-9.234 4.6348 -10.6911 { o ala A 104 2d73A_124Y_106}-8.3551 3.7785 -10.6273 { c ala A 104 2d73A_124Y_106}P -9.234 4.6348 -10.6911 { n thr A 105 2d73A_124Y_106}-9.7451 5.2294 -9.6218 { ca thr A 105 2d73A_124Y_106}-9.3342 4.8615 -8.2773 { c thr A 105 2d73A_124Y_106}-10.606 4.5692 -7.5 { o thr A 105 2d73A_124Y_106}-11.5954 5.2931 -7.6145 { c thr A 105 2d73A_124Y_106}P -10.606 4.5692 -7.5 { n phe A 106 2d73A_124Y_106}-10.5813 3.4918 -6.7281 { ca phe A 106 2d73A_124Y_106}-11.7321 3.0884 -5.9328 { c phe A 106 2d73A_124Y_106}-11.271 2.9501 -4.49 { o phe A 106 2d73A_124Y_106}-10.1992 2.4051 -4.2269 { c phe A 106 2d73A_124Y_106}P -11.271 2.9501 -4.49 { n asp A 107 2d73A_124Y_106}-12.0795 3.4435 -3.5596 { ca asp A 107 2d73A_124Y_106}-11.7416 3.3645 -2.1451 { c asp A 107 2d73A_124Y_106}-13.0261 3.3875 -1.3274 { o asp A 107 2d73A_124Y_106}-13.5212 4.4526 -0.9552 { c asp A 107 2d73A_124Y_106}P -13.0261 3.3875 -1.3274 { n glu A 108 2d73A_124Y_106}-13.5675 2.2058 -1.0576 { ca glu A 108 2d73A_124Y_106}-14.7948 2.0852 -0.2827 { c glu A 108 2d73A_124Y_106}-14.6745 0.9172 0.6833 { o glu A 108 2d73A_124Y_106}-13.9474 -0.0414 0.4262 { n asn A 122 2d73A_124Y_106}P -11.7555 -1.7631 0.3017 {"}-11.7555 -1.7631 0.3017 { ca asn A 122 2d73A_124Y_106}-11.5206 -2.1034 -1.099 { c asn A 122 2d73A_124Y_106}-10.891 -0.8543 -1.7112 { o asn A 122 2d73A_124Y_106}-11.5922 0.0686 -2.1199 { c asn A 122 2d73A_124Y_106}P -10.891 -0.8543 -1.7112 { n his A 123 2d73A_124Y_106}-9.5622 -0.8341 -1.7555 { ca his A 123 2d73A_124Y_106}-8.8199 0.3244 -2.2546 { c his A 123 2d73A_124Y_106}-7.8127 -0.0539 -3.3344 { o his A 123 2d73A_124Y_106}-6.8329 -0.7509 -3.0631 { c his A 123 2d73A_124Y_106}P -7.8127 -0.0539 -3.3344 { n tyr A 124 2d73A_124Y_106}-8.0357 0.4271 -4.5539 { ca tyr A 124 2d73A_124Y_106}-7.1369 0.0986 -5.653 { c tyr A 124 2d73A_124Y_106}-7.095 1.1552 -6.746 { o tyr A 124 2d73A_124Y_106}-7.9795 2.0035 -6.8499 { c tyr A 124 2d73A_124Y_106}P -7.095 1.1552 -6.746 { n asn A 125 2d73A_124Y_106}-6.0335 1.1072 -7.5434 { ca asn A 125 2d73A_124Y_106}-5.8999 1.9847 -8.6941 { c asn A 125 2d73A_124Y_106}-6.1271 1.0269 -9.8523 { o asn A 125 2d73A_124Y_106}-5.5913 -0.0851 -9.8641 { c asn A 125 2d73A_124Y_106}P -6.1271 1.0269 -9.8523 { n glu A 126 2d73A_124Y_106}-6.9294 1.4498 -10.8164 { ca glu A 126 2d73A_124Y_106}-7.2697 0.599 -11.9469 { c glu A 126 2d73A_124Y_106}-6.829 1.1285 -13.3041 { o glu A 126 2d73A_124Y_106}-6.7526 2.3371 -13.5217 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 104 2d73A_124Y_106}P -8.8421 4.7341 -13.0798 { ca ala A 104 2d73A_124Y_106}P -9.7802 5.0948 -12.0297 { n thr A 105 2d73A_124Y_106}P -9.7451 5.2294 -9.6218 { ca thr A 105 2d73A_124Y_106}P -9.3342 4.8615 -8.2773 { n phe A 106 2d73A_124Y_106}P -10.5813 3.4918 -6.7281 { ca phe A 106 2d73A_124Y_106}P -11.7321 3.0884 -5.9328 { n asp A 107 2d73A_124Y_106}P -12.0795 3.4435 -3.5596 { ca asp A 107 2d73A_124Y_106}P -11.7416 3.3645 -2.1451 { n glu A 108 2d73A_124Y_106}P -13.5675 2.2058 -1.0576 { ca glu A 108 2d73A_124Y_106}P -14.7948 2.0852 -0.2827 { n asn A 122 2d73A_124Y_106}P -11.7555 -1.7631 0.3017 { ca asn A 122 2d73A_124Y_106}P -11.5206 -2.1034 -1.099 { n his A 123 2d73A_124Y_106}P -9.5622 -0.8341 -1.7555 { ca his A 123 2d73A_124Y_106}P -8.8199 0.3244 -2.2546 { n tyr A 124 2d73A_124Y_106}P -8.0357 0.4271 -4.5539 { ca tyr A 124 2d73A_124Y_106}P -7.1369 0.0986 -5.653 { n asn A 125 2d73A_124Y_106}P -6.0335 1.1072 -7.5434 { ca asn A 125 2d73A_124Y_106}P -5.8999 1.9847 -8.6941 { n glu A 126 2d73A_124Y_106}P -6.9294 1.4498 -10.8164 { ca glu A 126 2d73A_124Y_106}P -7.2697 0.599 -11.9469 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 104 2d73A_124Y_106}P -9.7802 5.0948 -12.0297 {"}-9.7802 5.0948 -12.0297 { ca thr A 105 2d73A_124Y_106}-9.3342 4.8615 -8.2773 { ca phe A 106 2d73A_124Y_106}-11.7321 3.0884 -5.9328 { ca asp A 107 2d73A_124Y_106}-11.7416 3.3645 -2.1451 { ca glu A 108 2d73A_124Y_106}-14.7948 2.0852 -0.2827 { ca asn A 122 2d73A_124Y_106}P -11.5206 -2.1034 -1.099 {"}-11.5206 -2.1034 -1.099 { ca his A 123 2d73A_124Y_106}-8.8199 0.3244 -2.2546 { ca tyr A 124 2d73A_124Y_106}-7.1369 0.0986 -5.653 { ca asn A 125 2d73A_124Y_106}-5.8999 1.9847 -8.6941 { ca glu A 126 2d73A_124Y_106}-7.2697 0.599 -11.9469 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 106 2d73A_124Y_106}P -11.7321 3.0884 -5.9328 { cb phe A 106 2d73A_124Y_106}-12.2616 1.7434 -6.4349 { cg phe A 106 2d73A_124Y_106}-13.5731 1.3376 -5.8262 { cd1 phe A 106 2d73A_124Y_106}-14.7724 1.8377 -6.3235 { ce1 phe A 106 2d73A_124Y_106}-15.993 1.4518 -5.771 { cz phe A 106 2d73A_124Y_106}-16.0183 0.5572 -4.7059 { cg phe A 106 2d73A_124Y_106}P -13.5731 1.3376 -5.8262 { cd2 phe A 106 2d73A_124Y_106}-13.6102 0.4442 -4.7604 { ce2 phe A 106 2d73A_124Y_106}-14.8221 0.0533 -4.1984 { cz phe A 106 2d73A_124Y_106}ghost -16.0183 0.5572 -4.7059 { ca tyr A 124 2d73A_124Y_106}P -7.1369 0.0986 -5.653 { cb tyr A 124 2d73A_124Y_106}-7.5735 -1.2346 -6.2805 { cg tyr A 124 2d73A_124Y_106}-8.9777 -1.2016 -6.8623 { cd1 tyr A 124 2d73A_124Y_106}-9.2294 -0.6468 -8.1225 { ce1 tyr A 124 2d73A_124Y_106}-10.5281 -0.5741 -8.6342 { cz tyr A 124 2d73A_124Y_106}-11.5903 -1.0589 -7.8836 { oh tyr A 124 2d73A_124Y_106}-12.8788 -0.9703 -8.3628 { cg tyr A 124 2d73A_124Y_106}P -8.9777 -1.2016 -6.8623 { cd2 tyr A 124 2d73A_124Y_106}-10.0651 -1.6844 -6.1314 { ce2 tyr A 124 2d73A_124Y_106}-11.3634 -1.6152 -6.6348 { cz tyr A 124 2d73A_124Y_106}ghost -11.5903 -1.0589 -7.8836 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 106 2d73A_124Y_106}P -12.2616 1.7434 -6.4349 {"}P -12.2616 1.7434 -6.4349 { cd1 phe A 106 2d73A_124Y_106}P -14.7724 1.8377 -6.3235 { cd2 phe A 106 2d73A_124Y_106}P -13.6102 0.4442 -4.7604 { ce1 phe A 106 2d73A_124Y_106}P -15.993 1.4518 -5.771 { ce2 phe A 106 2d73A_124Y_106}P -14.8221 0.0533 -4.1984 { cz phe A 106 2d73A_124Y_106}P -16.0183 0.5572 -4.7059 { cb tyr A 124 2d73A_124Y_106}P -7.5735 -1.2346 -6.2805 {"}P -7.5735 -1.2346 -6.2805 { cd1 tyr A 124 2d73A_124Y_106}P -9.2294 -0.6468 -8.1225 { cd2 tyr A 124 2d73A_124Y_106}P -10.0651 -1.6844 -6.1314 { ce1 tyr A 124 2d73A_124Y_106}P -10.5281 -0.5741 -8.6342 { ce2 tyr A 124 2d73A_124Y_106}P -11.3634 -1.6152 -6.6348 { oh tyr A 124 2d73A_124Y_106}P -12.8788 -0.9703 -8.3628 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 124 A}'S' blue -10.292 0.3585 -7.1624 { CD2 TYR 124 A}'S' blue -10.9373 -0.2965 -5.5178 {"}'S' blue -10.7029 -0.1533 -5.5736 {"}'S' blue -10.3195 0.0288 -5.8773 {"}'S' blue -10.294 0.0459 -6.2632 {"}'S' sky -10.4579 -0.0107 -6.4589 { CE1 TYR 124 A}'S' sky -11.4002 0.8138 -8.0206 {"}'S' sky -11.5615 0.776 -8.2187 {"}'S' blue -11.7201 0.6853 -8.3994 {"}'S' blue -10.5355 0.1228 -7.0295 {"}'S' sky -10.58 0.3499 -7.1491 {"}'S' sky -10.6519 0.5499 -7.2981 {"}'S' sky -10.7508 0.7156 -7.4728 {"}'S' sky -10.873 0.8419 -7.6652 {"}'S' sky -11.0129 0.9228 -7.8681 {"}'S' blue -11.1659 0.957 -8.0765 {"}'S' blue -11.3269 0.9421 -8.2795 {"}'S' blue -11.4898 0.8794 -8.4723 { CE2 TYR 124 A}'S' sky -12.5507 -1.2346 -5.4069 {"}'S' sky -12.8136 -1.1612 -5.7677 {"}'S' sky -12.3492 -1.141 -5.2692 {"}'S' sky -12.8759 -1.0241 -5.9815 {"}'S' sky -12.1795 -0.8521 -5.2877 {"}'S' sky -12.8955 -0.8877 -6.2035 {"}'S' blue -11.9323 -0.7825 -5.205 {"}'S' sky -12.7528 -0.6007 -6.3166 {"}'S' blue -11.7207 -0.6045 -5.252 {"}'S' blue -11.8174 -0.4374 -5.4223 {"}'S' sky -11.939 -0.3154 -5.6146 {"}'S' sky -12.3968 -0.2651 -6.2194 {"}'S' sky -12.5554 -0.3558 -6.4 {"}'S' blue -12.706 -0.4952 -6.5552 { CZ TYR 124 A}'S' blue -12.6473 -0.3757 -6.6681 {"}'S' sky -12.7846 -0.2744 -6.8737 {"}'S' blue -12.9508 -0.3078 -7.0796 {"}'S' sky -12.3205 0.4988 -8.2016 {"}'S' blue -12.1442 0.521 -8.3929 { HE2 TYR 124 A}'S' blue -12.7707 -1.3692 -5.5129 {"}'S' blue -12.9317 -1.3973 -5.7129 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 124 A}'S' sea -10.8639 -0.1683 -5.7767 {"}'S' sea -10.6021 -0.0464 -5.831 {"}'S' green -10.7625 -0.0826 -6.0283 {"}'S' sea -10.4772 0.0157 -6.0778 {"}'S' sea -10.638 -0.0369 -6.2702 { CE1 TYR 124 A}'S' green -10.8855 0.4366 -7.2514 {"}'S' sea -10.9821 0.6038 -7.4217 {"}'S' sea -11.1037 0.7258 -7.614 {"}'S' sea -11.246 0.7961 -7.8159 { CE2 TYR 124 A}'S' sea -12.6525 -1.0714 -5.5834 {"}'S' sea -12.4204 -0.9319 -5.4193 {"}'S' green -12.5576 -0.8307 -5.6249 {"}'S' sea -12.7239 -0.864 -5.8308 {"}'S' green -12.2848 -0.691 -5.4684 {"}'S' green -12.426 -0.6099 -5.6748 {"}'S' green -12.589 -0.6177 -5.882 {"}'S' sea -12.7523 -0.714 -6.0662 {"}'S' sea -12.0194 -0.6024 -5.3668 {"}'S' sea -12.1383 -0.4757 -5.5565 {"}'S' green -12.2811 -0.4092 -5.7601 {"}'S' green -12.4388 -0.4093 -5.9636 {"}'S' sea -12.5996 -0.4735 -6.1533 {"}'S' sea -12.2355 -0.2273 -6.0212 {"}'S' green -11.8482 -0.1183 -5.8687 {"}'S' green -12.1622 -0.0991 -6.2801 {"}'S' sea -12.325 -0.1617 -6.473 {"}'S' green -11.4611 -0.1228 -5.7266 {"}'S' green -11.1955 -0.098 -5.7793 {"}'S' green -10.9929 -0.0496 -5.9458 {"}'S' green -10.8078 -0.0314 -6.1413 {"}'S' green -10.7369 0.0128 -6.4954 {"}'S' green -10.8856 0.0666 -6.7023 { CZ TYR 124 A}'S' green -12.2463 -0.0462 -6.6156 {"}'S' green -12.6657 0.147 -7.2125 {"}'S' green -12.6237 0.2911 -7.4682 {"}'S' green -12.5519 0.3945 -7.7218 {"}'S' green -12.2877 0.5428 -7.7806 {"}'S' sea -12.4483 0.4644 -7.9652 {"}'S' green -12.0024 0.6411 -7.8301 {"}'S' green -12.1632 0.5886 -8.0225 {"}'S' green -11.5009 0.6658 -7.6032 {"}'S' green -11.6576 0.6888 -7.8106 {"}'S' sea -11.8191 0.6714 -8.0155 {"}'S' sea -11.983 0.6147 -8.2112 {"}'S' green -10.8074 0.2439 -7.017 {"}'S' green -10.9124 0.4003 -7.1962 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 124 A}'S' P -12.0012 -0.0841 -6.0771 {"}'S' -12.0004 -0.0856 -6.0774 {"}'S' P -11.5965 -0.0326 -5.9254 {"}'S' -11.5876 -0.0896 -5.9514 {"}'S' P -11.7445 0.0172 -6.1304 {"}'S' -11.7235 -0.0722 -6.1583 {"}'S' P -11.9003 0.0228 -6.3345 {"}'S' -11.8784 -0.045 -6.3471 {"}'S' P -12.0607 -0.0134 -6.5318 {"}'S' -12.06 -0.0163 -6.5319 {"}'S' P -11.3234 0.005 -5.9743 {"}'S' -11.3253 -0.069 -6.0044 {"}'S' P -11.4659 0.0709 -6.1772 {"}'S' -11.4575 -0.0606 -6.2126 {"}'S' P -11.6178 0.098 -6.3807 {"}'S' -11.5971 -0.041 -6.401 {"}'S' P -11.1272 0.0488 -6.1467 {"}'S' -11.1386 -0.0332 -6.171 {"}'S' P -11.274 0.1096 -6.3544 {"}'S' -11.281 -0.0246 -6.376 {"}'S' P -11.4306 0.1326 -6.5618 {"}'S' -11.425 -0.0019 -6.5678 {"}'S' P -10.9457 0.0597 -6.3437 {"}'S' -10.9564 0.0139 -6.3513 {"}'S' P -11.0948 0.1127 -6.5511 {"}'S' -11.1078 0.0309 -6.5553 { CZ TYR 124 A}'S' P -12.3652 0.0805 -6.8053 {"}'S' -12.3557 0.067 -6.8183 {"}'S' P -12.508 0.147 -7.0089 {"}'S' -12.4988 0.135 -7.0175 {"}'S' P -12.0443 0.1189 -6.6711 {"}'S' -12.0326 0.0871 -6.7043 {"}'S' P -12.1659 0.2409 -6.8634 {"}'S' -12.1362 0.1717 -6.9165 {"}'S' P -12.3081 0.3113 -7.0654 {"}'S' -12.2694 0.2393 -7.1088 {"}'S' P -12.4624 0.3289 -7.27 {"}'S' -12.4391 0.2911 -7.2877 {"}'S' P -11.813 0.2307 -6.7222 {"}'S' -11.7987 0.1452 -6.7994 {"}'S' P -11.9352 0.357 -6.9147 {"}'S' -11.9106 0.257 -6.983 {"}'S' P -12.0751 0.4379 -7.1175 {"}'S' -12.038 0.3243 -7.176 {"}'S' P -12.2281 0.4721 -7.3259 {"}'S' -12.1924 0.3861 -7.3566 {"}'S' P -12.3891 0.4572 -7.5289 {"}'S' 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4.1683 -9.5907 { c leu A 100 2dg1A_115F_102}P -8.0785 5.3621 -9.4453 { n phe A 101 2dg1A_115F_102}-8.286 5.9183 -8.2581 { ca phe A 101 2dg1A_115F_102}-8.3131 5.1169 -7.0424 { c phe A 101 2dg1A_115F_102}-9.7915 4.9197 -6.7385 { o phe A 101 2dg1A_115F_102}-10.5419 5.8872 -6.6094 { c phe A 101 2dg1A_115F_102}P -9.7915 4.9197 -6.7385 { n val A 102 2dg1A_115F_102}-10.2081 3.6615 -6.6448 { ca val A 102 2dg1A_115F_102}-11.607 3.3322 -6.407 { c val A 102 2dg1A_115F_102}-11.8384 2.6705 -5.0514 { o val A 102 2dg1A_115F_102}-11.3047 1.5965 -4.7706 { c val A 102 2dg1A_115F_102}P -11.8384 2.6705 -5.0514 { n cys A 103 2dg1A_115F_102}-12.6383 3.3242 -4.2125 { ca cys A 103 2dg1A_115F_102}-12.9695 2.7947 -2.8919 { c cys A 103 2dg1A_115F_102}-14.1929 1.8989 -3.0351 { o cys A 103 2dg1A_115F_102}-15.1389 2.2566 -3.7296 { c cys A 103 2dg1A_115F_102}P -14.1929 1.8989 -3.0351 { n tyr A 104 2dg1A_115F_102}-14.1851 0.7378 -2.3887 { ca tyr A 104 2dg1A_115F_102}-15.3438 -0.1418 -2.4744 { c tyr A 104 2dg1A_115F_102}-15.7184 -0.7716 -1.139 { o tyr A 104 2dg1A_115F_102}-14.8653 -1.0129 -0.2768 { n gly A 113 2dg1A_115F_102}P -12.2708 -2.3751 0.2873 {"}-12.2708 -2.3751 0.2873 { ca gly A 113 2dg1A_115F_102}-10.8677 -2.0333 0.1276 { c gly A 113 2dg1A_115F_102}-10.7071 -0.9131 -0.8809 { o gly A 113 2dg1A_115F_102}-11.6398 -0.1513 -1.1146 { c gly A 113 2dg1A_115F_102}P -10.7071 -0.9131 -0.8809 { n ile A 114 2dg1A_115F_102}-9.5261 -0.8052 -1.4787 { ca ile A 114 2dg1A_115F_102}-9.2759 0.2271 -2.4814 { c ile A 114 2dg1A_115F_102}-8.3679 -0.3125 -3.5728 { o ile A 114 2dg1A_115F_102}-7.3171 -0.8794 -3.2803 { c ile A 114 2dg1A_115F_102}P -8.3679 -0.3125 -3.5728 { n phe A 115 2dg1A_115F_102}-8.775 -0.15 -4.826 { ca phe A 115 2dg1A_115F_102}-7.9259 -0.5858 -5.9258 { c phe A 115 2dg1A_115F_102}-7.6653 0.6201 -6.8121 { o phe A 115 2dg1A_115F_102}-8.3714 1.6225 -6.7278 { c phe A 115 2dg1A_115F_102}P -7.6653 0.6201 -6.8121 { n ala A 116 2dg1A_115F_102}-6.6302 0.5307 -7.6344 { ca ala A 116 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-15.3438 -0.1418 -2.4744 { n gly A 113 2dg1A_115F_102}P -12.2708 -2.3751 0.2873 { ca gly A 113 2dg1A_115F_102}P -10.8677 -2.0333 0.1276 {"}P -10.8677 -2.0333 0.1276 { n ile A 114 2dg1A_115F_102}P -9.5261 -0.8052 -1.4787 { ca ile A 114 2dg1A_115F_102}P -9.2759 0.2271 -2.4814 { n phe A 115 2dg1A_115F_102}P -8.775 -0.15 -4.826 { ca phe A 115 2dg1A_115F_102}P -7.9259 -0.5858 -5.9258 { n ala A 116 2dg1A_115F_102}P -6.6302 0.5307 -7.6344 { ca ala A 116 2dg1A_115F_102}P -6.2944 1.6092 -8.5512 { n ala A 117 2dg1A_115F_102}P -6.4249 1.885 -10.9542 { ca ala A 117 2dg1A_115F_102}P -6.4081 1.4425 -12.3425 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 100 2dg1A_115F_102}P -8.1242 6.2894 -10.6491 {"}-8.1242 6.2894 -10.6491 { ca phe A 101 2dg1A_115F_102}-8.3131 5.1169 -7.0424 { ca val A 102 2dg1A_115F_102}-11.607 3.3322 -6.407 { ca cys A 103 2dg1A_115F_102}-12.9695 2.7947 -2.8919 { ca tyr A 104 2dg1A_115F_102}-15.3438 -0.1418 -2.4744 { ca gly A 113 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{vdw contact} { CG PHE 115 A}'S' blue -10.5343 0.2063 -7.2504 {"}'S' blue -10.4329 0.292 -7.502 {"}'S' blue -10.5935 0.2135 -7.6867 {"}'S' blue -10.7487 0.0949 -7.8545 { CD1 PHE 115 A}'S' blue -11.4252 0.121 -6.6679 {"}'S' sky -11.5811 0.1266 -6.872 {"}'S' blue -11.1466 0.1747 -6.7146 {"}'S' sky -10.9548 0.2134 -6.8919 {"}'S' sky -10.7756 0.2165 -7.0885 {"}'S' sky -10.724 0.1876 -7.4472 {"}'S' sky -10.8857 0.1646 -7.651 { CD2 PHE 115 A}'S' blue -10.5909 0.2273 -7.9185 {"}'S' blue -10.446 0.428 -8.0038 { CE1 PHE 115 A}'S' blue -13.2048 0.0075 -7.3244 {"}'S' sky -12.8472 0.1718 -7.1773 {"}'S' sky -13.0015 0.1895 -7.382 {"}'S' sky -13.1627 0.1517 -7.5801 {"}'S' blue -13.3213 0.061 -7.7607 {"}'S' blue -13.4719 -0.0784 -7.916 {"}'S' sky -12.6141 0.2985 -7.2295 {"}'S' sky -13.2496 0.1461 -8.0085 {"}'S' blue -13.3989 -0.0055 -8.1592 {"}'S' sky -12.9874 0.3249 -8.0772 {"}'S' sky -13.1425 0.2063 -8.245 {"}'S' blue -13.2881 0.0521 -8.39 {"}'S' sky -12.7022 0.4491 -8.1344 { CE2 PHE 115 A}'S' sky -10.8964 0.3452 -8.1836 {"}'S' sky -11.1801 0.8375 -8.6889 {"}'S' blue -10.6564 0.4616 -8.224 {"}'S' sky -10.7283 0.6616 -8.373 {"}'S' sky -10.8272 0.8273 -8.5477 {"}'S' sky -10.9494 0.9536 -8.7401 {"}'S' blue -11.0893 1.0346 -8.943 {"}'S' sky -11.2423 1.0688 -9.1514 {"}'S' sky -11.4033 1.0538 -9.3544 {"}'S' blue -10.8377 1.1202 -8.9997 {"}'S' sky -10.9856 1.1701 -9.2047 {"}'S' sky -11.1415 1.1756 -9.4088 {"}'S' sky -11.3019 1.1394 -9.6061 {"}'S' sky -11.4626 1.061 -9.7907 {"}'S' blue -11.6177 0.9424 -9.9586 {"}'S' blue -10.707 1.2237 -9.2514 {"}'S' sky -10.8589 1.2509 -9.455 {"}'S' blue -11.0166 1.2378 -9.6555 {"}'S' blue -11.1774 1.1852 -9.848 {"}'S' blue -11.3347 1.0955 -10.0271 { CZ PHE 115 A}'S' blue -13.2701 0.0777 -8.4653 {"}'S' sky -12.9723 0.3318 -8.3093 {"}'S' sky -13.1352 0.324 -8.5165 {"}'S' sky -13.2985 0.2277 -8.7007 {"}'S' sky -12.6845 0.466 -8.191 {"}'S' sky -12.8274 0.5325 -8.3946 {"}'S' sky -13.1458 0.4682 -8.7878 {"}'S' blue -13.2991 0.341 -8.9512 {"}'S' sky -12.7818 0.7144 -8.6557 {"}'S' sky -12.943 0.6766 -8.8539 {"}'S' sky -13.1016 0.5859 -9.0345 {"}'S' blue -12.7085 0.8427 -8.9146 {"}'S' blue -12.8713 0.78 -9.1075 {"}'S' sky -12.4466 0.9645 -8.969 {"}'S' blue -12.607 0.9283 -9.1663 {"}'S' sky -12.6398 0.8843 -9.5873 {"}'S' sky -12.4635 0.9065 -9.7786 {"}'S' sky -11.3541 0.9104 -8.7758 {"}'S' sky -11.492 1.0014 -8.9783 {"}'S' sky -12.2846 0.8853 -9.9701 {"}'S' sky -11.5895 1.0255 -9.5442 {"}'S' sky -11.9144 0.9419 -9.9419 {"}'S' blue -12.0756 0.8454 -10.1231 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 115 A}'S' sea -11.2985 0.2019 -6.9182 {"}'S' green -11.4562 0.1887 -7.1187 {"}'S' sea -11.1114 0.2364 -7.0992 {"}'S' green -11.273 0.219 -7.3041 {"}'S' sea -10.9325 0.2308 -7.296 {"}'S' sea -11.0946 0.2074 -7.4986 { CE1 PHE 115 A}'S' sea -12.7671 0.3327 -7.4378 {"}'S' sea -12.9282 0.3177 -7.6409 {"}'S' sea -13.091 0.2551 -7.8337 {"}'S' sea -12.2271 0.294 -7.0873 {"}'S' green -12.3625 0.3842 -7.2862 {"}'S' sea -12.5104 0.434 -7.4912 {"}'S' sea -12.6663 0.4396 -7.6953 {"}'S' sea -12.8267 0.4034 -7.8925 {"}'S' sea -11.8488 0.1811 -6.9563 {"}'S' green -11.9614 0.3188 -7.1401 {"}'S' green -12.3837 0.5148 -7.7415 {"}'S' sea -12.5414 0.5017 -7.942 {"}'S' green -11.6401 0.2335 -7.1155 {"}'S' green -11.4514 0.2608 -7.3081 {"}'S' green -11.2435 0.2124 -7.4606 {"}'S' green -11.1558 0.2397 -7.7827 { CE2 PHE 115 A}'S' sea -10.9618 0.5483 -8.3263 {"}'S' sea -11.0585 0.7155 -8.4966 { CZ PHE 115 A}'S' sea -12.9851 0.5325 -8.5982 {"}'S' sea -12.4852 0.6264 -8.2491 {"}'S' sea -12.6275 0.6967 -8.4511 {"}'S' green -12.1323 0.6162 -8.1079 {"}'S' green -12.2545 0.7425 -8.3004 {"}'S' green -12.3944 0.8234 -8.5032 {"}'S' sea -12.5474 0.8576 -8.7116 {"}'S' green -12.1428 0.9091 -8.5599 {"}'S' green -12.2907 0.9589 -8.7649 {"}'S' green -11.8697 0.9467 -8.6088 {"}'S' green -12.0121 1.0126 -8.8117 {"}'S' sea -12.164 1.0397 -9.0152 {"}'S' sea -12.3217 1.0266 -9.2158 {"}'S' sea -12.4825 0.9741 -9.4082 {"}'S' green -11.2412 0.3982 -8.0586 {"}'S' green -11.5391 0.8921 -8.5803 {"}'S' sea -11.6735 0.9905 -8.7813 {"}'S' sea -11.8203 1.0513 -8.9889 {"}'S' sea -11.9769 1.0743 -9.1963 {"}'S' green -12.1385 1.0569 -9.4012 {"}'S' sea -12.3024 1.0002 -9.5969 {"}'S' sea -11.0406 0.4436 -8.2409 {"}'S' sea -11.1267 0.6294 -8.4027 {"}'S' sea -11.2317 0.7858 -8.5819 {"}'S' sea -11.6411 1.0544 -9.1856 {"}'S' sea -11.798 1.0687 -9.3931 {"}'S' green -11.9601 1.0452 -9.5956 {"}'S' sea -12.1237 0.9838 -9.7898 {"}'S' sea -11.7512 1.0025 -9.7481 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 115 A}'S' P -12.0894 0.4218 -7.335 {"}'S' -12.0906 0.4038 -7.3428 {"}'S' P -12.2318 0.4877 -7.5379 {"}'S' -12.2316 0.4727 -7.541 {"}'S' P -11.7588 0.3672 -7.3065 {"}'S' -11.7674 0.329 -7.3232 {"}'S' P -11.8932 0.4656 -7.5075 {"}'S' -11.9035 0.3897 -7.53 {"}'S' P -12.04 0.5264 -7.7152 {"}'S' -12.0432 0.4613 -7.7252 {"}'S' P -12.1966 0.5494 -7.9225 {"}'S' -12.1963 0.5457 -7.923 {"}'S' P -11.5738 0.3854 -7.502 {"}'S' -11.5936 0.3287 -7.5196 {"}'S' P -11.7117 0.4765 -7.7045 {"}'S' -11.7332 0.39 -7.7194 {"}'S' P -11.8608 0.5295 -7.9118 {"}'S' -11.8703 0.4657 -7.9154 {"}'S' P -11.3658 0.3387 -7.6531 {"}'S' -11.3742 0.3216 -7.6573 {"}'S' P -11.5029 0.4296 -7.8561 {"}'S' -11.5195 0.387 -7.8588 { CZ PHE 115 A}'S' P -11.7921 0.5259 -8.0001 {"}'S' -11.7957 0.4918 -8.0365 {"}'S' P -11.8898 0.6898 -8.1727 {"}'S' -11.891 0.6507 -8.2047 {"}'S' P -12.0074 0.8189 -8.3611 {"}'S' -12.0079 0.8164 -8.363 {"}'S' P -11.5357 0.537 -8.0623 {"}'S' -11.5457 0.5053 -8.0943 {"}'S' P -11.6291 0.706 -8.2301 {"}'S' -11.6374 0.6617 -8.2639 {"}'S' P -11.7417 0.8437 -8.4138 {"}'S' -11.7434 0.826 -8.424 {"}'S' P -11.3203 0.592 -8.2145 {"}'S' -11.3222 0.5886 -8.2179 {"}'S' P -11.4204 0.7585 -8.3893 {"}'S' -11.4223 0.7536 -8.3924 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 102 A}'S' sky -12.6693 1.0279 -8.4916 {"}'S' sky -12.5079 1.1808 -8.74 {"}'S' sky -12.2863 1.2737 -8.87 {"}'S' blue -11.3605 1.2495 -8.6125 { CG1 VAL 102 A}'S' blue -13.4604 0.3698 -7.3053 {"}'S' blue -13.2966 0.4078 -7.1055 {"}'S' sky -13.363 0.4001 -7.6029 {"}'S' sky -13.2054 0.4118 -7.4021 {"}'S' sky -13.045 0.4622 -7.2098 {"}'S' blue -12.8869 0.5507 -7.0294 {"}'S' sky -13.3027 0.4983 -7.9428 {"}'S' sky -12.6715 0.6471 -7.1688 {"}'S' sky -13.0575 0.5936 -8.0105 {"}'S' sky -12.964 0.7678 -8.2557 {"}'S' sky -12.8138 0.7258 -8.0511 {"}'S' sky -12.6553 0.7377 -7.8492 {"}'S' sky -12.842 0.976 -8.427 { CG2 VAL 102 A}'S' blue -12.4909 1.3718 -9.0302 {"}'S' sky -11.4616 1.3018 -8.9574 {"}'S' blue -11.3012 1.3521 -8.7651 {"}'S' sky -11.5589 1.3883 -9.4981 {"}'S' sky -11.4057 1.3621 -9.293 {"}'S' sky -11.2471 1.3782 -9.0918 {"}'S' blue -11.0857 1.4371 -8.9 {"}'S' sky -11.3137 1.4836 -9.5658 {"}'S' sky -11.1559 1.4719 -9.3594 {"}'S' sky -10.9938 1.5098 -9.1602 {"}'S' blue -10.8324 1.5949 -8.9745 {"}'S' blue -11.07 1.6157 -9.6063 {"}'S' blue -10.9115 1.6277 -9.4044 { HB VAL 102 A}'S' sky -11.6234 0.4649 -6.7986 {"}'S' sky -11.3244 0.4704 -6.8457 {"}'S' sky -11.0676 0.5132 -6.9574 {"}'S' sky -10.9053 0.5311 -7.1616 {"}'S' sky -10.9561 0.4547 -7.5743 {"}'S' blue -10.7989 0.5731 -7.4035 {"}'S' blue -10.8795 0.5735 -7.8144 {"}'S' blue -10.7233 0.6688 -7.6399 {"}'S' sky -11.0859 1.0691 -8.4506 {"}'S' sky -10.8847 0.7578 -8.1046 {"}'S' blue -10.7211 0.7865 -7.9012 {"}'S' blue -10.8647 1.1397 -8.3285 {"}'S' blue -10.7597 0.9834 -8.1493 {HG11 VAL 102 A}'S' blue -13.5898 0.3906 -7.7945 {"}'S' blue -13.5859 0.3362 -8.1852 {"}'S' sky -13.4278 0.413 -8.002 {"}'S' blue -13.6472 0.4433 -8.6608 {"}'S' sky -13.4914 0.4191 -8.4526 {"}'S' sky -13.3282 0.468 -8.2561 {"}'S' sky -13.171 0.5864 -8.0853 {"}'S' blue -13.545 0.651 -8.8949 {"}'S' sky -13.4078 0.576 -8.6955 {"}'S' sky -13.0954 0.6821 -8.3217 {"}'S' blue -13.3901 0.8739 -8.987 {"}'S' sky -13.2567 0.7712 -8.7864 {"}'S' sky -13.0932 0.7998 -8.583 {"}'S' blue -13.1317 0.9967 -8.8311 {"}'S' blue -12.9713 1.0944 -8.6513 {HG21 VAL 102 A}'S' blue -12.7409 1.2718 -9.602 {"}'S' sky -12.5889 1.246 -9.3987 {"}'S' sky -12.4296 1.2765 -9.2015 {"}'S' sky -12.5865 1.2176 -9.8195 {"}'S' sky -12.3352 1.1842 -9.9161 {"}'S' blue -12.1665 1.2471 -10.1255 {"}'S' sky -11.7034 1.2978 -9.5416 {"}'S' blue -11.767 1.3039 -9.9923 {"}'S' sky -11.6038 1.3528 -9.7957 {"}'S' blue -11.5271 1.4716 -10.0359 {"}'S' blue -11.371 1.5669 -9.8614 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 102 A}'S' sea -12.5535 0.7133 -7.8257 {"}'S' sea -12.5595 0.8788 -8.3074 {"}'S' sea -12.4327 0.7632 -8.1112 {"}'S' green -12.4151 1.0111 -8.5726 {"}'S' green -12.3033 0.8717 -8.3897 {"}'S' green -12.1995 1.0946 -8.7072 {"}'S' green -12.0901 0.9486 -8.5259 {"}'S' sea -11.9643 1.1791 -8.7844 {"}'S' green -11.8537 1.0312 -8.601 {"}'S' sea -11.6152 1.1373 -8.6395 { CG1 VAL 102 A}'S' sea -13.1499 0.4714 -7.7381 {"}'S' sea -12.9909 0.4883 -7.5366 {"}'S' sea -12.8295 0.5471 -7.3447 {"}'S' sea -12.8997 0.582 -7.8042 {"}'S' sea -12.7376 0.6199 -7.6049 { CG2 VAL 102 A}'S' sea -12.1426 1.276 -8.9886 {"}'S' sea -11.876 1.2604 -9.0684 {"}'S' sea -11.7166 1.2597 -8.8606 {"}'S' sea -11.6192 1.29 -9.1582 { HB VAL 102 A}'S' sea -12.4391 0.6208 -7.486 {"}'S' green -12.3103 0.5191 -7.2918 {"}'S' sea -12.1631 0.476 -7.0893 {"}'S' green -12.3459 0.5868 -7.7661 {"}'S' green -11.9413 0.3479 -7.1773 {"}'S' sea -11.7819 0.3784 -6.98 {"}'S' green -12.2595 0.737 -8.1282 {"}'S' green -12.1783 0.5546 -7.9722 {"}'S' green -11.636 0.2899 -7.1979 {"}'S' sea -11.4773 0.3543 -7.0112 {"}'S' green -11.3757 0.2916 -7.2937 {"}'S' green -11.2177 0.3773 -7.1127 {"}'S' green -11.2139 0.3229 -7.5034 {"}'S' sea -11.0557 0.3997 -7.3202 {"}'S' green -11.5782 0.8925 -8.5005 {"}'S' green -11.2752 0.43 -7.979 {"}'S' sea -11.1194 0.4058 -7.7708 {"}'S' sea -11.3306 1.0017 -8.5169 {"}'S' green -11.2755 0.7905 -8.3882 {"}'S' green -11.1729 0.6377 -8.2131 {"}'S' sea -11.0358 0.5627 -8.0137 {"}'S' sea -11.0181 0.8606 -8.3052 {HG11 VAL 102 A}'S' sea -13.2515 0.5868 -8.4962 {HG21 VAL 102 A}'S' sea -12.4392 1.176 -9.6172 {"}'S' sea -12.2837 1.1879 -9.4194 {"}'S' sea -12.125 1.2524 -9.2326 {"}'S' sea -12.1828 1.1592 -9.7124 {"}'S' green -12.0234 1.1897 -9.5152 {"}'S' sea -11.8654 1.2754 -9.3342 {"}'S' sea -12.0193 1.204 -9.9229 {"}'S' sea -11.8615 1.221 -9.7249 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 102 A}'S' P -12.2306 0.4552 -7.58 {"}'S' -12.2189 0.4732 -7.5785 {"}'S' P -12.0932 0.3737 -7.3805 {"}'S' -12.0801 0.4017 -7.3827 {"}'S' P -12.0695 0.4139 -7.7931 {"}'S' -12.0449 0.4677 -7.7751 {"}'S' P -11.9388 0.3195 -7.5981 {"}'S' -11.9139 0.4 -7.5874 {"}'S' P -11.7915 0.2779 -7.3958 {"}'S' -11.7814 0.3374 -7.399 {"}'S' P -12.0279 0.6754 -8.2436 {"}'S' -12.0184 0.6921 -8.2259 {"}'S' P -11.9402 0.4993 -8.0802 {"}'S' -11.9285 0.5309 -8.0594 {"}'S' P -11.8241 0.3675 -7.8947 {"}'S' -11.8093 0.4365 -7.8664 {"}'S' P -11.6875 0.2861 -7.6947 {"}'S' -11.6807 0.3706 -7.6772 {"}'S' P -11.5351 0.2611 -7.4909 {"}'S' -11.5376 0.3089 -7.4899 {"}'S' P -11.821 0.7989 -8.4196 {"}'S' -11.8156 0.8118 -8.3999 {"}'S' P -11.7499 0.6025 -8.2742 {"}'S' -11.7418 0.6466 -8.2304 {"}'S' P -11.6473 0.4498 -8.0992 {"}'S' -11.6448 0.4948 -8.0701 {"}'S' P -11.5189 0.349 -7.904 {"}'S' -11.5213 0.3879 -7.8889 {"}'S' P -11.3716 0.3059 -7.7015 {"}'S' -11.3754 0.3248 -7.6973 {"}'S' P -11.5137 0.6836 -8.3579 {"}'S' -11.5161 0.7051 -8.3319 {"}'S' P -11.41 0.5249 -8.1799 {"}'S' -11.4143 0.5461 -8.1632 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O PHE 115 A}'M' P -9.4236 2.5407 -6.6274 {"}'M' -9.4184 2.5369 -6.628 {"}'M' P -9.3402 2.6239 -6.8604 {"}'M' -9.3346 2.6181 -6.8601 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 115 A}'M' greentint -9.4448 2.3028 -6.1407 {"}'M' greentint -9.5934 2.1459 -6.2892 {"}'M' greentint -9.6972 2.0495 -6.5867 {"}'M' greentint -9.1377 2.5413 -6.0009 {"}'M' greentint -9.2956 2.5329 -6.2029 {"}'M' greentint -9.4542 2.4398 -6.3813 {"}'M' greentint -9.5934 2.2718 -6.5144 {"}'M' greentint -9.6668 2.1436 -6.8315 {"}'M' greentint -9.7379 1.8984 -6.8557 {"}'M' greentint -8.9525 2.7114 -6.0669 {"}'M' greentint -9.1086 2.7221 -6.2707 {"}'M' greentint -9.2688 2.6638 -6.4627 {"}'M' greentint -9.5593 2.3632 -6.7535 {"}'M' greentint -9.5889 2.2238 -7.0697 {"}'M' greentint -9.6701 1.9806 -7.1081 {"}'M' greentint -8.8654 2.8655 -6.3128 {"}'M' greentint -9.0259 2.842 -6.5148 {"}'M' greentint -9.1879 2.7599 -6.7005 {"}'M' greentint -9.4768 2.4423 -6.9853 {"}'M' greentint -9.4744 2.2685 -7.2994 {"}'M' greentint -8.7719 2.956 -6.5816 {"}'M' greentint -8.931 2.9049 -6.7738 {"}'M' greentint -9.0868 2.8061 -6.9471 {"}'M' greentint -9.233 2.6626 -7.097 {"}'M' greentint -9.3638 2.4806 -7.2154 {"}'M' greentint -8.7743 2.9393 -6.9792 {"}'M' greentint -8.9311 2.8334 -7.1523 {"}'M' greentint -9.0778 2.6863 -7.3021 {"}'M' greentint -9.2099 2.5033 -7.4221 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H VAL 102 A}'M' P -8.991 2.0961 -6.8916 {"}'M' -8.9918 2.0976 -6.8913 {"}'M' P -8.8368 2.2287 -6.7299 {"}'M' -8.8507 2.24 -6.7293 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 102 A}'M' greentint -9.7232 1.8818 -6.6061 {"}'M' greentint -9.5665 1.9192 -6.4143 {"}'M' greentint -9.4116 2.0164 -6.2418 {"}'M' greentint -9.2703 2.1672 -6.1002 {"}'M' greentint -9.1497 2.3614 -5.9985 {"}'M' greentint -9.6101 1.8799 -6.8887 {"}'M' greentint -9.4558 1.8792 -6.6896 {"}'M' greentint -9.2976 1.9429 -6.5033 {"}'M' greentint -9.1474 2.0673 -6.3435 {"}'M' greentint -9.0143 2.2429 -6.2204 {"}'M' greentint -8.909 2.4576 -6.1426 {"}'M' greentint -8.8355 2.6973 -6.1157 {"}'M' greentint -9.5466 2.0112 -7.2437 {"}'M' greentint -9.4052 1.9381 -7.0406 {"}'M' greentint -9.2471 1.9403 -6.8369 {"}'M' greentint -9.0864 2.0163 -6.65 {"}'M' greentint -8.9369 2.1617 -6.4976 {"}'M' greentint -8.8123 2.3617 -6.3918 {"}'M' greentint -8.7237 2.5992 -6.3437 {"}'M' greentint -8.6792 2.854 -6.3564 {"}'M' greentint -9.3021 2.1008 -7.2957 {"}'M' greentint -9.1534 2.0512 -7.0896 {"}'M' greentint -8.7126 2.432 -6.6253 {"}'M' greentint -8.6343 2.6777 -6.5931 {"}'M' greentint -8.6133 2.9331 -6.6365 {"}'M' greentint -9.1741 2.3364 -7.4582 {"}'M' greentint -9.0424 2.2347 -7.26 {"}'M' greentint -8.8814 2.2627 -7.06 {"}'M' greentint -8.7333 2.4147 -6.9112 {"}'M' greentint -8.6385 2.6488 -6.8538 {"}'M' greentint -8.6222 2.9025 -6.9031 {"}'M' greentint -8.9089 2.4525 -7.3135 {"}'M' greentint -8.7489 2.5494 -7.1341 {"}'M' greentint -8.6939 2.8027 -7.1339 {"}'M' greentint -8.8272 2.6991 -7.3334 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 115 A}'M' green -10.4249 0.4293 -4.4927 {"}'M' green -10.5581 0.3256 -4.6922 {"}'M' green -10.078 0.7919 -4.3679 {"}'M' green -10.6357 0.3223 -5.2212 {"}'M' green -10.4884 0.6513 -5.4658 {"}'M' green -9.9244 1.1982 -4.8882 {"}'M' green -9.9544 1.1855 -5.3228 {"}'M' green -10.1047 1.061 -5.4826 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 115 A}'M' greentint -10.3432 0.6758 -4.5125 {"}'M' greentint -10.5032 0.5789 -4.692 {"}'M' greentint -10.6136 0.4795 -4.9722 {"}'M' greentint -10.2097 0.8937 -4.5661 {"}'M' greentint -10.3707 0.8656 -4.766 {"}'M' greentint -10.5187 0.7137 -4.9149 {"}'M' greentint -10.5853 0.577 -5.2258 {"}'M' greentint -10.0213 1.0635 -4.6327 {"}'M' greentint -10.1802 1.0667 -4.8386 {"}'M' greentint -10.3404 0.9756 -5.0215 {"}'M' greentint -10.4818 0.8051 -5.157 {"}'M' greentint -10.0857 1.1591 -5.0861 {"}'M' greentint -10.2424 1.047 -5.2575 {"}'M' greentint -10.3809 0.8723 -5.3882 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 102 A}'M' green -10.6713 0.3543 -4.6415 {"}'M' green -10.5195 0.475 -4.4786 {"}'M' green -10.3792 0.637 -4.3426 {"}'M' green -10.7265 0.3587 -5.0768 {"}'M' green -10.1361 0.8888 -4.4626 {"}'M' green -10.6521 0.4941 -5.3359 {"}'M' green -9.9709 1.1886 -4.6488 {"}'M' green -10.5335 0.676 -5.4904 {"}'M' green -10.3992 0.8839 -5.5662 {"}'M' green -9.991 1.3031 -5.1552 {"}'M' green -10.1278 1.211 -5.4237 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 102 A}'M' greentint -10.5639 0.4144 -4.8826 {"}'M' greentint -10.4061 0.5246 -4.7092 {"}'M' greentint -10.2607 0.6864 -4.5662 {"}'M' greentint -10.493 0.5165 -5.1354 {"}'M' greentint -10.3332 0.6051 -4.9544 {"}'M' greentint -10.1865 0.7547 -4.8068 {"}'M' greentint -10.0628 0.9545 -4.7021 {"}'M' greentint -10.3747 0.687 -5.2895 {"}'M' greentint -10.2177 0.7829 -5.1121 {"}'M' greentint -10.0792 0.9535 -4.9806 {"}'M' greentint -9.9763 1.177 -4.9097 {"}'M' greentint -10.236 0.9131 -5.3635 {"}'M' greentint -10.0863 1.0668 -5.2127 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 148 2dg1A_150F_165}P -12.134 -2.4123 0.2487 {"}-12.134 -2.4123 0.2487 { ca phe A 148 2dg1A_150F_165}-10.7923 -2.1621 -0.2611 { c phe A 148 2dg1A_150F_165}-10.7192 -1.096 -1.341 { o phe A 148 2dg1A_150F_165}-11.6948 -0.8277 -2.0367 { c phe A 148 2dg1A_150F_165}P -10.7192 -1.096 -1.341 { n tyr A 149 2dg1A_150F_165}-9.5457 -0.4793 -1.4483 { ca tyr A 149 2dg1A_150F_165}-9.2829 0.5482 -2.4481 { c tyr A 149 2dg1A_150F_165}-8.3992 -0.1109 -3.4975 { o tyr A 149 2dg1A_150F_165}-7.5001 -0.8779 -3.1514 { c tyr A 149 2dg1A_150F_165}P -8.3992 -0.1109 -3.4975 { n phe A 150 2dg1A_150F_165}-8.651 0.1571 -4.7743 { ca phe A 150 2dg1A_150F_165}-7.8106 -0.4293 -5.8074 { c phe A 150 2dg1A_150F_165}-7.3592 0.6056 -6.8228 { o phe A 150 2dg1A_150F_165}-7.9888 1.6512 -6.9821 { c phe A 150 2dg1A_150F_165}P -7.3592 0.6056 -6.8228 { n thr A 151 2dg1A_150F_165}-6.2514 0.314 -7.4927 { ca thr A 151 2dg1A_150F_165}-5.7106 1.2226 -8.4921 { c thr A 151 2dg1A_150F_165}-6.0454 0.7945 -9.9114 { o thr A 151 2dg1A_150F_165}-5.8649 -0.3681 -10.2845 { c thr A 151 2dg1A_150F_165}P -6.0454 0.7945 -9.9114 { n asp A 152 2dg1A_150F_165}-6.5536 1.746 -10.6882 { ca asp A 152 2dg1A_150F_165}-6.9042 1.5155 -12.0854 { c asp A 152 2dg1A_150F_165}-5.6616 1.9214 -12.8756 { o asp A 152 2dg1A_150F_165}-5.3406 3.1059 -13.0079 { n gly A 163 2dg1A_150F_165}P -7.0905 5.8962 -11.9866 {"}-7.0905 5.8962 -11.9866 { ca gly A 163 2dg1A_150F_165}-7.6826 6.4554 -10.7891 { c gly A 163 2dg1A_150F_165}-7.7246 5.4299 -9.6761 { o gly A 163 2dg1A_150F_165}-7.131 4.3515 -9.784 { c gly A 163 2dg1A_150F_165}P -7.7246 5.4299 -9.6761 { n val A 164 2dg1A_150F_165}-8.4308 5.7733 -8.6058 { ca val A 164 2dg1A_150F_165}-8.5702 4.9099 -7.4423 { c val A 164 2dg1A_150F_165}-10.0482 4.7887 -7.1056 { o val A 164 2dg1A_150F_165}-10.7793 5.7815 -7.1182 { c val A 164 2dg1A_150F_165}P -10.0482 4.7887 -7.1056 { n tyr A 165 2dg1A_150F_165}-10.4825 3.5673 -6.8086 { ca tyr A 165 2dg1A_150F_165}-11.8784 3.297 -6.4862 { c tyr A 165 2dg1A_150F_165}-11.9928 2.4891 -5.2004 { o tyr A 165 2dg1A_150F_165}-11.0762 1.7507 -4.8454 { c tyr A 165 2dg1A_150F_165}P -11.9928 2.4891 -5.2004 { n tyr A 166 2dg1A_150F_165}-13.1226 2.6303 -4.511 { ca tyr A 166 2dg1A_150F_165}-13.3483 1.905 -3.2664 { c tyr A 166 2dg1A_150F_165}-14.4815 0.8976 -3.4147 { o tyr A 166 2dg1A_150F_165}-15.5677 1.2392 -3.8801 { c tyr A 166 2dg1A_150F_165}P -14.4815 0.8976 -3.4147 { n val A 167 2dg1A_150F_165}-14.2171 -0.3422 -3.0164 { ca val A 167 2dg1A_150F_165}-15.2189 -1.3975 -3.0818 { c val A 167 2dg1A_150F_165}-15.7424 -1.6462 -1.6762 { o val A 167 2dg1A_150F_165}-14.9635 -1.8649 -0.748 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 148 2dg1A_150F_165}P -12.134 -2.4123 0.2487 { ca phe A 148 2dg1A_150F_165}P -10.7923 -2.1621 -0.2611 { n tyr A 149 2dg1A_150F_165}P -9.5457 -0.4793 -1.4483 { ca tyr A 149 2dg1A_150F_165}P -9.2829 0.5482 -2.4481 { n phe A 150 2dg1A_150F_165}P -8.651 0.1571 -4.7743 { ca phe A 150 2dg1A_150F_165}P -7.8106 -0.4293 -5.8074 { n thr A 151 2dg1A_150F_165}P -6.2514 0.314 -7.4927 { ca thr A 151 2dg1A_150F_165}P -5.7106 1.2226 -8.4921 { n asp A 152 2dg1A_150F_165}P -6.5536 1.746 -10.6882 { ca asp A 152 2dg1A_150F_165}P -6.9042 1.5155 -12.0854 { n gly A 163 2dg1A_150F_165}P -7.0905 5.8962 -11.9866 { ca gly A 163 2dg1A_150F_165}P -7.6826 6.4554 -10.7891 {"}P -7.6826 6.4554 -10.7891 { n val A 164 2dg1A_150F_165}P -8.4308 5.7733 -8.6058 { ca val A 164 2dg1A_150F_165}P -8.5702 4.9099 -7.4423 { n tyr A 165 2dg1A_150F_165}P -10.4825 3.5673 -6.8086 { ca tyr A 165 2dg1A_150F_165}P -11.8784 3.297 -6.4862 { n tyr A 166 2dg1A_150F_165}P -13.1226 2.6303 -4.511 { ca tyr A 166 2dg1A_150F_165}P -13.3483 1.905 -3.2664 { n val A 167 2dg1A_150F_165}P -14.2171 -0.3422 -3.0164 { ca val A 167 2dg1A_150F_165}P -15.2189 -1.3975 -3.0818 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 148 2dg1A_150F_165}P -10.7923 -2.1621 -0.2611 {"}-10.7923 -2.1621 -0.2611 { ca tyr A 149 2dg1A_150F_165}-9.2829 0.5482 -2.4481 { ca phe A 150 2dg1A_150F_165}-7.8106 -0.4293 -5.8074 { ca thr A 151 2dg1A_150F_165}-5.7106 1.2226 -8.4921 { ca asp A 152 2dg1A_150F_165}-6.9042 1.5155 -12.0854 { ca gly A 163 2dg1A_150F_165}P -7.6826 6.4554 -10.7891 {"}-7.6826 6.4554 -10.7891 { ca val A 164 2dg1A_150F_165}-8.5702 4.9099 -7.4423 { ca tyr A 165 2dg1A_150F_165}-11.8784 3.297 -6.4862 { ca tyr A 166 2dg1A_150F_165}-13.3483 1.905 -3.2664 { ca val A 167 2dg1A_150F_165}-15.2189 -1.3975 -3.0818 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 150 2dg1A_150F_165}P -7.8106 -0.4293 -5.8074 { cb phe A 150 2dg1A_150F_165}-8.5159 -1.6065 -6.5113 { cg phe A 150 2dg1A_150F_165}-9.6418 -1.2095 -7.4332 { cd1 phe A 150 2dg1A_150F_165}-10.9691 -1.3787 -7.0454 { ce1 phe A 150 2dg1A_150F_165}-12.0184 -1.0801 -7.924 { cz phe A 150 2dg1A_150F_165}-11.7384 -0.6029 -9.2052 { cg phe A 150 2dg1A_150F_165}P -9.6418 -1.2095 -7.4332 { cd2 phe A 150 2dg1A_150F_165}-9.3729 -0.7273 -8.7121 { ce2 phe A 150 2dg1A_150F_165}-10.4113 -0.4244 -9.6006 { cz phe A 150 2dg1A_150F_165}ghost -11.7384 -0.6029 -9.2052 { ca tyr A 165 2dg1A_150F_165}P -11.8784 3.297 -6.4862 { cb tyr A 165 2dg1A_150F_165}-12.5299 2.5276 -7.6419 { cg tyr A 165 2dg1A_150F_165}-12.4353 3.2558 -8.9639 { cd1 tyr A 165 2dg1A_150F_165}-11.236 3.2987 -9.6741 { ce1 tyr A 165 2dg1A_150F_165}-11.1191 4.0353 -10.8495 { cz tyr A 165 2dg1A_150F_165}-12.2141 4.7366 -11.3253 { oh tyr A 165 2dg1A_150F_165}-12.0975 5.4909 -12.4677 { cg tyr A 165 2dg1A_150F_165}P -12.4353 3.2558 -8.9639 { cd2 tyr A 165 2dg1A_150F_165}-13.5257 3.9644 -9.4694 { ce2 tyr A 165 2dg1A_150F_165}-13.4213 4.7039 -10.6421 { cz tyr A 165 2dg1A_150F_165}ghost -12.2141 4.7366 -11.3253 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 150 2dg1A_150F_165}P -8.5159 -1.6065 -6.5113 {"}P -8.5159 -1.6065 -6.5113 { cd1 phe A 150 2dg1A_150F_165}P -10.9691 -1.3787 -7.0454 { cd2 phe A 150 2dg1A_150F_165}P -9.3729 -0.7273 -8.7121 { ce1 phe A 150 2dg1A_150F_165}P -12.0184 -1.0801 -7.924 { ce2 phe A 150 2dg1A_150F_165}P -10.4113 -0.4244 -9.6006 { cz phe A 150 2dg1A_150F_165}P -11.7384 -0.6029 -9.2052 { cb tyr A 165 2dg1A_150F_165}P -12.5299 2.5276 -7.6419 {"}P -12.5299 2.5276 -7.6419 { cd1 tyr A 165 2dg1A_150F_165}P -11.236 3.2987 -9.6741 { cd2 tyr A 165 2dg1A_150F_165}P -13.5257 3.9644 -9.4694 { ce1 tyr A 165 2dg1A_150F_165}P -11.1191 4.0353 -10.8495 { ce2 tyr A 165 2dg1A_150F_165}P -13.4213 4.7039 -10.6421 { oh tyr A 165 2dg1A_150F_165}P -12.0975 5.4909 -12.4677 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 150 A}'S' blue -11.3812 0.3214 -6.9918 {"}'S' blue -11.198 0.3516 -7.1772 { CE2 PHE 150 A}'S' blue -10.8653 0.7534 -8.3881 {"}'S' sky -10.9869 0.8754 -8.5804 {"}'S' blue -10.9483 1.2136 -9.3003 {"}'S' blue -11.1086 1.1774 -9.4976 {"}'S' blue -11.2693 1.0989 -9.6822 {"}'S' blue -10.6657 1.2888 -9.3465 {"}'S' sky -10.8233 1.2757 -9.5471 {"}'S' sky -10.9842 1.2231 -9.7395 {"}'S' blue -11.1414 1.1334 -9.9186 {"}'S' blue -10.3219 1.3004 -9.3202 {"}'S' blue -10.4785 1.3234 -9.5276 {"}'S' sky -10.6401 1.3059 -9.7325 {"}'S' blue -10.804 1.2493 -9.9282 {"}'S' blue -10.9652 1.1555 -10.1099 {"}'S' blue -10.1427 1.3035 -9.5169 {"}'S' blue -10.2996 1.3178 -9.7243 {"}'S' blue -10.4618 1.2943 -9.9269 {"}'S' blue -10.6254 1.2329 -10.1211 { CZ PHE 150 A}'S' blue -12.7718 0.7471 -8.7897 {"}'S' blue -12.4357 0.9988 -9.1021 {"}'S' blue -12.1504 1.0971 -9.1516 {"}'S' blue -11.9672 1.1274 -9.337 {"}'S' blue -11.6267 1.1392 -9.3289 {"}'S' blue -11.4182 1.096 -9.48 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 150 A}'S' green -12.2516 0.5025 -7.2146 {"}'S' green -12.7158 0.5216 -7.8209 {"}'S' green -11.6479 0.4855 -7.2349 {"}'S' green -11.4629 0.5037 -7.4304 {"}'S' green -11.392 0.5478 -7.7845 { CZ PHE 150 A}'S' green -12.6561 0.603 -8.3304 {"}'S' green -12.6105 0.7849 -8.5915 {"}'S' green -11.3645 0.6075 -7.9981 {"}'S' green -11.9928 1.1103 -8.9511 {"}'S' green -11.2492 0.829 -8.3251 {"}'S' green -11.3678 0.9627 -8.5161 {"}'S' green -11.5022 1.0611 -8.7171 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 150 A}'S' P -12.3995 0.5523 -7.4196 {"}'S' -12.3915 0.5177 -7.4297 {"}'S' P -12.5554 0.5578 -7.6237 {"}'S' -12.547 0.5315 -7.6283 {"}'S' P -11.9785 0.5401 -7.2634 {"}'S' -11.9793 0.5126 -7.2753 {"}'S' P -12.1209 0.6059 -7.4663 {"}'S' -12.1155 0.5133 -7.4908 {"}'S' P -12.2728 0.6331 -7.6699 {"}'S' -12.2561 0.5194 -7.686 {"}'S' P -12.4305 0.62 -7.8704 {"}'S' -12.4115 0.5406 -7.8725 {"}'S' P -12.5913 0.5674 -8.0628 {"}'S' -12.5902 0.5639 -8.0622 {"}'S' P -11.7823 0.5839 -7.4359 {"}'S' -11.7908 0.5224 -7.4541 {"}'S' P -11.9291 0.6447 -7.6436 {"}'S' -11.9362 0.5173 -7.6635 {"}'S' P -12.0857 0.6677 -7.8509 {"}'S' -12.0803 0.5245 -7.8571 {"}'S' P -12.2473 0.6502 -8.0558 {"}'S' -12.234 0.5506 -8.0475 {"}'S' P -11.6008 0.5947 -7.6329 {"}'S' -11.6147 0.5393 -7.6426 {"}'S' P -11.7499 0.6477 -7.8402 {"}'S' -11.7671 0.5385 -7.8456 { CZ PHE 150 A}'S' P -12.3139 0.6969 -8.1849 {"}'S' -12.285 0.6309 -8.2362 {"}'S' P -12.4562 0.7673 -8.3869 {"}'S' -12.4393 0.7365 -8.4063 {"}'S' P -11.961 0.6867 -8.0437 {"}'S' -11.9452 0.5918 -8.1286 {"}'S' P -12.0833 0.813 -8.2362 {"}'S' -12.0549 0.6973 -8.3146 {"}'S' P -12.2231 0.8939 -8.439 {"}'S' -12.1954 0.8093 -8.4827 {"}'S' P -12.3761 0.9281 -8.6474 {"}'S' -12.3717 0.9173 -8.6508 {"}'S' P -11.7186 0.7603 -8.1085 {"}'S' -11.7197 0.6662 -8.1842 {"}'S' P -11.8361 0.8894 -8.2969 {"}'S' -11.8286 0.7688 -8.3703 {"}'S' P -11.9715 0.9796 -8.4958 {"}'S' -11.9562 0.8799 -8.5409 {"}'S' P -12.1194 1.0294 -8.7007 {"}'S' -12.111 0.994 -8.7119 {"}'S' P -11.4578 0.7765 -8.1659 {"}'S' -11.4665 0.7331 -8.1987 {"}'S' P -11.5705 0.9143 -8.3496 {"}'S' -11.5779 0.8405 -8.3908 {"}'S' P -11.6984 1.0172 -8.5446 {"}'S' -11.7008 0.9509 -8.5721 {"}'S' P -11.8409 1.0831 -8.7475 {"}'S' -11.84 1.0635 -8.7521 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 165 A}'S' blue -12.8137 1.1529 -8.6867 {"}'S' sky -12.5982 1.2365 -8.8213 {"}'S' sky -12.363 1.3209 -8.8985 {"}'S' sky -12.1239 1.4227 -8.9367 {"}'S' blue -11.8771 1.5197 -8.9155 { CG TYR 165 A}'S' blue -12.4423 1.514 -9.1347 {"}'S' blue -12.1855 1.5437 -9.2245 {"}'S' blue -12.0279 1.5554 -9.0237 { CD1 TYR 165 A}'S' blue -11.5511 1.6009 -9.3925 {"}'S' blue -11.3524 1.5562 -9.5566 {"}'S' blue -11.1903 1.5783 -9.3538 {"}'S' blue -11.0279 1.6391 -9.1594 {"}'S' blue -11.2431 1.557 -9.8449 {"}'S' sky -11.0837 1.5563 -9.6371 {"}'S' sky -10.9199 1.5943 -9.4373 {"}'S' blue -10.7571 1.6701 -9.2475 {"}'S' blue -10.9863 1.5866 -9.9347 {"}'S' sky -10.8286 1.5983 -9.7339 {"}'S' sky -10.6683 1.6487 -9.5416 {"}'S' blue -10.5102 1.7372 -9.3612 {"}'S' blue -10.7728 1.6587 -10.0695 {"}'S' blue -10.6142 1.6748 -9.8683 {"}'S' blue -10.4527 1.7336 -9.6765 { HD1 TYR 165 A}'S' blue -10.4814 1.7552 -9.1738 {"}'S' blue -10.3684 1.7533 -9.4563 {"}'S' blue -10.2141 1.7526 -9.2572 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 165 A}'S' green -12.6864 0.5688 -7.8565 {"}'S' green -12.6342 0.6682 -8.2487 {"}'S' green -11.412 0.5683 -7.8507 {"}'S' green -11.7865 1.1154 -8.7933 {"}'S' green -11.3353 0.6871 -8.0909 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 165 A}'S' P -12.5491 0.4873 -7.657 {"}'S' -12.5341 0.5209 -7.6596 {"}'S' P -12.3971 0.4615 -7.4537 {"}'S' -12.3828 0.5051 -7.4646 {"}'S' P -12.2377 0.492 -7.2565 {"}'S' -12.2358 0.5053 -7.262 {"}'S' P -12.5254 0.5275 -8.0696 {"}'S' -12.5138 0.5519 -8.0609 {"}'S' P -12.3947 0.4332 -7.8745 {"}'S' -12.3673 0.5231 -7.8628 {"}'S' P -12.2474 0.3915 -7.6722 {"}'S' -12.2277 0.5098 -7.6791 {"}'S' P -12.0918 0.4035 -7.4743 {"}'S' -12.0879 0.4993 -7.496 {"}'S' P -11.9332 0.468 -7.2876 {"}'S' -11.9369 0.502 -7.3021 {"}'S' P -12.4838 0.789 -8.5201 {"}'S' -12.4787 0.7986 -8.5103 {"}'S' P -12.3961 0.6129 -8.3566 {"}'S' -12.3769 0.664 -8.3233 {"}'S' P -12.2799 0.4811 -8.1712 {"}'S' -12.2655 0.5524 -8.1421 {"}'S' P -12.1434 0.3997 -7.9711 {"}'S' -12.1324 0.529 -7.9446 {"}'S' P -11.991 0.3747 -7.7674 {"}'S' -11.9984 0.5181 -7.7642 {"}'S' P -11.8316 0.4052 -7.5702 {"}'S' -11.8518 0.5087 -7.5855 {"}'S' P -11.6736 0.491 -7.3892 {"}'S' -11.682 0.5155 -7.3977 {"}'S' P -12.2768 0.9125 -8.6961 {"}'S' -12.2704 0.9293 -8.6706 {"}'S' P -12.2057 0.7162 -8.5507 {"}'S' -12.1924 0.7891 -8.479 {"}'S' P -12.1032 0.5634 -8.3756 {"}'S' -12.0969 0.6781 -8.301 {"}'S' P -11.9747 0.4626 -8.1805 {"}'S' -11.9829 0.5798 -8.1329 {"}'S' P -11.8275 0.4196 -7.9779 {"}'S' -11.8497 0.5334 -7.954 {"}'S' P -11.6693 0.4373 -7.7794 {"}'S' -11.6998 0.5252 -7.7763 {"}'S' P -11.5116 0.5133 -7.5966 {"}'S' -11.5224 0.5334 -7.5989 {"}'S' P -12.034 1.0061 -8.7769 {"}'S' -12.0346 1.0198 -8.7501 {"}'S' P -11.9696 0.7972 -8.6343 {"}'S' -11.9772 0.8674 -8.5497 {"}'S' P -11.8659 0.6385 -8.4564 {"}'S' -11.8883 0.7519 -8.366 {"}'S' P -11.731 0.5436 -8.2555 {"}'S' -11.7661 0.655 -8.1972 {"}'S' P -11.5752 0.5194 -8.0473 {"}'S' -11.6012 0.5758 -8.0307 {"}'S' P -11.7314 0.9041 -8.6646 {"}'S' -11.7516 0.9446 -8.6059 {"}'S' P -11.6288 0.7513 -8.4896 {"}'S' -11.6673 0.8245 -8.4205 {"}'S' P -11.4916 0.6763 -8.2901 {"}'S' -11.5297 0.7348 -8.253 {"}'S' P -11.4739 0.9742 -8.5817 {"}'S' -11.4824 0.9825 -8.5695 {"}'S' P -11.3405 0.8715 -8.381 {"}'S' -11.3452 0.8754 -8.3763 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 150 A}'M' green -9.1609 2.0437 -6.3257 {"}'M' green -9.3044 1.9359 -6.5982 {"}'M' green -9.0622 2.3316 -6.3949 {"}'M' green -9.371 1.8288 -6.8441 {"}'M' green -8.9129 2.5617 -6.4571 {"}'M' green -9.3552 1.9272 -7.1099 {"}'M' sea -8.7259 2.7508 -6.525 {"}'M' green -8.8861 2.6926 -6.7169 {"}'M' green -9.2062 2.2525 -7.3239 {"}'M' green -9.2874 2.0093 -7.3623 {"}'M' green -8.8053 2.7886 -6.9547 {"}'M' sea -8.8503 2.6913 -7.3512 {"}'M' sea -8.9811 2.5093 -7.4697 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 150 A}'M' greentint -9.2108 2.1747 -6.5434 {"}'M' greentint -9.3145 2.0783 -6.8409 {"}'M' greentint -9.0715 2.4686 -6.6355 {"}'M' greentint -9.2108 2.3006 -6.7687 {"}'M' greentint -9.2841 2.1723 -7.0857 {"}'M' greentint -9.0409 2.5695 -6.8816 {"}'M' greentint -9.1766 2.392 -7.0078 {"}'M' greentint -8.9575 2.6527 -7.1147 {"}'M' greentint -9.0942 2.4711 -7.2395 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 165 A}'M' sea -9.3006 2.1349 -6.276 {"}'M' sea -9.5334 1.8323 -6.8925 {"}'M' green -9.3727 1.9083 -6.7056 {"}'M' green -9.01 2.4912 -6.3994 {"}'M' sea -8.9655 2.7459 -6.4121 {"}'M' green -9.4397 1.9431 -7.1452 {"}'M' green -8.8996 2.8251 -6.6921 {"}'M' green -9.3287 2.1266 -7.3156 {"}'M' green -8.9085 2.7944 -6.9588 {"}'M' green -9.1952 2.3445 -7.3692 {"}'M' green -8.9802 2.6947 -7.1895 {"}'M' green -9.1135 2.591 -7.389 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 165 A}'M' greentint -9.2232 2.0537 -6.5532 {"}'M' greentint -9.0986 2.2536 -6.4474 {"}'M' greentint -9.2773 1.9881 -6.9472 {"}'M' greentint -9.1231 2.1207 -6.7855 {"}'M' greentint -8.9989 2.324 -6.6809 {"}'M' greentint -8.9206 2.5697 -6.6488 {"}'M' greentint -9.1677 2.1547 -7.1156 {"}'M' greentint -9.0196 2.3066 -6.9668 {"}'M' greentint -8.9248 2.5408 -6.9095 {"}'M' greentint -9.0352 2.4414 -7.1897 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 150 A}'M' greentint -10.1696 0.9129 -4.5003 {"}'M' greentint -10.3029 0.8092 -4.6998 {"}'M' greentint -10.088 1.1594 -4.5201 {"}'M' greentint -10.2479 1.0625 -4.6996 {"}'M' greentint -10.3583 0.9631 -4.9798 {"}'M' greentint -10.3746 0.7094 -4.9305 {"}'M' greentint -9.9545 1.3773 -4.5736 {"}'M' greentint -10.1155 1.3492 -4.7736 {"}'M' greentint -10.2635 1.1973 -4.9225 {"}'M' greentint -10.33 1.0606 -5.2334 {"}'M' greentint -10.3804 0.8059 -5.2288 {"}'M' greentint -9.766 1.5471 -4.6403 {"}'M' greentint -9.9249 1.5503 -4.8462 {"}'M' greentint -10.0852 1.4592 -5.0291 {"}'M' greentint -10.2266 1.2887 -5.1646 {"}'M' greentint -10.2332 1.1349 -5.4734 {"}'M' greentint -10.3015 0.8859 -5.4911 {"}'M' greentint -9.8305 1.6427 -5.0937 {"}'M' greentint -9.9871 1.5306 -5.265 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{"}-11.1358 -2.3081 -0.4426 { ca cys A 379 2dgkA_380F_421}-9.024 0.2766 -2.2304 { ca phe A 380 2dgkA_380F_421}-7.603 -0.0585 -5.7331 { ca lys A 381 2dgkA_380F_421}-6.5984 1.7482 -8.9061 { ca leu A 382 2dgkA_380F_421}-6.0798 0.749 -12.5147 { ca val A 419 2dgkA_380F_421}P -7.3387 7.8006 -9.0899 {"}-7.3387 7.8006 -9.0899 { ca val A 420 2dgkA_380F_421}-8.612 5.1505 -6.6812 { ca met A 421 2dgkA_380F_421}-11.9381 3.5847 -5.7534 { ca arg A 422 2dgkA_380F_421}-12.5451 2.7831 -2.0801 { ca ile A 423 2dgkA_380F_421}-15.2324 0.4994 -0.647 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 380 2dgkA_380F_421}P -7.603 -0.0585 -5.7331 { cb phe A 380 2dgkA_380F_421}-8.1088 -1.3641 -6.3468 { cg phe A 380 2dgkA_380F_421}-9.5621 -1.3284 -6.7349 { cd1 phe A 380 2dgkA_380F_421}-10.5588 -1.3302 -5.7608 { ce1 phe A 380 2dgkA_380F_421}-11.9 -1.3005 -6.114 { cz phe A 380 2dgkA_380F_421}-12.2595 -1.2686 -7.4568 { cg phe A 380 2dgkA_380F_421}P -9.5621 -1.3284 -6.7349 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0.6982 -7.3194 {"}'S' sky -11.5585 0.674 -7.1112 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 MET 421 A}'S' sea -12.221 0.6466 -6.3204 {"}'S' sea -12.5086 0.6821 -7.1335 {"}'S' sea -12.3779 0.5877 -6.9385 {"}'S' sea -12.2306 0.5461 -6.7362 {"}'S' sea -12.0751 0.5581 -6.5383 {"}'S' sea -11.9164 0.6225 -6.3516 {"}'S' sea -12.2632 0.6357 -7.2352 {"}'S' green -12.1266 0.5543 -7.0351 {"}'S' sea -11.9742 0.5293 -6.8314 {"}'S' sea -11.8148 0.5598 -6.6341 {"}'S' sea -11.6568 0.6455 -6.4531 {"}'S' sea -12.0864 0.718 -7.4396 {"}'S' sea -11.958 0.6172 -7.2444 {"}'S' sea -11.8107 0.5741 -7.0419 @dotlist {x} color= yellow width= 1 master= {vdw contact} { SD MET 421 A}'S' blue -14.2833 -0.259 -7.7157 {"}'S' blue -14.1248 -0.1697 -7.5348 {"}'S' blue -13.9703 -0.0447 -7.3711 {"}'S' blue -13.8263 0.1133 -7.2291 {"}'S' blue -13.6954 0.3008 -7.1118 {"}'S' blue -14.2365 -0.2215 -8.0397 {"}'S' sky -14.0763 -0.1632 -7.8477 {"}'S' sky -13.9183 -0.0633 -7.6717 {"}'S' sky -13.7677 0.0747 -7.5162 {"}'S' sky -13.6288 0.2461 -7.3843 {"}'S' blue -13.5059 0.447 -7.2809 {"}'S' blue -14.0546 -0.1022 -8.1771 {"}'S' blue -13.8976 -0.0381 -7.9926 {"}'S' sky -13.7441 0.0684 -7.8242 {"}'S' sky -13.6008 0.2148 -7.6789 {"}'S' sky -13.4713 0.3958 -7.562 {"}'S' blue -13.3604 0.6031 -7.4766 {"}'S' blue -13.7574 0.1074 -8.1538 {"}'S' sky -13.6037 0.2237 -7.9873 {"}'S' sky -13.4633 0.3846 -7.8493 {"}'S' blue -13.3405 0.5838 -7.7474 {"}'S' blue -13.5007 0.3969 -8.1561 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 380 A}'M' green -9.1202 2.6179 -5.7296 {"}'M' green -9.4497 2.8239 -6.9772 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 380 A}'M' greentint -9.4362 2.2389 -5.8751 {"}'M' greentint -9.5764 2.1462 -6.0711 {"}'M' greentint -9.3575 2.4852 -5.8818 {"}'M' greentint -9.5164 2.3965 -6.0634 {"}'M' greentint -9.66 2.2887 -6.3359 {"}'M' greentint -9.2545 2.7177 -5.9308 {"}'M' greentint -9.4177 2.6843 -6.1327 {"}'M' greentint -9.5663 2.5274 -6.2811 {"}'M' greentint -9.6701 2.4311 -6.5786 {"}'M' greentint -9.7266 2.1816 -6.5819 {"}'M' greentint -9.1106 2.9229 -5.9928 {"}'M' greentint -9.2685 2.9145 -6.1948 {"}'M' greentint -9.4271 2.8213 -6.3732 {"}'M' greentint -9.5663 2.6534 -6.5064 {"}'M' greentint -9.6397 2.5251 -6.8234 {"}'M' greentint -9.0815 3.1036 -6.2627 {"}'M' greentint -9.2417 3.0454 -6.4547 {"}'M' greentint -9.3965 2.9223 -6.6193 {"}'M' greentint -9.5322 2.7447 -6.7455 {"}'M' greentint -9.1608 3.1414 -6.6924 {"}'M' greentint -9.3131 3.0055 -6.8524 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H MET 421 A}'M' greentint -9.617 2.1012 -6.236 {"}'M' greentint -9.4564 2.1771 -6.0492 {"}'M' greentint -9.3068 2.3225 -5.8968 {"}'M' greentint -9.1823 2.5225 -5.791 {"}'M' greentint -9.6721 2.2616 -6.6948 {"}'M' greentint -9.5233 2.212 -6.4887 {"}'M' greentint -9.361 2.2569 -6.2908 {"}'M' greentint -9.2068 2.3895 -6.1291 {"}'M' greentint -9.0825 2.5929 -6.0244 {"}'M' greentint -9.0042 2.8385 -5.9923 {"}'M' greentint -9.5441 2.4972 -6.8573 {"}'M' greentint -9.4123 2.3955 -6.6592 {"}'M' greentint -9.2513 2.4235 -6.4592 {"}'M' greentint -9.1033 2.5755 -6.3103 {"}'M' greentint -9.0085 2.8096 -6.253 {"}'M' greentint -8.9922 3.0633 -6.3023 {"}'M' greentint -9.3831 2.7685 -6.8905 {"}'M' greentint -9.2788 2.6133 -6.7127 {"}'M' greentint -9.1189 2.7102 -6.5333 {"}'M' greentint -9.0639 2.9635 -6.533 {"}'M' greentint -9.1681 3.1187 -6.7109 {"}'M' greentint -9.1972 2.8599 -6.7325 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 380 A}'M' green -9.7741 1.1711 -4.0134 {"}'M' green -10.1649 0.8763 -4.6017 {"}'M' green -9.613 1.4424 -4.0466 {"}'M' green -10.1707 0.9728 -4.9 {"}'M' green -9.5563 1.714 -4.3114 {"}'M' green -10.0235 1.3017 -5.1446 {"}'M' green -9.4595 1.8487 -4.5669 {"}'M' green -9.6208 1.8095 -4.7648 {"}'M' green -9.7774 1.6975 -4.9362 {"}'M' green -9.916 1.5228 -5.0669 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 380 A}'M' greentint -9.9599 1.0797 -4.1714 {"}'M' greentint -10.0932 0.9761 -4.3709 {"}'M' greentint -9.8783 1.3263 -4.1913 {"}'M' greentint -10.0382 1.2294 -4.3707 {"}'M' greentint -10.1486 1.13 -4.651 {"}'M' greentint -9.7448 1.5441 -4.2448 {"}'M' greentint -9.9058 1.5161 -4.4448 {"}'M' greentint -10.0538 1.3641 -4.5936 {"}'M' greentint -10.1203 1.2275 -4.9046 {"}'M' greentint -9.7152 1.7172 -4.5174 {"}'M' greentint -9.8755 1.6261 -4.7002 {"}'M' greentint -10.0169 1.4556 -4.8358 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O MET 421 A}'M' green -10.2007 0.8678 -4.3052 {"}'M' green -10.0429 0.978 -4.1318 {"}'M' green -9.8975 1.1397 -3.9888 {"}'M' sea -9.7729 1.3422 -3.8852 {"}'M' green -10.289 0.9475 -4.7585 {"}'M' green -9.6078 1.642 -4.0714 {"}'M' green -10.1703 1.1294 -4.913 {"}'M' green -9.5587 1.8801 -4.332 {"}'M' green -9.9234 1.5671 -5.0239 {"}'M' green -9.7093 1.9157 -4.8451 {"}'M' sea -9.8497 1.815 -5.0379 @dotlist {x} color= red width= 1 master= {H-bonds} { O MET 421 A}'M' greentint -10.1298 0.9699 -4.558 {"}'M' greentint -9.9701 1.0585 -4.377 {"}'M' greentint -9.8234 1.2081 -4.2294 {"}'M' greentint -9.6996 1.4078 -4.1247 {"}'M' greentint -10.0115 1.1404 -4.7121 {"}'M' greentint -9.8545 1.2363 -4.5347 {"}'M' greentint -9.716 1.4069 -4.4032 {"}'M' greentint -9.6131 1.6303 -4.3323 {"}'M' greentint -10.036 1.3373 -4.9887 {"}'M' greentint -9.8729 1.3665 -4.7861 {"}'M' greentint -9.7231 1.5202 -4.6353 {"}'M' greentint -9.6278 1.7565 -4.5778 {"}'M' greentint -9.7647 1.6644 -4.8463 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg A 508 2dkaA_510F_523}P -11.4113 -1.4433 1.3279 {"}-11.4113 -1.4433 1.3279 { ca arg A 508 2dkaA_510F_523}-11.0183 -2.0242 0.0496 { c arg A 508 2dkaA_510F_523}-10.7811 -0.8889 -0.9397 { o arg A 508 2dkaA_510F_523}-11.6223 -0.0024 -1.1008 { c arg A 508 2dkaA_510F_523}P -10.7811 -0.8889 -0.9397 { n ser A 509 2dkaA_510F_523}-9.6318 -0.9167 -1.6011 { ca ser A 509 2dkaA_510F_523}-9.2941 0.124 -2.5579 { c ser A 509 2dkaA_510F_523}-8.3815 -0.4273 -3.649 { o ser A 509 2dkaA_510F_523}-7.547 -1.2952 -3.3937 { c ser A 509 2dkaA_510F_523}P -8.3815 -0.4273 -3.649 { n phe A 510 2dkaA_510F_523}-8.5514 0.0672 -4.869 { ca phe A 510 2dkaA_510F_523}-7.7106 -0.3706 -5.9729 { c phe A 510 2dkaA_510F_523}-7.5533 0.7542 -6.9768 { o phe A 510 2dkaA_510F_523}-8.3996 1.6441 -7.0755 { c phe A 510 2dkaA_510F_523}P -7.5533 0.7542 -6.9768 { n val A 511 2dkaA_510F_523}-6.4493 0.7143 -7.7093 { ca val A 511 2dkaA_510F_523}-6.1435 1.729 -8.702 { c val A 511 2dkaA_510F_523}-5.9446 1.0569 -10.0505 { o val A 511 2dkaA_510F_523}-5.3314 -0.0028 -10.1361 { c val A 511 2dkaA_510F_523}P -5.9446 1.0569 -10.0505 { n arg A 512 2dkaA_510F_523}-6.4802 1.669 -11.1001 { ca arg A 512 2dkaA_510F_523}-6.3282 1.134 -12.4466 { c arg A 512 2dkaA_510F_523}-6.4161 2.2577 -13.4675 { o arg A 512 2dkaA_510F_523}-7.1542 3.2253 -13.2788 { n arg A 521 2dkaA_510F_523}P -8.1406 5.7029 -12.1798 {"}-8.1406 5.7029 -12.1798 { ca arg A 521 2dkaA_510F_523}-9.3102 5.7257 -11.3194 { c arg A 521 2dkaA_510F_523}-8.9426 5.1208 -9.9749 { o arg A 521 2dkaA_510F_523}-8.3305 4.0539 -9.9081 { c arg A 521 2dkaA_510F_523}P -8.9426 5.1208 -9.9749 { n val A 522 2dkaA_510F_523}-9.3042 5.8162 -8.9053 { ca val A 522 2dkaA_510F_523}-9.0372 5.3338 -7.5605 { c val A 522 2dkaA_510F_523}-10.3745 5.0689 -6.8876 { o val A 522 2dkaA_510F_523}-11.1512 5.9957 -6.6466 { c val A 522 2dkaA_510F_523}P -10.3745 5.0689 -6.8876 { n tyr A 523 2dkaA_510F_523}-10.6432 3.797 -6.6039 { ca tyr A 523 2dkaA_510F_523}-11.8848 3.4004 -5.9513 { c tyr A 523 2dkaA_510F_523}-11.6119 3.0275 -4.5055 { o tyr A 523 2dkaA_510F_523}-10.5879 2.4225 -4.2015 { c tyr A 523 2dkaA_510F_523}P -11.6119 3.0275 -4.5055 { n ala A 524 2dkaA_510F_523}-12.5445 3.3721 -3.6236 { ca ala A 524 2dkaA_510F_523}-12.4047 3.0502 -2.2107 { c ala A 524 2dkaA_510F_523}-13.7651 2.8825 -1.5454 { o ala A 524 2dkaA_510F_523}-14.732 3.551 -1.9087 { c ala A 524 2dkaA_510F_523}P -13.7651 2.8825 -1.5454 { n glu A 525 2dkaA_510F_523}-13.8299 1.9639 -0.5869 { ca glu A 525 2dkaA_510F_523}-15.0445 1.7123 0.1823 { c glu A 525 2dkaA_510F_523}-14.6001 1.3079 1.5827 { o glu A 525 2dkaA_510F_523}-13.5342 0.7191 1.7573 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n arg A 508 2dkaA_510F_523}P -11.4113 -1.4433 1.3279 { ca arg A 508 2dkaA_510F_523}P -11.0183 -2.0242 0.0496 { n ser A 509 2dkaA_510F_523}P -9.6318 -0.9167 -1.6011 { ca ser A 509 2dkaA_510F_523}P -9.2941 0.124 -2.5579 { n phe A 510 2dkaA_510F_523}P -8.5514 0.0672 -4.869 { ca phe A 510 2dkaA_510F_523}P -7.7106 -0.3706 -5.9729 { n val A 511 2dkaA_510F_523}P -6.4493 0.7143 -7.7093 { ca val A 511 2dkaA_510F_523}P -6.1435 1.729 -8.702 { n arg A 512 2dkaA_510F_523}P -6.4802 1.669 -11.1001 { ca arg A 512 2dkaA_510F_523}P -6.3282 1.134 -12.4466 { n arg A 521 2dkaA_510F_523}P -8.1406 5.7029 -12.1798 { ca arg A 521 2dkaA_510F_523}P -9.3102 5.7257 -11.3194 { n val A 522 2dkaA_510F_523}P -9.3042 5.8162 -8.9053 { ca val A 522 2dkaA_510F_523}P -9.0372 5.3338 -7.5605 { n tyr A 523 2dkaA_510F_523}P -10.6432 3.797 -6.6039 { ca tyr A 523 2dkaA_510F_523}P -11.8848 3.4004 -5.9513 { n ala A 524 2dkaA_510F_523}P -12.5445 3.3721 -3.6236 { ca ala A 524 2dkaA_510F_523}P -12.4047 3.0502 -2.2107 { n glu A 525 2dkaA_510F_523}P -13.8299 1.9639 -0.5869 { ca glu A 525 2dkaA_510F_523}P -15.0445 1.7123 0.1823 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca arg A 508 2dkaA_510F_523}P -11.0183 -2.0242 0.0496 {"}-11.0183 -2.0242 0.0496 { ca ser A 509 2dkaA_510F_523}-9.2941 0.124 -2.5579 { ca phe A 510 2dkaA_510F_523}-7.7106 -0.3706 -5.9729 { ca val A 511 2dkaA_510F_523}-6.1435 1.729 -8.702 { ca arg A 512 2dkaA_510F_523}-6.3282 1.134 -12.4466 { ca arg A 521 2dkaA_510F_523}P -9.3102 5.7257 -11.3194 {"}-9.3102 5.7257 -11.3194 { ca val A 522 2dkaA_510F_523}-9.0372 5.3338 -7.5605 { ca tyr A 523 2dkaA_510F_523}-11.8848 3.4004 -5.9513 { ca ala A 524 2dkaA_510F_523}-12.4047 3.0502 -2.2107 { ca glu A 525 2dkaA_510F_523}-15.0445 1.7123 0.1823 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 510 2dkaA_510F_523}P -7.7106 -0.3706 -5.9729 { cb phe A 510 2dkaA_510F_523}-8.2887 -1.6265 -6.6473 { cg phe A 510 2dkaA_510F_523}-9.5865 -1.3971 -7.3696 { cd1 phe A 510 2dkaA_510F_523}-9.598 -1.1067 -8.7314 { ce1 phe A 510 2dkaA_510F_523}-10.8006 -0.9085 -9.4105 { cz phe A 510 2dkaA_510F_523}-12.0081 -1.0008 -8.7226 { cg phe A 510 2dkaA_510F_523}P -9.5865 -1.3971 -7.3696 { cd2 phe A 510 2dkaA_510F_523}-10.7994 -1.4846 -6.6918 { ce2 phe A 510 2dkaA_510F_523}-12.0068 -1.2885 -7.3597 { cz phe A 510 2dkaA_510F_523}ghost -12.0081 -1.0008 -8.7226 { ca tyr A 523 2dkaA_510F_523}P -11.8848 3.4004 -5.9513 { cb tyr A 523 2dkaA_510F_523}-12.5062 2.1839 -6.6442 { cg tyr A 523 2dkaA_510F_523}-13.7259 1.6579 -5.9185 { cd1 tyr A 523 2dkaA_510F_523}-14.9889 2.1977 -6.1582 { ce1 tyr A 523 2dkaA_510F_523}-16.1035 1.7693 -5.4408 { cz tyr A 523 2dkaA_510F_523}-15.9616 0.7958 -4.4744 { oh tyr A 523 2dkaA_510F_523}-17.0658 0.3917 -3.752 { cg tyr A 523 2dkaA_510F_523}P -13.7259 1.6579 -5.9185 { cd2 tyr A 523 2dkaA_510F_523}-13.6068 0.6679 -4.9401 { ce2 tyr A 523 2dkaA_510F_523}-14.7168 0.2356 -4.2157 { cz tyr A 523 2dkaA_510F_523}ghost -15.9616 0.7958 -4.4744 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 510 2dkaA_510F_523}P -8.2887 -1.6265 -6.6473 {"}P -8.2887 -1.6265 -6.6473 { cd1 phe A 510 2dkaA_510F_523}P -9.598 -1.1067 -8.7314 { cd2 phe A 510 2dkaA_510F_523}P -10.7994 -1.4846 -6.6918 { ce1 phe A 510 2dkaA_510F_523}P -10.8006 -0.9085 -9.4105 { ce2 phe A 510 2dkaA_510F_523}P -12.0068 -1.2885 -7.3597 { cz phe A 510 2dkaA_510F_523}P -12.0081 -1.0008 -8.7226 { cb tyr A 523 2dkaA_510F_523}P -12.5062 2.1839 -6.6442 {"}P -12.5062 2.1839 -6.6442 { cd1 tyr A 523 2dkaA_510F_523}P -14.9889 2.1977 -6.1582 { cd2 tyr A 523 2dkaA_510F_523}P -13.6068 0.6679 -4.9401 { ce1 tyr A 523 2dkaA_510F_523}P -16.1035 1.7693 -5.4408 { ce2 tyr A 523 2dkaA_510F_523}P -14.7168 0.2356 -4.2157 { oh tyr A 523 2dkaA_510F_523}P -17.0658 0.3917 -3.752 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 510 A}'S' blue -11.8564 -0.8013 -5.4762 {"}'S' blue -11.9936 -0.7001 -5.6818 {"}'S' blue -11.7208 -0.5604 -5.5254 {"}'S' blue -11.862 -0.4793 -5.7317 {"}'S' blue -11.5743 -0.3451 -5.6134 {"}'S' sky -11.4371 0.0465 -6.134 {"}'S' sky -11.1804 0.1478 -6.1874 {"}'S' blue -10.9018 0.2015 -6.2341 {"}'S' sky -10.8666 0.2632 -6.6187 {"}'S' blue -10.6877 0.2576 -6.8155 {"}'S' sky -10.8498 0.2341 -7.0181 {"}'S' sky -11.0134 0.1727 -7.2123 { CE2 PHE 510 A}'S' sky -12.7684 -1.0008 -5.8108 {"}'S' blue -13.3956 -0.3873 -6.7911 {"}'S' sky -12.5192 -0.921 -5.7277 {"}'S' blue -13.2429 -0.1469 -6.8782 {"}'S' sky -12.2651 -0.713 -5.7269 {"}'S' sky -13.0402 0.0616 -6.9443 {"}'S' blue -13.1987 -0.0291 -7.1249 {"}'S' blue -12.0141 -0.5917 -5.7551 {"}'S' sky -12.0587 -0.3646 -5.8747 {"}'S' sky -12.1305 -0.1646 -6.0236 {"}'S' sky -12.8056 0.2276 -7.005 {"}'S' blue -12.9684 0.165 -7.1979 {"}'S' blue -12.8648 0.2348 -7.4414 {"}'S' sky -12.5796 0.359 -7.4986 {"}'S' sky -12.3995 0.3851 -7.6873 { CZ PHE 510 A}'S' sky -12.353 0.4152 -7.7536 {"}'S' blue -12.4929 0.4961 -7.9564 {"}'S' sky -12.1058 0.4916 -7.8143 {"}'S' blue -12.2412 0.5818 -8.0131 {"}'S' sky -11.8402 0.5164 -7.867 {"}'S' blue -11.9682 0.6194 -8.062 {"}'S' sky -11.5189 0.4312 -7.8425 {"}'S' blue -11.6376 0.5648 -8.0335 { HE2 PHE 510 A}'S' sky -13.5508 -1.1009 -6.0491 {"}'S' sky -13.655 -0.9457 -6.2269 {"}'S' sky -13.6825 -0.7559 -6.4804 {"}'S' sky -13.0664 -1.0568 -5.8636 {"}'S' sky -13.492 -0.5548 -6.553 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 510 A}'S' sea -11.3363 0.1534 -6.3914 {"}'S' sea -11.0538 0.2286 -6.4377 {"}'S' green -11.2114 0.2155 -6.6382 {"}'S' sea -11.0282 0.2457 -6.8236 { CE2 PHE 510 A}'S' green -13.0638 -0.6053 -6.1442 {"}'S' green -13.201 -0.504 -6.3498 {"}'S' green -12.7676 -0.7467 -5.8798 {"}'S' green -12.8229 -0.5255 -6.0126 {"}'S' green -12.9282 -0.3643 -6.1933 {"}'S' green -13.0694 -0.2833 -6.3997 {"}'S' sea -13.2323 -0.2911 -6.6069 {"}'S' sea -12.5263 -0.6756 -5.8053 {"}'S' green -12.5757 -0.4558 -5.9299 {"}'S' green -12.6628 -0.2758 -6.0917 {"}'S' green -12.7817 -0.1491 -6.2814 {"}'S' green -12.9245 -0.0826 -6.485 {"}'S' sea -13.0822 -0.0826 -6.6886 {"}'S' sea -12.2986 -0.481 -5.8342 {"}'S' green -12.3641 -0.2779 -5.9769 {"}'S' green -12.4608 -0.1107 -6.1472 {"}'S' green -12.5823 0.0113 -6.3395 {"}'S' sea -12.7246 0.0817 -6.5415 {"}'S' sea -12.8789 0.0993 -6.7461 {"}'S' sea -12.2294 0.0011 -6.1983 {"}'S' sea -12.3516 0.1274 -6.3908 {"}'S' sea -12.4915 0.2084 -6.5936 {"}'S' sea -12.6445 0.2426 -6.802 {"}'S' sea -11.9869 0.0747 -6.2631 {"}'S' green -12.1045 0.2038 -6.4515 {"}'S' green -12.2399 0.294 -6.6503 {"}'S' green -12.3878 0.3438 -6.8553 {"}'S' green -12.5437 0.3494 -7.0594 {"}'S' sea -12.7041 0.3132 -7.2567 {"}'S' sea -11.7262 0.0909 -6.3205 {"}'S' green -11.8389 0.2287 -6.5042 {"}'S' green -12.4188 0.4115 -7.3062 {"}'S' green -11.5175 0.1434 -6.4797 {"}'S' green -12.2356 0.4418 -7.4916 {"}'S' green -11.8951 0.4536 -7.4835 {"}'S' sea -12.0572 0.4302 -7.686 {"}'S' green -11.2432 0.2485 -7.0173 {"}'S' green -11.3803 0.3394 -7.2203 {"}'S' green -11.529 0.3932 -7.4272 {"}'S' sea -11.6866 0.4104 -7.6346 { HE2 PHE 510 A}'S' sea -13.3231 -1.0349 -5.9392 {"}'S' green -13.3897 -0.8296 -6.0823 {"}'S' sea -13.5215 -0.7279 -6.2804 {"}'S' green -13.105 -0.8274 -5.9773 {"}'S' green -13.1982 -0.6529 -6.1462 {"}'S' green -13.3331 -0.558 -6.3471 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 510 A}'S' P -11.9668 0.3316 -6.6992 {"}'S' -11.9683 0.287 -6.7184 {"}'S' P -12.1092 0.3975 -6.9021 {"}'S' -12.1059 0.3468 -6.915 {"}'S' P -12.2612 0.4247 -7.1056 {"}'S' -12.2598 0.4158 -7.1069 {"}'S' P -11.6362 0.2771 -6.6707 {"}'S' -11.6422 0.2521 -6.6817 {"}'S' P -11.7706 0.3755 -6.8717 {"}'S' -11.7803 0.3048 -6.8928 {"}'S' P -11.9174 0.4363 -7.0793 {"}'S' -11.9208 0.3666 -7.0903 {"}'S' P -12.074 0.4592 -7.2867 {"}'S' -12.073 0.4403 -7.2879 {"}'S' P -11.4512 0.2953 -6.8662 {"}'S' -11.4566 0.2817 -6.8705 {"}'S' P -11.5891 0.3863 -7.0687 {"}'S' -11.6007 0.339 -7.0771 {"}'S' P -11.7382 0.4393 -7.276 {"}'S' -11.7431 0.4038 -7.278 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 523 A}'S' sky -12.6225 0.4414 -6.5268 {"}'S' sky -12.4604 0.4635 -6.3239 {"}'S' sky -12.8076 0.5614 -7.2276 {"}'S' sky -12.6782 0.67 -7.5061 {"}'S' blue -12.5745 0.8928 -7.8236 {"}'S' blue -12.4654 0.7474 -7.643 {"}'S' blue -12.3393 0.9773 -7.9008 {"}'S' blue -12.2286 0.8295 -7.7174 { CG TYR 523 A}'S' blue -13.5578 0.1121 -6.7217 {"}'S' blue -13.4483 0.3034 -6.9917 {"}'S' sky -13.3171 0.1981 -6.7934 {"}'S' blue -13.2099 0.4095 -7.0301 {"}'S' sky -12.9552 0.5217 -7.0032 { CD2 TYR 523 A}'S' sky -13.7618 -0.4441 -6.2823 {"}'S' sky -13.4386 -0.878 -5.7433 {"}'S' blue -13.2967 -0.946 -5.5406 {"}'S' blue -13.5827 -0.1386 -6.4935 {"}'S' sky -13.0515 -0.8507 -5.6083 {"}'S' sky -13.3351 -0.0335 -6.5208 {"}'S' blue -12.6493 -0.7066 -5.4469 {"}'S' blue -12.3753 -0.4769 -5.4273 {"}'S' sky -12.2514 -0.0858 -5.7506 {"}'S' sky -12.418 0.2794 -6.1642 { HB3 TYR 523 A}'S' blue -11.4844 0.4253 -6.1022 {"}'S' sky -11.2276 0.4681 -6.2139 {"}'S' sky -11.9809 0.7538 -7.6761 {"}'S' sky -11.0652 0.486 -6.4181 {"}'S' blue -11.7382 0.8474 -7.757 {"}'S' sky -10.9589 0.528 -6.66 {"}'S' blue -11.4355 0.7454 -7.6447 {"}'S' sky -11.0394 0.5284 -7.0709 {"}'S' blue -10.8833 0.6238 -6.8964 { HD2 TYR 523 A}'S' blue -12.1892 -0.3082 -5.4661 {"}'S' blue -12.0574 -0.4099 -5.2679 {"}'S' blue -11.9239 -0.1921 -5.3214 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 523 A}'S' sea -12.6655 0.483 -7.0223 {"}'S' green -12.5132 0.4422 -6.815 {"}'S' sea -12.5498 0.5664 -7.3104 {"}'S' sea -12.338 0.6381 -7.4474 { CG TYR 523 A}'S' sea -13.1707 0.1393 -6.5867 {"}'S' sea -13.0772 0.3135 -6.8319 {"}'S' sea -12.927 0.2715 -6.6273 {"}'S' sea -12.8128 0.453 -6.7998 { CD2 TYR 523 A}'S' sea -13.675 -0.6232 -6.1194 {"}'S' sea -13.5656 -0.7693 -5.9382 {"}'S' sea -13.5251 -0.3531 -6.359 {"}'S' green -13.4398 -0.5388 -6.1966 {"}'S' green -13.3292 -0.6866 -6.0133 {"}'S' sea -13.1979 -0.7919 -5.815 {"}'S' sea -13.2835 -0.2522 -6.3936 {"}'S' green -13.2008 -0.437 -6.2349 {"}'S' green -13.0907 -0.5805 -6.0517 {"}'S' green -12.958 -0.6765 -5.8535 {"}'S' sea -12.8078 -0.7186 -5.6488 {"}'S' sea -13.0883 0.0623 -6.4976 {"}'S' green -13.0402 -0.1585 -6.3746 {"}'S' green -12.954 -0.3401 -6.2136 {"}'S' green -12.836 -0.4684 -6.0248 {"}'S' green -12.6936 -0.537 -5.8214 {"}'S' sea -12.5364 -0.5392 -5.6179 {"}'S' green -12.8453 0.1179 -6.4174 {"}'S' green -12.7883 -0.1016 -6.2825 {"}'S' green -12.6817 -0.2603 -6.1005 {"}'S' green -12.5383 -0.3392 -5.8935 {"}'S' sea -12.3757 -0.3277 -5.6857 {"}'S' sea -12.622 0.2011 -6.3088 {"}'S' green -12.5534 -0.01 -6.1618 {"}'S' green -12.4175 -0.115 -5.9573 {"}'S' sea -12.313 0.123 -5.9849 { HB3 TYR 523 A}'S' green -12.3905 0.4101 -6.8366 {"}'S' green -12.2532 0.3286 -6.6371 {"}'S' green -12.1012 0.3028 -6.4338 {"}'S' green -12.3383 0.5095 -7.2287 {"}'S' green -11.796 0.2448 -6.4544 {"}'S' sea -11.6373 0.3093 -6.2677 {"}'S' sea -12.1879 0.6303 -7.5001 {"}'S' green -11.5357 0.2465 -6.5502 {"}'S' sea -11.3777 0.3322 -6.3692 {"}'S' green -11.9099 0.5574 -7.5308 {"}'S' green -11.3734 0.2786 -6.7595 {"}'S' green -11.2157 0.3546 -6.5767 {"}'S' sea -11.6737 0.6385 -7.6144 {"}'S' green -11.57 0.4798 -7.4364 {"}'S' green -11.4351 0.3849 -7.2355 {"}'S' green -11.2793 0.3607 -7.0273 {"}'S' sea -11.1161 0.4096 -6.8308 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 TYR 523 A}'S' P -12.2295 0.3688 -7.0496 {"}'S' -12.2196 0.39 -7.0427 {"}'S' P -12.0988 0.2744 -6.8546 {"}'S' -12.0831 0.3242 -6.8479 {"}'S' P -11.9515 0.2328 -6.6523 {"}'S' -11.9459 0.2675 -6.6543 {"}'S' P -12.1002 0.4542 -7.3367 {"}'S' -12.0993 0.4557 -7.3359 {"}'S' P -11.984 0.3224 -7.1513 {"}'S' -11.9722 0.3791 -7.1276 {"}'S' P -11.8475 0.241 -6.9512 {"}'S' -11.8405 0.3187 -6.9354 {"}'S' P -11.6951 0.216 -6.7475 {"}'S' -11.6976 0.2638 -6.7464 {"}'S' P -11.8073 0.4047 -7.3557 {"}'S' -11.806 0.4236 -7.3428 {"}'S' P -11.6788 0.3039 -7.1605 {"}'S' -11.6824 0.3555 -7.1396 {"}'S' P -11.5316 0.2609 -6.958 {"}'S' -11.5391 0.3 -6.9498 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 510 A}'M' green -9.3098 2.3578 -6.2865 {"}'M' green -9.7254 2.0711 -6.9343 {"}'M' green -9.1659 2.5629 -6.3485 {"}'M' green -9.695 2.1651 -7.1791 {"}'M' green -9.6171 2.2453 -7.4174 {"}'M' sea -8.8936 2.887 -6.6604 {"}'M' green -8.9592 2.9265 -7.1214 {"}'M' green -9.115 2.8277 -7.2947 {"}'M' green -9.2612 2.6841 -7.4446 {"}'M' green -9.392 2.5022 -7.5631 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 510 A}'M' greentint -9.473 2.3244 -6.4883 {"}'M' greentint -9.6216 2.1675 -6.6368 {"}'M' greentint -9.3238 2.5545 -6.5505 {"}'M' greentint -9.4824 2.4614 -6.7289 {"}'M' greentint -9.6216 2.2934 -6.8621 {"}'M' greentint -9.1368 2.7436 -6.6184 {"}'M' greentint -9.297 2.6854 -6.8103 {"}'M' greentint -9.4518 2.5623 -6.975 {"}'M' greentint -9.5875 2.3848 -7.1012 {"}'M' greentint -9.0541 2.8636 -6.8625 {"}'M' greentint -9.2161 2.7814 -7.0481 {"}'M' greentint -9.3684 2.6455 -7.2081 {"}'M' greentint -9.505 2.4639 -7.3329 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 523 A}'M' green -9.7175 2.1142 -6.5865 {"}'M' green -9.5673 2.2387 -6.4267 {"}'M' green -9.4341 2.4143 -6.3036 {"}'M' green -9.8251 2.1095 -7.1238 {"}'M' green -9.1435 2.7706 -6.427 {"}'M' green -9.722 2.2722 -7.3789 {"}'M' green -9.0541 2.8491 -6.6764 {"}'M' green -9.1138 2.9741 -7.2171 {"}'M' green -9.2471 2.8704 -7.4166 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 523 A}'M' greentint -9.6669 2.1117 -6.9201 {"}'M' greentint -9.5062 2.1877 -6.7332 {"}'M' greentint -9.3567 2.3331 -6.5808 {"}'M' greentint -9.2321 2.533 -6.475 {"}'M' greentint -9.5732 2.2226 -7.1728 {"}'M' greentint -9.4109 2.2675 -6.9748 {"}'M' greentint -9.2567 2.4001 -6.8131 {"}'M' greentint -9.1324 2.6034 -6.7085 {"}'M' greentint -9.4622 2.406 -7.3432 {"}'M' greentint -9.3012 2.4341 -7.1432 {"}'M' greentint -9.1532 2.586 -6.9944 {"}'M' greentint -9.0584 2.8202 -6.937 {"}'M' greentint -9.3287 2.6239 -7.3967 {"}'M' greentint -9.1688 2.7208 -7.2173 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 510 A}'M' -9.6069 1.0767 -4.2402 {"}'M' -9.3888 1.2842 -4.2783 {"}'M' -9.2375 1.7385 -4.9527 {"}'M' -9.3918 1.7392 -5.1518 @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 510 A}'M' sea -10.0205 0.9193 -4.5081 {"}'M' sea -9.8346 1.0107 -4.3501 {"}'M' green -9.9388 1.1659 -4.5279 {"}'M' green -10.0988 1.069 -4.7073 {"}'M' green -9.6735 1.282 -4.3833 {"}'M' green -10.1143 1.2037 -4.9303 {"}'M' green -9.482 1.4587 -4.4472 {"}'M' green -9.936 1.4657 -5.0368 {"}'M' sea -10.0774 1.2952 -5.1724 {"}'M' sea -9.2401 1.5437 -4.5017 {"}'M' green -9.3683 1.6528 -4.6984 {"}'M' green -9.52 1.6883 -4.9036 {"}'M' green -9.6813 1.6491 -5.1014 {"}'M' sea -9.8379 1.5371 -5.2728 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 510 A}'M' greentint -9.8053 1.3837 -4.5814 {"}'M' greentint -9.9663 1.3557 -4.7814 {"}'M' greentint -9.6169 1.5536 -4.6481 {"}'M' greentint -9.7758 1.5567 -4.854 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 523 A}'M' sky -10.2704 1.0824 -4.4529 {"}'M' sky -10.0584 1.7328 -5.2993 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 523 A}'M' sea -10.3131 1.2526 -4.9191 {"}'M' green -10.1668 1.1893 -4.7133 {"}'M' green -10.0096 1.1847 -4.5077 {"}'M' green -9.847 1.2404 -4.3135 {"}'M' sea -9.6892 1.3506 -4.1401 {"}'M' sea -10.2089 1.4796 -5.1651 {"}'M' green -10.0833 1.3671 -4.9713 {"}'M' green -9.6164 1.4311 -4.3853 {"}'M' sea -9.4697 1.5807 -4.2377 {"}'M' green -9.955 1.5789 -5.1228 {"}'M' green -9.5008 1.6089 -4.543 {"}'M' sea -9.3623 1.7795 -4.4115 {"}'M' sea -9.8153 1.8134 -5.1973 {"}'M' green -9.6823 1.7099 -4.9971 {"}'M' green -9.5192 1.7391 -4.7944 {"}'M' sea -9.3694 1.8928 -4.6436 {"}'M' sea -9.5697 1.9397 -5.0323 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 523 A}'M' greentint -9.9353 1.3201 -4.7668 {"}'M' greentint -9.7761 1.3425 -4.5663 {"}'M' greentint -9.8166 1.502 -4.9213 {"}'M' greentint -9.6578 1.513 -4.7204 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 95 2e1nA_97Y_110M}P -12.5739 -1.9999 0.2453 {"}-12.5739 -1.9999 0.2453 { ca ser A 95 2e1nA_97Y_110M}-11.1437 -1.9856 -0.0622 { c ser A 95 2e1nA_97Y_110M}-10.8744 -1.123 -1.2634 { o ser A 95 2e1nA_97Y_110M}-11.7436 -0.9376 -2.1228 { c ser A 95 2e1nA_97Y_110M}P -10.8744 -1.123 -1.2634 { n gly A 96 2e1nA_97Y_110M}-9.6337 -0.6342 -1.3521 { ca gly A 96 2e1nA_97Y_110M}-9.2652 0.2548 -2.4287 { c gly A 96 2e1nA_97Y_110M}-8.387 -0.4552 -3.4279 { o gly A 96 2e1nA_97Y_110M}-7.7356 -1.4775 -3.0955 { c gly A 96 2e1nA_97Y_110M}P -8.387 -0.4552 -3.4279 { n tyr A 97 2e1nA_97Y_110M}-8.3824 0.0805 -4.6547 { ca tyr A 97 2e1nA_97Y_110M}-7.5139 -0.4214 -5.7045 { c tyr A 97 2e1nA_97Y_110M}-7.2227 0.6768 -6.7072 { o tyr A 97 2e1nA_97Y_110M}-7.9505 1.6394 -6.7682 { c tyr A 97 2e1nA_97Y_110M}P -7.2227 0.6768 -6.7072 { n trp A 98 2e1nA_97Y_110M}-6.1296 0.5535 -7.4407 { ca trp A 98 2e1nA_97Y_110M}-5.8228 1.5016 -8.5108 { c trp A 98 2e1nA_97Y_110M}-6.3297 1.0376 -9.8838 { o trp A 98 2e1nA_97Y_110M}-6.2169 -0.1512 -10.2342 { c trp A 98 2e1nA_97Y_110M}P -6.3297 1.0376 -9.8838 { n lys A 99 2e1nA_97Y_110M}-6.8036 1.9852 -10.6914 { ca lys A 99 2e1nA_97Y_110M}-7.3188 1.6702 -12.0193 { c lys A 99 2e1nA_97Y_110M}-6.846 2.7101 -13.0167 { o lys A 99 2e1nA_97Y_110M}-6.756 3.9035 -12.6911 { n arg A 108 2e1nA_97Y_110M}P -6.3719 6.0801 -11.0054 {"}-6.3719 6.0801 -11.0054 { ca arg A 108 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0.2076 -7.5429 {"}'S' green -11.2948 0.1646 -7.3403 {"}'S' green -11.1374 0.1825 -7.1413 {"}'S' sea -10.9792 0.2593 -6.958 {"}'S' green -10.9136 0.0669 -7.2311 {"}'S' green -10.7551 0.1534 -7.0496 {"}'S' sea -10.6058 0.2894 -6.8937 {"}'S' green -10.7677 -0.0216 -7.4489 {"}'S' green -10.609 0.0429 -7.2622 {"}'S' green -10.4561 0.1589 -7.0967 {"}'S' green -10.6668 -0.0503 -7.742 {"}'S' green -10.5074 -0.0199 -7.5448 {"}'S' green -10.3494 0.0659 -7.3638 {"}'S' sea -10.1993 0.2017 -7.2084 {"}'S' green -10.5033 -0.0055 -7.9525 {"}'S' green -10.3451 0.0122 -7.754 {"}'S' green -10.1874 0.0883 -7.5712 {"}'S' sea -10.037 0.2196 -7.4127 {"}'S' green -10.2511 0.0943 -8.0219 {"}'S' green -10.0878 0.1432 -7.8253 {"}'S' sea -9.9306 0.2616 -7.6545 {"}'S' sea -10.4623 0.6903 -8.7679 {"}'S' green -10.4072 0.479 -8.6392 {"}'S' green -10.1675 0.2512 -8.2647 {"}'S' green -10.0111 0.262 -8.0654 {"}'S' green -9.855 0.3574 -7.8909 {"}'S' sea -10.1497 0.5491 -8.5563 {"}'S' sea -10.0163 0.4464 -8.3556 {"}'S' sea -9.8528 0.475 -8.1523 { HB3 MET 110 A}'S' sea -12.5396 0.3509 -8.1153 {"}'S' sea -12.3872 0.3259 -7.9116 {"}'S' sea -12.2278 0.3563 -7.7143 {"}'S' sea -12.3709 0.4137 -8.3246 {"}'S' green -12.2237 0.3707 -8.1221 { HG3 MET 110 A}'S' sea -11.3379 0.5184 -9.5683 {"}'S' sea -11.1795 0.605 -9.3868 {"}'S' sea -11.3475 0.4179 -9.984 {"}'S' green -11.192 0.4299 -9.7861 {"}'S' green -11.0334 0.4944 -9.5994 {"}'S' green -10.8804 0.6105 -9.4339 {"}'S' green -11.0912 0.4012 -10.0792 {"}'S' green -10.9318 0.4316 -9.882 {"}'S' green -10.7738 0.5174 -9.701 {"}'S' green -10.6237 0.6532 -9.5456 {"}'S' sea -10.9276 0.446 -10.2897 {"}'S' green -10.7695 0.4638 -10.0912 {"}'S' green -10.6117 0.5398 -9.9084 {"}'S' sea -10.4613 0.6712 -9.7499 {"}'S' sea -10.5121 0.5948 -10.1625 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB MET 110 A}'S' P -11.9962 0.3488 -8.4282 {"}'S' -11.9916 0.3608 -8.4247 {"}'S' P -11.8587 0.257 -8.2262 {"}'S' -11.8477 0.3021 -8.218 {"}'S' P -11.7101 0.2032 -8.0193 {"}'S' -11.7038 0.2438 -8.0165 {"}'S' P -11.7379 0.3069 -8.5117 {"}'S' -11.7285 0.3576 -8.4933 {"}'S' P -11.5959 0.2285 -8.3064 {"}'S' -11.589 0.3019 -8.2899 {"}'S' P -11.4435 0.1876 -8.0991 {"}'S' -11.4432 0.2435 -8.0926 {"}'S' P -11.6085 0.4154 -8.7902 {"}'S' -11.6088 0.4194 -8.788 {"}'S' P -11.4802 0.3118 -8.5945 {"}'S' -11.4794 0.3594 -8.5753 {"}'S' P -11.339 0.245 -8.3932 {"}'S' -11.342 0.3036 -8.3765 {"}'S' P -11.1264 0.3155 -8.5288 {"}'S' -11.1277 0.3233 -8.5255 { HB2 MET 110 A}'S' P -11.3623 0.1437 -7.8311 {"}'S' -11.3562 0.1538 -7.8302 {"}'S' P -11.2249 0.0622 -7.6316 {"}'S' -11.2166 0.0797 -7.6328 {"}'S' P -11.073 0.0364 -7.4283 {"}'S' -11.068 0.0522 -7.432 {"}'S' P -11.2012 0.1024 -8.0441 {"}'S' -11.1775 0.1533 -8.0267 {"}'S' P -11.0705 0.0081 -7.8491 {"}'S' -11.0608 0.0396 -7.8447 {"}'S' P -10.9232 -0.0336 -7.6468 {"}'S' -10.9232 -0.0322 -7.647 {"}'S' P -11.0719 0.1878 -8.3312 {"}'S' -11.0584 0.2226 -8.3088 {"}'S' P -10.9558 0.056 -8.1458 {"}'S' -10.9456 0.1041 -8.1257 {"}'S' P -10.8192 -0.0254 -7.9457 {"}'S' -10.8182 -0.0097 -7.9428 {"}'S' P -10.8816 0.2911 -8.5253 {"}'S' -10.8794 0.3017 -8.5144 {"}'S' P -10.779 0.1383 -8.3502 {"}'S' -10.7776 0.1769 -8.3246 {"}'S' P -10.6506 0.0375 -8.155 {"}'S' -10.6529 0.0696 -8.1416 {"}'S' P -10.6454 0.3721 -8.6089 {"}'S' -10.6468 0.3825 -8.5961 {"}'S' P -10.5417 0.2134 -8.431 {"}'S' -10.5495 0.2527 -8.3993 {"}'S' P -10.4068 0.1185 -8.2301 {"}'S' -10.415 0.1468 -8.2152 {"}'S' P -10.3046 0.3262 -8.4642 {"}'S' -10.3076 0.3316 -8.4592 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 97 A}'M' greentint -9.0239 2.3197 -6.181 {"}'M' greentint -9.1725 2.1628 -6.3295 {"}'M' greentint -9.2763 2.0665 -6.627 {"}'M' greentint -8.8747 2.5499 -6.2432 {"}'M' greentint -9.0333 2.4567 -6.4216 {"}'M' greentint -9.1725 2.2887 -6.5548 {"}'M' greentint -9.2459 2.1605 -6.8718 {"}'M' greentint -9.317 1.9154 -6.896 {"}'M' greentint -8.6877 2.739 -6.3111 {"}'M' greentint -8.8479 2.6807 -6.5031 {"}'M' greentint -9.0027 2.5577 -6.6677 {"}'M' greentint -9.1384 2.3801 -6.7939 {"}'M' greentint -9.168 2.2407 -7.1101 {"}'M' greentint -9.2492 1.9975 -7.1484 {"}'M' greentint -8.605 2.859 -6.5552 {"}'M' greentint -8.767 2.7768 -6.7408 {"}'M' greentint -8.9193 2.6408 -6.9008 {"}'M' greentint -9.0559 2.4593 -7.0256 {"}'M' greentint -9.0535 2.2854 -7.3397 {"}'M' greentint -9.139 2.0506 -7.3843 {"}'M' greentint -8.351 2.9729 -6.622 {"}'M' greentint -8.5101 2.9218 -6.8141 {"}'M' greentint -8.6659 2.8231 -6.9875 {"}'M' greentint -8.8121 2.6795 -7.1374 {"}'M' greentint -8.9429 2.4975 -7.2558 {"}'M' greentint -8.9025 2.3072 -7.5485 {"}'M' greentint -8.3534 2.9563 -7.0196 {"}'M' greentint -8.5102 2.8504 -7.1927 {"}'M' greentint -8.6569 2.7032 -7.3425 {"}'M' greentint -8.789 2.5203 -7.4625 {"}'M' greentint -8.4819 2.6855 -7.5316 {"}'M' greentint -8.614 2.4998 -7.651 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H MET 110 A}'M' greentint -9.2206 1.9041 -6.678 {"}'M' greentint -9.0657 2.0012 -6.5055 {"}'M' greentint -8.9244 2.152 -6.3639 {"}'M' greentint -8.8038 2.3463 -6.2622 {"}'M' greentint -8.7113 2.5723 -6.2062 {"}'M' greentint -9.2643 1.8647 -7.1525 {"}'M' greentint -9.11 1.864 -6.9533 {"}'M' greentint -8.9518 1.9277 -6.767 {"}'M' greentint -8.8015 2.0522 -6.6072 {"}'M' greentint -8.6684 2.2278 -6.4841 {"}'M' greentint -8.5632 2.4424 -6.4064 {"}'M' greentint -8.4897 2.6822 -6.3795 {"}'M' greentint -9.0594 1.923 -7.3044 {"}'M' greentint -8.9012 1.9252 -7.1006 {"}'M' greentint -8.7405 2.0012 -6.9138 {"}'M' greentint -8.591 2.1466 -6.7614 {"}'M' greentint -8.4664 2.3465 -6.6555 {"}'M' greentint -8.3778 2.5841 -6.6075 {"}'M' greentint -8.3333 2.8388 -6.6202 {"}'M' greentint -8.9562 2.0857 -7.5594 {"}'M' greentint -8.8075 2.036 -7.3533 {"}'M' greentint -8.6451 2.081 -7.1554 {"}'M' greentint -8.4909 2.2136 -6.9936 {"}'M' greentint -8.3667 2.4169 -6.889 {"}'M' greentint -8.2884 2.6626 -6.8569 {"}'M' greentint -8.2674 2.918 -6.9002 {"}'M' greentint -8.6965 2.2195 -7.5237 {"}'M' greentint -8.5355 2.2476 -7.3238 {"}'M' greentint -8.3875 2.3995 -7.1749 {"}'M' greentint -8.2926 2.6337 -7.1176 {"}'M' greentint -8.2764 2.8873 -7.1669 {"}'M' greentint -8.563 2.4374 -7.5773 {"}'M' greentint -8.403 2.5343 -7.3978 {"}'M' greentint -8.3481 2.7876 -7.3976 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 97 A}'M' greentint -9.7429 1.0144 -4.3281 {"}'M' greentint -9.8761 0.9107 -4.5276 {"}'M' greentint -9.6612 1.2609 -4.3479 {"}'M' greentint -9.8212 1.164 -4.5274 {"}'M' greentint -9.9316 1.0646 -4.8076 {"}'M' greentint -9.9478 0.8109 -4.7583 {"}'M' greentint -9.5277 1.4788 -4.4015 {"}'M' greentint -9.6887 1.4507 -4.6014 {"}'M' greentint -9.8367 1.2988 -4.7503 {"}'M' greentint -9.9033 1.1621 -5.0612 {"}'M' greentint -9.9537 0.9074 -5.0566 {"}'M' greentint -9.3393 1.6486 -4.4681 {"}'M' greentint -9.4982 1.6518 -4.674 {"}'M' greentint -9.6584 1.5607 -4.8569 {"}'M' greentint -9.7998 1.3902 -4.9924 {"}'M' greentint -9.8064 1.2364 -5.3012 {"}'M' greentint -9.8747 0.9874 -5.3189 {"}'M' greentint -9.4037 1.7442 -4.9215 {"}'M' greentint -9.5604 1.6321 -5.0928 {"}'M' greentint -9.6989 1.4574 -5.2236 {"}'M' greentint -9.661 1.2559 -5.5188 {"}'M' greentint -9.4227 1.6461 -5.318 {"}'M' greentint -9.5558 1.4705 -5.4411 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O MET 110 A}'M' greentint -9.8647 0.7752 -4.5306 {"}'M' greentint -9.7244 0.9372 -4.3946 {"}'M' greentint -9.6025 1.1338 -4.2916 {"}'M' greentint -9.9092 0.7146 -4.9347 {"}'M' greentint -9.7513 0.8249 -4.7612 {"}'M' greentint -9.606 0.9866 -4.6182 {"}'M' greentint -9.4814 1.189 -4.5146 {"}'M' greentint -9.3849 1.4221 -4.4548 {"}'M' greentint -9.8382 0.8168 -5.1874 {"}'M' greentint -9.6785 0.9053 -5.0064 {"}'M' greentint -9.5318 1.0549 -4.8588 {"}'M' greentint -9.4081 1.2547 -4.7541 {"}'M' greentint -9.3162 1.4889 -4.7008 {"}'M' greentint -9.2642 1.7397 -4.7024 {"}'M' greentint -9.7199 0.9873 -5.3415 {"}'M' greentint -9.5629 1.0832 -5.1641 {"}'M' greentint -9.4245 1.2537 -5.0326 {"}'M' greentint -9.3215 1.4772 -4.9618 {"}'M' greentint -9.2671 1.7269 -4.9614 {"}'M' greentint -9.5813 1.2133 -5.4155 {"}'M' greentint -9.4315 1.3671 -5.2647 {"}'M' greentint -9.3363 1.6034 -5.2072 {"}'M' greentint -9.4731 1.5113 -5.4757 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n asp A 75 2eifA_119Y_77R}P -6.5345 5.948 -11.3068 {"}-6.5345 5.948 -11.3068 { ca asp A 75 2eifA_119Y_77R}-7.9568 6.1025 -10.9466 { c asp A 75 2eifA_119Y_77R}-8.0636 5.3636 -9.6064 { o asp A 75 2eifA_119Y_77R}-7.8998 4.1607 -9.5813 { c asp A 75 2eifA_119Y_77R}P -8.0636 5.3636 -9.6064 { n arg A 76 2eifA_119Y_77R}-8.2952 6.0774 -8.5069 { ca arg A 76 2eifA_119Y_77R}-8.3833 5.4159 -7.2118 { c arg A 76 2eifA_119Y_77R}-9.8315 5.0966 -6.9669 { o arg A 76 2eifA_119Y_77R}-10.6999 5.9876 -6.9558 { c arg A 76 2eifA_119Y_77R}P -9.8315 5.0966 -6.9669 { n arg A 77 2eifA_119Y_77R}-10.1061 3.8154 -6.7865 { ca arg A 77 2eifA_119Y_77R}-11.4895 3.3995 -6.6087 { c arg A 77 2eifA_119Y_77R}-11.7126 2.5883 -5.3375 { o arg A 77 2eifA_119Y_77R}-10.7698 2.2933 -4.6052 { c arg A 77 2eifA_119Y_77R}P -11.7126 2.5883 -5.3375 { n lys A 78 2eifA_119Y_77R}-12.9693 2.2424 -5.0742 { ca lys A 78 2eifA_119Y_77R}-13.2992 1.4381 -3.894 { c lys A 78 2eifA_119Y_77R}-14.1321 0.2425 -4.3375 { o lys A 78 2eifA_119Y_77R}-14.9534 0.3504 -5.2608 { c lys A 78 2eifA_119Y_77R}P -14.1321 0.2425 -4.3375 { n gly A 79 2eifA_119Y_77R}-13.9177 -0.889 -3.6819 { ca gly A 79 2eifA_119Y_77R}-14.6611 -2.0812 -4.014 { c gly A 79 2eifA_119Y_77R}-15.0033 -2.9008 -2.7789 { o gly A 79 2eifA_119Y_77R}-14.4803 -2.6589 -1.692 { n val A 117 2eifA_119Y_77R}P -12.1621 -2.5425 0.0007 {"}-12.1621 -2.5425 0.0007 { ca val A 117 2eifA_119Y_77R}-10.7884 -2.3845 -0.4357 { c val A 117 2eifA_119Y_77R}-10.6694 -1.118 -1.2936 { o val A 117 2eifA_119Y_77R}-11.648 -0.6609 -1.8896 { c val A 117 2eifA_119Y_77R}P -10.6694 -1.118 -1.2936 { n glu A 118 2eifA_119Y_77R}-9.481 -0.5305 -1.2901 { ca glu A 118 2eifA_119Y_77R}-9.1852 0.5959 -2.146 { c glu A 118 2eifA_119Y_77R}-8.3727 -0.0957 -3.2255 { o glu A 118 2eifA_119Y_77R}-7.5331 -0.9515 -2.925 { c glu A 118 2eifA_119Y_77R}P -8.3727 -0.0957 -3.2255 { n tyr A 119 2eifA_119Y_77R}-8.6422 0.2376 -4.48 { ca tyr A 119 2eifA_119Y_77R}-7.9028 -0.368 -5.5766 { c tyr A 119 2eifA_119Y_77R}-7.7015 0.6884 -6.65 { o tyr A 119 2eifA_119Y_77R}-8.4308 1.6971 -6.6961 { c tyr A 119 2eifA_119Y_77R}P -7.7015 0.6884 -6.65 { n ile A 120 2eifA_119Y_77R}-6.7026 0.4827 -7.4917 { ca ile A 120 2eifA_119Y_77R}-6.4319 1.4602 -8.5223 { c ile A 120 2eifA_119Y_77R}-6.4376 0.8124 -9.8996 { o ile A 120 2eifA_119Y_77R}-6.2888 -0.4007 -10.0413 { c ile A 120 2eifA_119Y_77R}P -6.4376 0.8124 -9.8996 { n glu A 121 2eifA_119Y_77R}-6.638 1.6631 -10.8924 { ca glu A 121 2eifA_119Y_77R}-6.5812 1.2888 -12.2911 { c glu A 121 2eifA_119Y_77R}-5.6146 2.3 -12.8687 { o glu A 121 2eifA_119Y_77R}-5.7081 3.4786 -12.5733 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n asp A 75 2eifA_119Y_77R}P -6.5345 5.948 -11.3068 { ca asp A 75 2eifA_119Y_77R}P -7.9568 6.1025 -10.9466 { n arg A 76 2eifA_119Y_77R}P -8.2952 6.0774 -8.5069 { ca arg A 76 2eifA_119Y_77R}P -8.3833 5.4159 -7.2118 { n arg A 77 2eifA_119Y_77R}P -10.1061 3.8154 -6.7865 { ca arg A 77 2eifA_119Y_77R}P -11.4895 3.3995 -6.6087 { n lys A 78 2eifA_119Y_77R}P -12.9693 2.2424 -5.0742 { ca lys A 78 2eifA_119Y_77R}P -13.2992 1.4381 -3.894 { n gly A 79 2eifA_119Y_77R}P -13.9177 -0.889 -3.6819 { ca gly A 79 2eifA_119Y_77R}P -14.6611 -2.0812 -4.014 {"}P -14.6611 -2.0812 -4.014 { n val A 117 2eifA_119Y_77R}P -12.1621 -2.5425 0.0007 { ca val A 117 2eifA_119Y_77R}P -10.7884 -2.3845 -0.4357 { n glu A 118 2eifA_119Y_77R}P -9.481 -0.5305 -1.2901 { ca glu A 118 2eifA_119Y_77R}P -9.1852 0.5959 -2.146 { n tyr A 119 2eifA_119Y_77R}P -8.6422 0.2376 -4.48 { ca tyr A 119 2eifA_119Y_77R}P -7.9028 -0.368 -5.5766 { n ile A 120 2eifA_119Y_77R}P -6.7026 0.4827 -7.4917 { ca ile A 120 2eifA_119Y_77R}P -6.4319 1.4602 -8.5223 { n glu A 121 2eifA_119Y_77R}P -6.638 1.6631 -10.8924 { ca glu A 121 2eifA_119Y_77R}P -6.5812 1.2888 -12.2911 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca asp A 75 2eifA_119Y_77R}P -7.9568 6.1025 -10.9466 {"}-7.9568 6.1025 -10.9466 { ca arg A 76 2eifA_119Y_77R}-8.3833 5.4159 -7.2118 { ca arg A 77 2eifA_119Y_77R}-11.4895 3.3995 -6.6087 { ca lys A 78 2eifA_119Y_77R}-13.2992 1.4381 -3.894 { ca gly A 79 2eifA_119Y_77R}-14.6611 -2.0812 -4.014 { ca val A 117 2eifA_119Y_77R}P -10.7884 -2.3845 -0.4357 {"}-10.7884 -2.3845 -0.4357 { ca glu A 118 2eifA_119Y_77R}-9.1852 0.5959 -2.146 { ca tyr A 119 2eifA_119Y_77R}-7.9028 -0.368 -5.5766 { ca ile A 120 2eifA_119Y_77R}-6.4319 1.4602 -8.5223 { ca glu A 121 2eifA_119Y_77R}-6.5812 1.2888 -12.2911 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 77 2eifA_119Y_77R}P 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-9.5385 {"}'S' sea -11.7911 0.3564 -9.7183 {"}'S' sea -11.9434 0.2321 -9.8811 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 119 A}'S' P -11.7485 0.6439 -7.3265 {"}'S' -11.7503 0.6383 -7.326 {"}'S' P -11.9061 0.6611 -7.5339 {"}'S' -11.9096 0.6396 -7.5303 {"}'S' P -11.5352 0.5574 -7.4544 {"}'S' -11.54 0.5456 -7.4532 {"}'S' P -11.691 0.5789 -7.662 {"}'S' -11.7022 0.5454 -7.6542 { CZ TYR 119 A}'S' P -11.6913 0.5751 -7.9452 {"}'S' -11.6993 0.5408 -7.9602 {"}'S' P -11.8256 0.6735 -8.1462 {"}'S' -11.8318 0.6317 -8.1587 {"}'S' P -11.3839 0.4688 -7.9468 {"}'S' -11.3852 0.4664 -7.9481 {"}'S' P -11.5062 0.5933 -8.1407 {"}'S' -11.5205 0.5533 -8.1528 {"}'S' P -11.6441 0.6844 -8.3431 {"}'S' -11.6528 0.6473 -8.35 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 119 A}'S' blue -13.9505 0.3809 -9.4269 {"}'S' blue -13.5345 0.5771 -9.308 {"}'S' sky -13.6936 0.526 -9.5002 {"}'S' sky -13.8494 0.4272 -9.6735 {"}'S' blue -13.9956 0.2836 -9.8234 {"}'S' 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-7.7603 {"}'S' -11.9098 0.5887 -7.7617 {"}'S' P -11.7645 0.5469 -7.557 {"}'S' -11.7538 0.5809 -7.5654 {"}'S' P -11.6051 0.5773 -7.3597 {"}'S' -11.6037 0.5846 -7.3629 {"}'S' P -11.8928 0.6129 -8.1728 {"}'S' -11.8784 0.6447 -8.1622 {"}'S' P -11.7621 0.5185 -7.9778 {"}'S' -11.7509 0.5551 -7.9726 {"}'S' P -11.6148 0.4768 -7.7755 {"}'S' -11.6125 0.4952 -7.7766 {"}'S' P -11.4592 0.4888 -7.5776 {"}'S' -11.4591 0.4943 -7.5786 {"}'S' P -11.7635 0.6982 -8.4599 {"}'S' -11.7593 0.7087 -8.4532 {"}'S' P -11.6473 0.5664 -8.2745 {"}'S' -11.6376 0.612 -8.2563 {"}'S' P -11.5108 0.4851 -8.0744 {"}'S' -11.5077 0.5238 -8.0671 {"}'S' P -11.4706 0.6487 -8.4789 {"}'S' -11.4709 0.6496 -8.4779 {"}'S' P -11.3421 0.5479 -8.2837 {"}'S' -11.3426 0.5556 -8.281 @dotlist {x} color= sky width= 1 master= {vdw contact} { NE ARG 77 A}'S' blue -13.3145 0.9526 -10.2175 {"}'S' blue -13.1513 1.0292 -10.0273 { HE ARG 77 A}'S' blue -14.1213 0.799 -9.4771 {"}'S' blue -14.1427 0.6505 -9.8929 {"}'S' -13.986 0.688 -9.701 {"}'S' -13.8311 0.7852 -9.5285 {"}'S' blue -13.6898 0.936 -9.3869 {"}'S' -13.8754 0.6479 -9.9763 {"}'S' -13.5669 0.8361 -9.6302 {"}'S' blue -13.4338 1.0117 -9.5071 {"}'S' -13.6666 0.7091 -10.1236 {"}'S' -13.5059 0.7851 -9.9367 {"}'S' -13.3564 0.9305 -9.7844 {"}'S' blue -13.4105 0.8649 -10.1783 @dotlist {x} color= sky width= 1 master= {vdw contact} { HE ARG 77 A}'S' sea -13.7172 0.7116 -9.79 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O TYR 119 A}'M' P -9.2473 2.8345 -6.6688 {"}'M' -9.2235 2.8013 -6.6696 {"}'M' P -9.3995 2.6986 -6.8287 {"}'M' -9.396 2.695 -6.8282 {"}'M' P -9.1462 2.8808 -6.9154 {"}'M' -9.1411 2.8717 -6.9132 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 119 A}'M' greentint -9.5042 2.3774 -6.109 {"}'M' greentint -9.197 2.616 -5.9691 {"}'M' greentint -9.3549 2.6076 -6.1711 {"}'M' greentint -9.5135 2.5144 -6.3495 {"}'M' greentint -9.6528 2.3465 -6.4827 {"}'M' greentint -9.7261 2.2182 -6.7997 {"}'M' greentint -9.0118 2.786 -6.0351 {"}'M' greentint -9.168 2.7967 -6.239 {"}'M' greentint -9.3282 2.7385 -6.431 {"}'M' greentint -9.4829 2.6154 -6.5956 {"}'M' greentint -9.6187 2.4379 -6.7218 {"}'M' greentint -9.6482 2.2984 -7.038 {"}'M' greentint -8.7718 2.9042 -6.0741 {"}'M' greentint -8.9247 2.9401 -6.2811 {"}'M' greentint -9.0852 2.9167 -6.4831 {"}'M' greentint -9.5362 2.517 -6.9535 {"}'M' greentint -9.5337 2.3432 -7.2677 {"}'M' greentint -8.676 3.0315 -6.3499 {"}'M' greentint -8.8312 3.0306 -6.5499 {"}'M' greentint -8.9904 2.9795 -6.7421 {"}'M' greentint -9.2923 2.7372 -7.0653 {"}'M' greentint -9.4231 2.5552 -7.1837 {"}'M' greentint -8.5153 3.0872 -6.5565 {"}'M' greentint -8.6734 3.0747 -6.7577 {"}'M' greentint -8.8336 3.014 -6.9475 {"}'M' greentint -8.9905 2.9081 -7.1206 {"}'M' greentint -9.1371 2.7609 -7.2704 {"}'M' greentint -9.2692 2.578 -7.3904 {"}'M' greentint -8.498 3.0719 -6.9514 {"}'M' greentint -8.6588 3.0049 -7.1405 {"}'M' greentint -8.8154 2.8942 -7.3122 {"}'M' greentint -8.9621 2.7432 -7.4595 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H ARG 77 A}'M' P -8.9088 2.2295 -6.6798 {"}'M' -8.9306 2.2654 -6.6836 {"}'M' P -8.7593 2.3748 -6.5274 {"}'M' -8.7688 2.3846 -6.5307 {"}'M' P -8.8134 2.3092 -6.9214 {"}'M' -8.8267 2.3261 -6.9177 {"}'M' P -8.6592 2.4418 -6.7597 {"}'M' -8.6664 2.448 -6.7589 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 77 A}'M' greentint -9.6815 2.1795 -6.407 {"}'M' greentint -9.5241 2.2433 -6.2201 {"}'M' greentint -9.3731 2.3676 -6.0609 {"}'M' greentint -9.2412 2.5426 -5.9376 {"}'M' greentint -9.6946 2.1192 -6.8349 {"}'M' greentint -9.5456 2.0949 -6.6359 {"}'M' greentint -9.3889 2.1323 -6.444 {"}'M' greentint -9.234 2.2295 -6.2716 {"}'M' greentint -9.0927 2.3803 -6.13 {"}'M' greentint -8.9721 2.5745 -6.0282 {"}'M' greentint -8.8796 2.8006 -5.9722 {"}'M' greentint -9.5725 2.1581 -7.1178 {"}'M' greentint -9.4326 2.093 -6.9185 {"}'M' greentint -9.2782 2.0923 -6.7194 {"}'M' greentint -9.12 2.156 -6.5331 {"}'M' greentint -8.9698 2.2804 -6.3732 {"}'M' greentint -8.8367 2.456 -6.2502 {"}'M' greentint -8.7314 2.6707 -6.1724 {"}'M' greentint -8.658 2.9105 -6.1455 {"}'M' greentint -9.369 2.2243 -7.2735 {"}'M' greentint -9.2277 2.1513 -7.0704 {"}'M' greentint -9.0695 2.1535 -6.8667 {"}'M' greentint -8.6347 2.5748 -6.4216 {"}'M' greentint -8.5461 2.8124 -6.3735 {"}'M' greentint -9.2406 2.451 -7.5136 {"}'M' greentint -9.1245 2.314 -7.3255 {"}'M' greentint -8.9758 2.2643 -7.1193 {"}'M' greentint -8.535 2.6452 -6.6551 {"}'M' greentint -8.4567 2.8908 -6.6229 {"}'M' greentint -8.9965 2.5495 -7.4879 {"}'M' greentint -8.8648 2.4478 -7.2898 {"}'M' greentint -8.7038 2.4758 -7.0898 {"}'M' greentint -8.5557 2.6278 -6.9409 {"}'M' greentint -8.4609 2.8619 -6.8836 {"}'M' greentint -8.7313 2.6656 -7.3433 {"}'M' greentint -8.5713 2.7625 -7.1639 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 119 A}'M' greentint -10.0384 1.3134 -4.1696 {"}'M' greentint -10.1983 1.2165 -4.3491 {"}'M' greentint -10.3087 1.1171 -4.6293 {"}'M' greentint -9.9049 1.5313 -4.2232 {"}'M' greentint -10.0659 1.5032 -4.4232 {"}'M' greentint -10.2139 1.3512 -4.572 {"}'M' greentint -10.2804 1.2146 -4.8829 {"}'M' greentint -9.7165 1.7011 -4.2898 {"}'M' greentint -9.8753 1.7043 -4.4957 {"}'M' greentint -10.0356 1.6132 -4.6786 {"}'M' greentint -10.177 1.4427 -4.8141 {"}'M' greentint -10.1836 1.2888 -5.123 {"}'M' greentint -9.6196 1.8358 -4.5453 {"}'M' greentint -9.7809 1.7967 -4.7432 {"}'M' greentint -9.9375 1.6846 -4.9146 {"}'M' greentint -10.0761 1.5099 -5.0453 {"}'M' greentint -9.4914 1.8868 -4.7936 {"}'M' greentint -9.6496 1.823 -4.9799 {"}'M' greentint -9.7998 1.6986 -5.1397 {"}'M' greentint -9.933 1.523 -5.2628 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 77 A}'M' green -9.7223 1.5303 -4.0742 {"}'M' green -9.436 1.8854 -4.4834 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 77 A}'M' greentint -10.2944 0.977 -4.6598 {"}'M' greentint -10.1363 1.0511 -4.4761 {"}'M' greentint -9.9845 1.1717 -4.3132 {"}'M' greentint -9.8442 1.3337 -4.1772 {"}'M' greentint -10.1915 1.0554 -4.9114 {"}'M' greentint -10.0289 1.1112 -4.7172 {"}'M' greentint -9.8711 1.2214 -4.5438 {"}'M' greentint -9.7257 1.3831 -4.4008 {"}'M' greentint -9.6011 1.5855 -4.2972 {"}'M' greentint -10.1172 1.1909 -5.1705 {"}'M' greentint -9.958 1.2133 -4.97 {"}'M' greentint -9.7983 1.3019 -4.789 {"}'M' greentint -9.6516 1.4515 -4.6414 {"}'M' greentint -9.5278 1.6512 -4.5367 {"}'M' greentint -9.9986 1.3728 -5.325 {"}'M' greentint -9.8397 1.3838 -5.1241 {"}'M' greentint -9.6827 1.4797 -4.9467 {"}'M' greentint -9.5442 1.6502 -4.8152 {"}'M' greentint -9.4413 1.8737 -4.7443 {"}'M' greentint -9.7011 1.6099 -5.1981 {"}'M' greentint -9.5513 1.7636 -5.0473 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 46 2eifA_61F_48V}P -7.8736 5.6315 -12.0446 {"}-7.8736 5.6315 -12.0446 { ca ala A 46 2eifA_61F_48V}-8.928 5.9489 -11.0889 { c ala A 46 2eifA_61F_48V}-8.5691 5.2184 -9.8011 { o ala A 46 2eifA_61F_48V}-8.0382 4.1109 -9.8395 { c ala A 46 2eifA_61F_48V}P -8.5691 5.2184 -9.8011 { n arg A 47 2eifA_61F_48V}-8.8118 5.8566 -8.6653 { ca arg A 47 2eifA_61F_48V}-8.6028 5.2042 -7.3985 { c arg A 47 2eifA_61F_48V}-10.0285 5.0026 -6.919 { o arg A 47 2eifA_61F_48V}-10.8106 5.9631 -6.8282 { c arg A 47 2eifA_61F_48V}P -10.0285 5.0026 -6.919 { n val A 48 2eifA_61F_48V}-10.3682 3.7515 -6.6466 { ca val A 48 2eifA_61F_48V}-11.6969 3.4166 -6.1835 { c val A 48 2eifA_61F_48V}-11.6248 2.8263 -4.7882 { o val A 48 2eifA_61F_48V}-10.8972 1.8658 -4.5366 { c val A 48 2eifA_61F_48V}P -11.6248 2.8263 -4.7882 { n val A 49 2eifA_61F_48V}-12.3725 3.4338 -3.881 { ca val A 49 2eifA_61F_48V}-12.431 3.0143 -2.4964 { c val A 49 2eifA_61F_48V}-13.8241 2.4973 -2.1806 { o val A 49 2eifA_61F_48V}-14.8339 3.1568 -2.4947 { c val A 49 2eifA_61F_48V}P -13.8241 2.4973 -2.1806 { n gly A 50 2eifA_61F_48V}-13.8855 1.3178 -1.5664 { ca gly A 50 2eifA_61F_48V}-15.1739 0.7508 -1.2395 { c gly A 50 2eifA_61F_48V}-15.2534 0.2096 0.1715 { o gly A 50 2eifA_61F_48V}-14.2292 0.0776 0.8461 { n lys A 59 2eifA_61F_48V}P -11.7218 -1.4994 1.2273 {"}-11.7218 -1.4994 1.2273 { ca lys A 59 2eifA_61F_48V}-10.9094 -2.0503 0.1531 { c lys A 59 2eifA_61F_48V}-10.7223 -0.943 -0.8778 { o lys A 59 2eifA_61F_48V}-11.5428 -0.0318 -0.97 { c lys A 59 2eifA_61F_48V}P -10.7223 -0.943 -0.8778 { n glu A 60 2eifA_61F_48V}-9.6406 -1.0063 -1.6422 { ca glu A 60 2eifA_61F_48V}-9.4403 -0.0034 -2.6791 { c glu A 60 2eifA_61F_48V}-8.5464 -0.557 -3.7627 { o glu A 60 2eifA_61F_48V}-7.8223 -1.5351 -3.5477 { c glu A 60 2eifA_61F_48V}P -8.5464 -0.557 -3.7627 { n phe A 61 2eifA_61F_48V}-8.6218 0.0475 -4.935 { ca phe A 61 2eifA_61F_48V}-7.7442 -0.3224 -6.0316 { c phe A 61 2eifA_61F_48V}-7.4736 0.9038 -6.8814 { o phe A 61 2eifA_61F_48V}-8.2011 1.9193 -6.8037 { c phe A 61 2eifA_61F_48V}P -7.4736 0.9038 -6.8814 { n val A 62 2eifA_61F_48V}-6.4025 0.8252 -7.6603 { ca val A 62 2eifA_61F_48V}-6.0486 1.8785 -8.5894 { c val A 62 2eifA_61F_48V}-5.9339 1.1656 -9.9343 { o val A 62 2eifA_61F_48V}-5.2681 0.1289 -10.0539 { c val A 62 2eifA_61F_48V}P -5.9339 1.1656 -9.9343 { n ala A 63 2eifA_61F_48V}-6.5901 1.7043 -10.9455 { ca ala A 63 2eifA_61F_48V}-6.5396 1.0729 -12.2499 { c ala A 63 2eifA_61F_48V}-6.9043 2.0372 -13.3564 { o ala A 63 2eifA_61F_48V}-7.5066 3.0772 -13.1029 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 46 2eifA_61F_48V}P -7.8736 5.6315 -12.0446 { ca ala A 46 2eifA_61F_48V}P -8.928 5.9489 -11.0889 { n arg A 47 2eifA_61F_48V}P -8.8118 5.8566 -8.6653 { ca arg A 47 2eifA_61F_48V}P -8.6028 5.2042 -7.3985 { n val A 48 2eifA_61F_48V}P -10.3682 3.7515 -6.6466 { ca val A 48 2eifA_61F_48V}P -11.6969 3.4166 -6.1835 { n val A 49 2eifA_61F_48V}P -12.3725 3.4338 -3.881 { ca val A 49 2eifA_61F_48V}P -12.431 3.0143 -2.4964 { n gly A 50 2eifA_61F_48V}P -13.8855 1.3178 -1.5664 { ca gly A 50 2eifA_61F_48V}P -15.1739 0.7508 -1.2395 {"}P -15.1739 0.7508 -1.2395 { n lys A 59 2eifA_61F_48V}P -11.7218 -1.4994 1.2273 { ca lys A 59 2eifA_61F_48V}P -10.9094 -2.0503 0.1531 { n glu A 60 2eifA_61F_48V}P -9.6406 -1.0063 -1.6422 { ca glu A 60 2eifA_61F_48V}P -9.4403 -0.0034 -2.6791 { n phe A 61 2eifA_61F_48V}P -8.6218 0.0475 -4.935 { ca phe A 61 2eifA_61F_48V}P -7.7442 -0.3224 -6.0316 { n val A 62 2eifA_61F_48V}P -6.4025 0.8252 -7.6603 { ca val A 62 2eifA_61F_48V}P -6.0486 1.8785 -8.5894 { n ala A 63 2eifA_61F_48V}P -6.5901 1.7043 -10.9455 { ca ala A 63 2eifA_61F_48V}P -6.5396 1.0729 -12.2499 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 46 2eifA_61F_48V}P -8.928 5.9489 -11.0889 {"}-8.928 5.9489 -11.0889 { ca arg A 47 2eifA_61F_48V}-8.6028 5.2042 -7.3985 { ca val A 48 2eifA_61F_48V}-11.6969 3.4166 -6.1835 { ca val A 49 2eifA_61F_48V}-12.431 3.0143 -2.4964 { ca gly A 50 2eifA_61F_48V}-15.1739 0.7508 -1.2395 { ca lys A 59 2eifA_61F_48V}P -10.9094 -2.0503 0.1531 {"}-10.9094 -2.0503 0.1531 { ca glu A 60 2eifA_61F_48V}-9.4403 -0.0034 -2.6791 { ca phe A 61 2eifA_61F_48V}-7.7442 -0.3224 -6.0316 { ca val A 62 2eifA_61F_48V}-6.0486 1.8785 -8.5894 { ca ala A 63 2eifA_61F_48V}-6.5396 1.0729 -12.2499 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 48 2eifA_61F_48V}P -11.6969 3.4166 -6.1835 { cb val A 48 2eifA_61F_48V}-12.3613 2.4285 -7.1685 { cg1 val A 48 2eifA_61F_48V}-13.7441 2.0092 -6.6763 { cb val A 48 2eifA_61F_48V}P -12.3613 2.4285 -7.1685 { cg2 val A 48 2eifA_61F_48V}-12.4415 3.0891 -8.5516 { ca phe A 61 2eifA_61F_48V}P -7.7442 -0.3224 -6.0316 { cb phe A 61 2eifA_61F_48V}-8.3273 -1.4766 -6.8813 { cg phe A 61 2eifA_61F_48V}-9.5686 -1.131 -7.6775 { cd1 phe A 61 2eifA_61F_48V}-9.4843 -0.4215 -8.8863 { ce1 phe A 61 2eifA_61F_48V}-10.6356 -0.1722 -9.664 { cz phe A 61 2eifA_61F_48V}-11.8793 -0.6334 -9.2319 { cg phe A 61 2eifA_61F_48V}P -9.5686 -1.131 -7.6775 { cd2 phe A 61 2eifA_61F_48V}-10.816 -1.5773 -7.2504 { ce2 phe A 61 2eifA_61F_48V}-11.9718 -1.3355 -8.0189 { cz phe A 61 2eifA_61F_48V}ghost -11.8793 -0.6334 -9.2319 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A 48 2eifA_61F_48V}P -12.3613 2.4285 -7.1685 { cg1 val A 48 2eifA_61F_48V}P -13.7441 2.0092 -6.6763 {"}P -13.7441 2.0092 -6.6763 {"}P -13.7441 2.0092 -6.6763 { cg2 val A 48 2eifA_61F_48V}P -12.4415 3.0891 -8.5516 {"}P -12.4415 3.0891 -8.5516 {"}P -12.4415 3.0891 -8.5516 { cb phe A 61 2eifA_61F_48V}P -8.3273 -1.4766 -6.8813 {"}P -8.3273 -1.4766 -6.8813 { cd1 phe A 61 2eifA_61F_48V}P -9.4843 -0.4215 -8.8863 { cd2 phe A 61 2eifA_61F_48V}P -10.816 -1.5773 -7.2504 { ce1 phe A 61 2eifA_61F_48V}P -10.6356 -0.1722 -9.664 { ce2 phe A 61 2eifA_61F_48V}P -11.9718 -1.3355 -8.0189 { cz phe A 61 2eifA_61F_48V}P -11.8793 -0.6334 -9.2319 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 61 A}'S' blue -11.3529 0.0606 -6.9501 {"}'S' blue -11.0704 0.1359 -6.9963 {"}'S' sky -11.228 0.1228 -7.1968 {"}'S' blue -10.8832 0.1705 -7.1773 {"}'S' blue -11.0448 0.153 -7.3822 { CE1 PHE 61 A}'S' sky -11.2045 0.6606 -8.2341 {"}'S' sky -11.4105 0.9673 -8.5857 {"}'S' sky -10.9275 0.6353 -8.1385 {"}'S' sky -10.9929 0.8385 -8.2812 {"}'S' sky -11.0896 1.0057 -8.4515 {"}'S' blue -11.2112 1.1277 -8.6438 {"}'S' blue -11.3534 1.198 -8.8458 {"}'S' blue -11.5077 1.2157 -9.0504 {"}'S' blue -11.669 1.1779 -9.2486 {"}'S' blue -10.7594 0.9518 -8.3279 {"}'S' blue -10.8583 1.1175 -8.5026 {"}'S' blue -11.2734 1.3589 -9.1063 {"}'S' blue -11.4344 1.344 -9.3093 {"}'S' blue -11.5972 1.2813 -9.5022 {"}'S' blue -11.1726 1.4658 -9.3637 { CE2 PHE 61 A}'S' blue -12.3167 0.0804 -7.05 {"}'S' blue -12.4566 0.1614 -7.2528 {"}'S' blue -11.952 0.0278 -6.9223 {"}'S' sky -12.5087 0.3025 -7.7186 {"}'S' sky -11.6912 0.044 -6.9797 {"}'S' sky -11.4826 0.0964 -7.1388 {"}'S' sky -11.2939 0.1237 -7.3315 {"}'S' sky -11.2082 0.2016 -7.6765 { CZ PHE 61 A}'S' blue -12.6542 0.506 -8.1536 {"}'S' sky -12.4549 0.6664 -8.2117 {"}'S' blue -12.5971 0.7368 -8.4136 {"}'S' sky -12.3641 0.8635 -8.4658 {"}'S' blue -12.5171 0.8977 -8.6741 {"}'S' blue -12.6781 0.8827 -8.8772 {"}'S' blue -12.8409 0.8201 -9.07 {"}'S' sky -12.1124 0.9491 -8.5225 {"}'S' blue -12.2604 0.999 -8.7275 {"}'S' sky -12.4162 1.0045 -8.9316 {"}'S' sky -12.5766 0.9683 -9.1289 {"}'S' sky -12.7373 0.8899 -9.3135 {"}'S' sky -11.8393 0.9867 -8.5713 {"}'S' sky -11.9818 1.0526 -8.7742 {"}'S' sky -12.1337 1.0798 -8.9778 {"}'S' sky -12.2913 1.0666 -9.1783 {"}'S' sky -12.4522 1.0141 -9.3708 {"}'S' blue -12.6094 0.9244 -9.5498 {"}'S' sky -11.2108 0.4382 -8.0212 {"}'S' sky -11.5088 0.9322 -8.5428 {"}'S' blue -11.7899 1.0914 -8.9515 {"}'S' blue -11.9465 1.1143 -9.1588 {"}'S' blue -12.1081 1.0969 -9.3637 {"}'S' blue -12.272 1.0402 -9.5594 {"}'S' blue -12.4332 0.9465 -9.7412 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 61 A}'S' sea -11.2916 0.8406 -8.396 { CE2 PHE 61 A}'S' sea -12.0695 0.1569 -7.1107 {"}'S' sea -12.2049 0.2471 -7.3095 {"}'S' sea -12.3528 0.2969 -7.5145 {"}'S' sea -11.8039 0.1817 -7.1634 {"}'S' green -11.9318 0.2847 -7.3584 {"}'S' green -12.0743 0.3506 -7.5613 {"}'S' sea -12.2262 0.3777 -7.7648 {"}'S' green -11.6013 0.2301 -7.3299 {"}'S' green -11.7356 0.3285 -7.5309 {"}'S' green -11.8824 0.3893 -7.7385 {"}'S' sea -11.4162 0.2483 -7.5254 {"}'S' green -11.5541 0.3394 -7.7278 { CZ PHE 61 A}'S' sea -12.3333 0.5444 -8.0194 {"}'S' green -12.0031 0.4905 -7.8958 {"}'S' green -12.1019 0.6562 -8.0704 {"}'S' sea -12.2242 0.7825 -8.2629 {"}'S' green -11.7618 0.566 -7.9626 {"}'S' green -11.8595 0.7299 -8.1352 {"}'S' green -11.977 0.8589 -8.3236 {"}'S' sea -11.433 0.3817 -7.8779 {"}'S' green -11.5054 0.577 -8.0248 {"}'S' green -11.5987 0.746 -8.1926 {"}'S' green -11.7114 0.8838 -8.3764 {"}'S' sea -11.29 0.6321 -8.177 {"}'S' sea -11.3901 0.7985 -8.3518 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 48 A}'S' blue -12.6452 1.0539 -8.2133 {"}'S' sky -12.5334 0.9145 -8.0304 {"}'S' blue -12.5164 1.3165 -8.5108 {"}'S' sky -12.4296 1.1374 -8.3479 {"}'S' sky -12.1944 1.2219 -8.4251 {"}'S' blue -11.9553 1.3236 -8.4633 { CG2 VAL 48 A}'S' blue -12.4485 1.3473 -8.7224 {"}'S' sky -12.1917 1.3769 -8.8122 {"}'S' blue -12.0341 1.3887 -8.6114 {"}'S' blue -12.1314 1.4751 -9.1521 {"}'S' blue -11.9787 1.4482 -8.9474 {"}'S' blue -11.8196 1.4651 -8.7458 {"}'S' blue -11.8862 1.5705 -9.2198 {"}'S' blue -11.7284 1.5588 -9.0134 {"}'S' blue -11.5663 1.5967 -8.8142 {"}'S' blue -11.6425 1.7026 -9.2603 {"}'S' blue -11.484 1.7145 -9.0584 {"}'S' blue -11.3228 1.781 -8.8686 {"}'S' blue -11.3712 1.882 -9.2294 { HB VAL 48 A}'S' blue -12.5074 0.6711 -7.5429 {"}'S' sky -12.392 0.5394 -7.3568 {"}'S' sky -12.2547 0.4579 -7.1573 {"}'S' sky -12.1027 0.4322 -6.954 {"}'S' sky -12.4209 0.8212 -7.905 {"}'S' sky -12.3398 0.6388 -7.749 {"}'S' sky -11.7974 0.3741 -6.9747 {"}'S' sky -11.5372 0.3758 -7.0705 {"}'S' blue -11.3792 0.4616 -6.8895 {"}'S' blue -11.2171 0.484 -7.0969 {"}'S' sky -11.759 1.2191 -8.3693 {"}'S' sky -11.2808 0.49 -7.5476 {"}'S' blue -11.1176 0.539 -7.351 {"}'S' blue -11.4924 1.3301 -8.3618 {"}'S' sky -11.1972 0.6469 -7.7904 {"}'S' sky -11.2473 1.1533 -8.2274 {"}'S' sky -11.1795 0.9448 -8.082 {"}'S' sky -11.0461 0.8421 -7.8813 {"}'S' blue -11.0261 1.224 -8.1053 {"}'S' blue -10.9211 1.0676 -7.9261 {HG21 VAL 48 A}'S' blue -12.9545 1.2559 -9.0018 {"}'S' blue -12.8537 1.2272 -9.2949 {"}'S' sky -12.6943 1.2577 -9.0976 {"}'S' blue -12.5363 1.3434 -8.9166 {"}'S' sky -12.6901 1.272 -9.5054 {"}'S' sky -12.5319 1.2898 -9.3069 {"}'S' sky -12.3742 1.3658 -9.1241 {"}'S' blue -12.4379 1.3718 -9.5747 {"}'S' sky -12.2746 1.4208 -9.3782 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 48 A}'S' sea -12.3201 0.9914 -8.1666 { HB VAL 48 A}'S' sea -12.231 0.4982 -7.5699 {"}'S' green -12.1003 0.4038 -7.3748 {"}'S' green -11.953 0.3621 -7.1725 {"}'S' sea -12.2457 0.9713 -8.1509 {"}'S' green -12.1893 0.7596 -8.0204 {"}'S' green -12.1017 0.5835 -7.857 {"}'S' green -11.9855 0.4517 -7.6715 {"}'S' green -11.849 0.3703 -7.4715 {"}'S' green -11.6966 0.3454 -7.2677 {"}'S' sea -12.0169 1.1107 -8.304 {"}'S' green -11.9824 0.8831 -8.1964 {"}'S' green -11.9113 0.6868 -8.051 {"}'S' green -11.8088 0.534 -7.8759 {"}'S' green -11.6803 0.4332 -7.6808 {"}'S' green -11.533 0.3902 -7.4782 {"}'S' sea -11.3749 0.4079 -7.2798 {"}'S' green -11.7396 0.9767 -8.2773 {"}'S' green -11.6752 0.7678 -8.1346 {"}'S' green -11.5715 0.6091 -7.9567 {"}'S' sea -11.4366 0.5142 -7.7558 {"}'S' sea -11.4921 1.086 -8.2936 {"}'S' sea -11.437 0.8747 -8.165 {"}'S' sea -11.3344 0.7219 -7.9899 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 61 A}'M' greentint -9.3732 2.3117 -6.1473 {"}'M' greentint -9.5168 2.204 -6.4198 {"}'M' greentint -9.2745 2.5996 -6.2166 {"}'M' greentint -9.4231 2.4427 -6.3651 {"}'M' greentint -9.5268 2.3463 -6.6625 {"}'M' greentint -9.5833 2.0968 -6.6658 {"}'M' greentint -9.1253 2.8297 -6.2787 {"}'M' greentint -9.2838 2.7366 -6.4571 {"}'M' greentint -9.4231 2.5686 -6.5903 {"}'M' greentint -9.4964 2.4403 -6.9073 {"}'M' greentint -9.5676 2.1952 -6.9315 {"}'M' greentint -8.9383 3.0188 -6.3466 {"}'M' greentint -9.0985 2.9606 -6.5386 {"}'M' greentint -9.2533 2.8375 -6.7032 {"}'M' greentint -9.389 2.66 -6.8294 {"}'M' greentint -9.4185 2.5205 -7.1456 {"}'M' greentint -9.4997 2.2774 -7.184 {"}'M' greentint -8.8551 3.1382 -6.59 {"}'M' greentint -9.0176 3.0566 -6.7763 {"}'M' greentint -9.1698 2.9207 -6.9363 {"}'M' greentint -9.3065 2.7391 -7.0611 {"}'M' greentint -9.304 2.5653 -7.3753 {"}'M' greentint -8.9165 3.1029 -7.023 {"}'M' greentint -9.0626 2.9593 -7.1729 {"}'M' greentint -9.1934 2.7774 -7.2913 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 48 A}'M' greentint -9.4427 2.0456 -6.5114 {"}'M' greentint -9.2925 2.17 -6.3516 {"}'M' greentint -9.1594 2.3456 -6.2285 {"}'M' greentint -9.0541 2.5603 -6.1508 {"}'M' greentint -8.9806 2.8001 -6.1239 {"}'M' greentint -9.5503 2.0409 -7.0488 {"}'M' greentint -9.3921 2.0431 -6.845 {"}'M' greentint -9.2315 2.119 -6.6582 {"}'M' greentint -9.082 2.2644 -6.5058 {"}'M' greentint -8.9574 2.4644 -6.3999 {"}'M' greentint -8.8688 2.702 -6.3519 {"}'M' greentint -8.8243 2.9567 -6.3646 {"}'M' greentint -9.4472 2.2035 -7.3038 {"}'M' greentint -9.2984 2.1539 -7.0977 {"}'M' greentint -9.1361 2.1988 -6.8998 {"}'M' greentint -8.9819 2.3314 -6.738 {"}'M' greentint -8.8576 2.5348 -6.6334 {"}'M' greentint -8.7794 2.7804 -6.6013 {"}'M' greentint -8.7584 3.0359 -6.6446 {"}'M' greentint -9.1875 2.3374 -7.2681 {"}'M' greentint -9.0265 2.3654 -7.0682 {"}'M' greentint -8.8784 2.5174 -6.9193 {"}'M' greentint -8.7836 2.7515 -6.862 {"}'M' greentint -8.7673 3.0052 -6.9113 {"}'M' greentint -9.054 2.5552 -7.3217 {"}'M' greentint -8.894 2.6521 -7.1422 {"}'M' greentint -8.839 2.9054 -7.142 {"}'M' greentint -8.9723 2.8018 -7.3415 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 61 A}'M' green -10.0767 0.6896 -4.5667 {"}'M' green -10.2585 0.8414 -5.2736 {"}'M' green -9.5472 1.7174 -4.9406 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 61 A}'M' greentint -10.0477 0.9484 -4.5451 {"}'M' greentint -10.1809 0.8448 -4.7446 {"}'M' greentint -9.8618 1.0398 -4.3871 {"}'M' greentint -9.966 1.195 -4.5649 {"}'M' greentint -10.126 1.098 -4.7444 {"}'M' greentint -10.2364 0.9987 -5.0246 {"}'M' greentint -10.2527 0.745 -4.9753 {"}'M' greentint -9.7008 1.3111 -4.4203 {"}'M' greentint -9.8325 1.4128 -4.6184 {"}'M' greentint -9.9935 1.3847 -4.8184 {"}'M' greentint -10.1416 1.2328 -4.9673 {"}'M' greentint -10.2081 1.0961 -5.2782 {"}'M' greentint -9.6441 1.5827 -4.6851 {"}'M' greentint -9.803 1.5858 -4.891 {"}'M' greentint -9.9632 1.4947 -5.0739 {"}'M' greentint -10.1047 1.3242 -5.2094 {"}'M' greentint -9.7086 1.6782 -5.1385 {"}'M' greentint -9.8652 1.5662 -5.3098 {"}'M' greentint -10.0038 1.3914 -5.4406 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 48 A}'M' green -10.1564 0.6836 -4.6486 {"}'M' green -9.8532 0.9556 -4.3321 {"}'M' green -9.5634 1.4579 -4.4147 {"}'M' green -10.2644 1.0221 -5.4578 {"}'M' green -9.5143 1.6959 -4.6754 {"}'M' green -10.1246 1.2567 -5.5323 {"}'M' green -9.665 1.7316 -5.1885 {"}'M' green -9.8054 1.6308 -5.3813 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 48 A}'M' greentint -9.9985 0.7939 -4.4751 {"}'M' greentint -10.2446 0.7633 -5.1018 {"}'M' greentint -10.0854 0.7858 -4.9013 {"}'M' greentint -9.9257 0.8743 -4.7203 {"}'M' greentint -9.779 1.0239 -4.5727 {"}'M' greentint -9.6553 1.2237 -4.468 {"}'M' greentint -10.126 0.9453 -5.2563 {"}'M' greentint -9.9672 0.9563 -5.0554 {"}'M' greentint -9.8101 1.0522 -4.8781 {"}'M' greentint -9.6717 1.2227 -4.7465 {"}'M' greentint -9.5687 1.4462 -4.6757 {"}'M' greentint -9.9917 1.1531 -5.3321 {"}'M' greentint -9.8285 1.1823 -5.1294 {"}'M' greentint -9.6788 1.3361 -4.9786 {"}'M' greentint -9.5835 1.5724 -4.9211 {"}'M' greentint -9.879 1.3829 -5.3673 {"}'M' 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-10.9852 0.56 -8.2908 {"}'S' blue -11.1371 0.5872 -8.4944 {"}'S' blue -11.2948 0.5741 -8.6949 {"}'S' blue -11.4556 0.5215 -8.8873 {"}'S' sky -10.95 0.6218 -8.6754 {"}'S' sky -11.1115 0.6043 -8.8803 {"}'S' sky -11.2754 0.5476 -9.076 {"}'S' blue -11.4366 0.4539 -9.2578 {"}'S' blue -10.6141 0.6018 -8.6647 {"}'S' sky -10.771 0.6162 -8.8722 {"}'S' sky -11.0968 0.5312 -9.269 {"}'S' blue -11.2576 0.4328 -9.4492 {"}'S' blue -10.4049 0.5557 -8.8159 {"}'S' sky -10.5625 0.573 -9.0233 {"}'S' sky -10.7243 0.55 -9.2272 {"}'S' sky -10.8874 0.4893 -9.421 {"}'S' blue -11.0486 0.3928 -9.6022 {"}'S' blue -10.1916 0.4693 -8.9438 {"}'S' blue -10.3474 0.4907 -9.1515 {"}'S' sky -10.5091 0.4719 -9.3561 {"}'S' blue -10.6725 0.4146 -9.5511 { CE2 TYR 89 A}'S' sky -11.8481 0.3702 -6.3202 {"}'S' sky -12.3302 0.3191 -6.9281 {"}'S' sky -11.5198 0.3203 -6.3095 {"}'S' sky -11.311 0.2734 -6.4611 {"}'S' blue -11.0987 0.1812 -6.5891 {"}'S' sky -11.0384 0.1151 -6.9069 { CZ TYR 89 A}'S' blue -12.6632 0.3233 -7.4184 {"}'S' sky -12.5624 0.4301 -7.6759 {"}'S' blue -12.7228 0.3939 -7.8731 {"}'S' sky -12.4375 0.4923 -7.9226 {"}'S' blue -12.5983 0.4397 -8.115 {"}'S' sky -12.2543 0.5225 -8.108 {"}'S' blue -12.4182 0.4658 -8.3037 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 89 A}'S' sea -10.9804 0.3663 -7.8402 {"}'S' sea -11.1158 0.4566 -8.0391 {"}'S' sea -11.2638 0.5064 -8.244 {"}'S' sea -10.9332 0.5927 -9.0747 { CE2 TYR 89 A}'S' sea -12.0047 0.3932 -6.5275 {"}'S' sea -12.1663 0.3758 -6.7324 {"}'S' sea -11.6689 0.3733 -6.5168 {"}'S' green -11.8258 0.3876 -6.7243 {"}'S' green -11.9879 0.3641 -6.9269 {"}'S' green -11.4596 0.3272 -6.668 {"}'S' green -11.6173 0.3444 -6.8755 {"}'S' green -11.779 0.3214 -7.0793 {"}'S' sea -11.2463 0.2407 -6.7959 {"}'S' green -11.4022 0.2622 -7.0036 {"}'S' sea -11.1903 0.1437 -7.1107 { CZ TYR 89 A}'S' green -12.2586 0.3748 -7.2668 {"}'S' sea -12.4065 0.4246 -7.4718 {"}'S' green -12.2798 0.5054 -7.7221 {"}'S' green -12.0927 0.54 -7.9031 {"}'S' green -11.3475 0.2514 -7.2887 {"}'S' green -11.9138 0.5344 -8.0999 {"}'S' sea -11.1396 0.2029 -7.4412 {"}'S' green -11.2619 0.3292 -7.6337 {"}'S' green -11.399 0.4201 -7.8367 {"}'S' green -11.5476 0.4739 -8.0436 {"}'S' sea -11.7053 0.4912 -8.251 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 89 A}'S' P -11.9855 0.4123 -7.3156 {"}'S' -11.9865 0.3975 -7.3222 {"}'S' P -12.1279 0.4782 -7.5185 {"}'S' -12.128 0.4755 -7.518 {"}'S' P -11.6549 0.3578 -7.2871 {"}'S' -11.6604 0.3336 -7.2977 {"}'S' P -11.7893 0.4562 -7.4881 {"}'S' -11.7971 0.4031 -7.5037 {"}'S' P -11.9361 0.517 -7.6958 {"}'S' -11.9373 0.4845 -7.7002 {"}'S' P -11.4699 0.376 -7.4826 {"}'S' -11.479 0.3519 -7.4896 {"}'S' P -11.6078 0.467 -7.6851 {"}'S' -11.6179 0.4249 -7.6927 {"}'S' P -11.7569 0.52 -7.8924 {"}'S' -11.7581 0.5084 -7.8931 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 105 A}'S' blue -12.7519 0.7786 -7.5103 {"}'S' blue -12.6028 0.7256 -7.303 {"}'S' blue -12.4451 0.7111 -7.0961 {"}'S' blue -12.6897 0.8284 -7.8776 {"}'S' sky -12.5523 0.7366 -7.6755 {"}'S' sky -12.4315 0.7865 -7.961 {"}'S' blue -12.3021 0.895 -8.2395 {"}'S' sky -12.1737 0.7914 -8.0439 { CD2 TYR 105 A}'S' blue -11.3792 0.9 -9.0864 {"}'S' sky -11.2163 0.9367 -8.8857 {"}'S' blue -11.0527 1.0124 -8.6965 {"}'S' blue -11.3922 0.8294 -9.5118 {"}'S' sky -11.2345 0.815 -9.3049 {"}'S' sky -11.0723 0.8384 -9.1023 {"}'S' sky -10.9095 0.9 -8.9075 {"}'S' blue -10.7491 0.9977 -8.7276 {"}'S' blue -11.1929 0.7866 -9.6774 {"}'S' sky -11.0357 0.7703 -9.469 {"}'S' sky -10.7112 0.8532 -9.0718 {"}'S' blue -10.55 0.9497 -8.8906 {"}'S' blue -10.9264 0.7711 -9.7573 {"}'S' sky -10.767 0.7704 -9.5495 {"}'S' sky -10.6032 0.8084 -9.3497 {"}'S' sky -10.4404 0.8842 -9.1599 {"}'S' blue -10.512 0.8124 -9.6463 {"}'S' blue -10.3516 0.8628 -9.454 { HB2 TYR 105 A}'S' sky -12.2281 0.6914 -6.7095 {"}'S' blue -12.0656 0.7405 -6.5123 {"}'S' sky -11.4459 0.6415 -6.4613 {"}'S' blue -11.0394 0.5538 -6.776 {"}'S' sky -11.0275 0.4404 -7.1388 {"}'S' blue -10.9279 0.4953 -7.3929 {"}'S' sky -11.2473 0.8311 -8.2068 {"}'S' sky -10.8512 0.6141 -7.633 {"}'S' blue -10.9898 0.9012 -8.1238 {"}'S' sky -10.8564 0.7985 -7.9232 { HD2 TYR 105 A}'S' blue -10.3841 0.9782 -8.8019 {"}'S' blue -10.2481 0.8936 -9.0308 {"}'S' blue -10.0915 0.9311 -8.8389 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 105 A}'S' sea -10.8736 0.7924 -9.2662 { HB2 TYR 105 A}'S' sea -12.2821 0.5597 -7.1104 {"}'S' sea -12.1349 0.5167 -6.9079 {"}'S' green -11.9775 0.5346 -6.7088 {"}'S' sea -11.8193 0.6114 -6.5256 {"}'S' green -12.3177 0.6274 -7.5847 {"}'S' green -12.2023 0.4958 -7.3987 {"}'S' green -12.065 0.4143 -7.1992 {"}'S' green -11.913 0.3885 -6.9959 {"}'S' green -11.7537 0.419 -6.7986 {"}'S' green -11.5952 0.5055 -6.6172 {"}'S' green -12.1501 0.5952 -7.7908 {"}'S' green -11.6078 0.3305 -7.0165 {"}'S' green -11.4491 0.395 -6.8298 {"}'S' sea -11.2962 0.511 -6.6643 {"}'S' sea -11.9997 0.716 -8.0622 {"}'S' green -11.912 0.5399 -7.8988 {"}'S' green -11.3475 0.3322 -7.1123 {"}'S' sea -11.1895 0.418 -6.9313 {"}'S' green -11.7217 0.6432 -8.0928 {"}'S' green -11.3434 0.3466 -7.5201 {"}'S' green -11.1852 0.3643 -7.3216 {"}'S' green -11.3818 0.5655 -7.9985 {"}'S' green -11.2469 0.4706 -7.7976 {"}'S' sea -11.0911 0.4464 -7.5894 {"}'S' sea -11.1447 0.6783 -8.0317 {"}'S' sea -11.0076 0.6033 -7.8323 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 105 A}'S' P -12.0413 0.4545 -7.6117 {"}'S' -12.0319 0.4749 -7.6052 {"}'S' P -11.9106 0.3602 -7.4167 {"}'S' -11.899 0.399 -7.4114 {"}'S' P -11.7633 0.3185 -7.2144 {"}'S' -11.7617 0.3306 -7.2149 {"}'S' P -11.7958 0.4081 -7.7134 {"}'S' -11.7867 0.4516 -7.6953 {"}'S' P -11.6593 0.3267 -7.5133 {"}'S' -11.6553 0.3783 -7.5025 {"}'S' P -11.5069 0.3018 -7.3096 {"}'S' -11.5074 0.3119 -7.3091 {"}'S' P -11.6191 0.4904 -7.9178 {"}'S' -11.619 0.4921 -7.9163 {"}'S' P -11.4906 0.3896 -7.7226 {"}'S' -11.4922 0.4114 -7.7143 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 89 A}'M' greentint -9.2388 2.3631 -5.9651 {"}'M' greentint -9.3977 2.2744 -6.1467 {"}'M' greentint -9.5413 2.1666 -6.4192 {"}'M' greentint -9.0014 2.4958 -5.8128 {"}'M' greentint -9.1357 2.5956 -6.0141 {"}'M' greentint -9.299 2.5622 -6.2159 {"}'M' greentint -9.4476 2.4053 -6.3644 {"}'M' greentint -9.5513 2.309 -6.6619 {"}'M' greentint -8.854 2.7215 -5.8764 {"}'M' greentint -8.9918 2.8008 -6.0761 {"}'M' greentint -9.1498 2.7924 -6.2781 {"}'M' greentint -9.3084 2.6992 -6.4565 {"}'M' greentint -9.4476 2.5313 -6.5897 {"}'M' greentint -9.5209 2.403 -6.9067 {"}'M' greentint -8.8066 2.9709 -6.1421 {"}'M' greentint -8.9628 2.9815 -6.3459 {"}'M' greentint -9.123 2.9233 -6.5379 {"}'M' greentint -9.2778 2.8002 -6.7026 {"}'M' greentint -9.4135 2.6227 -6.8288 {"}'M' greentint -9.443 2.4832 -7.1449 {"}'M' greentint -8.7195 3.1249 -6.388 {"}'M' greentint -8.8796 3.1009 -6.5893 {"}'M' greentint -9.0421 3.0193 -6.7757 {"}'M' greentint -9.1944 2.8834 -6.9357 {"}'M' greentint -9.331 2.7018 -7.0605 {"}'M' greentint -8.7852 3.1643 -6.849 {"}'M' greentint -8.941 3.0656 -7.0223 {"}'M' greentint -9.0872 2.922 -7.1722 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 105 A}'M' greentint -9.582 2.065 -6.5405 {"}'M' greentint -9.4277 2.0643 -6.3414 {"}'M' greentint -9.2695 2.128 -6.1551 {"}'M' greentint -9.1193 2.2524 -5.9953 {"}'M' greentint -8.9862 2.428 -5.8722 {"}'M' greentint -9.5185 2.1963 -6.8955 {"}'M' greentint -9.3771 2.1233 -6.6924 {"}'M' greentint -9.219 2.1255 -6.4887 {"}'M' greentint -9.0583 2.2015 -6.3018 {"}'M' greentint -8.9088 2.3468 -6.1494 {"}'M' greentint -8.7842 2.5468 -6.0436 {"}'M' greentint -8.6956 2.7844 -5.9956 {"}'M' greentint -9.3901 2.423 -7.1357 {"}'M' greentint -9.274 2.2859 -6.9475 {"}'M' greentint -9.1253 2.2363 -6.7414 {"}'M' greentint -8.9629 2.2812 -6.5434 {"}'M' greentint -8.8087 2.4138 -6.3817 {"}'M' greentint -8.6845 2.6172 -6.2771 {"}'M' greentint -8.6062 2.8628 -6.245 {"}'M' greentint -8.5852 3.1183 -6.2883 {"}'M' greentint -9.2127 2.7268 -7.253 {"}'M' greentint -9.146 2.5215 -7.11 {"}'M' greentint -9.0143 2.4198 -6.9118 {"}'M' greentint -8.8533 2.4478 -6.7118 {"}'M' greentint -8.7052 2.5998 -6.563 {"}'M' greentint -8.6104 2.8339 -6.5056 {"}'M' greentint -8.5941 3.0876 -6.555 {"}'M' greentint -8.985 2.7928 -7.1432 {"}'M' greentint -8.8808 2.6376 -6.9653 {"}'M' greentint -8.7208 2.7345 -6.7859 {"}'M' greentint -8.6658 2.9878 -6.7857 {"}'M' greentint -8.77 3.143 -6.9635 {"}'M' greentint -8.7991 2.8842 -6.9852 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 89 A}'M' greentint -9.9343 1.1824 -4.1462 {"}'M' greentint -10.0676 1.0787 -4.3457 {"}'M' greentint -9.8527 1.4289 -4.166 {"}'M' greentint -10.0126 1.332 -4.3455 {"}'M' greentint -10.123 1.2326 -4.6257 {"}'M' greentint -10.1393 0.9789 -4.5764 {"}'M' greentint -9.7192 1.6468 -4.2196 {"}'M' greentint -9.8802 1.6187 -4.4196 {"}'M' greentint -10.0282 1.4668 -4.5684 {"}'M' greentint -10.0947 1.3301 -4.8793 {"}'M' greentint -10.1451 1.0754 -4.8747 {"}'M' greentint -9.5307 1.8166 -4.2862 {"}'M' greentint -9.6896 1.8198 -4.4921 {"}'M' greentint -9.8499 1.7287 -4.675 {"}'M' greentint -9.9913 1.5582 -4.8105 {"}'M' greentint -9.9979 1.4044 -5.1194 {"}'M' greentint -10.0662 1.1554 -5.137 {"}'M' greentint -9.5952 1.9122 -4.7396 {"}'M' greentint -9.7518 1.8001 -4.911 {"}'M' greentint -9.8904 1.6254 -5.0417 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 105 A}'M' green -10.1408 0.8616 -4.5996 {"}'M' green -9.4959 1.8867 -4.3674 {"}'M' green -9.9761 1.3311 -5.2831 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 105 A}'M' greentint -9.983 0.9718 -4.4261 {"}'M' greentint -9.8376 1.1336 -4.2831 {"}'M' greentint -9.713 1.336 -4.1796 {"}'M' greentint -9.6166 1.5691 -4.1197 {"}'M' greentint -10.0699 0.9637 -4.8523 {"}'M' greentint -9.9102 1.0523 -4.6713 {"}'M' greentint -9.7635 1.2019 -4.5238 {"}'M' greentint -9.6397 1.4017 -4.4191 {"}'M' greentint -9.5479 1.6358 -4.3658 {"}'M' greentint -9.9516 1.1342 -5.0064 {"}'M' greentint -9.7946 1.2301 -4.8291 {"}'M' greentint -9.6561 1.4007 -4.6976 {"}'M' greentint -9.5532 1.6242 -4.6267 {"}'M' greentint -9.4988 1.8739 -4.6264 {"}'M' greentint -9.813 1.3603 -5.0805 {"}'M' greentint -9.6632 1.514 -4.9296 {"}'M' greentint -9.5679 1.7503 -4.8721 {"}'M' greentint -9.7048 1.6582 -5.1407 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n glu A 275 2exrA_277F_315}P -12.1639 -1.7648 0.9588 {"}-12.1639 -1.7648 0.9588 { ca glu A 275 2exrA_277F_315}-10.9667 -2.0009 0.166 { c glu A 275 2exrA_277F_315}-10.7804 -0.8576 -0.804 { o glu A 275 2exrA_277F_315}-11.5813 0.0964 -0.869 { c glu A 275 2exrA_277F_315}P -10.7804 -0.8576 -0.804 { n gly A 276 2exrA_277F_315}-9.6878 -0.9243 -1.5546 { ca gly A 276 2exrA_277F_315}-9.4545 0.0754 -2.5918 { c gly A 276 2exrA_277F_315}-8.5724 -0.505 -3.6631 { o gly A 276 2exrA_277F_315}-7.8848 -1.5036 -3.4284 { c gly A 276 2exrA_277F_315}P -8.5724 -0.505 -3.6631 { n phe A 277 2exrA_277F_315}-8.5679 0.132 -4.826 { ca phe A 277 2exrA_277F_315}-7.6811 -0.3132 -5.9081 { c phe A 277 2exrA_277F_315}-7.3305 0.7984 -6.8498 { o phe A 277 2exrA_277F_315}-8.0354 1.7842 -6.9258 { c phe A 277 2exrA_277F_315}P -7.3305 0.7984 -6.8498 { n val A 278 2exrA_277F_315}-6.2215 0.6311 -7.5585 { ca val A 278 2exrA_277F_315}-5.7867 1.5956 -8.553 { c val A 278 2exrA_277F_315}-6.1776 1.0328 -9.9089 { o val A 278 2exrA_277F_315}-6.0396 -0.1753 -10.1401 { c val A 278 2exrA_277F_315}P -6.1776 1.0328 -9.9089 { n phe A 279 2exrA_277F_315}-6.6905 1.8838 -10.7837 { ca phe A 279 2exrA_277F_315}-6.943 1.4514 -12.1563 { c phe A 279 2exrA_277F_315}-6.4417 2.4662 -13.1792 { o phe A 279 2exrA_277F_315}-6.2785 3.6425 -12.8795 { n leu A 313 2exrA_277F_315}P -6.2867 6.1219 -11.6862 {"}-6.2867 6.1219 -11.6862 { ca leu A 313 2exrA_277F_315}-7.405 6.5952 -10.8791 { c leu A 313 2exrA_277F_315}-7.5877 5.6076 -9.7362 { o leu A 313 2exrA_277F_315}-6.9735 4.5324 -9.7126 { c leu A 313 2exrA_277F_315}P -7.5877 5.6076 -9.7362 { n tyr A 314 2exrA_277F_315}-8.3955 6.0011 -8.7513 { ca tyr A 314 2exrA_277F_315}-8.5086 5.2155 -7.5338 { c tyr A 314 2exrA_277F_315}-9.9715 4.8668 -7.3364 { o tyr A 314 2exrA_277F_315}-10.8579 5.6707 -7.6446 { c tyr A 314 2exrA_277F_315}P -9.9715 4.8668 -7.3364 { n cys A 315 2exrA_277F_315}-10.2024 3.6466 -6.8643 { ca cys A 315 2exrA_277F_315}-11.547 3.1835 -6.5371 { c cys A 315 2exrA_277F_315}-11.6274 2.7766 -5.0897 { o cys A 315 2exrA_277F_315}-10.8241 1.9834 -4.6001 { c cys A 315 2exrA_277F_315}P -11.6274 2.7766 -5.0897 { n leu A 316 2exrA_277F_315}-12.6187 3.3222 -4.3955 { ca leu A 316 2exrA_277F_315}-12.8972 2.9579 -3.008 { c leu A 316 2exrA_277F_315}-14.042 1.9694 -3.062 { o leu A 316 2exrA_277F_315}-15.088 2.2737 -3.6503 { c leu A 316 2exrA_277F_315}P -14.042 1.9694 -3.062 { n glu A 317 2exrA_277F_315}-13.8172 0.7876 -2.4883 { ca glu A 317 2exrA_277F_315}-14.7954 -0.2928 -2.5227 { c glu A 317 2exrA_277F_315}-15.348 -0.5841 -1.13 { o glu A 317 2exrA_277F_315}-14.5935 -0.8773 -0.1959 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n glu A 275 2exrA_277F_315}P -12.1639 -1.7648 0.9588 { ca glu A 275 2exrA_277F_315}P -10.9667 -2.0009 0.166 { n gly A 276 2exrA_277F_315}P -9.6878 -0.9243 -1.5546 { ca gly A 276 2exrA_277F_315}P -9.4545 0.0754 -2.5918 {"}P -9.4545 0.0754 -2.5918 { n phe A 277 2exrA_277F_315}P -8.5679 0.132 -4.826 { ca phe A 277 2exrA_277F_315}P -7.6811 -0.3132 -5.9081 { n val A 278 2exrA_277F_315}P -6.2215 0.6311 -7.5585 { ca val A 278 2exrA_277F_315}P -5.7867 1.5956 -8.553 { n phe A 279 2exrA_277F_315}P -6.6905 1.8838 -10.7837 { ca phe A 279 2exrA_277F_315}P -6.943 1.4514 -12.1563 { n leu A 313 2exrA_277F_315}P -6.2867 6.1219 -11.6862 { ca leu A 313 2exrA_277F_315}P -7.405 6.5952 -10.8791 { n tyr A 314 2exrA_277F_315}P -8.3955 6.0011 -8.7513 { ca tyr A 314 2exrA_277F_315}P -8.5086 5.2155 -7.5338 { n cys A 315 2exrA_277F_315}P -10.2024 3.6466 -6.8643 { ca cys A 315 2exrA_277F_315}P -11.547 3.1835 -6.5371 { n leu A 316 2exrA_277F_315}P -12.6187 3.3222 -4.3955 { ca leu A 316 2exrA_277F_315}P -12.8972 2.9579 -3.008 { n glu A 317 2exrA_277F_315}P -13.8172 0.7876 -2.4883 { ca glu A 317 2exrA_277F_315}P -14.7954 -0.2928 -2.5227 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca glu A 275 2exrA_277F_315}P -10.9667 -2.0009 0.166 {"}-10.9667 -2.0009 0.166 { ca gly A 276 2exrA_277F_315}-9.4545 0.0754 -2.5918 { ca phe A 277 2exrA_277F_315}-7.6811 -0.3132 -5.9081 { ca val A 278 2exrA_277F_315}-5.7867 1.5956 -8.553 { ca phe A 279 2exrA_277F_315}-6.943 1.4514 -12.1563 { ca leu A 313 2exrA_277F_315}P -7.405 6.5952 -10.8791 {"}-7.405 6.5952 -10.8791 { ca tyr A 314 2exrA_277F_315}-8.5086 5.2155 -7.5338 { ca cys A 315 2exrA_277F_315}-11.547 3.1835 -6.5371 { ca leu A 316 2exrA_277F_315}-12.8972 2.9579 -3.008 { ca glu A 317 2exrA_277F_315}-14.7954 -0.2928 -2.5227 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 277 2exrA_277F_315}P -7.6811 -0.3132 -5.9081 { cb phe A 277 2exrA_277F_315}-8.2365 -1.5443 -6.6613 { cg phe A 277 2exrA_277F_315}-9.5433 -1.327 -7.3657 { cd1 phe A 277 2exrA_277F_315}-9.578 -0.895 -8.6977 { ce1 phe A 277 2exrA_277F_315}-10.8022 -0.7575 -9.3736 { cz phe A 277 2exrA_277F_315}-12.0034 -1.068 -8.7042 { cg phe A 277 2exrA_277F_315}P -9.5433 -1.327 -7.3657 { cd2 phe A 277 2exrA_277F_315}-10.7391 -1.6654 -6.7253 { ce2 phe A 277 2exrA_277F_315}-11.972 -1.5044 -7.3842 { cz phe A 277 2exrA_277F_315}ghost -12.0034 -1.068 -8.7042 { ca cys A 315 2exrA_277F_315}P -11.547 3.1835 -6.5371 { cb cys A 315 2exrA_277F_315}-11.917 1.9837 -7.4166 { sg cys A 315 2exrA_277F_315}-13.5945 1.3777 -7.0813 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 277 2exrA_277F_315}P -8.2365 -1.5443 -6.6613 {"}P -8.2365 -1.5443 -6.6613 { cd1 phe A 277 2exrA_277F_315}P -9.578 -0.895 -8.6977 { cd2 phe A 277 2exrA_277F_315}P -10.7391 -1.6654 -6.7253 { ce1 phe A 277 2exrA_277F_315}P -10.8022 -0.7575 -9.3736 { ce2 phe A 277 2exrA_277F_315}P -11.972 -1.5044 -7.3842 { cz phe A 277 2exrA_277F_315}P -12.0034 -1.068 -8.7042 { cb cys A 315 2exrA_277F_315}P -11.917 1.9837 -7.4166 {"}P -11.917 1.9837 -7.4166 { sg cys A 315 2exrA_277F_315}P -13.5945 1.3777 -7.0813 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 277 A}'S' sky -10.4154 0.0608 -6.7521 {"}'S' sky -10.181 0.204 -6.808 {"}'S' sky -10.0802 0.3109 -7.0654 {"}'S' sky -9.9553 0.373 -7.3122 { CD1 PHE 277 A}'S' sky -9.9228 0.5209 -7.7287 {"}'S' sky -10.0627 0.6019 -7.9316 {"}'S' sky -10.2157 0.6361 -8.14 {"}'S' sky -10.3768 0.6211 -8.343 { CD2 PHE 277 A}'S' sky -11.276 -0.0275 -6.425 {"}'S' sky -10.6497 0.0594 -6.4449 {"}'S' sky -10.4705 0.0624 -6.6415 { CE1 PHE 277 A}'S' sky -11.601 0.7586 -9.0189 {"}'S' sky -11.3391 0.8804 -9.0733 {"}'S' sky -10.6343 0.7597 -8.5181 {"}'S' sky -10.7622 0.8626 -8.713 {"}'S' sky -10.9047 0.9285 -8.9159 { HE2 PHE 277 A}'S' sky -13.7469 -1.1787 -6.9145 @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 277 A}'S' sea -10.3421 0.1891 -7.011 {"}'S' green -10.5049 0.1264 -7.2039 {"}'S' green -10.6635 0.0174 -7.3787 {"}'S' green -10.2406 0.2747 -7.2627 {"}'S' green -10.4013 0.1963 -7.4473 {"}'S' green -10.5564 0.0777 -7.6152 {"}'S' sea -10.1161 0.3205 -7.5046 { CD1 PHE 277 A}'S' sea -10.7722 -0.1105 -7.6877 {"}'S' green -10.6406 0.1102 -7.7376 {"}'S' green -10.3528 0.2445 -7.6194 {"}'S' green -10.4957 0.311 -7.8229 {"}'S' sea -10.1535 0.4048 -7.6775 {"}'S' green -10.2958 0.4752 -7.8794 {"}'S' green -10.4501 0.4929 -8.0841 { CD2 PHE 277 A}'S' sea -10.9935 0.0478 -6.4712 {"}'S' green -11.1511 0.0346 -6.6717 {"}'S' green -10.8063 0.0823 -6.6523 {"}'S' green -10.9679 0.0649 -6.8571 {"}'S' green -11.1318 0.0082 -7.0528 {"}'S' green -10.6274 0.0767 -6.849 {"}'S' green -10.7895 0.0533 -7.0516 {"}'S' green -10.9532 -0.0082 -7.2458 {"}'S' green -10.7438 -0.0501 -7.3978 { CE1 PHE 277 A}'S' green -11.2562 0.4203 -8.1611 {"}'S' green -11.3777 0.5423 -8.3534 {"}'S' green -11.52 0.6127 -8.5553 {"}'S' sea -10.8095 -0.0607 -7.7689 {"}'S' green -10.8541 0.1664 -7.8885 {"}'S' green -11.0248 0.5321 -8.2121 {"}'S' green -11.1471 0.6584 -8.4046 {"}'S' green -11.2869 0.7393 -8.6075 {"}'S' sea -11.4399 0.7735 -8.8158 {"}'S' green -10.6847 0.4418 -8.1043 {"}'S' green -10.7824 0.6057 -8.2769 {"}'S' sea -10.8999 0.7348 -8.4653 {"}'S' sea -11.0353 0.825 -8.6642 {"}'S' sea -11.1832 0.8748 -8.8692 {"}'S' sea -10.5216 0.6219 -8.3343 { CE2 PHE 277 A}'S' green -12.8897 -0.2984 -6.5095 {"}'S' green -12.6898 -0.1342 -6.566 {"}'S' green -12.4567 -0.0075 -6.6181 {"}'S' green -12.2051 0.0782 -6.6748 {"}'S' sea -11.932 0.1158 -6.7237 {"}'S' green -12.0744 0.1817 -6.9266 {"}'S' green -12.2263 0.2088 -7.1301 {"}'S' green -11.6014 0.0612 -6.6952 {"}'S' green -11.7358 0.1596 -6.8961 {"}'S' green -11.8826 0.2204 -7.1038 {"}'S' green -12.2008 0.226 -7.5161 {"}'S' sea -10.9318 -0.1015 -7.4892 { CZ PHE 277 A}'S' green -13.5355 -0.3405 -8.2728 {"}'S' green -13.1953 0.1914 -8.4694 {"}'S' green -12.226 0.2217 -7.5427 {"}'S' green -12.965 0.3855 -8.5423 {"}'S' green -12.5403 0.57 -8.4039 {"}'S' sea -12.7007 0.5338 -8.6012 {"}'S' green -12.4154 0.6321 -8.6506 {"}'S' green -12.0706 0.6798 -8.6311 {"}'S' sea -12.2322 0.6623 -8.836 {"}'S' green -11.1344 0.0491 -7.6758 {"}'S' green -11.7348 0.6599 -8.6204 {"}'S' sea -11.8917 0.6742 -8.8279 { HE2 PHE 277 A}'S' sea -13.4452 -0.9171 -6.5961 {"}'S' sea -13.6055 -1.0082 -6.779 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 277 A}'S' P -10.9259 0.3664 -8.0375 {"}'S' -10.9257 0.3635 -8.0416 { CE2 PHE 277 A}'S' P -12.8441 -0.1165 -6.7706 {"}'S' -12.82 -0.1559 -6.7886 {"}'S' P -12.6097 0.0267 -6.8265 {"}'S' -12.59 -0.021 -6.8434 {"}'S' P -12.7708 0.0118 -7.0295 {"}'S' -12.7243 -0.0769 -7.05 {"}'S' P -12.353 0.128 -6.8798 {"}'S' -12.3502 0.1157 -6.8835 {"}'S' P -12.5089 0.1336 -7.0839 {"}'S' -12.4861 0.0643 -7.0968 {"}'S' P -12.6693 0.0974 -7.2812 {"}'S' -12.628 0.0023 -7.2868 {"}'S' P -12.83 0.019 -7.4658 {"}'S' -12.7825 -0.0659 -7.4618 {"}'S' P -12.384 0.1957 -7.3307 {"}'S' -12.3737 0.1512 -7.332 {"}'S' P -12.5448 0.1432 -7.5231 {"}'S' -12.5245 0.0873 -7.5185 {"}'S' P -12.0392 0.2434 -7.3112 {"}'S' -12.0384 0.2419 -7.3115 {"}'S' P -11.4164 0.0794 -6.8907 {"}'S' -11.4164 0.0794 -6.8907 {"}'S' P -11.5543 0.1705 -7.0931 {"}'S' -11.5654 0.1239 -7.1011 {"}'S' P -11.7034 0.2235 -7.3005 {"}'S' -11.7103 0.1765 -7.3026 {"}'S' P -11.8603 0.2378 -7.5079 {"}'S' -11.8603 0.2378 -7.5079 {"}'S' P -11.2084 0.0327 -7.0418 {"}'S' -11.2114 0.0275 -7.043 {"}'S' P -11.3455 0.1236 -7.2448 {"}'S' -11.3657 0.0723 -7.2487 {"}'S' P -11.4941 0.1774 -7.4517 {"}'S' -11.5101 0.1243 -7.4495 {"}'S' P -11.1332 0.0314 -7.3727 {"}'S' -11.138 0.0223 -7.3721 {"}'S' P -11.2808 0.0909 -7.5796 {"}'S' -11.2875 0.0748 -7.5781 { CZ PHE 277 A}'S' P -12.7783 0.0715 -7.6259 {"}'S' -12.7411 0.0175 -7.6773 {"}'S' P -12.9211 0.138 -7.8294 {"}'S' -12.8681 0.068 -7.8795 {"}'S' P -13.0788 0.1379 -8.033 {"}'S' -13.0314 0.085 -8.062 {"}'S' P -13.2396 0.0737 -8.2227 {"}'S' -13.2289 0.0633 -8.2263 {"}'S' P -12.5789 0.2318 -7.684 {"}'S' -12.5536 0.1745 -7.7285 {"}'S' P -12.7212 0.3022 -7.8859 {"}'S' -12.6802 0.2254 -7.932 {"}'S' P -12.8755 0.3199 -8.0906 {"}'S' -12.8331 0.2517 -8.1213 {"}'S' P -13.0368 0.2821 -8.2887 {"}'S' -13.0134 0.2523 -8.2979 {"}'S' P -12.3483 0.348 -7.7352 {"}'S' -12.3428 0.3249 -7.7498 {"}'S' P -12.4881 0.4289 -7.9381 {"}'S' -12.4726 0.3828 -7.9627 {"}'S' P -12.6411 0.4631 -8.1464 {"}'S' -12.6226 0.4179 -8.162 {"}'S' P -12.8022 0.4481 -8.3495 {"}'S' -12.793 0.4313 -8.3536 {"}'S' P -11.9836 0.2953 -7.6075 {"}'S' -11.9841 0.2759 -7.6227 {"}'S' P -12.1011 0.4244 -7.7959 {"}'S' -12.0977 0.3665 -7.831 {"}'S' P -12.2365 0.5146 -7.9948 {"}'S' -12.2266 0.452 -8.0233 {"}'S' P -12.3844 0.5644 -8.1998 {"}'S' -12.3774 0.5351 -8.2091 {"}'S' 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-12.2095 -1.3303 -7.3949 {"}'S' green -12.2673 -1.4236 -7.8747 {"}'S' green -12.1079 -1.3931 -7.6775 {"}'S' green -11.9499 -1.3073 -7.4965 {"}'S' sea -12.1038 -1.3787 -8.0852 {"}'S' green -11.9456 -1.361 -7.8868 {"}'S' green -11.7879 -1.285 -7.7039 {"}'S' sea -11.8516 -1.2789 -8.1546 {"}'S' green -11.6883 -1.23 -7.958 {HG23 ILE 439 A}'S' sea -11.5893 -1.0536 -6.2533 {"}'S' sea -11.4299 -1.0231 -6.056 {"}'S' sea -11.2676 -0.991 -6.2653 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG2 ILE 439 A}'S' P -11.7527 -1.2686 -7.4289 {"}'S' -11.7528 -1.2604 -7.4275 {"}'S' P -11.5933 -1.2693 -7.2211 {"}'S' -11.5949 -1.2449 -7.2221 {"}'S' P -11.4295 -1.2313 -7.0213 {"}'S' -11.4302 -1.2283 -7.0212 {"}'S' P -11.4959 -1.239 -7.5187 {"}'S' -11.5 -1.2167 -7.5157 {"}'S' P -11.3383 -1.2272 -7.3179 {"}'S' -11.3447 -1.201 -7.3173 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 415 A}'M' green -8.9602 2.1817 -6.5477 {"}'M' green -9.2245 1.6824 -7.6888 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 415 A}'M' greentint -9.3517 1.5559 -6.6888 {"}'M' greentint -9.1094 1.9516 -6.4856 {"}'M' greentint -9.258 1.7947 -6.6341 {"}'M' greentint -9.3617 1.6983 -6.9315 {"}'M' greentint -9.4183 1.4488 -6.9348 {"}'M' greentint -9.1188 2.0886 -6.7261 {"}'M' greentint -9.258 1.9206 -6.8593 {"}'M' greentint -9.3313 1.7923 -7.1763 {"}'M' greentint -9.4025 1.5472 -7.2005 {"}'M' greentint -8.9334 2.3126 -6.8076 {"}'M' greentint -9.0882 2.1895 -6.9722 {"}'M' greentint -9.2239 2.012 -7.0984 {"}'M' greentint -9.2535 1.8725 -7.4146 {"}'M' greentint -9.3347 1.6293 -7.453 {"}'M' greentint -8.8525 2.4086 -7.0453 {"}'M' greentint -9.0048 2.2727 -7.2053 {"}'M' greentint -9.1414 2.0911 -7.3301 {"}'M' greentint -9.139 1.9173 -7.6442 {"}'M' greentint -8.8976 2.3113 -7.4419 {"}'M' greentint -9.0284 2.1293 -7.5603 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ILE 439 A}'M' green -9.4328 1.3768 -7.227 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 439 A}'M' greentint -9.3332 1.5038 -6.7336 {"}'M' greentint -9.2 1.6794 -6.6105 {"}'M' greentint -9.0948 1.894 -6.5328 {"}'M' greentint -9.2722 1.4528 -7.0401 {"}'M' greentint -9.1226 1.5982 -6.8877 {"}'M' greentint -8.998 1.7981 -6.7819 {"}'M' greentint -8.9095 2.0357 -6.7339 {"}'M' greentint -8.865 2.2904 -6.7466 {"}'M' greentint -9.3391 1.4876 -7.4797 {"}'M' greentint -9.1768 1.5326 -7.2817 {"}'M' greentint -9.0226 1.6652 -7.12 {"}'M' greentint -8.8983 1.8685 -7.0154 {"}'M' greentint -8.82 2.1142 -6.9833 {"}'M' greentint -8.7991 2.3696 -7.0266 {"}'M' greentint -9.2281 1.6711 -7.6501 {"}'M' greentint -9.0671 1.6992 -7.4501 {"}'M' greentint -8.9191 1.8511 -7.3013 {"}'M' greentint -8.8243 2.0853 -7.2439 {"}'M' greentint -8.808 2.3389 -7.2933 {"}'M' greentint -9.0946 1.889 -7.7036 {"}'M' greentint -8.9347 1.9859 -7.5242 {"}'M' greentint -8.8797 2.2392 -7.524 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 415 A}'M' green -9.5381 0.9357 -4.2251 {"}'M' green -9.6714 0.8321 -4.4245 {"}'M' green -9.7431 0.7323 -4.6553 {"}'M' green -9.7489 0.8288 -4.9536 {"}'M' green -9.1345 1.57 -4.3651 {"}'M' green -9.6017 1.1577 -5.1982 {"}'M' green -9.6699 0.9087 -5.2159 {"}'M' green -9.199 1.6656 -4.8184 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 415 A}'M' greentint -9.4564 1.1823 -4.2449 {"}'M' greentint -9.6164 1.0854 -4.4243 {"}'M' greentint -9.7268 0.986 -4.7046 {"}'M' greentint -9.3229 1.4002 -4.2984 {"}'M' greentint -9.4839 1.3721 -4.4984 {"}'M' greentint -9.632 1.2201 -4.6473 {"}'M' greentint -9.6985 1.0835 -4.9582 {"}'M' greentint -9.2934 1.5732 -4.571 {"}'M' greentint -9.4537 1.4821 -4.7538 {"}'M' greentint -9.5951 1.3116 -4.8894 {"}'M' greentint -9.3556 1.5535 -4.9898 {"}'M' greentint -9.4942 1.3788 -5.1206 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 439 A}'M' green -9.8804 0.6801 -4.6175 {"}'M' green -9.7226 0.7903 -4.444 {"}'M' green -9.4526 1.1544 -4.1975 {"}'M' green -9.3562 1.3876 -4.1376 {"}'M' green -9.8095 0.7822 -4.8702 {"}'M' green -9.2355 1.7052 -4.3853 {"}'M' sea -9.85 0.9417 -5.2252 {"}'M' green -9.2384 1.6924 -4.6443 {"}'M' green -9.7157 1.1496 -5.301 {"}'M' sea -9.6031 1.3794 -5.3362 {"}'M' green -9.4444 1.4767 -5.1586 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 439 A}'M' greentint -9.5772 0.952 -4.3011 {"}'M' greentint -9.6498 0.8708 -4.6892 {"}'M' greentint -9.5031 1.0204 -4.5417 {"}'M' greentint -9.3793 1.2201 -4.437 {"}'M' greentint -9.2875 1.4543 -4.3837 {"}'M' greentint -9.6912 0.9527 -5.0243 {"}'M' greentint -9.5342 1.0486 -4.847 {"}'M' greentint -9.3957 1.2192 -4.7155 {"}'M' greentint -9.2928 1.4426 -4.6446 {"}'M' greentint -9.5526 1.1788 -5.0984 {"}'M' greentint -9.4028 1.3325 -4.9475 {"}'M' greentint -9.3075 1.5688 -4.89 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 69 2f1wA_71F_193V}P -12.2595 -2.1793 0.3195 {"}-12.2595 -2.1793 0.3195 { ca ala A 69 2f1wA_71F_193V}-10.9511 -2.2011 -0.3052 { c ala A 69 2f1wA_71F_193V}-10.7491 -0.9613 -1.158 { o ala A 69 2f1wA_71F_193V}-11.7083 -0.2696 -1.523 { c ala A 69 2f1wA_71F_193V}P -10.7491 -0.9613 -1.158 { n thr A 70 2f1wA_71F_193V}-9.4863 -0.6795 -1.4547 { ca thr A 70 2f1wA_71F_193V}-9.1187 0.4469 -2.2962 { c thr A 70 2f1wA_71F_193V}-8.2645 -0.1362 -3.4085 { o thr A 70 2f1wA_71F_193V}-7.3022 -0.8588 -3.1347 { c thr A 70 2f1wA_71F_193V}P -8.2645 -0.1362 -3.4085 { n phe A 71 2f1wA_71F_193V}-8.6171 0.1517 -4.6567 { ca phe A 71 2f1wA_71F_193V}-7.8342 -0.361 -5.7732 { c phe A 71 2f1wA_71F_193V}-7.6544 0.6778 -6.8668 { o phe A 71 2f1wA_71F_193V}-8.4679 1.5877 -7.0107 { c phe A 71 2f1wA_71F_193V}P -7.6544 0.6778 -6.8668 { n gln A 72 2f1wA_71F_193V}-6.5559 0.5619 -7.6101 { ca gln A 72 2f1wA_71F_193V}-6.262 1.5113 -8.6759 { c gln A 72 2f1wA_71F_193V}-6.1901 0.8379 -10.0353 { o gln A 72 2f1wA_71F_193V}-5.96 -0.3634 -10.1405 { c gln A 72 2f1wA_71F_193V}P -6.1901 0.8379 -10.0353 { n phe A 73 2f1wA_71F_193V}-6.3664 1.6457 -11.0725 { ca phe A 73 2f1wA_71F_193V}-6.3283 1.1828 -12.4476 { c phe A 73 2f1wA_71F_193V}-5.6692 2.2852 -13.2646 { o phe A 73 2f1wA_71F_193V}-6.1926 3.399 -13.3627 { n phe A 191 2f1wA_71F_193V}P -6.83 5.8161 -12.0394 {"}-6.83 5.8161 -12.0394 { ca phe A 191 2f1wA_71F_193V}-8.1402 5.8927 -11.4109 { c phe A 191 2f1wA_71F_193V}-8.1048 5.058 -10.1449 { o phe A 191 2f1wA_71F_193V}-7.4362 4.0259 -10.0909 { c phe A 191 2f1wA_71F_193V}P -8.1048 5.058 -10.1449 { n glu A 192 2f1wA_71F_193V}-8.8255 5.5047 -9.1283 { ca glu A 192 2f1wA_71F_193V}-8.8575 4.7829 -7.8693 { c glu A 192 2f1wA_71F_193V}-10.2637 4.7207 -7.3042 { o glu A 192 2f1wA_71F_193V}-11.0459 5.6691 -7.4227 { c glu A 192 2f1wA_71F_193V}P -10.2637 4.7207 -7.3042 { n val A 193 2f1wA_71F_193V}-10.5874 3.5851 -6.6997 { ca val A 193 2f1wA_71F_193V}-11.8844 3.4124 -6.0816 { c val A 193 2f1wA_71F_193V}-11.7349 2.8096 -4.6991 { o val A 193 2f1wA_71F_193V}-10.9927 1.8473 -4.5039 { c val A 193 2f1wA_71F_193V}P -11.7349 2.8096 -4.6991 { n phe A 194 2f1wA_71F_193V}-12.4067 3.4257 -3.7345 { ca phe A 194 2f1wA_71F_193V}-12.4592 2.9002 -2.3807 { c phe A 194 2f1wA_71F_193V}-13.9071 2.4487 -2.3325 { o phe A 194 2f1wA_71F_193V}-14.8073 3.251 -2.5789 { c phe A 194 2f1wA_71F_193V}P -13.9071 2.4487 -2.3325 { n val A 195 2f1wA_71F_193V}-14.1424 1.1744 -2.0488 { ca val A 195 2f1wA_71F_193V}-15.5102 0.6835 -1.9948 { c val A 195 2f1wA_71F_193V}-15.7921 -0.0762 -0.7081 { o val A 195 2f1wA_71F_193V}-14.9557 -0.8387 -0.23 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 69 2f1wA_71F_193V}P -12.2595 -2.1793 0.3195 { ca ala A 69 2f1wA_71F_193V}P -10.9511 -2.2011 -0.3052 { n thr A 70 2f1wA_71F_193V}P -9.4863 -0.6795 -1.4547 { ca thr A 70 2f1wA_71F_193V}P -9.1187 0.4469 -2.2962 { n phe A 71 2f1wA_71F_193V}P -8.6171 0.1517 -4.6567 { ca phe A 71 2f1wA_71F_193V}P -7.8342 -0.361 -5.7732 { n gln A 72 2f1wA_71F_193V}P -6.5559 0.5619 -7.6101 { ca gln A 72 2f1wA_71F_193V}P -6.262 1.5113 -8.6759 { n phe A 73 2f1wA_71F_193V}P -6.3664 1.6457 -11.0725 { ca phe A 73 2f1wA_71F_193V}P -6.3283 1.1828 -12.4476 { n phe A 191 2f1wA_71F_193V}P -6.83 5.8161 -12.0394 { ca phe A 191 2f1wA_71F_193V}P -8.1402 5.8927 -11.4109 { n glu A 192 2f1wA_71F_193V}P -8.8255 5.5047 -9.1283 { ca glu A 192 2f1wA_71F_193V}P -8.8575 4.7829 -7.8693 { n val A 193 2f1wA_71F_193V}P -10.5874 3.5851 -6.6997 { ca val A 193 2f1wA_71F_193V}P -11.8844 3.4124 -6.0816 { n phe A 194 2f1wA_71F_193V}P -12.4067 3.4257 -3.7345 { ca phe A 194 2f1wA_71F_193V}P -12.4592 2.9002 -2.3807 { n val A 195 2f1wA_71F_193V}P -14.1424 1.1744 -2.0488 { ca val A 195 2f1wA_71F_193V}P -15.5102 0.6835 -1.9948 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 69 2f1wA_71F_193V}P -10.9511 -2.2011 -0.3052 {"}-10.9511 -2.2011 -0.3052 { ca thr A 70 2f1wA_71F_193V}-9.1187 0.4469 -2.2962 { ca phe A 71 2f1wA_71F_193V}-7.8342 -0.361 -5.7732 { ca gln A 72 2f1wA_71F_193V}-6.262 1.5113 -8.6759 { ca phe A 73 2f1wA_71F_193V}-6.3283 1.1828 -12.4476 { ca phe A 191 2f1wA_71F_193V}P -8.1402 5.8927 -11.4109 {"}-8.1402 5.8927 -11.4109 { ca glu A 192 2f1wA_71F_193V}-8.8575 4.7829 -7.8693 { ca val A 193 2f1wA_71F_193V}-11.8844 3.4124 -6.0816 { ca phe A 194 2f1wA_71F_193V}-12.4592 2.9002 -2.3807 { ca val A 195 2f1wA_71F_193V}-15.5102 0.6835 -1.9948 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 71 2f1wA_71F_193V}P -7.8342 -0.361 -5.7732 { cb phe A 71 2f1wA_71F_193V}-8.4423 -1.6707 -6.3173 { cg phe A 71 2f1wA_71F_193V}-9.7995 -1.5422 -6.9696 { cd1 phe A 71 2f1wA_71F_193V}-9.9219 -1.5761 -8.3578 { ce1 phe A 71 2f1wA_71F_193V}-11.1802 -1.5568 -8.9747 { cz phe A 71 2f1wA_71F_193V}-12.3308 -1.4504 -8.1946 { cg phe A 71 2f1wA_71F_193V}P -9.7995 -1.5422 -6.9696 { cd2 phe A 71 2f1wA_71F_193V}-10.9591 -1.4275 -6.2002 { ce2 phe A 71 2f1wA_71F_193V}-12.2223 -1.4052 -6.8057 { cz phe A 71 2f1wA_71F_193V}ghost -12.3308 -1.4504 -8.1946 { ca val A 193 2f1wA_71F_193V}P -11.8844 3.4124 -6.0816 { cb val A 193 2f1wA_71F_193V}-12.8095 2.4764 -6.9033 { cg1 val A 193 2f1wA_71F_193V}-14.0145 2.0421 -6.0554 { cb val A 193 2f1wA_71F_193V}P -12.8095 2.4764 -6.9033 { cg2 val A 193 2f1wA_71F_193V}-13.2934 3.1924 -8.1537 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 71 2f1wA_71F_193V}P -8.4423 -1.6707 -6.3173 {"}P -8.4423 -1.6707 -6.3173 { cd1 phe A 71 2f1wA_71F_193V}P -9.9219 -1.5761 -8.3578 { cd2 phe A 71 2f1wA_71F_193V}P -10.9591 -1.4275 -6.2002 { ce1 phe A 71 2f1wA_71F_193V}P -11.1802 -1.5568 -8.9747 { ce2 phe A 71 2f1wA_71F_193V}P -12.2223 -1.4052 -6.8057 { cz phe A 71 2f1wA_71F_193V}P -12.3308 -1.4504 -8.1946 { cb val A 193 2f1wA_71F_193V}P -12.8095 2.4764 -6.9033 { cg1 val A 193 2f1wA_71F_193V}P -14.0145 2.0421 -6.0554 {"}P -14.0145 2.0421 -6.0554 {"}P -14.0145 2.0421 -6.0554 { cg2 val A 193 2f1wA_71F_193V}P -13.2934 3.1924 -8.1537 {"}P -13.2934 3.1924 -8.1537 {"}P -13.2934 3.1924 -8.1537 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 71 A}'S' blue -13.0211 0.1109 -6.451 {"}'S' blue -13.1839 0.0483 -6.6439 {"}'S' blue -12.3248 0.2808 -6.3481 {"}'S' sky -12.4767 0.308 -6.5516 {"}'S' sky -12.7952 0.2423 -6.9446 {"}'S' sky -12.1329 0.3196 -6.5253 {"}'S' sky -12.7762 0.1747 -7.315 {"}'S' blue -11.8046 0.2696 -6.5147 {"}'S' sky -12.5972 0.1536 -7.5065 {"}'S' sky -11.7445 0.2765 -6.8732 {"}'S' sky -11.687 0.2115 -7.2088 {"}'S' sky -11.8486 0.1927 -7.4134 { CZ PHE 71 A}'S' blue -12.7119 0.182 -7.6902 {"}'S' sky -12.4333 0.2356 -7.737 {"}'S' blue -12.5852 0.2628 -7.9405 {"}'S' sky -12.0947 0.2136 -7.7066 {"}'S' sky -12.2415 0.2744 -7.9142 {"}'S' blue -12.3981 0.2973 -8.1216 {"}'S' blue -11.7752 0.1334 -7.7011 {"}'S' blue -11.9132 0.2244 -7.9035 {"}'S' blue -12.0622 0.2774 -8.1109 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 71 A}'S' sea -12.6343 0.2949 -6.7522 {"}'S' sea -12.2896 0.3426 -6.7327 {"}'S' green -12.4511 0.3251 -6.9376 {"}'S' sea -12.615 0.2684 -7.1333 {"}'S' sea -11.9537 0.3226 -6.722 {"}'S' green -12.1106 0.337 -6.9295 {"}'S' green -12.2728 0.3135 -7.132 {"}'S' sea -12.4364 0.252 -7.3262 {"}'S' sea -11.9021 0.2938 -7.0806 {"}'S' sea -12.0639 0.2708 -7.2845 {"}'S' sea -12.227 0.2101 -7.4783 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG1 VAL 193 A}'S' blue -13.3926 0.4181 -6.2497 {"}'S' blue -13.3014 0.5118 -6.5173 {"}'S' blue -13.1393 0.5498 -6.318 { HB VAL 193 A}'S' blue -12.8071 0.6304 -6.8239 {"}'S' blue -12.6497 0.6483 -6.6248 {"}'S' sky -12.7372 0.5281 -7.1151 {"}'S' sky -12.2674 0.6193 -6.5332 {"}'S' blue -12.7135 0.5683 -7.5277 {"}'S' sky -11.9684 0.6248 -6.5803 {"}'S' blue -12.5842 0.6536 -7.8148 {"}'S' sky -12.4681 0.5219 -7.6293 {"}'S' blue -11.7116 0.6676 -6.692 {"}'S' sky -12.2913 0.6041 -7.8338 {"}'S' sky -12.1628 0.5034 -7.6386 {"}'S' sky -11.6997 0.5541 -7.0548 {"}'S' blue -12.054 0.6792 -7.9145 {"}'S' blue -11.9191 0.5844 -7.7136 {"}'S' blue -11.7634 0.5601 -7.5054 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 193 A}'S' sea -12.5853 0.5023 -6.9118 {"}'S' sea -12.4259 0.5328 -6.7146 {"}'S' sea -12.5828 0.4739 -7.3327 {"}'S' green -12.4355 0.4322 -7.1304 {"}'S' green -12.28 0.4442 -6.9325 {"}'S' sea -12.1213 0.5087 -6.7458 {"}'S' sea -12.3315 0.4405 -7.4293 {"}'S' green -12.1791 0.4155 -7.2255 {"}'S' green -12.0197 0.446 -7.0283 {"}'S' sea -11.8617 0.5317 -6.8473 {"}'S' sea -12.0156 0.4603 -7.436 {"}'S' sea -11.8574 0.4781 -7.2376 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 71 A}'M' green -9.1833 2.7714 -7.2299 {"}'M' green -9.3294 2.6278 -7.3798 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 71 A}'M' greentint -9.4811 2.0689 -6.1727 {"}'M' greentint -9.64 1.9802 -6.3543 {"}'M' greentint -9.7836 1.8724 -6.6268 {"}'M' greentint -9.378 2.3014 -6.2217 {"}'M' greentint -9.5413 2.268 -6.4235 {"}'M' greentint -9.6899 2.1111 -6.572 {"}'M' greentint -9.7936 2.0148 -6.8695 {"}'M' greentint -9.2341 2.5066 -6.2837 {"}'M' greentint -9.3921 2.4982 -6.4857 {"}'M' greentint -9.5506 2.405 -6.6641 {"}'M' greentint -9.6899 2.2371 -6.7973 {"}'M' greentint -9.7632 2.1088 -7.1143 {"}'M' greentint -9.0489 2.6766 -6.3497 {"}'M' greentint -9.2051 2.6873 -6.5535 {"}'M' greentint -9.3653 2.6291 -6.7455 {"}'M' greentint -9.52 2.506 -6.9102 {"}'M' greentint -9.6558 2.3284 -7.0364 {"}'M' greentint -9.6853 2.189 -7.3525 {"}'M' greentint -9.1223 2.8073 -6.7976 {"}'M' greentint -9.2844 2.7251 -6.9833 {"}'M' greentint -9.4366 2.5892 -7.1433 {"}'M' greentint -9.5733 2.4076 -7.2681 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 193 A}'M' greentint -9.6729 1.8679 -6.401 {"}'M' greentint -9.5227 1.9924 -6.2412 {"}'M' greentint -9.7805 1.8632 -6.9383 {"}'M' greentint -9.6223 1.8654 -6.7346 {"}'M' greentint -9.4617 1.9414 -6.5477 {"}'M' greentint -9.3121 2.0868 -6.3953 {"}'M' greentint -9.1876 2.2867 -6.2895 {"}'M' greentint -9.099 2.5243 -6.2415 {"}'M' greentint -9.6774 2.0259 -7.1934 {"}'M' greentint -9.5286 1.9762 -6.9873 {"}'M' greentint -9.3663 2.0212 -6.7893 {"}'M' greentint -9.2121 2.1538 -6.6276 {"}'M' greentint -9.0878 2.3571 -6.523 {"}'M' greentint -9.0096 2.6028 -6.4909 {"}'M' greentint -9.5494 2.2615 -7.3559 {"}'M' greentint -9.4177 2.1597 -7.1577 {"}'M' greentint -9.2567 2.1878 -6.9577 {"}'M' greentint -9.1086 2.3397 -6.8089 {"}'M' greentint -9.0138 2.5739 -6.7515 {"}'M' greentint -8.9975 2.8275 -6.8009 {"}'M' greentint -9.3884 2.5327 -7.3891 {"}'M' greentint -9.2842 2.3776 -7.2112 {"}'M' greentint -9.1242 2.4745 -7.0318 {"}'M' greentint -9.0692 2.7278 -7.0316 {"}'M' greentint -9.2025 2.6241 -7.2311 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 71 A}'M' greentint -10.1849 0.8797 -4.3085 {"}'M' greentint -10.3181 0.776 -4.508 {"}'M' greentint -9.999 0.9711 -4.1505 {"}'M' greentint -10.1032 1.1262 -4.3283 {"}'M' greentint -10.2632 1.0293 -4.5078 {"}'M' greentint -10.3736 0.9299 -4.788 {"}'M' greentint -10.3899 0.6762 -4.7387 {"}'M' greentint -9.838 1.2423 -4.1837 {"}'M' greentint -9.9697 1.3441 -4.3819 {"}'M' greentint -10.1307 1.316 -4.5818 {"}'M' greentint -10.2788 1.1641 -4.7307 {"}'M' greentint -10.3453 1.0274 -5.0416 {"}'M' greentint -10.3957 0.7727 -5.037 {"}'M' greentint -9.7813 1.5139 -4.4485 {"}'M' greentint -9.9402 1.5171 -4.6544 {"}'M' greentint -10.1004 1.426 -4.8373 {"}'M' greentint -10.2419 1.2555 -4.9728 {"}'M' greentint -10.2484 1.1017 -5.2817 {"}'M' greentint -9.6844 1.6487 -4.704 {"}'M' greentint -9.8457 1.6095 -4.9019 {"}'M' greentint -10.0024 1.4974 -5.0733 {"}'M' greentint -10.1409 1.3227 -5.204 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 193 A}'M' green -10.4145 0.6095 -4.8101 {"}'M' green -9.6098 1.6775 -4.6428 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 193 A}'M' greentint -10.2519 0.6652 -4.616 {"}'M' greentint -10.094 0.7754 -4.4425 {"}'M' greentint -9.9487 0.9372 -4.2995 {"}'M' greentint -9.8241 1.1396 -4.1959 {"}'M' greentint -10.3401 0.7449 -5.0692 {"}'M' greentint -10.1809 0.7673 -4.8687 {"}'M' greentint -10.0212 0.8559 -4.6877 {"}'M' greentint -9.8745 1.0055 -4.5401 {"}'M' greentint -9.7508 1.2053 -4.4354 {"}'M' greentint -9.6589 1.4394 -4.3821 {"}'M' greentint -10.2215 0.9268 -5.2237 {"}'M' greentint -10.0627 0.9378 -5.0228 {"}'M' greentint -9.9056 1.0337 -4.8454 {"}'M' greentint -9.7672 1.2043 -4.7139 {"}'M' greentint -9.6642 1.4278 -4.6431 {"}'M' greentint -10.0872 1.1347 -5.2995 {"}'M' greentint -9.924 1.1639 -5.0968 {"}'M' greentint -9.7743 1.3176 -4.946 {"}'M' greentint -9.679 1.5539 -4.8885 {"}'M' greentint -9.9745 1.3645 -5.3347 {"}'M' greentint -9.8158 1.4618 -5.157 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n met A 150 2f2hA_230F_152}P -7.2139 5.8846 -12.2466 {"}-7.2139 5.8846 -12.2466 { ca met A 150 2f2hA_230F_152}-8.4963 6.0041 -11.5693 { c met A 150 2f2hA_230F_152}-8.5406 5.0593 -10.3802 { o met A 150 2f2hA_230F_152}-7.8986 4.0105 -10.4152 { c met A 150 2f2hA_230F_152}P -8.5406 5.0593 -10.3802 { n phe A 151 2f2hA_230F_152}-9.276 5.4344 -9.3333 { ca phe A 151 2f2hA_230F_152}-9.4011 4.6445 -8.1329 { c phe A 151 2f2hA_230F_152}-10.7529 4.7195 -7.4582 { o phe A 151 2f2hA_230F_152}-11.5286 5.6449 -7.6702 { c phe A 151 2f2hA_230F_152}P -10.7529 4.7195 -7.4582 { n glu A 152 2f2hA_230F_152}-10.9727 3.716 -6.6223 { ca glu A 152 2f2hA_230F_152}-12.1318 3.5789 -5.7639 { c glu A 152 2f2hA_230F_152}-11.7037 2.9385 -4.438 { o glu A 152 2f2hA_230F_152}-10.7584 2.178 -4.3788 { c glu A 152 2f2hA_230F_152}P -11.7037 2.9385 -4.438 { n arg A 153 2f2hA_230F_152}-12.4364 3.2501 -3.3915 { ca arg A 153 2f2hA_230F_152}-12.3575 2.5602 -2.0958 { c arg A 153 2f2hA_230F_152}-13.734 2.1866 -1.6123 { o arg A 153 2f2hA_230F_152}-14.5419 3.0538 -1.3252 { c arg A 153 2f2hA_230F_152}P -13.734 2.1866 -1.6123 { n leu A 154 2f2hA_230F_152}-14.0096 0.8919 -1.5722 { ca leu A 154 2f2hA_230F_152}-15.3131 0.3918 -1.107 { c leu A 154 2f2hA_230F_152}-15.1851 -0.0057 0.3687 { o leu A 154 2f2hA_230F_152}-14.2391 -0.7117 0.7667 { n val A 228 2f2hA_230F_152}P -11.4942 -1.4879 0.9531 {"}-11.4942 -1.4879 0.9531 { ca val A 228 2f2hA_230F_152}-10.7865 -2.0861 -0.1663 { c val A 228 2f2hA_230F_152}-10.6172 -1.0454 -1.2593 { o val A 228 2f2hA_230F_152}-11.6031 -0.6451 -1.9514 { c val A 228 2f2hA_230F_152}P -10.6172 -1.0454 -1.2593 { n gln A 229 2f2hA_230F_152}-9.3765 -0.5997 -1.3929 { ca gln A 229 2f2hA_230F_152}-8.9263 0.3385 -2.4135 { c gln A 229 2f2hA_230F_152}-8.4463 -0.4621 -3.5877 { o gln A 229 2f2hA_230F_152}-7.6932 -1.4549 -3.4083 { c gln A 229 2f2hA_230F_152}P -8.4463 -0.4621 -3.5877 { n phe A 230 2f2hA_230F_152}-8.8776 -0.0185 -4.7861 { ca phe A 230 2f2hA_230F_152}-8.294 -0.4887 -6.0547 { c phe A 230 2f2hA_230F_152}-8.0797 0.6496 -7.0469 { o phe A 230 2f2hA_230F_152}-8.8286 1.5884 -7.1005 { c phe A 230 2f2hA_230F_152}P -8.0797 0.6496 -7.0469 { n ser A 231 2f2hA_230F_152}-7.0202 0.5265 -7.823 { ca ser A 231 2f2hA_230F_152}-6.5683 1.5419 -8.77 { c ser A 231 2f2hA_230F_152}-5.9783 0.8828 -10.0057 { o ser A 231 2f2hA_230F_152}-5.4961 -0.2521 -9.9641 { c ser A 231 2f2hA_230F_152}P -5.9783 0.8828 -10.0057 { n val A 232 2f2hA_230F_152}-6.1341 1.5663 -11.13 { ca val A 232 2f2hA_230F_152}-5.6722 1.1072 -12.412 { c val A 232 2f2hA_230F_152}-5.1753 2.3351 -13.2333 { o val A 232 2f2hA_230F_152}-5.7141 3.4352 -13.098 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n met A 150 2f2hA_230F_152}P -7.2139 5.8846 -12.2466 { ca met A 150 2f2hA_230F_152}P -8.4963 6.0041 -11.5693 { n phe A 151 2f2hA_230F_152}P -9.276 5.4344 -9.3333 { ca phe A 151 2f2hA_230F_152}P -9.4011 4.6445 -8.1329 { n glu A 152 2f2hA_230F_152}P -10.9727 3.716 -6.6223 { ca glu A 152 2f2hA_230F_152}P -12.1318 3.5789 -5.7639 { n arg A 153 2f2hA_230F_152}P -12.4364 3.2501 -3.3915 { ca arg A 153 2f2hA_230F_152}P -12.3575 2.5602 -2.0958 { n leu A 154 2f2hA_230F_152}P -14.0096 0.8919 -1.5722 { ca leu A 154 2f2hA_230F_152}P -15.3131 0.3918 -1.107 { n val A 228 2f2hA_230F_152}P -11.4942 -1.4879 0.9531 { ca val A 228 2f2hA_230F_152}P -10.7865 -2.0861 -0.1663 { n gln A 229 2f2hA_230F_152}P -9.3765 -0.5997 -1.3929 { ca gln A 229 2f2hA_230F_152}P -8.9263 0.3385 -2.4135 { n phe A 230 2f2hA_230F_152}P -8.8776 -0.0185 -4.7861 { ca phe A 230 2f2hA_230F_152}P -8.294 -0.4887 -6.0547 { n ser A 231 2f2hA_230F_152}P -7.0202 0.5265 -7.823 { ca ser A 231 2f2hA_230F_152}P -6.5683 1.5419 -8.77 { n val A 232 2f2hA_230F_152}P -6.1341 1.5663 -11.13 { ca val A 232 2f2hA_230F_152}P -5.6722 1.1072 -12.412 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca met A 150 2f2hA_230F_152}P -8.4963 6.0041 -11.5693 {"}-8.4963 6.0041 -11.5693 { ca phe A 151 2f2hA_230F_152}-9.4011 4.6445 -8.1329 { ca glu A 152 2f2hA_230F_152}-12.1318 3.5789 -5.7639 { ca arg A 153 2f2hA_230F_152}-12.3575 2.5602 -2.0958 { ca leu A 154 2f2hA_230F_152}-15.3131 0.3918 -1.107 { ca val A 228 2f2hA_230F_152}P -10.7865 -2.0861 -0.1663 {"}-10.7865 -2.0861 -0.1663 { ca gln A 229 2f2hA_230F_152}-8.9263 0.3385 -2.4135 { ca phe A 230 2f2hA_230F_152}-8.294 -0.4887 -6.0547 { ca ser A 231 2f2hA_230F_152}-6.5683 1.5419 -8.77 { ca val A 232 2f2hA_230F_152}-5.6722 1.1072 -12.412 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca glu A 152 2f2hA_230F_152}P -12.1318 3.5789 -5.7639 { cb glu A 152 2f2hA_230F_152}-13.1409 2.6367 -6.4633 { cg glu A 152 2f2hA_230F_152}-14.4674 2.3885 -5.7504 { cd glu A 152 2f2hA_230F_152}-15.2197 3.6581 -5.4741 { oe1 glu A 152 2f2hA_230F_152}-14.9758 4.2828 -4.4118 { cd glu A 152 2f2hA_230F_152}P -15.2197 3.6581 -5.4741 { oe2 glu A 152 2f2hA_230F_152}-16.1254 4.0076 -6.2705 { ca phe A 230 2f2hA_230F_152}P -8.294 -0.4887 -6.0547 { cb phe A 230 2f2hA_230F_152}-9.0585 -1.6282 -6.6635 { cg phe A 230 2f2hA_230F_152}-10.5227 -1.442 -6.66 { cd1 phe A 230 2f2hA_230F_152}-11.1691 -0.9147 -7.7681 { ce1 phe A 230 2f2hA_230F_152}-12.5252 -0.7382 -7.777 { cz phe A 230 2f2hA_230F_152}-13.2819 -1.1452 -6.6848 { cg phe A 230 2f2hA_230F_152}P -10.5227 -1.442 -6.66 { cd2 phe A 230 2f2hA_230F_152}-11.263 -1.8436 -5.5945 { ce2 phe A 230 2f2hA_230F_152}-12.6506 -1.7083 -5.5977 { cz phe A 230 2f2hA_230F_152}ghost -13.2819 -1.1452 -6.6848 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb glu A 152 2f2hA_230F_152}P -13.1409 2.6367 -6.4633 {"}P -13.1409 2.6367 -6.4633 { cg glu A 152 2f2hA_230F_152}P -14.4674 2.3885 -5.7504 {"}P -14.4674 2.3885 -5.7504 { cb phe A 230 2f2hA_230F_152}P -9.0585 -1.6282 -6.6635 {"}P -9.0585 -1.6282 -6.6635 { cd1 phe A 230 2f2hA_230F_152}P -11.1691 -0.9147 -7.7681 { cd2 phe A 230 2f2hA_230F_152}P -11.263 -1.8436 -5.5945 { ce1 phe A 230 2f2hA_230F_152}P -12.5252 -0.7382 -7.777 { ce2 phe A 230 2f2hA_230F_152}P -12.6506 -1.7083 -5.5977 { cz phe A 230 2f2hA_230F_152}P -13.2819 -1.1452 -6.6848 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 230 A}'S' sky -11.6539 0.5822 -7.002 {"}'S' blue -11.5502 0.7177 -7.2637 { CZ PHE 230 A}'S' blue -14.154 0.2427 -6.0712 {"}'S' blue -13.7667 0.3517 -5.9187 {"}'S' blue -13.9197 0.3859 -6.1271 {"}'S' blue -14.0807 0.371 -6.3301 {"}'S' blue -14.2435 0.3083 -6.5229 {"}'S' blue -13.515 0.4374 -5.9754 {"}'S' blue -13.663 0.4872 -6.1804 {"}'S' blue -13.8189 0.4928 -6.3845 {"}'S' blue -13.9793 0.4566 -6.5818 {"}'S' sky -13.242 0.475 -6.0243 {"}'S' sky -13.5363 0.5681 -6.4307 {"}'S' sky -12.604 0.3141 -5.9974 {"}'S' sky -12.3961 0.2656 -6.1499 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 230 A}'S' green -13.2431 0.632 -6.9588 {"}'S' green -13.163 0.7928 -7.2193 {"}'S' green -12.4077 0.4611 -6.5077 {"}'S' green -13.0622 0.8997 -7.4767 {"}'S' green -12.1513 0.4722 -6.57 {"}'S' green -12.036 0.6937 -6.8969 {"}'S' green -12.5925 1.0095 -7.704 {"}'S' sea -11.8473 0.721 -7.0896 {"}'S' green -11.9697 0.8456 -7.2835 {"}'S' green -12.1076 0.9366 -7.4859 {"}'S' sea -12.2567 0.9896 -7.6933 { CZ PHE 230 A}'S' sea -13.3844 0.5409 -6.2271 {"}'S' sea -12.9114 0.4204 -5.9957 {"}'S' green -13.0457 0.5188 -6.1967 {"}'S' green -13.1925 0.5796 -6.4044 {"}'S' green -13.3492 0.6026 -6.6117 {"}'S' sea -13.5107 0.5852 -6.8166 {"}'S' green -12.7263 0.4387 -6.1913 {"}'S' green -12.8642 0.5297 -6.3937 {"}'S' green -13.1702 0.597 -6.8085 {"}'S' green -12.5183 0.3919 -6.3423 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 230 A}'S' P -12.7479 0.5514 -6.6156 {"}'S' -12.7448 0.5323 -6.6326 {"}'S' P -12.8701 0.6777 -6.8081 {"}'S' -12.8565 0.6211 -6.8466 {"}'S' P -13.01 0.7586 -7.0109 {"}'S' -12.9939 0.7079 -7.0371 {"}'S' P -12.5054 0.625 -6.6804 {"}'S' -12.5061 0.5793 -6.717 {"}'S' P -12.623 0.7541 -6.8688 {"}'S' -12.6168 0.6579 -6.9273 {"}'S' P -12.7584 0.8443 -7.0676 {"}'S' -12.7432 0.7415 -7.114 {"}'S' P -12.9063 0.8941 -7.2726 {"}'S' -12.8919 0.8349 -7.2907 {"}'S' P -12.2447 0.6412 -6.7378 {"}'S' -12.2487 0.6169 -6.7566 {"}'S' P -12.3573 0.779 -6.9215 {"}'S' -12.366 0.6971 -6.9676 {"}'S' P -12.4853 0.8819 -7.1165 {"}'S' -12.4885 0.7766 -7.1601 {"}'S' P -12.6277 0.9478 -7.3194 {"}'S' -12.6231 0.8666 -7.3407 {"}'S' P -12.7796 0.975 -7.5229 {"}'S' -12.778 0.9623 -7.5247 {"}'S' P -12.1547 0.8274 -7.088 {"}'S' -12.1642 0.7862 -7.1052 {"}'S' P -12.2891 0.9258 -7.2889 {"}'S' -12.2964 0.8734 -7.3042 {"}'S' P -12.4359 0.9865 -7.4966 {"}'S' -12.4374 0.966 -7.4992 { CZ PHE 230 A}'S' P -13.0133 0.5827 -6.601 {"}'S' -13.015 0.5689 -6.6019 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB GLU 152 A}'S' blue -13.6137 0.9533 -6.3887 {"}'S' blue -13.456 0.9388 -6.1818 { CG GLU 152 A}'S' blue -14.3699 0.7041 -6.2153 {"}'S' blue -14.2176 0.6763 -6.011 {"}'S' blue -14.06 0.6881 -5.8102 {"}'S' blue -14.1573 0.7746 -6.3509 {"}'S' sky -14.0041 0.7484 -6.1458 {"}'S' blue -13.8455 0.7645 -5.9447 {"}'S' blue -13.6841 0.8234 -5.7528 {"}'S' blue -13.9121 0.8699 -6.4186 {"}'S' blue -13.7544 0.8582 -6.2123 {"}'S' blue -13.5922 0.8962 -6.013 { HB3 GLU 152 A}'S' sky -13.4935 0.8568 -6.6449 {"}'S' sky -12.6778 0.7009 -5.9575 { HG2 GLU 152 A}'S' blue -14.4535 0.7487 -6.4799 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 GLU 152 A}'S' sea -13.3647 0.7551 -6.4507 {"}'S' sea -13.2174 0.7121 -6.2482 {"}'S' sea -13.06 0.73 -6.0491 {"}'S' green -13.2849 0.6912 -6.7389 {"}'S' green -13.1475 0.6097 -6.5394 {"}'S' green -12.9956 0.5839 -6.3361 {"}'S' green -12.8362 0.6144 -6.1389 {"}'S' green -13.2326 0.7906 -7.1311 {"}'S' green -12.6903 0.5259 -6.3568 {"}'S' sea -12.5317 0.5904 -6.17 {"}'S' green -13.0822 0.9114 -7.4025 {"}'S' green -12.4301 0.5276 -6.4526 {"}'S' green -12.8753 1.0349 -7.5785 {"}'S' green -12.6325 1.1285 -7.6594 {"}'S' green -12.0104 0.6907 -6.7331 {"}'S' green -12.3298 1.0265 -7.5471 {"}'S' green -11.9338 0.8095 -6.9733 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 GLU 152 A}'S' P -13.1238 0.6499 -6.952 {"}'S' -13.1189 0.6614 -6.9478 {"}'S' P -12.9931 0.5556 -6.7569 {"}'S' -12.9884 0.5732 -6.7545 {"}'S' P -12.8458 0.5139 -6.5546 {"}'S' -12.8441 0.5288 -6.5557 {"}'S' P -12.9946 0.7353 -7.2391 {"}'S' -12.9777 0.7807 -7.2093 {"}'S' P -12.8784 0.6035 -7.0536 {"}'S' -12.8605 0.6879 -7.0195 {"}'S' P -12.7418 0.5221 -6.8536 {"}'S' -12.735 0.6066 -6.8361 {"}'S' P -12.5895 0.4972 -6.6498 {"}'S' -12.5915 0.5348 -6.6492 {"}'S' P -12.8042 0.8386 -7.4331 {"}'S' -12.7975 0.8782 -7.3937 {"}'S' P -12.7016 0.6858 -7.258 {"}'S' -12.6972 0.7794 -7.1964 {"}'S' P -12.5732 0.585 -7.0629 {"}'S' -12.5811 0.6985 -7.0158 {"}'S' P -12.4259 0.542 -6.8603 {"}'S' -12.4416 0.625 -6.8426 {"}'S' P -12.2677 0.5597 -6.6619 {"}'S' -12.2711 0.5692 -6.6618 {"}'S' P -12.568 0.9196 -7.5167 {"}'S' -12.5708 0.9421 -7.4897 {"}'S' P -12.4644 0.7609 -7.3388 {"}'S' -12.4791 0.8333 -7.2815 {"}'S' P -12.3295 0.666 -7.1379 {"}'S' -12.3556 0.749 -7.0952 {"}'S' P -12.1737 0.6418 -6.9297 {"}'S' -12.1921 0.6827 -6.9181 {"}'S' P -12.2273 0.8737 -7.372 {"}'S' -12.2384 0.895 -7.3528 {"}'S' P -12.0901 0.7987 -7.1725 {"}'S' -12.1004 0.8145 -7.1629 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 230 A}'M' green -9.8417 2.0695 -6.2625 {"}'M' green -10.0007 1.9808 -6.4441 {"}'M' green -10.1443 1.8731 -6.7166 {"}'M' green -10.1543 2.0154 -6.9593 {"}'M' green -9.457 2.4279 -6.1739 {"}'M' green -10.1239 2.1095 -7.2041 {"}'M' green -9.3225 2.8314 -6.6854 {"}'M' green -9.934 2.4082 -7.3579 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 230 A}'M' greentint -9.7387 2.3021 -6.3115 {"}'M' greentint -9.902 2.2687 -6.5134 {"}'M' greentint -10.0506 2.1118 -6.6618 {"}'M' greentint -9.5948 2.5072 -6.3735 {"}'M' greentint -9.7527 2.4989 -6.5755 {"}'M' greentint -9.9113 2.4057 -6.7539 {"}'M' greentint -10.0506 2.2377 -6.8871 {"}'M' greentint -9.4096 2.6773 -6.4395 {"}'M' greentint -9.5658 2.688 -6.6434 {"}'M' greentint -9.7259 2.6297 -6.8354 {"}'M' greentint -9.8807 2.5067 -7 {"}'M' greentint -10.0165 2.3291 -7.1262 {"}'M' greentint -9.4826 2.8074 -6.8868 {"}'M' greentint -9.6451 2.7258 -7.0731 {"}'M' greentint -9.7973 2.5898 -7.2331 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLU 152 A}'M' green -9.534 2.4524 -6.1857 {"}'M' green -9.356 2.7684 -6.387 {"}'M' green -9.7348 2.6984 -7.2853 {"}'M' green -9.4157 2.8934 -6.9278 {"}'M' green -9.549 2.7898 -7.1273 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLU 152 A}'M' greentint -10.127 2.0289 -6.8345 {"}'M' greentint -9.9688 2.0311 -6.6308 {"}'M' greentint -9.8081 2.107 -6.4439 {"}'M' greentint -9.6586 2.2524 -6.2915 {"}'M' greentint -10.0239 2.1915 -7.0896 {"}'M' greentint -9.8751 2.1419 -6.8834 {"}'M' greentint -9.7128 2.1868 -6.6855 {"}'M' greentint -9.5586 2.3194 -6.5238 {"}'M' greentint -9.4343 2.5228 -6.4192 {"}'M' greentint -9.8959 2.4271 -7.252 {"}'M' greentint -9.7641 2.3254 -7.0539 {"}'M' greentint -9.6031 2.3534 -6.8539 {"}'M' greentint -9.4551 2.5054 -6.705 {"}'M' greentint -9.3603 2.7395 -6.6477 {"}'M' greentint -9.6306 2.5432 -7.1074 {"}'M' greentint -9.4707 2.6401 -6.928 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 230 A}'M' greentint -10.3101 1.0642 -4.3149 {"}'M' greentint -10.47 0.9673 -4.4944 {"}'M' greentint -10.5804 0.8679 -4.7746 {"}'M' greentint -10.0448 1.1803 -4.1703 {"}'M' greentint -10.1766 1.282 -4.3685 {"}'M' greentint -10.3376 1.254 -4.5684 {"}'M' greentint -10.4856 1.102 -4.7173 {"}'M' greentint -10.5522 0.9654 -5.0282 {"}'M' greentint -9.8533 1.3571 -4.2342 {"}'M' greentint -9.9882 1.4519 -4.4351 {"}'M' greentint -10.147 1.4551 -4.641 {"}'M' greentint -10.3073 1.364 -4.8239 {"}'M' greentint -10.4487 1.1935 -4.9594 {"}'M' greentint -9.6114 1.442 -4.2887 {"}'M' greentint -9.7396 1.5511 -4.4855 {"}'M' greentint -9.8913 1.5866 -4.6906 {"}'M' greentint -10.0526 1.5474 -4.8885 {"}'M' greentint -10.2092 1.4354 -5.0599 {"}'M' greentint -10.3478 1.2607 -5.1906 {"}'M' greentint -9.6088 1.6368 -4.7398 {"}'M' greentint -9.7631 1.6375 -4.9389 {"}'M' greentint -9.9213 1.5738 -5.1252 {"}'M' greentint -10.0715 1.4494 -5.285 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLU 152 A}'M' green -10.592 0.8638 -4.8323 {"}'M' green -9.5399 1.6483 -4.8208 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLU 152 A}'M' greentint -10.4409 0.8379 -4.6301 {"}'M' greentint -10.283 0.8618 -4.4334 {"}'M' greentint -10.1249 0.9358 -4.2496 {"}'M' greentint -9.9731 1.0565 -4.0868 {"}'M' greentint -10.4836 1.0081 -5.0964 {"}'M' greentint -10.3373 0.9448 -4.8906 {"}'M' greentint -10.1801 0.9402 -4.6849 {"}'M' greentint -10.0175 0.9959 -4.4908 {"}'M' greentint -9.8597 1.1062 -4.3173 {"}'M' greentint -9.7143 1.2679 -4.1744 {"}'M' greentint -10.2538 1.1226 -5.1485 {"}'M' greentint -10.1058 1.0756 -4.944 {"}'M' greentint -9.9466 1.098 -4.7435 {"}'M' greentint -9.7869 1.1866 -4.5625 {"}'M' greentint -9.6402 1.3362 -4.415 {"}'M' greentint -10.1255 1.3344 -5.3001 {"}'M' greentint -9.9872 1.2575 -5.0985 {"}'M' greentint -9.8283 1.2686 -4.8976 {"}'M' greentint -9.6713 1.3644 -4.7203 {"}'M' greentint -9.5328 1.535 -4.5888 {"}'M' greentint -9.8528 1.4654 -5.1743 {"}'M' greentint -9.6897 1.4946 -4.9717 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 65 2f2hA_239Y_67V}P -7.1402 5.8614 -11.9081 {"}-7.1402 5.8614 -11.9081 { ca val A 65 2f2hA_239Y_67V}-8.32 6.0526 -11.1138 { c val A 65 2f2hA_239Y_67V}-8.3764 5.0986 -9.9256 { o val A 65 2f2hA_239Y_67V}-8.2448 3.8845 -10.0103 { c val A 65 2f2hA_239Y_67V}P -8.3764 5.0986 -9.9256 { n gly A 66 2f2hA_239Y_67V}-8.429 5.7578 -8.7945 { ca gly A 66 2f2hA_239Y_67V}-8.6041 5.1032 -7.5106 { c gly A 66 2f2hA_239Y_67V}-10.0866 4.835 -7.2284 { o gly A 66 2f2hA_239Y_67V}-10.9462 5.6476 -7.4985 { c gly A 66 2f2hA_239Y_67V}P -10.0866 4.835 -7.2284 { n val A 67 2f2hA_239Y_67V}-10.3419 3.655 -6.6809 { ca val A 67 2f2hA_239Y_67V}-11.6578 3.265 -6.256 { c val A 67 2f2hA_239Y_67V}-11.592 2.7195 -4.8454 { o val A 67 2f2hA_239Y_67V}-10.8952 1.7262 -4.6044 { c val A 67 2f2hA_239Y_67V}P -11.592 2.7195 -4.8454 { n arg A 68 2f2hA_239Y_67V}-12.2921 3.3926 -3.9378 { ca arg A 68 2f2hA_239Y_67V}-12.4364 2.9465 -2.567 { c arg A 68 2f2hA_239Y_67V}-13.9 2.5738 -2.271 { o arg A 68 2f2hA_239Y_67V}-14.8139 3.3875 -2.414 { c arg A 68 2f2hA_239Y_67V}P -13.9 2.5738 -2.271 { n ile A 69 2f2hA_239Y_67V}-14.0976 1.32 -1.8653 { ca ile A 69 2f2hA_239Y_67V}-15.3949 0.7724 -1.567 { c ile A 69 2f2hA_239Y_67V}-15.3941 0.4621 -0.0683 { o ile A 69 2f2hA_239Y_67V}-14.5664 -0.3534 0.3948 { n leu A 237 2f2hA_239Y_67V}P -11.9765 -1.6266 0.6708 {"}-11.9765 -1.6266 0.6708 { ca leu A 237 2f2hA_239Y_67V}-11.1344 -2.1399 -0.3749 { c leu A 237 2f2hA_239Y_67V}-10.8044 -0.9609 -1.2558 { o leu A 237 2f2hA_239Y_67V}-11.7062 -0.2291 -1.6934 { c leu A 237 2f2hA_239Y_67V}P -10.8044 -0.9609 -1.2558 { n glu A 238 2f2hA_239Y_67V}-9.5205 -0.7711 -1.5335 { ca glu A 238 2f2hA_239Y_67V}-9.071 0.3289 -2.3459 { c glu A 238 2f2hA_239Y_67V}-8.117 -0.2171 -3.3798 { o glu A 238 2f2hA_239Y_67V}-7.172 -0.9945 -3.09 { c glu A 238 2f2hA_239Y_67V}P -8.117 -0.2171 -3.3798 { n tyr A 239 2f2hA_239Y_67V}-8.4786 0.0218 -4.6292 { ca tyr A 239 2f2hA_239Y_67V}-7.6218 -0.3064 -5.7107 { c tyr A 239 2f2hA_239Y_67V}-7.5108 0.8226 -6.7259 { o tyr A 239 2f2hA_239Y_67V}-8.323 1.7579 -6.7353 { c tyr A 239 2f2hA_239Y_67V}P -7.5108 0.8226 -6.7259 { n phe A 240 2f2hA_239Y_67V}-6.4758 0.7461 -7.5529 { ca phe A 240 2f2hA_239Y_67V}-6.1579 1.7315 -8.6028 { c phe A 240 2f2hA_239Y_67V}-6.0164 1.0787 -9.9691 { o phe A 240 2f2hA_239Y_67V}-5.1609 0.2071 -10.1457 { c phe A 240 2f2hA_239Y_67V}P -6.0164 1.0787 -9.9691 { n val A 241 2f2hA_239Y_67V}-6.8593 1.4976 -10.9144 { ca val A 241 2f2hA_239Y_67V}-6.7361 1.1127 -12.2901 { c val A 241 2f2hA_239Y_67V}-5.8218 2.1283 -12.9828 { o val A 241 2f2hA_239Y_67V}-5.9894 3.3303 -12.8454 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 65 2f2hA_239Y_67V}P -7.1402 5.8614 -11.9081 { ca val A 65 2f2hA_239Y_67V}P -8.32 6.0526 -11.1138 { n gly A 66 2f2hA_239Y_67V}P -8.429 5.7578 -8.7945 { ca gly A 66 2f2hA_239Y_67V}P -8.6041 5.1032 -7.5106 {"}P -8.6041 5.1032 -7.5106 { n val A 67 2f2hA_239Y_67V}P -10.3419 3.655 -6.6809 { ca val A 67 2f2hA_239Y_67V}P -11.6578 3.265 -6.256 { n arg A 68 2f2hA_239Y_67V}P -12.2921 3.3926 -3.9378 { ca arg A 68 2f2hA_239Y_67V}P -12.4364 2.9465 -2.567 { n ile A 69 2f2hA_239Y_67V}P -14.0976 1.32 -1.8653 { ca ile A 69 2f2hA_239Y_67V}P -15.3949 0.7724 -1.567 { n leu A 237 2f2hA_239Y_67V}P -11.9765 -1.6266 0.6708 { ca leu A 237 2f2hA_239Y_67V}P -11.1344 -2.1399 -0.3749 { n glu A 238 2f2hA_239Y_67V}P -9.5205 -0.7711 -1.5335 { ca glu A 238 2f2hA_239Y_67V}P -9.071 0.3289 -2.3459 { n tyr A 239 2f2hA_239Y_67V}P -8.4786 0.0218 -4.6292 { ca tyr A 239 2f2hA_239Y_67V}P -7.6218 -0.3064 -5.7107 { n phe A 240 2f2hA_239Y_67V}P -6.4758 0.7461 -7.5529 { ca phe A 240 2f2hA_239Y_67V}P -6.1579 1.7315 -8.6028 { n val A 241 2f2hA_239Y_67V}P -6.8593 1.4976 -10.9144 { ca val A 241 2f2hA_239Y_67V}P -6.7361 1.1127 -12.2901 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 65 2f2hA_239Y_67V}P -8.32 6.0526 -11.1138 {"}-8.32 6.0526 -11.1138 { ca gly A 66 2f2hA_239Y_67V}-8.6041 5.1032 -7.5106 { ca val A 67 2f2hA_239Y_67V}-11.6578 3.265 -6.256 { ca arg A 68 2f2hA_239Y_67V}-12.4364 2.9465 -2.567 { ca ile A 69 2f2hA_239Y_67V}-15.3949 0.7724 -1.567 { ca leu A 237 2f2hA_239Y_67V}P -11.1344 -2.1399 -0.3749 {"}-11.1344 -2.1399 -0.3749 { ca glu A 238 2f2hA_239Y_67V}-9.071 0.3289 -2.3459 { ca tyr A 239 2f2hA_239Y_67V}-7.6218 -0.3064 -5.7107 { ca phe A 240 2f2hA_239Y_67V}-6.1579 1.7315 -8.6028 { ca val A 241 2f2hA_239Y_67V}-6.7361 1.1127 -12.2901 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 67 2f2hA_239Y_67V}P -11.6578 3.265 -6.256 { cb val A 67 2f2hA_239Y_67V}-12.2076 2.1011 -7.1366 { cg1 val A 67 2f2hA_239Y_67V}-13.6479 1.7648 -6.7095 { cb val A 67 2f2hA_239Y_67V}P -12.2076 2.1011 -7.1366 { cg2 val A 67 2f2hA_239Y_67V}-12.0527 2.4569 -8.5766 { ca tyr A 239 2f2hA_239Y_67V}P -7.6218 -0.3064 -5.7107 { cb tyr A 239 2f2hA_239Y_67V}-8.0596 -1.605 -6.3493 { cg tyr A 239 2f2hA_239Y_67V}-9.4284 -1.6189 -6.9797 { cd1 tyr A 239 2f2hA_239Y_67V}-10.5406 -1.9379 -6.2466 { ce1 tyr A 239 2f2hA_239Y_67V}-11.8222 -1.9757 -6.8532 { cz tyr A 239 2f2hA_239Y_67V}-11.9481 -1.7311 -8.185 { oh tyr A 239 2f2hA_239Y_67V}-13.2188 -1.7941 -8.7402 { cg tyr A 239 2f2hA_239Y_67V}P -9.4284 -1.6189 -6.9797 { cd2 tyr A 239 2f2hA_239Y_67V}-9.6002 -1.4044 -8.3486 { ce2 tyr A 239 2f2hA_239Y_67V}-10.8694 -1.4057 -8.9278 { cz tyr A 239 2f2hA_239Y_67V}ghost -11.9481 -1.7311 -8.185 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A 67 2f2hA_239Y_67V}P -12.2076 2.1011 -7.1366 { cg1 val A 67 2f2hA_239Y_67V}P -13.6479 1.7648 -6.7095 {"}P -13.6479 1.7648 -6.7095 {"}P -13.6479 1.7648 -6.7095 { cg2 val A 67 2f2hA_239Y_67V}P -12.0527 2.4569 -8.5766 {"}P -12.0527 2.4569 -8.5766 {"}P -12.0527 2.4569 -8.5766 { cb tyr A 239 2f2hA_239Y_67V}P -8.0596 -1.605 -6.3493 {"}P -8.0596 -1.605 -6.3493 { cd1 tyr A 239 2f2hA_239Y_67V}P -10.5406 -1.9379 -6.2466 { cd2 tyr A 239 2f2hA_239Y_67V}P -9.6002 -1.4044 -8.3486 { ce1 tyr A 239 2f2hA_239Y_67V}P -11.8222 -1.9757 -6.8532 { ce2 tyr A 239 2f2hA_239Y_67V}P -10.8694 -1.4057 -8.9278 { oh tyr A 239 2f2hA_239Y_67V}P -13.2188 -1.7941 -8.7402 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 239 A}'S' blue -10.9333 -0.2642 -6.5741 {"}'S' blue -11.0945 -0.3579 -6.7559 { CE1 TYR 239 A}'S' blue -12.0766 -0.2625 -6.5991 {"}'S' blue -12.2343 -0.2757 -6.7997 {"}'S' sky -11.7328 -0.2509 -6.5728 {"}'S' sky -11.8895 -0.228 -6.7802 {"}'S' sky -12.051 -0.2454 -6.9851 {"}'S' blue -12.2149 -0.3021 -7.1808 {"}'S' blue -11.4045 -0.3009 -6.5621 {"}'S' sky -11.5536 -0.2479 -6.7695 {"}'S' sky -11.8727 -0.257 -7.1795 {"}'S' sky -11.3444 -0.294 -6.9207 {"}'S' sky -11.502 -0.2768 -7.1281 {"}'S' blue -11.2869 -0.359 -7.2562 { CE2 TYR 239 A}'S' blue -11.092 -0.1161 -7.7664 {"}'S' blue -11.2142 0.0102 -7.9589 {"}'S' blue -11.3541 0.0911 -8.1617 {"}'S' blue -10.9671 0.0866 -8.0196 { CZ TYR 239 A}'S' sky -12.0458 -0.2387 -7.2768 {"}'S' sky -12.1812 -0.1485 -7.4756 {"}'S' sky -11.7802 -0.2139 -7.3295 {"}'S' sky -11.9081 -0.1109 -7.5245 {"}'S' sky -12.0506 -0.045 -7.7274 {"}'S' blue -11.4589 -0.2991 -7.3049 {"}'S' sky -11.5775 -0.1655 -7.496 {"}'S' sky -11.7119 -0.0671 -7.697 {"}'S' sky -11.8587 -0.0063 -7.9046 {"}'S' blue -11.2702 -0.2719 -7.4976 {"}'S' sky -11.3925 -0.1473 -7.6915 {"}'S' blue -11.5304 -0.0562 -7.8939 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 239 A}'S' sea -11.7105 -0.2336 -6.9769 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 67 A}'S' blue -12.1303 0.1214 -6.9072 {"}'S' sky -11.9784 0.0957 -6.7039 {"}'S' blue -11.819 0.1261 -6.5067 {"}'S' blue -12.2154 0.3023 -7.4989 {"}'S' sky -12.1066 0.1617 -7.3198 {"}'S' sky -11.976 0.0673 -7.1247 {"}'S' sky -11.8286 0.0256 -6.9224 {"}'S' sky -11.6731 0.0376 -6.7245 {"}'S' blue -11.5145 0.1021 -6.5378 {"}'S' sky -11.9774 0.247 -7.6068 {"}'S' sky -11.7246 0.0339 -7.2213 {"}'S' sky -11.5723 0.0089 -7.0176 {"}'S' sky -11.4129 0.0393 -6.8204 {"}'S' blue -11.2549 0.1251 -6.6394 {"}'S' blue -11.787 0.3503 -7.8009 {"}'S' sky -11.6844 0.1975 -7.6258 {"}'S' sky -11.556 0.0967 -7.4307 {"}'S' sky -11.4087 0.0537 -7.2281 {"}'S' blue -11.2505 0.0715 -7.0296 {"}'S' blue -11.0928 0.1475 -6.8468 {"}'S' blue -11.5509 0.4313 -7.8845 {"}'S' blue -11.4472 0.2726 -7.7066 {"}'S' blue -11.3123 0.1778 -7.5057 {"}'S' blue -11.2101 0.3855 -7.7398 {"}'S' blue -11.0729 0.3104 -7.5403 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 67 A}'S' sea -11.8612 0.1152 -7.4214 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 239 A}'M' greentint -9.4951 2.1503 -6.0789 {"}'M' greentint -9.6387 2.0426 -6.3514 {"}'M' greentint -9.2331 2.4716 -5.9463 {"}'M' greentint -9.3964 2.4382 -6.1481 {"}'M' greentint -9.545 2.2813 -6.2966 {"}'M' greentint -9.6487 2.1849 -6.5941 {"}'M' greentint -9.0892 2.6767 -6.0083 {"}'M' greentint -9.2472 2.6684 -6.2103 {"}'M' greentint -9.4058 2.5752 -6.3887 {"}'M' greentint -9.545 2.4072 -6.5219 {"}'M' greentint -9.6183 2.279 -6.8389 {"}'M' greentint -9.6895 2.0339 -6.8631 {"}'M' greentint -8.904 2.8468 -6.0743 {"}'M' greentint -9.0602 2.8575 -6.2781 {"}'M' greentint -9.2204 2.7992 -6.4701 {"}'M' greentint -9.3752 2.6762 -6.6348 {"}'M' greentint -9.5109 2.4986 -6.761 {"}'M' greentint -9.5404 2.3592 -7.0771 {"}'M' greentint -8.8169 3.0009 -6.3202 {"}'M' greentint -8.977 2.9769 -6.5216 {"}'M' greentint -9.1395 2.8953 -6.7079 {"}'M' greentint -9.2917 2.7593 -6.8679 {"}'M' greentint -9.4284 2.5778 -6.9927 {"}'M' greentint -9.4259 2.4039 -7.3068 {"}'M' greentint -8.7235 3.0914 -6.589 {"}'M' greentint -8.8826 3.0403 -6.7812 {"}'M' greentint -9.0384 2.9415 -6.9545 {"}'M' greentint -9.1846 2.798 -7.1044 {"}'M' greentint -9.3153 2.616 -7.2229 {"}'M' greentint -8.8827 2.9689 -7.1598 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 67 A}'M' greentint -9.4478 2.1072 -6.0369 {"}'M' greentint -9.3065 2.258 -5.8952 {"}'M' greentint -9.6463 1.9707 -6.6838 {"}'M' greentint -9.492 1.97 -6.4847 {"}'M' greentint -9.3338 2.0337 -6.2984 {"}'M' greentint -9.1836 2.1581 -6.1385 {"}'M' greentint -9.0505 2.3337 -6.0154 {"}'M' greentint -8.9452 2.5484 -5.9377 {"}'M' greentint -9.5828 2.102 -7.0388 {"}'M' greentint -9.4414 2.029 -6.8357 {"}'M' greentint -9.2832 2.0312 -6.632 {"}'M' greentint -9.1226 2.1072 -6.4451 {"}'M' greentint -8.973 2.2525 -6.2927 {"}'M' greentint -8.8485 2.4525 -6.1869 {"}'M' greentint -8.7599 2.6901 -6.1388 {"}'M' greentint -8.7154 2.9448 -6.1515 {"}'M' greentint -9.4544 2.3287 -7.2789 {"}'M' greentint -9.3383 2.1917 -7.0907 {"}'M' greentint -9.1895 2.142 -6.8846 {"}'M' greentint -9.0272 2.1869 -6.6867 {"}'M' greentint -8.873 2.3196 -6.525 {"}'M' greentint -8.7488 2.5229 -6.4204 {"}'M' greentint -8.6705 2.7686 -6.3882 {"}'M' greentint -8.6495 3.024 -6.4315 {"}'M' greentint -9.2103 2.4272 -7.2532 {"}'M' greentint -9.0786 2.3255 -7.0551 {"}'M' greentint -8.9176 2.3536 -6.8551 {"}'M' greentint -8.7695 2.5055 -6.7062 {"}'M' greentint -8.6747 2.7396 -6.6489 {"}'M' greentint -8.6584 2.9933 -6.6982 {"}'M' greentint -9.0493 2.6985 -7.2864 {"}'M' greentint -8.9451 2.5433 -7.1086 {"}'M' greentint -8.7851 2.6403 -6.9292 {"}'M' greentint -8.7301 2.8935 -6.929 {"}'M' greentint -8.8634 2.7899 -7.1284 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 239 A}'M' green -9.7813 0.9675 -4.1666 {"}'M' green -10.339 0.4979 -5.0199 {"}'M' green -9.9412 1.061 -5.4043 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 239 A}'M' greentint -10.1282 0.6048 -4.2913 {"}'M' greentint -10.2615 0.5012 -4.4908 {"}'M' greentint -10.0466 0.8514 -4.3112 {"}'M' greentint -10.2065 0.7545 -4.4906 {"}'M' greentint -10.3169 0.6551 -4.7709 {"}'M' greentint -9.9131 1.0692 -4.3647 {"}'M' greentint -10.0741 1.0412 -4.5647 {"}'M' greentint -10.2221 0.8892 -4.7136 {"}'M' greentint -10.2886 0.7526 -5.0245 {"}'M' greentint -9.7246 1.2391 -4.4314 {"}'M' greentint -9.8835 1.2423 -4.6373 {"}'M' greentint -10.0438 1.1512 -4.8201 {"}'M' greentint -10.1852 0.9807 -4.9557 {"}'M' greentint -10.1918 0.8268 -5.2645 {"}'M' greentint -9.6278 1.3738 -4.6868 {"}'M' greentint -9.7891 1.3346 -4.8847 {"}'M' greentint -9.9457 1.2226 -5.0561 {"}'M' greentint -10.0843 1.0479 -5.1869 {"}'M' greentint -9.6578 1.361 -5.1214 {"}'M' greentint -9.808 1.2366 -5.2813 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 67 A}'M' green -10.2617 0.484 -4.4753 {"}'M' green -9.9696 0.7666 -4.1764 {"}'M' green -9.5814 1.4328 -4.989 {"}'M' green -9.7183 1.3407 -5.2575 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 67 A}'M' greentint -10.1099 0.6046 -4.3124 {"}'M' greentint -10.3169 0.4884 -4.9106 {"}'M' greentint -10.1543 0.5441 -4.7164 {"}'M' greentint -9.9965 0.6543 -4.543 {"}'M' greentint -9.8511 0.816 -4.4 {"}'M' greentint -9.7265 1.0184 -4.2964 {"}'M' greentint -10.2426 0.6238 -5.1697 {"}'M' greentint -10.0834 0.6462 -4.9692 {"}'M' greentint -9.9236 0.7348 -4.7882 {"}'M' greentint -9.7769 0.8844 -4.6406 {"}'M' greentint -9.6532 1.0841 -4.5359 {"}'M' greentint -9.5614 1.3183 -4.4826 {"}'M' greentint -10.1239 0.8057 -5.3242 {"}'M' greentint -9.9651 0.8167 -5.1233 {"}'M' greentint -9.8081 0.9126 -4.9459 {"}'M' greentint -9.6696 1.0832 -4.8144 {"}'M' greentint -9.5667 1.3066 -4.7435 {"}'M' greentint -9.9896 1.0136 -5.3999 {"}'M' greentint -9.8265 1.0428 -5.1973 {"}'M' greentint -9.6767 1.1965 -5.0465 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr X 54 2f68X_131F_56V}P -6.4177 6.0906 -11.6701 {"}-6.4177 6.0906 -11.6701 { ca thr X 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2f68X_131F_56V}-14.2456 0.853 -2.3181 { ca met X 58 2f68X_131F_56V}-15.5232 0.1949 -2.0566 { c met X 58 2f68X_131F_56V}-15.627 -0.1526 -0.5727 { o met X 58 2f68X_131F_56V}-14.7643 -0.849 -0.0377 { n ala X 129 2f68X_131F_56V}P -12.2283 -1.685 0.4032 {"}-12.2283 -1.685 0.4032 { ca ala X 129 2f68X_131F_56V}-11.3146 -2.1851 -0.6193 { c ala X 129 2f68X_131F_56V}-10.8565 -1.0464 -1.5263 { o ala X 129 2f68X_131F_56V}-11.634 -0.531 -2.3357 { c ala X 129 2f68X_131F_56V}P -10.8565 -1.0464 -1.5263 { n glu X 130 2f68X_131F_56V}-9.5934 -0.6563 -1.379 { ca glu X 130 2f68X_131F_56V}-9.0199 0.4448 -2.147 { c glu X 130 2f68X_131F_56V}-7.9832 -0.0733 -3.1426 { o glu X 130 2f68X_131F_56V}-7.0262 -0.7481 -2.7572 { c glu X 130 2f68X_131F_56V}P -7.9832 -0.0733 -3.1426 { n phe X 131 2f68X_131F_56V}-8.1881 0.2414 -4.4207 { ca phe X 131 2f68X_131F_56V}-7.3062 -0.2205 -5.4972 { c phe X 131 2f68X_131F_56V}-7.257 0.7636 -6.6679 { o phe X 131 2f68X_131F_56V}-8.1888 1.5446 -6.8723 { c phe X 131 2f68X_131F_56V}P -7.257 0.7636 -6.6679 { n glu X 132 2f68X_131F_56V}-6.167 0.7127 -7.4308 { ca glu X 132 2f68X_131F_56V}-5.9652 1.6096 -8.5712 { c glu X 132 2f68X_131F_56V}-6.3349 0.9494 -9.8982 { o glu X 132 2f68X_131F_56V}-6.087 -0.2418 -10.0992 { c glu X 132 2f68X_131F_56V}P -6.3349 0.9494 -9.8982 { n val X 133 2f68X_131F_56V}-6.9334 1.7351 -10.7929 { ca val X 133 2f68X_131F_56V}-7.3158 1.2677 -12.13 { c val X 133 2f68X_131F_56V}-6.8076 2.2145 -13.2221 { o val X 133 2f68X_131F_56V}-6.457 3.3644 -12.9421 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr X 54 2f68X_131F_56V}P -6.4177 6.0906 -11.6701 { ca thr X 54 2f68X_131F_56V}P -7.3679 6.5735 -10.6645 { n thr X 55 2f68X_131F_56V}P -8.0126 5.9029 -8.4157 { ca thr X 55 2f68X_131F_56V}P -8.2131 4.976 -7.3008 { n val X 56 2f68X_131F_56V}P -10.0811 3.473 -6.9186 { ca val X 56 2f68X_131F_56V}P -11.4575 3.0754 -6.6157 { n lys X 57 2f68X_131F_56V}P -12.5178 3.0466 -4.4253 { ca lys X 57 2f68X_131F_56V}P -12.737 2.6034 -3.0499 { n met X 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{"}'S' sea -12.3003 0.7612 -7.2359 { CD1 LEU 136 A}'S' sea -12.2304 0.3353 -9.0238 {"}'S' sea -12.0754 0.4667 -8.8607 { HB2 LEU 136 A}'S' sea -12.2131 0.7376 -7.2293 {"}'S' green -12.0658 0.6945 -7.0267 {"}'S' sea -11.9084 0.7124 -6.8277 {"}'S' green -12.1333 0.6737 -7.5175 {"}'S' green -11.9959 0.5922 -7.318 {"}'S' green -11.844 0.5664 -7.1147 {"}'S' green -11.6846 0.5969 -6.9175 {"}'S' green -11.9723 0.6324 -7.7305 {"}'S' green -11.8416 0.538 -7.5355 {"}'S' green -11.6943 0.4964 -7.3332 {"}'S' green -11.5387 0.5083 -7.1353 {"}'S' sea -11.3801 0.5728 -6.9486 {"}'S' green -11.7268 0.586 -7.8322 {"}'S' green -11.5903 0.5046 -7.6321 {"}'S' green -11.4379 0.4796 -7.4284 {"}'S' sea -11.2785 0.5101 -7.2312 {"}'S' green -11.55 0.6683 -8.0366 {"}'S' green -11.4216 0.5675 -7.8415 {"}'S' green -11.2743 0.5244 -7.6389 {"}'S' sea -11.1162 0.5422 -7.4404 {"}'S' sea -11.3128 0.7433 -8.1174 {"}'S' green -11.1779 0.6485 -7.9165 {"}'S' sea -11.0221 0.6243 -7.7083 {HD12 LEU 136 A}'S' sea -12.14 0.2927 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-7.5941 {"}'S' P -11.9229 0.8558 -7.5312 {"}'S' -11.9411 0.8851 -7.4586 {"}'S' P -11.8678 0.6445 -7.4026 {"}'S' -11.8982 0.7052 -7.3144 {"}'S' P -11.7652 0.4917 -7.2275 {"}'S' -11.7979 0.5525 -7.1698 {"}'S' P -11.6281 0.4167 -7.028 {"}'S' -11.6383 0.4325 -7.0184 {"}'S' P -11.6781 0.9231 -7.465 {"}'S' -11.6965 0.9363 -7.4282 {"}'S' P -11.6103 0.7146 -7.3196 {"}'S' -11.6418 0.7457 -7.274 {"}'S' P -11.4769 0.6119 -7.1189 {"}'S' -11.4824 0.6159 -7.1136 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 6 A}'M' greentint -9.434 2.1715 -6.1369 {"}'M' greentint -9.5929 2.0827 -6.3185 {"}'M' greentint -9.7365 1.975 -6.5909 {"}'M' greentint -9.3309 2.404 -6.1859 {"}'M' greentint -9.4942 2.3706 -6.3877 {"}'M' greentint -9.6428 2.2137 -6.5362 {"}'M' greentint -9.7465 2.1174 -6.8337 {"}'M' greentint -9.8031 1.8679 -6.8369 {"}'M' greentint -9.187 2.6091 -6.2479 {"}'M' greentint -9.345 2.6008 -6.4499 {"}'M' greentint -9.5036 2.5076 -6.6283 {"}'M' greentint -9.6428 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{"}'M' greentint -9.403 1.4306 -4.2713 {"}'M' greentint -9.8884 1.4288 -5.1564 {"}'M' greentint -9.75 1.3519 -4.9549 {"}'M' greentint -9.5912 1.363 -4.754 {"}'M' greentint -9.4342 1.4588 -4.5767 {"}'M' greentint -9.2957 1.6294 -4.4451 {"}'M' greentint -9.6157 1.5598 -5.0307 {"}'M' greentint -9.4526 1.589 -4.828 {"}'M' greentint -9.3028 1.7427 -4.6772 {"}'M' greentint -9.5031 1.7896 -5.0659 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 71 2fmdA_73F_169A}P -12.123 -2.0295 0.4703 {"}-12.123 -2.0295 0.4703 { ca thr A 71 2fmdA_73F_169A}-11.0462 -2.3133 -0.4489 { c thr A 71 2fmdA_73F_169A}-10.8069 -1.0575 -1.2646 { o thr A 71 2fmdA_73F_169A}-11.7403 -0.3199 -1.5843 { c thr A 71 2fmdA_73F_169A}P -10.8069 -1.0575 -1.2646 { n thr A 72 2fmdA_73F_169A}-9.541 -0.7959 -1.5576 { ca thr A 72 2fmdA_73F_169A}-9.1712 0.3568 -2.3542 { c thr A 72 2fmdA_73F_169A}-8.2542 -0.1788 -3.4342 { o thr A 72 2fmdA_73F_169A}-7.4107 -1.0383 -3.1755 { c thr A 72 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2fmdA_73F_169A}-15.6265 -0.1893 -0.2902 { o ile A 171 2fmdA_73F_169A}-14.6554 -0.6528 0.309 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 71 2fmdA_73F_169A}P -12.123 -2.0295 0.4703 { ca thr A 71 2fmdA_73F_169A}P -11.0462 -2.3133 -0.4489 { n thr A 72 2fmdA_73F_169A}P -9.541 -0.7959 -1.5576 { ca thr A 72 2fmdA_73F_169A}P -9.1712 0.3568 -2.3542 { n phe A 73 2fmdA_73F_169A}P -8.4346 0.3042 -4.6524 { ca phe A 73 2fmdA_73F_169A}P -7.5908 -0.1391 -5.7424 { n thr A 74 2fmdA_73F_169A}P -6.385 0.8686 -7.5456 { ca thr A 74 2fmdA_73F_169A}P -6.1307 1.7931 -8.6274 { n phe A 75 2fmdA_73F_169A}P -6.6266 1.5861 -10.9822 { ca phe A 75 2fmdA_73F_169A}P -6.7083 0.8667 -12.2352 { n ala A 167 2fmdA_73F_169A}P -7.2061 5.5923 -12.1231 { ca ala A 167 2fmdA_73F_169A}P -8.3465 5.9024 -11.2729 { n thr A 168 2fmdA_73F_169A}P -8.7639 5.8219 -8.8876 { ca thr A 168 2fmdA_73F_169A}P -8.7006 5.2702 -7.5404 { n ala A 169 2fmdA_73F_169A}P -10.393 3.7934 -6.6115 { ca ala A 169 2fmdA_73F_169A}P 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master= {vdw contact} { CE1 PHE 73 A}'S' green -11.7364 0.3544 -7.531 {"}'S' green -11.8787 0.4248 -7.733 {"}'S' sea -12.0329 0.4425 -7.9376 {"}'S' sea -11.2846 0.1785 -7.2151 {"}'S' green -11.3835 0.3442 -7.3898 {"}'S' green -11.7986 0.5857 -7.9935 {"}'S' sea -11.9596 0.5707 -8.1965 {"}'S' green -11.141 0.4179 -7.4546 {"}'S' green -11.5419 0.687 -8.0468 {"}'S' sea -11.6978 0.6925 -8.2509 {"}'S' sea -10.8803 0.434 -7.512 {"}'S' green -10.9929 0.5718 -7.6957 {"}'S' green -11.1209 0.6748 -7.8907 {"}'S' green -11.2633 0.7406 -8.0936 {"}'S' sea -11.4152 0.7678 -8.2971 { CZ PHE 73 A}'S' sea -12.0245 0.1634 -6.8558 {"}'S' sea -12.1524 0.2663 -7.0508 {"}'S' green -12.2948 0.3322 -7.2536 {"}'S' sea -12.4467 0.3594 -7.4572 {"}'S' green -11.8218 0.2118 -7.0222 {"}'S' green -11.9562 0.3102 -7.2232 {"}'S' green -12.103 0.371 -7.4309 {"}'S' sea -12.2596 0.3939 -7.6382 {"}'S' green -11.6368 0.23 -7.2178 {"}'S' green -11.7747 0.321 -7.4202 {"}'S' green -11.9238 0.374 -7.6275 {"}'S' sea -12.0807 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contact} { HB3 ALA 169 A}'S' sea -12.3646 0.5384 -7.2969 {"}'S' sea -12.2272 0.4569 -7.0974 {"}'S' sea -12.0753 0.4312 -6.8941 {"}'S' sea -12.3123 0.6378 -7.689 {"}'S' green -12.2035 0.4972 -7.5099 {"}'S' green -12.0728 0.4028 -7.3149 {"}'S' green -11.9255 0.3611 -7.1126 {"}'S' sea -11.77 0.3731 -6.9147 {"}'S' sea -12.0742 0.5825 -7.797 {"}'S' green -11.9581 0.4507 -7.6116 {"}'S' green -11.8215 0.3694 -7.4115 {"}'S' green -11.6691 0.3444 -7.2078 {"}'S' sea -11.5098 0.3748 -7.0106 {"}'S' green -11.8839 0.6858 -7.9911 {"}'S' green -11.7813 0.533 -7.816 {"}'S' green -11.5056 0.3892 -7.4183 {"}'S' sea -11.3474 0.4069 -7.2198 {"}'S' green -11.6477 0.7668 -8.0747 {"}'S' green -11.2534 0.489 -7.4877 {"}'S' sea -11.0901 0.538 -7.2911 {"}'S' green -11.4095 0.8737 -8.105 {"}'S' green -11.3069 0.7209 -7.93 {"}'S' green -11.1698 0.6459 -7.7305 {"}'S' sea -11.0135 0.6567 -7.5313 {"}'S' sea -11.1521 0.9438 -8.0221 {"}'S' sea -11.0187 0.8411 -7.8214 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 169 A}'S' P -11.6529 0.4322 -7.6209 {"}'S' -11.6534 0.4399 -7.6182 {"}'S' P -11.544 0.6081 -7.8968 {"}'S' -11.5453 0.6166 -7.8901 {"}'S' P -11.4092 0.5132 -7.6959 {"}'S' -11.4141 0.5311 -7.6861 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 73 A}'M' greentint -9.3791 2.2545 -6.1082 {"}'M' greentint -9.538 2.1658 -6.2898 {"}'M' greentint -9.2761 2.487 -6.1572 {"}'M' greentint -9.4394 2.4536 -6.359 {"}'M' greentint -9.588 2.2967 -6.5075 {"}'M' greentint -9.6917 2.2004 -6.805 {"}'M' greentint -8.9943 2.6128 -6.0195 {"}'M' greentint -9.1322 2.6922 -6.2192 {"}'M' greentint -9.2901 2.6838 -6.4212 {"}'M' greentint -9.4487 2.5906 -6.5996 {"}'M' greentint -9.5879 2.4227 -6.7328 {"}'M' greentint -9.6613 2.2944 -7.0498 {"}'M' greentint -8.947 2.8622 -6.2852 {"}'M' greentint -9.1031 2.8729 -6.489 {"}'M' greentint -9.2633 2.8147 -6.681 {"}'M' greentint -9.4181 2.6916 -6.8457 {"}'M' greentint -9.5538 2.514 -6.9719 {"}'M' greentint -8.8599 3.0163 -6.5311 {"}'M' greentint -9.02 2.9923 -6.7325 {"}'M' greentint -9.1825 2.9107 -6.9188 {"}'M' greentint -9.3347 2.7748 -7.0788 {"}'M' greentint -9.4713 2.5932 -7.2036 {"}'M' greentint -8.7664 3.1068 -6.7999 {"}'M' greentint -8.9255 3.0557 -6.9921 {"}'M' greentint -9.0814 2.957 -7.1654 {"}'M' greentint -9.2275 2.8134 -7.3153 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 169 A}'M' greentint -9.5559 2.0863 -6.4618 {"}'M' greentint -9.3977 2.15 -6.2755 {"}'M' greentint -9.2475 2.2745 -6.1157 {"}'M' greentint -9.1143 2.4501 -5.9926 {"}'M' greentint -9.6467 2.2183 -7.0159 {"}'M' greentint -9.5053 2.1453 -6.8128 {"}'M' greentint -9.3471 2.1475 -6.6091 {"}'M' greentint -9.1865 2.2235 -6.4222 {"}'M' greentint -9.0369 2.3688 -6.2698 {"}'M' greentint -8.9124 2.5688 -6.164 {"}'M' greentint -9.5183 2.445 -7.2561 {"}'M' greentint -9.4022 2.308 -7.0679 {"}'M' greentint -9.2534 2.2583 -6.8618 {"}'M' greentint -9.0911 2.3032 -6.6638 {"}'M' greentint -8.9369 2.4359 -6.5021 {"}'M' greentint -8.8126 2.6392 -6.3975 {"}'M' greentint -8.7343 2.8849 -6.3654 {"}'M' greentint -9.2742 2.5435 -7.2304 {"}'M' greentint -9.1424 2.4418 -7.0322 {"}'M' greentint -8.9814 2.4699 -6.8322 {"}'M' greentint -8.8334 2.6218 -6.6834 {"}'M' greentint -8.7386 2.8559 -6.626 {"}'M' greentint -9.1131 2.8148 -7.2636 {"}'M' greentint -9.0089 2.6596 -7.0857 {"}'M' greentint -8.849 2.7566 -6.9063 {"}'M' greentint -8.794 3.0098 -6.9061 {"}'M' greentint -8.9273 2.9062 -7.1056 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 73 A}'M' green -10.121 1.0392 -5.0249 {"}'M' green -9.4098 1.9151 -4.6919 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 73 A}'M' greentint -9.9102 1.1461 -4.2964 {"}'M' greentint -10.0435 1.0425 -4.4959 {"}'M' greentint -9.7244 1.2375 -4.1384 {"}'M' greentint -9.8286 1.3927 -4.3162 {"}'M' greentint -9.9885 1.2958 -4.4957 {"}'M' greentint -10.0989 1.1964 -4.7759 {"}'M' greentint -10.1152 0.9427 -4.7266 {"}'M' greentint -9.5633 1.5088 -4.1716 {"}'M' greentint -9.6951 1.6105 -4.3698 {"}'M' greentint -9.8561 1.5825 -4.5697 {"}'M' greentint -10.0041 1.4305 -4.7186 {"}'M' greentint -10.0706 1.2939 -5.0295 {"}'M' greentint -9.5067 1.7804 -4.4364 {"}'M' greentint -9.6655 1.7836 -4.6423 {"}'M' greentint -9.8258 1.6925 -4.8252 {"}'M' greentint -9.9672 1.522 -4.9607 {"}'M' greentint -9.9738 1.3681 -5.2696 {"}'M' greentint -9.5711 1.8759 -4.8898 {"}'M' greentint -9.7277 1.7639 -5.0612 {"}'M' greentint -9.8663 1.5892 -5.1919 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 169 A}'M' green -9.6108 1.4055 -4.0932 {"}'M' green -9.4456 1.7053 -4.2794 {"}'M' green -9.3965 1.9434 -4.5401 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 169 A}'M' greentint -10.0386 0.9311 -4.5133 {"}'M' greentint -9.8807 1.0413 -4.3398 {"}'M' greentint -9.7354 1.203 -4.1968 {"}'M' greentint -10.1268 1.0108 -4.9665 {"}'M' greentint -9.9676 1.0332 -4.766 {"}'M' greentint -9.8079 1.1218 -4.585 {"}'M' greentint -9.6612 1.2714 -4.4375 {"}'M' greentint -9.5375 1.4712 -4.3327 {"}'M' greentint -10.0082 1.1927 -5.121 {"}'M' greentint -9.8494 1.2037 -4.9201 {"}'M' greentint -9.6923 1.2996 -4.7428 {"}'M' greentint -9.5539 1.4702 -4.6112 {"}'M' greentint -9.4509 1.6937 -4.5404 {"}'M' greentint -9.8739 1.4006 -5.1968 {"}'M' greentint -9.7107 1.4298 -4.9941 {"}'M' greentint -9.561 1.5835 -4.8433 {"}'M' greentint -9.4657 1.8198 -4.7858 {"}'M' greentint -9.7612 1.6304 -5.232 {"}'M' greentint -9.6025 1.7277 -5.0544 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 66 2fosA_93F_68V}P -5.7431 7.0768 -9.4233 {"}-5.7431 7.0768 -9.4233 { ca phe A 66 2fosA_93F_68V}-7.0241 7.2958 -8.7037 { c phe A 66 2fosA_93F_68V}-7.4437 6.0097 -8.0146 { o phe A 66 2fosA_93F_68V}-7.3737 4.905 -8.5742 { c phe A 66 2fosA_93F_68V}P -7.4437 6.0097 -8.0146 { n asn A 67 2fosA_93F_68V}-7.9311 6.1276 -6.7818 { ca asn A 67 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1.7035 -11.0336 { ca phe A 95 2fosA_93F_68V}-5.0359 1.2875 -12.2517 { c phe A 95 2fosA_93F_68V}-3.6512 1.903 -12.41 { o phe A 95 2fosA_93F_68V}-3.358 2.9352 -11.7972 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 66 2fosA_93F_68V}P -5.7431 7.0768 -9.4233 { ca phe A 66 2fosA_93F_68V}P -7.0241 7.2958 -8.7037 { n asn A 67 2fosA_93F_68V}P -7.9311 6.1276 -6.7818 { ca asn A 67 2fosA_93F_68V}P -8.3882 4.9861 -5.9925 { n val A 68 2fosA_93F_68V}P -10.5789 3.9636 -6.1234 { ca val A 68 2fosA_93F_68V}P -11.9712 3.7362 -5.741 { n glu A 69 2fosA_93F_68V}P -12.4313 3.6344 -3.3305 { ca glu A 69 2fosA_93F_68V}P -12.3735 3.1821 -1.9572 { n phe A 70 2fosA_93F_68V}P -13.5015 1.4578 -0.7044 { ca phe A 70 2fosA_93F_68V}P -14.6014 0.6285 -0.2207 { n ile A 91 2fosA_93F_68V}P -10.2647 -3.2205 0.0557 { ca ile A 91 2fosA_93F_68V}P -10.1691 -1.8815 0.5659 { n gln A 92 2fosA_93F_68V}P -9.5939 -1.0675 -1.7114 { ca gln A 92 2fosA_93F_68V}P -9.5621 -0.1075 -2.803 { n phe A 93 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green alpha= 0.1176 master= {sidechain} { ca val A 68 2fosA_93F_68V}P -11.9712 3.7362 -5.741 { cb val A 68 2fosA_93F_68V}-12.7927 2.9731 -6.7597 { cg1 val A 68 2fosA_93F_68V}-14.1636 2.6143 -6.2087 { cb val A 68 2fosA_93F_68V}P -12.7927 2.9731 -6.7597 { cg2 val A 68 2fosA_93F_68V}-12.8947 3.794 -8.0553 { ca phe A 93 2fosA_93F_68V}P -8.8512 -0.5696 -6.4851 { cb phe A 93 2fosA_93F_68V}-9.738 -1.4069 -7.4257 { cg phe A 93 2fosA_93F_68V}-10.9102 -0.7325 -8.0829 { cd1 phe A 93 2fosA_93F_68V}-10.7751 0.1435 -9.1646 { ce1 phe A 93 2fosA_93F_68V}-11.8696 0.7541 -9.7591 { cz phe A 93 2fosA_93F_68V}-13.1426 0.44 -9.3221 { cg phe A 93 2fosA_93F_68V}P -10.9102 -0.7325 -8.0829 { cd2 phe A 93 2fosA_93F_68V}-12.2089 -1.0098 -7.6262 { ce2 phe A 93 2fosA_93F_68V}-13.327 -0.4148 -8.2495 { cz phe A 93 2fosA_93F_68V}ghost -13.1426 0.44 -9.3221 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val A 68 2fosA_93F_68V}P -12.7927 2.9731 -6.7597 { cg1 val A 68 2fosA_93F_68V}P -14.1636 2.6143 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-12.0999 1.7117 -7.4132 {"}'S' green -11.9722 1.5507 -7.2514 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 158 A}'S' P -13.3602 0.7319 -6.8784 {"}'S' -13.3547 0.7441 -6.8738 {"}'S' P -13.2295 0.6375 -6.6834 {"}'S' -13.216 0.6822 -6.6769 {"}'S' P -13.0821 0.5958 -6.4811 {"}'S' -13.0749 0.6426 -6.4836 {"}'S' P -12.9266 0.6078 -6.2832 {"}'S' -12.9266 0.6251 -6.287 {"}'S' P -13.2309 0.8172 -7.1655 {"}'S' -13.2116 0.87 -7.1307 {"}'S' P -13.1147 0.6854 -6.9801 {"}'S' -13.0898 0.8008 -6.9331 {"}'S' P -12.9782 0.6041 -6.78 {"}'S' -12.9655 0.7556 -6.7495 {"}'S' P -12.8258 0.5791 -6.5763 {"}'S' -12.8328 0.7232 -6.5726 {"}'S' P -12.6664 0.6095 -6.379 {"}'S' -12.6856 0.7054 -6.393 {"}'S' P -12.5084 0.6953 -6.1981 {"}'S' -12.5164 0.7178 -6.2056 {"}'S' P -13.1116 1.1168 -7.5049 {"}'S' -13.1102 1.1198 -7.5003 {"}'S' P -13.0405 0.9205 -7.3596 {"}'S' -13.0287 0.9873 -7.2937 {"}'S' P -12.9379 0.7677 -7.1845 {"}'S' -12.9302 0.9136 -7.0893 {"}'S' P -12.5045 0.6409 -6.5887 {"}'S' -12.5633 0.8109 -6.5814 {"}'S' P -12.3463 0.7177 -6.4055 {"}'S' -12.3934 0.809 -6.4172 {"}'S' P -12.1959 0.8491 -6.247 {"}'S' -12.1991 0.8531 -6.2488 {"}'S' P -12.8882 1.4528 -7.6778 {"}'S' -12.8878 1.4599 -7.6516 {"}'S' P -12.8688 1.2104 -7.5858 {"}'S' -12.8699 1.2455 -7.5183 {"}'S' P -12.8044 1.0015 -7.4432 {"}'S' -12.813 1.0762 -7.3541 {"}'S' P -12.2468 0.7727 -6.6596 {"}'S' -12.3378 0.9116 -6.6432 {"}'S' P -12.0895 0.891 -6.4888 {"}'S' -12.135 0.94 -6.492 {"}'S' P -12.6216 1.5638 -7.6704 {"}'S' -12.6304 1.5698 -7.6325 {"}'S' P -12.6213 1.3197 -7.6022 {"}'S' -12.6438 1.3555 -7.5113 {"}'S' P -12.5662 1.1084 -7.4735 {"}'S' -12.5994 1.1751 -7.377 {"}'S' P -12.4636 0.9556 -7.2984 {"}'S' -12.5303 1.0809 -7.1791 {"}'S' P -12.1701 0.8914 -6.8997 {"}'S' -12.2766 1.0195 -6.8474 {"}'S' P -12.014 0.9868 -6.7252 {"}'S' -12.0792 1.0439 -6.7112 {"}'S' P -12.3601 1.6449 -7.586 {"}'S' -12.3663 1.6458 -7.5743 {"}'S' P -12.3765 1.387 -7.5359 {"}'S' -12.4136 1.4141 -7.463 {"}'S' P -12.3087 1.1785 -7.3905 {"}'S' -12.3571 1.2263 -7.3206 {"}'S' P -12.1753 1.0758 -7.1899 {"}'S' -12.255 1.15 -7.1176 {"}'S' P -12.0117 1.1044 -6.9866 {"}'S' -12.076 1.152 -6.9537 {"}'S' P -12.1553 1.4577 -7.4138 {"}'S' -12.1742 1.4652 -7.3918 {"}'S' P -12.0503 1.3013 -7.2346 {"}'S' -12.0641 1.309 -7.2227 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { HB3 ALA 158 A}'S' P -12.8095 0.6669 -6.9893 {"}'S' -12.8234 0.8695 -6.906 {"}'S' P -12.6622 0.6239 -6.7868 {"}'S' -12.7037 0.8359 -6.7414 {"}'S' P -12.7007 0.8428 -7.2652 {"}'S' -12.732 0.9997 -7.1405 {"}'S' P -12.5658 0.7479 -7.0643 {"}'S' -12.6317 0.9561 -6.9559 {"}'S' P -12.41 0.7237 -6.8562 {"}'S' -12.5037 0.9259 -6.7945 {"}'S' P -12.3264 0.8806 -7.099 {"}'S' -12.4273 1.037 -6.9992 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 141 A}'M' green -9.3173 2.3281 -6.1397 {"}'M' green -9.2574 2.5783 -6.132 {"}'M' green -9.4148 2.2147 -6.3512 {"}'M' green -9.1587 2.8662 -6.2012 {"}'M' green -9.469 2.1162 -6.5839 {"}'M' green -9.1681 3.0032 -6.4418 {"}'M' green -9.4824 2.2081 -6.8847 {"}'M' sea -9.4681 1.966 -6.7996 {"}'M' green -9.1375 3.1042 -6.6879 {"}'M' green -9.3027 2.7872 -7.1302 {"}'M' green -9.3839 2.544 -7.1686 {"}'M' sea -9.4313 2.2896 -7.1582 {"}'M' sea -9.1907 3.0057 -7.0457 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 141 A}'M' greentint -9.401 2.4706 -6.4044 {"}'M' greentint -9.3073 2.7093 -6.3497 {"}'M' greentint -9.411 2.6129 -6.6472 {"}'M' greentint -9.4676 2.3635 -6.6504 {"}'M' greentint -9.3073 2.8352 -6.5749 {"}'M' greentint -9.3806 2.707 -6.892 {"}'M' greentint -9.4518 2.4618 -6.9162 {"}'M' greentint -9.2732 2.9266 -6.814 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ALA 158 A}'M' green -9.5381 2.1933 -6.2773 {"}'M' green -9.4135 2.3932 -6.1715 {"}'M' green -9.3249 2.6308 -6.1235 {"}'M' green -9.2804 2.8856 -6.1362 {"}'M' green -9.5923 2.1277 -6.6713 {"}'M' green -9.2145 2.9647 -6.4162 {"}'M' sea -9.2527 3.195 -6.5295 {"}'M' sea -9.6436 2.2663 -7.0397 {"}'M' green -9.4826 2.2943 -6.8397 {"}'M' green -9.2901 3.1394 -6.8259 {"}'M' green -9.5101 2.4841 -7.0932 {"}'M' sea -9.3994 2.9895 -7.0914 {"}'M' green -9.4284 2.7307 -7.1131 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 158 A}'M' greentint -9.438 2.2603 -6.5096 {"}'M' greentint -9.3138 2.4636 -6.405 {"}'M' greentint -9.2355 2.7093 -6.3729 {"}'M' greentint -9.3346 2.4463 -6.6909 {"}'M' greentint -9.2397 2.6804 -6.6335 {"}'M' greentint -9.2235 2.9341 -6.6829 {"}'M' greentint -9.3501 2.581 -6.9138 {"}'M' greentint -9.2952 2.8343 -6.9136 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 141 A}'M' green -10.1101 1.1756 -4.7353 {"}'M' green -9.3667 1.9185 -4.2442 {"}'M' green -9.8612 1.8221 -5.2005 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 141 A}'M' greentint -9.9052 1.379 -4.305 {"}'M' greentint -10.0384 1.2754 -4.5045 {"}'M' greentint -9.7193 1.4704 -4.147 {"}'M' greentint -9.8235 1.6256 -4.3249 {"}'M' greentint -9.9835 1.5287 -4.5043 {"}'M' greentint -10.0939 1.4293 -4.7846 {"}'M' greentint -9.5583 1.7417 -4.1803 {"}'M' greentint -9.69 1.8434 -4.3784 {"}'M' greentint -9.851 1.8154 -4.5784 {"}'M' greentint -9.999 1.6634 -4.7272 {"}'M' greentint -10.0656 1.5268 -5.0382 {"}'M' greentint -9.5016 2.0133 -4.4451 {"}'M' greentint -9.6605 2.0165 -4.651 {"}'M' greentint -9.8207 1.9254 -4.8338 {"}'M' greentint -9.9621 1.7549 -4.9694 {"}'M' greentint -9.4047 2.148 -4.7005 {"}'M' greentint -9.566 2.1088 -4.8984 {"}'M' greentint -9.7227 1.9968 -5.0698 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 158 A}'M' green -10.1221 1.2118 -4.5719 {"}'M' green -9.6563 1.5395 -4.0613 {"}'M' green -10.1957 1.3943 -5.0355 {"}'M' green -10.0675 1.606 -5.187 {"}'M' green -9.9278 1.8406 -5.2615 {"}'M' green -9.3866 2.1563 -4.6503 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 158 A}'M' greentint -9.9595 1.2675 -4.3778 {"}'M' greentint -9.8017 1.3778 -4.2043 {"}'M' greentint -10.0477 1.3472 -4.831 {"}'M' greentint -9.8886 1.3697 -4.6305 {"}'M' greentint -9.7288 1.4582 -4.4495 {"}'M' greentint -9.5821 1.6078 -4.3019 {"}'M' greentint -9.4584 1.8076 -4.1972 {"}'M' greentint -9.9291 1.5292 -4.9855 {"}'M' greentint -9.7703 1.5402 -4.7846 {"}'M' greentint -9.6133 1.6361 -4.6072 {"}'M' greentint -9.4748 1.8066 -4.4757 {"}'M' greentint -9.3719 2.0301 -4.4049 {"}'M' greentint -9.7948 1.737 -5.0613 {"}'M' greentint -9.6316 1.7662 -4.8586 {"}'M' greentint -9.4819 1.9199 -4.7078 {"}'M' greentint -9.6821 1.9668 -5.0965 {"}'M' greentint -9.5234 2.0642 -4.9189 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 200 2fwvA_202Y_219}P -11.7453 -1.828 0.8978 {"}-11.7453 -1.828 0.8978 { ca leu A 200 2fwvA_202Y_219}-10.983 -2.3078 -0.2766 { c leu A 200 2fwvA_202Y_219}-10.7601 -1.141 -1.2038 { o leu A 200 2fwvA_202Y_219}-11.7541 -0.5091 -1.6471 { c leu A 200 2fwvA_202Y_219}P -10.7601 -1.141 -1.2038 { n ala A 201 2fwvA_202Y_219}-9.4847 -0.8365 -1.4781 { ca ala A 201 2fwvA_202Y_219}-9.1363 0.2484 -2.4082 { c ala A 201 2fwvA_202Y_219}-8.4523 -0.3354 -3.6231 { o ala A 201 2fwvA_202Y_219}-7.8099 -1.3922 -3.5361 { c ala A 201 2fwvA_202Y_219}P -8.4523 -0.3354 -3.6231 { n tyr A 202 2fwvA_202Y_219}-8.5684 0.3469 -4.763 { ca tyr A 202 2fwvA_202Y_219}-7.7876 -0.0782 -5.9193 { c tyr A 202 2fwvA_202Y_219}-7.4821 1.0774 -6.8251 { o tyr A 202 2fwvA_202Y_219}-8.0956 2.1655 -6.726 { c tyr A 202 2fwvA_202Y_219}P -7.4821 1.0774 -6.8251 { n val A 203 2fwvA_202Y_219}-6.4668 0.8549 -7.6576 { ca val A 203 2fwvA_202Y_219}-6.1111 1.776 -8.7147 { c val A 203 2fwvA_202Y_219}-5.9867 0.9249 -9.9669 { o val A 203 2fwvA_202Y_219}-5.3748 -0.146 -9.9252 { c val A 203 2fwvA_202Y_219}P -5.9867 0.9249 -9.9669 { n glu A 204 2fwvA_202Y_219}-6.5672 1.3896 -11.0681 { ca glu A 204 2fwvA_202Y_219}-6.3392 0.7693 -12.3596 { c glu A 204 2fwvA_202Y_219}-5.658 1.7948 -13.2638 { o glu A 204 2fwvA_202Y_219}-6.1806 2.9083 -13.4325 { n leu A 217 2fwvA_202Y_219}P -8.6635 4.5294 -13.4007 {"}-8.6635 4.5294 -13.4007 { ca leu A 217 2fwvA_202Y_219}-9.6949 4.4289 -12.3865 { c leu A 217 2fwvA_202Y_219}-9.0648 4.326 -11.0045 { o leu A 217 2fwvA_202Y_219}-7.9313 3.8665 -10.8321 { c leu A 217 2fwvA_202Y_219}P -9.0648 4.326 -11.0045 { n ser A 218 2fwvA_202Y_219}-9.8207 4.7755 -10.0127 { ca ser A 218 2fwvA_202Y_219}-9.4827 4.4542 -8.6196 { c ser A 218 2fwvA_202Y_219}-10.7701 4.4211 -7.8101 { o ser A 218 2fwvA_202Y_219}-11.7516 5.0416 -8.1893 { c ser A 218 2fwvA_202Y_219}P -10.7701 4.4211 -7.8101 { n ala A 219 2fwvA_202Y_219}-10.7949 3.6702 -6.7157 { ca ala A 219 2fwvA_202Y_219}-12.0223 3.5834 -5.9024 { c ala A 219 2fwvA_202Y_219}-11.6553 3.1084 -4.5183 { o ala A 219 2fwvA_202Y_219}-10.5846 2.531 -4.309 { c ala A 219 2fwvA_202Y_219}P -11.6553 3.1084 -4.5183 { n arg A 220 2fwvA_202Y_219}-12.5463 3.3819 -3.5719 { ca arg A 220 2fwvA_202Y_219}-12.4069 2.9124 -2.2164 { c arg A 220 2fwvA_202Y_219}-13.7985 2.438 -1.8194 { o arg A 220 2fwvA_202Y_219}-14.7811 3.2069 -1.8973 { c arg A 220 2fwvA_202Y_219}P -13.7985 2.438 -1.8194 { n leu A 221 2fwvA_202Y_219}-13.9088 1.1636 -1.4639 { ca leu A 221 2fwvA_202Y_219}-15.1768 0.5212 -1.2321 { c leu A 221 2fwvA_202Y_219}-15.2815 0.0115 0.1936 { o leu A 221 2fwvA_202Y_219}-14.3031 -0.5527 0.7369 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 200 2fwvA_202Y_219}P -11.7453 -1.828 0.8978 { ca leu A 200 2fwvA_202Y_219}P -10.983 -2.3078 -0.2766 { n ala A 201 2fwvA_202Y_219}P -9.4847 -0.8365 -1.4781 { ca ala A 201 2fwvA_202Y_219}P -9.1363 0.2484 -2.4082 { n tyr A 202 2fwvA_202Y_219}P -8.5684 0.3469 -4.763 { ca tyr A 202 2fwvA_202Y_219}P -7.7876 -0.0782 -5.9193 { n val A 203 2fwvA_202Y_219}P -6.4668 0.8549 -7.6576 { ca val A 203 2fwvA_202Y_219}P -6.1111 1.776 -8.7147 { n glu A 204 2fwvA_202Y_219}P -6.5672 1.3896 -11.0681 { ca glu A 204 2fwvA_202Y_219}P -6.3392 0.7693 -12.3596 { n leu A 217 2fwvA_202Y_219}P -8.6635 4.5294 -13.4007 { ca leu A 217 2fwvA_202Y_219}P -9.6949 4.4289 -12.3865 { n ser A 218 2fwvA_202Y_219}P -9.8207 4.7755 -10.0127 { ca ser A 218 2fwvA_202Y_219}P -9.4827 4.4542 -8.6196 { n ala A 219 2fwvA_202Y_219}P -10.7949 3.6702 -6.7157 { ca ala A 219 2fwvA_202Y_219}P -12.0223 3.5834 -5.9024 { n arg A 220 2fwvA_202Y_219}P -12.5463 3.3819 -3.5719 { ca arg A 220 2fwvA_202Y_219}P -12.4069 2.9124 -2.2164 { n leu A 221 2fwvA_202Y_219}P -13.9088 1.1636 -1.4639 { ca leu A 221 2fwvA_202Y_219}P -15.1768 0.5212 -1.2321 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 200 2fwvA_202Y_219}P -10.983 -2.3078 -0.2766 {"}-10.983 -2.3078 -0.2766 { ca ala A 201 2fwvA_202Y_219}-9.1363 0.2484 -2.4082 { ca tyr A 202 2fwvA_202Y_219}-7.7876 -0.0782 -5.9193 { ca val A 203 2fwvA_202Y_219}-6.1111 1.776 -8.7147 { ca glu A 204 2fwvA_202Y_219}-6.3392 0.7693 -12.3596 { ca leu A 217 2fwvA_202Y_219}-9.6949 4.4289 -12.3865 { ca ser A 218 2fwvA_202Y_219}-9.4827 4.4542 -8.6196 { ca ala A 219 2fwvA_202Y_219}-12.0223 3.5834 -5.9024 { ca arg A 220 2fwvA_202Y_219}-12.4069 2.9124 -2.2164 { ca leu A 221 2fwvA_202Y_219}-15.1768 0.5212 -1.2321 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 202 2fwvA_202Y_219}P -7.7876 -0.0782 -5.9193 { cb tyr A 202 2fwvA_202Y_219}-8.4874 -1.2098 -6.7012 { cg tyr A 202 2fwvA_202Y_219}-9.7458 -0.738 -7.4266 { cd1 tyr A 202 2fwvA_202Y_219}-9.6445 -0.0262 -8.6246 { ce1 tyr A 202 2fwvA_202Y_219}-10.7915 0.4198 -9.3013 { cz tyr A 202 2fwvA_202Y_219}-12.0359 0.1368 -8.764 { oh tyr A 202 2fwvA_202Y_219}-13.1407 0.5737 -9.4372 { cg tyr A 202 2fwvA_202Y_219}P -9.7458 -0.738 -7.4266 { cd2 tyr A 202 2fwvA_202Y_219}-11.0108 -1.0017 -6.9082 { ce2 tyr A 202 2fwvA_202Y_219}-12.1662 -0.5422 -7.5566 { cz tyr A 202 2fwvA_202Y_219}ghost -12.0359 0.1368 -8.764 { ca ala A 219 2fwvA_202Y_219}P -12.0223 3.5834 -5.9024 { cb ala A 219 2fwvA_202Y_219}-13.0429 2.6325 -6.5317 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 202 2fwvA_202Y_219}P -8.4874 -1.2098 -6.7012 {"}P -8.4874 -1.2098 -6.7012 { cd1 tyr A 202 2fwvA_202Y_219}P -9.6445 -0.0262 -8.6246 { cd2 tyr A 202 2fwvA_202Y_219}P -11.0108 -1.0017 -6.9082 { ce1 tyr A 202 2fwvA_202Y_219}P -10.7915 0.4198 -9.3013 { ce2 tyr A 202 2fwvA_202Y_219}P -12.1662 -0.5422 -7.5566 { oh tyr A 202 2fwvA_202Y_219}P -13.1407 0.5737 -9.4372 { cb ala A 219 2fwvA_202Y_219}P -13.0429 2.6325 -6.5317 {"}P -13.0429 2.6325 -6.5317 {"}P -13.0429 2.6325 -6.5317 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 202 A}'S' blue -11.3919 0.6307 -6.4038 { CZ TYR 202 A}'S' blue -13.2615 1.1343 -8.0112 {"}'S' sky -13.1114 1.3428 -8.0928 {"}'S' blue -12.8348 1.653 -8.4092 {"}'S' sky -12.417 1.7692 -8.2595 {"}'S' sky -11.868 1.654 -7.9084 {"}'S' sky -11.996 1.757 -8.1034 @dotlist {x} color= white width= 1 master= {vdw contact} { CZ TYR 202 A}'S' green -12.9574 1.061 -7.5975 {"}'S' green -12.9537 1.3428 -7.8892 {"}'S' green -12.7538 1.507 -7.9457 {"}'S' sea -12.9081 1.5247 -8.1503 {"}'S' green -12.3808 1.5528 -7.795 {"}'S' green -12.5207 1.6337 -7.9978 {"}'S' sea -12.6737 1.6679 -8.2062 {"}'S' green -12.0161 1.5001 -7.6673 {"}'S' green -12.1337 1.6292 -7.8557 {"}'S' sea -12.2691 1.7194 -8.0546 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 202 A}'S' P -12.9411 0.5973 -6.4783 {"}'S' -12.9233 0.5713 -6.5027 {"}'S' P -13.0839 0.6638 -6.6819 {"}'S' -13.0597 0.6321 -6.7048 {"}'S' P -12.6202 0.6357 -6.3441 {"}'S' -12.6021 0.5876 -6.3938 {"}'S' P -12.7418 0.7577 -6.5364 {"}'S' -12.6952 0.6507 -6.6193 {"}'S' P -12.884 0.828 -6.7384 {"}'S' -12.8191 0.7048 -6.8128 {"}'S' P -13.0383 0.8457 -6.943 {"}'S' -12.984 0.759 -6.9823 {"}'S' P -13.1996 0.8079 -7.1412 {"}'S' -13.1902 0.7969 -7.1446 {"}'S' P -12.29 0.5818 -6.2205 {"}'S' -12.2897 0.5788 -6.2247 {"}'S' P -12.3888 0.7475 -6.3952 {"}'S' -12.3739 0.6601 -6.4744 {"}'S' P -12.804 0.9889 -6.9989 {"}'S' -12.7315 0.8144 -7.0616 {"}'S' P -12.965 0.974 -7.2019 {"}'S' -12.9152 0.8782 -7.2247 {"}'S' P -12.0487 0.6572 -6.2873 {"}'S' -12.0484 0.656 -6.2901 {"}'S' P -12.1464 0.8211 -6.46 {"}'S' -12.1477 0.7313 -6.5318 {"}'S' P -12.7031 1.0958 -7.2563 {"}'S' -12.6521 0.9414 -7.2846 {"}'S' P -12.8635 1.0596 -7.4536 {"}'S' -12.8394 1.0021 -7.457 {"}'S' P -11.8856 0.8373 -6.5174 {"}'S' -11.8932 0.7989 -6.5464 {"}'S' P -11.9983 0.975 -6.7011 {"}'S' -12.0111 0.8562 -6.7683 {"}'S' P -12.1262 1.078 -6.8961 {"}'S' -12.1309 0.8981 -6.9691 {"}'S' P -12.4206 1.171 -7.3025 {"}'S' -12.3978 1.012 -7.3256 {"}'S' P -11.7957 1.0234 -6.8676 {"}'S' -11.8087 0.9658 -6.8928 {"}'S' P -11.93 1.1218 -7.0685 {"}'S' -11.9442 1.0211 -7.0974 {"}'S' P -12.0768 1.1826 -7.2762 {"}'S' -12.0823 1.0775 -7.2922 { CZ TYR 202 A}'S' P -12.6919 1.1496 -7.4959 {"}'S' -12.6609 1.1022 -7.5555 {"}'S' P -12.8108 1.2763 -7.6856 {"}'S' -12.8051 1.2682 -7.6931 {"}'S' P -12.49 1.3147 -7.5515 {"}'S' -12.4667 1.2557 -7.6122 {"}'S' P -12.6115 1.4367 -7.7437 {"}'S' -12.6079 1.4267 -7.7502 {"}'S' P -12.1597 1.2608 -7.4278 {"}'S' -12.1536 1.2056 -7.4941 {"}'S' P -12.2586 1.4265 -7.6025 {"}'S' -12.2524 1.3882 -7.6366 {"}'S' P -11.9184 1.3362 -7.4947 {"}'S' -11.9188 1.3308 -7.5007 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { CE2 TYR 202 A}'S' P -12.5111 0.8738 -6.5877 {"}'S' -12.4704 0.7079 -6.701 {"}'S' P -12.651 0.9547 -6.7905 {"}'S' -12.5856 0.7519 -6.8941 {"}'S' P -12.2639 0.9502 -6.6484 {"}'S' -12.2529 0.7749 -6.7556 {"}'S' P -12.3993 1.0404 -6.8472 {"}'S' -12.3655 0.8119 -6.9504 {"}'S' P -12.5473 1.0902 -7.0522 {"}'S' -12.4956 0.8685 -7.1207 {"}'S' P -12.2687 1.1439 -7.099 {"}'S' -12.2567 0.9477 -7.1524 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 202 A}'S' blue -13.3946 1.2514 -8.2386 {"}'S' blue -13.2352 1.5424 -8.4306 {"}'S' blue -13.0029 1.6184 -8.515 { HH TYR 202 A}'S' blue -13.5859 1.1846 -8.1225 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 219 A}'S' blue -13.6718 1.4546 -7.6625 {"}'S' blue -13.491 1.6245 -7.8899 {"}'S' blue -13.4196 1.4276 -7.7439 {"}'S' sky -13.3267 1.2578 -7.5765 {"}'S' blue -13.2616 1.7271 -8.0133 {"}'S' sky -13.1979 1.5205 -7.874 {"}'S' sky -13.0188 1.826 -8.0851 {"}'S' sky -12.7712 1.931 -8.1125 {"}'S' sky -12.5244 2.0269 -8.0893 {"}'S' blue -12.2814 2.0825 -8.009 {"}'S' sky -11.9895 1.9546 -7.7535 {"}'S' blue -11.8536 1.8496 -7.5489 @dotlist {x} color= white width= 1 master= {vdw contact} { CB ALA 219 A}'S' sea -13.1112 1.3414 -7.7111 {"}'S' sea -12.9613 1.6114 -7.9506 {"}'S' green -12.876 1.4258 -7.7883 {"}'S' green -12.7197 1.7124 -7.9853 {"}'S' green -12.6369 1.5276 -7.8265 {"}'S' sea -12.4763 1.8061 -7.9663 {"}'S' green -12.3901 1.6245 -7.8053 {"}'S' sea -12.2244 1.863 -7.8742 {"}'S' sea -12.1178 1.7042 -7.6922 { HB3 ALA 219 A}'S' green -12.0812 1.5246 -7.6542 {"}'S' green -11.8765 1.3374 -7.482 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 219 A}'S' P -13.1901 0.7523 -7.1257 {"}'S' -13.1791 0.7689 -7.1162 {"}'S' P -13.0813 0.6116 -6.9466 {"}'S' -13.05 0.6783 -6.9241 {"}'S' P -12.9506 0.5172 -6.7515 {"}'S' -12.9205 0.6144 -6.7395 {"}'S' P -12.8033 0.4755 -6.5492 {"}'S' -12.7886 0.5655 -6.5548 {"}'S' P -12.6477 0.4875 -6.3514 {"}'S' -12.6461 0.5324 -6.361 {"}'S' P -13.0397 0.8731 -7.3971 {"}'S' -13.0248 0.8985 -7.3706 {"}'S' P -12.952 0.6969 -7.2337 {"}'S' -12.915 0.7953 -7.168 {"}'S' P -12.8358 0.5651 -7.0482 {"}'S' -12.8012 0.7279 -6.9816 {"}'S' P -12.6993 0.4838 -6.8481 {"}'S' -12.683 0.6765 -6.8084 {"}'S' P -12.5469 0.4588 -6.6444 {"}'S' -12.5554 0.6304 -6.6406 {"}'S' P -12.3875 0.4893 -6.4472 {"}'S' -12.4084 0.5957 -6.4625 {"}'S' P -12.2295 0.575 -6.2662 {"}'S' -12.236 0.5935 -6.2724 {"}'S' P -12.8672 1.2241 -7.6807 {"}'S' -12.8667 1.2253 -7.6786 {"}'S' P -12.8327 0.9965 -7.5731 {"}'S' -12.8252 1.0176 -7.5402 {"}'S' P -12.7616 0.8002 -7.4277 {"}'S' -12.7436 0.8978 -7.3314 {"}'S' P -12.2256 0.5206 -6.6569 {"}'S' -12.2836 0.6892 -6.6499 {"}'S' P -12.0675 0.5974 -6.4736 {"}'S' -12.1068 0.6744 -6.4835 {"}'S' P -12.6093 1.3325 -7.746 {"}'S' -12.6089 1.3425 -7.7085 {"}'S' P -12.5899 1.0902 -7.654 {"}'S' -12.5912 1.1324 -7.5714 {"}'S' P -12.5255 0.8813 -7.5113 {"}'S' -12.5349 0.9708 -7.4045 {"}'S' P -11.9679 0.6524 -6.7277 {"}'S' -12.0446 0.7695 -6.7141 {"}'S' P -11.8106 0.7708 -6.557 {"}'S' -11.8316 0.7935 -6.5583 {"}'S' P -12.3427 1.4436 -7.7385 {"}'S' -12.3493 1.4478 -7.7092 {"}'S' P -12.3424 1.1994 -7.6703 {"}'S' -12.3642 1.2348 -7.5817 {"}'S' P -12.2873 0.9881 -7.5417 {"}'S' -12.3202 1.0539 -7.4461 {"}'S' P -12.1847 0.8354 -7.3666 {"}'S' -12.2496 0.9577 -7.2508 {"}'S' P -12.0475 0.7604 -7.1671 {"}'S' -12.1397 0.9026 -7.0761 {"}'S' P -11.8912 0.7711 -6.9679 {"}'S' -11.9775 0.8753 -6.9251 {"}'S' P -11.7351 0.8665 -6.7933 {"}'S' -11.7687 0.8955 -6.7861 {"}'S' P -12.0976 1.2668 -7.6041 {"}'S' -12.1256 1.2872 -7.5496 {"}'S' P -12.0298 1.0583 -7.4587 {"}'S' -12.0674 1.0956 -7.4041 {"}'S' P -11.8964 0.9555 -7.258 {"}'S' -11.9571 1.0122 -7.2035 {"}'S' P -11.7329 0.9841 -7.0547 {"}'S' -11.7648 1.0075 -7.0388 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { HB3 ALA 219 A}'S' P -12.6591 0.6474 -7.2526 {"}'S' -12.6497 0.8262 -7.1355 {"}'S' P -12.5306 0.5467 -7.0575 {"}'S' -12.5471 0.7766 -6.9633 {"}'S' P -12.3833 0.5036 -6.8549 {"}'S' -12.4279 0.7299 -6.8069 {"}'S' P -12.4218 0.7225 -7.3334 {"}'S' -12.4557 0.893 -7.1982 {"}'S' P -12.2869 0.6277 -7.1325 {"}'S' -12.3538 0.8413 -7.0215 {"}'S' P -12.1311 0.6034 -6.9243 {"}'S' -12.2203 0.7962 -6.8663 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 202 A}'M' green -9.3277 2.3078 -6.0774 {"}'M' green -9.1088 2.6467 -5.8881 {"}'M' green -9.4251 2.1943 -6.289 {"}'M' green -9.0058 2.8792 -5.937 {"}'M' green -9.0198 3.076 -6.2011 {"}'M' green -9.4621 2.4415 -6.8539 {"}'M' sea -9.4927 2.1877 -6.8224 {"}'M' green -8.993 3.2069 -6.4609 {"}'M' green -9.3131 2.7668 -7.0679 {"}'M' green -9.3943 2.5236 -7.1063 {"}'M' sea -8.9121 3.3029 -6.6987 {"}'M' green -9.0644 3.167 -6.8586 {"}'M' green -9.201 2.9854 -6.9835 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 202 A}'M' greentint -9.2677 2.558 -6.0697 {"}'M' greentint -9.4113 2.4503 -6.3421 {"}'M' greentint -9.169 2.8459 -6.1389 {"}'M' greentint -9.3176 2.689 -6.2874 {"}'M' greentint -9.4214 2.5926 -6.5849 {"}'M' greentint -9.4779 2.3431 -6.5881 {"}'M' greentint -9.1784 2.9829 -6.3795 {"}'M' greentint -9.3176 2.8149 -6.5126 {"}'M' greentint -9.391 2.6866 -6.8297 {"}'M' greentint -9.1478 3.0838 -6.6256 {"}'M' greentint -9.2835 2.9063 -6.7517 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ALA 219 A}'M' green -9.5016 2.2831 -6.2958 {"}'M' green -9.3521 2.4285 -6.1434 {"}'M' green -9.2275 2.6284 -6.0376 {"}'M' green -9.1389 2.866 -5.9896 {"}'M' green -9.5686 2.3179 -6.7354 {"}'M' green -9.0285 3.1999 -6.2823 {"}'M' green -9.4576 2.5014 -6.9058 {"}'M' green -9.2424 2.9658 -6.9792 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 219 A}'M' greentint -9.4062 2.3629 -6.5374 {"}'M' greentint -9.252 2.4955 -6.3757 {"}'M' greentint -9.1278 2.6988 -6.2711 {"}'M' greentint -9.0495 2.9445 -6.239 {"}'M' greentint -9.2966 2.5295 -6.7058 {"}'M' greentint -9.1486 2.6814 -6.557 {"}'M' greentint -9.0537 2.9155 -6.4996 {"}'M' greentint -9.0375 3.1692 -6.5489 {"}'M' greentint -9.3241 2.7193 -6.9593 {"}'M' greentint -9.1641 2.8162 -6.7799 {"}'M' greentint -9.1092 3.0695 -6.7797 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 202 A}'M' green -10.0692 1.208 -4.5004 {"}'M' green -9.75 1.403 -4.1429 {"}'M' green -9.2838 2.0451 -4.4913 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 202 A}'M' greentint -9.9359 1.3116 -4.3009 {"}'M' greentint -9.8542 1.5582 -4.3208 {"}'M' greentint -10.0142 1.4612 -4.5002 {"}'M' greentint -10.1246 1.3619 -4.7805 {"}'M' greentint -9.589 1.6743 -4.1761 {"}'M' greentint -9.7207 1.776 -4.3743 {"}'M' greentint -9.8818 1.7479 -4.5743 {"}'M' greentint -10.0298 1.596 -4.7231 {"}'M' greentint -10.0963 1.4593 -5.0341 {"}'M' greentint -9.3974 1.851 -4.24 {"}'M' greentint -9.5323 1.9459 -4.4409 {"}'M' greentint -9.6912 1.949 -4.6468 {"}'M' greentint -9.8515 1.858 -4.8297 {"}'M' greentint -9.9929 1.6874 -4.9652 {"}'M' greentint -9.4355 2.0806 -4.6964 {"}'M' greentint -9.5968 2.0414 -4.8943 {"}'M' greentint -9.7534 1.9294 -5.0657 {"}'M' greentint -9.892 1.7546 -5.1964 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ALA 219 A}'M' green -9.9512 1.2888 -4.1798 {"}'M' green -10.1636 1.2978 -4.8208 {"}'M' green -9.5406 1.6209 -4.1046 {"}'M' green -9.3427 1.889 -4.2405 {"}'M' green -9.9517 1.6873 -5.2303 {"}'M' green -9.2561 2.1115 -4.4481 {"}'M' green -9.5664 2.0482 -5.1397 {"}'M' green -9.4077 2.1455 -4.9621 @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 219 A}'M' greentint -10.0064 1.2932 -4.6152 {"}'M' greentint -9.8438 1.3489 -4.421 {"}'M' greentint -9.6859 1.4591 -4.2475 {"}'M' greentint -10.08 1.4756 -5.0787 {"}'M' greentint -9.932 1.4286 -4.8742 {"}'M' greentint -9.7728 1.451 -4.6737 {"}'M' greentint -9.6131 1.5396 -4.4927 {"}'M' greentint -9.4664 1.6892 -4.3452 {"}'M' greentint -9.8134 1.6105 -5.0287 {"}'M' greentint -9.6546 1.6215 -4.8278 {"}'M' greentint -9.4975 1.7174 -4.6505 {"}'M' greentint -9.3591 1.888 -4.519 {"}'M' greentint -9.6791 1.8184 -5.1045 {"}'M' greentint -9.5159 1.8476 -4.9019 {"}'M' greentint -9.3661 2.0013 -4.751 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 60 2g2nA_88F_62Y}P -7.194 5.8581 -12.01 {"}-7.194 5.8581 -12.01 { ca gly A 60 2g2nA_88F_62Y}-7.3208 6.4678 -10.7059 { c gly A 60 2g2nA_88F_62Y}-7.7563 5.4652 -9.6659 { o gly A 60 2g2nA_88F_62Y}-7.8304 4.2693 -9.9333 { c gly A 60 2g2nA_88F_62Y}P -7.7563 5.4652 -9.6659 { n asp A 61 2g2nA_88F_62Y}-8.052 5.9752 -8.4775 { ca asp A 61 2g2nA_88F_62Y}-8.3819 5.1392 -7.3467 { c asp A 61 2g2nA_88F_62Y}-9.8693 4.9108 -7.2171 { o asp A 61 2g2nA_88F_62Y}-10.6721 5.7796 -7.5352 { c asp A 61 2g2nA_88F_62Y}P -9.8693 4.9108 -7.2171 { n tyr A 62 2g2nA_88F_62Y}-10.2062 3.7199 -6.7358 { ca tyr A 62 2g2nA_88F_62Y}-11.5836 3.2801 -6.546 { c tyr A 62 2g2nA_88F_62Y}-11.6982 2.503 -5.2419 { o tyr A 62 2g2nA_88F_62Y}-10.7081 2.0841 -4.644 { c tyr A 62 2g2nA_88F_62Y}P -11.6982 2.503 -5.2419 { n arg A 63 2g2nA_88F_62Y}-12.9206 2.2936 -4.7954 { ca arg A 63 2g2nA_88F_62Y}-13.1582 1.5911 -3.5501 { c arg A 63 2g2nA_88F_62Y}-14.3851 0.7415 -3.6813 { o arg A 63 2g2nA_88F_62Y}-15.439 1.2536 -4.0475 { c arg A 63 2g2nA_88F_62Y}P -14.3851 0.7415 -3.6813 { n val A 64 2g2nA_88F_62Y}-14.263 -0.5622 -3.4339 { ca val A 64 2g2nA_88F_62Y}-15.4369 -1.3951 -3.2248 { c val A 64 2g2nA_88F_62Y}-15.6248 -1.6019 -1.7443 { o val A 64 2g2nA_88F_62Y}-14.6567 -1.7351 -0.9973 { n val A 86 2g2nA_88F_62Y}P -12.2518 -1.9826 0.2835 {"}-12.2518 -1.9826 0.2835 { ca val A 86 2g2nA_88F_62Y}-11.0048 -2.3055 -0.401 { c val A 86 2g2nA_88F_62Y}-10.7459 -1.2462 -1.4577 { o val A 86 2g2nA_88F_62Y}-11.5421 -1.0766 -2.3898 { c val A 86 2g2nA_88F_62Y}P -10.7459 -1.2462 -1.4577 { n glu A 87 2g2nA_88F_62Y}-9.621 -0.5527 -1.326 { ca glu A 87 2g2nA_88F_62Y}-9.2239 0.4908 -2.2586 { c glu A 87 2g2nA_88F_62Y}-8.2561 -0.0777 -3.2651 { o glu A 87 2g2nA_88F_62Y}-7.3463 -0.7943 -2.8988 { c glu A 87 2g2nA_88F_62Y}P -8.2561 -0.0777 -3.2651 { n phe A 88 2g2nA_88F_62Y}-8.4642 0.2343 -4.535 { ca phe A 88 2g2nA_88F_62Y}-7.5999 -0.2448 -5.5871 { c phe A 88 2g2nA_88F_62Y}-7.4265 0.7828 -6.6955 { o phe A 88 2g2nA_88F_62Y}-8.2022 1.7514 -6.8045 { c phe A 88 2g2nA_88F_62Y}P -7.4265 0.7828 -6.6955 { n his A 89 2g2nA_88F_62Y}-6.4054 0.5684 -7.5185 { ca his A 89 2g2nA_88F_62Y}-6.0005 1.505 -8.5546 { c his A 89 2g2nA_88F_62Y}-6.225 0.8721 -9.9285 { o his A 89 2g2nA_88F_62Y}-5.8652 -0.2828 -10.1489 { c his A 89 2g2nA_88F_62Y}P -6.225 0.8721 -9.9285 { n ile A 90 2g2nA_88F_62Y}-6.8577 1.6243 -10.8266 { ca ile A 90 2g2nA_88F_62Y}-6.9671 1.2664 -12.2325 { c ile A 90 2g2nA_88F_62Y}-5.9751 2.1219 -12.9943 { o ile A 90 2g2nA_88F_62Y}-6.0328 3.3492 -12.9312 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 60 2g2nA_88F_62Y}P -7.194 5.8581 -12.01 { ca gly A 60 2g2nA_88F_62Y}P -7.3208 6.4678 -10.7059 {"}P -7.3208 6.4678 -10.7059 { n asp A 61 2g2nA_88F_62Y}P -8.052 5.9752 -8.4775 { ca asp A 61 2g2nA_88F_62Y}P -8.3819 5.1392 -7.3467 { n tyr A 62 2g2nA_88F_62Y}P -10.2062 3.7199 -6.7358 { ca tyr A 62 2g2nA_88F_62Y}P -11.5836 3.2801 -6.546 { n arg A 63 2g2nA_88F_62Y}P -12.9206 2.2936 -4.7954 { ca arg A 63 2g2nA_88F_62Y}P -13.1582 1.5911 -3.5501 { n val A 64 2g2nA_88F_62Y}P -14.263 -0.5622 -3.4339 { ca val A 64 2g2nA_88F_62Y}P -15.4369 -1.3951 -3.2248 { n val A 86 2g2nA_88F_62Y}P -12.2518 -1.9826 0.2835 { ca val A 86 2g2nA_88F_62Y}P -11.0048 -2.3055 -0.401 { n glu A 87 2g2nA_88F_62Y}P -9.621 -0.5527 -1.326 { ca glu A 87 2g2nA_88F_62Y}P -9.2239 0.4908 -2.2586 { n phe A 88 2g2nA_88F_62Y}P -8.4642 0.2343 -4.535 { ca phe A 88 2g2nA_88F_62Y}P -7.5999 -0.2448 -5.5871 { n his A 89 2g2nA_88F_62Y}P -6.4054 0.5684 -7.5185 { ca his A 89 2g2nA_88F_62Y}P -6.0005 1.505 -8.5546 { n ile A 90 2g2nA_88F_62Y}P -6.8577 1.6243 -10.8266 { ca ile A 90 2g2nA_88F_62Y}P -6.9671 1.2664 -12.2325 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 60 2g2nA_88F_62Y}P -7.3208 6.4678 -10.7059 {"}-7.3208 6.4678 -10.7059 { ca asp A 61 2g2nA_88F_62Y}-8.3819 5.1392 -7.3467 { ca tyr A 62 2g2nA_88F_62Y}-11.5836 3.2801 -6.546 { ca arg A 63 2g2nA_88F_62Y}-13.1582 1.5911 -3.5501 { ca val A 64 2g2nA_88F_62Y}-15.4369 -1.3951 -3.2248 { ca val A 86 2g2nA_88F_62Y}P -11.0048 -2.3055 -0.401 {"}-11.0048 -2.3055 -0.401 { ca glu A 87 2g2nA_88F_62Y}-9.2239 0.4908 -2.2586 { ca phe A 88 2g2nA_88F_62Y}-7.5999 -0.2448 -5.5871 { ca his A 89 2g2nA_88F_62Y}-6.0005 1.505 -8.5546 { ca ile A 90 2g2nA_88F_62Y}-6.9671 1.2664 -12.2325 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 62 2g2nA_88F_62Y}P -11.5836 3.2801 -6.546 { cb tyr A 62 2g2nA_88F_62Y}-12.0373 2.4289 -7.7425 { cg tyr A 62 2g2nA_88F_62Y}-12.0841 3.2246 -9.0185 { cd1 tyr A 62 2g2nA_88F_62Y}-13.2493 3.8848 -9.4135 { ce1 tyr A 62 2g2nA_88F_62Y}-13.2848 4.6487 -10.5745 { cz tyr A 62 2g2nA_88F_62Y}-12.1508 4.7881 -11.3479 { oh tyr A 62 2g2nA_88F_62Y}-12.2028 5.5507 -12.4988 { cg tyr A 62 2g2nA_88F_62Y}P -12.0841 3.2246 -9.0185 { cd2 tyr A 62 2g2nA_88F_62Y}-10.9462 3.3804 -9.8075 { ce2 tyr A 62 2g2nA_88F_62Y}-10.9708 4.1538 -10.9694 { cz tyr A 62 2g2nA_88F_62Y}ghost -12.1508 4.7881 -11.3479 { ca phe A 88 2g2nA_88F_62Y}P -7.5999 -0.2448 -5.5871 { cb phe A 88 2g2nA_88F_62Y}-8.1184 -1.5908 -6.127 { cg phe A 88 2g2nA_88F_62Y}-9.4337 -1.4842 -6.8503 { cd1 phe A 88 2g2nA_88F_62Y}-9.4752 -1.3891 -8.2258 { ce1 phe A 88 2g2nA_88F_62Y}-10.6924 -1.28 -8.8942 { cz phe A 88 2g2nA_88F_62Y}-11.8686 -1.2688 -8.1648 { cg phe A 88 2g2nA_88F_62Y}P -9.4337 -1.4842 -6.8503 { cd2 phe A 88 2g2nA_88F_62Y}-10.6301 -1.4702 -6.1357 { ce2 phe A 88 2g2nA_88F_62Y}-11.8372 -1.3609 -6.7868 { cz phe A 88 2g2nA_88F_62Y}ghost -11.8686 -1.2688 -8.1648 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 62 2g2nA_88F_62Y}P -12.0373 2.4289 -7.7425 {"}P -12.0373 2.4289 -7.7425 { cd1 tyr A 62 2g2nA_88F_62Y}P -13.2493 3.8848 -9.4135 { cd2 tyr A 62 2g2nA_88F_62Y}P -10.9462 3.3804 -9.8075 { ce1 tyr A 62 2g2nA_88F_62Y}P -13.2848 4.6487 -10.5745 { ce2 tyr A 62 2g2nA_88F_62Y}P -10.9708 4.1538 -10.9694 { oh tyr A 62 2g2nA_88F_62Y}P -12.2028 5.5507 -12.4988 { cb phe A 88 2g2nA_88F_62Y}P -8.1184 -1.5908 -6.127 {"}P -8.1184 -1.5908 -6.127 { cd1 phe A 88 2g2nA_88F_62Y}P -9.4752 -1.3891 -8.2258 { cd2 phe A 88 2g2nA_88F_62Y}P -10.6301 -1.4702 -6.1357 { ce1 phe A 88 2g2nA_88F_62Y}P -10.6924 -1.28 -8.8942 { ce2 phe A 88 2g2nA_88F_62Y}P -11.8372 -1.3609 -6.7868 { cz phe A 88 2g2nA_88F_62Y}P -11.8686 -1.2688 -8.1648 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 88 A}'S' sky -10.7902 0.2124 -7.9859 {"}'S' sky -11.2294 0.358 -8.5938 {"}'S' blue -11.3898 0.3218 -8.7911 {"}'S' blue -10.5245 0.2372 -8.0386 {"}'S' sky -10.6525 0.3402 -8.2336 {"}'S' sky -10.9468 0.4332 -8.6401 {"}'S' blue -11.1045 0.4201 -8.8406 {"}'S' blue -10.4563 0.384 -8.4061 {"}'S' blue -10.6031 0.4448 -8.6138 {"}'S' blue -10.7597 0.4678 -8.8211 { CE2 PHE 88 A}'S' blue -12.066 0.3694 -6.9186 {"}'S' blue -12.2299 0.3127 -7.1143 {"}'S' blue -11.7255 0.3812 -6.9105 {"}'S' blue -11.8876 0.3578 -7.113 {"}'S' blue -12.0513 0.2963 -7.3073 {"}'S' sky -11.517 0.338 -7.0616 {"}'S' sky -11.6787 0.315 -7.2655 {"}'S' sky -11.3019 0.2558 -7.1898 {"}'S' blue -11.09 0.1373 -7.2969 { CZ PHE 88 A}'S' blue -12.1018 0.3137 -7.4554 {"}'S' sky -12.2497 0.3635 -7.6604 {"}'S' sky -12.4056 0.3691 -7.8645 {"}'S' blue -12.566 0.3329 -8.0618 {"}'S' sky -12.2807 0.4312 -8.1113 {"}'S' blue -12.4415 0.3787 -8.3037 {"}'S' blue -12.2613 0.4048 -8.4924 {"}'S' sky -11.1907 0.1904 -7.4774 {"}'S' sky -10.9828 0.1419 -7.6299 {"}'S' sky -11.7102 0.4071 -8.6436 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 88 A}'S' sea -10.9256 0.3026 -8.1848 {"}'S' sea -11.0735 0.3524 -8.3897 {"}'S' sea -10.7949 0.4061 -8.4365 { CZ PHE 88 A}'S' sea -11.8287 0.3513 -7.5043 {"}'S' sea -11.9711 0.4172 -7.7072 {"}'S' sea -12.123 0.4444 -7.9107 {"}'S' sea -11.4981 0.2968 -7.4758 {"}'S' green -11.6324 0.3952 -7.6768 {"}'S' green -11.7792 0.456 -7.8844 {"}'S' green -11.9359 0.4789 -8.0918 {"}'S' sea -12.0974 0.4615 -8.2967 {"}'S' green -11.313 0.315 -7.6713 {"}'S' green -11.4509 0.406 -7.8737 {"}'S' green -11.7569 0.4733 -8.2885 {"}'S' sea -11.9191 0.4499 -8.4911 {"}'S' sea -11.105 0.2682 -7.8224 {"}'S' green -11.2422 0.3591 -8.0254 {"}'S' green -11.3908 0.4129 -8.2323 {"}'S' green -11.5484 0.4301 -8.4397 {"}'S' sea -11.1775 0.3265 -8.3602 {"}'S' sea -11.3333 0.3479 -8.5678 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 88 A}'S' P -11.6 0.459 -8.0811 {"}'S' -11.6005 0.4568 -8.0812 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 62 A}'S' blue -12.5101 0.7455 -7.6678 {"}'S' blue -12.3524 0.731 -7.4609 {"}'S' blue -12.1903 0.7545 -7.2584 {"}'S' blue -12.0275 0.816 -7.0636 {"}'S' blue -12.4596 0.7565 -8.0404 {"}'S' sky -12.3109 0.7027 -7.8335 {"}'S' sky -12.1536 0.6863 -7.6251 {"}'S' blue -12.3388 0.8063 -8.3259 {"}'S' sky -12.1967 0.728 -8.1206 {"}'S' blue -12.081 0.8113 -8.4087 { HB2 TYR 62 A}'S' sky -12.0672 0.6677 -7.6992 {"}'S' sky -11.92 0.6246 -7.4967 {"}'S' sky -11.7626 0.6425 -7.2976 {"}'S' blue -11.6044 0.7194 -7.1144 {"}'S' sky -11.3803 0.6135 -7.206 {"}'S' sky -11.2342 0.5029 -7.4185 {"}'S' blue -11.0813 0.619 -7.2531 {"}'S' blue -10.9746 0.5259 -7.5201 {"}'S' sky -11.1669 0.6735 -8.5873 {"}'S' sky -10.713 0.6033 -7.9816 {"}'S' sky -10.9298 0.7863 -8.6205 {"}'S' sky -10.7927 0.7113 -8.4211 {"}'S' blue -10.6363 0.7221 -8.2218 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 TYR 62 A}'S' green -11.9874 0.6038 -7.9874 {"}'S' green -11.8501 0.5223 -7.7879 {"}'S' green -11.6982 0.4965 -7.5846 {"}'S' sea -11.5388 0.527 -7.3874 {"}'S' sea -11.9352 0.7032 -8.3796 {"}'S' green -11.8264 0.5625 -8.2005 {"}'S' green -11.6957 0.4681 -8.0054 {"}'S' green -11.5484 0.4265 -7.8031 {"}'S' green -11.3929 0.4384 -7.6053 {"}'S' sea -11.6971 0.6478 -8.4876 {"}'S' green -11.581 0.5161 -8.3021 {"}'S' green -11.4444 0.4347 -8.1021 {"}'S' green -11.292 0.4097 -7.8983 {"}'S' sea -11.1326 0.4402 -7.7011 {"}'S' sea -11.4042 0.5984 -8.5065 {"}'S' green -11.2757 0.4976 -8.3114 {"}'S' green -11.1285 0.4545 -8.1088 {"}'S' sea -10.9703 0.4723 -7.9104 {"}'S' sea -11.032 0.5786 -8.3864 {"}'S' sea -10.8763 0.5544 -8.1782 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 88 A}'M' greentint -9.2153 2.2326 -5.9665 {"}'M' greentint -9.3743 2.1439 -6.1481 {"}'M' greentint -9.5178 2.0361 -6.4206 {"}'M' greentint -9.1123 2.4651 -6.0155 {"}'M' greentint -9.2756 2.4317 -6.2173 {"}'M' greentint -9.4242 2.2748 -6.3658 {"}'M' greentint -9.5279 2.1785 -6.6633 {"}'M' greentint -8.9684 2.6702 -6.0775 {"}'M' greentint -9.1263 2.6619 -6.2795 {"}'M' greentint -9.2849 2.5687 -6.4579 {"}'M' greentint -9.4242 2.4008 -6.5911 {"}'M' greentint -9.4975 2.2725 -6.9081 {"}'M' greentint -8.7832 2.8403 -6.1435 {"}'M' greentint -8.9393 2.851 -6.3473 {"}'M' greentint -9.0995 2.7928 -6.5393 {"}'M' greentint -9.2543 2.6697 -6.704 {"}'M' greentint -9.39 2.4921 -6.8302 {"}'M' greentint -9.4196 2.3527 -7.1463 {"}'M' greentint -8.6961 2.9944 -6.3894 {"}'M' greentint -8.8566 2.971 -6.5914 {"}'M' greentint -9.0187 2.8888 -6.7771 {"}'M' greentint -9.1709 2.7529 -6.9371 {"}'M' greentint -9.3076 2.5713 -7.0619 {"}'M' greentint -8.6026 3.0849 -6.6582 {"}'M' greentint -8.7618 3.0338 -6.8504 {"}'M' greentint -8.9176 2.9351 -7.0237 {"}'M' greentint -9.0637 2.7915 -7.1736 {"}'M' greentint -9.1945 2.6095 -7.292 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 62 A}'M' greentint -9.5347 2.0462 -6.6253 {"}'M' greentint -9.3804 2.0455 -6.4262 {"}'M' greentint -9.2222 2.1092 -6.2399 {"}'M' greentint -9.0719 2.2336 -6.0801 {"}'M' greentint -8.9388 2.4092 -5.957 {"}'M' greentint -9.4712 2.1775 -6.9803 {"}'M' greentint -9.3298 2.1045 -6.7772 {"}'M' greentint -9.1716 2.1067 -6.5735 {"}'M' greentint -9.0109 2.1826 -6.3866 {"}'M' greentint -8.8614 2.328 -6.2342 {"}'M' greentint -8.7368 2.528 -6.1284 {"}'M' greentint -8.6482 2.7656 -6.0803 {"}'M' greentint -9.3427 2.4041 -7.2205 {"}'M' greentint -9.2267 2.2671 -7.0323 {"}'M' greentint -9.0779 2.2175 -6.8262 {"}'M' greentint -8.9156 2.2624 -6.6282 {"}'M' greentint -8.7613 2.395 -6.4665 {"}'M' greentint -8.6371 2.5984 -6.3619 {"}'M' greentint -8.5588 2.844 -6.3298 {"}'M' greentint -9.0987 2.5027 -7.1948 {"}'M' greentint -8.9669 2.401 -6.9966 {"}'M' greentint -8.8059 2.429 -6.7966 {"}'M' greentint -8.6579 2.581 -6.6478 {"}'M' greentint -8.5631 2.8151 -6.5904 {"}'M' greentint -8.5468 3.0688 -6.6397 {"}'M' greentint -8.9376 2.774 -7.228 {"}'M' greentint -8.8334 2.6188 -7.0501 {"}'M' greentint -8.6734 2.7157 -6.8707 {"}'M' greentint -8.6185 2.969 -6.8705 {"}'M' greentint -8.7517 2.8654 -7.07 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 88 A}'M' greentint -9.9964 0.9778 -4.2476 {"}'M' greentint -10.1297 0.8742 -4.4471 {"}'M' greentint -9.9148 1.2244 -4.2675 {"}'M' greentint -10.0747 1.1275 -4.4469 {"}'M' greentint -10.1851 1.0281 -4.7272 {"}'M' greentint -9.6495 1.3405 -4.1228 {"}'M' greentint -9.7813 1.4423 -4.321 {"}'M' greentint -9.9423 1.4142 -4.521 {"}'M' greentint -10.0903 1.2622 -4.6698 {"}'M' greentint -10.1568 1.1256 -4.9808 {"}'M' greentint -10.2072 0.8709 -4.9762 {"}'M' greentint -9.5929 1.6121 -4.3876 {"}'M' greentint -9.7517 1.6153 -4.5936 {"}'M' greentint -9.912 1.5242 -4.7764 {"}'M' greentint -10.0534 1.3537 -4.912 {"}'M' greentint -10.06 1.1999 -5.2208 {"}'M' 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{"}'S' P -10.7818 0.7842 -10.0582 {"}'S' -10.7833 0.7728 -10.0543 { CZ PHE 15 A}'S' P -12.1173 0.5791 -8.2259 {"}'S' -12.1176 0.5729 -8.2283 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 48 A}'S' sky -12.7005 0.5994 -7.4675 {"}'S' sky -12.5486 0.5581 -7.2589 {"}'S' sky -12.3888 0.5551 -7.0519 {"}'S' blue -12.2259 0.5919 -6.8513 {"}'S' sky -12.8116 0.7524 -8.0814 {"}'S' sky -12.6884 0.6277 -7.8881 {"}'S' sky -11.9191 0.5552 -6.873 {"}'S' sky -12.7155 0.8705 -8.4248 {"}'S' sky -11.413 0.9196 -8.6636 {"}'S' blue -11.1582 1.0317 -8.6367 { CG TYR 48 A}'S' blue -12.69 0.9951 -8.6952 {"}'S' sky -12.6923 0.9746 -9.1209 {"}'S' sky -12.5432 0.9216 -8.9136 {"}'S' sky -12.4926 0.9326 -9.2861 {"}'S' blue -12.3719 0.9825 -9.5716 {"}'S' sky -12.2298 0.9041 -9.3664 {"}'S' blue -12.1141 0.9875 -9.6545 {"}'S' sky -11.9729 0.9206 -9.4531 {"}'S' sky -11.663 0.9046 -9.0481 {"}'S' sky -11.5027 0.955 -8.8558 { CD2 TYR 48 A}'S' sky -11.7678 0.9202 -9.8015 {"}'S' sky -11.2977 0.8662 -10.4693 {"}'S' sky -11.0399 0.8712 -10.5521 {"}'S' sky -10.6861 0.8748 -10.4864 { HB2 TYR 48 A}'S' sky -11.5922 0.4285 -6.9372 {"}'S' sky -11.2099 0.3995 -6.8456 {"}'S' sky -10.9109 0.405 -6.8927 {"}'S' blue -10.6541 0.4477 -7.0044 {"}'S' sky -10.9581 0.2405 -7.7484 {"}'S' sky -10.7999 0.2583 -7.55 {"}'S' sky -10.6422 0.3343 -7.3671 {"}'S' blue -10.4917 0.4657 -7.2086 {"}'S' sky -11.1646 0.827 -8.5475 {"}'S' sky -10.7058 0.3403 -7.8178 {"}'S' sky -10.5426 0.3893 -7.6212 {"}'S' blue -10.3854 0.5077 -7.4505 {"}'S' sky -10.9171 0.9363 -8.5638 {"}'S' sky -10.6222 0.4972 -8.0607 {"}'S' sky -10.4659 0.508 -7.8614 {"}'S' blue -10.3098 0.6034 -7.6869 {"}'S' blue -10.6045 0.7952 -8.3522 {"}'S' blue -10.4711 0.6924 -8.1516 {"}'S' blue -10.3076 0.721 -7.9482 { HB3 TYR 48 A}'S' blue -12.9797 0.5921 -7.4612 {"}'S' blue -12.8273 0.5672 -7.2575 {"}'S' blue -12.6679 0.5976 -7.0602 {"}'S' blue -12.9395 0.7558 -7.8657 {"}'S' blue -12.811 0.655 -7.6705 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 48 A}'S' sea -12.5509 0.5376 -7.6846 {"}'S' sea -12.4018 0.4846 -7.4773 {"}'S' sea -12.2441 0.4701 -7.2704 {"}'S' sea -12.0819 0.4936 -7.0678 {"}'S' sea -12.6106 0.7128 -8.2454 {"}'S' green -12.4887 0.5874 -8.0519 {"}'S' green -12.3512 0.4956 -7.8499 {"}'S' green -12.2026 0.4418 -7.643 {"}'S' green -12.0453 0.4255 -7.4345 {"}'S' green -11.8832 0.4475 -7.2317 {"}'S' sea -12.467 0.8102 -8.5157 {"}'S' green -12.3572 0.6611 -8.3316 {"}'S' green -12.2304 0.5455 -8.1353 {"}'S' green -12.0884 0.4671 -7.9301 {"}'S' green -11.936 0.4262 -7.7228 {"}'S' green -12.2128 0.7933 -8.5967 {"}'S' green -12.101 0.654 -8.4139 {"}'S' green -11.8315 0.4836 -8.0169 {"}'S' green -11.8878 0.7308 -8.5501 {"}'S' green -11.7608 0.6221 -8.3552 {"}'S' sea -11.6514 0.8135 -8.6252 {"}'S' sea -11.5202 0.7082 -8.4269 { CG TYR 48 A}'S' sea -12.3855 0.9071 -8.7067 {"}'S' sea -12.344 0.8788 -9.0792 {"}'S' sea -12.1867 0.8625 -8.8708 {"}'S' sea -12.0774 0.8632 -9.1591 {"}'S' sea -11.918 0.8626 -8.9513 {"}'S' sea -11.7542 0.9006 -8.7515 {"}'S' sea -11.8206 0.8929 -9.2489 { CD2 TYR 48 A}'S' green -11.6158 0.8789 -9.5929 {"}'S' green -11.4561 0.8759 -9.3859 {"}'S' green -11.2931 0.9127 -9.1852 {"}'S' sea -11.1296 0.9883 -8.996 {"}'S' sea -11.6181 0.8584 -10.0186 {"}'S' green -11.469 0.8053 -9.8112 {"}'S' green -10.9864 0.8759 -9.207 {"}'S' sea -10.826 0.9736 -9.0271 {"}'S' green -11.4184 0.8164 -10.1838 {"}'S' green -10.6268 0.9256 -9.19 {"}'S' green -11.1556 0.7878 -10.264 {"}'S' green -10.5173 0.8601 -9.4594 {"}'S' sea -10.3589 0.9739 -9.286 {"}'S' green -10.8987 0.8044 -10.3508 {"}'S' green -10.7464 0.7766 -10.1466 {"}'S' green -10.5888 0.7883 -9.9458 {"}'S' green -10.4285 0.8387 -9.7535 {"}'S' sea -10.2704 0.9272 -9.573 {"}'S' sea -10.5334 0.8479 -10.2817 {"}'S' sea -10.3743 0.8648 -10.0802 {"}'S' sea -10.2129 0.9236 -9.8884 { HB2 TYR 48 A}'S' sea -11.7495 0.4106 -7.1363 {"}'S' green -11.817 0.3897 -7.627 {"}'S' green -11.6797 0.3082 -7.4275 {"}'S' green 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TYR 48 A}'S' P -11.3113 0.7909 -9.6044 {"}'S' -11.3093 0.8034 -9.6062 {"}'S' P -11.1492 0.8144 -9.4018 {"}'S' -11.1485 0.8246 -9.4049 {"}'S' P -11.2698 0.7626 -9.9769 {"}'S' -11.2687 0.7714 -9.9757 {"}'S' P -11.1125 0.7462 -9.7685 {"}'S' -11.1099 0.7923 -9.7719 {"}'S' P -10.9504 0.7683 -9.5657 {"}'S' -10.9516 0.8129 -9.574 {"}'S' P -10.7881 0.8291 -9.3713 {"}'S' -10.7884 0.8339 -9.3728 {"}'S' P -11.0032 0.747 -10.0567 {"}'S' -11.0029 0.7683 -10.0543 {"}'S' P -10.8438 0.7463 -9.849 {"}'S' -10.8473 0.7894 -9.8499 {"}'S' P -10.6801 0.7843 -9.6492 {"}'S' -10.685 0.8096 -9.6532 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 15 A}'M' greentint -9.3571 2.2534 -6.5341 {"}'M' greentint -9.5057 2.0964 -6.6826 {"}'M' greentint -9.6094 2.0001 -6.9801 {"}'M' greentint -9.0499 2.4919 -6.3943 {"}'M' greentint -9.2079 2.4835 -6.5963 {"}'M' greentint -9.3664 2.3903 -6.7747 {"}'M' greentint -9.5057 2.2224 -6.9078 {"}'M' greentint -9.579 2.0941 -7.2249 {"}'M' greentint -8.8647 2.662 -6.4603 {"}'M' greentint -9.0209 2.6726 -6.6641 {"}'M' greentint -9.1811 2.6144 -6.8561 {"}'M' greentint -9.3358 2.4913 -7.0208 {"}'M' greentint -9.4716 2.3138 -7.1469 {"}'M' greentint -9.5011 2.1743 -7.4631 {"}'M' greentint -9.5823 1.9311 -7.5015 {"}'M' greentint -8.7776 2.816 -6.7062 {"}'M' greentint -8.9381 2.7926 -6.9082 {"}'M' greentint -9.1002 2.7104 -7.0939 {"}'M' greentint -9.2524 2.5745 -7.2539 {"}'M' greentint -9.3891 2.3929 -7.3787 {"}'M' greentint -9.3866 2.2191 -7.6928 {"}'M' greentint -8.6841 2.9066 -6.975 {"}'M' greentint -8.8433 2.8554 -7.1672 {"}'M' greentint -8.9991 2.7567 -7.3405 {"}'M' greentint -9.1452 2.6131 -7.4904 {"}'M' greentint -9.276 2.4311 -7.6088 {"}'M' greentint -8.6865 2.8899 -7.3726 {"}'M' greentint -8.8434 2.784 -7.5457 {"}'M' greentint -8.99 2.6369 -7.6955 {"}'M' greentint -9.1221 2.4539 -7.8155 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 48 A}'M' greentint -9.5214 1.8961 -6.7814 {"}'M' greentint -9.3665 1.9933 -6.609 {"}'M' greentint -9.2252 2.1441 -6.4673 {"}'M' greentint -9.1046 2.3383 -6.3656 {"}'M' greentint -9.5651 1.8568 -7.2559 {"}'M' greentint -9.4108 1.8561 -7.0568 {"}'M' greentint -9.2526 1.9198 -6.8705 {"}'M' greentint -9.1023 2.0442 -6.7106 {"}'M' greentint -8.9692 2.2198 -6.5875 {"}'M' greentint -8.864 2.4345 -6.5098 {"}'M' greentint -8.7905 2.6743 -6.4829 {"}'M' greentint -9.5016 1.9881 -7.6109 {"}'M' greentint -9.3602 1.915 -7.4078 {"}'M' greentint -9.202 1.9172 -7.2041 {"}'M' greentint -9.0413 1.9932 -7.0172 {"}'M' greentint -8.8918 2.1386 -6.8648 {"}'M' greentint -8.7672 2.3386 -6.759 {"}'M' greentint -8.6786 2.5762 -6.7109 {"}'M' greentint -8.6341 2.8309 -6.7236 {"}'M' greentint -9.257 2.0777 -7.6628 {"}'M' greentint -9.1083 2.0281 -7.4567 {"}'M' greentint -8.9459 2.073 -7.2588 {"}'M' greentint -8.7917 2.2056 -7.0971 {"}'M' greentint -8.6675 2.4089 -6.9924 {"}'M' greentint -8.5892 2.6546 -6.9603 {"}'M' greentint -8.5682 2.91 -7.0036 {"}'M' greentint -9.129 2.3133 -7.8253 {"}'M' greentint -8.9973 2.2116 -7.6272 {"}'M' greentint -8.8363 2.2396 -7.4272 {"}'M' greentint -8.6883 2.3916 -7.2783 {"}'M' greentint -8.5934 2.6257 -7.221 {"}'M' greentint -8.5772 2.8794 -7.2703 {"}'M' greentint -8.8638 2.4294 -7.6807 {"}'M' greentint -8.7038 2.5263 -7.5013 {"}'M' greentint -8.6489 2.7796 -7.501 {"}'M' greentint -8.7821 2.676 -7.7005 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 15 A}'M' green -10.3216 0.5678 -5.0547 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 15 A}'M' greentint -10.1166 0.7713 -4.6244 {"}'M' greentint -10.2498 0.6676 -4.8239 {"}'M' greentint -9.9307 0.8627 -4.4664 {"}'M' greentint -10.0349 1.0178 -4.6443 {"}'M' greentint -10.1949 0.9209 -4.8237 {"}'M' greentint -10.3053 0.8215 -5.104 {"}'M' greentint -9.7697 1.1339 -4.4996 {"}'M' greentint -9.9014 1.2357 -4.6978 {"}'M' greentint -10.0624 1.2076 -4.8978 {"}'M' greentint -10.2105 1.0557 -5.0466 {"}'M' greentint -10.277 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-5.4681 {"}'M' greentint -9.9684 0.9106 -5.2672 {"}'M' greentint -9.8114 1.0065 -5.0898 {"}'M' greentint -9.6729 1.177 -4.9583 {"}'M' greentint -9.57 1.4005 -4.8874 {"}'M' greentint -9.993 1.1074 -5.5438 {"}'M' greentint -9.8298 1.1366 -5.3412 {"}'M' greentint -9.68 1.2904 -5.1904 {"}'M' greentint -9.5847 1.5267 -5.1329 {"}'M' greentint -9.8803 1.3372 -5.579 {"}'M' greentint -9.7216 1.4346 -5.4014 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 152 2g6yA_154F_170}P -12.1829 -1.8126 0.7063 {"}-12.1829 -1.8126 0.7063 { ca gly A 152 2g6yA_154F_170}-11.3546 -2.1378 -0.4473 { c gly A 152 2g6yA_154F_170}-10.8108 -0.8419 -1.0423 { o gly A 152 2g6yA_154F_170}-11.4341 0.2283 -1.0055 { c gly A 152 2g6yA_154F_170}P -10.8108 -0.8419 -1.0423 { n ser A 153 2g6yA_154F_170}-9.6099 -0.9361 -1.5975 { ca ser A 153 2g6yA_154F_170}-9.0385 0.1519 -2.367 { c ser A 153 2g6yA_154F_170}-8.1427 -0.411 -3.4801 { o ser A 153 2g6yA_154F_170}-7.3701 -1.3712 -3.3156 { c 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0.0746 -7.637 { CG2 VAL 170 A}'S' sea -11.4427 0.4356 -8.4708 {"}'S' sea -11.2799 0.5114 -8.281 {"}'S' green -11.1911 0.49 -8.5751 {"}'S' green -11.033 0.5785 -8.3946 {"}'S' green -10.9756 0.5749 -8.71 {"}'S' green -10.8176 0.6749 -8.534 {"}'S' green -10.8837 0.6477 -8.9701 {"}'S' green -10.7223 0.7328 -8.7844 {"}'S' sea -10.8014 0.7655 -9.2144 {"}'S' sea -10.6402 0.832 -9.0246 { HB VAL 170 A}'S' sea -11.3847 0.1622 -7.6147 {"}'S' sea -11.2685 0.0304 -7.4293 {"}'S' sea -11.1319 -0.051 -7.2292 {"}'S' sea -11.1943 0.2654 -7.8087 {"}'S' sea -11.0917 0.1127 -7.6337 {"}'S' sea -10.9633 0.0119 -7.4385 {"}'S' sea -10.9581 0.3465 -7.8924 {"}'S' green -10.8545 0.1878 -7.7144 {"}'S' sea -10.7196 0.0929 -7.5135 {"}'S' sea -10.7199 0.4534 -7.9227 {"}'S' sea -10.6173 0.3006 -7.7476 {"}'S' sea -10.4802 0.2256 -7.5482 {"}'S' sea -10.3239 0.2364 -7.3489 {"}'S' sea -10.3291 0.4208 -7.6391 {HG11 VAL 170 A}'S' sea -13.1378 -0.7682 -7.5531 {"}'S' sea -12.9796 -0.7505 -7.3546 {"}'S' sea -12.8219 -0.6745 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greentint -8.6534 3.1256 -6.4276 {"}'M' greentint -8.8135 3.1016 -6.629 {"}'M' greentint -8.9759 3.02 -6.8153 {"}'M' greentint -9.1282 2.8841 -6.9753 {"}'M' greentint -9.2648 2.7025 -7.1001 {"}'M' greentint -8.5599 3.2161 -6.6964 {"}'M' greentint -8.719 3.165 -6.8886 {"}'M' greentint -8.8749 3.0663 -7.0619 {"}'M' greentint -9.021 2.9227 -7.2118 {"}'M' greentint -9.1518 2.7407 -7.3303 {"}'M' greentint -8.7191 3.0936 -7.2672 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H VAL 170 A}'M' P -8.7818 2.3272 -6.6994 {"}'M' -8.7876 2.3357 -6.6973 {"}'M' P -8.6721 2.4938 -6.8678 {"}'M' -8.6729 2.4953 -6.8675 @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 170 A}'M' greentint -9.3573 2.1503 -6.2221 {"}'M' greentint -9.2024 2.2475 -6.0496 {"}'M' greentint -9.0611 2.3983 -5.908 {"}'M' greentint -9.4009 2.1109 -6.6965 {"}'M' greentint -9.2466 2.1102 -6.4974 {"}'M' greentint -9.0884 2.1739 -6.3111 {"}'M' greentint -8.9382 2.2984 -6.1513 {"}'M' greentint -8.805 2.474 -6.0282 {"}'M' greentint -8.6998 2.6886 -5.9504 {"}'M' greentint -9.3374 2.2422 -7.0515 {"}'M' greentint -9.196 2.1692 -6.8484 {"}'M' greentint -9.0378 2.1714 -6.6447 {"}'M' greentint -8.8772 2.2474 -6.4578 {"}'M' greentint -8.7276 2.3928 -6.3054 {"}'M' greentint -8.6031 2.5927 -6.1996 {"}'M' greentint -8.5145 2.8303 -6.1515 {"}'M' greentint -9.209 2.4689 -7.2917 {"}'M' greentint -9.0929 2.3319 -7.1035 {"}'M' greentint -8.9441 2.2823 -6.8974 {"}'M' greentint -8.6276 2.4598 -6.5377 {"}'M' greentint -8.5033 2.6631 -6.4331 {"}'M' greentint -8.425 2.9088 -6.4009 {"}'M' greentint -8.4041 3.1642 -6.4443 {"}'M' greentint -9.0315 2.7728 -7.409 {"}'M' greentint -8.9649 2.5675 -7.266 {"}'M' greentint -8.8331 2.4657 -7.0678 {"}'M' greentint -8.5241 2.6457 -6.719 {"}'M' greentint -8.4293 2.8799 -6.6616 {"}'M' greentint -8.413 3.1336 -6.7109 {"}'M' greentint -8.8038 2.8388 -7.2992 {"}'M' greentint -8.6996 2.6836 -7.1213 {"}'M' greentint -8.5397 2.7805 -6.9419 {"}'M' greentint -8.4847 3.0338 -6.9417 {"}'M' greentint -8.618 2.9302 -7.1412 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 154 A}'M' green -9.9074 0.9139 -4.653 {"}'M' green -9.3555 1.48 -4.098 {"}'M' green -9.9132 1.0104 -4.9513 {"}'M' green -9.3822 1.7491 -5.2127 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 154 A}'M' greentint -9.7024 1.1173 -4.2228 {"}'M' greentint -9.8357 1.0137 -4.4223 {"}'M' greentint -9.6207 1.3639 -4.2426 {"}'M' greentint -9.7807 1.267 -4.4221 {"}'M' greentint -9.8911 1.1676 -4.7023 {"}'M' greentint -9.4873 1.5817 -4.2962 {"}'M' greentint -9.6483 1.5537 -4.4962 {"}'M' greentint -9.7963 1.4017 -4.645 {"}'M' greentint -9.8628 1.265 -4.956 {"}'M' greentint -9.2988 1.7516 -4.3628 {"}'M' greentint -9.4577 1.7547 -4.5687 {"}'M' greentint -9.618 1.6637 -4.7516 {"}'M' greentint -9.7594 1.4931 -4.8871 {"}'M' greentint -9.766 1.3393 -5.196 {"}'M' greentint -9.202 1.8863 -4.6183 {"}'M' greentint -9.3633 1.8471 -4.8162 {"}'M' greentint -9.5199 1.7351 -4.9876 {"}'M' greentint -9.6585 1.5603 -5.1183 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 170 A}'M' green -9.7463 1.0673 -4.174 {"}'M' green -9.606 1.2293 -4.0379 {"}'M' green -9.9533 0.951 -4.7721 {"}'M' green -9.5134 1.706 -5.2967 {"}'M' green -9.3547 1.8034 -5.1191 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 170 A}'M' greentint -9.7907 1.0067 -4.578 {"}'M' greentint -9.6329 1.117 -4.4045 {"}'M' greentint -9.4875 1.2787 -4.2616 {"}'M' greentint -9.3629 1.4811 -4.158 {"}'M' greentint -9.879 1.0864 -5.0312 {"}'M' greentint -9.7198 1.1089 -4.8307 {"}'M' greentint -9.5601 1.1974 -4.6497 {"}'M' greentint -9.4133 1.347 -4.5022 {"}'M' greentint -9.2896 1.5468 -4.3975 {"}'M' greentint -9.1978 1.781 -4.3442 {"}'M' greentint -9.7603 1.2684 -5.1857 {"}'M' greentint -9.6015 1.2794 -4.9848 {"}'M' greentint -9.4445 1.3753 -4.8075 {"}'M' greentint -9.306 1.5458 -4.676 {"}'M' greentint -9.2031 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2givA_129F_113}-11.2606 1.7158 -4.7461 { c tyr A 113 2givA_129F_113}P -11.7391 2.8319 -5.0123 { n ile A 114 2givA_129F_113}-12.3477 3.6118 -4.1202 { ca ile A 114 2givA_129F_113}-12.3085 3.3642 -2.672 { c ile A 114 2givA_129F_113}-13.6436 2.802 -2.27 { o ile A 114 2givA_129F_113}-14.654 3.4287 -2.4339 { c ile A 114 2givA_129F_113}P -13.6436 2.802 -2.27 { n leu A 115 2givA_129F_113}-13.5938 1.6193 -1.686 { ca leu A 115 2givA_129F_113}-14.7475 0.8968 -1.2284 { c leu A 115 2givA_129F_113}-14.8831 1.2038 0.278 { o leu A 115 2givA_129F_113}-13.9156 0.9853 1.0539 { n gly A 127 2givA_129F_113}P -11.3718 -1.2139 1.4817 {"}-11.3718 -1.2139 1.4817 { ca gly A 127 2givA_129F_113}-10.3522 -1.65 0.5705 { c gly A 127 2givA_129F_113}-10.4739 -0.67 -0.5835 { o gly A 127 2givA_129F_113}-11.2026 0.3214 -0.4694 { c gly A 127 2givA_129F_113}P -10.4739 -0.67 -0.5835 { n tyr A 128 2givA_129F_113}-9.7667 -0.9663 -1.6785 { ca tyr A 128 2givA_129F_113}-9.7121 -0.1369 -2.8714 { c tyr A 128 2givA_129F_113}-9.1013 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H} off nobutton color= gray master= {sidechain} { cb tyr A 113 2givA_129F_113}P -12.2623 2.4065 -7.4604 {"}P -12.2623 2.4065 -7.4604 { cd1 tyr A 113 2givA_129F_113}P -13.4203 3.7748 -9.241 { cd2 tyr A 113 2givA_129F_113}P -11.2195 2.9308 -9.6683 { ce1 tyr A 113 2givA_129F_113}P -13.4362 4.3799 -10.4809 { ce2 tyr A 113 2givA_129F_113}P -11.2133 3.5199 -10.9016 { oh tyr A 113 2givA_129F_113}P -12.2436 4.8342 -12.5329 { cb phe A 129 2givA_129F_113}P -8.843 -1.8606 -7.2899 {"}P -8.843 -1.8606 -7.2899 { cd1 phe A 129 2givA_129F_113}P -9.6777 -0.9742 -9.5063 { cd2 phe A 129 2givA_129F_113}P -11.2868 -1.4762 -7.7974 { ce1 phe A 129 2givA_129F_113}P -10.7077 -0.5436 -10.3767 { ce2 phe A 129 2givA_129F_113}P -12.311 -1.1084 -8.6985 { cz phe A 129 2givA_129F_113}P -12.0107 -0.622 -9.9849 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 129 A}'S' blue -11.7716 0.0207 -7.0312 {"}'S' sky -11.9246 0.0549 -7.2396 {"}'S' sky -11.5199 0.1064 -7.0879 {"}'S' 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-12.4955 0.8749 -9.2188 {"}'S' blue -11.9909 0.7413 -8.8882 {"}'S' blue -12.1085 0.8703 -9.0767 {"}'S' blue -12.2439 0.9605 -9.2755 {"}'S' blue -12.3918 1.0104 -9.4805 {"}'S' blue -12.5477 1.0159 -9.6846 {"}'S' blue -11.6369 0.5884 -8.7778 {"}'S' blue -11.7302 0.7574 -8.9457 {"}'S' blue -11.8428 0.8952 -9.1294 {"}'S' blue -11.9708 0.9981 -9.3244 {"}'S' sky -12.1132 1.064 -9.5272 {"}'S' blue -12.2651 1.0912 -9.7308 {"}'S' sky -11.6402 0.9436 -9.2958 {"}'S' sky -12.078 1.1257 -9.9118 {"}'S' blue -12.2396 1.1083 -10.1167 {"}'S' blue -11.3328 0.8372 -9.2975 {"}'S' blue -12.0612 1.0967 -10.3112 {"}'S' sky -11.6906 1.077 -10.2598 {"}'S' blue -11.8523 1.054 -10.4636 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 129 A}'S' sea -11.6678 0.1562 -7.2929 {"}'S' sea -11.8237 0.1618 -7.497 {"}'S' green -11.3893 0.2099 -7.3397 {"}'S' green -11.5412 0.237 -7.5433 {"}'S' green -11.1974 0.2486 -7.5169 {"}'S' green -11.354 0.2716 -7.7243 {"}'S' green -11.5156 0.2542 -7.9292 {"}'S' sea -11.0182 0.2517 -7.7136 {"}'S' sea -11.1751 0.266 -7.9211 { CE1 PHE 129 A}'S' sea -11.1925 0.9533 -9.6106 {"}'S' sea -10.9409 1.039 -9.6673 {"}'S' green -11.0888 1.0888 -9.8723 {"}'S' green -11.2447 1.0944 -10.0764 {"}'S' sea -11.4051 1.0582 -10.2737 {"}'S' sea -10.6678 1.0766 -9.7162 {"}'S' green -10.8102 1.1425 -9.9191 {"}'S' green -10.9621 1.1696 -10.1226 {"}'S' green -11.1198 1.1565 -10.3232 {"}'S' sea -10.4716 1.1204 -9.8887 {"}'S' green -10.6184 1.1812 -10.0963 {"}'S' green -10.775 1.2042 -10.3037 {"}'S' sea -10.9366 1.1867 -10.5086 { CE2 PHE 129 A}'S' sea -12.2912 0.2549 -7.6018 {"}'S' sea -12.4087 0.384 -7.7902 {"}'S' green -12.0304 0.271 -7.6592 {"}'S' green -12.1431 0.4088 -7.843 {"}'S' green -12.2711 0.5117 -8.0379 {"}'S' sea -12.4135 0.5776 -8.2408 {"}'S' green -11.8218 0.3235 -7.8184 {"}'S' green -11.9405 0.4572 -8.0094 {"}'S' green -12.0749 0.5556 -8.2104 {"}'S' sea -12.2216 0.6164 -8.4181 {"}'S' green -11.6331 0.3508 -8.011 {"}'S' green -11.7554 0.4754 -8.2049 {"}'S' green -11.8933 0.5664 -8.4074 {"}'S' sea -11.4252 0.3023 -8.1635 {"}'S' sea -11.5474 0.4286 -8.356 { CZ PHE 129 A}'S' sea -11.7746 1.042 -9.4968 {"}'S' sea -11.9214 1.1028 -9.7045 {"}'S' sea -11.4552 0.9618 -9.4914 {"}'S' sea -11.5931 1.0528 -9.6938 {"}'S' sea -11.7422 1.1058 -9.9011 {"}'S' sea -11.8991 1.1202 -10.1086 {"}'S' sea -11.3843 1.0059 -9.8455 {"}'S' sea -11.5329 1.0597 -10.0524 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 113 A}'S' blue -12.822 0.826 -7.9603 {"}'S' blue -12.6845 0.7341 -7.7583 {"}'S' blue -12.5359 0.6803 -7.5514 {"}'S' sky -12.6905 0.8997 -8.24 {"}'S' sky -12.5637 0.784 -8.0438 {"}'S' blue -12.5461 1.0319 -8.5052 {"}'S' sky -12.4351 0.8927 -8.3217 {"}'S' blue -12.3306 1.1154 -8.6398 {"}'S' sky -12.2211 0.9694 -8.4586 {"}'S' blue -12.0954 1.1999 -8.717 { CG TYR 113 A}'S' blue -12.5985 1.4143 -9.3972 {"}'S' blue -12.4564 1.3359 -9.1919 {"}'S' blue -12.304 1.2951 -8.9846 {"}'S' blue -12.4698 1.523 -9.6751 {"}'S' blue -12.3407 1.4193 -9.48 {"}'S' blue -12.1995 1.3524 -9.2787 {"}'S' blue -12.0472 1.3247 -9.0744 { CD2 TYR 113 A}'S' sky -12.1322 1.4422 -9.7882 {"}'S' sky -11.991 1.3622 -9.5838 {"}'S' sky -11.8391 1.3209 -9.3752 {"}'S' blue -11.6794 1.3179 -9.1682 {"}'S' blue -12.1021 1.5152 -10.1977 {"}'S' sky -11.9789 1.3905 -10.0044 {"}'S' sky -11.5346 1.2329 -9.3867 {"}'S' blue -11.3725 1.2564 -9.1841 {"}'S' blue -11.9011 1.4756 -10.3616 {"}'S' sky -11.1737 1.2104 -9.348 {"}'S' blue -11.6477 1.4239 -10.4478 {"}'S' sky -11.5209 1.3083 -10.2516 {"}'S' sky -10.9033 1.2264 -9.4315 {"}'S' sky -11.3915 1.4168 -10.5301 {"}'S' sky -10.6517 1.2808 -9.5358 {"}'S' blue -11.1787 1.4942 -10.6671 {"}'S' sky -10.4362 1.3657 -9.6707 {"}'S' sky -10.8107 1.471 -10.5432 {"}'S' sky -10.3443 1.4385 -9.9309 {"}'S' blue -10.5707 1.5864 -10.5817 {"}'S' blue -10.4205 1.5443 -10.377 {"}'S' blue -10.262 1.5563 -10.1751 { HB2 TYR 113 A}'S' sky -12.1637 0.4274 -7.4157 {"}'S' sky -12.0118 0.4016 -7.2124 {"}'S' blue -11.8524 0.4321 -7.0152 {"}'S' sky -11.5478 0.4081 -7.0463 {"}'S' sky -11.2882 0.4311 -7.1479 {"}'S' sky -11.8915 0.8526 -8.4547 {"}'S' blue -11.6487 0.9462 -8.5356 {"}'S' sky -11.5842 0.7373 -8.393 {"}'S' sky -11.0266 0.5084 -7.6094 {"}'S' blue -11.1063 0.6164 -8.0488 {"}'S' blue -10.9499 0.6272 -7.8496 { HD2 TYR 113 A}'S' blue -10.3426 1.3679 -9.5075 {"}'S' blue -10.1377 1.4261 -9.6594 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 113 A}'S' sea -11.8414 1.3004 -9.8009 {"}'S' sea -11.6923 1.2474 -9.5936 {"}'S' sea -11.7792 1.3502 -10.1682 {"}'S' sea -11.6417 1.2584 -9.9661 {"}'S' sea -11.4931 1.2046 -9.7592 {"}'S' sea -11.3358 1.1883 -9.5508 {"}'S' sea -11.3789 1.2299 -10.0464 {"}'S' green -11.2265 1.189 -9.8391 {"}'S' sea -11.0671 1.1884 -9.6313 {"}'S' sea -11.2632 1.3133 -10.3345 {"}'S' green -11.122 1.2464 -10.1331 {"}'S' green -10.9697 1.2186 -9.9289 {"}'S' green -10.8121 1.2304 -9.7281 {"}'S' sea -11.0513 1.3849 -10.4715 {"}'S' green -10.9094 1.3169 -10.2688 {"}'S' green -10.7562 1.2907 -10.0637 {"}'S' sea -10.5976 1.3068 -9.8625 {"}'S' sea -10.6642 1.4122 -10.3365 {"}'S' sea -10.5064 1.4005 -10.1301 { HB2 TYR 113 A}'S' sea -12.4164 0.6405 -7.8012 {"}'S' sea -12.3011 0.5089 -7.6152 {"}'S' sea -12.33 0.7907 -8.1633 {"}'S' green -12.2488 0.6083 -8.0073 {"}'S' green -12.14 0.4676 -7.8282 {"}'S' green -12.0093 0.3733 -7.6332 {"}'S' sea -11.862 0.3316 -7.4309 {"}'S' sea -11.7065 0.3436 -7.233 {"}'S' green -12.0984 0.7291 -8.2788 {"}'S' green -12.0107 0.553 -8.1153 {"}'S' green -11.8946 0.4212 -7.9299 {"}'S' green -11.758 0.3398 -7.7298 {"}'S' green -11.6056 0.3149 -7.5261 {"}'S' green -11.4462 0.3453 -7.3289 {"}'S' green -11.8204 0.6563 -8.3094 {"}'S' green -11.7178 0.5035 -8.1343 {"}'S' green -11.5894 0.4027 -7.9392 {"}'S' green -11.4421 0.3597 -7.7366 {"}'S' green -11.2839 0.3774 -7.5381 {"}'S' sea -11.1262 0.4534 -7.3553 {"}'S' sea -11.4805 0.5786 -8.2151 {"}'S' sea -11.3456 0.4837 -8.0142 {"}'S' sea -11.1899 0.4595 -7.806 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 129 A}'M' greentint -9.514 2.1429 -6.2586 {"}'M' greentint -9.6773 2.1095 -6.4604 {"}'M' greentint -9.8259 1.9526 -6.6089 {"}'M' greentint -9.3701 2.348 -6.3206 {"}'M' greentint -9.528 2.3397 -6.5226 {"}'M' greentint -9.6866 2.2465 -6.701 {"}'M' greentint -9.8259 2.0785 -6.8341 {"}'M' greentint -9.8992 1.9503 -7.1512 {"}'M' greentint -9.0458 2.4398 -6.1854 {"}'M' greentint -9.1849 2.5181 -6.3866 {"}'M' greentint -9.3411 2.5288 -6.5904 {"}'M' greentint -9.5012 2.4705 -6.7824 {"}'M' greentint -9.656 2.3475 -6.9471 {"}'M' greentint -9.7917 2.1699 -7.0732 {"}'M' greentint -9.8213 2.0305 -7.3894 {"}'M' greentint -8.9449 2.6363 -6.4255 {"}'M' greentint -9.0978 2.6722 -6.6325 {"}'M' greentint -9.2579 2.6482 -6.8338 {"}'M' greentint -9.4204 2.5666 -7.0202 {"}'M' greentint -9.5726 2.4306 -7.1802 {"}'M' greentint -9.7093 2.2491 -7.305 {"}'M' greentint -8.8491 2.7636 -6.7014 {"}'M' greentint -9.0043 2.7627 -6.9013 {"}'M' greentint -9.1635 2.7116 -7.0935 {"}'M' greentint -9.3193 2.6128 -7.2668 {"}'M' greentint -9.4654 2.4693 -7.4167 {"}'M' greentint -9.5962 2.2873 -7.5351 {"}'M' greentint -8.6884 2.8193 -6.9079 {"}'M' greentint -8.8465 2.8067 -7.1092 {"}'M' greentint -9.0067 2.746 -7.2989 {"}'M' greentint -9.1636 2.6401 -7.472 {"}'M' greentint -9.3102 2.493 -7.6218 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H TYR 113 A}'M' P -9.0652 2.0674 -6.9864 {"}'M' -9.0679 2.0712 -6.9858 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 113 A}'M' greentint -9.7973 1.8531 -6.7009 {"}'M' greentint -9.6406 1.8905 -6.509 {"}'M' greentint -9.4857 1.9877 -6.3366 {"}'M' greentint -9.3444 2.1385 -6.1949 {"}'M' greentint -9.8242 1.9162 -7.1827 {"}'M' greentint -9.6843 1.8512 -6.9835 {"}'M' greentint -9.53 1.8505 -6.7844 {"}'M' greentint -9.3718 1.9142 -6.5981 {"}'M' greentint -9.2215 2.0386 -6.4382 {"}'M' greentint -9.0884 2.2142 -6.3151 {"}'M' greentint -8.9832 2.4288 -6.2374 {"}'M' greentint -9.6208 1.9825 -7.3385 {"}'M' greentint -9.4794 1.9094 -7.1354 {"}'M' greentint -9.3212 1.9116 -6.9316 {"}'M' greentint -9.1605 1.9876 -6.7448 {"}'M' greentint -9.011 2.133 -6.5924 {"}'M' greentint -8.8864 2.3329 -6.4866 {"}'M' greentint -8.7978 2.5705 -6.4385 {"}'M' greentint -9.4923 2.2091 -7.5786 {"}'M' greentint -9.3762 2.0721 -7.3904 {"}'M' greentint -9.2275 2.0225 -7.1843 {"}'M' greentint -8.9109 2.2 -6.8247 {"}'M' greentint -8.7867 2.4033 -6.72 {"}'M' greentint -8.7084 2.649 -6.6879 {"}'M' greentint -9.2482 2.3077 -7.5529 {"}'M' greentint -9.1165 2.206 -7.3548 {"}'M' greentint -8.9555 2.234 -7.1548 {"}'M' greentint -8.8075 2.386 -7.0059 {"}'M' greentint -8.7126 2.6201 -6.9486 {"}'M' greentint -9.0872 2.579 -7.5861 {"}'M' greentint -8.983 2.4238 -7.4083 {"}'M' greentint -8.823 2.5207 -7.2289 {"}'M' greentint -8.7681 2.774 -7.2286 {"}'M' greentint -8.9013 2.6704 -7.4281 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 129 A}'M' green -10.8234 0.2585 -4.913 {"}'M' green -10.6376 0.3499 -4.755 {"}'M' green -10.9017 0.4082 -5.1123 {"}'M' green -10.8804 0.6344 -5.5774 {"}'M' green -10.0431 0.8829 -4.9067 {"}'M' green -10.0405 1.0777 -5.3577 {"}'M' green -10.1948 1.0784 -5.5568 {"}'M' green -10.353 1.0147 -5.7431 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 129 A}'M' greentint -10.7418 0.5051 -4.9329 {"}'M' greentint -10.4765 0.6212 -4.7882 {"}'M' greentint -10.6083 0.7229 -4.9864 {"}'M' greentint -10.7693 0.6949 -5.1864 {"}'M' greentint -10.9173 0.5429 -5.3352 {"}'M' greentint -10.285 0.7979 -4.8521 {"}'M' greentint -10.4199 0.8928 -5.053 {"}'M' greentint -10.5787 0.8959 -5.2589 {"}'M' greentint -10.739 0.8049 -5.4418 {"}'M' greentint -10.1713 0.992 -5.1034 {"}'M' greentint -10.323 1.0275 -5.3085 {"}'M' greentint -10.4843 0.9883 -5.5064 {"}'M' greentint -10.6409 0.8763 -5.6778 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 113 A}'M' green -11.0943 0.4016 -5.1996 {"}'M' green -10.9432 0.3756 -4.9974 {"}'M' green -10.7852 0.3995 -4.8007 {"}'M' green -10.6272 0.4736 -4.6169 {"}'M' green -10.9858 0.5458 -5.4637 {"}'M' green -10.3619 0.6439 -4.6846 {"}'M' green -10.8816 0.7728 -5.7097 {"}'M' green -10.1424 0.874 -4.7823 {"}'M' green -10.0351 1.0727 -4.9561 {"}'M' green -10.488 1.1067 -5.7419 {"}'M' green -10.0422 1.1861 -5.1882 {"}'M' sea -10.2424 1.2329 -5.5768 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 113 A}'M' greentint -10.8396 0.4825 -5.2579 {"}'M' greentint -10.6824 0.4779 -5.0523 {"}'M' greentint -10.5198 0.5336 -4.8581 {"}'M' greentint -10.756 0.6604 -5.5158 {"}'M' greentint -10.608 0.6133 -5.3114 {"}'M' greentint -10.4488 0.6358 -5.1109 {"}'M' greentint -10.2891 0.7244 -4.9299 {"}'M' greentint -10.6278 0.8721 -5.6674 {"}'M' greentint -10.4894 0.7953 -5.4658 {"}'M' greentint -10.3306 0.8063 -5.265 {"}'M' greentint -10.1735 0.9022 -5.0876 {"}'M' greentint -10.3551 1.0031 -5.5416 {"}'M' greentint -10.1919 1.0323 -5.339 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 20 2gpiA_22F_33C}P -12.1458 -1.6335 0.5434 {"}-12.1458 -1.6335 0.5434 { ca ile A 20 2gpiA_22F_33C}-10.9949 -2.0134 -0.2405 { c ile A 20 2gpiA_22F_33C}-10.7218 -0.8979 -1.2565 { o ile A 20 2gpiA_22F_33C}-11.6185 -0.4596 -2.0011 { c ile A 20 2gpiA_22F_33C}P -10.7218 -0.8979 -1.2565 { n his A 21 2gpiA_22F_33C}-9.49 -0.4594 -1.2503 { ca his A 21 2gpiA_22F_33C}-8.9868 0.5462 -2.1881 { c his A 21 2gpiA_22F_33C}-8.2014 -0.2319 -3.2765 { o his A 21 2gpiA_22F_33C}-7.2349 -0.9765 -2.9852 { c his A 21 2gpiA_22F_33C}P -8.2014 -0.2319 -3.2765 { n phe A 22 2gpiA_22F_33C}-8.5947 -0.0212 -4.532 { ca phe A 22 2gpiA_22F_33C}-7.9156 -0.6376 -5.6607 { c phe A 22 2gpiA_22F_33C}-7.6557 0.4486 -6.712 { o phe A 22 2gpiA_22F_33C}-8.2697 1.4826 -6.7021 { c phe A 22 2gpiA_22F_33C}P -7.6557 0.4486 -6.712 { n thr A 23 2gpiA_22F_33C}-6.7186 0.1991 -7.589 { ca thr A 23 2gpiA_22F_33C}-6.2215 1.231 -8.4728 { c thr A 23 2gpiA_22F_33C}-6.4415 0.9054 -9.9569 { o thr A 23 2gpiA_22F_33C}-6.3168 -0.2343 -10.3962 { c thr A 23 2gpiA_22F_33C}P -6.4415 0.9054 -9.9569 { n ala A 24 2gpiA_22F_33C}-6.8365 1.923 -10.7017 { ca ala A 24 2gpiA_22F_33C}-6.8793 1.8689 -12.1543 { c ala A 24 2gpiA_22F_33C}-5.9667 2.9665 -12.6408 { o ala A 24 2gpiA_22F_33C}-5.5842 3.856 -11.8973 { n ile A 31 2gpiA_22F_33C}P -6.4744 6.4004 -11.1126 {"}-6.4744 6.4004 -11.1126 { ca ile A 31 2gpiA_22F_33C}-7.848 6.5328 -10.6826 { c ile A 31 2gpiA_22F_33C}-8.0616 5.6175 -9.4702 { o ile A 31 2gpiA_22F_33C}-7.9615 4.3867 -9.5873 { c ile A 31 2gpiA_22F_33C}P -8.0616 5.6175 -9.4702 { n asp A 32 2gpiA_22F_33C}-8.2681 6.2385 -8.317 { ca asp A 32 2gpiA_22F_33C}-8.5338 5.5026 -7.1075 { c asp A 32 2gpiA_22F_33C}-9.9673 4.9657 -7.0901 { o asp A 32 2gpiA_22F_33C}-10.9766 5.6944 -7.2091 { c asp A 32 2gpiA_22F_33C}P -9.9673 4.9657 -7.0901 { n cys A 33 2gpiA_22F_33C}-10.0771 3.6581 -6.8871 { ca cys A 33 2gpiA_22F_33C}-11.381 2.9982 -6.8643 { c cys A 33 2gpiA_22F_33C}-11.5883 2.3415 -5.5009 { o cys A 33 2gpiA_22F_33C}-10.6233 1.937 -4.838 { c cys A 33 2gpiA_22F_33C}P -11.5883 2.3415 -5.5009 { n tyr A 34 2gpiA_22F_33C}-12.8333 2.2383 -5.1096 { ca tyr A 34 2gpiA_22F_33C}-13.1878 1.7588 -3.7723 { c tyr A 34 2gpiA_22F_33C}-14.412 0.8639 -3.8417 { o tyr A 34 2gpiA_22F_33C}-15.3297 1.1182 -4.5764 { c tyr A 34 2gpiA_22F_33C}P -14.412 0.8639 -3.8417 { n ile A 35 2gpiA_22F_33C}-14.3931 -0.2043 -3.0526 { ca ile A 35 2gpiA_22F_33C}-15.5895 -1.0144 -2.806 { c ile A 35 2gpiA_22F_33C}-15.7453 -1.1469 -1.2781 { o ile A 35 2gpiA_22F_33C}-14.8503 -1.6667 -0.5804 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 20 2gpiA_22F_33C}P -12.1458 -1.6335 0.5434 { ca ile A 20 2gpiA_22F_33C}P -10.9949 -2.0134 -0.2405 { n his A 21 2gpiA_22F_33C}P -9.49 -0.4594 -1.2503 { ca his A 21 2gpiA_22F_33C}P -8.9868 0.5462 -2.1881 { n phe A 22 2gpiA_22F_33C}P -8.5947 -0.0212 -4.532 { ca phe A 22 2gpiA_22F_33C}P -7.9156 -0.6376 -5.6607 { n thr A 23 2gpiA_22F_33C}P -6.7186 0.1991 -7.589 { ca thr A 23 2gpiA_22F_33C}P -6.2215 1.231 -8.4728 { n ala A 24 2gpiA_22F_33C}P -6.8365 1.923 -10.7017 { ca ala A 24 2gpiA_22F_33C}P -6.8793 1.8689 -12.1543 { n ile A 31 2gpiA_22F_33C}P -6.4744 6.4004 -11.1126 { ca ile A 31 2gpiA_22F_33C}P -7.848 6.5328 -10.6826 { n asp A 32 2gpiA_22F_33C}P -8.2681 6.2385 -8.317 { ca asp A 32 2gpiA_22F_33C}P -8.5338 5.5026 -7.1075 { n cys A 33 2gpiA_22F_33C}P -10.0771 3.6581 -6.8871 { ca cys A 33 2gpiA_22F_33C}P -11.381 2.9982 -6.8643 { n tyr A 34 2gpiA_22F_33C}P -12.8333 2.2383 -5.1096 { ca tyr A 34 2gpiA_22F_33C}P -13.1878 1.7588 -3.7723 { n ile A 35 2gpiA_22F_33C}P -14.3931 -0.2043 -3.0526 { ca ile A 35 2gpiA_22F_33C}P -15.5895 -1.0144 -2.806 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 20 2gpiA_22F_33C}P -10.9949 -2.0134 -0.2405 {"}-10.9949 -2.0134 -0.2405 { ca his A 21 2gpiA_22F_33C}-8.9868 0.5462 -2.1881 { ca phe A 22 2gpiA_22F_33C}-7.9156 -0.6376 -5.6607 { ca thr A 23 2gpiA_22F_33C}-6.2215 1.231 -8.4728 { ca ala A 24 2gpiA_22F_33C}-6.8793 1.8689 -12.1543 { ca ile A 31 2gpiA_22F_33C}-7.848 6.5328 -10.6826 { ca asp A 32 2gpiA_22F_33C}-8.5338 5.5026 -7.1075 { ca cys A 33 2gpiA_22F_33C}-11.381 2.9982 -6.8643 { ca tyr A 34 2gpiA_22F_33C}-13.1878 1.7588 -3.7723 { ca ile A 35 2gpiA_22F_33C}-15.5895 -1.0144 -2.806 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 22 2gpiA_22F_33C}P -7.9156 -0.6376 -5.6607 { cb phe A 22 2gpiA_22F_33C}-8.6069 -1.8777 -6.2303 { cg phe A 22 2gpiA_22F_33C}-10.014 -1.672 -6.7598 { cd1 phe A 22 2gpiA_22F_33C}-11.0912 -1.462 -5.915 { ce1 phe A 22 2gpiA_22F_33C}-12.3798 -1.3396 -6.4328 { cz phe A 22 2gpiA_22F_33C}-12.5889 -1.3751 -7.8007 { cg phe A 22 2gpiA_22F_33C}P -10.014 -1.672 -6.7598 { cd2 phe A 22 2gpiA_22F_33C}-10.2544 -1.6997 -8.1142 { ce2 phe A 22 2gpiA_22F_33C}-11.5518 -1.5611 -8.6272 { cz phe A 22 2gpiA_22F_33C}ghost -12.5889 -1.3751 -7.8007 { ca cys A 33 2gpiA_22F_33C}P -11.381 2.9982 -6.8643 { cb cys A 33 2gpiA_22F_33C}-11.4746 1.8921 -7.895 { sg cys A 33 2gpiA_22F_33C}-11.1406 2.449 -9.5923 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 22 2gpiA_22F_33C}P -8.6069 -1.8777 -6.2303 {"}P -8.6069 -1.8777 -6.2303 { cd1 phe A 22 2gpiA_22F_33C}P -11.0912 -1.462 -5.915 { cd2 phe A 22 2gpiA_22F_33C}P -10.2544 -1.6997 -8.1142 { ce1 phe A 22 2gpiA_22F_33C}P -12.3798 -1.3396 -6.4328 { ce2 phe A 22 2gpiA_22F_33C}P -11.5518 -1.5611 -8.6272 { cz phe A 22 2gpiA_22F_33C}P -12.5889 -1.3751 -7.8007 { cb cys A 33 2gpiA_22F_33C}P -11.4746 1.8921 -7.895 {"}P -11.4746 1.8921 -7.895 { sg cys A 33 2gpiA_22F_33C}P -11.1406 2.449 -9.5923 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 22 A}'S' sky -10.4261 0.028 -6.7063 {"}'S' blue -10.0813 0.0757 -6.6868 {"}'S' blue -9.9024 0.0701 -6.8835 {"}'S' sky -9.8556 0.0039 -7.2386 { CD1 PHE 22 A}'S' blue -10.9327 0.214 -6.3937 {"}'S' sky -11.0959 0.1533 -6.5875 {"}'S' sky -11.2571 0.0568 -6.7687 {"}'S' sky -10.7175 0.1359 -6.5226 {"}'S' sky -11.1989 -0.1469 -7.0647 {"}'S' sky -10.5016 0.0245 -6.6259 {"}'S' sky -10.9728 -0.2394 -7.1618 {"}'S' blue -11.1164 -0.3966 -7.3034 { CD2 PHE 22 A}'S' sky -9.8367 -0.0249 -7.8231 {"}'S' sky -10.3049 0.019 -8.4405 { CE1 PHE 22 A}'S' blue -12.7726 0.334 -6.7603 {"}'S' blue -12.9337 0.2403 -6.9421 {"}'S' blue -12.2682 0.4025 -6.5565 {"}'S' blue -12.4303 0.3791 -6.7591 {"}'S' sky -12.5939 0.3176 -6.9533 {"}'S' blue -11.902 0.3421 -6.5003 {"}'S' sky -12.0596 0.3594 -6.7077 {"}'S' sky -11.6887 0.2557 -6.6281 {"}'S' sky -11.4808 0.1301 -6.7391 {"}'S' sky -11.4016 -0.0003 -6.9907 {"}'S' sky -11.5575 0.0039 -7.1945 {"}'S' sky -11.3111 -0.1748 -7.1844 { CE2 PHE 22 A}'S' blue -11.1779 -0.3506 -7.4202 {"}'S' blue -12.1247 0.0864 -8.7661 {"}'S' blue -11.9445 0.1126 -8.9547 {"}'S' sky -11.6023 0.1576 -8.9535 {"}'S' sky -11.2316 0.1379 -8.9021 {"}'S' sky -10.713 -0.0253 -8.6157 { CZ PHE 22 A}'S' 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-7.0712 { n val A 168 2gq1A_158Y_168}-10.3109 3.8395 -6.6601 { ca val A 168 2gq1A_158Y_168}-11.6563 3.4858 -6.2224 { c val A 168 2gq1A_158Y_168}-11.5552 2.8453 -4.8443 { o val A 168 2gq1A_158Y_168}-10.7068 1.9868 -4.6252 { c val A 168 2gq1A_158Y_168}P -11.5552 2.8453 -4.8443 { n tyr A 169 2gq1A_158Y_168}-12.4059 3.2578 -3.9104 { ca tyr A 169 2gq1A_158Y_168}-12.3467 2.6759 -2.5757 { c tyr A 169 2gq1A_158Y_168}-13.6776 2.6836 -1.8384 { o tyr A 169 2gq1A_158Y_168}-14.6422 3.3398 -2.2471 { c tyr A 169 2gq1A_158Y_168}P -13.6776 2.6836 -1.8384 { n thr A 170 2gq1A_158Y_168}-13.7149 1.9283 -0.7463 { ca thr A 170 2gq1A_158Y_168}-14.8878 1.8549 0.1076 { c thr A 170 2gq1A_158Y_168}-14.4359 1.6073 1.5388 { o thr A 170 2gq1A_158Y_168}-13.3774 1.0225 1.7793 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala A 156 2gq1A_158Y_168}P -11.1131 -1.0812 1.5417 { ca ala A 156 2gq1A_158Y_168}P -10.5637 -1.8144 0.4146 { n gly A 157 2gq1A_158Y_168}P -9.8095 -1.1642 -1.7841 { ca gly A 157 2gq1A_158Y_168}P -9.8489 -0.3527 -2.9751 {"}P -9.8489 -0.3527 -2.9751 { n tyr A 158 2gq1A_158Y_168}P -8.8143 -0.085 -5.1133 { ca tyr A 158 2gq1A_158Y_168}P -7.8657 -0.3776 -6.1594 { n val A 159 2gq1A_158Y_168}P -6.4081 0.7964 -7.6342 { ca val A 159 2gq1A_158Y_168}P -5.9722 1.8814 -8.4822 { n val A 160 2gq1A_158Y_168}P -6.537 1.7493 -10.8286 { ca val A 160 2gq1A_158Y_168}P -6.471 1.17 -12.1561 { n mse A 166 2gq1A_158Y_168}P -7.1071 5.8723 -12.108 { ca mse A 166 2gq1A_158Y_168}P -8.2014 6.1015 -11.1798 { n leu A 167 2gq1A_158Y_168}P -8.5725 5.8804 -8.8153 { ca leu A 167 2gq1A_158Y_168}P -8.5424 5.2595 -7.5047 { n val A 168 2gq1A_158Y_168}P -10.3109 3.8395 -6.6601 { ca val A 168 2gq1A_158Y_168}P -11.6563 3.4858 -6.2224 { n tyr A 169 2gq1A_158Y_168}P -12.4059 3.2578 -3.9104 { ca tyr A 169 2gq1A_158Y_168}P -12.3467 2.6759 -2.5757 { n thr A 170 2gq1A_158Y_168}P -13.7149 1.9283 -0.7463 { ca thr A 170 2gq1A_158Y_168}P -14.8878 1.8549 0.1076 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ala A 156 2gq1A_158Y_168}P -10.5637 -1.8144 0.4146 {"}-10.5637 -1.8144 0.4146 { ca gly A 157 2gq1A_158Y_168}-9.8489 -0.3527 -2.9751 { ca tyr A 158 2gq1A_158Y_168}-7.8657 -0.3776 -6.1594 { ca val A 159 2gq1A_158Y_168}-5.9722 1.8814 -8.4822 { ca val A 160 2gq1A_158Y_168}-6.471 1.17 -12.1561 { ca mse A 166 2gq1A_158Y_168}P -8.2014 6.1015 -11.1798 {"}-8.2014 6.1015 -11.1798 { ca leu A 167 2gq1A_158Y_168}-8.5424 5.2595 -7.5047 { ca val A 168 2gq1A_158Y_168}-11.6563 3.4858 -6.2224 { ca tyr A 169 2gq1A_158Y_168}-12.3467 2.6759 -2.5757 { ca thr A 170 2gq1A_158Y_168}-14.8878 1.8549 0.1076 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 158 2gq1A_158Y_168}P -7.8657 -0.3776 -6.1594 { cb tyr A 158 2gq1A_158Y_168}-8.4202 -1.4367 -7.13 { cg tyr A 158 2gq1A_158Y_168}-9.6882 -1.0561 -7.8786 { cd1 tyr A 158 2gq1A_158Y_168}-9.6539 -0.2307 -9.0079 { ce1 tyr A 158 2gq1A_158Y_168}-10.8301 0.0823 -9.7111 { cz tyr A 158 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2gq1A_158Y_168}P -13.2218 -0.1464 -9.9425 { cb val A 168 2gq1A_158Y_168}P -12.2979 2.4739 -7.1965 { cg1 val A 168 2gq1A_158Y_168}P -13.6925 2.1107 -6.7297 {"}P -13.6925 2.1107 -6.7297 {"}P -13.6925 2.1107 -6.7297 { cg2 val A 168 2gq1A_158Y_168}P -12.3455 3.0599 -8.5999 {"}P -12.3455 3.0599 -8.5999 {"}P -12.3455 3.0599 -8.5999 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 158 A}'S' blue -10.7216 0.294 -7.4631 {"}'S' blue -10.8802 0.2033 -7.6437 { CD1 TYR 158 A}'S' blue -10.711 0.4525 -7.7923 {"}'S' blue -10.8482 0.5538 -7.9979 {"}'S' blue -10.5754 0.6935 -7.8414 {"}'S' sky -10.7166 0.7745 -8.0478 {"}'S' blue -10.4288 0.9087 -7.9295 {"}'S' blue -10.5717 0.9752 -8.1331 { CD2 TYR 158 A}'S' blue -11.5639 -0.0208 -6.9106 {"}'S' blue -11.3072 0.0805 -6.9639 {"}'S' sky -11.4631 0.086 -7.168 {"}'S' blue -11.0287 0.1341 -7.0107 {"}'S' sky -11.1806 0.1613 -7.2142 {"}'S' sky -11.3382 0.1482 -7.4147 {"}'S' blue -10.9934 0.1959 -7.3953 {"}'S' blue -11.155 0.1784 -7.6002 { CE1 TYR 158 A}'S' blue -11.0898 0.4092 -8.0115 {"}'S' sky -10.8374 0.7792 -8.1064 {"}'S' sky -11.0527 1.372 -8.5496 {"}'S' sky -10.9278 1.5747 -8.8028 {"}'S' sky -11.8432 1.487 -9.9605 {"}'S' blue -11.9888 1.3328 -10.1055 {"}'S' blue -10.7901 1.7025 -9.0505 {"}'S' sky -10.9325 1.7684 -9.2534 {"}'S' sky -11.4029 1.7298 -9.8499 { CE2 TYR 158 A}'S' blue -13.129 0.1029 -7.7382 {"}'S' blue -12.7334 0.2839 -7.5959 {"}'S' sky -12.0758 0.1161 -7.057 {"}'S' sky -12.4767 0.3852 -7.6493 {"}'S' sky -11.8151 0.1322 -7.1144 {"}'S' sky -11.3321 0.2898 -7.8112 { CZ TYR 158 A}'S' blue -13.2431 0.3508 -8.2617 {"}'S' blue -12.9703 0.4905 -8.1053 {"}'S' blue -13.1115 0.5715 -8.3116 {"}'S' blue -13.2744 0.5637 -8.5189 {"}'S' sky -12.7049 0.579 -8.0036 {"}'S' sky -12.8237 0.7057 -8.1933 {"}'S' blue -12.9666 0.7722 -8.3969 {"}'S' sky -12.7667 0.9365 -8.4534 {"}'S' sky -11.6783 1.1318 -8.5826 {"}'S' sky -12.4238 1.125 -9.9725 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 158 A}'S' green -11.399 0.915 -8.2812 {"}'S' sea -11.4861 1.0951 -8.443 {"}'S' sea -11.6049 1.2218 -8.6327 {"}'S' green -11.7478 1.2883 -8.8363 {"}'S' sea -11.0884 0.6578 -8.0782 {"}'S' green -11.1219 0.8898 -8.1855 {"}'S' green -11.1874 1.093 -8.3282 {"}'S' sea -11.2841 1.2601 -8.4986 {"}'S' sea -11.4056 1.3821 -8.6908 {"}'S' green -11.5479 1.4525 -8.8928 {"}'S' green -11.7022 1.4702 -9.0974 {"}'S' green -11.8635 1.4324 -9.2956 {"}'S' green -12.022 1.3417 -9.4762 {"}'S' sea -10.882 1.0063 -8.226 {"}'S' sea -10.9538 1.2063 -8.3749 {"}'S' sea -11.1749 1.4982 -8.7421 {"}'S' green -11.3148 1.5792 -8.9449 {"}'S' green -11.4678 1.6134 -9.1533 {"}'S' green -11.6289 1.5984 -9.3563 {"}'S' green -11.7917 1.5358 -9.5492 {"}'S' green -11.9503 1.4267 -9.724 {"}'S' sea -12.0996 1.2752 -9.8747 {"}'S' sea -11.0632 1.6649 -9.0016 {"}'S' green -11.2111 1.7147 -9.2066 {"}'S' green -11.367 1.7203 -9.4107 {"}'S' green -11.5274 1.6841 -9.608 {"}'S' sea -11.6881 1.6056 -9.7927 {"}'S' sea -11.0844 1.7955 -9.457 {"}'S' sea -11.2421 1.7824 -9.6575 { CE2 TYR 158 A}'S' sea -12.1934 0.2452 -7.2454 {"}'S' sea -12.3288 0.3354 -7.4443 {"}'S' green -11.9277 0.27 -7.2982 {"}'S' green -12.0557 0.373 -7.4931 {"}'S' sea -12.1981 0.4388 -7.696 {"}'S' sea -11.6064 0.1847 -7.2736 {"}'S' green -11.7251 0.3184 -7.4646 {"}'S' green -11.8595 0.4168 -7.6656 {"}'S' sea -11.4177 0.212 -7.4662 {"}'S' green -11.54 0.3366 -7.6601 { CZ TYR 158 A}'S' sea -12.4062 0.5769 -7.8889 {"}'S' sea -12.5029 0.7441 -8.0592 {"}'S' sea -12.6244 0.8661 -8.2514 {"}'S' green -12.1008 0.4902 -7.7866 {"}'S' green -12.1726 0.6902 -7.9356 {"}'S' green -12.2715 0.8559 -8.1102 {"}'S' green -12.3937 0.9822 -8.3027 {"}'S' sea -12.5336 1.0631 -8.5055 {"}'S' sea -12.6866 1.0973 -8.7139 {"}'S' green -12.8477 1.0824 -8.917 {"}'S' sea -13.0105 1.0197 -9.1098 {"}'S' green -11.8564 0.5708 -7.8521 {"}'S' green -12.029 0.9295 -8.175 {"}'S' green -12.1466 1.0586 -8.3634 {"}'S' sea -12.282 1.1488 -8.5623 {"}'S' green -12.4299 1.1986 -8.7673 {"}'S' green -12.5858 1.2042 -8.9713 {"}'S' green -12.7462 1.168 -9.1686 {"}'S' green -12.9069 1.0896 -9.3533 {"}'S' green -11.6026 0.5814 -7.9177 {"}'S' green -11.7683 0.9457 -8.2324 {"}'S' green -11.8809 1.0835 -8.4162 {"}'S' sea -12.0089 1.1864 -8.6111 {"}'S' green -12.1513 1.2523 -8.814 {"}'S' green -12.3032 1.2795 -9.0176 {"}'S' sea -11.3238 0.4204 -7.9271 {"}'S' green -11.3804 0.6379 -8.061 {"}'S' green -11.4595 0.8318 -8.2168 {"}'S' green -11.5596 0.9982 -8.3916 {"}'S' sea -11.8127 1.2303 -8.7836 {"}'S' green -11.9595 1.291 -8.9913 {"}'S' green -12.1161 1.314 -9.1986 {"}'S' green -12.4416 1.2399 -9.5992 {"}'S' green -12.6027 1.1462 -9.781 {"}'S' green -12.0993 1.285 -9.598 {"}'S' sea -12.2629 1.2235 -9.7922 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 158 A}'S' P -11.9314 0.7656 -8.0024 {"}'S' -11.9322 0.7574 -8.012 {"}'S' P -11.675 0.7767 -8.0646 {"}'S' -11.6761 0.7714 -8.07 {"}'S' P -12.4609 1.2663 -9.2181 {"}'S' -12.4551 1.243 -9.2186 {"}'S' P -12.6217 1.2138 -9.4105 {"}'S' -12.6168 1.2002 -9.4093 {"}'S' P -12.2777 1.2966 -9.4035 {"}'S' -12.2777 1.2952 -9.4032 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 158 A}'S' sky -13.4279 0.9673 -9.1199 {"}'S' sky -13.5629 1.0607 -9.3205 {"}'S' sky -13.6223 1.1872 -9.7963 {"}'S' sky -13.4645 1.2312 -10.0041 {"}'S' sky -13.289 1.2284 -10.1978 {"}'S' sky -12.923 1.2066 -10.147 {"}'S' sky -12.5629 1.0823 -10.0674 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 158 A}'S' sea -13.192 1.0403 -9.2002 {"}'S' green -13.3217 1.1377 -9.3947 {"}'S' sea -13.4671 1.188 -9.5963 {"}'S' green -13.019 1.1281 -9.3991 {"}'S' green -13.1555 1.2094 -9.5992 {"}'S' green -13.3064 1.2437 -9.8029 {"}'S' green -12.8353 1.1517 -9.5891 {"}'S' green -12.9767 1.2233 -9.7919 {"}'S' sea -13.1299 1.2495 -9.997 {"}'S' sea -12.7698 1.179 -9.9417 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 168 A}'S' blue -12.9269 1.2961 -8.3272 {"}'S' sky -12.836 1.1162 -8.1602 {"}'S' sky -12.7261 0.9671 -7.9761 {"}'S' sky -12.5994 0.8514 -7.7798 {"}'S' sky -12.6746 1.2691 -8.4086 {"}'S' sky -11.3728 1.5457 -8.3569 { CG1 VAL 168 A}'S' blue -13.1372 0.5921 -7.398 {"}'S' blue -13.1765 0.8623 -7.8414 {"}'S' blue -12.8935 0.7242 -7.4385 {"}'S' blue -13.0397 1.1027 -8.0033 { CG2 VAL 168 A}'S' blue -12.8183 1.3765 -8.5252 {"}'S' sky -11.4042 1.5947 -8.4264 {"}'S' blue -11.154 1.7813 -8.5132 {"}'S' sky -11.0717 1.869 -8.7489 {"}'S' blue -10.9604 2.0403 -8.9229 {"}'S' blue -11.4204 2.1316 -9.7604 {"}'S' sky -11.277 2.0528 -9.5533 {"}'S' sky -11.1144 2.0643 -9.3456 { HB VAL 168 A}'S' sky -12.4379 0.7183 -7.522 {"}'S' sky -12.3226 0.5867 -7.3359 {"}'S' sky -12.1852 0.5052 -7.1364 {"}'S' blue -12.0333 0.4794 -6.9331 {"}'S' sky -11.728 0.4214 -6.9538 {"}'S' sky -11.4677 0.4231 -7.0496 {"}'S' blue -11.3097 0.5089 -6.8686 {"}'S' sky -11.3059 0.4544 -7.2593 {"}'S' blue -11.1477 0.5313 -7.076 {"}'S' sky -11.2114 0.5373 -7.5267 {"}'S' blue -11.0481 0.5862 -7.3301 {"}'S' sky -11.1278 0.6942 -7.7696 {"}'S' blue -10.9715 0.705 -7.5703 {"}'S' blue -10.8153 0.8004 -7.3958 {"}'S' sky -11.1615 1.4585 -8.2566 {"}'S' sky -10.9767 0.8894 -7.8605 {"}'S' blue -10.8131 0.918 -7.6571 {"}'S' sky -10.9567 1.2713 -8.0844 {"}'S' sky -10.8517 1.1149 -7.9052 {"}'S' blue -10.6913 1.2126 -7.7253 {HG11 VAL 168 A}'S' blue -13.5794 0.5236 -7.985 {"}'S' blue -13.5617 0.8215 -8.2765 {"}'S' blue -13.4283 0.7187 -8.0759 {"}'S' blue -13.2647 0.7473 -7.8725 {"}'S' blue -13.3033 0.9442 -8.1206 {HG21 VAL 168 A}'S' sky -13.5551 1.4908 -9.5925 {"}'S' sky -13.1504 1.2519 -9.0037 {"}'S' sky -12.991 1.2823 -8.8065 {"}'S' sky -12.8326 1.3688 -8.6251 {"}'S' sky -13.237 1.5793 -10.0701 {"}'S' sky -12.959 1.5065 -10.1007 {"}'S' sky -12.6192 1.4288 -10.0064 {"}'S' sky -12.0938 1.6618 -9.931 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 168 A}'S' sea -12.5818 1.0993 -8.2412 {"}'S' green -12.47 0.96 -8.0584 {"}'S' green -12.3662 1.1828 -8.3759 {"}'S' green -12.2568 1.0368 -8.1946 {"}'S' green -12.131 1.2673 -8.453 {"}'S' green -12.0203 1.1194 -8.2697 {"}'S' sea -11.8919 1.3691 -8.4913 { CG2 VAL 168 A}'S' sea -12.6191 1.3337 -8.6909 {"}'S' green -12.3525 1.3181 -8.7707 {"}'S' green -12.1931 1.3174 -8.563 {"}'S' green -12.0957 1.3477 -8.8606 {"}'S' green -11.9381 1.3595 -8.6598 {"}'S' green -12.0354 1.446 -9.2004 {"}'S' green -11.8822 1.4198 -8.9953 {"}'S' green -11.7236 1.4359 -8.7942 {"}'S' sea -11.5622 1.4948 -8.6024 {"}'S' green -11.7902 1.5413 -9.2682 {"}'S' green -11.6324 1.5296 -9.0618 {"}'S' green -11.4703 1.5676 -8.8625 {"}'S' sea -11.3089 1.6527 -8.6768 {"}'S' sea -11.8295 1.8115 -9.7116 {"}'S' green -11.6967 1.7155 -9.5133 {"}'S' green -11.5465 1.6734 -9.3087 {"}'S' green -11.388 1.6854 -9.1068 {"}'S' green -11.2268 1.7518 -8.917 {"}'S' sea -11.5747 1.9236 -9.6846 {"}'S' green -11.4323 1.855 -9.4812 {"}'S' green -11.2751 1.8528 -9.2778 {"}'S' sea -11.114 1.9151 -9.0872 { HB VAL 168 A}'S' sea -12.2703 0.6861 -7.7281 {"}'S' green -12.1615 0.5454 -7.549 {"}'S' green -12.0308 0.4511 -7.354 {"}'S' sea -11.8835 0.4094 -7.1516 {"}'S' green -12.1199 0.8069 -7.9995 {"}'S' green -12.0322 0.6308 -7.8361 {"}'S' green -11.9161 0.499 -7.6506 {"}'S' green -11.7795 0.4176 -7.4506 {"}'S' sea -11.6271 0.3927 -7.2468 {"}'S' green -11.913 0.9304 -8.1755 {"}'S' green -11.7393 0.5813 -7.855 {"}'S' green -11.6109 0.4805 -7.6599 {"}'S' sea -11.4636 0.4375 -7.4573 {"}'S' sea -11.6895 1.2664 -8.3484 {"}'S' green -11.6702 1.024 -8.2564 {"}'S' green -11.6057 0.8151 -8.1138 {"}'S' green -11.502 0.6564 -7.9358 {"}'S' sea -11.3672 0.5615 -7.7349 {"}'S' sea -11.423 1.3774 -8.3409 {"}'S' green -11.4226 1.1333 -8.2727 {"}'S' green -11.3675 0.922 -8.1441 {"}'S' sea -11.2649 0.7692 -7.969 {"}'S' sea -11.1779 1.2006 -8.2065 {"}'S' sea -11.1101 0.9921 -8.0611 {HG21 VAL 168 A}'S' sea -13.4397 1.3591 -9.4065 {"}'S' sea -13.3023 1.2776 -9.207 {"}'S' sea -13.3874 1.4585 -9.7987 {"}'S' green -13.2787 1.3178 -9.6196 {"}'S' green -13.148 1.2235 -9.4245 {"}'S' green -13.0006 1.1818 -9.2222 {"}'S' green -12.8451 1.1938 -9.0244 {"}'S' green -12.6865 1.2583 -8.8376 {"}'S' sea -13.1494 1.4032 -9.9067 {"}'S' green -13.0332 1.2714 -9.7212 {"}'S' green -12.8967 1.19 -9.5211 {"}'S' green -12.4269 1.2813 -8.9392 {"}'S' green -12.8564 1.3537 -9.9256 {"}'S' green -12.728 1.2529 -9.7305 {"}'S' green -12.2648 1.3037 -9.1466 {"}'S' green -12.4843 1.3339 -9.8055 {"}'S' green -12.3285 1.3097 -9.5973 {"}'S' green -12.1652 1.3586 -9.4007 {"}'S' sea -12.2449 1.4666 -9.8401 {"}'S' green -12.0886 1.4774 -9.6409 {"}'S' green -11.9324 1.5728 -9.4663 {"}'S' sea -11.9302 1.6904 -9.7277 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 168 A}'S' P -11.8419 0.7341 -8.0301 {"}'S' -11.84 0.7456 -8.0183 {HG21 VAL 168 A}'S' P -12.7443 1.1651 -9.3174 {"}'S' -12.745 1.168 -9.3174 {"}'S' P -12.5849 1.1955 -9.1202 {"}'S' -12.5877 1.2096 -9.1222 {"}'S' P -12.5807 1.2099 -9.5279 {"}'S' -12.5807 1.2113 -9.5282 {"}'S' P -12.4225 1.2276 -9.3294 {"}'S' -12.4308 1.2496 -9.3287 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 158 A}'M' greentint -9.3659 2.2978 -6.1667 {"}'M' greentint -9.5095 2.19 -6.4391 {"}'M' greentint -9.1039 2.619 -6.034 {"}'M' greentint -9.2672 2.5856 -6.2359 {"}'M' greentint -9.4158 2.4287 -6.3844 {"}'M' greentint -9.5195 2.3324 -6.6819 {"}'M' greentint -8.96 2.8242 -6.0961 {"}'M' greentint -9.118 2.8158 -6.2981 {"}'M' greentint -9.2766 2.7226 -6.4765 {"}'M' greentint -9.4158 2.5547 -6.6096 {"}'M' greentint -9.4891 2.4264 -6.9267 {"}'M' greentint -9.5603 2.1813 -6.9509 {"}'M' greentint -8.7749 2.9942 -6.1621 {"}'M' greentint -8.931 3.0049 -6.3659 {"}'M' greentint -9.0912 2.9467 -6.5579 {"}'M' greentint -9.246 2.8236 -6.7226 {"}'M' greentint -9.3817 2.646 -6.8487 {"}'M' greentint -9.4112 2.5066 -7.1649 {"}'M' greentint -8.6878 3.1483 -6.408 {"}'M' greentint -8.8478 3.1243 -6.6093 {"}'M' greentint -9.0103 3.0427 -6.7957 {"}'M' greentint -9.1626 2.9068 -6.9557 {"}'M' greentint -9.2992 2.7252 -7.0805 {"}'M' greentint -8.7534 3.1877 -6.869 {"}'M' greentint -8.9092 3.089 -7.0423 {"}'M' greentint -9.0554 2.9454 -7.1922 {"}'M' greentint -9.1862 2.7634 -7.3106 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 168 A}'M' greentint -9.508 2.0937 -6.5792 {"}'M' greentint -9.3498 2.1574 -6.3929 {"}'M' greentint -9.1996 2.2819 -6.233 {"}'M' greentint -9.0664 2.4575 -6.1099 {"}'M' greentint -8.9612 2.6721 -6.0322 {"}'M' greentint -9.4574 2.1527 -6.9302 {"}'M' greentint -9.2992 2.1549 -6.7265 {"}'M' greentint -9.1386 2.2309 -6.5396 {"}'M' greentint -8.989 2.3763 -6.3872 {"}'M' greentint -8.8644 2.5762 -6.2814 {"}'M' greentint -8.7759 2.8138 -6.2333 {"}'M' greentint -9.3543 2.3154 -7.1852 {"}'M' greentint -9.2055 2.2658 -6.9791 {"}'M' greentint -9.0432 2.3107 -6.7812 {"}'M' greentint -8.889 2.4433 -6.6195 {"}'M' greentint -8.7647 2.6466 -6.5149 {"}'M' greentint -8.6864 2.8923 -6.4827 {"}'M' greentint -8.6655 3.1477 -6.526 {"}'M' greentint -9.2263 2.551 -7.3477 {"}'M' greentint -9.0945 2.4492 -7.1496 {"}'M' greentint -8.9335 2.4773 -6.9496 {"}'M' greentint -8.7855 2.6292 -6.8007 {"}'M' greentint -8.6907 2.8634 -6.7434 {"}'M' greentint -8.6744 3.1171 -6.7927 {"}'M' greentint -9.0652 2.8222 -7.3809 {"}'M' greentint -8.961 2.6671 -7.2031 {"}'M' greentint -8.8011 2.764 -7.0237 {"}'M' greentint -8.7461 3.0173 -7.0235 {"}'M' greentint -8.8794 2.9136 -7.2229 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 158 A}'M' greentint -10.2133 0.8421 -4.7061 {"}'M' greentint -10.3465 0.7385 -4.9056 {"}'M' greentint -10.0274 0.9335 -4.5481 {"}'M' greentint -10.1316 1.0887 -4.726 {"}'M' greentint -10.2916 0.9918 -4.9054 {"}'M' greentint -10.402 0.8924 -5.1857 {"}'M' greentint -9.7997 0.9995 -4.4383 {"}'M' greentint -9.8664 1.2048 -4.5813 {"}'M' greentint -9.9981 1.3066 -4.7795 {"}'M' greentint -10.1591 1.2785 -4.9795 {"}'M' greentint -10.3072 1.1265 -5.1283 {"}'M' greentint -10.3737 0.9899 -5.4393 {"}'M' greentint -9.5817 1.207 -4.4764 {"}'M' greentint -9.6748 1.3816 -4.6452 {"}'M' greentint -9.8097 1.4764 -4.8461 {"}'M' greentint -9.9686 1.4796 -5.0521 {"}'M' greentint -10.1288 1.3885 -5.2349 {"}'M' greentint -10.2702 1.218 -5.3705 {"}'M' greentint -9.433 1.4665 -4.6998 {"}'M' greentint -9.5612 1.5756 -4.8965 {"}'M' greentint -9.7128 1.6111 -5.1016 {"}'M' greentint -9.8741 1.572 -5.2995 {"}'M' greentint -10.0308 1.4599 -5.4709 {"}'M' greentint -10.1693 1.2852 -5.6016 {"}'M' greentint -9.5846 1.6621 -5.3499 {"}'M' greentint -9.7428 1.5984 -5.5362 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 168 A}'M' greentint -10.2858 0.7535 -5.137 {"}'M' greentint -10.1286 0.7489 -4.9314 {"}'M' greentint -9.966 0.8047 -4.7372 {"}'M' greentint -9.8081 0.9149 -4.5638 {"}'M' greentint -10.2022 0.9314 -5.3949 {"}'M' greentint -10.0542 0.8843 -5.1905 {"}'M' greentint -9.895 0.9068 -4.99 {"}'M' greentint -9.7353 0.9954 -4.809 {"}'M' greentint -9.5886 1.145 -4.6614 {"}'M' greentint -10.0739 1.1431 -5.5465 {"}'M' greentint -9.9356 1.0663 -5.345 {"}'M' greentint -9.7768 1.0773 -5.1441 {"}'M' greentint -9.6197 1.1732 -4.9667 {"}'M' greentint -9.4813 1.3437 -4.8352 {"}'M' greentint -9.9342 1.3777 -5.621 {"}'M' greentint -9.8013 1.2741 -5.4207 {"}'M' greentint -9.6381 1.3034 -5.2181 {"}'M' greentint -9.4884 1.4571 -5.0673 {"}'M' greentint -9.6886 1.504 -5.4559 {"}'M' greentint -9.5299 1.6013 -5.2783 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 221 2gufA_223Y_247}P -11.6787 -1.6878 1.1857 {"}-11.6787 -1.6878 1.1857 { ca tyr A 221 2gufA_223Y_247}-10.7264 -1.9956 0.1429 { c tyr A 221 2gufA_223Y_247}-10.7565 -0.947 -0.9613 { o tyr A 221 2gufA_223Y_247}-11.7051 -0.1525 -1.089 { c tyr A 221 2gufA_223Y_247}P -10.7565 -0.947 -0.9613 { n gly A 222 2gufA_223Y_247}-9.7378 -1.0126 -1.8011 { ca gly A 222 2gufA_223Y_247}-9.6661 -0.0964 -2.905 { c gly A 222 2gufA_223Y_247}-8.7037 -0.6164 -3.9487 { o gly A 222 2gufA_223Y_247}-7.9565 -1.5841 -3.7251 { c gly A 222 2gufA_223Y_247}P -8.7037 -0.6164 -3.9487 { n tyr A 223 2gufA_223Y_247}-8.7387 0.0288 -5.0974 { ca tyr A 223 2gufA_223Y_247}-7.7776 -0.2968 -6.1377 { c tyr A 223 2gufA_223Y_247}-7.5382 0.8973 -7.0059 { o tyr A 223 2gufA_223Y_247}-8.3838 1.7898 -7.0563 { c tyr A 223 2gufA_223Y_247}P -7.5382 0.8973 -7.0059 { n asp A 224 2gufA_223Y_247}-6.3365 0.9603 -7.5942 { ca asp A 224 2gufA_223Y_247}-5.9838 2.0119 -8.5211 { c asp A 224 2gufA_223Y_247}-5.8124 1.2742 -9.8136 { o asp A 224 2gufA_223Y_247}-5.0177 0.3624 -9.8504 { c asp A 224 2gufA_223Y_247}P -5.8124 1.2742 -9.8136 { n asn A 225 2gufA_223Y_247}-6.6818 1.53 -10.8074 { ca asn A 225 2gufA_223Y_247}-6.5293 0.8992 -12.1159 { c asn A 225 2gufA_223Y_247}-6.103 1.8928 -13.1903 { o asn A 225 2gufA_223Y_247}-6.6927 2.9529 -13.3241 { n leu A 245 2gufA_223Y_247}P -8.4032 5.2037 -12.611 {"}-8.4032 5.2037 -12.611 { ca leu A 245 2gufA_223Y_247}-9.5375 5.0417 -11.7627 { c leu A 245 2gufA_223Y_247}-8.9457 4.7361 -10.3698 { o leu A 245 2gufA_223Y_247}-8.095 3.8526 -10.2289 { c leu A 245 2gufA_223Y_247}P -8.9457 4.7361 -10.3698 { n tyr A 246 2gufA_223Y_247}-9.3536 5.5001 -9.3552 { ca tyr A 246 2gufA_223Y_247}-8.9941 5.2264 -7.9623 { c tyr A 246 2gufA_223Y_247}-10.3036 4.9993 -7.2379 { o tyr A 246 2gufA_223Y_247}-11.1999 5.8348 -7.2967 { c tyr A 246 2gufA_223Y_247}P -10.3036 4.9993 -7.2379 { n ser A 247 2gufA_223Y_247}-10.4536 3.8347 -6.6387 { ca ser A 247 2gufA_223Y_247}-11.6958 3.4696 -6.0437 { c ser A 247 2gufA_223Y_247}-11.4474 2.9518 -4.6375 { o ser A 247 2gufA_223Y_247}-10.424 2.2442 -4.3966 { c ser A 247 2gufA_223Y_247}P -11.4474 2.9518 -4.6375 { n gln A 248 2gufA_223Y_247}-12.3539 3.3175 -3.7162 { ca gln A 248 2gufA_223Y_247}-12.357 2.7989 -2.3564 { c gln A 248 2gufA_223Y_247}-13.753 2.5129 -1.9229 { o gln A 248 2gufA_223Y_247}-14.7006 3.155 -2.3582 { c gln A 248 2gufA_223Y_247}P -13.753 2.5129 -1.9229 { n ser A 249 2gufA_223Y_247}-13.8742 1.5198 -1.0587 { ca ser A 249 2gufA_223Y_247}-15.1531 1.1192 -0.6082 { c ser A 249 2gufA_223Y_247}-14.9888 0.6689 0.8264 { o ser A 249 2gufA_223Y_247}-14.0501 -0.0762 1.1567 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 221 2gufA_223Y_247}P -11.6787 -1.6878 1.1857 { ca tyr A 221 2gufA_223Y_247}P -10.7264 -1.9956 0.1429 { n gly A 222 2gufA_223Y_247}P -9.7378 -1.0126 -1.8011 { ca gly A 222 2gufA_223Y_247}P -9.6661 -0.0964 -2.905 {"}P -9.6661 -0.0964 -2.905 { n tyr A 223 2gufA_223Y_247}P -8.7387 0.0288 -5.0974 { ca tyr A 223 2gufA_223Y_247}P -7.7776 -0.2968 -6.1377 { n asp A 224 2gufA_223Y_247}P -6.3365 0.9603 -7.5942 { ca asp A 224 2gufA_223Y_247}P -5.9838 2.0119 -8.5211 { n asn A 225 2gufA_223Y_247}P -6.6818 1.53 -10.8074 { ca asn A 225 2gufA_223Y_247}P -6.5293 0.8992 -12.1159 { n leu A 245 2gufA_223Y_247}P -8.4032 5.2037 -12.611 { ca leu A 245 2gufA_223Y_247}P -9.5375 5.0417 -11.7627 { n tyr A 246 2gufA_223Y_247}P -9.3536 5.5001 -9.3552 { ca tyr A 246 2gufA_223Y_247}P -8.9941 5.2264 -7.9623 { n ser A 247 2gufA_223Y_247}P -10.4536 3.8347 -6.6387 { ca ser A 247 2gufA_223Y_247}P -11.6958 3.4696 -6.0437 { n gln A 248 2gufA_223Y_247}P -12.3539 3.3175 -3.7162 { ca gln A 248 2gufA_223Y_247}P -12.357 2.7989 -2.3564 { n ser A 249 2gufA_223Y_247}P -13.8742 1.5198 -1.0587 { ca ser A 249 2gufA_223Y_247}P -15.1531 1.1192 -0.6082 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 221 2gufA_223Y_247}P -10.7264 -1.9956 0.1429 {"}-10.7264 -1.9956 0.1429 { ca gly A 222 2gufA_223Y_247}-9.6661 -0.0964 -2.905 { ca tyr A 223 2gufA_223Y_247}-7.7776 -0.2968 -6.1377 { ca asp A 224 2gufA_223Y_247}-5.9838 2.0119 -8.5211 { ca asn A 225 2gufA_223Y_247}-6.5293 0.8992 -12.1159 { ca leu A 245 2gufA_223Y_247}P -9.5375 5.0417 -11.7627 {"}-9.5375 5.0417 -11.7627 { ca tyr A 246 2gufA_223Y_247}-8.9941 5.2264 -7.9623 { ca ser A 247 2gufA_223Y_247}-11.6958 3.4696 -6.0437 { ca gln A 248 2gufA_223Y_247}-12.357 2.7989 -2.3564 { ca ser A 249 2gufA_223Y_247}-15.1531 1.1192 -0.6082 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 223 2gufA_223Y_247}P -7.7776 -0.2968 -6.1377 { cb tyr A 223 2gufA_223Y_247}-8.2284 -1.4945 -6.9606 { cg tyr A 223 2gufA_223Y_247}-9.667 -1.4344 -7.2592 { cd1 tyr A 223 2gufA_223Y_247}-10.1358 -0.7975 -8.4076 { ce1 tyr A 223 2gufA_223Y_247}-11.4909 -0.7444 -8.6655 { cz tyr A 223 2gufA_223Y_247}-12.3804 -1.3145 -7.7569 { oh tyr A 223 2gufA_223Y_247}-13.76 -1.2585 -8.0181 { cg tyr A 223 2gufA_223Y_247}P -9.667 -1.4344 -7.2592 { cd2 tyr A 223 2gufA_223Y_247}-10.604 -2.0183 -6.3696 { ce2 tyr A 223 2gufA_223Y_247}-11.9437 -1.9453 -6.6075 { cz tyr A 223 2gufA_223Y_247}ghost -12.3804 -1.3145 -7.7569 { ca ser A 247 2gufA_223Y_247}P -11.6958 3.4696 -6.0437 { cb ser A 247 2gufA_223Y_247}-12.3258 2.34 -6.869 { og ser A 247 2gufA_223Y_247}-13.4165 1.8416 -6.1716 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 223 2gufA_223Y_247}P -8.2284 -1.4945 -6.9606 {"}P -8.2284 -1.4945 -6.9606 { cd1 tyr A 223 2gufA_223Y_247}P -10.1358 -0.7975 -8.4076 { cd2 tyr A 223 2gufA_223Y_247}P -10.604 -2.0183 -6.3696 { ce1 tyr A 223 2gufA_223Y_247}P -11.4909 -0.7444 -8.6655 { ce2 tyr A 223 2gufA_223Y_247}P -11.9437 -1.9453 -6.6075 { oh tyr A 223 2gufA_223Y_247}P -13.76 -1.2585 -8.0181 { cb ser A 247 2gufA_223Y_247}P -12.3258 2.34 -6.869 {"}P -12.3258 2.34 -6.869 { og ser A 247 2gufA_223Y_247}P -13.4165 1.8416 -6.1716 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 223 A}'S' blue -10.7918 0.2153 -7.1396 {"}'S' blue -10.5899 0.3804 -7.1951 {"}'S' sky -10.4807 0.6185 -7.4386 {"}'S' blue -10.369 0.7851 -7.6982 {"}'S' blue -10.5169 0.8349 -7.9032 {"}'S' blue -10.6728 0.8405 -8.1073 { CE1 TYR 223 A}'S' sky -12.4086 0.4616 -7.7907 {"}'S' sky -12.363 0.6435 -8.0519 {"}'S' blue -12.2897 0.7718 -8.3108 {"}'S' blue -12.0279 0.8936 -8.3652 { CZ TYR 223 A}'S' 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{"}'S' sea -11.872 0.888 -8.1611 {"}'S' sea -11.0447 0.2707 -7.3115 {"}'S' green -11.117 0.4661 -7.4584 {"}'S' green -11.451 0.8758 -8.0049 {"}'S' green -11.5934 0.9417 -8.2078 {"}'S' green -11.0017 0.6876 -7.7854 {"}'S' green -11.1204 0.8212 -7.9764 {"}'S' sea -11.2548 0.9197 -8.1774 { CZ TYR 223 A}'S' sea -12.0099 0.2511 -7.0678 {"}'S' sea -12.1443 0.3495 -7.2688 {"}'S' sea -12.291 0.4103 -7.4764 {"}'S' sea -11.7025 0.1447 -7.0694 {"}'S' green -11.8248 0.2693 -7.2633 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 223 A}'S' P -11.7136 0.5453 -7.504 {"}'S' -11.7099 0.5209 -7.526 {"}'S' P -11.8358 0.6716 -7.6965 {"}'S' -11.83 0.6476 -7.7122 {"}'S' P -11.3734 0.455 -7.3962 {"}'S' -11.374 0.4522 -7.3998 {"}'S' P -11.4711 0.6189 -7.5688 {"}'S' -11.4715 0.5783 -7.6011 {"}'S' P -11.5886 0.748 -7.7572 {"}'S' -11.5862 0.7032 -7.7847 {"}'S' P -11.7241 0.8382 -7.9561 {"}'S' -11.7227 0.8318 -7.9596 {"}'S' P -11.2103 0.6351 -7.6262 {"}'S' -11.2126 0.6234 -7.6351 {"}'S' P -11.323 0.7729 -7.81 {"}'S' -11.3257 0.7488 -7.8236 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 247 A}'S' blue -12.8855 0.7594 -7.3689 {"}'S' blue -12.748 0.6676 -7.1669 {"}'S' sky -12.5994 0.6138 -6.96 {"}'S' blue -12.4421 0.5975 -6.7516 {"}'S' blue -12.754 0.8332 -7.6486 {"}'S' sky -12.6272 0.7175 -7.4524 {"}'S' sky -12.4852 0.6391 -7.2472 {"}'S' sky -12.3328 0.5983 -7.0399 {"}'S' blue -12.6096 0.9654 -7.9138 {"}'S' sky -12.4978 0.8261 -7.7309 {"}'S' sky -12.3695 0.7225 -7.5353 {"}'S' blue -12.3941 1.0489 -8.0484 {"}'S' sky -12.1589 1.1334 -8.1256 {"}'S' sky -11.9198 1.2351 -8.1638 { HB3 SER 247 A}'S' sky -11.9383 0.4613 -6.7667 {"}'S' blue -11.633 0.4033 -6.7873 {"}'S' sky -10.9531 0.5681 -7.1637 {"}'S' blue -10.7959 0.6865 -6.9929 {"}'S' sky -10.7203 0.7822 -7.2293 {"}'S' sky -10.7181 0.8999 -7.4907 {"}'S' blue -10.7567 1.0968 -7.7387 @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 247 A}'S' sea -12.2846 0.9029 -7.8672 { HB3 SER 247 A}'S' sea -12.2276 0.5686 -7.1695 {"}'S' sea -12.0902 0.4871 -6.97 {"}'S' sea -12.1753 0.668 -7.5616 {"}'S' green -12.0665 0.5273 -7.3826 {"}'S' green -11.9358 0.4329 -7.1875 {"}'S' sea -11.7885 0.3913 -6.9852 {"}'S' green -12.0249 0.7888 -7.8331 {"}'S' green -11.6845 0.3995 -7.2841 {"}'S' sea -11.5321 0.3745 -7.0804 {"}'S' sea -11.8524 1.1399 -8.1167 {"}'S' green -11.818 0.9123 -8.0091 {"}'S' green -11.3686 0.4193 -7.2909 {"}'S' sea -11.2104 0.4371 -7.0924 {"}'S' green -11.5752 1.0059 -8.0899 {"}'S' green -11.1164 0.5192 -7.3603 {"}'S' sea -11.3276 1.1151 -8.1063 {"}'S' green -11.2725 0.9039 -7.9776 {"}'S' green -11.1699 0.7511 -7.8026 {"}'S' green -11.0328 0.6761 -7.6031 {"}'S' sea -10.8765 0.6869 -7.4039 {"}'S' sea -11.0151 0.974 -7.8947 {"}'S' sea -10.8817 0.8712 -7.694 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 SER 247 A}'S' P -11.9372 0.6126 -7.6696 {"}'S' -11.9355 0.6158 -7.6679 {"}'S' P -11.8211 0.4809 -7.4842 {"}'S' -11.8199 0.4886 -7.481 {"}'S' P -11.7469 0.7159 -7.8637 {"}'S' -11.7428 0.7395 -7.8412 {"}'S' P -11.6443 0.5632 -7.6886 {"}'S' -11.6417 0.6099 -7.6581 {"}'S' P -11.5159 0.4624 -7.4935 {"}'S' -11.5178 0.4936 -7.4811 {"}'S' P -11.5107 0.797 -7.9473 {"}'S' -11.5118 0.8128 -7.9285 {"}'S' P -11.4071 0.6383 -7.7694 {"}'S' -11.4141 0.6774 -7.7383 {"}'S' P -11.2722 0.5434 -7.5685 {"}'S' -11.2778 0.5627 -7.5584 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 223 A}'M' green -8.7842 3.1233 -6.9101 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 223 A}'M' greentint -9.3969 2.2709 -6.2183 {"}'M' greentint -9.5559 2.1822 -6.3999 {"}'M' greentint -9.2939 2.5035 -6.2673 {"}'M' greentint -9.4572 2.4701 -6.4692 {"}'M' greentint -9.6058 2.3132 -6.6177 {"}'M' greentint -9.7095 2.2168 -6.9151 {"}'M' greentint -9.0122 2.6293 -6.1297 {"}'M' greentint -9.15 2.7086 -6.3293 {"}'M' greentint -9.3079 2.7002 -6.5313 {"}'M' greentint -9.4665 2.6071 -6.7097 {"}'M' greentint -9.6058 2.4391 -6.8429 {"}'M' greentint -8.9648 2.8787 -6.3953 {"}'M' greentint -9.121 2.8893 -6.5992 {"}'M' greentint -9.2811 2.8311 -6.7912 {"}'M' greentint -9.4359 2.708 -6.9558 {"}'M' greentint -9.5716 2.5305 -7.082 {"}'M' greentint -8.8777 3.0327 -6.6412 {"}'M' greentint -9.0382 3.0093 -6.8433 {"}'M' greentint -9.2003 2.9271 -7.0289 {"}'M' greentint -9.3525 2.7912 -7.1889 {"}'M' greentint -9.4892 2.6096 -7.3137 {"}'M' greentint -8.9434 3.0722 -7.1022 {"}'M' greentint -9.0992 2.9734 -7.2756 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 247 A}'M' greentint -9.5825 2.1585 -6.5181 {"}'M' greentint -9.4243 2.2222 -6.3318 {"}'M' greentint -9.2741 2.3467 -6.172 {"}'M' greentint -9.6733 2.2905 -7.0722 {"}'M' greentint -9.532 2.2175 -6.8692 {"}'M' greentint -9.3738 2.2197 -6.6654 {"}'M' greentint -9.2131 2.2957 -6.4785 {"}'M' greentint -9.0636 2.4411 -6.3261 {"}'M' greentint -8.939 2.641 -6.2203 {"}'M' greentint -9.5449 2.5172 -7.3124 {"}'M' greentint -9.4288 2.3802 -7.1242 {"}'M' greentint -9.2801 2.3305 -6.9181 {"}'M' greentint -9.1177 2.3755 -6.7201 {"}'M' greentint -8.9635 2.5081 -6.5584 {"}'M' greentint -8.8393 2.7114 -6.4538 {"}'M' greentint -8.761 2.9571 -6.4217 {"}'M' greentint -9.3008 2.6158 -7.2867 {"}'M' greentint -9.1691 2.514 -7.0885 {"}'M' greentint -9.0081 2.5421 -6.8885 {"}'M' greentint -8.86 2.694 -6.7397 {"}'M' greentint -8.7652 2.9281 -6.6823 {"}'M' greentint -9.1398 2.887 -7.3199 {"}'M' greentint -9.0356 2.7319 -7.142 {"}'M' greentint -8.8756 2.8288 -6.9626 {"}'M' greentint -8.8207 3.0821 -6.9624 {"}'M' greentint -8.9539 2.9784 -7.1619 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 223 A}'M' green -9.5412 1.7398 -5.3699 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 223 A}'M' greentint -10.1699 0.9199 -4.7261 {"}'M' greentint -9.984 1.0113 -4.5681 {"}'M' greentint -10.0882 1.1665 -4.7459 {"}'M' greentint -10.2482 1.0696 -4.9254 {"}'M' greentint -9.7563 1.0773 -4.4582 {"}'M' greentint -9.823 1.2826 -4.6013 {"}'M' greentint -9.9547 1.3843 -4.7995 {"}'M' greentint -10.1157 1.3563 -4.9994 {"}'M' greentint -10.2638 1.2043 -5.1483 {"}'M' greentint -9.5383 1.2848 -4.4963 {"}'M' greentint -9.6314 1.4593 -4.6652 {"}'M' greentint -9.7663 1.5542 -4.8661 {"}'M' greentint -9.9252 1.5573 -5.072 {"}'M' greentint -10.0854 1.4663 -5.2549 {"}'M' greentint -10.2268 1.2958 -5.3904 {"}'M' greentint -9.3896 1.5443 -4.7197 {"}'M' greentint -9.5178 1.6534 -4.9165 {"}'M' greentint -9.6694 1.6889 -5.1216 {"}'M' greentint -9.8307 1.6497 -5.3195 {"}'M' greentint -9.9874 1.5377 -5.4909 {"}'M' greentint -9.3869 1.7391 -5.1707 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 247 A}'M' green -10.2577 0.93 -4.8501 {"}'M' green -10.1066 0.904 -4.6479 {"}'M' green -9.9486 0.928 -4.4512 {"}'M' green -10.1395 1.471 -5.5281 {"}'M' green -9.4058 1.7614 -5.2273 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 247 A}'M' greentint -10.2738 1.1925 -5.308 {"}'M' greentint -10.1492 1.0743 -5.1142 {"}'M' greentint -10.003 1.011 -4.9084 {"}'M' greentint -9.8458 1.0064 -4.7027 {"}'M' greentint -9.6832 1.0621 -4.5086 {"}'M' greentint -10.045 1.3013 -5.3602 {"}'M' greentint -9.9194 1.1888 -5.1663 {"}'M' greentint -9.7714 1.1418 -4.9618 {"}'M' greentint -9.6122 1.1642 -4.7613 {"}'M' greentint -9.4525 1.2528 -4.5803 {"}'M' greentint -9.8945 1.5545 -5.4943 {"}'M' greentint -9.7911 1.4005 -5.3178 {"}'M' greentint -9.6528 1.3237 -5.1163 {"}'M' greentint -9.494 1.3347 -4.9154 {"}'M' greentint -9.3369 1.4306 -4.7381 {"}'M' greentint -9.6514 1.6351 -5.3923 {"}'M' greentint -9.5185 1.5316 -5.1921 {"}'M' greentint -9.3553 1.5608 -4.9894 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 30 2h1tA_49Y_32S}P -8.3586 4.9316 -12.8673 {"}-8.3586 4.9316 -12.8673 { ca ala A 30 2h1tA_49Y_32S}-9.4104 5.0983 -11.8821 { c ala A 30 2h1tA_49Y_32S}-8.8657 4.7456 -10.536 { o ala A 30 2h1tA_49Y_32S}-7.9427 3.9279 -10.402 { c ala A 30 2h1tA_49Y_32S}P -8.8657 4.7456 -10.536 { n glu A 31 2h1tA_49Y_32S}-9.4706 5.3568 -9.5336 { ca glu A 31 2h1tA_49Y_32S}-9.1852 5.0494 -8.1746 { c glu A 31 2h1tA_49Y_32S}-10.4976 4.9426 -7.4422 { o glu A 31 2h1tA_49Y_32S}-11.3871 5.7874 -7.6375 { c glu A 31 2h1tA_49Y_32S}P -10.4976 4.9426 -7.4422 { n ser A 32 2h1tA_49Y_32S}-10.6002 3.9075 -6.6183 { ca ser A 32 2h1tA_49Y_32S}-11.8382 3.5377 -6.0095 { c ser A 32 2h1tA_49Y_32S}-11.6825 3.0298 -4.5768 { o ser A 32 2h1tA_49Y_32S}-10.6549 2.4628 -4.2084 { c ser A 32 2h1tA_49Y_32S}P -11.6825 3.0298 -4.5768 { n gln A 33 2h1tA_49Y_32S}-12.7165 3.3069 -3.7857 { ca gln A 33 2h1tA_49Y_32S}-12.8781 2.8237 -2.4385 { c gln A 33 2h1tA_49Y_32S}-14.1886 2.0577 -2.4145 { o gln A 33 2h1tA_49Y_32S}-15.2626 2.6189 -2.6911 { c gln A 33 2h1tA_49Y_32S}P -14.1886 2.0577 -2.4145 { n leu A 34 2h1tA_49Y_32S}-14.1012 0.7851 -2.0455 { ca leu A 34 2h1tA_49Y_32S}-15.2426 -0.1109 -2.0817 { c leu A 34 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-7.5146 {"}'S' sky -12.9236 0.6165 -7.7165 {"}'S' sky -12.8436 0.7774 -7.977 {"}'S' sky -12.7427 0.8842 -8.2345 {"}'S' sky -12.4602 0.9595 -8.2807 {"}'S' sky -12.1164 0.9711 -8.2544 {"}'S' blue -12.273 0.994 -8.4617 {"}'S' sky -11.3368 0.3634 -7.5064 {"}'S' sky -11.7881 0.9211 -8.2437 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 49 A}'S' sea -11.7309 0.2837 -6.4136 {"}'S' sea -11.4456 0.382 -6.4631 {"}'S' sea -11.2623 0.4123 -6.6485 {"}'S' green -11.4262 0.3556 -6.8442 {"}'S' sea -11.084 0.4006 -6.8429 {"}'S' sea -11.2476 0.3392 -7.0371 { CE1 TYR 49 A}'S' sea -11.3679 0.573 -7.7506 {"}'S' sea -11.4646 0.7402 -7.9209 {"}'S' sea -11.5862 0.8622 -8.1132 {"}'S' sea -11.2333 0.852 -7.9719 { CE2 TYR 49 A}'S' sea -12.4678 0.3972 -6.524 {"}'S' sea -12.6157 0.447 -6.729 {"}'S' sea -12.0668 0.3318 -6.3779 {"}'S' green -12.1947 0.4348 -6.5729 {"}'S' green -12.3372 0.5007 -6.7757 {"}'S' green -12.4891 0.5278 -6.9793 {"}'S' sea -12.6467 0.5147 -7.1798 {"}'S' green -11.8641 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{"}'S' -12.0846 0.5316 -7.374 {"}'S' P -11.9508 0.4339 -7.1808 {"}'S' -11.946 0.4854 -7.1706 {"}'S' P -11.7984 0.4089 -6.9771 {"}'S' -11.8003 0.4479 -6.9767 {"}'S' P -12.0131 0.7503 -7.7604 {"}'S' -12.0106 0.7678 -7.7437 {"}'S' P -11.9106 0.5976 -7.5853 {"}'S' -11.9095 0.628 -7.5652 {"}'S' P -11.7821 0.4968 -7.3901 {"}'S' -11.7821 0.4982 -7.3904 {"}'S' P -11.6348 0.4537 -7.1876 {"}'S' -11.6344 0.4559 -7.1874 @dotlist {x} color= red width= 1 master= {vdw contact} { HG SER 32 A}'S' blue -13.813 0.2725 -7.0473 {"}'S' sky -13.6548 0.2747 -6.8435 {"}'S' sky -13.4941 0.3507 -6.6567 {"}'S' blue -13.3446 0.4961 -6.5043 {"}'S' sky -13.5611 0.3856 -7.0962 {"}'S' sky -13.3988 0.4305 -6.8983 {"}'S' sky -13.2445 0.5631 -6.7366 {"}'S' blue -13.4501 0.569 -7.2667 {"}'S' sky -13.2891 0.5971 -7.0667 {"}'S' blue -13.1411 0.749 -6.9178 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 49 A}'M' green -9.3678 2.5273 -5.9653 {"}'M' green -9.6703 2.3309 -6.4193 {"}'M' green -9.07 3.2298 -7.0225 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 49 A}'M' greentint -9.5267 2.4386 -6.1469 {"}'M' greentint -9.2647 2.7599 -6.0142 {"}'M' greentint -9.428 2.7265 -6.2161 {"}'M' greentint -9.5766 2.5696 -6.3646 {"}'M' greentint -9.6803 2.4732 -6.6621 {"}'M' greentint -9.1208 2.965 -6.0763 {"}'M' greentint -9.2788 2.9566 -6.2783 {"}'M' greentint -9.4374 2.8635 -6.4567 {"}'M' greentint -9.5766 2.6955 -6.5898 {"}'M' greentint -9.6499 2.5672 -6.9069 {"}'M' greentint -8.9356 3.1351 -6.1423 {"}'M' greentint -9.0918 3.1457 -6.3461 {"}'M' greentint -9.252 3.0875 -6.5381 {"}'M' greentint -9.4068 2.9644 -6.7028 {"}'M' greentint -9.5425 2.7869 -6.8289 {"}'M' greentint -8.8485 3.2892 -6.3882 {"}'M' greentint -9.009 3.2657 -6.5902 {"}'M' greentint -9.1711 3.1835 -6.7759 {"}'M' greentint -9.3233 3.0476 -6.9358 {"}'M' greentint -9.46 2.866 -7.0607 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 32 A}'M' greentint -9.5218 2.3957 -6.1407 {"}'M' greentint -9.3716 2.5202 -5.9809 {"}'M' greentint -9.6295 2.391 -6.678 {"}'M' greentint -9.4713 2.3932 -6.4743 {"}'M' greentint -9.3106 2.4692 -6.2874 {"}'M' greentint -9.1611 2.6146 -6.135 {"}'M' greentint -9.0365 2.8145 -6.0292 {"}'M' greentint -9.5263 2.5537 -6.9331 {"}'M' greentint -9.3776 2.5041 -6.727 {"}'M' greentint -9.2152 2.549 -6.529 {"}'M' greentint -9.061 2.6816 -6.3673 {"}'M' greentint -8.9368 2.8849 -6.2627 {"}'M' greentint -8.8585 3.1306 -6.2306 {"}'M' greentint -9.3983 2.7893 -7.0956 {"}'M' greentint -9.2666 2.6875 -6.8974 {"}'M' greentint -9.1056 2.7156 -6.6974 {"}'M' greentint -8.9575 2.8675 -6.5486 {"}'M' greentint -8.8627 3.1017 -6.4912 {"}'M' greentint -9.2373 3.0605 -7.1288 {"}'M' greentint -9.1331 2.9054 -6.9509 {"}'M' greentint -8.9731 3.0023 -6.7715 {"}'M' greentint -8.9182 3.2556 -6.7713 {"}'M' greentint -9.0514 3.1519 -6.9708 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 49 A}'M' greentint -10.047 1.2967 -4.1486 {"}'M' greentint -10.1803 1.1931 -4.3481 {"}'M' greentint -9.8612 1.3881 -3.9906 {"}'M' greentint -9.9654 1.5433 -4.1685 {"}'M' greentint -10.1253 1.4464 -4.3479 {"}'M' greentint -10.2357 1.347 -4.6282 {"}'M' greentint -9.7001 1.6594 -4.0238 {"}'M' greentint -9.8319 1.7612 -4.222 {"}'M' greentint -9.9929 1.7331 -4.422 {"}'M' greentint -10.1409 1.5811 -4.5708 {"}'M' greentint -10.2074 1.4445 -4.8818 {"}'M' greentint -9.5086 1.8362 -4.0878 {"}'M' greentint -9.6435 1.931 -4.2886 {"}'M' greentint -9.8023 1.9342 -4.4946 {"}'M' greentint -9.9626 1.8431 -4.6774 {"}'M' greentint -10.104 1.6726 -4.813 {"}'M' greentint -9.3949 2.0302 -4.339 {"}'M' greentint -9.5466 2.0657 -4.5441 {"}'M' greentint -9.7079 2.0266 -4.742 {"}'M' greentint -9.8645 1.9145 -4.9134 {"}'M' greentint -10.0031 1.7398 -5.0441 {"}'M' greentint -9.5766 2.053 -4.9787 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 32 A}'M' green -10.0215 1.2206 -4.0792 {"}'M' green -9.3264 2.0432 -4.3475 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 32 A}'M' greentint -10.2339 1.2295 -4.7202 {"}'M' greentint -10.0767 1.2249 -4.5145 {"}'M' greentint -9.9141 1.2806 -4.3204 {"}'M' greentint -9.7563 1.3909 -4.1469 {"}'M' greentint -9.6109 1.5526 -4.004 {"}'M' greentint -10.1503 1.4074 -4.9781 {"}'M' greentint -10.0023 1.3603 -4.7736 {"}'M' greentint -9.8431 1.3828 -4.5731 {"}'M' greentint -9.6834 1.4714 -4.3921 {"}'M' greentint -9.5367 1.621 -4.2446 {"}'M' greentint -9.413 1.8207 -4.1399 {"}'M' greentint -10.0221 1.6191 -5.1296 {"}'M' greentint -9.8837 1.5423 -4.9281 {"}'M' greentint -9.7249 1.5533 -4.7272 {"}'M' greentint -9.5678 1.6492 -4.5499 {"}'M' greentint -9.4294 1.8197 -4.4184 {"}'M' greentint -9.7494 1.7501 -5.0039 {"}'M' greentint -9.5862 1.7793 -4.8013 {"}'M' greentint -9.4365 1.9331 -4.6504 {"}'M' greentint -9.6367 1.98 -5.0391 {"}'M' greentint -9.478 2.0773 -4.8615 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 34 2h3bA_36Y_400K}P -11.6163 -1.6479 1.2346 {"}-11.6163 -1.6479 1.2346 { ca tyr A 34 2h3bA_36Y_400K}-10.6635 -2.1392 0.2463 { c tyr A 34 2h3bA_36Y_400K}-10.8037 -1.332 -1.0404 { o tyr A 34 2h3bA_36Y_400K}-11.8927 -1.2597 -1.6173 { c tyr A 34 2h3bA_36Y_400K}P -10.8037 -1.332 -1.0404 { n ser A 35 2h3bA_36Y_400K}-9.702 -0.7388 -1.4933 { ca ser A 35 2h3bA_36Y_400K}-9.7164 0.078 -2.706 { c ser A 35 2h3bA_36Y_400K}-8.6437 -0.3498 -3.702 { o ser A 35 2h3bA_36Y_400K}-7.6869 -1.029 -3.3363 { c ser A 35 2h3bA_36Y_400K}P -8.6437 -0.3498 -3.702 { n tyr A 36 2h3bA_36Y_400K}-8.7957 0.0646 -4.9545 { ca tyr A 36 2h3bA_36Y_400K}-7.8374 -0.3172 -5.9841 { c tyr A 36 2h3bA_36Y_400K}-7.5441 0.8178 -6.9514 { o tyr A 36 2h3bA_36Y_400K}-8.3129 1.7776 -7.0678 { c tyr A 36 2h3bA_36Y_400K}P -7.5441 0.8178 -6.9514 { n phe A 37 2h3bA_36Y_400K}-6.4278 0.6849 -7.6562 { ca phe A 37 2h3bA_36Y_400K}-6.0005 1.673 -8.6373 { c phe A 37 2h3bA_36Y_400K}-5.9183 0.9891 -9.9974 { o phe A 37 2h3bA_36Y_400K}-5.4342 -0.1397 -10.1069 { c phe A 37 2h3bA_36Y_400K}P -5.9183 0.9891 -9.9974 { n glu A 38 2h3bA_36Y_400K}-6.3972 1.6726 -11.0267 { ca glu A 38 2h3bA_36Y_400K}-6.3432 1.1494 -12.3868 { c glu A 38 2h3bA_36Y_400K}-6.2273 2.3163 -13.3646 { o glu A 38 2h3bA_36Y_400K}-6.4933 3.4651 -13.0129 { n ser A 398 2h3bA_36Y_400K}P -7.2507 6.0286 -11.8512 {"}-7.2507 6.0286 -11.8512 { ca ser A 398 2h3bA_36Y_400K}-8.2913 6.1775 -10.8519 { c ser A 398 2h3bA_36Y_400K}-8.1369 5.221 -9.6792 { o ser A 398 2h3bA_36Y_400K}-7.6898 4.0868 -9.8413 { c ser A 398 2h3bA_36Y_400K}P -8.1369 5.221 -9.6792 { n phe A 399 2h3bA_36Y_400K}-8.5201 5.711 -8.5034 { ca phe A 399 2h3bA_36Y_400K}-8.4647 4.9751 -7.2413 { c phe A 399 2h3bA_36Y_400K}-9.9097 4.9153 -6.7572 { o phe A 399 2h3bA_36Y_400K}-10.5383 5.9584 -6.5711 { c phe A 399 2h3bA_36Y_400K}P -9.9097 4.9153 -6.7572 { n lys A 400 2h3bA_36Y_400K}-10.4325 3.711 -6.5543 { ca lys A 400 2h3bA_36Y_400K}-11.8185 3.5489 -6.1115 { c lys A 400 2h3bA_36Y_400K}-11.997 2.4331 -5.0858 { o lys A 400 2h3bA_36Y_400K}-11.2701 1.4398 -5.0959 { c lys A 400 2h3bA_36Y_400K}P -11.997 2.4331 -5.0858 { n cys A 401 2h3bA_36Y_400K}-12.9746 2.6007 -4.2028 { ca cys A 401 2h3bA_36Y_400K}-13.275 1.5841 -3.2005 { c cys A 401 2h3bA_36Y_400K}-14.1146 0.5342 -3.9221 { o cys A 401 2h3bA_36Y_400K}-15.0525 0.8849 -4.645 { c cys A 401 2h3bA_36Y_400K}P -14.1146 0.5342 -3.9221 { n ser A 402 2h3bA_36Y_400K}-13.7824 -0.7436 -3.7489 { ca ser A 402 2h3bA_36Y_400K}-14.5423 -1.8013 -4.4196 { c ser A 402 2h3bA_36Y_400K}-15.0949 -2.8605 -3.4721 { o ser A 402 2h3bA_36Y_400K}-15.9061 -3.6979 -3.8754 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 34 2h3bA_36Y_400K}P -11.6163 -1.6479 1.2346 { ca tyr A 34 2h3bA_36Y_400K}P -10.6635 -2.1392 0.2463 { n ser A 35 2h3bA_36Y_400K}P -9.702 -0.7388 -1.4933 { ca ser A 35 2h3bA_36Y_400K}P -9.7164 0.078 -2.706 { n tyr A 36 2h3bA_36Y_400K}P -8.7957 0.0646 -4.9545 { ca tyr A 36 2h3bA_36Y_400K}P -7.8374 -0.3172 -5.9841 { n phe A 37 2h3bA_36Y_400K}P -6.4278 0.6849 -7.6562 { ca phe A 37 2h3bA_36Y_400K}P -6.0005 1.673 -8.6373 { n glu A 38 2h3bA_36Y_400K}P -6.3972 1.6726 -11.0267 { ca glu A 38 2h3bA_36Y_400K}P -6.3432 1.1494 -12.3868 { n ser A 398 2h3bA_36Y_400K}P -7.2507 6.0286 -11.8512 { ca ser A 398 2h3bA_36Y_400K}P -8.2913 6.1775 -10.8519 { n phe A 399 2h3bA_36Y_400K}P -8.5201 5.711 -8.5034 { ca phe A 399 2h3bA_36Y_400K}P -8.4647 4.9751 -7.2413 { n lys A 400 2h3bA_36Y_400K}P -10.4325 3.711 -6.5543 { ca lys A 400 2h3bA_36Y_400K}P -11.8185 3.5489 -6.1115 { n cys A 401 2h3bA_36Y_400K}P -12.9746 2.6007 -4.2028 { ca cys A 401 2h3bA_36Y_400K}P -13.275 1.5841 -3.2005 { n ser A 402 2h3bA_36Y_400K}P -13.7824 -0.7436 -3.7489 { ca ser A 402 2h3bA_36Y_400K}P -14.5423 -1.8013 -4.4196 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 34 2h3bA_36Y_400K}P -10.6635 -2.1392 0.2463 {"}-10.6635 -2.1392 0.2463 { ca ser A 35 2h3bA_36Y_400K}-9.7164 0.078 -2.706 { ca tyr A 36 2h3bA_36Y_400K}-7.8374 -0.3172 -5.9841 { ca phe A 37 2h3bA_36Y_400K}-6.0005 1.673 -8.6373 { ca glu A 38 2h3bA_36Y_400K}-6.3432 1.1494 -12.3868 { ca ser A 398 2h3bA_36Y_400K}P -8.2913 6.1775 -10.8519 {"}-8.2913 6.1775 -10.8519 { ca phe A 399 2h3bA_36Y_400K}-8.4647 4.9751 -7.2413 { ca lys A 400 2h3bA_36Y_400K}-11.8185 3.5489 -6.1115 { ca cys A 401 2h3bA_36Y_400K}-13.275 1.5841 -3.2005 { ca ser A 402 2h3bA_36Y_400K}-14.5423 -1.8013 -4.4196 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 36 2h3bA_36Y_400K}P -7.8374 -0.3172 -5.9841 { cb tyr A 36 2h3bA_36Y_400K}-8.3729 -1.5218 -6.7692 { cg tyr A 36 2h3bA_36Y_400K}-9.4098 -1.1545 -7.8157 { cd1 tyr A 36 2h3bA_36Y_400K}-9.0596 -1.0129 -9.1551 { ce1 tyr A 36 2h3bA_36Y_400K}-10.0095 -0.6437 -10.1173 { cz tyr A 36 2h3bA_36Y_400K}-11.3219 -0.4126 -9.727 { oh tyr A 36 2h3bA_36Y_400K}-12.2656 -0.0363 -10.6549 { cg tyr A 36 2h3bA_36Y_400K}P -9.4098 -1.1545 -7.8157 { cd2 tyr A 36 2h3bA_36Y_400K}-10.7351 -0.9204 -7.4572 { ce2 tyr A 36 2h3bA_36Y_400K}-11.6879 -0.5506 -8.4013 { cz tyr A 36 2h3bA_36Y_400K}ghost -11.3219 -0.4126 -9.727 { ca lys A 400 2h3bA_36Y_400K}P -11.8185 3.5489 -6.1115 { cb lys A 400 2h3bA_36Y_400K}-12.7186 3.2485 -7.3143 { cg lys A 400 2h3bA_36Y_400K}-12.8535 4.3962 -8.3142 { cd lys A 400 2h3bA_36Y_400K}-13.5888 5.578 -7.6922 { ce lys A 400 2h3bA_36Y_400K}-13.5573 6.793 -8.6032 { nz lys A 400 2h3bA_36Y_400K}-12.1603 7.2877 -8.7856 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 36 2h3bA_36Y_400K}P -8.3729 -1.5218 -6.7692 {"}P -8.3729 -1.5218 -6.7692 { cd1 tyr A 36 2h3bA_36Y_400K}P -9.0596 -1.0129 -9.1551 { cd2 tyr A 36 2h3bA_36Y_400K}P -10.7351 -0.9204 -7.4572 { ce1 tyr A 36 2h3bA_36Y_400K}P -10.0095 -0.6437 -10.1173 { ce2 tyr A 36 2h3bA_36Y_400K}P -11.6879 -0.5506 -8.4013 { oh tyr A 36 2h3bA_36Y_400K}P -12.2656 -0.0363 -10.6549 { cb lys A 400 2h3bA_36Y_400K}P -12.7186 3.2485 -7.3143 {"}P -12.7186 3.2485 -7.3143 { cg lys A 400 2h3bA_36Y_400K}P -12.8535 4.3962 -8.3142 {"}P -12.8535 4.3962 -8.3142 { cd lys A 400 2h3bA_36Y_400K}P -13.5888 5.578 -7.6922 {"}P -13.5888 5.578 -7.6922 { ce lys A 400 2h3bA_36Y_400K}P -13.5573 6.793 -8.6032 {"}P -13.5573 6.793 -8.6032 { nz lys A 400 2h3bA_36Y_400K}P -12.1603 7.2877 -8.7856 {"}P -12.1603 7.2877 -8.7856 {"}P -12.1603 7.2877 -8.7856 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 36 A}'S' blue -12.4057 0.8196 -7.5831 {"}'S' blue -12.56 0.8373 -7.7877 {"}'S' sky -12.1726 0.9463 -7.6352 {"}'S' sky -12.4867 0.9656 -8.0466 {"}'S' blue -12.6495 0.9029 -8.2394 {"}'S' blue -11.7856 0.9418 -7.4931 {"}'S' blue -12.5459 0.9727 -8.4829 {"}'S' sky -11.6479 1.0696 -7.7408 {"}'S' sky -12.2607 1.0969 -8.5402 {"}'S' blue -11.4517 1.1134 -7.9132 {"}'S' sky -11.5985 1.1742 -8.1209 {"}'S' sky -11.9167 1.1797 -8.5331 {"}'S' blue -12.0806 1.1231 -8.7288 {"}'S' blue -11.4193 1.1773 -8.3175 {"}'S' blue -11.5762 1.1916 -8.525 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 36 A}'S' sea -12.3256 0.9805 -7.8436 {"}'S' sea -11.921 1.032 -7.6919 {"}'S' green -12.0689 1.0818 -7.8969 {"}'S' green -12.2248 1.0874 -8.101 {"}'S' sea -12.3852 1.0512 -8.2983 {"}'S' sea -11.7904 1.1355 -7.9437 {"}'S' green -11.9423 1.1626 -8.1472 {"}'S' sea -12.0999 1.1495 -8.3477 {"}'S' sea -11.7551 1.1972 -8.3283 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 LYS 400 A}'S' sky -12.6671 1.2578 -7.9789 {"}'S' sky -12.5198 1.2162 -7.7766 {"}'S' sky -12.3643 1.2281 -7.5787 {"}'S' sky -12.5524 1.3058 -8.2756 {"}'S' sky -11.9461 1.3156 -7.4936 {"}'S' sky -12.3756 1.3881 -8.48 {"}'S' sky -11.784 1.338 -7.701 {"}'S' sky -12.1384 1.4631 -8.5608 {"}'S' blue -11.9013 1.576 -8.594 {"}'S' sky -11.7641 1.501 -8.3945 {"}'S' sky -11.6078 1.5118 -8.1952 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 LYS 400 A}'S' sea -12.4158 1.2244 -8.0755 {"}'S' sea -12.2635 1.1994 -7.8718 {"}'S' sea -12.1041 1.2299 -7.6746 {"}'S' sea -12.2472 1.2873 -8.2848 {"}'S' green -12.0999 1.2442 -8.0823 {"}'S' sea -11.9417 1.262 -7.8838 {"}'S' sea -12.0035 1.3683 -8.3599 {"}'S' sea -11.8477 1.3441 -8.1517 {"}'S' sea -11.6844 1.393 -7.9551 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 36 A}'M' greentint -9.3261 2.2588 -6.2298 {"}'M' greentint -9.485 2.1701 -6.4114 {"}'M' greentint -9.6286 2.0623 -6.6839 {"}'M' greentint -9.2231 2.4913 -6.2788 {"}'M' greentint -9.3863 2.4579 -6.4806 {"}'M' greentint -9.5349 2.301 -6.6291 {"}'M' greentint -9.6386 2.2047 -6.9266 {"}'M' greentint -9.6952 1.9552 -6.9298 {"}'M' greentint -9.0791 2.6965 -6.3408 {"}'M' greentint -9.2371 2.6881 -6.5428 {"}'M' greentint -9.3957 2.5949 -6.7212 {"}'M' greentint -9.5349 2.427 -6.8544 {"}'M' greentint -9.6082 2.2987 -7.1714 {"}'M' greentint -9.6794 2.0536 -7.1956 {"}'M' greentint -9.0501 2.8772 -6.6107 {"}'M' greentint -9.2103 2.819 -6.8026 {"}'M' greentint -9.3651 2.6959 -6.9673 {"}'M' greentint -9.5008 2.5183 -7.0935 {"}'M' greentint -9.5304 2.3789 -7.4096 {"}'M' greentint -8.9674 2.9972 -6.8548 {"}'M' greentint -9.1294 2.915 -7.0404 {"}'M' greentint -9.2817 2.7791 -7.2004 {"}'M' greentint -9.4183 2.5975 -7.3252 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LYS 400 A}'M' greentint -9.5754 1.9259 -6.792 {"}'M' greentint -9.4148 2.0019 -6.6051 {"}'M' greentint -9.2652 2.1473 -6.4527 {"}'M' greentint -9.1407 2.3472 -6.3469 {"}'M' greentint -9.0521 2.5848 -6.2988 {"}'M' greentint -9.6305 2.0864 -7.2508 {"}'M' greentint -9.4817 2.0368 -7.0447 {"}'M' greentint -9.3194 2.0817 -6.8467 {"}'M' greentint -9.1652 2.2143 -6.685 {"}'M' greentint -9.0409 2.4176 -6.5804 {"}'M' greentint -8.9626 2.6633 -6.5482 {"}'M' greentint -8.9417 2.9187 -6.5916 {"}'M' greentint -9.5025 2.322 -7.4132 {"}'M' greentint -9.3708 2.2202 -7.2151 {"}'M' greentint -9.2097 2.2483 -7.0151 {"}'M' greentint -9.0617 2.4002 -6.8662 {"}'M' greentint -8.9669 2.6344 -6.8089 {"}'M' greentint -8.9506 2.8881 -6.8582 {"}'M' greentint -9.3415 2.5933 -7.4464 {"}'M' greentint -9.2373 2.4381 -7.2686 {"}'M' greentint -9.0773 2.535 -7.0892 {"}'M' greentint -9.0223 2.7883 -7.089 {"}'M' greentint -9.1556 2.6847 -7.2885 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 36 A}'M' greentint -10.3253 0.8137 -4.6682 {"}'M' greentint -10.4586 0.71 -4.8677 {"}'M' greentint -10.3544 0.5549 -4.6899 {"}'M' greentint -10.1395 0.9051 -4.5102 {"}'M' greentint -10.2437 1.0602 -4.6881 {"}'M' greentint -10.4036 0.9633 -4.8675 {"}'M' greentint -10.514 0.8639 -5.1478 {"}'M' greentint -10.5303 0.6102 -5.0985 {"}'M' greentint -10.4637 0.405 -4.9554 {"}'M' greentint -10.1102 1.2781 -4.7416 {"}'M' greentint -10.2712 1.25 -4.9416 {"}'M' greentint -10.4192 1.0981 -5.0904 {"}'M' greentint -10.4857 0.9614 -5.4014 {"}'M' greentint -10.5361 0.7067 -5.3968 {"}'M' greentint -10.5274 0.4589 -5.3163 {"}'M' greentint -9.9218 1.4479 -4.8082 {"}'M' greentint -10.0806 1.4511 -5.0141 {"}'M' greentint -10.2409 1.36 -5.197 {"}'M' greentint -10.3823 1.1895 -5.3326 {"}'M' greentint -10.3889 1.0357 -5.6414 {"}'M' greentint -10.4572 0.7867 -5.6591 {"}'M' greentint -10.4776 0.5334 -5.6156 {"}'M' greentint -9.9862 1.5435 -5.2616 {"}'M' greentint -10.1428 1.4314 -5.433 {"}'M' greentint -10.2814 1.2567 -5.5637 {"}'M' greentint -10.2435 1.0552 -5.859 {"}'M' greentint -10.317 0.8154 -5.8859 {"}'M' greentint -10.0051 1.4454 -5.6581 {"}'M' greentint -10.1383 1.2698 -5.7812 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O LYS 400 A}'M' greentint -10.2226 0.6769 -4.5649 {"}'M' greentint -10.1242 0.9017 -4.4989 {"}'M' greentint -10.3714 0.3679 -5.0345 {"}'M' greentint -10.2261 0.5296 -4.8915 {"}'M' greentint -10.1015 0.7321 -4.7879 {"}'M' greentint -10.005 0.9652 -4.7281 {"}'M' greentint -9.9412 1.2169 -4.7155 {"}'M' greentint -10.4583 0.3598 -5.4607 {"}'M' greentint -10.2986 0.4484 -5.2797 {"}'M' greentint -10.1519 0.598 -5.1321 {"}'M' greentint -10.0282 0.7977 -5.0274 {"}'M' greentint -9.9363 1.0319 -4.9741 {"}'M' greentint -9.8843 1.2828 -4.9757 {"}'M' greentint -9.8745 1.533 -5.033 {"}'M' greentint -10.34 0.5303 -5.6148 {"}'M' greentint -10.183 0.6262 -5.4374 {"}'M' greentint -10.0446 0.7968 -5.3059 {"}'M' greentint -9.9416 1.0203 -5.2351 {"}'M' greentint -9.8872 1.27 -5.2348 {"}'M' greentint -9.8875 1.5169 -5.3035 {"}'M' greentint -10.2014 0.7564 -5.6888 {"}'M' greentint -10.0516 0.9101 -5.538 {"}'M' greentint -9.9564 1.1464 -5.4805 {"}'M' greentint -9.94 1.4029 -5.5303 {"}'M' greentint -10.0932 1.0543 -5.749 {"}'M' greentint -10.0379 1.3056 -5.7479 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n lys A 50 2h5cA_52F_106V}P -10.9422 -0.5617 1.6773 {"}-10.9422 -0.5617 1.6773 { ca lys A 50 2h5cA_52F_106V}-10.5177 -1.4076 0.5555 { c lys A 50 2h5cA_52F_106V}-10.5597 -0.6116 -0.7448 { o lys A 50 2h5cA_52F_106V}-11.4166 0.2556 -0.9194 { c lys A 50 2h5cA_52F_106V}P -10.5597 -0.6116 -0.7448 { n gly A 51 2h5cA_52F_106V}-9.6646 -0.953 -1.6803 { ca gly A 51 2h5cA_52F_106V}-9.6575 -0.2362 -2.9348 { c gly A 51 2h5cA_52F_106V}-8.9782 -1.023 -4.0397 { o gly A 51 2h5cA_52F_106V}-8.3724 -2.0648 -3.8369 { c gly A 51 2h5cA_52F_106V}P -8.9782 -1.023 -4.0397 { n phe A 52 2h5cA_52F_106V}-9.0521 -0.438 -5.25 { ca phe A 52 2h5cA_52F_106V}-8.1237 -0.8495 -6.2967 { c phe A 52 2h5cA_52F_106V}-7.6193 0.3838 -7.0235 { o phe A 52 2h5cA_52F_106V}-8.341 1.3743 -7.1986 { c phe A 52 2h5cA_52F_106V}P -7.6193 0.3838 -7.0235 { n val A 53 2h5cA_52F_106V}-6.3612 0.3268 -7.4679 { ca val A 53 2h5cA_52F_106V}-5.8245 1.3607 -8.3427 { c val A 53 2h5cA_52F_106V}-6.1498 1.0325 -9.7992 { o val A 53 2h5cA_52F_106V}-6.2885 -0.1387 -10.1828 { c val A 53 2h5cA_52F_106V}P -6.1498 1.0325 -9.7992 { n thr A 54 2h5cA_52F_106V}-6.2476 2.085 -10.6036 { ca thr A 54 2h5cA_52F_106V}-6.5855 1.9852 -12.0116 { c thr A 54 2h5cA_52F_106V}-6.1217 3.2941 -12.6762 { o thr A 54 2h5cA_52F_106V}-5.4289 4.1071 -12.0652 { n ala A 104 2h5cA_52F_106V}P -5.8337 6.7374 -10.6863 {"}-5.8337 6.7374 -10.6863 { ca ala A 104 2h5cA_52F_106V}-7.0337 6.8375 -9.8784 { c ala A 104 2h5cA_52F_106V}-7.0317 5.6751 -8.8772 { o ala A 104 2h5cA_52F_106V}-6.3474 4.6605 -9.0638 { c ala A 104 2h5cA_52F_106V}P -7.0317 5.6751 -8.8772 { n trp A 105 2h5cA_52F_106V}-7.8806 5.8069 -7.8631 { ca trp A 105 2h5cA_52F_106V}-8.2426 4.6331 -7.0851 { c trp A 105 2h5cA_52F_106V}-9.7455 4.6499 -6.8413 { o trp A 105 2h5cA_52F_106V}-10.3842 5.6916 -6.7216 { c trp A 105 2h5cA_52F_106V}P -9.7455 4.6499 -6.8413 { n val A 106 2h5cA_52F_106V}-10.2686 3.423 -6.8234 { ca val A 106 2h5cA_52F_106V}-11.6697 3.1387 -6.5493 { c val A 106 2h5cA_52F_106V}-11.7677 2.6363 -5.1298 { o val A 106 2h5cA_52F_106V}-11.1062 1.6664 -4.7476 { c val A 106 2h5cA_52F_106V}P -11.7677 2.6363 -5.1298 { n ser A 107 2h5cA_52F_106V}-12.5846 3.3365 -4.3333 { ca aser A 107 2h5cA_52F_106V}-12.7852 2.8812 -2.9621 {"}P -12.7852 2.8812 -2.9621 { c ser A 107 2h5cA_52F_106V}-14.0245 2.0089 -2.9377 { o ser A 107 2h5cA_52F_106V}-15.1217 2.3188 -3.4315 { ca bser A 107 2h5cA_52F_106V}P -12.8622 3.0007 -2.9665 { c ser A 107 2h5cA_52F_106V}ghost -14.0245 2.0089 -2.9377 {"}P -14.0245 2.0089 -2.9377 { n leu A 108 2h5cA_52F_106V}-13.7794 0.8244 -2.4058 { ca leu A 108 2h5cA_52F_106V}-14.6899 -0.3071 -2.4983 { c leu A 108 2h5cA_52F_106V}-15.4766 -0.4806 -1.227 { o leu A 108 2h5cA_52F_106V}-15.0387 -0.1196 -0.14 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n lys A 50 2h5cA_52F_106V}P -10.9422 -0.5617 1.6773 { ca lys A 50 2h5cA_52F_106V}P -10.5177 -1.4076 0.5555 { n gly A 51 2h5cA_52F_106V}P -9.6646 -0.953 -1.6803 { ca gly A 51 2h5cA_52F_106V}P -9.6575 -0.2362 -2.9348 {"}P -9.6575 -0.2362 -2.9348 { n phe A 52 2h5cA_52F_106V}P -9.0521 -0.438 -5.25 { ca phe A 52 2h5cA_52F_106V}P -8.1237 -0.8495 -6.2967 { n val A 53 2h5cA_52F_106V}P -6.3612 0.3268 -7.4679 { ca val A 53 2h5cA_52F_106V}P -5.8245 1.3607 -8.3427 { n thr A 54 2h5cA_52F_106V}P -6.2476 2.085 -10.6036 { ca thr A 54 2h5cA_52F_106V}P -6.5855 1.9852 -12.0116 { n ala A 104 2h5cA_52F_106V}P -5.8337 6.7374 -10.6863 { ca ala A 104 2h5cA_52F_106V}P -7.0337 6.8375 -9.8784 { n trp A 105 2h5cA_52F_106V}P -7.8806 5.8069 -7.8631 { ca trp A 105 2h5cA_52F_106V}P -8.2426 4.6331 -7.0851 { n val A 106 2h5cA_52F_106V}P -10.2686 3.423 -6.8234 { ca val A 106 2h5cA_52F_106V}P -11.6697 3.1387 -6.5493 { n ser A 107 2h5cA_52F_106V}P -12.5846 3.3365 -4.3333 { ca aser A 107 2h5cA_52F_106V}P -12.7852 2.8812 -2.9621 { n leu A 108 2h5cA_52F_106V}P -13.7794 0.8244 -2.4058 { ca leu A 108 2h5cA_52F_106V}P -14.6899 -0.3071 -2.4983 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca lys A 50 2h5cA_52F_106V}P -10.5177 -1.4076 0.5555 {"}-10.5177 -1.4076 0.5555 { ca gly A 51 2h5cA_52F_106V}-9.6575 -0.2362 -2.9348 { ca phe A 52 2h5cA_52F_106V}-8.1237 -0.8495 -6.2967 { ca val A 53 2h5cA_52F_106V}-5.8245 1.3607 -8.3427 { ca thr A 54 2h5cA_52F_106V}-6.5855 1.9852 -12.0116 { ca ala A 104 2h5cA_52F_106V}P -7.0337 6.8375 -9.8784 {"}-7.0337 6.8375 -9.8784 { ca trp A 105 2h5cA_52F_106V}-8.2426 4.6331 -7.0851 { ca val A 106 2h5cA_52F_106V}-11.6697 3.1387 -6.5493 { ca aser A 107 2h5cA_52F_106V}-12.7852 2.8812 -2.9621 { ca val A 106 2h5cA_52F_106V}P -11.6697 3.1387 -6.5493 { ca bser A 107 2h5cA_52F_106V}-12.8622 3.0007 -2.9665 { ca aser A 107 2h5cA_52F_106V}P -12.7852 2.8812 -2.9621 { ca leu A 108 2h5cA_52F_106V}-14.6899 -0.3071 -2.4983 { ca bser A 107 2h5cA_52F_106V}P -12.8622 3.0007 -2.9665 { ca leu A 108 2h5cA_52F_106V}-14.6899 -0.3071 -2.4983 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 52 2h5cA_52F_106V}P -8.1237 -0.8495 -6.2967 { cb phe A 52 2h5cA_52F_106V}-8.6833 -1.9095 -7.2724 { cg phe A 52 2h5cA_52F_106V}-9.8443 -1.5112 -8.1624 { cd1 phe A 52 2h5cA_52F_106V}-9.6322 -0.7594 -9.3223 { ce1 phe A 52 2h5cA_52F_106V}-10.6701 -0.4639 -10.1812 { cz phe A 52 2h5cA_52F_106V}-11.9579 -0.9106 -9.9151 { cg phe A 52 2h5cA_52F_106V}P -9.8443 -1.5112 -8.1624 { cd2 phe A 52 2h5cA_52F_106V}-11.1271 -1.944 -7.8944 { ce2 phe A 52 2h5cA_52F_106V}-12.1832 -1.6459 -8.765 { cz phe A 52 2h5cA_52F_106V}ghost -11.9579 -0.9106 -9.9151 { ca val A 106 2h5cA_52F_106V}P -11.6697 3.1387 -6.5493 { cb val A 106 2h5cA_52F_106V}-12.1989 2.1007 -7.5758 { cg1 val A 106 2h5cA_52F_106V}-13.6065 1.6414 -7.204 { cb val A 106 2h5cA_52F_106V}P -12.1989 2.1007 -7.5758 { cg2 val A 106 2h5cA_52F_106V}-12.1733 2.6847 -8.9745 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 52 2h5cA_52F_106V}P -8.6833 -1.9095 -7.2724 {"}P -8.6833 -1.9095 -7.2724 { cd1 phe A 52 2h5cA_52F_106V}P -9.6322 -0.7594 -9.3223 { cd2 phe A 52 2h5cA_52F_106V}P -11.1271 -1.944 -7.8944 { ce1 phe A 52 2h5cA_52F_106V}P -10.6701 -0.4639 -10.1812 { ce2 phe A 52 2h5cA_52F_106V}P -12.1832 -1.6459 -8.765 { cz phe A 52 2h5cA_52F_106V}P -11.9579 -0.9106 -9.9151 { cb val A 106 2h5cA_52F_106V}P -12.1989 2.1007 -7.5758 { cg1 val A 106 2h5cA_52F_106V}P -13.6065 1.6414 -7.204 {"}P -13.6065 1.6414 -7.204 {"}P -13.6065 1.6414 -7.204 { cg2 val A 106 2h5cA_52F_106V}P -12.1733 2.6847 -8.9745 {"}P -12.1733 2.6847 -8.9745 {"}P -12.1733 2.6847 -8.9745 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG PHE 52 A}'S' blue -10.7165 -0.1233 -7.5488 {"}'S' blue -10.8777 -0.1611 -7.7469 {"}'S' blue -10.4821 0.0199 -7.6047 {"}'S' blue -10.6432 0.005 -7.8077 {"}'S' blue -10.806 -0.0577 -8.0005 {"}'S' blue -10.9646 -0.1667 -8.1754 {"}'S' blue -10.3813 0.1268 -7.8621 {"}'S' blue -10.5417 0.0906 -8.0594 { CD1 PHE 52 A}'S' blue -10.8264 0.0251 -8.3123 {"}'S' blue -10.5536 0.1649 -8.1559 {"}'S' blue -10.6948 0.2459 -8.3622 {"}'S' blue -10.8578 0.2381 -8.5695 {"}'S' blue -10.4071 0.3801 -8.2439 {"}'S' blue -10.5499 0.4466 -8.4475 {"}'S' blue -10.7076 0.4466 -8.6511 { CD2 PHE 52 A}'S' blue -11.5081 -0.3116 -7.3899 {"}'S' blue -11.664 -0.306 -7.594 {"}'S' sky -11.2296 -0.2579 -7.4367 {"}'S' sky -11.3815 -0.2308 -7.6403 {"}'S' sky -11.5391 -0.2439 -7.8408 {"}'S' blue -11.0377 -0.2192 -7.614 {"}'S' sky -11.1943 -0.1962 -7.8213 {"}'S' blue -11.3559 -0.2137 -8.0262 {"}'S' blue -11.0154 -0.2018 -8.0181 { CE1 PHE 52 A}'S' blue -11.1896 0.1491 -8.6268 {"}'S' sky -11.239 0.3689 -8.7513 {"}'S' blue -11.3261 0.5489 -8.9132 {"}'S' blue -11.445 0.6756 -9.1029 {"}'S' sky -11.5879 0.7421 -9.3065 {"}'S' blue -10.962 0.3436 -8.6557 {"}'S' sky -11.0275 0.5468 -8.7984 {"}'S' blue -11.1242 0.714 -8.9687 {"}'S' sky -11.2457 0.836 -9.161 {"}'S' blue -10.7221 0.4601 -8.6961 {"}'S' blue -10.7939 0.6601 -8.8451 {"}'S' sky -11.015 0.9521 -9.2123 {"}'S' sky -10.9033 1.1187 -9.4718 {"}'S' sky -11.0512 1.1685 -9.6768 {"}'S' sky -11.2071 1.1741 -9.8809 {"}'S' sky -11.3675 1.1379 -10.0782 {"}'S' sky -11.5282 1.0594 -10.2628 {"}'S' sky -11.6833 0.9408 -10.4307 {"}'S' blue -10.7726 1.2222 -9.7236 {"}'S' blue -10.9245 1.2493 -9.9271 {"}'S' blue -11.0822 1.2362 -10.1276 { CE2 PHE 52 A}'S' blue -13.1009 -0.4399 -7.8903 {"}'S' blue -13.2586 -0.4399 -8.0939 {"}'S' blue -13.4193 -0.5042 -8.2835 {"}'S' blue -12.7587 -0.346 -7.7448 {"}'S' blue -12.901 -0.2757 -7.9468 {"}'S' sky -13.0553 -0.258 -8.1514 {"}'S' sky -13.2166 -0.2958 -8.3496 {"}'S' blue -13.3751 -0.3865 -8.5302 {"}'S' blue -12.6679 -0.149 -7.9989 {"}'S' blue -12.8209 -0.1148 -8.2073 {"}'S' sky -12.982 -0.1297 -8.4103 {"}'S' blue -13.1448 -0.1924 -8.6032 {"}'S' blue -13.3034 -0.3014 -8.778 {"}'S' blue -12.2809 -0.1535 -7.8568 {"}'S' blue -12.4163 -0.0633 -8.0556 {"}'S' blue -12.5642 -0.0135 -8.2606 {"}'S' blue -12.8805 -0.0441 -8.662 {"}'S' blue -11.9026 -0.2664 -7.7258 {"}'S' sky -12.0153 -0.1287 -7.9095 {"}'S' sky -12.1432 -0.0257 -8.1045 {"}'S' blue -12.2857 0.0402 -8.3074 {"}'S' sky -11.694 -0.2139 -7.885 {"}'S' sky -11.8126 -0.0803 -8.076 {"}'S' sky -11.947 0.0181 -8.277 {"}'S' sky -11.5053 -0.1866 -8.0776 {"}'S' sky -11.6276 -0.0621 -8.2715 {"}'S' blue -11.4196 -0.1088 -8.4226 { CZ PHE 52 A}'S' blue -13.1521 -0.1261 -8.9052 {"}'S' blue -12.8793 0.0136 -8.7487 {"}'S' blue -13.0205 0.0947 -8.9551 {"}'S' blue -12.4119 0.2673 -8.7026 {"}'S' blue -12.5334 0.3893 -8.8949 {"}'S' blue -12.83 0.4773 -9.3015 {"}'S' blue -12.0816 0.2134 -8.579 {"}'S' sky -12.1805 0.3791 -8.7537 {"}'S' blue -12.3027 0.5054 -8.9462 {"}'S' sky -12.4426 0.5863 -9.149 {"}'S' sky -12.9195 0.5429 -9.7533 {"}'S' sky -11.7655 0.094 -8.4956 {"}'S' sky -11.8404 0.2888 -8.6458 {"}'S' sky -11.938 0.4527 -8.8185 {"}'S' sky -12.0556 0.5818 -9.0069 {"}'S' sky -11.5116 0.1045 -8.5611 {"}'S' sky -11.584 0.2999 -8.7081 {"}'S' blue -11.6773 0.4689 -8.8759 {"}'S' blue -11.79 0.6066 -9.0596 {"}'S' sky -11.9179 0.7096 -9.2546 {"}'S' sky -11.7217 0.7534 -9.427 {"}'S' sky -12.5117 0.6694 -10.4244 {"}'S' sky -12.1719 0.7467 -10.4356 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 52 A}'S' sea -11.388 0.9063 -9.363 {"}'S' sea -11.5423 0.924 -9.5676 {"}'S' sea -11.7035 0.8862 -9.7657 {"}'S' sea -11.1549 1.033 -9.4151 {"}'S' sea -11.3079 1.0672 -9.6235 {"}'S' sea -11.469 1.0523 -9.8265 {"}'S' sea -11.6318 0.9896 -10.0193 {"}'S' sea -11.7904 0.8806 -10.1942 { CZ PHE 52 A}'S' sea -12.5956 0.6205 -9.3574 {"}'S' sea -12.7567 0.6056 -9.5604 {"}'S' sea -12.191 0.672 -9.2057 {"}'S' green -12.3389 0.7218 -9.4107 {"}'S' green -12.4948 0.7274 -9.6148 {"}'S' green -12.6552 0.6912 -9.8121 {"}'S' sea -12.8159 0.6127 -9.9967 {"}'S' green -12.0604 0.7755 -9.4575 {"}'S' green -12.2123 0.8026 -9.661 {"}'S' green -12.3699 0.7895 -9.8616 {"}'S' green -12.5307 0.7369 -10.054 {"}'S' sea -12.688 0.6472 -10.2331 {"}'S' green -11.8685 0.8142 -9.6347 {"}'S' green -12.0251 0.8372 -9.8421 {"}'S' green -12.1867 0.8198 -10.047 {"}'S' green -12.3506 0.7631 -10.2427 {"}'S' sea -11.8462 0.8316 -10.0388 {"}'S' sea -12.0083 0.8081 -10.2414 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 106 A}'S' blue -12.5004 0.4782 -8.1591 {"}'S' blue -12.3583 0.3998 -7.9539 {"}'S' blue -12.4827 0.7261 -8.6205 {"}'S' blue -12.3718 0.5869 -8.4371 {"}'S' blue -12.2426 0.4832 -8.242 {"}'S' sky -12.2672 0.8096 -8.7552 {"}'S' sky -12.1577 0.6636 -8.5739 {"}'S' blue -12.032 0.8941 -8.8323 {"}'S' sky -11.9213 0.7462 -8.649 {"}'S' blue -11.6829 0.8523 -8.6874 { CG1 VAL 106 A}'S' blue -13.0512 0.1228 -7.8723 {"}'S' blue -12.8935 0.1112 -7.6659 {"}'S' blue -12.9577 0.297 -8.1175 {"}'S' blue -12.8075 0.255 -7.9128 { CG2 VAL 106 A}'S' sky -12.1803 0.943 -9.1453 {"}'S' sky -12.0209 0.9423 -8.9375 {"}'S' sky -11.9235 0.9726 -9.2351 {"}'S' sky -11.7659 0.9843 -9.0343 {"}'S' sky -11.71 1.0446 -9.3699 {"}'S' sky -11.5514 1.0607 -9.1687 {"}'S' blue -11.39 1.1196 -8.9769 {"}'S' sky -11.2981 1.1924 -9.2371 {"}'S' blue -11.1368 1.2775 -9.0514 {"}'S' sky -11.5245 1.3403 -9.8879 {"}'S' sky -11.0546 1.3767 -9.2915 {"}'S' blue -11.4025 1.5485 -10.0592 {"}'S' sky -11.2602 1.4798 -9.8558 {"}'S' sky -11.1029 1.4777 -9.6523 {"}'S' blue -10.9418 1.54 -9.4617 { HB VAL 106 A}'S' blue -12.1766 0.2459 -7.6739 {"}'S' blue -12.1244 0.3453 -8.066 {"}'S' sky -12.0156 0.2046 -7.8869 {"}'S' sky -11.8849 0.1102 -7.6919 {"}'S' blue -11.7376 0.0686 -7.4896 {"}'S' blue -11.5821 0.0805 -7.2917 {"}'S' sky -11.974 0.4661 -8.3375 {"}'S' sky -11.8863 0.2899 -8.174 {"}'S' sky -11.7701 0.1582 -7.9886 {"}'S' sky -11.6336 0.0768 -7.7885 {"}'S' sky -11.4812 0.0518 -7.5848 {"}'S' sky -11.3218 0.0823 -7.3876 {"}'S' sky -11.767 0.5896 -8.5134 {"}'S' sky -11.696 0.3932 -8.3681 {"}'S' sky -11.5934 0.2405 -8.193 {"}'S' sky -11.4649 0.1397 -7.9978 {"}'S' sky -11.3177 0.0966 -7.7953 {"}'S' sky -11.1599 0.1136 -7.5972 {"}'S' blue -11.0018 0.1904 -7.414 {"}'S' blue -11.5243 0.6832 -8.5943 {"}'S' sky -11.4598 0.4743 -8.4517 {"}'S' blue -11.3561 0.3155 -8.2737 {"}'S' blue -11.2212 0.2207 -8.0729 {"}'S' blue -11.0654 0.1965 -7.8647 {"}'S' blue -10.9022 0.2454 -7.6681 {"}'S' blue -10.745 0.3638 -7.4973 {"}'S' blue -11.2767 0.7924 -8.6107 {"}'S' sky -11.2216 0.5812 -8.482 {"}'S' blue -11.119 0.4284 -8.3069 {"}'S' blue -10.9819 0.3534 -8.1075 {"}'S' blue -10.8255 0.3641 -7.9082 {"}'S' blue -10.6694 0.4595 -7.7337 {"}'S' blue -11.0319 0.8598 -8.5444 {"}'S' blue -10.9641 0.6513 -8.399 {"}'S' sky -10.8307 0.5485 -8.1984 {"}'S' blue -10.6672 0.5771 -7.9951 {"}'S' blue -10.7058 0.774 -8.2431 {HG11 VAL 106 A}'S' blue -13.739 -0.215 -8.1848 {"}'S' blue -13.5812 -0.198 -7.9868 {"}'S' blue -13.4231 -0.1212 -7.8035 {"}'S' blue -13.6425 -0.091 -8.4624 {"}'S' sky -13.4867 -0.1152 -8.2542 {"}'S' sky -13.3235 -0.0662 -8.0576 {"}'S' blue -13.1663 0.0521 -7.8869 {"}'S' sky -13.4031 0.0417 -8.4971 {"}'S' sky -13.2468 0.0525 -8.2978 {"}'S' blue -13.0907 0.1479 -8.1233 {"}'S' blue -13.3854 0.3396 -8.7886 {"}'S' blue -13.252 0.2369 -8.588 {"}'S' blue -13.0885 0.2655 -8.3846 {"}'S' blue -13.1271 0.4624 -8.6327 {HG21 VAL 106 A}'S' sky -12.8982 0.8593 -9.4084 {"}'S' sky -12.7388 0.8898 -9.2112 {"}'S' sky -12.6042 0.9612 -10.3303 {"}'S' sky -12.3669 1.0363 -10.4111 {"}'S' sky -11.9927 1.0741 -10.2448 {"}'S' sky -11.8415 1.2693 -10.3357 {"}'S' sky -11.678 1.2979 -10.1324 @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 VAL 106 A}'S' sea -11.618 1.1661 -9.6427 {"}'S' sea -11.4602 1.1544 -9.4363 {"}'S' sea -11.3743 1.2983 -9.6832 {"}'S' sea -11.2158 1.3102 -9.4813 {HG21 VAL 106 A}'S' sea -12.8957 0.831 -9.8292 {"}'S' green -12.7484 0.7893 -9.6269 {"}'S' green -12.5929 0.8013 -9.429 {"}'S' sea -12.4342 0.8658 -9.2423 {"}'S' sea -12.781 0.8789 -10.1259 {"}'S' green -12.6444 0.7975 -9.9258 {"}'S' green -12.492 0.7726 -9.7221 {"}'S' green -12.3326 0.803 -9.5249 {"}'S' green -12.1746 0.8888 -9.3439 {"}'S' green -12.4757 0.8604 -10.1352 {"}'S' green -12.3285 0.8174 -9.9326 {"}'S' green -12.1703 0.8351 -9.7341 {"}'S' green -12.0126 0.9112 -9.5513 {"}'S' green -12.232 0.9414 -10.2102 {"}'S' green -12.0763 0.9172 -10.002 {"}'S' green -11.913 0.9661 -9.8054 {"}'S' sea -11.7558 1.0845 -9.6346 {"}'S' sea -11.8363 1.0849 -10.0456 {"}'S' sea -11.6802 1.1803 -9.871 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 52 A}'M' greentint -9.5131 1.7668 -6.5423 {"}'M' greentint -9.6567 1.659 -6.8147 {"}'M' greentint -9.2511 2.0881 -6.4097 {"}'M' greentint -9.4144 2.0547 -6.6115 {"}'M' greentint -9.563 1.8978 -6.76 {"}'M' greentint -9.6667 1.8014 -7.0575 {"}'M' greentint -9.1072 2.2932 -6.4717 {"}'M' greentint -9.2652 2.2848 -6.6737 {"}'M' greentint -9.4238 2.1917 -6.8521 {"}'M' greentint -9.563 2.0237 -6.9852 {"}'M' greentint -9.6363 1.8954 -7.3023 {"}'M' greentint -8.922 2.4633 -6.5377 {"}'M' greentint -9.0782 2.4739 -6.7415 {"}'M' greentint -9.2384 2.4157 -6.9335 {"}'M' greentint -9.3932 2.2926 -7.0982 {"}'M' greentint -9.5289 2.1151 -7.2243 {"}'M' greentint -9.5584 1.9756 -7.5405 {"}'M' greentint -8.8349 2.6173 -6.7836 {"}'M' greentint -8.995 2.5933 -6.9849 {"}'M' greentint -9.1575 2.5117 -7.1713 {"}'M' greentint -9.3097 2.3758 -7.3313 {"}'M' greentint -9.4464 2.1942 -7.4561 {"}'M' greentint -8.7414 2.7079 -7.0524 {"}'M' greentint -8.9006 2.6568 -7.2446 {"}'M' greentint -9.0564 2.558 -7.4179 {"}'M' greentint -9.2026 2.4144 -7.5678 {"}'M' greentint -9.3333 2.2325 -7.6862 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 106 A}'M' greentint -9.5752 1.6128 -6.9594 {"}'M' greentint -9.417 1.6765 -6.7731 {"}'M' greentint -9.2667 1.801 -6.6133 {"}'M' greentint -9.1336 1.9766 -6.4902 {"}'M' greentint -9.0284 2.1912 -6.4124 {"}'M' greentint -9.5246 1.6718 -7.3104 {"}'M' greentint -9.3664 1.674 -7.1067 {"}'M' greentint -9.2057 1.75 -6.9198 {"}'M' greentint -9.0562 1.8954 -6.7674 {"}'M' greentint -8.9316 2.0953 -6.6616 {"}'M' greentint -8.843 2.3329 -6.6135 {"}'M' greentint -9.4215 1.8345 -7.5655 {"}'M' greentint -9.2727 1.7849 -7.3594 {"}'M' greentint -9.1104 1.8298 -7.1614 {"}'M' greentint -8.9562 1.9624 -6.9997 {"}'M' greentint -8.8319 2.1657 -6.8951 {"}'M' greentint -8.7536 2.4114 -6.863 {"}'M' greentint -8.7326 2.6668 -6.9063 {"}'M' greentint -9.2935 2.0701 -7.728 {"}'M' greentint -9.1617 1.9683 -7.5298 {"}'M' greentint -9.0007 1.9964 -7.3298 {"}'M' greentint -8.8527 2.1484 -7.181 {"}'M' greentint -8.7579 2.3825 -7.1236 {"}'M' greentint -8.7416 2.6362 -7.1729 {"}'M' greentint -9.1324 2.3414 -7.7612 {"}'M' greentint -9.0282 2.1862 -7.5833 {"}'M' greentint -8.8682 2.2831 -7.4039 {"}'M' greentint -8.8133 2.5364 -7.4037 {"}'M' greentint -8.9465 2.4328 -7.6032 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 52 A}'M' green -10.6174 0.3405 -5.1029 {"}'M' green -10.6728 0.4944 -5.383 {"}'M' green -10.0705 0.6015 -4.6356 {"}'M' green -10.6445 0.5919 -5.6366 {"}'M' green -9.832 1.1776 -5.0938 {"}'M' green -10.4402 0.8872 -5.7989 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 52 A}'M' greentint -10.4841 0.4442 -4.9034 {"}'M' greentint -10.2982 0.5356 -4.7454 {"}'M' greentint -10.4024 0.6907 -4.9233 {"}'M' greentint -10.5624 0.5938 -5.1027 {"}'M' greentint -10.1372 0.8068 -4.7786 {"}'M' greentint -10.2689 0.9086 -4.9768 {"}'M' greentint -10.4299 0.8805 -5.1768 {"}'M' greentint -10.578 0.7286 -5.3256 {"}'M' greentint -9.9456 0.9836 -4.8425 {"}'M' greentint -10.0805 1.0784 -5.0434 {"}'M' greentint -10.2394 1.0816 -5.2493 {"}'M' greentint -10.3997 0.9905 -5.4322 {"}'M' greentint -10.5411 0.82 -5.5678 {"}'M' greentint -9.9836 1.2131 -5.2989 {"}'M' greentint -10.145 1.174 -5.4968 {"}'M' greentint -10.3016 1.0619 -5.6682 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 106 A}'M' green -10.6852 0.4332 -5.2594 {"}'M' green -10.2075 0.5945 -4.6862 {"}'M' green -10.3336 1.0573 -5.7434 {"}'M' green -9.9293 1.2809 -5.4007 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 106 A}'M' greentint -10.528 0.4286 -5.0538 {"}'M' greentint -10.3654 0.4843 -4.8597 {"}'M' greentint -10.6016 0.611 -5.5174 {"}'M' greentint -10.4536 0.564 -5.3129 {"}'M' greentint -10.2944 0.5864 -5.1124 {"}'M' greentint -10.1347 0.675 -4.9314 {"}'M' greentint -9.988 0.8246 -4.7838 {"}'M' greentint -10.4733 0.8227 -5.6689 {"}'M' greentint -10.335 0.7459 -5.4674 {"}'M' greentint -10.1762 0.7569 -5.2665 {"}'M' greentint -10.0191 0.8528 -5.0891 {"}'M' greentint -9.8807 1.0233 -4.9576 {"}'M' greentint -10.2007 0.9537 -5.5432 {"}'M' greentint -10.0375 0.983 -5.3405 {"}'M' greentint -9.8878 1.1367 -5.1897 {"}'M' greentint -10.088 1.1836 -5.5784 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 65 2h6uA_93F_67Y}P -8.351 5.6344 -12.3919 {"}-8.351 5.6344 -12.3919 { ca gly A 65 2h6uA_93F_67Y}-8.3495 6.3748 -11.1389 { c gly A 65 2h6uA_93F_67Y}-8.253 5.4232 -9.9643 { o gly A 65 2h6uA_93F_67Y}-7.9917 4.2302 -10.15 { c gly A 65 2h6uA_93F_67Y}P -8.253 5.4232 -9.9643 { n val A 66 2h6uA_93F_67Y}-8.4793 5.9471 -8.7681 { ca val A 66 2h6uA_93F_67Y}-8.4678 5.106 -7.5778 { c val A 66 2h6uA_93F_67Y}-9.9153 4.9058 -7.1249 { o val A 66 2h6uA_93F_67Y}-10.6683 5.8837 -7.0171 { c val A 66 2h6uA_93F_67Y}P -9.9153 4.9058 -7.1249 { n tyr A 67 2h6uA_93F_67Y}-10.2877 3.6401 -6.9042 { ca tyr A 67 2h6uA_93F_67Y}-11.6532 3.2588 -6.5935 { c tyr A 67 2h6uA_93F_67Y}-11.7011 2.635 -5.1991 { o tyr A 67 2h6uA_93F_67Y}-10.7091 2.1219 -4.7105 { c tyr A 67 2h6uA_93F_67Y}P -11.7011 2.635 -5.1991 { n lys A 68 2h6uA_93F_67Y}-12.8536 2.7039 -4.5565 { ca lys A 68 2h6uA_93F_67Y}-13.0094 2.0477 -3.2475 { c lys A 68 2h6uA_93F_67Y}-14.3352 1.3087 -3.2316 { o lys A 68 2h6uA_93F_67Y}-15.3673 1.9007 -3.5828 { c lys A 68 2h6uA_93F_67Y}P -14.3352 1.3087 -3.2316 { n met A 69 2h6uA_93F_67Y}-14.3135 0.032 -2.8524 { ca met A 69 2h6uA_93F_67Y}-15.5587 -0.6916 -2.6513 { c met A 69 2h6uA_93F_67Y}-15.7259 -0.8913 -1.168 { o met A 69 2h6uA_93F_67Y}-14.8288 -1.4239 -0.5073 { n ile A 91 2h6uA_93F_67Y}P -12.1116 -1.7613 0.322 {"}-12.1116 -1.7613 0.322 { ca ile A 91 2h6uA_93F_67Y}-11.0336 -2.2764 -0.5067 { c ile A 91 2h6uA_93F_67Y}-10.7546 -1.1581 -1.4846 { o ile A 91 2h6uA_93F_67Y}-11.6531 -0.7545 -2.2221 { c ile A 91 2h6uA_93F_67Y}P -10.7546 -1.1581 -1.4846 { n val A 92 2h6uA_93F_67Y}-9.5209 -0.6572 -1.4644 { ca val A 92 2h6uA_93F_67Y}-9.1172 0.4826 -2.263 { c 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{"}'S' P -11.2848 0.4506 -7.6159 {"}'S' -11.287 0.3891 -7.6407 {"}'S' P -11.4273 0.5165 -7.8188 {"}'S' -11.4212 0.4111 -7.8462 {"}'S' P -11.5792 0.5436 -8.0223 {"}'S' -11.5652 0.4447 -8.0371 {"}'S' P -11.7368 0.5305 -8.2229 {"}'S' -11.7272 0.489 -8.2241 {"}'S' P -11.0886 0.4944 -7.7884 {"}'S' -11.0978 0.4277 -7.8079 {"}'S' P -11.2354 0.5552 -7.996 {"}'S' -11.2413 0.4508 -8.0127 {"}'S' P -11.392 0.5782 -8.2034 {"}'S' -11.3886 0.4881 -8.2071 {"}'S' P -11.5536 0.5608 -8.4083 {"}'S' -11.55 0.5331 -8.4055 {"}'S' P -10.9071 0.5053 -7.9854 {"}'S' -10.9138 0.4787 -7.9902 {"}'S' P -11.0562 0.5583 -8.1927 {"}'S' -11.0637 0.5077 -8.1947 {"}'S' P -11.2131 0.5726 -8.4001 {"}'S' -11.2152 0.5449 -8.3984 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 67 A}'S' sky -12.6354 0.6486 -7.1248 {"}'S' sky -12.4724 0.6853 -6.9242 {"}'S' sky -12.7974 0.631 -7.7575 {"}'S' sky -12.1656 0.6486 -6.9459 {"}'S' sky -12.5977 0.589 -7.9227 {"}'S' blue -11.8061 0.6983 -6.929 {"}'S' blue -12.4769 0.6389 -8.2082 {"}'S' sky -12.3349 0.5605 -8.003 {"}'S' sky -12.2192 0.6439 -8.2911 { HB2 TYR 67 A}'S' sky -11.6815 0.6083 -7.0167 {"}'S' blue -10.6064 0.7476 -7.3495 {"}'S' sky -10.4938 0.7875 -7.5823 {"}'S' sky -10.5573 0.7064 -7.9496 {"}'S' blue -10.4202 0.8746 -7.8193 {"}'S' blue -10.5551 0.824 -8.2109 { HB3 TYR 67 A}'S' blue -13.127 0.6406 -6.9713 {"}'S' blue -13.1785 0.6369 -7.4681 {"}'S' sky -13.0262 0.6119 -7.2644 {"}'S' sky -12.8668 0.6424 -7.0671 {"}'S' blue -12.7088 0.7281 -6.8862 {"}'S' blue -13.0099 0.6998 -7.6774 {"}'S' sky -12.8626 0.6567 -7.4749 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 67 A}'S' sea -12.6483 0.578 -7.5502 {"}'S' sea -12.4906 0.5635 -7.3433 {"}'S' sea -12.3285 0.587 -7.1407 {"}'S' sea -12.4491 0.5352 -7.7158 {"}'S' green -12.2918 0.5189 -7.5074 {"}'S' sea -12.1297 0.541 -7.3046 {"}'S' sea -11.9674 0.6018 -7.1102 {"}'S' sea -12.1825 0.5196 -7.7957 { HB2 TYR 67 A}'S' green -11.9971 0.5136 -7.399 {"}'S' sea -11.8397 0.5315 -7.1999 {"}'S' green -12.0646 0.4927 -7.8897 {"}'S' green -11.9272 0.4112 -7.6903 {"}'S' green -11.7753 0.3855 -7.487 {"}'S' green -11.6159 0.4159 -7.2897 {"}'S' green -12.0123 0.5921 -8.2819 {"}'S' green -11.3113 0.3919 -7.3209 {"}'S' green -11.7742 0.5368 -8.3899 {"}'S' green -11.0517 0.4149 -7.4224 {"}'S' green -11.5839 0.6401 -8.5839 {"}'S' green -10.8897 0.4373 -7.6299 {"}'S' sea -10.7393 0.5687 -7.4713 {"}'S' green -10.7901 0.4922 -7.884 {"}'S' sea -10.6329 0.6106 -7.7132 {"}'S' green -11.0069 0.6752 -8.5228 {"}'S' green -10.8698 0.6002 -8.3234 {"}'S' green -10.7134 0.611 -8.1241 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 TYR 67 A}'S' P -11.9035 0.4514 -8.1028 {"}'S' -11.8995 0.4599 -8.0992 {"}'S' P -11.7728 0.3571 -7.9078 {"}'S' -11.7561 0.4126 -7.901 {"}'S' P -11.6255 0.3154 -7.7055 {"}'S' -11.6149 0.3799 -7.7091 {"}'S' P -11.47 0.3274 -7.5076 {"}'S' -11.4687 0.357 -7.5144 {"}'S' P -11.6581 0.405 -8.2045 {"}'S' -11.6448 0.4685 -8.1786 {"}'S' P -11.5215 0.3236 -8.0044 {"}'S' -11.5126 0.4312 -7.9825 {"}'S' P -11.3691 0.2987 -7.8006 {"}'S' -11.3738 0.4015 -7.7981 {"}'S' P -11.2097 0.3291 -7.6034 {"}'S' -11.2193 0.3791 -7.6108 {"}'S' P -11.4813 0.4873 -8.4089 {"}'S' -11.4793 0.521 -8.3864 {"}'S' P -11.3529 0.3865 -8.2137 {"}'S' -11.3589 0.4756 -8.1774 {"}'S' P -11.2056 0.3435 -8.0112 {"}'S' -11.2255 0.4446 -7.9896 {"}'S' P -11.0479 0.3604 -7.8131 {"}'S' -11.0683 0.4213 -7.8105 {"}'S' P -11.244 0.5624 -8.4896 {"}'S' -11.2439 0.5641 -8.4882 {"}'S' P -11.1091 0.4675 -8.2887 {"}'S' -11.122 0.5096 -8.2663 {"}'S' P -10.9534 0.4433 -8.0805 {"}'S' -10.9695 0.4796 -8.0699 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 93 A}'M' greentint -9.5249 1.9777 -6.6168 {"}'M' greentint -9.2826 2.3733 -6.4136 {"}'M' greentint -9.4312 2.2164 -6.5621 {"}'M' greentint -9.535 2.12 -6.8596 {"}'M' greentint -8.9755 2.6118 -6.2737 {"}'M' greentint -9.1334 2.6034 -6.4758 {"}'M' greentint -9.292 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2.724 -8.7386 {"}P -12.3167 2.724 -8.7386 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 217 A}'S' blue -11.1549 0.0874 -6.4958 {"}'S' blue -10.8723 0.1626 -6.5421 {"}'S' sky -11.03 0.1495 -6.7426 {"}'S' sky -10.8468 0.1798 -6.928 {"}'S' blue -10.6684 0.1681 -7.1224 {"}'S' sky -10.832 0.1067 -7.3167 { CE1 PHE 217 A}'S' blue -12.7129 0.0018 -6.8559 {"}'S' blue -12.8742 -0.0359 -7.0541 {"}'S' blue -13.0328 -0.1266 -7.2347 {"}'S' blue -12.6396 0.1301 -7.1148 {"}'S' blue -12.8024 0.0674 -7.3077 {"}'S' blue -12.9611 -0.0416 -7.4825 {"}'S' blue -12.6989 0.1373 -7.5511 { CE2 PHE 217 A}'S' blue -10.765 0.3888 -8.1267 {"}'S' blue -10.8639 0.5545 -8.3014 {"}'S' blue -10.9861 0.6808 -8.4939 {"}'S' blue -11.279 0.796 -8.9051 {"}'S' blue -11.44 0.781 -9.1081 {"}'S' blue -11.6028 0.7184 -9.301 {"}'S' blue -11.1782 0.9028 -9.1625 {"}'S' blue -11.3386 0.8666 -9.3598 { CZ PHE 217 A}'S' sky -12.5607 0.3839 -7.9928 {"}'S' blue -12.715 0.4016 -8.1974 {"}'S' blue -12.6417 0.5299 -8.4563 {"}'S' sky -12.3798 0.6517 -8.5107 {"}'S' sky -12.5402 0.6155 -8.708 {"}'S' sky -12.7009 0.5371 -8.8927 {"}'S' blue -12.856 0.4184 -9.0605 {"}'S' sky -12.0973 0.727 -8.557 {"}'S' sky -12.2549 0.7138 -8.7575 {"}'S' sky -12.7262 0.4461 -9.2909 {"}'S' sky -11.7535 0.7385 -8.5307 {"}'S' sky -11.9101 0.7615 -8.738 {"}'S' sky -12.0717 0.7441 -8.9429 {"}'S' sky -12.5522 0.4639 -9.4861 {"}'S' blue -11.5743 0.7416 -8.7273 {"}'S' sky -11.7312 0.7559 -8.9348 {"}'S' sky -11.8933 0.7324 -9.1373 {"}'S' sky -12.0569 0.671 -9.3316 {"}'S' sky -12.2178 0.5725 -9.5118 {"}'S' blue -12.372 0.441 -9.6755 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 217 A}'S' sea -11.0107 0.1231 -7.1237 { CE1 PHE 217 A}'S' green -12.0739 0.1965 -6.7601 {"}'S' green -12.2219 0.2463 -6.9651 {"}'S' green -12.3778 0.2519 -7.1692 {"}'S' sea -11.6729 0.1312 -6.614 {"}'S' green -11.8009 0.2341 -6.809 {"}'S' green -12.2529 0.314 -7.416 {"}'S' sea -12.4137 0.2615 -7.6084 {"}'S' green 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2haiA_383Y_371}P -11.5228 3.1037 -6.8037 { cb ser A 371 2haiA_383Y_371}-11.9836 2.585 -8.173 { og ser A 371 2haiA_383Y_371}-13.396 2.4338 -8.2216 { ca tyr A 383 2haiA_383Y_371}P -7.2441 -0.3624 -5.5645 { cb tyr A 383 2haiA_383Y_371}-7.6922 -1.7252 -6.1443 { cg tyr A 383 2haiA_383Y_371}-8.8646 -1.5813 -7.0756 { cd1 tyr A 383 2haiA_383Y_371}-10.1617 -1.3803 -6.5754 { ce1 tyr A 383 2haiA_383Y_371}-11.2392 -1.2097 -7.4274 { cz tyr A 383 2haiA_383Y_371}-11.0401 -1.228 -8.8018 { oh tyr A 383 2haiA_383Y_371}-12.1006 -1.0519 -9.6371 { cg tyr A 383 2haiA_383Y_371}P -8.8646 -1.5813 -7.0756 { cd2 tyr A 383 2haiA_383Y_371}-8.6888 -1.604 -8.4621 { ce2 tyr A 383 2haiA_383Y_371}-9.7665 -1.434 -9.3245 { cz tyr A 383 2haiA_383Y_371}ghost -11.0401 -1.228 -8.8018 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser A 371 2haiA_383Y_371}P -11.9836 2.585 -8.173 {"}P -11.9836 2.585 -8.173 { og ser A 371 2haiA_383Y_371}P -13.396 2.4338 -8.2216 { cb tyr A 383 2haiA_383Y_371}P -7.6922 -1.7252 -6.1443 {"}P -7.6922 -1.7252 -6.1443 { cd1 tyr A 383 2haiA_383Y_371}P -10.1617 -1.3803 -6.5754 { cd2 tyr A 383 2haiA_383Y_371}P -8.6888 -1.604 -8.4621 { ce1 tyr A 383 2haiA_383Y_371}P -11.2392 -1.2097 -7.4274 { ce2 tyr A 383 2haiA_383Y_371}P -9.7665 -1.434 -9.3245 { oh tyr A 383 2haiA_383Y_371}P -12.1006 -1.0519 -9.6371 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 383 A}'S' blue -11.6512 0.4903 -7.3738 {"}'S' sky -11.8121 0.4378 -7.5663 {"}'S' sky -11.9693 0.348 -7.7454 {"}'S' sky -11.3064 0.538 -7.3543 {"}'S' sky -11.9485 0.2405 -8.1024 {"}'S' sky -10.919 0.4892 -7.7023 {"}'S' blue -10.7039 0.407 -7.8304 {"}'S' sky -10.8655 0.3882 -8.035 { CZ TYR 383 A}'S' sky -12.0017 0.2255 -8.64 {"}'S' sky -11.8981 0.2953 -8.8834 {"}'S' sky -11.7702 0.3298 -9.1198 {"}'S' sky -10.6224 0.4468 -8.5107 {"}'S' blue -11.2541 0.4293 -9.3223 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 TYR 383 A}'S' sea -11.468 0.5206 -7.5592 {"}'S' sea -11.6319 0.4639 -7.7549 {"}'S' sea -11.793 0.3702 -7.9367 {"}'S' sea -11.1275 0.5324 -7.5511 {"}'S' green -11.2896 0.509 -7.7537 {"}'S' green -11.4532 0.4475 -7.9479 {"}'S' green -11.6141 0.349 -8.1282 {"}'S' green -11.0807 0.4662 -7.9061 {"}'S' green -11.2439 0.4056 -8.0999 { CZ TYR 383 A}'S' sea -11.6778 0.3031 -8.2441 {"}'S' sea -11.8389 0.2881 -8.4471 {"}'S' green -11.4211 0.4044 -8.2974 {"}'S' green -11.577 0.4099 -8.5015 {"}'S' green -11.7374 0.3737 -8.6988 {"}'S' sea -11.0001 0.3922 -8.1413 {"}'S' green -11.1425 0.458 -8.3442 {"}'S' green -11.4521 0.4721 -8.7483 {"}'S' sea -11.6129 0.4195 -8.9407 {"}'S' sea -10.8039 0.436 -8.3138 {"}'S' green -10.9507 0.4968 -8.5214 {"}'S' green -11.1073 0.5198 -8.7288 {"}'S' green -11.2689 0.5023 -8.9337 {"}'S' sea -11.4328 0.4456 -9.1294 {"}'S' sea -10.7715 0.4998 -8.7181 {"}'S' sea -10.9284 0.5142 -8.9255 {"}'S' sea -11.0905 0.4907 -9.1281 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ TYR 383 A}'S' P -11.2944 0.4852 -8.5477 {"}'S' -11.2942 0.4815 -8.5482 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 SER 371 A}'S' blue -12.0713 0.6657 -8.012 {"}'S' sky -11.914 0.6836 -7.8129 {"}'S' sky -11.7558 0.7604 -7.6297 {"}'S' blue -11.605 0.8908 -7.4721 {"}'S' sky -12.0015 0.5633 -8.3032 {"}'S' sky -11.3824 0.7905 -7.5654 {"}'S' sky -11.9778 0.6035 -8.7158 {"}'S' sky -11.0932 0.8208 -7.6315 {"}'S' sky -11.8485 0.6889 -9.0029 {"}'S' sky -10.8135 0.7207 -8.0843 {"}'S' sky -10.7072 0.7627 -8.3262 {"}'S' sky -11.0812 0.8273 -9.1358 {"}'S' sky -10.7877 0.7631 -8.7371 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 SER 371 A}'S' sea -11.8495 0.5375 -8.0999 {"}'S' green -11.6901 0.568 -7.9027 {"}'S' sea -11.5317 0.6545 -7.7213 {"}'S' sea -11.8471 0.5092 -8.5207 {"}'S' green -11.6998 0.4675 -8.3184 {"}'S' green -11.5442 0.4795 -8.1206 {"}'S' green -11.3856 0.544 -7.9338 {"}'S' sea -11.2327 0.66 -7.7684 {"}'S' sea -11.7323 0.5571 -8.8174 {"}'S' green -11.5958 0.4757 -8.6174 {"}'S' green -11.4434 0.4507 -8.4136 {"}'S' green -11.284 0.4812 -8.2164 {"}'S' green -11.126 0.567 -8.0354 {"}'S' sea -10.9759 0.7028 -7.8801 {"}'S' sea -11.5556 0.6394 -9.0218 {"}'S' green -11.4271 0.5386 -8.8267 {"}'S' green -11.1217 0.5133 -8.4257 {"}'S' sea -10.964 0.5893 -8.2428 {"}'S' sea -11.3183 0.7145 -9.1026 {"}'S' green -11.1834 0.6196 -8.9017 {"}'S' green -11.0276 0.5954 -8.6935 {"}'S' sea -10.8644 0.6443 -8.4969 {"}'S' sea -10.944 0.7523 -8.9364 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 SER 371 A}'S' P -11.2799 0.4956 -8.6241 {"}'S' -11.2799 0.4956 -8.6241 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 383 A}'M' green -9.2156 1.8069 -6.654 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 383 A}'M' greentint -9.149 1.9141 -6.4081 {"}'M' greentint -8.9067 2.3097 -6.2048 {"}'M' greentint -9.0553 2.1528 -6.3533 {"}'M' greentint -9.159 2.0564 -6.6508 {"}'M' greentint -8.7575 2.5398 -6.267 {"}'M' greentint -8.9161 2.4467 -6.4454 {"}'M' greentint -9.0553 2.2787 -6.5785 {"}'M' greentint -9.1286 2.1504 -6.8956 {"}'M' greentint -9.1998 1.9053 -6.9198 {"}'M' greentint -8.5705 2.729 -6.3348 {"}'M' greentint -8.7307 2.6707 -6.5268 {"}'M' greentint -8.8855 2.5476 -6.6915 {"}'M' greentint -9.0212 2.3701 -6.8176 {"}'M' greentint -9.0507 2.2306 -7.1338 {"}'M' greentint -9.132 1.9875 -7.1722 {"}'M' greentint -8.4877 2.8489 -6.5789 {"}'M' greentint -8.6498 2.7668 -6.7646 {"}'M' greentint -8.8021 2.6308 -6.9246 {"}'M' greentint -8.9387 2.4492 -7.0494 {"}'M' greentint -8.9363 2.2754 -7.3635 {"}'M' greentint -8.5487 2.813 -7.0112 {"}'M' greentint -8.6949 2.6695 -7.1611 {"}'M' greentint -8.8257 2.4875 -7.2795 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 371 A}'M' greentint -9.1679 1.8594 -6.4795 {"}'M' greentint -9.0177 1.9838 -6.3197 {"}'M' greentint -8.8845 2.1594 -6.1966 {"}'M' greentint -8.7793 2.3741 -6.1188 {"}'M' greentint -9.1173 1.8569 -6.8131 {"}'M' greentint -8.9567 1.9328 -6.6262 {"}'M' greentint -8.8071 2.0782 -6.4738 {"}'M' greentint -8.6826 2.2782 -6.368 {"}'M' greentint -8.594 2.5158 -6.32 {"}'M' greentint -9.0236 1.9677 -7.0658 {"}'M' greentint -8.8613 2.0126 -6.8678 {"}'M' greentint -8.7071 2.1452 -6.7061 {"}'M' greentint -8.5828 2.3485 -6.6015 {"}'M' greentint -8.5045 2.5942 -6.5694 {"}'M' greentint -8.4836 2.8497 -6.6127 {"}'M' greentint -8.9126 2.1512 -7.2362 {"}'M' greentint -8.7516 2.1792 -7.0362 {"}'M' greentint -8.6036 2.3312 -6.8874 {"}'M' greentint -8.5088 2.5653 -6.83 {"}'M' greentint -8.4925 2.819 -6.8794 {"}'M' greentint -8.7791 2.369 -7.2897 {"}'M' greentint -8.6192 2.4659 -7.1103 {"}'M' greentint -8.5642 2.7192 -7.1101 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 383 A}'M' green -9.5871 1.1826 -4.3741 {"}'M' green -9.4537 1.4004 -4.4276 {"}'M' green -9.8709 0.5812 -5.0023 {"}'M' green -9.8211 0.6558 -5.3016 {"}'M' green -9.3297 1.6658 -4.9476 {"}'M' green -9.587 1.1775 -5.545 {"}'M' green -9.6605 0.9377 -5.5719 {"}'M' green -9.3486 1.5678 -5.3441 {"}'M' green -9.4818 1.3922 -5.4672 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 383 A}'M' greentint -9.8021 0.8324 -4.5537 {"}'M' greentint -9.7471 1.0857 -4.5535 {"}'M' greentint -9.8575 0.9863 -4.8338 {"}'M' greentint -9.8738 0.7326 -4.7845 {"}'M' greentint -9.6147 1.3724 -4.6276 {"}'M' greentint -9.7627 1.2204 -4.7764 {"}'M' greentint -9.8292 1.0837 -5.0874 {"}'M' greentint -9.8796 0.8291 -5.0828 {"}'M' greentint -9.4241 1.5735 -4.7001 {"}'M' greentint -9.5844 1.4824 -4.883 {"}'M' greentint -9.7258 1.3119 -5.0186 {"}'M' greentint -9.7324 1.158 -5.3274 {"}'M' greentint -9.8006 0.909 -5.3451 {"}'M' greentint -9.4863 1.5538 -5.119 {"}'M' greentint -9.6249 1.3791 -5.2497 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O SER 371 A}'M' green -9.846 0.7645 -4.5538 {"}'M' green -9.6257 1.186 -4.3848 {"}'M' green -9.553 1.427 -4.3593 {"}'M' green -9.8415 0.8146 -5.5007 {"}'M' green -9.7029 1.0407 -5.5747 @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 371 A}'M' greentint -9.724 0.9611 -4.4508 {"}'M' greentint -9.8729 0.6522 -4.9204 {"}'M' greentint -9.7275 0.8139 -4.7774 {"}'M' greentint -9.6029 1.0163 -4.6738 {"}'M' greentint -9.5065 1.2494 -4.614 {"}'M' greentint -9.4427 1.5012 -4.6014 {"}'M' greentint -9.8001 0.7327 -5.1656 {"}'M' greentint -9.6534 0.8823 -5.018 {"}'M' greentint -9.5296 1.082 -4.9133 {"}'M' greentint -9.4378 1.3162 -4.86 {"}'M' greentint -9.3858 1.5671 -4.8616 {"}'M' greentint -9.6845 0.9105 -5.3234 {"}'M' greentint -9.546 1.081 -5.1918 {"}'M' greentint -9.4431 1.3045 -5.121 {"}'M' greentint -9.3887 1.5543 -5.1207 {"}'M' greentint -9.5531 1.1944 -5.4239 {"}'M' greentint -9.4578 1.4307 -5.3664 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 9 2hfnA_11Y_53Q}P -12.0383 -2.0428 0.5121 {"}-12.0383 -2.0428 0.5121 { ca leu 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-11.126 { ca ser A 13 2hfnA_11Y_53Q}-6.4138 0.8365 -12.4153 { c ser A 13 2hfnA_11Y_53Q}-6.1458 1.8783 -13.4985 { o ser A 13 2hfnA_11Y_53Q}-6.2201 3.0891 -13.2355 { n phe A 51 2hfnA_11Y_53Q}P -7.9473 5.3166 -12.6562 {"}-7.9473 5.3166 -12.6562 { ca phe A 51 2hfnA_11Y_53Q}-9.0159 5.2876 -11.6579 { c phe A 51 2hfnA_11Y_53Q}-8.4404 4.9516 -10.2529 { o phe A 51 2hfnA_11Y_53Q}-7.4499 4.2117 -10.1384 { c phe A 51 2hfnA_11Y_53Q}P -8.4404 4.9516 -10.2529 { n leu A 52 2hfnA_11Y_53Q}-9.082 5.4912 -9.2161 { ca leu A 52 2hfnA_11Y_53Q}-8.8613 5.1153 -7.8135 { c leu A 52 2hfnA_11Y_53Q}-10.254 4.9311 -7.1989 { o leu A 52 2hfnA_11Y_53Q}-11.0831 5.8381 -7.3071 { c leu A 52 2hfnA_11Y_53Q}P -10.254 4.9311 -7.1989 { n gln A 53 2hfnA_11Y_53Q}-10.5125 3.7857 -6.5714 { ca gln A 53 2hfnA_11Y_53Q}-11.8677 3.554 -6.0347 { c gln A 53 2hfnA_11Y_53Q}-11.7499 2.9298 -4.6666 { o gln A 53 2hfnA_11Y_53Q}-10.8147 2.1199 -4.398 { c gln A 53 2hfnA_11Y_53Q}P -11.7499 2.9298 -4.6666 { n val A 54 2hfnA_11Y_53Q}-12.6717 3.3131 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-12.3008 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca val A 145 2hgxA_164F_145}P -11.684 3.4236 -6.2169 { cb val A 145 2hgxA_164F_145}-12.2972 2.2389 -7.0495 { cg1 val A 145 2hgxA_164F_145}-13.7553 1.9772 -6.657 { cb val A 145 2hgxA_164F_145}P -12.2972 2.2389 -7.0495 { cg2 val A 145 2hgxA_164F_145}-12.2344 2.5002 -8.5425 { ca phe A 164 2hgxA_164F_145}P -7.7981 -0.2365 -5.7524 { cb phe A 164 2hgxA_164F_145}-8.3475 -1.5482 -6.3748 { cg phe A 164 2hgxA_164F_145}-9.7544 -1.4589 -6.9218 { cd1 phe A 164 2hgxA_164F_145}-10.8643 -1.6799 -6.0814 { ce1 phe A 164 2hgxA_164F_145}-12.1855 -1.674 -6.6035 { cz phe A 164 2hgxA_164F_145}-12.3958 -1.4384 -7.9923 { cg phe A 164 2hgxA_164F_145}P -9.7544 -1.4589 -6.9218 { cd2 phe A 164 2hgxA_164F_145}-9.9742 -1.2218 -8.2966 { ce2 phe A 164 2hgxA_164F_145}-11.2846 -1.2104 -8.8376 { cz phe A 164 2hgxA_164F_145}ghost -12.3958 -1.4384 -7.9923 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb val 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{"}'S' sky -12.4983 0.2476 -7.5346 {"}'S' blue -12.6502 0.2748 -7.7382 {"}'S' sky -12.3065 0.2864 -7.7119 {"}'S' blue -12.4631 0.3093 -7.9192 {"}'S' blue -12.7886 0.2352 -8.3198 {"}'S' sky -11.7179 0.0208 -7.3049 {"}'S' sky -11.9782 0.2364 -7.7012 {"}'S' blue -12.1273 0.2894 -7.9085 {"}'S' blue -12.2842 0.3037 -8.116 {"}'S' blue -12.4463 0.2803 -8.3186 {"}'S' blue -12.6099 0.2188 -8.5128 {"}'S' blue -12.7708 0.1203 -8.6931 {"}'S' blue -11.51 -0.0277 -7.4574 {"}'S' sky -11.6323 0.0986 -7.6498 {"}'S' blue -11.7694 0.1895 -7.8529 {"}'S' blue -12.2374 0.2375 -8.471 {"}'S' blue -12.4006 0.1769 -8.6648 {"}'S' blue -12.5618 0.0804 -8.846 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 164 A}'S' sea -11.9169 0.0538 -6.5197 {"}'S' sea -12.0738 0.0681 -6.7272 {"}'S' sea -11.7077 0.0077 -6.6709 {"}'S' sea -11.8653 0.0249 -6.8783 { CZ PHE 164 A}'S' sea -11.9066 -0.0065 -7.1122 {"}'S' sea -12.0253 0.1272 -7.3032 {"}'S' sea -12.1597 0.2256 -7.5042 {"}'S' sea -11.8402 0.1454 -7.4988 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 145 A}'S' blue -12.8569 0.6583 -7.5494 {"}'S' blue -12.7194 0.5665 -7.3474 {"}'S' blue -12.5707 0.5127 -7.1405 {"}'S' blue -12.7254 0.732 -7.8291 {"}'S' sky -12.5986 0.6164 -7.6328 {"}'S' sky -12.4565 0.538 -7.4276 {"}'S' blue -12.4692 0.7249 -7.9114 {"}'S' sky -12.3408 0.6214 -7.7157 {"}'S' sky -12.1997 0.5545 -7.5144 {"}'S' blue -12.129 0.6931 -7.8527 { CG1 VAL 145 A}'S' blue -13.1876 0.3272 -6.5246 {"}'S' blue -13.2925 0.3363 -7.0528 {"}'S' blue -12.972 0.4121 -6.6595 {"}'S' blue -13.2001 0.4586 -7.3253 {"}'S' blue -13.0423 0.4469 -7.1189 {"}'S' blue -13.1066 0.6328 -7.5704 {"}'S' blue -12.9564 0.5908 -7.3658 { CG2 VAL 145 A}'S' blue -12.1886 0.7798 -8.2223 {"}'S' blue -12.082 0.7578 -8.5056 {"}'S' blue -11.9183 0.7958 -8.3058 {"}'S' sky -11.827 0.7998 -8.6024 {"}'S' blue -11.6667 0.8502 -8.4101 {"}'S' blue -11.7716 0.8593 -8.9384 {"}'S' blue -11.6125 0.8762 -8.7368 {"}'S' blue -11.4511 0.9351 -8.545 {"}'S' blue -11.5214 0.9699 -9.0044 { HB VAL 145 A}'S' blue -12.4036 0.4441 -6.6469 {"}'S' sky -12.2563 0.4011 -6.4443 {"}'S' blue -12.099 0.419 -6.2453 {"}'S' sky -12.3238 0.3802 -6.9351 {"}'S' sky -11.8751 0.3034 -6.3351 {"}'S' sky -12.2716 0.4796 -7.3272 {"}'S' sky -11.5706 0.2794 -6.3662 {"}'S' blue -11.4177 0.3954 -6.2007 {"}'S' sky -11.469 0.2166 -6.6488 {"}'S' sky -11.311 0.3024 -6.4678 {"}'S' blue -11.1609 0.4382 -6.3124 {"}'S' sky -11.8432 0.5276 -7.6293 {"}'S' sky -11.7406 0.3748 -7.4542 {"}'S' sky -11.6121 0.274 -7.2591 {"}'S' sky -11.4649 0.231 -7.0565 {"}'S' blue -11.3067 0.2487 -6.858 {"}'S' blue -11.149 0.3248 -6.6752 {"}'S' blue -10.9985 0.4562 -6.5167 {"}'S' blue -11.607 0.6086 -7.7129 {"}'S' blue -11.5033 0.4499 -7.535 {"}'S' blue -11.3684 0.355 -7.3341 {"}'S' blue -11.2662 0.5627 -7.5682 {HG11 VAL 145 A}'S' blue -13.9305 0.0217 -7.4975 {"}'S' blue -13.7723 0.0395 -7.2991 {"}'S' blue -13.6146 0.1155 -7.1163 {"}'S' blue -13.834 0.1458 -7.7751 {"}'S' sky -13.6783 0.1216 -7.5669 {"}'S' sky -13.515 0.1705 -7.3704 {"}'S' blue -13.3578 0.2889 -7.1996 {"}'S' blue -13.5947 0.2785 -7.8098 {"}'S' sky -13.4383 0.2893 -7.6105 {"}'S' blue -13.2822 0.3846 -7.436 {"}'S' blue -13.4435 0.4737 -7.9007 {"}'S' blue -13.28 0.5023 -7.6973 {HG21 VAL 145 A}'S' blue -12.8605 0.597 -8.6032 {"}'S' blue -12.702 0.6836 -8.4218 {"}'S' blue -12.7146 0.5085 -8.8211 {"}'S' blue -12.5559 0.573 -8.6344 {"}'S' blue -12.403 0.6891 -8.4689 {"}'S' blue -12.6137 0.4798 -9.1142 {"}'S' sky -12.4543 0.5102 -8.9169 {"}'S' sky -12.2963 0.596 -8.7359 {"}'S' blue -12.1462 0.7318 -8.5806 {"}'S' blue -12.4502 0.5246 -9.3247 {"}'S' sky -12.2925 0.5416 -9.1266 {"}'S' sky -12.1343 0.6184 -8.9434 {"}'S' sky -11.9839 0.7498 -8.7848 {"}'S' blue -12.198 0.6244 -9.394 {"}'S' sky -12.0347 0.6734 -9.1975 {"}'S' sky -11.8775 0.7917 -9.0267 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 145 A}'S' sea -12.1865 0.2987 -6.7356 {"}'S' sea -12.0345 0.2729 -6.5323 {"}'S' sea -12.1628 0.3389 -7.1481 {"}'S' sea -12.0321 0.2446 -6.9531 {"}'S' sea -11.8848 0.2029 -6.7508 {"}'S' sea -11.7293 0.2149 -6.5529 {"}'S' sea -12.0335 0.4243 -7.4352 {"}'S' sea -11.9173 0.2925 -7.2498 {"}'S' sea -11.7808 0.2111 -7.0497 {"}'S' sea -11.6284 0.1862 -6.846 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 164 A}'M' greentint -9.3775 2.5115 -6.0314 {"}'M' greentint -9.5408 2.4781 -6.2332 {"}'M' greentint -9.6894 2.3212 -6.3817 {"}'M' greentint -9.0958 2.6373 -5.8937 {"}'M' greentint -9.2336 2.7167 -6.0934 {"}'M' greentint -9.3915 2.7083 -6.2954 {"}'M' greentint -9.5501 2.6151 -6.4738 {"}'M' greentint -9.6894 2.4472 -6.607 {"}'M' greentint -8.9093 2.8084 -5.9582 {"}'M' greentint -9.0484 2.8867 -6.1594 {"}'M' greentint -9.2046 2.8974 -6.3633 {"}'M' greentint -9.3647 2.8392 -6.5552 {"}'M' greentint -9.5195 2.7161 -6.7199 {"}'M' greentint -9.6553 2.5386 -6.8461 {"}'M' greentint -8.8084 3.0049 -6.1984 {"}'M' greentint -8.9613 3.0408 -6.4053 {"}'M' greentint -9.1218 3.0174 -6.6074 {"}'M' greentint -9.2839 2.9352 -6.793 {"}'M' greentint -9.4361 2.7993 -6.953 {"}'M' greentint -9.5728 2.6177 -7.0778 {"}'M' greentint -8.7126 3.1322 -6.4742 {"}'M' greentint -8.8678 3.1313 -6.6741 {"}'M' greentint -9.027 3.0802 -6.8663 {"}'M' greentint -9.1828 2.9815 -7.0396 {"}'M' greentint -9.3289 2.8379 -7.1895 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 145 A}'M' greentint -9.5818 2.2309 -6.0927 {"}'M' greentint -9.7654 2.2566 -6.7665 {"}'M' greentint -9.6254 2.1915 -6.5672 {"}'M' greentint -9.4711 2.1908 -6.3681 {"}'M' greentint -9.3129 2.2545 -6.1818 {"}'M' greentint -9.1627 2.379 -6.0219 {"}'M' greentint -9.0296 2.5546 -5.8989 {"}'M' greentint -9.5619 2.3228 -6.9222 {"}'M' greentint -9.4205 2.2498 -6.7191 {"}'M' greentint -9.2623 2.252 -6.5154 {"}'M' greentint -9.1017 2.328 -6.3285 {"}'M' greentint -8.9521 2.4734 -6.1761 {"}'M' greentint -8.8276 2.6733 -6.0703 {"}'M' greentint -8.739 2.9109 -6.0222 {"}'M' greentint -9.4335 2.5495 -7.1623 {"}'M' greentint -9.3174 2.4125 -6.9742 {"}'M' greentint -9.1686 2.3628 -6.768 {"}'M' greentint -9.0063 2.4078 -6.5701 {"}'M' greentint -8.8521 2.5404 -6.4084 {"}'M' greentint -8.7278 2.7437 -6.3038 {"}'M' greentint -8.6496 2.9894 -6.2716 {"}'M' greentint -9.256 2.8533 -7.2797 {"}'M' greentint -9.1894 2.6481 -7.1366 {"}'M' greentint -9.0577 2.5463 -6.9385 {"}'M' greentint -8.8967 2.5744 -6.7385 {"}'M' greentint -8.7486 2.7263 -6.5896 {"}'M' greentint -8.6538 2.9604 -6.5323 {"}'M' greentint -9.0284 2.9193 -7.1698 {"}'M' greentint -8.9242 2.7642 -6.992 {"}'M' greentint -8.7642 2.8611 -6.8126 {"}'M' greentint -8.7092 3.1144 -6.8124 {"}'M' greentint -8.8425 3.0107 -7.0119 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 164 A}'M' greentint -10.0559 1.1642 -4.204 {"}'M' greentint -10.2159 1.0673 -4.3834 {"}'M' greentint -10.3263 0.9679 -4.6637 {"}'M' greentint -9.7907 1.2803 -4.0593 {"}'M' greentint -9.9224 1.382 -4.2575 {"}'M' greentint -10.0834 1.354 -4.4575 {"}'M' greentint -10.2315 1.202 -4.6063 {"}'M' greentint -10.298 1.0653 -4.9173 {"}'M' greentint -9.5991 1.457 -4.1233 {"}'M' greentint -9.734 1.5519 -4.3241 {"}'M' greentint -9.8929 1.555 -4.5301 {"}'M' greentint -10.0531 1.464 -4.7129 {"}'M' greentint -10.1945 1.2935 -4.8485 {"}'M' greentint -9.4855 1.6511 -4.3745 {"}'M' greentint -9.6371 1.6866 -4.5796 {"}'M' greentint -9.7984 1.6474 -4.7775 {"}'M' greentint -9.9551 1.5354 -4.9489 {"}'M' greentint -10.0936 1.3607 -5.0796 {"}'M' greentint -9.3546 1.7368 -4.6288 {"}'M' greentint -9.5089 1.7375 -4.8279 {"}'M' greentint -9.6671 1.6738 -5.0142 {"}'M' greentint -9.8174 1.5494 -5.174 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 145 A}'M' green -9.6452 1.3485 -3.9922 {"}'M' green -9.3288 1.666 -4.3518 {"}'M' green -9.3523 1.7783 -4.8623 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 145 A}'M' greentint -10.2533 0.9679 -4.6716 {"}'M' greentint -10.0954 0.9918 -4.4749 {"}'M' greentint -9.9373 1.0658 -4.2911 {"}'M' greentint -9.7855 1.1865 -4.1283 {"}'M' greentint -10.1497 1.0748 -4.9321 {"}'M' greentint -9.9925 1.0702 -4.7264 {"}'M' greentint -9.8299 1.1259 -4.5323 {"}'M' greentint -9.6721 1.2362 -4.3588 {"}'M' greentint -9.5267 1.3979 -4.2158 {"}'M' greentint -10.0661 1.2526 -5.19 {"}'M' greentint -9.9182 1.2056 -4.9855 {"}'M' greentint -9.759 1.2281 -4.785 {"}'M' greentint -9.5992 1.3166 -4.604 {"}'M' greentint -9.4525 1.4662 -4.4565 {"}'M' greentint -9.7995 1.3875 -5.14 {"}'M' greentint -9.6407 1.3986 -4.9391 {"}'M' greentint -9.4837 1.4944 -4.7618 {"}'M' greentint -9.3452 1.665 -4.6303 {"}'M' greentint -9.6652 1.5954 -5.2158 {"}'M' greentint -9.5021 1.6246 -5.0132 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 164 2hpwA_166Y_182}P -12.1823 -1.6823 0.6876 {"}-12.1823 -1.6823 0.6876 { ca ile A 164 2hpwA_166Y_182}-11.4762 -2.1104 -0.5189 { c ile A 164 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{"}'M' greentint -9.382 2.6156 -6.7619 {"}'M' greentint -9.4116 2.4762 -7.0781 {"}'M' greentint -9.4928 2.233 -7.1165 {"}'M' greentint -8.6881 3.1179 -6.3212 {"}'M' greentint -8.8482 3.0939 -6.5225 {"}'M' greentint -9.0106 3.0123 -6.7089 {"}'M' greentint -9.1629 2.8764 -6.8688 {"}'M' greentint -9.2995 2.6948 -6.9936 {"}'M' greentint -9.2971 2.521 -7.3078 {"}'M' greentint -8.5946 3.2084 -6.59 {"}'M' greentint -8.7537 3.1573 -6.7822 {"}'M' greentint -8.9095 3.0586 -6.9555 {"}'M' greentint -9.0557 2.915 -7.1054 {"}'M' greentint -9.1865 2.733 -7.2238 {"}'M' greentint -9.1461 2.5427 -7.5165 {"}'M' greentint -8.597 3.1918 -6.9876 {"}'M' greentint -8.7538 3.0859 -7.1607 {"}'M' greentint -8.9005 2.9388 -7.3105 {"}'M' greentint -9.0326 2.7558 -7.4305 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H HIS 182 A}'M' greentint -9.5521 2.2033 -6.7072 {"}'M' greentint -9.3955 2.2407 -6.5154 {"}'M' greentint -9.2406 2.3379 -6.3429 {"}'M' greentint -9.0993 2.4887 -6.2013 {"}'M' greentint -8.9787 2.6829 -6.0996 {"}'M' greentint -9.4391 2.2014 -6.9898 {"}'M' greentint -9.2848 2.2007 -6.7907 {"}'M' greentint -9.1266 2.2644 -6.6044 {"}'M' greentint -8.9764 2.3888 -6.4446 {"}'M' greentint -8.8433 2.5644 -6.3215 {"}'M' greentint -8.738 2.7791 -6.2437 {"}'M' greentint -8.6645 3.0189 -6.2168 {"}'M' greentint -9.2342 2.2597 -7.1417 {"}'M' greentint -9.076 2.2619 -6.938 {"}'M' greentint -8.9154 2.3378 -6.7511 {"}'M' greentint -8.7658 2.4832 -6.5987 {"}'M' greentint -8.6413 2.6832 -6.4929 {"}'M' greentint -8.5527 2.9208 -6.4448 {"}'M' greentint -8.5082 3.1755 -6.4575 {"}'M' greentint -9.1311 2.4223 -7.3968 {"}'M' greentint -8.9823 2.3727 -7.1907 {"}'M' greentint -8.82 2.4176 -6.9927 {"}'M' greentint -8.6658 2.5502 -6.831 {"}'M' greentint -8.5415 2.7536 -6.7264 {"}'M' greentint -8.4633 2.9992 -6.6943 {"}'M' greentint -9.0031 2.6579 -7.5593 {"}'M' greentint -8.8714 2.5562 -7.3611 {"}'M' greentint -8.7103 2.5842 -7.1611 {"}'M' greentint -8.5623 2.7362 -7.0123 {"}'M' 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-4.4651 {"}'M' greentint -9.4731 1.4304 -4.3175 {"}'M' greentint -9.3494 1.6302 -4.2128 {"}'M' greentint -9.6613 1.3627 -4.8002 {"}'M' greentint -9.5042 1.4586 -4.6228 {"}'M' greentint -9.3658 1.6292 -4.4913 {"}'M' greentint -9.2629 1.8527 -4.4204 {"}'M' greentint -9.5226 1.5888 -4.8742 {"}'M' greentint -9.3729 1.7425 -4.7234 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n leu A 45 2hq9A_134F_47A}P -6.8727 5.2896 -12.2954 {"}-6.8727 5.2896 -12.2954 { ca leu A 45 2hq9A_134F_47A}-8.1888 5.567 -11.7174 { c leu A 45 2hq9A_134F_47A}-8.248 4.9343 -10.3415 { o leu A 45 2hq9A_134F_47A}-7.9128 3.7738 -10.184 { c leu A 45 2hq9A_134F_47A}P -8.248 4.9343 -10.3415 { n tyr A 46 2hq9A_134F_47A}-8.6847 5.6856 -9.3344 { ca tyr A 46 2hq9A_134F_47A}-8.7459 5.1721 -7.9679 { c tyr A 46 2hq9A_134F_47A}-10.1878 4.9778 -7.548 { o tyr A 46 2hq9A_134F_47A}-11.0813 5.7751 -7.8883 { c tyr A 46 2hq9A_134F_47A}P -10.1878 4.9778 -7.548 { n ala A 47 2hq9A_134F_47A}-10.4287 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@vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 45 2hq9A_134F_47A}P -6.8727 5.2896 -12.2954 { ca leu A 45 2hq9A_134F_47A}P -8.1888 5.567 -11.7174 { n tyr A 46 2hq9A_134F_47A}P -8.6847 5.6856 -9.3344 { ca tyr A 46 2hq9A_134F_47A}P -8.7459 5.1721 -7.9679 { n ala A 47 2hq9A_134F_47A}P -10.4287 3.905 -6.8036 { ca ala A 47 2hq9A_134F_47A}P -11.7653 3.6216 -6.3476 { n phe A 48 2hq9A_134F_47A}P -12.9198 2.7734 -4.4237 { ca phe A 48 2hq9A_134F_47A}P -13.1791 1.9843 -3.2514 { n ser A 49 2hq9A_134F_47A}P -14.2209 -0.1512 -2.8823 { ca ser A 49 2hq9A_134F_47A}P -15.2523 -1.173 -3.0608 { n val A 132 2hq9A_134F_47A}P -12.1032 -2.184 0.2079 { ca val A 132 2hq9A_134F_47A}P -10.9744 -2.5055 -0.6281 { n phe A 133 2hq9A_134F_47A}P -9.4649 -0.7589 -1.3305 { ca phe A 133 2hq9A_134F_47A}P -9.0287 0.42 -2.0474 { n phe A 134 2hq9A_134F_47A}P -8.4251 0.4058 -4.3908 { ca phe A 134 2hq9A_134F_47A}P -7.6486 -0.0121 -5.5325 { n arg A 135 2hq9A_134F_47A}P -6.5995 0.7402 -7.5189 { ca arg A 135 2hq9A_134F_47A}P -6.4288 1.5904 -8.6673 { n ile A 136 2hq9A_134F_47A}P -6.6862 1.4088 -11.0266 { ca ile A 136 2hq9A_134F_47A}P -6.5337 0.8781 -12.3581 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca leu A 45 2hq9A_134F_47A}P -8.1888 5.567 -11.7174 {"}-8.1888 5.567 -11.7174 { ca tyr A 46 2hq9A_134F_47A}-8.7459 5.1721 -7.9679 { ca ala A 47 2hq9A_134F_47A}-11.7653 3.6216 -6.3476 { ca phe A 48 2hq9A_134F_47A}-13.1791 1.9843 -3.2514 { ca ser A 49 2hq9A_134F_47A}-15.2523 -1.173 -3.0608 { ca val A 132 2hq9A_134F_47A}P -10.9744 -2.5055 -0.6281 {"}-10.9744 -2.5055 -0.6281 { ca phe A 133 2hq9A_134F_47A}-9.0287 0.42 -2.0474 { ca phe A 134 2hq9A_134F_47A}-7.6486 -0.0121 -5.5325 { ca arg A 135 2hq9A_134F_47A}-6.4288 1.5904 -8.6673 { ca ile A 136 2hq9A_134F_47A}-6.5337 0.8781 -12.3581 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ala A 47 2hq9A_134F_47A}P -11.7653 3.6216 -6.3476 { cb ala A 47 2hq9A_134F_47A}-12.5775 2.9456 -7.4829 { ca phe A 134 2hq9A_134F_47A}P -7.6486 -0.0121 -5.5325 { cb phe A 134 2hq9A_134F_47A}-8.2736 -1.2636 -6.1524 { cg phe A 134 2hq9A_134F_47A}-9.61 -1.0464 -6.8119 { cd1 phe A 134 2hq9A_134F_47A}-10.7955 -1.0561 -6.0648 { ce1 phe A 134 2hq9A_134F_47A}-12.0269 -0.909 -6.6947 { cz phe A 134 2hq9A_134F_47A}-12.0778 -0.7225 -8.0559 { cg phe A 134 2hq9A_134F_47A}P -9.61 -1.0464 -6.8119 { cd2 phe A 134 2hq9A_134F_47A}-9.6993 -0.8882 -8.1884 { ce2 phe A 134 2hq9A_134F_47A}-10.9399 -0.7038 -8.805 { cz phe A 134 2hq9A_134F_47A}ghost -12.0778 -0.7225 -8.0559 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ala A 47 2hq9A_134F_47A}P -12.5775 2.9456 -7.4829 {"}P -12.5775 2.9456 -7.4829 {"}P -12.5775 2.9456 -7.4829 { cb phe A 134 2hq9A_134F_47A}P -8.2736 -1.2636 -6.1524 {"}P -8.2736 -1.2636 -6.1524 { cd1 phe A 134 2hq9A_134F_47A}P -10.7955 -1.0561 -6.0648 { cd2 phe A 134 2hq9A_134F_47A}P -9.6993 -0.8882 -8.1884 { ce1 phe A 134 2hq9A_134F_47A}P -12.0269 -0.909 -6.6947 { ce2 phe A 134 2hq9A_134F_47A}P -10.9399 -0.7038 -8.805 { cz phe A 134 2hq9A_134F_47A}P -12.0778 -0.7225 -8.0559 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 134 A}'S' blue -12.2558 0.8213 -6.8266 {"}'S' sky -12.4197 0.7646 -7.0222 {"}'S' blue -11.9153 0.8332 -6.8184 {"}'S' sky -11.7068 0.79 -6.9696 {"}'S' blue -11.4917 0.7077 -7.0977 { CE2 PHE 134 A}'S' sky -11.173 0.8787 -8.0956 {"}'S' sky -11.3209 0.9285 -8.3006 {"}'S' sky -11.4768 0.9341 -8.5047 {"}'S' sky -11.6372 0.8979 -8.702 {"}'S' blue -11.0423 0.9822 -8.3474 {"}'S' blue -11.1942 1.0094 -8.5509 {"}'S' blue -11.3519 0.9962 -8.7515 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 134 A}'S' sea -12.0774 0.8097 -7.021 { CZ PHE 134 A}'S' sea -12.7155 0.8086 -7.4982 {"}'S' green -12.3109 0.8601 -7.3465 {"}'S' green -12.4588 0.9099 -7.5515 {"}'S' green -12.6147 0.9155 -7.7556 {"}'S' sea -12.7751 0.8793 -7.9529 {"}'S' sea -11.9099 0.7947 -7.2004 {"}'S' green -12.0378 0.8977 -7.3954 {"}'S' green -12.6506 0.925 -8.1948 {"}'S' green -11.7072 0.8431 -7.3668 {"}'S' green -12.4705 0.9512 -8.3834 {"}'S' green -11.5222 0.8613 -7.5624 {"}'S' green -12.1282 0.9962 -8.3822 {"}'S' sea -12.2918 0.9348 -8.5764 {"}'S' green -11.4513 0.9055 -7.9165 {"}'S' green -11.5999 0.9593 -8.1234 {"}'S' green -11.7576 0.9765 -8.3308 {"}'S' green -11.9193 0.9535 -8.5346 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 134 A}'S' P -12.1802 0.9636 -7.5983 {"}'S' -12.1778 0.9112 -7.612 {"}'S' P -12.3321 0.9907 -7.8018 {"}'S' -12.3225 0.9291 -7.8105 {"}'S' P -12.4898 0.9776 -8.0023 {"}'S' -12.4852 0.9564 -8.0032 {"}'S' P -11.8416 0.9415 -7.5678 {"}'S' -11.8455 0.9136 -7.5754 {"}'S' P -11.9884 1.0023 -7.7755 {"}'S' -11.9929 0.9225 -7.7874 {"}'S' P -12.145 1.0253 -7.9829 {"}'S' -12.1417 0.9417 -7.9866 {"}'S' P -12.3066 1.0078 -8.1878 {"}'S' -12.3028 0.9737 -8.185 {"}'S' P -11.6601 0.9524 -7.7648 {"}'S' -11.664 0.936 -7.7681 {"}'S' P -11.8092 1.0054 -7.9722 {"}'S' -11.8176 0.9491 -7.9743 {"}'S' P -11.9661 1.0197 -8.1796 {"}'S' -11.9692 0.9715 -8.1763 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 47 A}'S' blue -12.3412 1.1474 -7.0229 {"}'S' blue -11.9678 1.1775 -6.9586 {"}'S' blue -11.217 1.2455 -7.9558 {"}'S' blue -11.3784 1.3345 -8.4205 {"}'S' blue -11.2148 1.3631 -8.2172 @dotlist {x} color= white width= 1 master= {vdw contact} { HB3 ALA 47 A}'S' green -12.7243 1.0318 -7.896 {"}'S' green -12.5869 0.9503 -7.6965 {"}'S' green -12.435 0.9245 -7.4932 {"}'S' green -12.2756 0.955 -7.296 {"}'S' sea -12.1172 1.0415 -7.1146 {"}'S' green -12.5632 0.9905 -8.1091 {"}'S' green -11.9711 0.931 -7.3271 {"}'S' green -12.434 1.0759 -8.3962 {"}'S' green -11.7115 0.954 -7.4287 {"}'S' green -12.141 1.0264 -8.4151 {"}'S' green -11.5494 0.9763 -7.6361 {"}'S' green -11.9038 1.1015 -8.4959 {"}'S' green -11.7689 1.0066 -8.295 {"}'S' green -11.6131 0.9824 -8.0868 {"}'S' green -11.4498 1.0313 -7.8902 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 ALA 47 A}'S' P -12.4325 0.8961 -7.914 {"}'S' -12.4204 0.9371 -7.9086 {"}'S' P -12.2852 0.8545 -7.7117 {"}'S' -12.2756 0.9147 -7.7157 {"}'S' P -12.1297 0.8665 -7.5139 {"}'S' -12.1283 0.9003 -7.5214 {"}'S' P -12.3178 0.9441 -8.2107 {"}'S' -12.3126 0.9706 -8.1994 {"}'S' P -12.1812 0.8627 -8.0106 {"}'S' -12.175 0.9419 -7.9945 {"}'S' P -12.0288 0.8377 -7.8069 {"}'S' -12.0334 0.9218 -7.8049 {"}'S' P -11.8695 0.8682 -7.6097 {"}'S' -11.8772 0.909 -7.616 {"}'S' P -12.0126 0.9256 -8.22 {"}'S' -12.0153 0.9685 -8.2027 {"}'S' P -11.8653 0.8826 -8.0174 {"}'S' -11.8776 0.9459 -8.0043 {"}'S' P -11.7071 0.9003 -7.819 {"}'S' -11.7183 0.9326 -7.8176 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 134 A}'M' greentint -9.3719 2.4363 -6.1467 {"}'M' greentint -9.1296 2.8319 -5.9435 {"}'M' greentint -9.2782 2.675 -6.092 {"}'M' greentint -9.382 2.5787 -6.3894 {"}'M' greentint -9.4385 2.3292 -6.3927 {"}'M' greentint -8.9804 3.0621 -6.0056 {"}'M' greentint -9.139 2.9689 -6.184 {"}'M' greentint -9.2782 2.801 -6.3172 {"}'M' greentint -9.3516 2.6727 -6.6342 {"}'M' greentint -9.4227 2.4276 -6.6584 {"}'M' greentint -8.9536 3.193 -6.2655 {"}'M' greentint -9.1084 3.0699 -6.4301 {"}'M' greentint -9.2441 2.8924 -6.5563 {"}'M' greentint -9.2737 2.7529 -6.8725 {"}'M' greentint -9.3549 2.5097 -6.9109 {"}'M' greentint -8.8727 3.289 -6.5032 {"}'M' greentint -9.025 3.1531 -6.6632 {"}'M' greentint -9.1616 2.9715 -6.788 {"}'M' greentint -9.1592 2.7977 -7.1021 {"}'M' greentint -8.7716 3.3353 -6.7499 {"}'M' greentint -8.9178 3.1917 -6.8998 {"}'M' greentint -9.0486 3.0097 -7.0182 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ALA 47 A}'M' greentint -9.2748 2.4452 -6.1305 {"}'M' greentint -9.1417 2.6208 -6.0075 {"}'M' greentint -9.0365 2.8354 -5.9297 {"}'M' greentint -9.3745 2.3182 -6.624 {"}'M' greentint -9.2138 2.3942 -6.4371 {"}'M' greentint -9.0643 2.5396 -6.2847 {"}'M' greentint -8.9397 2.7395 -6.1789 {"}'M' greentint -8.8511 2.9771 -6.1308 {"}'M' greentint -8.8066 3.2319 -6.1435 {"}'M' greentint -9.2808 2.4291 -6.8766 {"}'M' greentint -9.1185 2.474 -6.6787 {"}'M' greentint -8.9642 2.6066 -6.517 {"}'M' greentint -8.84 2.8099 -6.4124 {"}'M' greentint -8.7617 3.0556 -6.3802 {"}'M' greentint -8.7407 3.311 -6.4235 {"}'M' greentint -9.1698 2.6126 -7.0471 {"}'M' greentint -9.0088 2.6406 -6.8471 {"}'M' greentint -8.8608 2.7926 -6.6982 {"}'M' greentint -8.766 3.0267 -6.6409 {"}'M' greentint -8.7497 3.2804 -6.6902 {"}'M' greentint -9.0363 2.8304 -7.1006 {"}'M' greentint -8.8763 2.9273 -6.9212 {"}'M' greentint -8.8214 3.1806 -6.921 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 134 A}'M' greentint -10.0308 1.1651 -4.1802 {"}'M' greentint -9.8159 1.5153 -4.0005 {"}'M' greentint -9.9759 1.4184 -4.18 {"}'M' greentint -10.0863 1.319 -4.4602 {"}'M' greentint -10.1026 1.0653 -4.4109 {"}'M' greentint -9.6824 1.7331 -4.0541 {"}'M' greentint -9.8434 1.7051 -4.254 {"}'M' greentint -9.9915 1.5531 -4.4029 {"}'M' greentint -10.058 1.4164 -4.7138 {"}'M' greentint -10.1084 1.1618 -4.7092 {"}'M' greentint -9.494 1.903 -4.1207 {"}'M' greentint -9.6529 1.9061 -4.3266 {"}'M' greentint -9.8131 1.8151 -4.5095 {"}'M' greentint -9.9545 1.6445 -4.645 {"}'M' greentint -9.9611 1.4907 -4.9539 {"}'M' greentint -10.0294 1.2417 -4.9715 {"}'M' greentint -9.3971 2.0377 -4.3762 {"}'M' greentint -9.5584 1.9985 -4.5741 {"}'M' greentint -9.7151 1.8865 -4.7455 {"}'M' greentint -9.8537 1.7117 -4.8762 {"}'M' greentint -9.8158 1.5102 -5.1714 {"}'M' greentint -9.8892 1.2704 -5.1983 {"}'M' greentint -9.4272 2.0249 -4.8108 {"}'M' greentint -9.5774 1.9005 -4.9706 {"}'M' greentint -9.7105 1.7249 -5.0937 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O ALA 47 A}'M' greentint -10.0986 0.9456 -4.5525 {"}'M' greentint -9.9468 1.0662 -4.3896 {"}'M' greentint -9.8065 1.2282 -4.2536 {"}'M' greentint -9.6845 1.4248 -4.1506 {"}'M' greentint -9.5862 1.6497 -4.0846 {"}'M' greentint -9.9912 1.0057 -4.7937 {"}'M' greentint -9.8334 1.1159 -4.6202 {"}'M' greentint -9.688 1.2776 -4.4772 {"}'M' greentint -9.5634 1.48 -4.3736 {"}'M' greentint -9.467 1.7131 -4.3138 {"}'M' greentint -9.4032 1.9649 -4.3012 {"}'M' greentint -9.9203 1.1078 -5.0464 {"}'M' greentint -9.7605 1.1964 -4.8654 {"}'M' greentint -9.6138 1.346 -4.7179 {"}'M' greentint -9.4901 1.5457 -4.6131 {"}'M' greentint -9.3983 1.7799 -4.5598 {"}'M' greentint -9.3463 2.0308 -4.5614 {"}'M' greentint -9.802 1.2783 -5.2005 {"}'M' greentint -9.645 1.3742 -5.0232 {"}'M' greentint -9.5065 1.5447 -4.8916 {"}'M' greentint -9.4036 1.7682 -4.8208 {"}'M' greentint -9.3492 2.0179 -4.8205 {"}'M' greentint -9.6634 1.5044 -5.2745 {"}'M' greentint -9.5136 1.6581 -5.1237 {"}'M' greentint -9.4183 1.8944 -5.0662 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 83 2hsiA_100F_85Q}P -7.2881 6.1124 -11.7678 {"}-7.2881 6.1124 -11.7678 { ca gly A 83 2hsiA_100F_85Q}-7.222 6.6414 -10.4122 { c gly A 83 2hsiA_100F_85Q}-7.6141 5.5973 -9.3786 { o gly A 83 2hsiA_100F_85Q}-7.8781 4.4336 -9.7301 { c gly A 83 2hsiA_100F_85Q}P -7.6141 5.5973 -9.3786 { n pro A 84 2hsiA_100F_85Q}-7.672 6.0062 -8.0986 { ca pro A 84 2hsiA_100F_85Q}-8.0822 5.1109 -7.0161 { c pro A 84 2hsiA_100F_85Q}-9.5588 4.7631 -7.1435 { o pro A 84 2hsiA_100F_85Q}-10.3571 5.6029 -7.5837 { c pro A 84 2hsiA_100F_85Q}P -9.5588 4.7631 -7.1435 { n gln A 85 2hsiA_100F_85Q}-9.9062 3.5312 -6.7628 { ca gln A 85 2hsiA_100F_85Q}-11.2941 3.0344 -6.7966 { c gln A 85 2hsiA_100F_85Q}-11.603 2.3511 -5.4752 { o gln A 85 2hsiA_100F_85Q}-10.6835 1.9574 -4.7661 { c gln A 85 2hsiA_100F_85Q}P -11.603 2.3511 -5.4752 { n lys A 86 2hsiA_100F_85Q}-12.8862 2.2057 -5.1607 { ca lys A 86 2hsiA_100F_85Q}-13.3347 1.6145 -3.8992 { c lys A 86 2hsiA_100F_85Q}-14.2038 0.388 -4.1918 { o lys A 86 2hsiA_100F_85Q}-15.0246 0.4118 -5.0987 { c lys A 86 2hsiA_100F_85Q}P -14.2038 0.388 -4.1918 { n leu A 87 2hsiA_100F_85Q}-13.9972 -0.6733 -3.4211 { ca leu A 87 2hsiA_100F_85Q}-14.8532 -1.847 -3.4431 { c leu A 87 2hsiA_100F_85Q}-15.5104 -1.95 -2.0759 { o leu A 87 2hsiA_100F_85Q}-14.8272 -1.8722 -1.059 { n glu A 98 2hsiA_100F_85Q}P -12.4248 -1.7034 0.3934 {"}-12.4248 -1.7034 0.3934 { ca glu A 98 2hsiA_100F_85Q}-11.0724 -2.0118 -0.0341 { c glu A 98 2hsiA_100F_85Q}-10.7483 -1.2331 -1.2897 { o glu A 98 2hsiA_100F_85Q}-11.4678 -1.3125 -2.2823 { c glu A 98 2hsiA_100F_85Q}P -10.7483 -1.2331 -1.2897 { n arg A 99 2hsiA_100F_85Q}-9.67 -0.4658 -1.2317 { ca arg A 99 2hsiA_100F_85Q}-9.2685 0.334 -2.3795 { c arg A 99 2hsiA_100F_85Q}-8.3775 -0.417 -3.3537 { o arg A 99 2hsiA_100F_85Q}-7.6272 -1.3171 -2.9771 { c arg A 99 2hsiA_100F_85Q}P -8.3775 -0.417 -3.3537 { n phe A 100 2hsiA_100F_85Q}-8.4898 -0.0402 -4.6202 { ca phe A 100 2hsiA_100F_85Q}-7.6022 -0.5379 -5.6413 { c phe A 100 2hsiA_100F_85Q}-7.3534 0.5949 -6.6381 { o phe A 100 2hsiA_100F_85Q}-7.9442 1.6526 -6.5181 { c phe A 100 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0.057 -8.1934 {"}'S' -11.1259 0.1012 -8.1648 {"}'S' P -10.9995 -0.0438 -7.9983 {"}'S' -11.0023 -0.0039 -7.9822 { HG3 GLN 85 A}'S' P -10.7882 0.2814 -9.5575 {"}'S' -10.7873 0.3013 -9.5624 {"}'S' P -10.6296 0.3459 -9.3707 {"}'S' -10.6305 0.3561 -9.3744 {"}'S' P -10.528 0.2832 -9.6533 {"}'S' -10.5302 0.2916 -9.6548 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O PHE 100 A}'M' P -8.9963 2.5709 -6.4177 {"}'M' -8.9892 2.5647 -6.4185 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 100 A}'M' greentint -9.1163 2.045 -5.8618 {"}'M' greentint -9.2598 1.9373 -6.1342 {"}'M' greentint -8.8543 2.3663 -5.7291 {"}'M' greentint -9.0176 2.3329 -5.931 {"}'M' greentint -9.1662 2.176 -6.0795 {"}'M' greentint -9.2699 2.0796 -6.377 {"}'M' greentint -8.7104 2.5714 -5.7912 {"}'M' greentint -8.8683 2.5631 -5.9932 {"}'M' greentint -9.0269 2.4699 -6.1716 {"}'M' greentint -9.1662 2.3019 -6.3047 {"}'M' greentint -9.2395 2.1737 -6.6218 {"}'M' greentint -9.3106 1.9285 -6.646 {"}'M' greentint -8.5252 2.7415 -5.8572 {"}'M' greentint -8.6814 2.7522 -6.061 {"}'M' greentint -8.8415 2.6939 -6.253 {"}'M' greentint -9.132 2.3933 -6.5438 {"}'M' greentint -9.1616 2.2539 -6.86 {"}'M' greentint -9.2428 2.0107 -6.8984 {"}'M' greentint -8.4381 2.8956 -6.1031 {"}'M' greentint -8.5986 2.8722 -6.3051 {"}'M' greentint -8.7607 2.79 -6.4908 {"}'M' greentint -8.9129 2.654 -6.6508 {"}'M' greentint -9.0496 2.4724 -6.7756 {"}'M' greentint -9.0471 2.2986 -7.0897 {"}'M' greentint -8.3446 2.9861 -6.3719 {"}'M' greentint -8.5038 2.935 -6.5641 {"}'M' greentint -8.6596 2.8362 -6.7374 {"}'M' greentint -8.8057 2.6927 -6.8873 {"}'M' greentint -8.9365 2.5107 -7.0057 {"}'M' greentint -8.347 2.9694 -6.7695 {"}'M' greentint -8.5039 2.8635 -6.9426 {"}'M' greentint -8.6505 2.7164 -7.0924 {"}'M' greentint -8.7826 2.5335 -7.2124 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H GLN 85 A}'M' P -8.4778 2.2187 -6.4267 {"}'M' -8.4842 2.2247 -6.4264 @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLN 85 A}'M' greentint -9.2076 1.9092 -6.111 {"}'M' greentint -9.0526 2.0064 -5.9386 {"}'M' greentint -8.9113 2.1572 -5.797 {"}'M' greentint -8.7907 2.3514 -5.6952 {"}'M' greentint -9.2512 1.8699 -6.5855 {"}'M' greentint -9.0969 1.8691 -6.3864 {"}'M' greentint -8.9387 1.9328 -6.2001 {"}'M' greentint -8.7884 2.0573 -6.0402 {"}'M' greentint -8.6553 2.2329 -5.9172 {"}'M' greentint -8.5501 2.4475 -5.8394 {"}'M' greentint -8.4766 2.6873 -5.8125 {"}'M' greentint -9.1877 2.0011 -6.9405 {"}'M' greentint -9.0463 1.9281 -6.7374 {"}'M' greentint -8.8881 1.9303 -6.5337 {"}'M' greentint -8.7274 2.0063 -6.3468 {"}'M' greentint -8.5779 2.1517 -6.1944 {"}'M' greentint -8.4533 2.3516 -6.0886 {"}'M' greentint -8.3647 2.5892 -6.0405 {"}'M' greentint -8.3202 2.844 -6.0532 {"}'M' greentint -8.9432 2.0908 -6.9925 {"}'M' greentint -8.7944 2.0412 -6.7863 {"}'M' greentint -8.6321 2.0861 -6.5884 {"}'M' greentint -8.3536 2.422 -6.3221 {"}'M' greentint -8.2753 2.6677 -6.2899 {"}'M' greentint -8.2543 2.9231 -6.3332 {"}'M' greentint -8.8152 2.3264 -7.1549 {"}'M' greentint -8.6834 2.2246 -6.9568 {"}'M' greentint -8.5224 2.2527 -6.7568 {"}'M' greentint -8.3744 2.4047 -6.6079 {"}'M' greentint -8.2796 2.6388 -6.5506 {"}'M' greentint -8.2633 2.8925 -6.5999 {"}'M' greentint -8.6541 2.5977 -7.1881 {"}'M' greentint -8.5499 2.4425 -7.0103 {"}'M' greentint -8.3899 2.5394 -6.8309 {"}'M' greentint -8.335 2.7927 -6.8307 {"}'M' greentint -8.4682 2.6891 -7.0302 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 100 A}'M' green -9.332 1.5893 -4.9913 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 100 A}'M' greentint -9.8789 1.0159 -4.3674 {"}'M' greentint -10.0389 0.919 -4.5468 {"}'M' greentint -10.1493 0.8196 -4.8271 {"}'M' greentint -9.7454 1.2338 -4.4209 {"}'M' greentint -9.9064 1.2057 -4.6209 {"}'M' greentint -10.0545 1.0537 -4.7698 {"}'M' greentint -10.121 0.9171 -5.0807 {"}'M' greentint -9.557 1.4036 -4.4876 {"}'M' greentint -9.7159 1.4068 -4.6935 {"}'M' greentint -9.8761 1.3157 -4.8764 {"}'M' greentint -10.0176 1.1452 -5.0119 {"}'M' greentint -10.0241 0.9913 -5.3207 {"}'M' greentint -9.4601 1.5383 -4.7431 {"}'M' greentint -9.6215 1.4992 -4.941 {"}'M' greentint -9.7781 1.3871 -5.1123 {"}'M' greentint -9.9167 1.2124 -5.2431 {"}'M' greentint -9.4902 1.5256 -5.1776 {"}'M' greentint -9.6404 1.4011 -5.3375 {"}'M' greentint -9.7735 1.2255 -5.4606 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLN 85 A}'M' green -10.2081 0.6411 -4.8207 {"}'M' green -9.636 1.1944 -4.2351 {"}'M' green -9.3497 1.5495 -4.6443 {"}'M' green -9.9123 1.0369 -5.4858 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLN 85 A}'M' greentint -10.0501 0.7151 -4.6369 {"}'M' greentint -9.8983 0.8358 -4.4741 {"}'M' greentint -9.7579 0.9978 -4.338 {"}'M' greentint -10.1053 0.7195 -5.0722 {"}'M' greentint -9.9427 0.7752 -4.8781 {"}'M' greentint -9.7849 0.8855 -4.7046 {"}'M' greentint -9.6395 1.0472 -4.5617 {"}'M' greentint -9.5149 1.2496 -4.4581 {"}'M' greentint -10.0309 0.8549 -5.3313 {"}'M' greentint -9.8717 0.8774 -5.1308 {"}'M' greentint -9.712 0.9659 -4.9498 {"}'M' greentint -9.5653 1.1155 -4.8023 {"}'M' greentint -9.4416 1.3153 -4.6976 {"}'M' greentint -9.7535 1.0479 -5.2849 {"}'M' greentint -9.5964 1.1438 -5.1076 {"}'M' greentint -9.458 1.3143 -4.9761 {"}'M' greentint -9.355 1.5378 -4.9052 {"}'M' greentint -9.6148 1.2739 -5.359 {"}'M' greentint -9.4651 1.4276 -5.2081 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gly A 18 2hw4A_20F_79I}P -12.4588 -2.6522 -1.0035 {"}-12.4588 -2.6522 -1.0035 { ca gly A 18 2hw4A_20F_79I}-11.197 -2.1395 -0.6759 { c gly A 18 2hw4A_20F_79I}-10.895 -1.0202 -1.6259 { o gly A 18 2hw4A_20F_79I}-11.7802 -0.5917 -2.3901 { c gly A 18 2hw4A_20F_79I}P -10.895 -1.0202 -1.6259 { n val A 19 2hw4A_20F_79I}-9.65 -0.6072 -1.5583 { ca val A 19 2hw4A_20F_79I}-9.138 0.5153 -2.3485 { c val A 19 2hw4A_20F_79I}-8.1074 -0.06 -3.2556 { o val A 19 2hw4A_20F_79I}-7.2492 -0.8043 -2.815 { c val A 19 2hw4A_20F_79I}P -8.1074 -0.06 -3.2556 { n phe A 20 2hw4A_20F_79I}-8.1095 0.3333 -4.536 { ca phe A 20 2hw4A_20F_79I}-7.1821 -0.2076 -5.4672 { c phe A 20 2hw4A_20F_79I}-7.0412 0.7199 -6.6569 { o phe A 20 2hw4A_20F_79I}-7.9174 1.5863 -6.892 { c phe A 20 2hw4A_20F_79I}P -7.0412 0.7199 -6.6569 { n lys A 21 2hw4A_20F_79I}-5.9109 0.5762 -7.3213 { ca lys A 21 2hw4A_20F_79I}-5.6559 1.2897 -8.5745 { c lys A 21 2hw4A_20F_79I}-6.6454 0.8483 -9.6724 { o lys A 21 2hw4A_20F_79I}-7.0128 -0.3369 -9.8066 { c lys A 21 2hw4A_20F_79I}P -6.6454 0.8483 -9.6724 { n tyr A 22 2hw4A_20F_79I}-6.9893 1.8018 -10.5395 { ca tyr A 22 2hw4A_20F_79I}-7.6861 1.5051 -11.7146 { c tyr A 22 2hw4A_20F_79I}-7.1726 2.3425 -12.882 { o tyr A 22 2hw4A_20F_79I}-6.5967 3.4374 -12.695 { n gly A 77 2hw4A_20F_79I}P -6.5418 6.1575 -11.6739 {"}-6.5418 6.1575 -11.6739 { ca gly A 77 2hw4A_20F_79I}-6.7761 6.645 -10.3931 { c gly A 77 2hw4A_20F_79I}-6.9565 5.5164 -9.4167 { o gly A 77 2hw4A_20F_79I}-6.2674 4.461 -9.5445 { c gly A 77 2hw4A_20F_79I}P -6.9565 5.5164 -9.4167 { n arg A 78 2hw4A_20F_79I}-7.8499 5.7483 -8.4588 { ca arg A 78 2hw4A_20F_79I}-8.2241 4.7066 -7.4903 { c arg A 78 2hw4A_20F_79I}-9.7351 4.5335 -7.4756 { o arg A 78 2hw4A_20F_79I}-10.5203 5.4738 -7.7893 { c arg A 78 2hw4A_20F_79I}P -9.7351 4.5335 -7.4756 { n ile A 79 2hw4A_20F_79I}-10.1466 3.3406 -7.0581 { ca ile A 79 2hw4A_20F_79I}-11.5207 3.0289 -6.7991 { c ile A 79 2hw4A_20F_79I}-11.6033 2.5143 -5.366 { o ile A 79 2hw4A_20F_79I}-10.7001 1.7443 -4.9554 { c ile A 79 2hw4A_20F_79I}P -11.6033 2.5143 -5.366 { n ser A 80 2hw4A_20F_79I}-12.5652 3.0137 -4.5988 { ca ser A 80 2hw4A_20F_79I}-12.8945 2.5139 -3.2737 { c ser A 80 2hw4A_20F_79I}-14.2179 1.7908 -3.4513 { o ser A 80 2hw4A_20F_79I}-15.1974 2.4236 -3.834 { c ser A 80 2hw4A_20F_79I}P -14.2179 1.7908 -3.4513 { n his A 81 2hw4A_20F_79I}-14.213 0.4698 -3.2866 { ca his A 81 2hw4A_20F_79I}-15.4366 -0.3439 -3.4523 { c his A 81 2hw4A_20F_79I}-15.8474 -0.8322 -2.0637 { o his A 81 2hw4A_20F_79I}-15.1299 -1.6161 -1.4577 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gly A 18 2hw4A_20F_79I}P -12.4588 -2.6522 -1.0035 { ca gly A 18 2hw4A_20F_79I}P -11.197 -2.1395 -0.6759 {"}P -11.197 -2.1395 -0.6759 { n val A 19 2hw4A_20F_79I}P -9.65 -0.6072 -1.5583 { ca val A 19 2hw4A_20F_79I}P -9.138 0.5153 -2.3485 { n phe A 20 2hw4A_20F_79I}P -8.1095 0.3333 -4.536 { ca phe A 20 2hw4A_20F_79I}P -7.1821 -0.2076 -5.4672 { n lys A 21 2hw4A_20F_79I}P -5.9109 0.5762 -7.3213 { ca lys A 21 2hw4A_20F_79I}P -5.6559 1.2897 -8.5745 { n tyr A 22 2hw4A_20F_79I}P -6.9893 1.8018 -10.5395 { ca tyr A 22 2hw4A_20F_79I}P -7.6861 1.5051 -11.7146 { n gly A 77 2hw4A_20F_79I}P -6.5418 6.1575 -11.6739 { ca gly A 77 2hw4A_20F_79I}P -6.7761 6.645 -10.3931 {"}P -6.7761 6.645 -10.3931 { n arg A 78 2hw4A_20F_79I}P -7.8499 5.7483 -8.4588 { ca arg A 78 2hw4A_20F_79I}P -8.2241 4.7066 -7.4903 { n ile A 79 2hw4A_20F_79I}P -10.1466 3.3406 -7.0581 { ca ile A 79 2hw4A_20F_79I}P -11.5207 3.0289 -6.7991 { n ser A 80 2hw4A_20F_79I}P -12.5652 3.0137 -4.5988 { ca ser A 80 2hw4A_20F_79I}P -12.8945 2.5139 -3.2737 { n his A 81 2hw4A_20F_79I}P -14.213 0.4698 -3.2866 { ca his A 81 2hw4A_20F_79I}P -15.4366 -0.3439 -3.4523 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gly A 18 2hw4A_20F_79I}P -11.197 -2.1395 -0.6759 {"}-11.197 -2.1395 -0.6759 { ca val A 19 2hw4A_20F_79I}-9.138 0.5153 -2.3485 { ca phe A 20 2hw4A_20F_79I}-7.1821 -0.2076 -5.4672 { ca lys A 21 2hw4A_20F_79I}-5.6559 1.2897 -8.5745 { ca tyr A 22 2hw4A_20F_79I}-7.6861 1.5051 -11.7146 { ca gly A 77 2hw4A_20F_79I}P -6.7761 6.645 -10.3931 {"}-6.7761 6.645 -10.3931 { ca arg A 78 2hw4A_20F_79I}-8.2241 4.7066 -7.4903 { ca ile A 79 2hw4A_20F_79I}-11.5207 3.0289 -6.7991 { ca ser A 80 2hw4A_20F_79I}-12.8945 2.5139 -3.2737 { ca his A 81 2hw4A_20F_79I}-15.4366 -0.3439 -3.4523 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 20 2hw4A_20F_79I}P -7.1821 -0.2076 -5.4672 { cb phe A 20 2hw4A_20F_79I}-7.5768 -1.6276 -5.9338 { cg phe A 20 2hw4A_20F_79I}-9.02 -1.7953 -6.2617 { cd1 phe A 20 2hw4A_20F_79I}-9.4801 -1.5725 -7.5617 { ce1 phe A 20 2hw4A_20F_79I}-10.844 -1.6527 -7.8713 { cz phe A 20 2hw4A_20F_79I}-11.7192 -2.0211 -6.914 { cg phe A 20 2hw4A_20F_79I}P -9.02 -1.7953 -6.2617 { cd2 phe A 20 2hw4A_20F_79I}-9.9322 -2.1253 -5.3159 { ce2 phe A 20 2hw4A_20F_79I}-11.2681 -2.2089 -5.6274 { cz phe A 20 2hw4A_20F_79I}ghost -11.7192 -2.0211 -6.914 { ca ile A 79 2hw4A_20F_79I}P -11.5207 3.0289 -6.7991 { cb ile A 79 2hw4A_20F_79I}-12.0625 1.9508 -7.743 { cg1 ile A 79 2hw4A_20F_79I}-12.0902 2.4431 -9.1817 { cd1 ile A 79 2hw4A_20F_79I}-12.4999 1.3988 -10.2039 { cb ile A 79 2hw4A_20F_79I}P -12.0625 1.9508 -7.743 { cg2 ile A 79 2hw4A_20F_79I}-13.5035 1.4441 -7.2233 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 20 2hw4A_20F_79I}P -7.5768 -1.6276 -5.9338 {"}P -7.5768 -1.6276 -5.9338 { cd1 phe A 20 2hw4A_20F_79I}P -9.4801 -1.5725 -7.5617 { cd2 phe A 20 2hw4A_20F_79I}P -9.9322 -2.1253 -5.3159 { ce1 phe A 20 2hw4A_20F_79I}P -10.844 -1.6527 -7.8713 { ce2 phe A 20 2hw4A_20F_79I}P -11.2681 -2.2089 -5.6274 { cz phe A 20 2hw4A_20F_79I}P -11.7192 -2.0211 -6.914 { cb ile A 79 2hw4A_20F_79I}P -12.0625 1.9508 -7.743 { cg1 ile A 79 2hw4A_20F_79I}P -12.0902 2.4431 -9.1817 {"}P -12.0902 2.4431 -9.1817 { cg2 ile A 79 2hw4A_20F_79I}P -13.5035 1.4441 -7.2233 {"}P -13.5035 1.4441 -7.2233 {"}P -13.5035 1.4441 -7.2233 { cd1 ile A 79 2hw4A_20F_79I}P -12.4999 1.3988 -10.2039 {"}P -12.4999 1.3988 -10.2039 {"}P -12.4999 1.3988 -10.2039 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 20 A}'S' blue -10.1775 0.0293 -7.4587 {"}'S' blue -10.2103 -0.0147 -7.8797 { CE1 PHE 20 A}'S' blue -11.5182 -0.3891 -8.8778 {"}'S' blue -11.3104 -0.4284 -9.0309 { CZ PHE 20 A}'S' blue -12.6809 -0.5677 -6.7521 {"}'S' blue -12.4166 -0.4194 -6.811 {"}'S' blue -12.5773 -0.4978 -6.9956 {"}'S' blue -12.7324 -0.6164 -7.1635 {"}'S' blue -12.2921 -0.3736 -7.0529 {"}'S' blue -12.4494 -0.4633 -7.232 {"}'S' blue -11.6076 -0.279 -7.0377 {"}'S' blue -11.7697 -0.3024 -7.2403 { HE1 PHE 20 A}'S' sky -11.5071 -0.4914 -9.1128 {"}'S' sky -11.6574 -0.6159 -9.2726 {"}'S' blue -11.7905 -0.7915 -9.3957 {"}'S' blue -11.1597 -0.4414 -9.1073 {"}'S' sky -11.3168 -0.5097 -9.291 {"}'S' sky -11.4662 -0.6339 -9.4497 {"}'S' sky -11.5984 -0.808 -9.572 {"}'S' blue -11.103 -0.5787 -9.4257 {"}'S' sky -11.2541 -0.703 -9.585 {"}'S' blue -11.386 -0.878 -9.7082 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 20 A}'S' sea -11.3288 -0.1558 -7.1052 {"}'S' green -11.4818 -0.1216 -7.3136 {"}'S' green -11.6428 -0.1365 -7.5166 {"}'S' sea -11.8056 -0.1992 -7.7094 {"}'S' sea -11.0772 -0.0701 -7.1619 {"}'S' green -11.2251 -0.0203 -7.3669 {"}'S' green -11.7021 -0.1294 -7.9529 {"}'S' sea -10.8041 -0.0325 -7.2108 {"}'S' green -10.9465 0.0334 -7.4137 {"}'S' green -11.5742 -0.0949 -8.1893 {"}'S' sea -10.6078 0.0113 -7.3832 {"}'S' green -10.7546 0.0721 -7.5909 {"}'S' green -11.2367 0.021 -8.1988 {"}'S' sea -11.3979 -0.0727 -8.3806 {"}'S' green -10.5754 0.0752 -7.7875 {"}'S' green -10.7323 0.0895 -7.995 {"}'S' green -10.8945 0.066 -8.1976 {"}'S' green -11.0581 0.0046 -8.3918 {"}'S' sea -10.5238 0.0463 -8.1462 {"}'S' sea -10.6856 0.0233 -8.35 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 20 A}'S' P -11.381 -0.0147 -7.571 {"}'S' -11.3726 -0.0424 -7.5754 {"}'S' P -11.5414 -0.0509 -7.7683 {"}'S' -11.5372 -0.0619 -7.7687 {"}'S' P -11.0984 0.0605 -7.6172 {"}'S' -11.0916 0.0108 -7.6239 {"}'S' P -11.2561 0.0474 -7.8177 {"}'S' -11.2421 -0.0116 -7.8194 {"}'S' P -11.4169 -0.0051 -8.0102 {"}'S' -11.4089 -0.0259 -8.0083 {"}'S' P -10.9113 0.0951 -7.7983 {"}'S' -10.9096 0.0595 -7.7998 {"}'S' P -11.0728 0.0777 -8.0031 {"}'S' -11.0672 0.0371 -7.9998 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 ILE 79 A}'S' blue -12.9358 -0.206 -7.0909 {"}'S' blue -12.7777 -0.1174 -6.9104 {"}'S' blue -12.6254 0.0068 -6.7477 {"}'S' blue -12.7202 -0.121 -7.2258 {"}'S' blue -12.5623 -0.0211 -7.0498 {"}'S' blue -12.467 0.0368 -7.3002 { HB ILE 79 A}'S' blue -11.7976 0.1496 -7.1646 {"}'S' blue -10.4517 0.4057 -7.547 {HD12 ILE 79 A}'S' sky -11.8232 -0.4081 -9.5091 {"}'S' sky -11.6739 -0.2721 -9.3532 {"}'S' blue -11.5395 -0.0931 -9.2308 {"}'S' sky -11.6771 -0.5186 -9.7217 {"}'S' sky -11.5242 -0.4026 -9.5562 {"}'S' sky -11.3847 -0.2418 -9.4194 {"}'S' blue -11.2632 -0.0449 -9.3188 {"}'S' sky -11.4175 -0.4956 -9.8233 {"}'S' sky -11.2674 -0.3598 -9.6679 {"}'S' blue -11.1333 -0.1798 -9.5445 @dotlist {x} color= white width= 1 master= {vdw contact} { HB ILE 79 A}'S' sea -11.8851 0.0294 -7.6549 {"}'S' sea -11.7332 0.0036 -7.4516 {"}'S' sea -11.5738 0.0341 -7.2544 {"}'S' green -11.7307 -0.0248 -7.8724 {"}'S' green -11.5834 -0.0664 -7.6701 {"}'S' green -11.2693 0.01 -7.2855 {"}'S' sea -11.1163 0.1261 -7.1201 {"}'S' green -11.616 0.0232 -8.1691 {"}'S' green -11.0097 0.033 -7.3871 {"}'S' sea -10.8596 0.1689 -7.2318 {"}'S' sea -11.4392 0.1054 -8.3735 {"}'S' green -10.6972 0.1868 -7.436 {"}'S' sea -11.202 0.1805 -8.4543 {"}'S' green -11.0671 0.0857 -8.2534 {"}'S' green -10.748 0.1104 -7.8486 {"}'S' sea -10.5908 0.2288 -7.6779 {"}'S' sea -10.8277 0.2184 -8.2881 {"}'S' sea -10.6714 0.2291 -8.0888 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB ILE 79 A}'S' P -11.4279 -0.0545 -7.4723 {"}'S' -11.4275 -0.0537 -7.4718 {"}'S' P -11.4794 -0.0582 -7.9691 {"}'S' -11.4784 -0.0426 -7.9662 {"}'S' P -11.327 -0.0832 -7.7653 {"}'S' -11.3302 -0.0311 -7.7645 {"}'S' P -11.1677 -0.0527 -7.5681 {"}'S' -11.1761 -0.009 -7.5743 {"}'S' P -11.3108 0.0047 -8.1784 {"}'S' -11.3103 0.0055 -8.178 {"}'S' P -11.1635 -0.0384 -7.9758 {"}'S' -11.1731 0.0099 -7.9658 {"}'S' P -11.0053 -0.0206 -7.7774 {"}'S' -11.0228 0.03 -7.7752 {"}'S' P -10.8476 0.0554 -7.5945 {"}'S' -10.8514 0.0641 -7.5949 {"}'S' P -10.9113 0.0615 -8.0452 {"}'S' -10.9162 0.0729 -8.0425 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 20 A}'M' greentint -9.0895 1.9787 -6.2356 {"}'M' greentint -9.2331 1.871 -6.5081 {"}'M' greentint -8.9908 2.2666 -6.3048 {"}'M' greentint -9.1394 2.1097 -6.4533 {"}'M' greentint -9.2431 2.0134 -6.7508 {"}'M' greentint -9.2997 1.7639 -6.754 {"}'M' greentint -8.8416 2.4968 -6.367 {"}'M' greentint -9.0002 2.4036 -6.5454 {"}'M' greentint -9.1394 2.2356 -6.6786 {"}'M' greentint -9.2128 2.1074 -6.9956 {"}'M' greentint -9.2839 1.8623 -7.0198 {"}'M' greentint -9.3145 1.6085 -6.9883 {"}'M' greentint -8.6546 2.6859 -6.4348 {"}'M' greentint -8.8148 2.6276 -6.6268 {"}'M' greentint -8.9696 2.5046 -6.7915 {"}'M' greentint -9.1053 2.327 -6.9177 {"}'M' greentint -9.1349 2.1876 -7.2338 {"}'M' greentint -9.2161 1.9444 -7.2722 {"}'M' greentint -9.2635 1.69 -7.2619 {"}'M' greentint -8.7339 2.7237 -6.8646 {"}'M' greentint -8.8862 2.5877 -7.0246 {"}'M' greentint -9.0228 2.4062 -7.1494 {"}'M' greentint -9.0204 2.2323 -7.4635 {"}'M' greentint -9.1059 1.9975 -7.508 {"}'M' greentint -8.6328 2.7699 -7.1112 {"}'M' greentint -8.779 2.6264 -7.2611 {"}'M' greentint -8.9098 2.4444 -7.3795 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H ILE 79 A}'M' greentint -9.2154 1.65 -6.6692 {"}'M' greentint -9.0651 1.7745 -6.5094 {"}'M' greentint -8.932 1.9501 -6.3863 {"}'M' greentint -8.8268 2.1647 -6.3085 {"}'M' greentint -8.7533 2.4045 -6.2816 {"}'M' greentint -9.1648 1.6475 -7.0028 {"}'M' greentint -9.0041 1.7235 -6.8159 {"}'M' greentint -8.8546 1.8689 -6.6635 {"}'M' greentint -8.73 2.0688 -6.5577 {"}'M' greentint -8.6414 2.3064 -6.5096 {"}'M' greentint -8.5969 2.5611 -6.5223 {"}'M' greentint -9.0711 1.7583 -7.2555 {"}'M' greentint -8.9088 1.8033 -7.0575 {"}'M' greentint -8.7545 1.9359 -6.8958 {"}'M' greentint -8.6303 2.1392 -6.7912 {"}'M' greentint -8.552 2.3849 -6.7591 {"}'M' greentint -8.531 2.6403 -6.8024 {"}'M' greentint -8.9601 1.9418 -7.4259 {"}'M' greentint -8.7991 1.9699 -7.2259 {"}'M' greentint -8.6511 2.1218 -7.0771 {"}'M' greentint -8.5563 2.356 -7.0197 {"}'M' greentint -8.54 2.6096 -7.069 {"}'M' greentint -8.8266 2.1597 -7.4794 {"}'M' greentint -8.6666 2.2566 -7.3 {"}'M' greentint -8.6117 2.5099 -7.2998 {"}'M' greentint -8.7449 2.4062 -7.4993 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 20 A}'M' green -9.5185 1.1784 -4.3135 {"}'M' green -9.4369 1.4249 -4.3334 {"}'M' green -9.6569 0.7697 -4.6007 {"}'M' green -9.2738 1.8158 -4.6594 {"}'M' green -9.4367 1.4199 -5.5043 {"}'M' green -9.5102 1.1801 -5.5312 {"}'M' green -9.3315 1.6345 -5.4265 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 20 A}'M' greentint -9.6518 1.0747 -4.513 {"}'M' greentint -9.5968 1.328 -4.5128 {"}'M' greentint -9.7072 1.2286 -4.7931 {"}'M' greentint -9.7235 0.9749 -4.7438 {"}'M' greentint -9.4644 1.6147 -4.5869 {"}'M' greentint -9.6124 1.4628 -4.7357 {"}'M' greentint -9.679 1.3261 -5.0467 {"}'M' greentint -9.7294 1.0714 -5.042 {"}'M' greentint -9.7207 0.8236 -4.9616 {"}'M' greentint -9.4341 1.7247 -4.8423 {"}'M' greentint -9.5755 1.5542 -4.9779 {"}'M' greentint -9.5821 1.4004 -5.2867 {"}'M' greentint -9.6504 1.1514 -5.3044 {"}'M' greentint -9.6709 0.8981 -5.2609 {"}'M' greentint -9.336 1.7961 -5.0783 {"}'M' greentint -9.4746 1.6214 -5.209 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ILE 79 A}'M' green -9.6525 0.9813 -4.4243 {"}'M' green -9.5542 1.2062 -4.3583 {"}'M' green -9.4815 1.4472 -4.3328 {"}'M' green -9.3439 1.7761 -4.6095 {"}'M' green -9.7285 0.7529 -5.1391 {"}'M' green -9.3044 1.8375 -4.8924 {"}'M' green -9.3174 1.8214 -5.1629 {"}'M' green -9.6314 1.0609 -5.5482 {"}'M' green -9.3699 1.7074 -5.3898 {"}'M' green -9.5232 1.3588 -5.6085 @dotlist {x} color= red width= 1 master= {H-bonds} { O ILE 79 A}'M' greentint -9.656 0.8341 -4.7509 {"}'M' greentint -9.5314 1.0365 -4.6473 {"}'M' greentint -9.4349 1.2696 -4.5875 {"}'M' greentint -9.3712 1.5214 -4.5749 {"}'M' greentint -9.5818 0.9025 -4.9915 {"}'M' greentint -9.4581 1.1022 -4.8868 {"}'M' greentint -9.3663 1.3364 -4.8335 {"}'M' greentint -9.3143 1.5873 -4.8351 {"}'M' greentint -9.613 0.9307 -5.2969 {"}'M' greentint -9.4745 1.1013 -5.1653 {"}'M' greentint -9.3716 1.3247 -5.0945 {"}'M' greentint -9.3171 1.5745 -5.0942 {"}'M' greentint -9.4816 1.2146 -5.3974 {"}'M' greentint -9.3863 1.4509 -5.3399 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gln A 52 2i0qA_54F_122V}P -12.3805 -2.5851 0.1306 {"}-12.3805 -2.5851 0.1306 { ca gln A 52 2i0qA_54F_122V}-11.0253 -2.518 -0.3975 { c gln A 52 2i0qA_54F_122V}-10.8825 -1.3221 -1.3468 { o gln A 52 2i0qA_54F_122V}-11.8746 -0.7799 -1.8302 { c gln A 52 2i0qA_54F_122V}P -10.8825 -1.3221 -1.3468 { n his A 53 2i0qA_54F_122V}-9.6466 -0.8982 -1.5777 { ca his A 53 2i0qA_54F_122V}-9.3642 0.2442 -2.4351 { c his A 53 2i0qA_54F_122V}-8.3516 -0.1686 -3.4945 { o his A 53 2i0qA_54F_122V}-7.531 -1.0608 -3.2595 { c his A 53 2i0qA_54F_122V}P -8.3516 -0.1686 -3.4945 { n phe A 54 2i0qA_54F_122V}-8.392 0.4912 -4.6505 { ca phe A 54 2i0qA_54F_122V}-7.4622 0.1681 -5.7239 { c phe A 54 2i0qA_54F_122V}-7.3251 1.245 -6.794 { o phe A 54 2i0qA_54F_122V}-8.134 2.1692 -6.8802 { c phe A 54 2i0qA_54F_122V}P -7.3251 1.245 -6.794 { n tyr A 55 2i0qA_54F_122V}-6.2666 1.102 -7.584 { ca tyr A 55 2i0qA_54F_122V}-5.9818 1.9532 -8.7287 { c tyr A 55 2i0qA_54F_122V}-6.0765 0.9661 -9.8957 { o tyr A 55 2i0qA_54F_122V}-5.6603 -0.1887 -9.7604 { c tyr A 55 2i0qA_54F_122V}P -6.0765 0.9661 -9.8957 { n ala A 56 2i0qA_54F_122V}-6.6388 1.4043 -11.0206 { ca ala A 56 2i0qA_54F_122V}-6.7782 0.5476 -12.2015 { c ala A 56 2i0qA_54F_122V}-6.8906 1.3608 -13.4977 { o ala A 56 2i0qA_54F_122V}-7.1498 2.5695 -13.4648 { n ile A 120 2i0qA_54F_122V}P -8.5461 4.9834 -12.9646 {"}-8.5461 4.9834 -12.9646 { ca 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-1.8922 { n arg A 124 2i0qA_54F_122V}-13.3747 2.0831 -1.0224 { ca arg A 124 2i0qA_54F_122V}-14.4866 1.3224 -0.4631 { c arg A 124 2i0qA_54F_122V}-15.3294 0.4685 -1.4048 { o arg A 124 2i0qA_54F_122V}-16.5577 0.5779 -1.4253 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gln A 52 2i0qA_54F_122V}P -12.3805 -2.5851 0.1306 { ca gln A 52 2i0qA_54F_122V}P -11.0253 -2.518 -0.3975 { n his A 53 2i0qA_54F_122V}P -9.6466 -0.8982 -1.5777 { ca his A 53 2i0qA_54F_122V}P -9.3642 0.2442 -2.4351 { n phe A 54 2i0qA_54F_122V}P -8.392 0.4912 -4.6505 { ca phe A 54 2i0qA_54F_122V}P -7.4622 0.1681 -5.7239 { n tyr A 55 2i0qA_54F_122V}P -6.2666 1.102 -7.584 { ca tyr A 55 2i0qA_54F_122V}P -5.9818 1.9532 -8.7287 { n ala A 56 2i0qA_54F_122V}P -6.6388 1.4043 -11.0206 { ca ala A 56 2i0qA_54F_122V}P -6.7782 0.5476 -12.2015 { n ile A 120 2i0qA_54F_122V}P -8.5461 4.9834 -12.9646 { ca ile A 120 2i0qA_54F_122V}P -9.5471 5.2469 -11.9509 { n arg A 121 2i0qA_54F_122V}P -9.3663 5.525 -9.5423 { ca arg A 121 2i0qA_54F_122V}P -9.012 5.181 -8.1713 { n val A 122 2i0qA_54F_122V}P -10.5245 3.8734 -6.8026 { ca val A 122 2i0qA_54F_122V}P -11.7666 3.5967 -6.0943 { n his A 123 2i0qA_54F_122V}P -12.3646 3.943 -3.7865 { ca his A 123 2i0qA_54F_122V}P -12.3143 3.7962 -2.3411 { n arg A 124 2i0qA_54F_122V}P -13.3747 2.0831 -1.0224 { ca arg A 124 2i0qA_54F_122V}P -14.4866 1.3224 -0.4631 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca gln A 52 2i0qA_54F_122V}P -11.0253 -2.518 -0.3975 {"}-11.0253 -2.518 -0.3975 { ca his A 53 2i0qA_54F_122V}-9.3642 0.2442 -2.4351 { ca phe A 54 2i0qA_54F_122V}-7.4622 0.1681 -5.7239 { ca tyr A 55 2i0qA_54F_122V}-5.9818 1.9532 -8.7287 { ca ala A 56 2i0qA_54F_122V}-6.7782 0.5476 -12.2015 { ca ile A 120 2i0qA_54F_122V}P -9.5471 5.2469 -11.9509 {"}-9.5471 5.2469 -11.9509 { ca arg A 121 2i0qA_54F_122V}-9.012 5.181 -8.1713 { ca val A 122 2i0qA_54F_122V}-11.7666 3.5967 -6.0943 { ca his A 123 2i0qA_54F_122V}-12.3143 3.7962 -2.3411 { ca arg A 124 2i0qA_54F_122V}-14.4866 1.3224 -0.4631 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 54 2i0qA_54F_122V}P -7.4622 0.1681 -5.7239 { cb phe A 54 2i0qA_54F_122V}-7.8841 -1.1517 -6.4077 { cg phe A 54 2i0qA_54F_122V}-9.2352 -1.0919 -7.0872 { cd1 phe A 54 2i0qA_54F_122V}-9.3801 -0.4952 -8.3459 { ce1 phe A 54 2i0qA_54F_122V}-10.6274 -0.4269 -8.9641 { cz phe A 54 2i0qA_54F_122V}-11.7509 -0.9581 -8.3312 { cg phe A 54 2i0qA_54F_122V}P -9.2352 -1.0919 -7.0872 { cd2 phe A 54 2i0qA_54F_122V}-10.3588 -1.6173 -6.4695 { ce2 phe A 54 2i0qA_54F_122V}-11.6152 -1.5558 -7.0796 { cz phe A 54 2i0qA_54F_122V}ghost -11.7509 -0.9581 -8.3312 { ca val A 122 2i0qA_54F_122V}P -11.7666 3.5967 -6.0943 { cb val A 122 2i0qA_54F_122V}-12.516 2.3783 -6.6951 { cg1 val A 122 2i0qA_54F_122V}-13.768 2.0664 -5.8812 { cb val A 122 2i0qA_54F_122V}P -12.516 2.3783 -6.6951 { cg2 val A 122 2i0qA_54F_122V}-12.9152 2.658 -8.1539 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 54 2i0qA_54F_122V}P -7.8841 -1.1517 -6.4077 {"}P -7.8841 -1.1517 -6.4077 { cd1 phe A 54 2i0qA_54F_122V}P -9.3801 -0.4952 -8.3459 { cd2 phe A 54 2i0qA_54F_122V}P -10.3588 -1.6173 -6.4695 { ce1 phe A 54 2i0qA_54F_122V}P -10.6274 -0.4269 -8.9641 { ce2 phe A 54 2i0qA_54F_122V}P -11.6152 -1.5558 -7.0796 { cz phe A 54 2i0qA_54F_122V}P -11.7509 -0.9581 -8.3312 { cb val A 122 2i0qA_54F_122V}P -12.516 2.3783 -6.6951 { cg1 val A 122 2i0qA_54F_122V}P -13.768 2.0664 -5.8812 {"}P -13.768 2.0664 -5.8812 {"}P -13.768 2.0664 -5.8812 { cg2 val A 122 2i0qA_54F_122V}P -12.9152 2.658 -8.1539 {"}P -12.9152 2.658 -8.1539 {"}P -12.9152 2.658 -8.1539 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 54 A}'S' blue -11.4023 0.7126 -7.8857 {"}'S' blue -10.9847 0.5838 -7.5813 {"}'S' blue -11.0814 0.751 -7.7516 {"}'S' blue -11.2029 0.873 -7.9438 {"}'S' blue -11.4995 0.961 -8.3504 {"}'S' blue -11.6608 0.9232 -8.5486 {"}'S' blue -11.8193 0.8325 -8.7292 {"}'S' blue -11.4262 1.0893 -8.6093 {"}'S' blue -11.589 1.0266 -8.8022 { CE2 PHE 54 A}'S' sky -11.8483 0.0268 -6.3702 {"}'S' sky -11.9962 0.0766 -6.5752 {"}'S' sky -12.1521 0.0821 -6.7793 {"}'S' blue -12.3125 0.0459 -6.9766 {"}'S' sky -11.5752 0.0644 -6.4191 {"}'S' sky -11.379 0.1082 -6.5916 {"}'S' blue -11.1975 0.119 -6.7885 {"}'S' sky -11.3466 0.172 -6.9959 { CZ PHE 54 A}'S' sky -12.3264 0.3417 -7.3109 {"}'S' blue -12.4687 0.4121 -7.5129 {"}'S' blue -12.623 0.4298 -7.7176 {"}'S' blue -12.3886 0.573 -7.7734 {"}'S' blue -12.5497 0.558 -7.9765 {"}'S' blue -12.7125 0.4954 -8.1693 {"}'S' blue -12.8711 0.3864 -8.3441 {"}'S' blue -13.0204 0.2348 -8.4948 {"}'S' sky -12.1319 0.6743 -7.8268 {"}'S' sky -12.2878 0.6799 -8.0309 {"}'S' sky -12.4482 0.6437 -8.2281 {"}'S' sky -12.6089 0.5652 -8.4128 {"}'S' sky -12.764 0.4466 -8.5806 {"}'S' blue -12.9096 0.2924 -8.7256 {"}'S' sky -11.8534 0.728 -7.8735 {"}'S' blue -12.0053 0.7551 -8.0771 {"}'S' sky -12.1629 0.742 -8.2776 {"}'S' sky -12.3237 0.6894 -8.47 {"}'S' blue -12.481 0.5997 -8.6491 {"}'S' blue -12.6342 0.4742 -8.8111 {"}'S' sky -11.1616 0.3074 -7.2763 {"}'S' sky -11.2617 0.4738 -7.4511 {"}'S' sky -11.5147 0.7059 -7.8431 {"}'S' blue -11.8181 0.7897 -8.2581 {"}'S' blue -11.9797 0.7722 -8.463 {"}'S' blue -12.1436 0.7156 -8.6587 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 54 A}'S' sea -11.7176 0.1302 -6.622 {"}'S' sea -11.8695 0.1574 -6.8255 {"}'S' sea -11.5258 0.169 -6.7992 {"}'S' sea -11.6824 0.192 -7.0066 { CZ PHE 54 A}'S' sea -12.2049 0.2197 -7.1187 {"}'S' green -11.9735 0.3316 -7.1697 {"}'S' green -12.0957 0.4579 -7.3622 {"}'S' sea -12.2356 0.5388 -7.5651 {"}'S' sea -11.6334 0.2413 -7.0619 {"}'S' green -11.731 0.4052 -7.2345 {"}'S' green -11.8486 0.5343 -7.4229 {"}'S' green -11.984 0.6245 -7.6218 {"}'S' sea -11.377 0.2524 -7.1241 {"}'S' green -11.4703 0.4214 -7.2919 {"}'S' green -11.583 0.5591 -7.4757 {"}'S' sea -11.7109 0.6621 -7.6706 {"}'S' sea -11.3803 0.6075 -7.6421 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 122 A}'S' blue -12.6888 0.8645 -7.5565 {"}'S' blue -12.5596 0.7608 -7.3614 {"}'S' blue -12.4748 0.9412 -7.6933 {"}'S' sky -12.3478 0.8325 -7.4984 {"}'S' blue -12.2384 1.0238 -7.7684 {"}'S' blue -12 1.1299 -7.8068 { CG2 VAL 122 A}'S' blue -12.7628 0.9156 -8.117 {"}'S' blue -12.599 0.9536 -7.9172 {"}'S' sky -12.5078 0.9576 -8.2138 {"}'S' sky -12.3474 1.008 -8.0215 {"}'S' blue -12.1894 1.0965 -7.841 {"}'S' blue -12.4519 1.018 -8.5493 {"}'S' sky -12.2933 1.0341 -8.3482 {"}'S' sky -12.1319 1.093 -8.1564 {"}'S' blue -11.9739 1.1929 -7.9804 {"}'S' blue -12.2022 1.1278 -8.6158 {"}'S' blue -12.04 1.1657 -8.4165 {"}'S' blue -11.8787 1.2508 -8.2308 {"}'S' blue -11.9578 1.2835 -8.6608 {"}'S' blue -11.7965 1.35 -8.471 {"}'S' blue -11.6837 1.5133 -8.6412 { HB VAL 122 A}'S' sky -12.4232 0.6378 -7.1758 {"}'S' sky -12.3144 0.4972 -6.9967 {"}'S' sky -12.1837 0.4028 -6.8017 {"}'S' sky -12.0364 0.3611 -6.5994 {"}'S' sky -11.8808 0.3731 -6.4015 {"}'S' sky -12.2728 0.7586 -7.4472 {"}'S' sky -11.6206 0.3748 -6.4973 {"}'S' blue -11.4626 0.4606 -6.3163 {"}'S' sky -11.4583 0.407 -6.7066 {"}'S' blue -11.3006 0.483 -6.5237 {"}'S' sky -11.823 0.9757 -7.7041 {"}'S' sky -11.3642 0.489 -6.9744 {"}'S' blue -11.201 0.538 -6.7778 {"}'S' blue -11.5755 1.085 -7.7204 {"}'S' sky -11.2806 0.6459 -7.2173 {"}'S' blue -11.3307 1.1523 -7.6542 {"}'S' sky -11.2629 0.9439 -7.5088 {"}'S' blue -11.1295 0.8411 -7.3082 {HG21 VAL 122 A}'S' blue -13.2256 0.6485 -8.3981 {"}'S' blue -13.0676 0.7342 -8.2171 {"}'S' blue -12.9175 0.8701 -8.0617 {"}'S' blue -13.0633 0.6806 -8.6073 {"}'S' sky -12.9056 0.7566 -8.4245 {"}'S' blue -12.7552 0.888 -8.266 {"}'S' blue -12.9693 0.7626 -8.8752 {"}'S' sky -12.806 0.8116 -8.6786 {"}'S' sky -12.6488 0.93 -8.5078 {"}'S' blue -12.5732 1.0257 -8.7442 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 122 A}'S' sea -12.1851 0.5825 -7.2838 {"}'S' green -12.0689 0.4507 -7.0983 {"}'S' sea -11.9324 0.3694 -6.8983 {"}'S' sea -11.78 0.3444 -6.6945 {"}'S' sea -12.0658 0.8821 -7.6232 {"}'S' green -11.9947 0.6858 -7.4778 {"}'S' green -11.8922 0.533 -7.3028 {"}'S' green -11.7637 0.4322 -7.1076 {"}'S' sea -11.6164 0.3892 -6.905 {"}'S' green -11.7586 0.7668 -7.5614 {"}'S' green -11.6549 0.6081 -7.3835 {"}'S' green -11.52 0.5133 -7.1826 {"}'S' sea -11.5204 0.8737 -7.5918 {"}'S' sea -11.4178 0.721 -7.4167 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 54 A}'M' greentint -9.3061 2.5617 -6.2238 {"}'M' greentint -9.4497 2.4539 -6.4963 {"}'M' greentint -9.2074 2.8496 -6.2931 {"}'M' greentint -9.356 2.6926 -6.4416 {"}'M' greentint -9.4598 2.5963 -6.739 {"}'M' greentint -9.5163 2.3468 -6.7423 {"}'M' greentint -9.0582 3.0797 -6.3552 {"}'M' greentint -9.2168 2.9865 -6.5336 {"}'M' greentint -9.356 2.8186 -6.6668 {"}'M' greentint -9.4294 2.6903 -6.9838 {"}'M' greentint -9.5005 2.4452 -7.008 {"}'M' greentint -9.0314 3.2106 -6.6151 {"}'M' greentint -9.1862 3.0875 -6.7797 {"}'M' greentint -9.3219 2.91 -6.9059 {"}'M' greentint -9.3515 2.7705 -7.2221 {"}'M' greentint -9.4327 2.5273 -7.2605 {"}'M' greentint -8.9505 3.3066 -6.8528 {"}'M' greentint -9.1028 3.1707 -7.0128 {"}'M' greentint -9.2394 2.9891 -7.1376 {"}'M' greentint -9.237 2.8153 -7.4518 {"}'M' greentint -8.9956 3.2093 -7.2494 {"}'M' greentint -9.1264 3.0273 -7.3678 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 122 A}'M' greentint -9.3794 2.3474 -6.3519 {"}'M' greentint -9.2462 2.523 -6.2288 {"}'M' greentint -9.141 2.7377 -6.1511 {"}'M' greentint -9.479 2.2204 -6.8453 {"}'M' greentint -9.3184 2.2964 -6.6585 {"}'M' greentint -9.1688 2.4418 -6.5061 {"}'M' greentint -9.0443 2.6418 -6.4003 {"}'M' greentint -8.9557 2.8793 -6.3522 {"}'M' greentint -8.9112 3.1341 -6.3649 {"}'M' greentint -9.3853 2.3313 -7.098 {"}'M' greentint -9.223 2.3762 -6.9001 {"}'M' greentint -9.0688 2.5088 -6.7384 {"}'M' greentint -8.9445 2.7121 -6.6337 {"}'M' greentint -8.8662 2.9578 -6.6016 {"}'M' greentint -8.8453 3.2132 -6.6449 {"}'M' greentint -9.2743 2.5148 -7.2685 {"}'M' greentint -9.1133 2.5428 -7.0685 {"}'M' greentint -8.9653 2.6948 -6.9196 {"}'M' greentint -8.8705 2.9289 -6.8623 {"}'M' greentint -8.8542 3.1826 -6.9116 {"}'M' greentint -9.1408 2.7326 -7.322 {"}'M' greentint -8.9809 2.8295 -7.1426 {"}'M' greentint -8.9259 3.0828 -7.1423 {"}'M' greentint -9.0592 2.9792 -7.3418 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 54 A}'M' green -9.8153 1.3958 -4.2561 {"}'M' green -9.9485 1.2921 -4.4556 {"}'M' green -9.6294 1.4871 -4.0981 {"}'M' green -10.004 1.446 -4.7356 {"}'M' green -9.4684 1.7584 -4.1313 {"}'M' green -9.9757 1.5435 -4.9892 {"}'M' green -9.2768 1.9352 -4.1952 {"}'M' green -9.1632 2.1292 -4.4464 {"}'M' green -9.3148 2.1647 -4.6516 {"}'M' green -9.7714 1.8388 -5.1516 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 54 A}'M' greentint -9.7336 1.6423 -4.2759 {"}'M' greentint -9.8936 1.5454 -4.4553 {"}'M' greentint -9.6001 1.8602 -4.3294 {"}'M' greentint -9.7611 1.8321 -4.5294 {"}'M' greentint -9.9092 1.6802 -4.6783 {"}'M' greentint -9.4117 2.03 -4.3961 {"}'M' greentint -9.5706 2.0332 -4.602 {"}'M' greentint -9.7308 1.9421 -4.7849 {"}'M' greentint -9.8723 1.7716 -4.9204 {"}'M' greentint -9.4762 2.1256 -4.8495 {"}'M' greentint -9.6328 2.0135 -5.0208 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 122 A}'M' green -10.1506 1.4031 -4.7452 {"}'M' green -9.9935 1.3985 -4.5395 {"}'M' green -9.5277 1.7262 -4.0289 {"}'M' green -10.0671 1.5809 -5.0031 {"}'M' green -9.3298 1.9943 -4.1648 {"}'M' green -9.9388 1.7927 -5.1546 {"}'M' green -9.2432 2.2168 -4.3725 {"}'M' sea -9.7991 2.0272 -5.2291 {"}'M' sea -9.2579 2.3429 -4.6179 {"}'M' green -9.5535 2.1535 -5.0641 {"}'M' green -9.3948 2.2509 -4.8865 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 122 A}'M' greentint -9.8309 1.4542 -4.3454 {"}'M' greentint -9.673 1.5645 -4.1719 {"}'M' greentint -9.9191 1.5339 -4.7986 {"}'M' greentint -9.7599 1.5563 -4.5981 {"}'M' greentint -9.6002 1.6449 -4.4171 {"}'M' greentint -9.4535 1.7945 -4.2695 {"}'M' greentint -9.8005 1.7158 -4.9531 {"}'M' greentint -9.6416 1.7269 -4.7522 {"}'M' greentint -9.4846 1.8227 -4.5749 {"}'M' greentint -9.3461 1.9933 -4.4433 {"}'M' greentint -9.6662 1.9237 -5.0289 {"}'M' greentint -9.503 1.9529 -4.8262 {"}'M' greentint -9.3532 2.1066 -4.6754 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 116 2i9wA_118F_133}P -12.2139 -2.53 -0.2729 {"}-12.2139 -2.53 -0.2729 { ca val A 116 2i9wA_118F_133}-10.9598 -2.6554 -1.02 { c val A 116 2i9wA_118F_133}-10.7786 -1.3177 -1.739 { o val A 116 2i9wA_118F_133}-11.6595 -0.882 -2.5212 { c val A 116 2i9wA_118F_133}P -10.7786 -1.3177 -1.739 { n glu A 117 2i9wA_118F_133}-9.63 -0.6845 -1.4996 { ca glu A 117 2i9wA_118F_133}-9.2131 0.5515 -2.1757 { c glu A 117 2i9wA_118F_133}-8.1755 0.1199 -3.2052 { o glu A 117 2i9wA_118F_133}-7.2366 -0.6035 -2.8778 { c glu A 117 2i9wA_118F_133}P -8.1755 0.1199 -3.2052 { n phe A 118 2i9wA_118F_133}-8.3272 0.5775 -4.4347 { ca phe A 118 2i9wA_118F_133}-7.4171 0.1814 -5.4978 { c phe A 118 2i9wA_118F_133}-7.2987 1.2245 -6.6011 { o phe A 118 2i9wA_118F_133}-8.1183 2.1627 -6.6949 { c phe A 118 2i9wA_118F_133}P -7.2987 1.2245 -6.6011 { n lys A 119 2i9wA_118F_133}-6.2541 1.0929 -7.4092 { ca lys A 119 2i9wA_118F_133}-6.083 1.8868 -8.6041 { c lys A 119 2i9wA_118F_133}-6.0894 0.955 -9.7963 { o lys A 119 2i9wA_118F_133}-5.2913 0.0027 -9.8603 { c lys A 119 2i9wA_118F_133}P -6.0894 0.955 -9.7963 { n ala A 120 2i9wA_118F_133}-7.0096 1.2031 -10.709 { ca ala A 120 2i9wA_118F_133}-7.0702 0.4593 -11.9739 { c ala A 120 2i9wA_118F_133}-6.5121 1.3294 -13.0911 { o ala A 120 2i9wA_118F_133}-7.0474 2.4033 -13.3724 { n his A 131 2i9wA_118F_133}P -7.95 4.9046 -12.3642 {"}-7.95 4.9046 -12.3642 { ca his A 131 2i9wA_118F_133}-9.195 5.0598 -11.6183 { c his A 131 2i9wA_118F_133}-8.8922 4.7196 -10.1819 { o his A 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{"}'S' sky -12.3345 0.8421 -8.8716 {"}'S' sky -12.0268 1.0647 -8.5343 {"}'S' blue -12.3441 0.7416 -9.2873 {"}'S' sky -11.7375 1.0949 -8.6004 {"}'S' sky -12.0877 0.7249 -9.3825 {"}'S' sky -11.4862 1.1569 -8.7256 {"}'S' blue -11.9242 0.7697 -9.593 {"}'S' sky -11.766 0.7875 -9.3946 {"}'S' sky -11.3251 1.1739 -8.9313 {"}'S' blue -11.672 0.8695 -9.6624 {"}'S' sky -11.2124 1.2138 -9.1642 {"}'S' blue -11.4321 1.0372 -9.706 {"}'S' sky -11.2759 1.1326 -9.5315 {"}'S' blue -11.1388 1.3008 -9.4012 @dotlist {x} color= white width= 1 master= {vdw contact} { CB GLU 133 A}'S' sea -12.4994 0.7998 -7.5802 {"}'S' sea -12.3508 0.746 -7.3733 {"}'S' green -12.3787 0.8497 -7.8657 {"}'S' green -12.2366 0.7713 -7.6604 {"}'S' sea -12.2492 0.9583 -8.1442 {"}'S' green -12.1209 0.8547 -7.9485 {"}'S' sea -12.036 1.0351 -8.2804 {"}'S' green -11.9091 0.9264 -8.0855 {"}'S' sea -11.6684 1.0124 -8.1573 { HB2 GLU 133 A}'S' sea -12.1333 0.6936 -6.9735 {"}'S' green -11.986 0.6505 -6.7709 {"}'S' green -11.8287 0.6684 -6.5719 {"}'S' sea -11.6705 0.7452 -6.3886 {"}'S' green -12.0535 0.6297 -7.2617 {"}'S' green -11.9162 0.5482 -7.0622 {"}'S' green -11.4464 0.6394 -6.4803 {"}'S' sea -11.2971 0.7754 -6.3243 {"}'S' green -11.1474 0.6449 -6.5274 {"}'S' green -11.8509 0.8499 -7.9253 {"}'S' green -11.0407 0.5518 -6.7944 {"}'S' sea -10.8906 0.6877 -6.639 {"}'S' green -11.6439 0.9733 -8.1013 {"}'S' green -11.0364 0.4982 -7.1846 {"}'S' green -10.8787 0.5742 -7.0018 {"}'S' green -11.3367 0.8581 -8.0395 {"}'S' green -10.9423 0.5802 -7.4525 {"}'S' green -11.0985 0.9649 -8.0699 {"}'S' green -10.9959 0.8122 -7.8948 {"}'S' green -10.8587 0.7372 -7.6953 {"}'S' sea -10.7024 0.7479 -7.4961 {"}'S' sea -10.841 1.0351 -7.9869 {"}'S' sea -10.7076 0.9323 -7.7862 { HG3 GLU 133 A}'S' sea -12.1761 0.9287 -8.6902 {"}'S' sea -12.1886 0.7536 -9.0895 {"}'S' sea -12.03 0.8181 -8.9027 {"}'S' sea -11.877 0.9342 -8.7373 {"}'S' sea -11.9284 0.7554 -9.1853 {"}'S' sea -11.7704 0.8411 -9.0043 {"}'S' sea -11.6203 0.9769 -8.849 {"}'S' sea -11.6083 0.8635 -9.2117 {"}'S' sea -11.4579 0.9949 -9.0532 {"}'S' sea -11.5087 0.9185 -9.4658 {"}'S' sea -11.3515 1.0369 -9.2951 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB2 GLU 133 A}'S' P -11.7642 0.5224 -6.8589 {"}'S' -11.7549 0.5517 -6.8664 {"}'S' P -11.6048 0.5529 -6.6617 {"}'S' -11.6016 0.5707 -6.6698 {"}'S' P -12.0013 0.7291 -7.6539 {"}'S' -11.9938 0.7407 -7.648 {"}'S' P -11.8925 0.5884 -7.4748 {"}'S' -11.8683 0.64 -7.4569 {"}'S' P -11.7618 0.494 -7.2797 {"}'S' -11.7433 0.554 -7.2715 {"}'S' P -11.6145 0.4523 -7.0774 {"}'S' -11.6054 0.5062 -7.0807 {"}'S' P -11.459 0.4643 -6.8795 {"}'S' -11.4565 0.5222 -6.8928 {"}'S' P -11.3003 0.5288 -6.6928 {"}'S' -11.3027 0.5469 -6.7003 {"}'S' P -11.7632 0.6737 -7.7619 {"}'S' -11.7422 0.7297 -7.7254 {"}'S' P -11.647 0.542 -7.5764 {"}'S' -11.6266 0.6396 -7.5366 {"}'S' P -11.5105 0.4606 -7.3763 {"}'S' -11.5028 0.5576 -7.3572 {"}'S' P -11.3581 0.4356 -7.1726 {"}'S' -11.3603 0.4797 -7.172 {"}'S' P -11.1987 0.4661 -6.9754 {"}'S' -11.2047 0.4977 -6.9806 {"}'S' P -11.5729 0.777 -7.9559 {"}'S' -11.5687 0.8009 -7.9317 {"}'S' P -11.4703 0.6242 -7.7808 {"}'S' -11.4663 0.7004 -7.7312 {"}'S' P -11.3418 0.5235 -7.5857 {"}'S' -11.3478 0.6157 -7.5482 {"}'S' P -11.1946 0.4804 -7.3831 {"}'S' -11.2059 0.5385 -7.3708 {"}'S' P -11.233 0.6993 -7.8616 {"}'S' -11.2385 0.7291 -7.8382 {"}'S' P -11.0981 0.6045 -7.6607 {"}'S' -11.108 0.6384 -7.6427 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 118 A}'M' greentint -9.2904 2.5552 -6.0385 {"}'M' greentint -9.434 2.4474 -6.311 {"}'M' greentint -9.0285 2.8764 -5.9059 {"}'M' greentint -9.1917 2.843 -6.1078 {"}'M' greentint -9.3403 2.6861 -6.2562 {"}'M' greentint -9.444 2.5898 -6.5537 {"}'M' greentint -9.5006 2.3403 -6.557 {"}'M' greentint -8.8845 3.0816 -5.9679 {"}'M' greentint -9.0425 3.0732 -6.1699 {"}'M' greentint -9.2011 2.98 -6.3483 {"}'M' greentint -9.3403 2.8121 -6.4815 {"}'M' greentint -9.4136 2.6838 -6.7985 {"}'M' greentint -9.4848 2.4387 -6.8227 {"}'M' greentint -8.8555 3.2623 -6.2378 {"}'M' greentint -9.0157 3.2041 -6.4298 {"}'M' greentint -9.1705 3.081 -6.5944 {"}'M' greentint -9.3062 2.9034 -6.7206 {"}'M' greentint -9.3358 2.764 -7.0368 {"}'M' greentint -9.417 2.5208 -7.0752 {"}'M' greentint -8.7728 3.3823 -6.4819 {"}'M' greentint -8.9348 3.3001 -6.6675 {"}'M' greentint -9.0871 3.1642 -6.8275 {"}'M' greentint -9.2237 2.9826 -6.9523 {"}'M' greentint -9.2213 2.8088 -7.2664 {"}'M' greentint -8.6779 3.4451 -6.7408 {"}'M' greentint -8.8337 3.3464 -6.9142 {"}'M' greentint -8.9799 3.2028 -7.0641 {"}'M' greentint -9.1107 3.0208 -7.1825 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H GLU 133 A}'M' greentint -9.4599 2.3291 -6.5108 {"}'M' greentint -9.3017 2.3928 -6.3245 {"}'M' greentint -9.1515 2.5173 -6.1646 {"}'M' greentint -9.0183 2.6929 -6.0415 {"}'M' greentint -8.9131 2.9075 -5.9638 {"}'M' greentint -9.4093 2.3881 -6.8618 {"}'M' greentint -9.2511 2.3903 -6.658 {"}'M' greentint -9.0904 2.4663 -6.4712 {"}'M' greentint -8.9409 2.6117 -6.3188 {"}'M' greentint -8.8163 2.8116 -6.213 {"}'M' greentint -8.7278 3.0492 -6.1649 {"}'M' greentint -8.6832 3.304 -6.1776 {"}'M' greentint -9.3062 2.5508 -7.1168 {"}'M' greentint -9.1574 2.5012 -6.9107 {"}'M' greentint -8.9951 2.5461 -6.7128 {"}'M' greentint -8.8409 2.6787 -6.5511 {"}'M' greentint -8.7166 2.882 -6.4464 {"}'M' greentint -8.6383 3.1277 -6.4143 {"}'M' greentint -8.6173 3.3831 -6.4576 {"}'M' greentint -9.1782 2.7864 -7.2793 {"}'M' greentint -9.0464 2.6846 -7.0812 {"}'M' greentint -8.8854 2.7127 -6.8812 {"}'M' greentint -8.7374 2.8646 -6.7323 {"}'M' greentint -8.6426 3.0988 -6.675 {"}'M' greentint -8.6263 3.3525 -6.7243 {"}'M' greentint -8.9129 2.9025 -7.1347 {"}'M' greentint -8.753 2.9994 -6.9553 {"}'M' greentint -8.698 3.2527 -6.955 {"}'M' greentint -8.8313 3.149 -7.1545 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 118 A}'M' green -9.8307 1.3759 -4.112 {"}'M' green -9.4838 1.7385 -3.9872 {"}'M' green -10.0416 1.2689 -4.8406 {"}'M' green -9.3603 2.1321 -4.9421 {"}'M' green -9.6437 1.832 -5.225 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 118 A}'M' greentint -9.964 1.2722 -4.3115 {"}'M' greentint -9.7491 1.6224 -4.1319 {"}'M' greentint -9.909 1.5255 -4.3113 {"}'M' greentint -10.0194 1.4262 -4.5916 {"}'M' greentint -9.6156 1.8403 -4.1854 {"}'M' greentint -9.7766 1.8122 -4.3854 {"}'M' greentint -9.9246 1.6603 -4.5342 {"}'M' greentint -9.9912 1.5236 -4.8452 {"}'M' greentint -9.4272 2.0101 -4.252 {"}'M' greentint -9.586 2.0133 -4.4579 {"}'M' greentint -9.7463 1.9222 -4.6408 {"}'M' greentint -9.8877 1.7517 -4.7764 {"}'M' greentint -9.8943 1.5979 -5.0852 {"}'M' greentint -9.3303 2.1449 -4.5075 {"}'M' greentint -9.4916 2.1057 -4.7054 {"}'M' greentint -9.6482 1.9936 -4.8768 {"}'M' greentint -9.7868 1.8189 -5.0075 {"}'M' greentint -9.5105 2.0076 -5.1019 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLU 133 A}'M' green -9.9908 1.2497 -4.2865 {"}'M' green -9.6986 1.5323 -3.9877 {"}'M' green -9.2904 2.084 -4.2939 {"}'M' green -9.7187 1.7792 -5.2112 {"}'M' green -9.3105 2.1985 -4.8002 {"}'M' green -9.4473 2.1064 -5.0688 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLU 133 A}'M' greentint -9.839 1.3703 -4.1237 {"}'M' greentint -10.046 1.254 -4.7219 {"}'M' greentint -9.8834 1.3097 -4.5277 {"}'M' greentint -9.7255 1.42 -4.3542 {"}'M' greentint -9.5802 1.5817 -4.2113 {"}'M' greentint -9.4556 1.7841 -4.1077 {"}'M' greentint -9.9716 1.3894 -4.981 {"}'M' greentint -9.8124 1.4119 -4.7805 {"}'M' greentint -9.6527 1.5005 -4.5995 {"}'M' greentint -9.506 1.65 -4.4519 {"}'M' greentint -9.3823 1.8498 -4.3472 {"}'M' greentint -9.853 1.5714 -5.1354 {"}'M' greentint -9.6942 1.5824 -4.9346 {"}'M' greentint -9.5371 1.6783 -4.7572 {"}'M' greentint -9.3987 1.8488 -4.6257 {"}'M' greentint -9.2957 2.0723 -4.5548 {"}'M' greentint -9.5555 1.8084 -5.0086 {"}'M' greentint -9.4057 1.9622 -4.8578 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 85 2igxA_102F_87S}P -6.2465 5.7919 -11.4261 {"}-6.2465 5.7919 -11.4261 { ca phe A 85 2igxA_102F_87S}-6.8966 6.4829 -10.3363 { c phe A 85 2igxA_102F_87S}-7.4341 5.462 -9.3512 { o phe A 85 2igxA_102F_87S}-7.6957 4.3135 -9.7286 { c phe A 85 2igxA_102F_87S}P -7.4341 5.462 -9.3512 { n phe A 86 2igxA_102F_87S}-7.5776 5.8864 -8.1046 { ca phe A 86 2igxA_102F_87S}-8.1389 5.0188 -7.0589 { c phe A 86 2igxA_102F_87S}-9.6263 4.7672 -7.2657 { o phe A 86 2igxA_102F_87S}-10.3744 5.6565 -7.6879 { c phe A 86 2igxA_102F_87S}P -9.6263 4.7672 -7.2657 { n ser A 87 2igxA_102F_87S}-10.042 3.5348 -6.9818 { ca ser A 87 2igxA_102F_87S}-11.455 3.1742 -6.927 { c ser A 87 2igxA_102F_87S}-11.6403 2.2597 -5.7173 { o ser A 87 2igxA_102F_87S}-10.6664 1.6803 -5.2399 { c ser A 87 2igxA_102F_87S}P -11.6403 2.2597 -5.7173 { n lys A 88 2igxA_102F_87S}-12.8748 2.1487 -5.2244 { ca lys A 88 2igxA_102F_87S}-13.1926 1.1942 -4.1592 { c lys A 88 2igxA_102F_87S}-14.241 0.2058 -4.6437 { o lys A 88 2igxA_102F_87S}-15.2165 0.5982 -5.2429 { c lys A 88 2igxA_102F_87S}P -14.241 0.2058 -4.6437 { n asp A 89 2igxA_102F_87S}-14.0494 -1.0757 -4.3713 { ca asp A 89 2igxA_102F_87S}-15.0427 -2.0626 -4.7824 { c asp A 89 2igxA_102F_87S}-14.7694 -3.3409 -3.9993 { o asp A 89 2igxA_102F_87S}-13.7624 -3.4461 -3.3115 { n tyr A 100 2igxA_102F_87S}P -12.4347 -2.6856 -0.8639 {"}-12.4347 -2.6856 -0.8639 { ca tyr A 100 2igxA_102F_87S}-11.0073 -2.3475 -0.8032 { c tyr A 100 2igxA_102F_87S}-10.6318 -1.2588 -1.82 { o tyr A 100 2igxA_102F_87S}-11.2125 -1.1646 -2.8933 { c tyr A 100 2igxA_102F_87S}P -10.6318 -1.2588 -1.82 { n lys A 101 2igxA_102F_87S}-9.6683 -0.4129 -1.455 { ca lys A 101 2igxA_102F_87S}-9.2072 0.6656 -2.3219 { c lys A 101 2igxA_102F_87S}-8.0763 0.1724 -3.2132 { o lys A 101 2igxA_102F_87S}-7.0244 -0.2809 -2.7264 { c lys A 101 2igxA_102F_87S}P -8.0763 0.1724 -3.2132 { n phe A 102 2igxA_102F_87S}-8.2972 0.228 -4.5121 { ca phe A 102 2igxA_102F_87S}-7.3045 -0.2361 -5.4725 { c phe A 102 2igxA_102F_87S}-7.0606 0.7891 -6.5677 { o phe A 102 2igxA_102F_87S}-7.774 1.7988 -6.6744 { c phe A 102 2igxA_102F_87S}P -7.0606 0.7891 -6.5677 { n ile A 103 2igxA_102F_87S}-6.0248 0.5363 -7.3517 { ca ile A 103 2igxA_102F_87S}-5.6729 1.4266 -8.4581 { c ile A 103 2igxA_102F_87S}-6.2285 0.8685 -9.7497 { o ile A 103 2igxA_102F_87S}-5.8725 -0.2344 -10.2025 { c ile A 103 2igxA_102F_87S}P -6.2285 0.8685 -9.7497 { n glu A 104 2igxA_102F_87S}-7.1467 1.6335 -10.33 { ca glu A 104 2igxA_102F_87S}-7.7325 1.3082 -11.5981 { c glu A 104 2igxA_102F_87S}-6.8345 1.9213 -12.6861 { o glu A 104 2igxA_102F_87S}-6.6807 3.1451 -12.75 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 85 2igxA_102F_87S}P -6.2465 5.7919 -11.4261 { ca phe A 85 2igxA_102F_87S}P -6.8966 6.4829 -10.3363 { n phe A 86 2igxA_102F_87S}P -7.5776 5.8864 -8.1046 { ca phe A 86 2igxA_102F_87S}P -8.1389 5.0188 -7.0589 { n ser A 87 2igxA_102F_87S}P -10.042 3.5348 -6.9818 { ca ser A 87 2igxA_102F_87S}P -11.455 3.1742 -6.927 { n lys A 88 2igxA_102F_87S}P -12.8748 2.1487 -5.2244 { ca lys A 88 2igxA_102F_87S}P -13.1926 1.1942 -4.1592 { n asp A 89 2igxA_102F_87S}P -14.0494 -1.0757 -4.3713 { ca asp A 89 2igxA_102F_87S}P -15.0427 -2.0626 -4.7824 { n tyr A 100 2igxA_102F_87S}P -12.4347 -2.6856 -0.8639 { ca tyr A 100 2igxA_102F_87S}P -11.0073 -2.3475 -0.8032 { n lys A 101 2igxA_102F_87S}P -9.6683 -0.4129 -1.455 { ca lys A 101 2igxA_102F_87S}P -9.2072 0.6656 -2.3219 { n phe A 102 2igxA_102F_87S}P -8.2972 0.228 -4.5121 { ca phe A 102 2igxA_102F_87S}P -7.3045 -0.2361 -5.4725 { n ile A 103 2igxA_102F_87S}P -6.0248 0.5363 -7.3517 { ca ile A 103 2igxA_102F_87S}P -5.6729 1.4266 -8.4581 { n glu A 104 2igxA_102F_87S}P -7.1467 1.6335 -10.33 { ca glu A 104 2igxA_102F_87S}P -7.7325 1.3082 -11.5981 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 85 2igxA_102F_87S}P -6.8966 6.4829 -10.3363 {"}-6.8966 6.4829 -10.3363 { ca phe A 86 2igxA_102F_87S}-8.1389 5.0188 -7.0589 { ca ser A 87 2igxA_102F_87S}-11.455 3.1742 -6.927 { ca lys A 88 2igxA_102F_87S}-13.1926 1.1942 -4.1592 { ca asp A 89 2igxA_102F_87S}-15.0427 -2.0626 -4.7824 { ca tyr A 100 2igxA_102F_87S}P -11.0073 -2.3475 -0.8032 {"}-11.0073 -2.3475 -0.8032 { ca lys A 101 2igxA_102F_87S}-9.2072 0.6656 -2.3219 { ca phe A 102 2igxA_102F_87S}-7.3045 -0.2361 -5.4725 { ca ile A 103 2igxA_102F_87S}-5.6729 1.4266 -8.4581 { ca glu A 104 2igxA_102F_87S}-7.7325 1.3082 -11.5981 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser A 87 2igxA_102F_87S}P -11.455 3.1742 -6.927 { cb ser A 87 2igxA_102F_87S}-11.8547 2.4078 -8.1768 { og ser A 87 2igxA_102F_87S}-11.8156 3.219 -9.3389 { ca phe A 102 2igxA_102F_87S}P -7.3045 -0.2361 -5.4725 { cb phe A 102 2igxA_102F_87S}-7.6969 -1.5974 -6.0707 { cg phe A 102 2igxA_102F_87S}-9.0063 -1.5717 -6.8101 { cd1 phe A 102 2igxA_102F_87S}-10.1981 -1.7654 -6.1271 { ce1 phe A 102 2igxA_102F_87S}-11.4221 -1.7302 -6.8067 { cz phe A 102 2igxA_102F_87S}-11.4421 -1.4607 -8.1397 { cg phe A 102 2igxA_102F_87S}P -9.0063 -1.5717 -6.8101 { cd2 phe A 102 2igxA_102F_87S}-9.0457 -1.3148 -8.1819 { ce2 phe A 102 2igxA_102F_87S}-10.2714 -1.2615 -8.8578 { cz phe A 102 2igxA_102F_87S}ghost -11.4421 -1.4607 -8.1397 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser A 87 2igxA_102F_87S}P -11.8547 2.4078 -8.1768 {"}P -11.8547 2.4078 -8.1768 { og ser A 87 2igxA_102F_87S}P -11.8156 3.219 -9.3389 { cb phe A 102 2igxA_102F_87S}P -7.6969 -1.5974 -6.0707 {"}P -7.6969 -1.5974 -6.0707 { cd1 phe A 102 2igxA_102F_87S}P -10.1981 -1.7654 -6.1271 { cd2 phe A 102 2igxA_102F_87S}P -9.0457 -1.3148 -8.1819 { ce1 phe A 102 2igxA_102F_87S}P -11.4221 -1.7302 -6.8067 { ce2 phe A 102 2igxA_102F_87S}P -10.2714 -1.2615 -8.8578 { cz phe A 102 2igxA_102F_87S}P -11.4421 -1.4607 -8.1397 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 102 A}'S' blue -10.6163 0.1544 -7.8888 {"}'S' sky -11.1295 0.2618 -8.9394 {"}'S' blue -10.2315 0.3586 -8.1973 {"}'S' blue -11.0016 0.2963 -9.1758 {"}'S' sky -10.1821 0.4633 -8.5774 {"}'S' sky -10.3387 0.4863 -8.7848 {"}'S' sky -10.5003 0.4688 -8.9897 {"}'S' blue -10.6642 0.4121 -9.1853 { CZ PHE 102 A}'S' sky -11.5446 0.2253 -7.682 {"}'S' sky -11.6965 0.2525 -7.8856 {"}'S' sky -11.8542 0.2394 -8.0861 {"}'S' sky -11.206 0.2033 -7.6516 {"}'S' sky -11.8349 0.213 -8.4672 {"}'S' sky -11.6562 0.1966 -8.6602 {"}'S' sky -10.8157 0.1672 -8.0002 {"}'S' sky -11.4469 0.1546 -8.8122 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 102 A}'S' sea -10.7562 0.2354 -8.0917 {"}'S' green -10.9092 0.2696 -8.3001 {"}'S' green -11.0702 0.2546 -8.5031 {"}'S' sea -11.233 0.192 -8.6959 {"}'S' sea -10.5046 0.3211 -8.1484 {"}'S' green -10.6525 0.3709 -8.3534 {"}'S' green -10.8084 0.3764 -8.5575 {"}'S' green -10.9688 0.3402 -8.7548 {"}'S' sea -10.3739 0.4245 -8.4002 {"}'S' green -10.5258 0.4517 -8.6037 {"}'S' green -10.6835 0.4386 -8.8042 {"}'S' sea -10.8443 0.386 -8.9967 { CZ PHE 102 A}'S' sea -11.3528 0.2641 -7.8593 {"}'S' sea -11.5094 0.2871 -8.0666 {"}'S' sea -11.671 0.2696 -8.2715 {"}'S' sea -11.0245 0.2141 -7.8486 {"}'S' green -11.1736 0.2672 -8.0559 {"}'S' green -11.3305 0.2815 -8.2634 {"}'S' sea -11.4926 0.258 -8.4659 {"}'S' sea -10.9643 0.221 -8.2071 {"}'S' green -11.1219 0.2383 -8.4145 {"}'S' sea -11.2837 0.2153 -8.6184 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 87 A}'S' blue -11.9711 0.6653 -8.0594 { HB2 SER 87 A}'S' blue -11.8974 0.6371 -8.1402 {"}'S' sky -11.7501 0.5941 -7.9377 {"}'S' blue -11.5927 0.612 -7.7386 {"}'S' sky -11.8176 0.5732 -8.4284 {"}'S' blue -11.2105 0.583 -7.647 {"}'S' sky -11.6566 0.532 -8.6415 {"}'S' sky -11.4111 0.4855 -8.7431 {"}'S' sky -10.8048 0.4954 -7.9611 {"}'S' sky -11.2343 0.5678 -8.9475 {"}'S' blue -10.4923 0.6492 -8.01 {"}'S' sky -10.9971 0.6429 -9.0283 {"}'S' sky -10.3859 0.6912 -8.2519 {"}'S' sky -10.76 0.7558 -9.0615 {"}'S' sky -10.3104 0.7869 -8.4883 @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 SER 87 A}'S' sea -11.6802 0.4917 -8.2289 {"}'S' sea -11.5283 0.466 -8.0256 {"}'S' sea -11.3689 0.4964 -7.8284 {"}'S' sea -11.5259 0.4376 -8.4464 {"}'S' green -11.3785 0.3959 -8.2441 {"}'S' green -11.223 0.4079 -8.0463 {"}'S' sea -11.0644 0.4724 -7.8595 {"}'S' sea -11.2746 0.4042 -8.5431 {"}'S' green -11.1222 0.3792 -8.3393 {"}'S' sea -10.9628 0.4096 -8.1421 {"}'S' sea -11.1059 0.467 -8.7524 {"}'S' green -10.9586 0.424 -8.5498 {"}'S' green -10.8005 0.4418 -8.3514 {"}'S' sea -10.6427 0.5178 -8.1685 {"}'S' sea -10.8622 0.5481 -8.8274 {"}'S' green -10.7064 0.5238 -8.6192 {"}'S' sea -10.5431 0.5728 -8.4226 {"}'S' sea -10.6228 0.6807 -8.862 {"}'S' sea -10.4665 0.6915 -8.6628 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 102 A}'M' greentint -9.0897 2.0836 -6.2905 {"}'M' greentint -8.8474 2.4792 -6.0873 {"}'M' greentint -8.996 2.3223 -6.2358 {"}'M' greentint -9.0998 2.2259 -6.5333 {"}'M' greentint -9.1563 1.9764 -6.5365 {"}'M' greentint -8.6982 2.7093 -6.1495 {"}'M' greentint -8.8568 2.6162 -6.3279 {"}'M' greentint -8.996 2.4482 -6.461 {"}'M' greentint -9.0694 2.3199 -6.7781 {"}'M' greentint -9.1405 2.0748 -6.8023 {"}'M' greentint -9.1711 1.821 -6.7708 {"}'M' greentint -8.6714 2.8402 -6.4093 {"}'M' greentint -8.8262 2.7171 -6.574 {"}'M' greentint -8.9619 2.5396 -6.7001 {"}'M' greentint -8.9915 2.4001 -7.0163 {"}'M' greentint -9.0727 2.1569 -7.0547 {"}'M' greentint -9.1201 1.9026 -7.0443 {"}'M' greentint -8.5905 2.9362 -6.6471 {"}'M' greentint -8.7428 2.8003 -6.8071 {"}'M' greentint -8.8794 2.6187 -6.9319 {"}'M' greentint -8.877 2.4449 -7.246 {"}'M' greentint -8.9625 2.21 -7.2905 {"}'M' greentint -8.4894 2.9825 -6.8937 {"}'M' greentint -8.6356 2.8389 -7.0436 {"}'M' greentint -8.7664 2.657 -7.162 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 87 A}'M' greentint -9.1131 1.8519 -6.5602 {"}'M' greentint -8.9629 1.9764 -6.4003 {"}'M' greentint -8.8298 2.152 -6.2773 {"}'M' greentint -8.7245 2.3666 -6.1995 {"}'M' greentint -8.651 2.6064 -6.1726 {"}'M' greentint -9.0626 1.8494 -6.8938 {"}'M' greentint -8.9019 1.9254 -6.7069 {"}'M' greentint -8.7524 2.0708 -6.5545 {"}'M' greentint -8.6278 2.2707 -6.4487 {"}'M' greentint -8.5392 2.5083 -6.4006 {"}'M' greentint -8.4947 2.7631 -6.4133 {"}'M' greentint -8.9689 1.9603 -7.1464 {"}'M' greentint -8.8065 2.0052 -6.9485 {"}'M' greentint -8.6523 2.1378 -6.7868 {"}'M' greentint -8.5281 2.3411 -6.6822 {"}'M' greentint -8.4498 2.5868 -6.65 {"}'M' greentint -8.4288 2.8422 -6.6933 {"}'M' greentint -8.8579 2.1437 -7.3169 {"}'M' greentint -8.6969 2.1718 -7.1169 {"}'M' greentint -8.5488 2.3237 -6.968 {"}'M' greentint -8.454 2.5579 -6.9107 {"}'M' greentint -8.4377 2.8116 -6.96 {"}'M' greentint -8.7244 2.3616 -7.3704 {"}'M' greentint -8.5644 2.4585 -7.191 {"}'M' greentint -8.5094 2.7118 -7.1908 {"}'M' greentint -8.6427 2.6081 -7.3902 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 102 A}'M' greentint -9.9948 0.9001 -4.5181 {"}'M' greentint -10.1051 0.8007 -4.7984 {"}'M' greentint -10.1214 0.547 -4.7491 {"}'M' greentint -9.7013 1.2149 -4.3922 {"}'M' greentint -9.8623 1.1868 -4.5922 {"}'M' greentint -10.0103 1.0349 -4.741 {"}'M' greentint -10.0769 0.8982 -5.052 {"}'M' greentint -10.1273 0.6435 -5.0473 {"}'M' greentint -9.6718 1.3879 -4.6647 {"}'M' greentint -9.832 1.2968 -4.8476 {"}'M' greentint -9.9734 1.1263 -4.9832 {"}'M' greentint -9.98 0.9725 -5.292 {"}'M' greentint -10.0483 0.7235 -5.3097 {"}'M' greentint -10.0688 0.4702 -5.2662 {"}'M' greentint -9.416 1.5194 -4.7143 {"}'M' greentint -9.5773 1.4803 -4.9122 {"}'M' greentint -9.7339 1.3682 -5.0836 {"}'M' greentint -9.8725 1.1935 -5.2143 {"}'M' greentint -9.8346 0.992 -5.5096 {"}'M' greentint -9.9081 0.7522 -5.5365 {"}'M' greentint -9.446 1.5067 -5.1489 {"}'M' greentint -9.5963 1.3822 -5.3087 {"}'M' greentint -9.7294 1.2066 -5.4318 {"}'M' greentint -9.645 0.978 -5.688 {"}'M' greentint -9.4051 1.3641 -5.4859 {"}'M' greentint -9.5373 1.1901 -5.6081 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 87 A}'M' greentint -10.0277 0.5424 -4.7326 {"}'M' greentint -9.888 0.7097 -4.5988 {"}'M' greentint -9.7655 0.9099 -4.4959 {"}'M' greentint -9.6647 1.135 -4.4282 {"}'M' greentint -10.0329 0.4381 -5.1107 {"}'M' greentint -9.8811 0.5587 -4.9479 {"}'M' greentint -9.7408 0.7207 -4.8118 {"}'M' greentint -9.6188 0.9173 -4.7089 {"}'M' greentint -9.5205 1.1422 -4.6428 {"}'M' greentint -9.4478 1.3832 -4.6173 {"}'M' greentint -9.9255 0.4981 -5.3519 {"}'M' greentint -9.7677 0.6084 -5.1784 {"}'M' greentint -9.6223 0.7701 -5.0355 {"}'M' greentint -9.4977 0.9725 -4.9319 {"}'M' greentint -9.4013 1.2056 -4.872 {"}'M' greentint -9.3375 1.4574 -4.8594 {"}'M' greentint -9.8546 0.6003 -5.6046 {"}'M' greentint -9.6949 0.6888 -5.4236 {"}'M' greentint -9.5481 0.8384 -5.2761 {"}'M' greentint -9.4244 1.0382 -5.1714 {"}'M' greentint -9.3326 1.2724 -5.1181 {"}'M' greentint -9.2806 1.5232 -5.1197 {"}'M' greentint -9.5793 0.8667 -5.5814 {"}'M' greentint -9.4408 1.0372 -5.4499 {"}'M' greentint -9.3379 1.2607 -5.379 {"}'M' greentint -9.4479 1.1506 -5.6819 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 86 2ikoA_103F_88S}P -5.8546 5.6732 -11.3197 {"}-5.8546 5.6732 -11.3197 { ca phe A 86 2ikoA_103F_88S}-6.6322 6.3676 -10.3075 { c phe A 86 2ikoA_103F_88S}-7.2533 5.3865 -9.3227 { o phe A 86 2ikoA_103F_88S}-7.4297 4.1897 -9.6153 { c phe A 86 2ikoA_103F_88S}P -7.2533 5.3865 -9.3227 { n leu A 87 2ikoA_103F_88S}-7.6034 5.9101 -8.1589 { ca leu A 87 2ikoA_103F_88S}-8.144 5.0957 -7.0714 { c leu A 87 2ikoA_103F_88S}-9.6425 4.8168 -7.2188 { o leu A 87 2ikoA_103F_88S}-10.4344 5.689 -7.5895 { c leu A 87 2ikoA_103F_88S}P -9.6425 4.8168 -7.2188 { n ser A 88 2ikoA_103F_88S}-10.0273 3.5966 -6.8698 { ca ser A 88 2ikoA_103F_88S}-11.4244 3.2041 -6.8289 { c ser A 88 2ikoA_103F_88S}-11.6261 2.3186 -5.6207 { o ser A 88 2ikoA_103F_88S}-10.6687 1.8642 -5.0287 { c ser A 88 2ikoA_103F_88S}P -11.6261 2.3186 -5.6207 { n gln A 89 2ikoA_103F_88S}-12.8786 2.1175 -5.2378 { ca gln A 89 2ikoA_103F_88S}-13.2124 1.1802 -4.183 { c gln A 89 2ikoA_103F_88S}-14.2383 0.1934 -4.7243 { o gln A 89 2ikoA_103F_88S}-15.13 0.5654 -5.4948 { c gln A 89 2ikoA_103F_88S}P -14.2383 0.1934 -4.7243 { n asp A 90 2ikoA_103F_88S}-14.1021 -1.0663 -4.3292 { ca asp A 90 2ikoA_103F_88S}-15.1102 -2.073 -4.6228 { c asp A 90 2ikoA_103F_88S}-14.9052 -3.2556 -3.69 { o asp A 90 2ikoA_103F_88S}-14.0044 -3.2444 -2.856 { n gln A 101 2ikoA_103F_88S}P -12.3033 -2.7081 -0.4484 {"}-12.3033 -2.7081 -0.4484 { ca gln A 101 2ikoA_103F_88S}-10.8961 -2.3687 -0.6737 { c gln A 101 2ikoA_103F_88S}-10.7372 -1.2439 -1.677 { o gln A 101 2ikoA_103F_88S}-11.4347 -1.2085 -2.6983 { c gln A 101 2ikoA_103F_88S}P -10.7372 -1.2439 -1.677 { n met A 102 2ikoA_103F_88S}-9.7988 -0.3419 -1.4035 { ca met A 102 2ikoA_103F_88S}-9.4105 0.6591 -2.3795 { c met A 102 2ikoA_103F_88S}-8.2533 0.1395 -3.2049 { o met A 102 2ikoA_103F_88S}-7.3134 -0.4447 -2.6739 { c met A 102 2ikoA_103F_88S}P -8.2533 0.1395 -3.2049 { n phe A 103 2ikoA_103F_88S}-8.3432 0.3434 -4.5107 { ca phe A 103 2ikoA_103F_88S}-7.3502 -0.2034 -5.4245 { c phe A 103 2ikoA_103F_88S}-7.1592 0.7521 -6.5727 { o phe A 103 2ikoA_103F_88S}-7.97 1.6697 -6.7898 { c phe A 103 2ikoA_103F_88S}P -7.1592 0.7521 -6.5727 { n gly A 104 2ikoA_103F_88S}-6.0684 0.5543 -7.2974 { ca gly A 104 2ikoA_103F_88S}-5.766 1.3602 -8.4659 { c gly A 104 2ikoA_103F_88S}-6.3946 0.7985 -9.7265 { o gly A 104 2ikoA_103F_88S}-6.2657 -0.3912 -10.0103 { c gly A 104 2ikoA_103F_88S}P -6.3946 0.7985 -9.7265 { n glu A 105 2ikoA_103F_88S}-7.1239 1.6397 -10.4541 { ca glu A 105 2ikoA_103F_88S}-7.5322 1.34 -11.8066 { c glu A 105 2ikoA_103F_88S}-6.4431 1.917 -12.7175 { o glu A 105 2ikoA_103F_88S}-6.3059 3.143 -12.8524 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 86 2ikoA_103F_88S}P -5.8546 5.6732 -11.3197 { ca phe A 86 2ikoA_103F_88S}P -6.6322 6.3676 -10.3075 { n leu A 87 2ikoA_103F_88S}P -7.6034 5.9101 -8.1589 { ca leu A 87 2ikoA_103F_88S}P -8.144 5.0957 -7.0714 { n ser A 88 2ikoA_103F_88S}P -10.0273 3.5966 -6.8698 { ca ser A 88 2ikoA_103F_88S}P -11.4244 3.2041 -6.8289 { n gln A 89 2ikoA_103F_88S}P -12.8786 2.1175 -5.2378 { ca gln A 89 2ikoA_103F_88S}P -13.2124 1.1802 -4.183 { n asp A 90 2ikoA_103F_88S}P -14.1021 -1.0663 -4.3292 { ca asp A 90 2ikoA_103F_88S}P -15.1102 -2.073 -4.6228 { n gln A 101 2ikoA_103F_88S}P -12.3033 -2.7081 -0.4484 { ca gln A 101 2ikoA_103F_88S}P -10.8961 -2.3687 -0.6737 { n met A 102 2ikoA_103F_88S}P -9.7988 -0.3419 -1.4035 { ca met A 102 2ikoA_103F_88S}P -9.4105 0.6591 -2.3795 { n phe A 103 2ikoA_103F_88S}P -8.3432 0.3434 -4.5107 { ca phe A 103 2ikoA_103F_88S}P -7.3502 -0.2034 -5.4245 { n gly A 104 2ikoA_103F_88S}P -6.0684 0.5543 -7.2974 { ca gly A 104 2ikoA_103F_88S}P -5.766 1.3602 -8.4659 {"}P -5.766 1.3602 -8.4659 { n glu A 105 2ikoA_103F_88S}P -7.1239 1.6397 -10.4541 { ca glu A 105 2ikoA_103F_88S}P -7.5322 1.34 -11.8066 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 86 2ikoA_103F_88S}P -6.6322 6.3676 -10.3075 {"}-6.6322 6.3676 -10.3075 { ca leu A 87 2ikoA_103F_88S}-8.144 5.0957 -7.0714 { ca ser A 88 2ikoA_103F_88S}-11.4244 3.2041 -6.8289 { ca gln A 89 2ikoA_103F_88S}-13.2124 1.1802 -4.183 { ca asp A 90 2ikoA_103F_88S}-15.1102 -2.073 -4.6228 { ca gln A 101 2ikoA_103F_88S}P -10.8961 -2.3687 -0.6737 {"}-10.8961 -2.3687 -0.6737 { ca met A 102 2ikoA_103F_88S}-9.4105 0.6591 -2.3795 { ca phe A 103 2ikoA_103F_88S}-7.3502 -0.2034 -5.4245 { ca gly A 104 2ikoA_103F_88S}-5.766 1.3602 -8.4659 { ca glu A 105 2ikoA_103F_88S}-7.5322 1.34 -11.8066 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca ser A 88 2ikoA_103F_88S}P -11.4244 3.2041 -6.8289 { cb ser A 88 2ikoA_103F_88S}-11.8102 2.4649 -8.0966 { og ser A 88 2ikoA_103F_88S}-11.8106 3.3343 -9.2149 { ca phe A 103 2ikoA_103F_88S}P -7.3502 -0.2034 -5.4245 { cb phe A 103 2ikoA_103F_88S}-7.7795 -1.6067 -5.9114 { cg phe A 103 2ikoA_103F_88S}-9.0427 -1.603 -6.745 { cd1 phe A 103 2ikoA_103F_88S}-10.2883 -1.6061 -6.1398 { ce1 phe A 103 2ikoA_103F_88S}-11.4515 -1.5784 -6.9037 { cz phe A 103 2ikoA_103F_88S}-11.3691 -1.5608 -8.2698 { cg phe A 103 2ikoA_103F_88S}P -9.0427 -1.603 -6.745 { cd2 phe A 103 2ikoA_103F_88S}-8.9782 -1.5967 -8.1279 { ce2 phe A 103 2ikoA_103F_88S}-10.1258 -1.5679 -8.8913 { cz phe A 103 2ikoA_103F_88S}ghost -11.3691 -1.5608 -8.2698 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb ser A 88 2ikoA_103F_88S}P -11.8102 2.4649 -8.0966 {"}P -11.8102 2.4649 -8.0966 { og ser A 88 2ikoA_103F_88S}P -11.8106 3.3343 -9.2149 { cb phe A 103 2ikoA_103F_88S}P -7.7795 -1.6067 -5.9114 {"}P -7.7795 -1.6067 -5.9114 { cd1 phe A 103 2ikoA_103F_88S}P -10.2883 -1.6061 -6.1398 { cd2 phe A 103 2ikoA_103F_88S}P -8.9782 -1.5967 -8.1279 { ce1 phe A 103 2ikoA_103F_88S}P -11.4515 -1.5784 -6.9037 { ce2 phe A 103 2ikoA_103F_88S}P -10.1258 -1.5679 -8.8913 { cz phe A 103 2ikoA_103F_88S}P -11.3691 -1.5608 -8.2698 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 103 A}'S' blue -10.6628 0.07 -8.591 { CZ PHE 103 A}'S' blue -11.6234 0.1524 -8.0157 {"}'S' blue -11.1329 0.1032 -7.7818 {"}'S' sky -11.2797 0.164 -7.9894 {"}'S' sky -11.4363 0.187 -8.1968 {"}'S' blue -11.5979 0.1695 -8.4017 {"}'S' blue -10.9514 0.114 -7.9787 {"}'S' sky -11.1005 0.167 -8.1861 {"}'S' sky -11.2574 0.1814 -8.3935 {"}'S' blue -11.4195 0.1579 -8.5961 {"}'S' blue -10.8912 0.1209 -8.3373 {"}'S' blue -11.0489 0.1382 -8.5447 {"}'S' blue -11.2106 0.1152 -8.7485 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { HB2 SER 88 A}'S' blue -11.6058 0.5822 -8.1922 {"}'S' blue -11.4538 0.5564 -7.9889 {"}'S' sky -11.4514 0.528 -8.4097 {"}'S' sky -11.3041 0.4864 -8.2074 {"}'S' sky -11.1485 0.4983 -8.0095 {"}'S' blue -11.3366 0.576 -8.7064 {"}'S' sky -11.2001 0.4946 -8.5063 {"}'S' sky -11.0477 0.4696 -8.3026 {"}'S' blue -10.8883 0.5001 -8.1054 {"}'S' blue -11.0314 0.5575 -8.7157 {"}'S' blue -10.8841 0.5144 -8.5131 {"}'S' blue -10.726 0.5322 -8.3146 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 103 A}'M' greentint -9.1421 2.0622 -6.1334 {"}'M' greentint -9.2857 1.9544 -6.4059 {"}'M' greentint -8.8802 2.3834 -6.0008 {"}'M' greentint -9.0434 2.35 -6.2027 {"}'M' greentint -9.192 2.1931 -6.3511 {"}'M' greentint -9.2957 2.0968 -6.6486 {"}'M' greentint -8.7362 2.5886 -6.0628 {"}'M' greentint -8.8942 2.5802 -6.2648 {"}'M' greentint -9.0528 2.487 -6.4432 {"}'M' greentint -9.192 2.3191 -6.5764 {"}'M' greentint -9.2653 2.1908 -6.8934 {"}'M' greentint -9.3365 1.9457 -6.9176 {"}'M' greentint -8.5511 2.7586 -6.1288 {"}'M' greentint -8.7072 2.7693 -6.3327 {"}'M' greentint -8.8674 2.7111 -6.5247 {"}'M' greentint -9.0222 2.588 -6.6893 {"}'M' greentint -9.1579 2.4105 -6.8155 {"}'M' greentint -9.1875 2.271 -7.1317 {"}'M' greentint -8.464 2.9127 -6.3747 {"}'M' greentint -8.6245 2.8893 -6.5768 {"}'M' greentint -8.7865 2.8071 -6.7624 {"}'M' greentint -8.9388 2.6712 -6.9224 {"}'M' greentint -9.0754 2.4896 -7.0472 {"}'M' greentint -9.073 2.3158 -7.3613 {"}'M' greentint -8.5296 2.9521 -6.8357 {"}'M' greentint -8.6854 2.8534 -7.0091 {"}'M' greentint -8.8316 2.7098 -7.159 {"}'M' greentint -8.9624 2.5278 -7.2774 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H SER 88 A}'M' greentint -9.2411 1.8813 -6.5727 {"}'M' greentint -9.0829 1.945 -6.3864 {"}'M' greentint -8.9327 2.0695 -6.2265 {"}'M' greentint -8.7996 2.2451 -6.1034 {"}'M' greentint -8.6943 2.4597 -6.0257 {"}'M' greentint -9.1905 1.9403 -6.9237 {"}'M' greentint -9.0324 1.9425 -6.7199 {"}'M' greentint -8.8717 2.0185 -6.5331 {"}'M' greentint -8.7222 2.1639 -6.3807 {"}'M' greentint -8.5976 2.3638 -6.2748 {"}'M' greentint -8.509 2.6014 -6.2268 {"}'M' greentint -8.4645 2.8562 -6.2395 {"}'M' greentint -9.0874 2.103 -7.1787 {"}'M' greentint -8.9387 2.0534 -6.9726 {"}'M' greentint -8.7763 2.0983 -6.7747 {"}'M' greentint -8.6221 2.2309 -6.613 {"}'M' greentint -8.4979 2.4342 -6.5083 {"}'M' greentint -8.4196 2.6799 -6.4762 {"}'M' greentint -8.3986 2.9353 -6.5195 {"}'M' greentint -8.9594 2.3386 -7.3412 {"}'M' greentint -8.8277 2.2369 -7.1431 {"}'M' greentint -8.6667 2.2649 -6.9431 {"}'M' greentint -8.5186 2.4169 -6.7942 {"}'M' greentint -8.4238 2.651 -6.7369 {"}'M' greentint -8.4075 2.9047 -6.7862 {"}'M' greentint -8.7984 2.6099 -7.3744 {"}'M' greentint -8.6942 2.4547 -7.1966 {"}'M' greentint -8.5342 2.5516 -7.0172 {"}'M' greentint -8.4792 2.8049 -7.0169 {"}'M' greentint -8.6125 2.7013 -7.2164 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 103 A}'M' greentint -9.8524 1.0364 -4.3462 {"}'M' greentint -9.9857 0.9328 -4.5457 {"}'M' greentint -9.7708 1.283 -4.366 {"}'M' greentint -9.9307 1.1861 -4.5454 {"}'M' greentint -10.0411 1.0867 -4.8257 {"}'M' greentint -10.0574 0.833 -4.7764 {"}'M' greentint -9.6373 1.5008 -4.4195 {"}'M' greentint -9.7983 1.4728 -4.6195 {"}'M' greentint -9.9463 1.3208 -4.7684 {"}'M' greentint -10.0129 1.1842 -5.0793 {"}'M' greentint -10.0633 0.9295 -5.0747 {"}'M' greentint -10.0546 0.6817 -4.9943 {"}'M' greentint -9.4489 1.6707 -4.4862 {"}'M' greentint -9.6077 1.6739 -4.6921 {"}'M' greentint -9.768 1.5828 -4.875 {"}'M' greentint -9.9094 1.4123 -5.0105 {"}'M' greentint -9.916 1.2584 -5.3193 {"}'M' greentint -9.9843 1.0094 -5.337 {"}'M' greentint -10.0048 0.7562 -5.2935 {"}'M' greentint -9.352 1.8054 -4.7417 {"}'M' greentint -9.5133 1.7663 -4.9395 {"}'M' greentint -9.6699 1.6542 -5.1109 {"}'M' greentint -9.8085 1.4795 -5.2417 {"}'M' greentint -9.7706 1.278 -5.5369 {"}'M' greentint -9.8441 1.0382 -5.5638 {"}'M' greentint -9.382 1.7926 -5.1762 {"}'M' greentint -9.5322 1.6682 -5.3361 {"}'M' greentint -9.6654 1.4926 -5.4592 {"}'M' greentint -9.4733 1.4761 -5.6354 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O SER 88 A}'M' greentint -9.8904 0.8937 -4.3876 {"}'M' greentint -9.7679 1.0938 -4.2847 {"}'M' greentint -10.0352 0.622 -4.8996 {"}'M' greentint -9.8834 0.7426 -4.7367 {"}'M' greentint -9.7431 0.9046 -4.6007 {"}'M' greentint -9.6212 1.1012 -4.4977 {"}'M' greentint -9.5228 1.3261 -4.4317 {"}'M' greentint -9.4501 1.5671 -4.4061 {"}'M' greentint -9.9279 0.682 -5.1407 {"}'M' greentint -9.77 0.7923 -4.9673 {"}'M' greentint -9.6247 0.954 -4.8243 {"}'M' greentint -9.5001 1.1564 -4.7207 {"}'M' greentint -9.4036 1.3895 -4.6609 {"}'M' greentint -9.3398 1.6413 -4.6483 {"}'M' greentint -9.8569 0.7842 -5.3935 {"}'M' greentint -9.6972 0.8728 -5.2125 {"}'M' greentint -9.5505 1.0223 -5.0649 {"}'M' greentint -9.4268 1.2221 -4.9602 {"}'M' greentint -9.3349 1.4563 -4.9069 {"}'M' greentint -9.2829 1.7071 -4.9085 {"}'M' greentint -9.7386 0.9547 -5.5476 {"}'M' greentint -9.5816 1.0506 -5.3702 {"}'M' greentint -9.4431 1.2211 -5.2387 {"}'M' greentint -9.3402 1.4446 -5.1678 {"}'M' greentint -9.2858 1.6943 -5.1675 {"}'M' greentint -9.6 1.1807 -5.6216 {"}'M' greentint -9.4502 1.3345 -5.4708 {"}'M' greentint -9.3549 1.5708 -5.4133 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ile A 6 2ikoA_16Y_8T}P -5.5807 7.452 -9.2187 {"}-5.5807 7.452 -9.2187 { ca ile A 6 2ikoA_16Y_8T}-6.8752 7.5934 -8.5646 { c ile A 6 2ikoA_16Y_8T}-7.3302 6.2157 -8.0842 { o ile A 6 2ikoA_16Y_8T}-7.2399 5.2238 -8.8212 { c ile A 6 2ikoA_16Y_8T}P -7.3302 6.2157 -8.0842 { n leu A 7 2ikoA_16Y_8T}-7.7976 6.1501 -6.8404 { ca leu A 7 2ikoA_16Y_8T}-8.281 4.9121 -6.2649 { c leu A 7 2ikoA_16Y_8T}-9.7888 4.9405 -6.0749 { o leu A 7 2ikoA_16Y_8T}-10.3919 5.9898 -5.833 { c leu A 7 2ikoA_16Y_8T}P -9.7888 4.9405 -6.0749 { n thr A 8 2ikoA_16Y_8T}-10.3804 3.7614 -6.1956 { ca thr A 8 2ikoA_16Y_8T}-11.7778 3.5267 -5.8834 { c thr A 8 2ikoA_16Y_8T}-11.8664 2.9359 -4.477 { o thr A 8 2ikoA_16Y_8T}-11.0468 2.1068 -4.0834 { c thr A 8 2ikoA_16Y_8T}P -11.8664 2.9359 -4.477 { n asn A 9 2ikoA_16Y_8T}-12.851 3.3988 -3.7239 { ca asn A 9 2ikoA_16Y_8T}-13.1281 2.9327 -2.3797 { c asn A 9 2ikoA_16Y_8T}-14.3735 2.0426 -2.4193 { o asn A 9 2ikoA_16Y_8T}-15.4982 2.5395 -2.5832 { c asn A 9 2ikoA_16Y_8T}P -14.3735 2.0426 -2.4193 { n tyr A 10 2ikoA_16Y_8T}-14.1543 0.7427 -2.2588 { ca tyr A 10 2ikoA_16Y_8T}-15.2442 -0.219 -2.1243 { c tyr A 10 2ikoA_16Y_8T}-15.5424 -0.5012 -0.6406 { o tyr A 10 2ikoA_16Y_8T}-14.7725 -1.1625 0.0431 { n gln A 14 2ikoA_16Y_8T}P -11.8172 -2.1464 0.5577 {"}-11.8172 -2.1464 0.5577 { ca gln A 14 2ikoA_16Y_8T}-10.9287 -2.396 -0.5753 { c gln A 14 2ikoA_16Y_8T}-10.6983 -1.0954 -1.3193 { o gln A 14 2ikoA_16Y_8T}-11.6502 -0.4579 -1.7372 { c gln A 14 2ikoA_16Y_8T}P -10.6983 -1.0954 -1.3193 { n tyr A 15 2ikoA_16Y_8T}-9.4366 -0.6974 -1.4545 { ca tyr A 15 2ikoA_16Y_8T}-9.0857 0.4968 -2.1907 { c tyr A 15 2ikoA_16Y_8T}-8.1853 0.0827 -3.3349 { o tyr A 15 2ikoA_16Y_8T}-7.1322 -0.5119 -3.1201 { c tyr A 15 2ikoA_16Y_8T}P -8.1853 0.0827 -3.3349 { n tyr A 16 2ikoA_16Y_8T}-8.5968 0.3849 -4.5507 { ca tyr A 16 2ikoA_16Y_8T}-7.8569 -0.1043 -5.7056 { c tyr A 16 2ikoA_16Y_8T}-7.8439 0.9016 -6.8318 { o tyr A 16 2ikoA_16Y_8T}-8.7114 1.7641 -6.9259 { c tyr A 16 2ikoA_16Y_8T}P -7.8439 0.9016 -6.8318 { n gly A 17 2ikoA_16Y_8T}-6.8231 0.7969 -7.6649 { ca gly A 17 2ikoA_16Y_8T}-6.6547 1.6693 -8.8027 { c gly A 17 2ikoA_16Y_8T}-6.4074 0.8194 -10.0257 { o gly A 17 2ikoA_16Y_8T}-6.3881 -0.4152 -9.9465 { c gly A 17 2ikoA_16Y_8T}P -6.4074 0.8194 -10.0257 { n glu A 18 2ikoA_16Y_8T}-6.2228 1.4844 -11.1538 { ca glu A 18 2ikoA_16Y_8T}-6.0769 0.7993 -12.4232 { c glu A 18 2ikoA_16Y_8T}-4.6229 0.7772 -12.8403 { o glu A 18 2ikoA_16Y_8T}-3.9068 1.7583 -12.6665 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 6 2ikoA_16Y_8T}P -5.5807 7.452 -9.2187 { ca ile A 6 2ikoA_16Y_8T}P -6.8752 7.5934 -8.5646 { n leu A 7 2ikoA_16Y_8T}P -7.7976 6.1501 -6.8404 { ca leu A 7 2ikoA_16Y_8T}P -8.281 4.9121 -6.2649 { n thr A 8 2ikoA_16Y_8T}P -10.3804 3.7614 -6.1956 { ca thr A 8 2ikoA_16Y_8T}P -11.7778 3.5267 -5.8834 { n asn A 9 2ikoA_16Y_8T}P -12.851 3.3988 -3.7239 { ca asn A 9 2ikoA_16Y_8T}P -13.1281 2.9327 -2.3797 { n tyr A 10 2ikoA_16Y_8T}P -14.1543 0.7427 -2.2588 { ca tyr A 10 2ikoA_16Y_8T}P -15.2442 -0.219 -2.1243 { n gln A 14 2ikoA_16Y_8T}P -11.8172 -2.1464 0.5577 { ca gln A 14 2ikoA_16Y_8T}P -10.9287 -2.396 -0.5753 { n tyr A 15 2ikoA_16Y_8T}P -9.4366 -0.6974 -1.4545 { ca tyr A 15 2ikoA_16Y_8T}P -9.0857 0.4968 -2.1907 { n tyr A 16 2ikoA_16Y_8T}P -8.5968 0.3849 -4.5507 { ca tyr A 16 2ikoA_16Y_8T}P -7.8569 -0.1043 -5.7056 { n gly A 17 2ikoA_16Y_8T}P -6.8231 0.7969 -7.6649 { ca gly A 17 2ikoA_16Y_8T}P -6.6547 1.6693 -8.8027 {"}P -6.6547 1.6693 -8.8027 { n glu A 18 2ikoA_16Y_8T}P -6.2228 1.4844 -11.1538 { ca glu A 18 2ikoA_16Y_8T}P -6.0769 0.7993 -12.4232 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca ile A 6 2ikoA_16Y_8T}P -6.8752 7.5934 -8.5646 {"}-6.8752 7.5934 -8.5646 { ca leu A 7 2ikoA_16Y_8T}-8.281 4.9121 -6.2649 { ca thr A 8 2ikoA_16Y_8T}-11.7778 3.5267 -5.8834 { ca asn A 9 2ikoA_16Y_8T}-13.1281 2.9327 -2.3797 { ca tyr A 10 2ikoA_16Y_8T}-15.2442 -0.219 -2.1243 { ca gln A 14 2ikoA_16Y_8T}P -10.9287 -2.396 -0.5753 {"}-10.9287 -2.396 -0.5753 { ca tyr A 15 2ikoA_16Y_8T}-9.0857 0.4968 -2.1907 { ca tyr A 16 2ikoA_16Y_8T}-7.8569 -0.1043 -5.7056 { ca gly A 17 2ikoA_16Y_8T}-6.6547 1.6693 -8.8027 { ca glu A 18 2ikoA_16Y_8T}-6.0769 0.7993 -12.4232 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca thr A 8 2ikoA_16Y_8T}P -11.7778 3.5267 -5.8834 { cb thr A 8 2ikoA_16Y_8T}-12.4094 2.5587 -6.9324 { og1 thr A 8 2ikoA_16Y_8T}-12.3887 3.1955 -8.2081 { cb thr A 8 2ikoA_16Y_8T}P -12.4094 2.5587 -6.9324 { cg2 thr A 8 2ikoA_16Y_8T}-13.8378 2.2287 -6.5879 { ca tyr A 16 2ikoA_16Y_8T}P -7.8569 -0.1043 -5.7056 { cb tyr A 16 2ikoA_16Y_8T}-8.4391 -1.4313 -6.1814 { cg tyr A 16 2ikoA_16Y_8T}-9.874 -1.3447 -6.5867 { cd1 tyr A 16 2ikoA_16Y_8T}-10.8856 -1.6696 -5.6943 { ce1 tyr A 16 2ikoA_16Y_8T}-12.2221 -1.5718 -6.0634 { cz tyr A 16 2ikoA_16Y_8T}-12.5501 -1.1805 -7.3359 { oh tyr A 16 2ikoA_16Y_8T}-13.8777 -1.1071 -7.7112 { cg tyr A 16 2ikoA_16Y_8T}P -9.874 -1.3447 -6.5867 { cd2 tyr A 16 2ikoA_16Y_8T}-10.2372 -0.9361 -7.8686 { ce2 tyr A 16 2ikoA_16Y_8T}-11.5708 -0.8602 -8.2424 { cz tyr A 16 2ikoA_16Y_8T}ghost -12.5501 -1.1805 -7.3359 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb thr A 8 2ikoA_16Y_8T}P -12.4094 2.5587 -6.9324 { og1 thr A 8 2ikoA_16Y_8T}P -12.3887 3.1955 -8.2081 { cg2 thr A 8 2ikoA_16Y_8T}P -13.8378 2.2287 -6.5879 {"}P -13.8378 2.2287 -6.5879 {"}P -13.8378 2.2287 -6.5879 { cb tyr A 16 2ikoA_16Y_8T}P -8.4391 -1.4313 -6.1814 {"}P -8.4391 -1.4313 -6.1814 { cd1 tyr A 16 2ikoA_16Y_8T}P -10.8856 -1.6696 -5.6943 { cd2 tyr A 16 2ikoA_16Y_8T}P -10.2372 -0.9361 -7.8686 { ce1 tyr A 16 2ikoA_16Y_8T}P -12.2221 -1.5718 -6.0634 { ce2 tyr A 16 2ikoA_16Y_8T}P -11.5708 -0.8602 -8.2424 { oh tyr A 16 2ikoA_16Y_8T}P -13.8777 -1.1071 -7.7112 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 TYR 16 A}'S' sky -10.9551 0.4341 -7.0503 {"}'S' blue -10.722 0.5608 -7.1024 {"}'S' sky -10.875 0.595 -7.3108 {"}'S' blue -10.6183 0.6963 -7.3641 {"}'S' blue -10.7742 0.7018 -7.5682 { CE1 TYR 16 A}'S' blue -11.9019 0.1272 -6.3382 { CE2 TYR 16 A}'S' blue -12.2682 0.7416 -8.1394 {"}'S' sky -11.1969 0.3503 -7.0354 {"}'S' sky -11.6381 0.8876 -8.1694 {"}'S' sky -11.0152 0.7237 -7.7489 { CZ TYR 16 A}'S' blue -13.268 0.1897 -6.5176 {"}'S' sky -13.4223 0.2074 -6.7223 {"}'S' blue -13.5836 0.1696 -6.9204 {"}'S' sky -13.0349 0.3164 -6.5698 {"}'S' sky -13.5118 0.273 -7.174 {"}'S' blue -12.7833 0.4021 -6.6265 {"}'S' sky -12.9312 0.4519 -6.8315 {"}'S' sky -13.2475 0.4213 -7.2329 {"}'S' sky -13.4082 0.3428 -7.4175 {"}'S' sky -12.3822 0.3367 -6.4804 {"}'S' sky -12.8045 0.5327 -7.0818 {"}'S' sky -12.9622 0.5196 -7.2823 {"}'S' sky -13.123 0.467 -7.4748 {"}'S' blue -13.2803 0.3773 -7.6539 {"}'S' blue -13.4335 0.2518 -7.8158 {"}'S' sky -12.0609 0.2514 -6.4558 {"}'S' blue -12.779 0.5498 -7.4677 {"}'S' sky -12.6006 0.5382 -7.6622 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 TYR 16 A}'S' green -11.7935 0.4295 -7.081 {"}'S' green -12.2086 0.6709 -7.6847 {"}'S' sea -11.4533 0.3392 -6.9731 {"}'S' green -11.551 0.5031 -7.1458 {"}'S' green -11.9519 0.7722 -7.738 {"}'S' sea -12.1078 0.7778 -7.9421 {"}'S' green -11.2902 0.5193 -7.2032 {"}'S' green -11.6733 0.8259 -7.7848 {"}'S' green -11.8252 0.853 -7.9883 {"}'S' sea -11.0816 0.5718 -7.3623 {"}'S' green -11.2003 0.7054 -7.5534 {"}'S' green -11.3346 0.8038 -7.7543 {"}'S' green -11.4814 0.8646 -7.962 { CZ TYR 16 A}'S' sea -13.1879 0.3506 -6.7782 {"}'S' sea -13.349 0.3356 -6.9812 {"}'S' sea -13.0871 0.4575 -7.0356 {"}'S' sea -12.5102 0.4397 -6.6754 {"}'S' sea -12.6526 0.5056 -6.8782 {"}'S' sea -12.1796 0.3851 -6.6468 {"}'S' green -12.314 0.4835 -6.8478 {"}'S' green -12.4608 0.5443 -7.0555 {"}'S' sea -12.6174 0.5673 -7.2628 {"}'S' sea -11.8722 0.2787 -6.6484 {"}'S' green -11.9946 0.4033 -6.8424 {"}'S' green -12.1325 0.4943 -7.0448 {"}'S' green -12.2816 0.5474 -7.2521 {"}'S' sea -12.4385 0.5617 -7.4596 {"}'S' sea -11.6643 0.2303 -6.801 {"}'S' green -11.7866 0.3566 -6.9934 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 16 A}'S' P -11.9157 0.5558 -7.2735 {"}'S' -11.9113 0.5369 -7.2853 {"}'S' P -12.0556 0.6367 -7.4763 {"}'S' -12.0523 0.6277 -7.4817 {"}'S' P -11.6685 0.6322 -7.3342 {"}'S' -11.6666 0.594 -7.357 {"}'S' P -11.8039 0.7224 -7.533 {"}'S' -11.7979 0.682 -7.5515 {"}'S' P -11.4029 0.657 -7.3869 {"}'S' -11.4033 0.6474 -7.3921 {"}'S' P -11.5309 0.76 -7.5819 {"}'S' -11.5323 0.7358 -7.592 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 16 A}'S' sky -14.2188 0.1 -7.0892 {"}'S' sky -14.5318 0.1118 -7.4975 {"}'S' blue -13.8479 0.0795 -6.9689 {"}'S' sky -14.4373 0.1753 -7.7571 {"}'S' sky -13.6749 0.1673 -7.1678 {"}'S' sky 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-6.4144 {"}'S' sky -13.2826 0.7101 -7.2562 {"}'S' sky -12.9627 0.7364 -6.8506 {"}'S' blue -12.8013 0.8215 -6.6648 {"}'S' blue -13.1891 0.8843 -7.5014 {"}'S' sky -13.0389 0.8423 -7.2967 {"}'S' sky -12.8804 0.8542 -7.0948 { HB THR 8 A}'S' sky -12.6733 0.8172 -6.9656 {"}'S' sky -12.3972 0.6725 -6.5689 {"}'S' sky -12.016 0.5748 -6.4597 {"}'S' blue -11.7115 0.5508 -6.4908 {"}'S' blue -11.033 0.7695 -6.8831 {"}'S' sky -10.9574 0.8653 -7.1195 {"}'S' blue -10.9552 0.9829 -7.3809 {HG21 THR 8 A}'S' sky -14.595 0.4387 -7.4842 {"}'S' sky -14.4477 0.397 -7.2819 {"}'S' sky -14.2922 0.409 -7.0841 {"}'S' blue -14.1336 0.4735 -6.8973 {"}'S' sky -14.4803 0.4866 -7.7809 {"}'S' blue -13.874 0.4965 -6.9989 {"}'S' blue -14.3035 0.5689 -7.9853 {"}'S' sky -13.7119 0.5189 -7.2063 {"}'S' blue -14.0663 0.644 -8.0661 {"}'S' sky -13.9314 0.5491 -7.8652 {"}'S' sky -13.6123 0.5739 -7.4604 {"}'S' blue -13.5357 0.6926 -7.7006 {"}'S' blue -13.3795 0.788 -7.5261 @dotlist {x} color= white width= 1 master= {vdw contact} { CG2 THR 8 A}'S' sea -13.3746 0.5887 -6.9833 {"}'S' sea -13.216 0.6047 -6.7822 {"}'S' sea -13.1248 0.6985 -7.0498 { HB THR 8 A}'S' sea -12.5445 0.7155 -6.7715 {"}'S' sea -12.5801 0.7832 -7.2457 {"}'S' green -12.4647 0.6516 -7.0597 {"}'S' green -12.3273 0.5701 -6.8602 {"}'S' green -12.1754 0.5443 -6.6569 {"}'S' sea -12.4124 0.751 -7.4518 {"}'S' green -12.3036 0.6103 -7.2727 {"}'S' green -12.1729 0.5159 -7.0777 {"}'S' green -12.0256 0.4743 -6.8754 {"}'S' sea -11.8701 0.4863 -6.6775 {"}'S' sea -12.262 0.8718 -7.7233 {"}'S' green -12.1744 0.6957 -7.5598 {"}'S' green -11.9216 0.4825 -7.1743 {"}'S' green -11.7693 0.4575 -6.9706 {"}'S' sea -11.6099 0.488 -6.7734 {"}'S' sea -12.0551 0.9953 -7.8992 {"}'S' green -11.984 0.7989 -7.7539 {"}'S' green -11.4475 0.5201 -6.9826 {"}'S' sea -11.8123 1.0889 -7.9801 {"}'S' green -11.7478 0.88 -7.8375 {"}'S' green -11.3535 0.6022 -7.2505 {"}'S' sea -11.1902 0.6511 -7.0539 {"}'S' green -11.5096 0.9869 -7.8678 {"}'S' green -11.4071 0.8341 -7.6928 {"}'S' green 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-9.6341 2.6729 -6.4018 {"}'M' P -9.7942 2.5814 -6.5793 {"}'M' -9.7867 2.5758 -6.5814 {"}'M' P -9.6088 2.8054 -6.6607 {"}'M' -9.5948 2.7884 -6.665 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 16 A}'M' greentint -9.7246 2.2453 -6.0879 {"}'M' greentint -9.8836 2.1565 -6.2695 {"}'M' greentint -10.0271 2.0488 -6.542 {"}'M' greentint -9.4873 2.378 -5.9356 {"}'M' greentint -9.6216 2.4778 -6.1369 {"}'M' greentint -9.7849 2.4444 -6.3387 {"}'M' greentint -9.9335 2.2875 -6.4872 {"}'M' greentint -10.0372 2.1912 -6.7847 {"}'M' greentint -9.3398 2.6036 -5.9992 {"}'M' greentint -9.4777 2.6829 -6.1989 {"}'M' greentint -9.9334 2.4134 -6.7125 {"}'M' greentint -10.0068 2.2852 -7.0295 {"}'M' greentint -9.1534 2.7747 -6.0637 {"}'M' greentint -9.2925 2.853 -6.2649 {"}'M' greentint -9.4486 2.8637 -6.4687 {"}'M' greentint -9.7636 2.6824 -6.8254 {"}'M' greentint -9.8993 2.5048 -6.9516 {"}'M' greentint -9.9289 2.3654 -7.2677 {"}'M' greentint -9.0525 2.9712 -6.3038 {"}'M' greentint -9.2054 3.0071 -6.5108 {"}'M' greentint -9.3659 2.9837 -6.7128 {"}'M' greentint -9.528 2.9015 -6.8985 {"}'M' greentint -9.6802 2.7655 -7.0585 {"}'M' greentint -9.8168 2.584 -7.1833 {"}'M' greentint -8.9567 3.0985 -6.5797 {"}'M' greentint -9.1119 3.0976 -6.7796 {"}'M' greentint -9.2711 3.0465 -6.9718 {"}'M' greentint -9.4269 2.9478 -7.1451 {"}'M' greentint -9.573 2.8042 -7.295 {"}'M' greentint -9.7038 2.6222 -7.4134 @subgroup {2->1} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { H THR 8 A}'M' P -9.2861 2.1715 -6.6747 {"}'M' -9.3021 2.1922 -6.6705 {"}'M' P -9.1319 2.3041 -6.513 {"}'M' -9.1319 2.3041 -6.513 {"}'M' P -9.1764 2.3381 -6.8431 {"}'M' -9.1965 2.3556 -6.8335 @dotlist {x} color= sky width= 1 master= {H-bonds} { H THR 8 A}'M' greentint -9.8616 1.9946 -6.1973 {"}'M' greentint -9.7067 2.0918 -6.0249 {"}'M' greentint -10.0451 2.0203 -6.8711 {"}'M' greentint -9.9052 1.9553 -6.6718 {"}'M' greentint -9.7509 1.9545 -6.4727 {"}'M' greentint -9.5927 2.0182 -6.2864 {"}'M' greentint -9.4425 2.1427 -6.1265 {"}'M' greentint -9.3093 2.3183 -6.0035 {"}'M' greentint -9.2041 2.5329 -5.9257 {"}'M' greentint -9.9542 2.2285 -7.2113 {"}'M' greentint -9.8417 2.0865 -7.0268 {"}'M' greentint -9.7003 2.0135 -6.8237 {"}'M' greentint -9.5421 2.0157 -6.62 {"}'M' greentint -9.3815 2.0917 -6.4331 {"}'M' greentint -9.2319 2.2371 -6.2807 {"}'M' greentint -9.1073 2.437 -6.1749 {"}'M' greentint -9.0188 2.6746 -6.1268 {"}'M' greentint -9.7803 2.5191 -7.4107 {"}'M' greentint -9.7132 2.3132 -7.2669 {"}'M' greentint -9.5972 2.1762 -7.0788 {"}'M' greentint -9.4484 2.1266 -6.8726 {"}'M' greentint -9.0076 2.5074 -6.4084 {"}'M' greentint -8.9293 2.7531 -6.3762 {"}'M' greentint -8.9084 3.0085 -6.4195 {"}'M' greentint -9.5358 2.6171 -7.3843 {"}'M' greentint -9.4692 2.4118 -7.2412 {"}'M' greentint -9.3374 2.31 -7.0431 {"}'M' greentint -9.0284 2.4901 -6.6942 {"}'M' greentint -8.9336 2.7242 -6.6369 {"}'M' greentint -8.9173 2.9779 -6.6862 {"}'M' greentint -9.3081 2.6831 -7.2744 {"}'M' greentint -9.2039 2.5279 -7.0966 {"}'M' greentint -9.044 2.6248 -6.9172 {"}'M' greentint -8.989 2.8781 -6.917 {"}'M' greentint -9.0932 3.0333 -7.0948 {"}'M' greentint -9.2532 2.9364 -7.2742 {"}'M' greentint -9.1223 2.7745 -7.1165 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 16 A}'M' green -10.3868 0.904 -4.5883 {"}'M' green -9.6433 1.6468 -4.0971 {"}'M' green -9.6813 1.8764 -4.5535 {"}'M' green -9.8427 1.8372 -4.7514 {"}'M' green -10.1379 1.5504 -5.0535 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 16 A}'M' greentint -10.1818 1.1074 -4.158 {"}'M' greentint -10.3151 1.0038 -4.3575 {"}'M' greentint -9.9959 1.1988 -4 {"}'M' greentint -10.1001 1.354 -4.1779 {"}'M' greentint -10.2601 1.257 -4.3573 {"}'M' greentint -10.3705 1.1577 -4.6376 {"}'M' greentint -9.8349 1.47 -4.0332 {"}'M' greentint -9.9666 1.5718 -4.2314 {"}'M' greentint -10.1276 1.5437 -4.4314 {"}'M' greentint -10.2757 1.3918 -4.5802 {"}'M' greentint -10.3422 1.2551 -4.8912 {"}'M' greentint -9.7782 1.7417 -4.298 {"}'M' greentint -9.9371 1.7448 -4.5039 {"}'M' greentint -10.0974 1.6537 -4.6868 {"}'M' greentint -10.2388 1.4832 -4.8224 {"}'M' greentint -9.9993 1.7251 -4.9228 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O THR 8 A}'M' green -10.4685 0.869 -4.3895 {"}'M' green -10.3059 0.9247 -4.1954 {"}'M' green -10.1481 1.0349 -4.0219 {"}'M' green -10.0027 1.1966 -3.879 {"}'M' green -10.3942 1.0044 -4.6486 {"}'M' green -10.4139 1.2631 -5.0047 {"}'M' green -10.2742 1.4977 -5.0791 {"}'M' green -9.8145 1.9726 -4.7353 {"}'M' green -9.9549 1.8719 -4.9281 @dotlist {x} color= red width= 1 master= {H-bonds} { O THR 8 A}'M' greentint -10.235 1.0268 -4.4481 {"}'M' greentint -10.0753 1.1154 -4.2671 {"}'M' greentint -9.9286 1.265 -4.1196 {"}'M' greentint -9.8048 1.4647 -4.0149 {"}'M' greentint -10.2755 1.1863 -4.8031 {"}'M' greentint -10.1167 1.1973 -4.6022 {"}'M' greentint -9.9597 1.2932 -4.4249 {"}'M' greentint -9.8212 1.4637 -4.2934 {"}'M' greentint -9.7183 1.6872 -4.2225 {"}'M' greentint -10.1412 1.3942 -4.8789 {"}'M' greentint -9.9781 1.4234 -4.6763 {"}'M' greentint -9.8283 1.5771 -4.5254 {"}'M' greentint -9.733 1.8134 -4.4679 {"}'M' greentint -10.0286 1.624 -4.9141 {"}'M' greentint -9.8699 1.7213 -4.7365 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n tyr A 93 2imjA_95Y_107S}P -11.8585 -1.7382 1.1121 {"}-11.8585 -1.7382 1.1121 { ca tyr A 93 2imjA_95Y_107S}-10.8335 -1.9461 0.1067 { c tyr A 93 2imjA_95Y_107S}-10.6538 -0.7649 -0.8162 { o tyr A 93 2imjA_95Y_107S}-11.4351 0.1868 -0.8061 { c tyr A 93 2imjA_95Y_107S}P -10.6538 -0.7649 -0.8162 { n ala A 94 2imjA_95Y_107S}-9.5904 -0.8346 -1.606 { ca ala A 94 2imjA_95Y_107S}-9.2904 0.1903 -2.5834 { c ala A 94 2imjA_95Y_107S}-8.5126 -0.4587 -3.7099 { o ala A 94 2imjA_95Y_107S}-7.7267 -1.382 -3.4845 { c ala A 94 2imjA_95Y_107S}P -8.5126 -0.4587 -3.7099 { n tyr A 95 2imjA_95Y_107S}-8.769 -0.0093 -4.9302 { ca tyr A 95 2imjA_95Y_107S}-8.0387 -0.5138 -6.0725 { c tyr A 95 2imjA_95Y_107S}-7.7187 0.6259 -7.018 { o tyr A 95 2imjA_95Y_107S}-8.5202 1.5441 -7.2037 { c tyr A 95 2imjA_95Y_107S}P -7.7187 0.6259 -7.018 { n glu A 96 2imjA_95Y_107S}-6.5065 0.6034 -7.5622 { ca glu A 96 2imjA_95Y_107S}-6.0841 1.6325 -8.4945 { c glu A 96 2imjA_95Y_107S}-6.0743 1.0198 -9.8777 { o glu A 96 2imjA_95Y_107S}-5.8102 -0.1746 -10.0403 { c glu A 96 2imjA_95Y_107S}P -6.0743 1.0198 -9.8777 { n trp A 97 2imjA_95Y_107S}-6.3832 1.8427 -10.8705 { ca trp A 97 2imjA_95Y_107S}-6.465 1.3859 -12.2468 { c trp A 97 2imjA_95Y_107S}-6.5886 2.5922 -13.1558 { o trp A 97 2imjA_95Y_107S}-6.6867 3.7262 -12.6892 { n phe A 105 2imjA_95Y_107S}P -7.5883 6.1637 -11.7096 {"}-7.5883 6.1637 -11.7096 { ca phe A 105 2imjA_95Y_107S}-8.5609 6.2825 -10.6342 { c phe A 105 2imjA_95Y_107S}-8.1449 5.4591 -9.4334 { o phe A 105 2imjA_95Y_107S}-7.3868 4.4922 -9.5505 { c phe A 105 2imjA_95Y_107S}P -8.1449 5.4591 -9.4334 { n arg A 106 2imjA_95Y_107S}-8.63 5.8637 -8.2681 { ca arg A 106 2imjA_95Y_107S}-8.4514 5.0594 -7.0782 { c arg A 106 2imjA_95Y_107S}-9.904 4.8389 -6.6995 { o arg A 106 2imjA_95Y_107S}-10.6663 5.7972 -6.5178 { c arg A 106 2imjA_95Y_107S}P -9.904 4.8389 -6.6995 { n ser A 107 2imjA_95Y_107S}-10.3006 3.5795 -6.6362 { ca ser A 107 2imjA_95Y_107S}-11.6678 3.2437 -6.2905 { c ser A 107 2imjA_95Y_107S}-11.7037 2.7675 -4.8484 { o ser A 107 2imjA_95Y_107S}-10.8832 1.9474 -4.43 { c ser A 107 2imjA_95Y_107S}P -11.7037 2.7675 -4.8484 { n tyr A 108 2imjA_95Y_107S}-12.6457 3.3146 -4.0889 { ca tyr A 108 2imjA_95Y_107S}-12.8072 2.9601 -2.6889 { c tyr A 108 2imjA_95Y_107S}-14.0539 2.1068 -2.5492 { o tyr A 108 2imjA_95Y_107S}-15.1331 2.4873 -3.0139 { c tyr A 108 2imjA_95Y_107S}P -14.0539 2.1068 -2.5492 { n gly A 109 2imjA_95Y_107S}-13.9112 0.9619 -1.8996 { ca gly A 109 2imjA_95Y_107S}-15.0535 0.0886 -1.7355 { c gly A 109 2imjA_95Y_107S}-15.2835 -0.4582 -0.3428 { o gly A 109 2imjA_95Y_107S}-14.3879 -0.4796 0.5051 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n tyr A 93 2imjA_95Y_107S}P -11.8585 -1.7382 1.1121 { ca tyr A 93 2imjA_95Y_107S}P -10.8335 -1.9461 0.1067 { n ala A 94 2imjA_95Y_107S}P -9.5904 -0.8346 -1.606 { ca ala A 94 2imjA_95Y_107S}P -9.2904 0.1903 -2.5834 { n tyr A 95 2imjA_95Y_107S}P -8.769 -0.0093 -4.9302 { ca tyr A 95 2imjA_95Y_107S}P -8.0387 -0.5138 -6.0725 { n glu A 96 2imjA_95Y_107S}P -6.5065 0.6034 -7.5622 { ca glu A 96 2imjA_95Y_107S}P -6.0841 1.6325 -8.4945 { n trp A 97 2imjA_95Y_107S}P -6.3832 1.8427 -10.8705 { ca trp A 97 2imjA_95Y_107S}P -6.465 1.3859 -12.2468 { n phe A 105 2imjA_95Y_107S}P -7.5883 6.1637 -11.7096 { ca phe A 105 2imjA_95Y_107S}P -8.5609 6.2825 -10.6342 { n arg A 106 2imjA_95Y_107S}P -8.63 5.8637 -8.2681 { ca arg A 106 2imjA_95Y_107S}P -8.4514 5.0594 -7.0782 { n ser A 107 2imjA_95Y_107S}P -10.3006 3.5795 -6.6362 { ca ser A 107 2imjA_95Y_107S}P -11.6678 3.2437 -6.2905 { n tyr A 108 2imjA_95Y_107S}P -12.6457 3.3146 -4.0889 { ca tyr A 108 2imjA_95Y_107S}P -12.8072 2.9601 -2.6889 { n gly A 109 2imjA_95Y_107S}P -13.9112 0.9619 -1.8996 { ca gly A 109 2imjA_95Y_107S}P -15.0535 0.0886 -1.7355 {"}P -15.0535 0.0886 -1.7355 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca tyr A 93 2imjA_95Y_107S}P -10.8335 -1.9461 0.1067 {"}-10.8335 -1.9461 0.1067 { ca ala A 94 2imjA_95Y_107S}-9.2904 0.1903 -2.5834 { ca tyr A 95 2imjA_95Y_107S}-8.0387 -0.5138 -6.0725 { ca glu A 96 2imjA_95Y_107S}-6.0841 1.6325 -8.4945 { ca trp A 97 2imjA_95Y_107S}-6.465 1.3859 -12.2468 { ca phe A 105 2imjA_95Y_107S}P -8.5609 6.2825 -10.6342 {"}-8.5609 6.2825 -10.6342 { ca arg A 106 2imjA_95Y_107S}-8.4514 5.0594 -7.0782 { ca ser A 107 2imjA_95Y_107S}-11.6678 3.2437 -6.2905 { ca tyr A 108 2imjA_95Y_107S}-12.8072 2.9601 -2.6889 { ca gly A 109 2imjA_95Y_107S}-15.0535 0.0886 -1.7355 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca tyr A 95 2imjA_95Y_107S}P -8.0387 -0.5138 -6.0725 { cb tyr A 95 2imjA_95Y_107S}-8.8033 -1.6583 -6.7725 { cg tyr A 95 2imjA_95Y_107S}-10.1484 -1.3553 -7.4174 { cd1 tyr A 95 2imjA_95Y_107S}-10.2251 -0.9156 -8.7384 { ce1 tyr A 95 2imjA_95Y_107S}-11.4586 -0.78 -9.3872 { cz tyr A 95 2imjA_95Y_107S}-12.6284 -1.0856 -8.7102 { oh tyr A 95 2imjA_95Y_107S}-13.838 -0.9992 -9.3681 { cg tyr A 95 2imjA_95Y_107S}P -10.1484 -1.3553 -7.4174 { cd2 tyr A 95 2imjA_95Y_107S}-11.3452 -1.6412 -6.7509 { ce2 tyr A 95 2imjA_95Y_107S}-12.5856 -1.5119 -7.3925 { cz tyr A 95 2imjA_95Y_107S}ghost -12.6284 -1.0856 -8.7102 { ca ser A 107 2imjA_95Y_107S}P -11.6678 3.2437 -6.2905 { cb ser A 107 2imjA_95Y_107S}-12.2012 2.1642 -7.2362 { og ser A 107 2imjA_95Y_107S}-12.3161 2.6766 -8.5628 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb tyr A 95 2imjA_95Y_107S}P -8.8033 -1.6583 -6.7725 {"}P -8.8033 -1.6583 -6.7725 { cd1 tyr A 95 2imjA_95Y_107S}P -10.2251 -0.9156 -8.7384 { cd2 tyr A 95 2imjA_95Y_107S}P -11.3452 -1.6412 -6.7509 { ce1 tyr A 95 2imjA_95Y_107S}P -11.4586 -0.78 -9.3872 { ce2 tyr A 95 2imjA_95Y_107S}P -12.5856 -1.5119 -7.3925 { oh tyr A 95 2imjA_95Y_107S}P -13.838 -0.9992 -9.3681 { cb ser A 107 2imjA_95Y_107S}P -12.2012 2.1642 -7.2362 {"}P -12.2012 2.1642 -7.2362 { og ser A 107 2imjA_95Y_107S}P -12.3161 2.6766 -8.5628 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 95 A}'S' sky -10.5294 0.2771 -6.9129 {"}'S' sky -10.4028 0.3579 -7.1633 {"}'S' sky -10.3772 0.375 -7.5492 { CD1 TYR 95 A}'S' sky -11.4193 -0.1311 -7.7284 {"}'S' sky -10.4477 0.374 -7.577 {"}'S' sky -11.0239 0.6005 -8.3837 {"}'S' blue -10.3228 0.5767 -7.8302 {"}'S' sky -10.4582 0.6669 -8.029 {"}'S' sky -10.6061 0.7167 -8.234 {"}'S' blue -10.762 0.7223 -8.4381 { CD2 TYR 95 A}'S' blue -11.8821 -0.0033 -6.4506 {"}'S' sky -11.5995 0.072 -6.4968 {"}'S' sky -11.2558 0.0836 -6.4705 {"}'S' sky -11.5111 -0.1224 -7.6047 { CE1 TYR 95 A}'S' sky -11.4659 -0.0831 -7.7826 {"}'S' sky -11.9433 0.7169 -8.6211 {"}'S' blue -12.0963 0.7511 -8.8295 {"}'S' sky -11.6917 0.8025 -8.6778 {"}'S' blue -11.8396 0.8524 -8.8828 {"}'S' sky -11.2907 0.7372 -8.5317 {"}'S' blue -11.4186 0.8401 -8.7267 {"}'S' blue -10.9694 0.6519 -8.5072 { CE2 TYR 95 A}'S' blue -12.5457 0.1082 -6.7319 {"}'S' sky -12.6881 0.1741 -6.9348 {"}'S' sky -12.84 0.2013 -7.1384 {"}'S' blue -12.9977 0.1881 -7.3389 {"}'S' sky -12.2151 0.0537 -6.7034 {"}'S' sky -12.3495 0.1521 -6.9044 {"}'S' sky -12.8145 0.2184 -7.5243 { CZ TYR 95 A}'S' sky -12.9733 0.3303 -7.7413 {"}'S' sky -13.1132 0.4113 -7.9441 {"}'S' sky -13.0094 0.5468 -8.2058 {"}'S' sky -12.8828 0.6276 -8.4561 {"}'S' blue -12.6956 0.6622 -8.6372 {"}'S' sky -12.3598 0.6422 -8.6265 @dotlist {x} color= white width= 1 master= {vdw contact} { CG TYR 95 A}'S' sea -10.7862 0.1758 -6.8596 {"}'S' green -10.9472 0.1608 -7.0626 {"}'S' green -11.11 0.0982 -7.2555 {"}'S' sea -11.2686 -0.0108 -7.4303 {"}'S' sea -10.6853 0.2827 -7.117 {"}'S' green -10.8457 0.2465 -7.3143 {"}'S' green -11.0064 0.168 -7.499 {"}'S' sea -10.5604 0.3448 -7.3638 {"}'S' sea -10.7213 0.2922 -7.5562 { CD1 TYR 95 A}'S' sea -11.2877 0.0896 -7.7784 {"}'S' green -11 0.2238 -7.6601 {"}'S' green -11.1428 0.2903 -7.8637 {"}'S' green -10.8006 0.3842 -7.7182 {"}'S' green -10.9429 0.4546 -7.9202 {"}'S' green -11.0972 0.4722 -8.1248 {"}'S' sea -10.57 0.5003 -7.7695 {"}'S' green -10.7098 0.5812 -7.9723 {"}'S' sea -10.8629 0.6154 -8.1807 { CD2 TYR 95 A}'S' sea -11.7572 0.0588 -6.6974 {"}'S' green -11.4124 0.1065 -6.6779 {"}'S' green -11.574 0.0891 -6.8828 {"}'S' green -11.7379 0.0324 -7.0785 {"}'S' sea -11.0766 0.0866 -6.6672 {"}'S' green -11.2335 0.101 -6.8746 {"}'S' green -11.3956 0.0775 -7.0772 {"}'S' green -11.5592 0.016 -7.2714 {"}'S' sea -11.3499 -0.0259 -7.4234 { CE1 TYR 95 A}'S' sea -11.5105 0.1439 -7.9022 {"}'S' green -11.5823 0.3439 -8.0511 {"}'S' green -11.6812 0.5096 -8.2258 {"}'S' sea -11.8035 0.6359 -8.4183 {"}'S' green -11.3411 0.4194 -8.118 {"}'S' green -11.4387 0.5833 -8.2906 {"}'S' sea -11.5563 0.7123 -8.479 {"}'S' sea -11.178 0.5994 -8.348 { CE2 TYR 95 A}'S' sea -12.4963 0.2129 -7.1121 {"}'S' sea -12.6529 0.2358 -7.3194 {"}'S' sea -12.0301 0.0719 -6.899 {"}'S' green -12.168 0.1629 -7.1014 {"}'S' sea -12.3171 0.2159 -7.3087 {"}'S' sea -12.474 0.2302 -7.5162 {"}'S' green -11.8221 0.0251 -7.05 {"}'S' green -11.9592 0.116 -7.253 {"}'S' green -12.1078 0.1698 -7.4599 {"}'S' green -11.7469 0.0238 -7.381 {"}'S' green -11.8945 0.0833 -7.5878 { CZ TYR 95 A}'S' sea -12.6086 0.2777 -7.6136 {"}'S' sea -12.7261 0.4067 -7.802 {"}'S' sea -12.8615 0.4969 -8.0008 {"}'S' sea -12.3478 0.2938 -7.671 {"}'S' green -12.4605 0.4316 -7.8547 {"}'S' green -12.5884 0.5345 -8.0497 {"}'S' sea -12.7309 0.6004 -8.2526 {"}'S' green -12.0391 0.1799 -7.6554 {"}'S' green -12.1392 0.3463 -7.8301 {"}'S' green -12.2579 0.48 -8.0212 {"}'S' green -12.3922 0.5784 -8.2222 {"}'S' sea -12.539 0.6392 -8.4298 {"}'S' sea -11.7594 0.0315 -7.6818 {"}'S' green -11.8455 0.2172 -7.8436 {"}'S' green -11.9505 0.3736 -8.0228 {"}'S' sea -12.0728 0.4982 -8.2167 {"}'S' sea -12.2107 0.5892 -8.4191 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 107 A}'S' blue -12.9727 0.5956 -7.1517 {"}'S' blue -12.8208 0.5543 -6.9432 {"}'S' blue -12.6611 0.5513 -6.7361 {"}'S' blue -13.0838 0.7486 -7.7656 {"}'S' sky -12.9606 0.6239 -7.5723 {"}'S' sky -12.8231 0.5338 -7.3688 {"}'S' sky -12.674 0.4808 -7.1615 {"}'S' sky -12.5163 0.4663 -6.9546 {"}'S' blue -12.3542 0.4898 -6.7521 {"}'S' sky -12.9877 0.8667 -8.1091 {"}'S' blue -12.8301 0.9863 -8.367 {"}'S' sky -12.5779 0.9593 -8.4483 {"}'S' blue -12.3562 1.0522 -8.5784 {"}'S' sky -12.2695 0.8731 -8.4156 {"}'S' blue -12.1196 1.1432 -8.6551 {"}'S' sky -12.0343 0.9575 -8.4928 {"}'S' blue -11.878 1.2441 -8.6897 {"}'S' sky -11.7952 1.0593 -8.531 {"}'S' sky -11.6852 0.9158 -8.3479 {"}'S' blue -11.5484 1.1562 -8.5098 { HB2 SER 107 A}'S' sky -11.9393 0.3592 -6.6593 {"}'S' blue -11.4077 0.4662 -6.4118 {"}'S' sky -11.0012 0.3785 -6.7265 {"}'S' sky -10.706 0.5754 -6.8089 {"}'S' sky -11.5311 1.0001 -8.3616 {"}'S' sky -10.5934 0.6153 -7.0417 {"}'S' sky -10.5198 0.7023 -7.2787 {"}'S' sky -11.0195 0.9344 -8.2197 {"}'S' blue -10.5041 0.8057 -7.5184 {"}'S' blue -10.7983 1.005 -8.0976 {"}'S' sky -10.6933 0.8486 -7.9184 @dotlist {x} color= white width= 1 master= {vdw contact} { CB SER 107 A}'S' sea -12.8828 0.709 -7.9296 {"}'S' sea -12.7609 0.5836 -7.7361 {"}'S' sea -12.6234 0.4918 -7.5341 {"}'S' sea -12.4748 0.438 -7.3272 {"}'S' sea -12.3175 0.4217 -7.1188 {"}'S' sea -12.7392 0.8064 -8.2 {"}'S' green -12.6294 0.6573 -8.0158 {"}'S' green -12.5026 0.5417 -7.8196 {"}'S' sea -12.3606 0.4633 -7.6143 {"}'S' sea -12.485 0.7895 -8.281 {"}'S' green -12.3732 0.6502 -8.0981 {"}'S' green -12.2449 0.5466 -7.9024 {"}'S' sea -12.16 0.727 -8.2343 {"}'S' sea -11.9236 0.8097 -8.3094 { HB2 SER 107 A}'S' sea -12.2439 0.3844 -7.0609 {"}'S' sea -12.0967 0.3413 -6.8584 {"}'S' green -12.1641 0.3205 -7.3492 {"}'S' green -12.0268 0.239 -7.1497 {"}'S' sea -11.8749 0.2132 -6.9464 {"}'S' sea -11.7155 0.2437 -6.7491 {"}'S' sea -11.557 0.3302 -6.5677 {"}'S' green -12.1119 0.4199 -7.7413 {"}'S' green -12.0031 0.2792 -7.5622 {"}'S' green -11.8724 0.1848 -7.3672 {"}'S' green -11.7251 0.1432 -7.1649 {"}'S' green -11.5696 0.1551 -6.967 {"}'S' green -11.4109 0.2196 -6.7803 {"}'S' sea -11.258 0.3357 -6.6148 {"}'S' green -11.9615 0.5407 -8.0127 {"}'S' green -11.8738 0.3645 -7.8493 {"}'S' green -11.7577 0.2328 -7.6639 {"}'S' sea -11.6211 0.1514 -7.4638 {"}'S' green -11.4687 0.1264 -7.2601 {"}'S' green -11.3093 0.1569 -7.0628 {"}'S' green -11.1513 0.2426 -6.8818 {"}'S' green -11.7546 0.6642 -8.1887 {"}'S' green -11.6835 0.4678 -8.0433 {"}'S' green -11.5809 0.3151 -7.8683 {"}'S' sea -11.4524 0.2143 -7.6731 {"}'S' sea -11.3052 0.1712 -7.4706 {"}'S' green -11.147 0.189 -7.2721 {"}'S' green -10.9893 0.265 -7.0893 {"}'S' sea -10.8389 0.3964 -6.9307 {"}'S' sea -11.5118 0.7578 -8.2696 {"}'S' green -11.4473 0.5489 -8.127 {"}'S' green -11.3436 0.3901 -7.949 {"}'S' green -11.2087 0.2953 -7.7481 {"}'S' green -11.053 0.2711 -7.5399 {"}'S' green -10.8897 0.32 -7.3434 {"}'S' sea -10.7325 0.4384 -7.1726 {"}'S' sea -11.2642 0.867 -8.286 {"}'S' sea -11.2091 0.6558 -8.1573 {"}'S' green -11.1065 0.503 -7.9822 {"}'S' green -10.9694 0.428 -7.7828 {"}'S' green -10.813 0.4387 -7.5835 {"}'S' sea -10.6569 0.5341 -7.409 {"}'S' sea -10.9516 0.7259 -8.0743 {"}'S' green -10.8182 0.6231 -7.8737 {"}'S' sea -10.6547 0.6518 -7.6703 @subgroup {1->2} dominant @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { O TYR 95 A}'M' P -9.4175 2.5855 -6.9386 {"}'M' -9.4105 2.5777 -6.9409 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 95 A}'M' greentint -9.5333 2.0253 -6.3658 {"}'M' greentint -9.6923 1.9366 -6.5474 {"}'M' greentint -9.8358 1.8288 -6.8198 {"}'M' greentint -9.296 2.158 -6.2135 {"}'M' greentint -9.4303 2.2578 -6.4147 {"}'M' greentint -9.5936 2.2245 -6.6166 {"}'M' greentint -9.7422 2.0675 -6.7651 {"}'M' greentint -9.8459 1.9712 -7.0626 {"}'M' greentint -9.1485 2.3837 -6.2771 {"}'M' 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2.6102 -6.7151 {"}'M' greentint -9.4969 2.4327 -6.8412 {"}'M' greentint -9.5264 2.2932 -7.1574 {"}'M' greentint -8.8029 2.9349 -6.4005 {"}'M' greentint -8.9634 2.9115 -6.6025 {"}'M' greentint -9.1255 2.8293 -6.7882 {"}'M' greentint -9.2777 2.6934 -6.9481 {"}'M' greentint -9.4144 2.5118 -7.0729 {"}'M' greentint -9.4119 2.338 -7.3871 {"}'M' greentint -8.7094 3.0255 -6.6693 {"}'M' greentint -8.8686 2.9744 -6.8615 {"}'M' greentint -9.0244 2.8756 -7.0348 {"}'M' greentint -9.1705 2.732 -7.1847 {"}'M' greentint -9.3013 2.55 -7.3031 {"}'M' greentint -8.8687 2.9029 -7.24 {"}'M' greentint -9.0153 2.7558 -7.3898 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H LEU 459 A}'M' greentint -9.4439 2.0818 -6.1556 {"}'M' greentint -9.3026 2.2326 -6.014 {"}'M' greentint -9.6424 1.9453 -6.8025 {"}'M' greentint -9.4881 1.9446 -6.6034 {"}'M' greentint -9.3299 2.0083 -6.4171 {"}'M' greentint -9.1797 2.1327 -6.2573 {"}'M' greentint -9.0466 2.3083 -6.1342 {"}'M' greentint -8.9413 2.523 -6.0564 {"}'M' greentint -9.5789 2.0766 -7.1575 {"}'M' greentint -9.4375 2.0036 -6.9544 {"}'M' greentint -9.2794 2.0058 -6.7507 {"}'M' greentint -9.1187 2.0818 -6.5638 {"}'M' greentint -8.9692 2.2271 -6.4114 {"}'M' greentint -8.8446 2.4271 -6.3056 {"}'M' greentint -8.756 2.6647 -6.2576 {"}'M' greentint -9.3344 2.1663 -7.2095 {"}'M' greentint -9.1857 2.1166 -7.0034 {"}'M' greentint -9.0233 2.1615 -6.8054 {"}'M' greentint -8.8691 2.2941 -6.6437 {"}'M' greentint -8.7449 2.4975 -6.5391 {"}'M' greentint -8.6666 2.7432 -6.507 {"}'M' greentint -8.6456 2.9986 -6.5503 {"}'M' greentint -9.2064 2.4018 -7.372 {"}'M' greentint -9.0747 2.3001 -7.1738 {"}'M' greentint -8.9137 2.3281 -6.9738 {"}'M' greentint -8.7656 2.4801 -6.825 {"}'M' greentint -8.6708 2.7142 -6.7676 {"}'M' greentint -8.6545 2.9679 -6.817 {"}'M' greentint -9.0454 2.6731 -7.4052 {"}'M' greentint -8.9412 2.5179 -7.2273 {"}'M' greentint -8.7812 2.6148 -7.0479 {"}'M' greentint -8.7262 2.8681 -7.0477 {"}'M' greentint -8.8595 2.7645 -7.2472 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 376 A}'M' green -10.0533 0.9125 -4.6181 {"}'M' green -9.5015 1.4785 -4.0631 {"}'M' green -10.0592 1.0089 -4.9164 {"}'M' green -9.5282 1.7476 -5.1778 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 376 A}'M' greentint -9.8484 1.1159 -4.1878 {"}'M' greentint -9.9816 1.0122 -4.3873 {"}'M' greentint -9.7667 1.3624 -4.2077 {"}'M' greentint -9.9267 1.2655 -4.3871 {"}'M' greentint -10.0371 1.1661 -4.6674 {"}'M' greentint -9.6332 1.5803 -4.2612 {"}'M' greentint -9.7942 1.5522 -4.4612 {"}'M' greentint -9.9422 1.4003 -4.6101 {"}'M' greentint -10.0088 1.2636 -4.921 {"}'M' greentint -9.4448 1.7501 -4.3279 {"}'M' greentint -9.6037 1.7533 -4.5338 {"}'M' greentint -9.7639 1.6622 -4.7166 {"}'M' greentint -9.9053 1.4917 -4.8522 {"}'M' greentint -9.9119 1.3379 -5.161 {"}'M' greentint -9.3479 1.8849 -4.5833 {"}'M' greentint -9.5092 1.8457 -4.7812 {"}'M' greentint -9.6659 1.7336 -4.9526 {"}'M' greentint -9.8044 1.5589 -5.0834 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O LEU 459 A}'M' green -9.8997 1.0497 -4.1575 {"}'M' green -9.7594 1.2117 -4.0215 {"}'M' green -10.1068 0.9334 -4.7557 {"}'M' green -9.6668 1.6884 -5.2802 @dotlist {x} color= red width= 1 master= {H-bonds} { O LEU 459 A}'M' greentint -9.9442 0.9891 -4.5615 {"}'M' greentint -9.7863 1.0993 -4.3881 {"}'M' greentint -9.641 1.261 -4.2451 {"}'M' greentint -9.5164 1.4634 -4.1415 {"}'M' greentint -10.0324 1.0688 -5.0148 {"}'M' greentint -9.8732 1.0912 -4.8143 {"}'M' greentint -9.7135 1.1798 -4.6333 {"}'M' greentint -9.5668 1.3294 -4.4857 {"}'M' greentint -9.4431 1.5291 -4.381 {"}'M' greentint -9.3512 1.7633 -4.3277 {"}'M' greentint -9.9138 1.2507 -5.1693 {"}'M' greentint -9.7549 1.2617 -4.9684 {"}'M' greentint -9.5979 1.3576 -4.791 {"}'M' greentint -9.4594 1.5282 -4.6595 {"}'M' greentint -9.3565 1.7517 -4.5886 {"}'M' greentint -9.7795 1.4586 -5.245 {"}'M' greentint -9.6163 1.4878 -5.0424 {"}'M' greentint -9.4665 1.6415 -4.8916 {"}'M' greentint -9.3712 1.8778 -4.8341 {"}'M' greentint -9.5081 1.7857 -5.1026 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 57 2ixcA_121F_59R}P -7.5568 5.8102 -12.3992 {"}-7.5568 5.8102 -12.3992 { ca val A 57 2ixcA_121F_59R}-8.7195 5.8534 -11.5323 { c val A 57 2ixcA_121F_59R}-8.475 5.0765 -10.2296 { o val A 57 2ixcA_121F_59R}-8.0787 3.9233 -10.2638 { c val A 57 2ixcA_121F_59R}P -8.475 5.0765 -10.2296 { n leu A 58 2ixcA_121F_59R}-8.7248 5.7187 -9.0891 { ca leu A 58 2ixcA_121F_59R}-8.6451 5.0632 -7.7899 { c leu A 58 2ixcA_121F_59R}-10.0471 5.0255 -7.1666 { o leu A 58 2ixcA_121F_59R}-10.6646 6.078 -6.9368 { c leu A 58 2ixcA_121F_59R}P -10.0471 5.0255 -7.1666 { n arg A 59 2ixcA_121F_59R}-10.5344 3.8087 -6.8954 { ca arg A 59 2ixcA_121F_59R}-11.7939 3.6001 -6.1871 { c arg A 59 2ixcA_121F_59R}-11.4964 3.0954 -4.7766 { o arg A 59 2ixcA_121F_59R}-10.834 2.0605 -4.6126 { c arg A 59 2ixcA_121F_59R}P -11.4964 3.0954 -4.7766 { n gly A 60 2ixcA_121F_59R}-11.9609 3.8304 -3.7644 { ca gly A 60 2ixcA_121F_59R}-11.7329 3.4421 -2.3697 { c gly A 60 2ixcA_121F_59R}-11.4422 4.6334 -1.4599 { o gly A 60 2ixcA_121F_59R}-11.5089 5.7741 -1.914 { c gly A 60 2ixcA_121F_59R}P -11.4422 4.6334 -1.4599 { n leu A 61 2ixcA_121F_59R}-11.1368 4.4036 -0.1783 { ca leu A 61 2ixcA_121F_59R}-11.1547 3.1062 0.4933 { c leu A 61 2ixcA_121F_59R}-12.5484 2.8454 1.0489 { o leu A 61 2ixcA_121F_59R}-13.119 3.7064 1.7283 { n his A 119 2ixcA_121F_59R}P -11.2044 -1.6302 1.5253 {"}-11.2044 -1.6302 1.5253 { ca his A 119 2ixcA_121F_59R}-10.6986 -2.1288 0.2542 { c his A 119 2ixcA_121F_59R}-10.7044 -1.0135 -0.7757 { o his A 119 2ixcA_121F_59R}-11.5883 -0.1324 -0.77 { c his A 119 2ixcA_121F_59R}P -10.7044 -1.0135 -0.7757 { n gly A 120 2ixcA_121F_59R}-9.7042 -1.0377 -1.6468 { ca gly A 120 2ixcA_121F_59R}-9.6387 -0.0817 -2.7428 { c gly A 120 2ixcA_121F_59R}-8.7234 -0.5805 -3.8421 { o gly A 120 2ixcA_121F_59R}-7.9547 -1.5198 -3.6279 { c gly A 120 2ixcA_121F_59R}P -8.7234 -0.5805 -3.8421 { n phe A 121 2ixcA_121F_59R}-8.8176 0.0174 -5.0249 { ca phe A 121 2ixcA_121F_59R}-7.8407 -0.2704 -6.0762 { c phe A 121 2ixcA_121F_59R}-7.5473 0.931 -6.9697 { o phe A 121 2ixcA_121F_59R}-8.3513 1.86 -7.0604 { c phe A 121 2ixcA_121F_59R}P -7.5473 0.931 -6.9697 { n leu A 122 2ixcA_121F_59R}-6.3754 0.8922 -7.6061 { ca leu A 122 2ixcA_121F_59R}-5.9542 1.8834 -8.5795 { c leu A 122 2ixcA_121F_59R}-5.7793 1.1577 -9.9143 { o leu A 122 2ixcA_121F_59R}-4.9813 0.2194 -10.0226 { c leu A 122 2ixcA_121F_59R}P -5.7793 1.1577 -9.9143 { n ala A 123 2ixcA_121F_59R}-6.508 1.6043 -10.9285 { ca ala A 123 2ixcA_121F_59R}-6.4533 0.9884 -12.2494 { c ala A 123 2ixcA_121F_59R}-5.1426 1.3945 -12.914 { o ala A 123 2ixcA_121F_59R}-4.7722 2.574 -12.894 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 57 2ixcA_121F_59R}P -7.5568 5.8102 -12.3992 { ca val A 57 2ixcA_121F_59R}P -8.7195 5.8534 -11.5323 { n leu A 58 2ixcA_121F_59R}P -8.7248 5.7187 -9.0891 { ca leu A 58 2ixcA_121F_59R}P -8.6451 5.0632 -7.7899 { n arg A 59 2ixcA_121F_59R}P -10.5344 3.8087 -6.8954 { ca arg A 59 2ixcA_121F_59R}P -11.7939 3.6001 -6.1871 { n gly A 60 2ixcA_121F_59R}P -11.9609 3.8304 -3.7644 { ca gly A 60 2ixcA_121F_59R}P -11.7329 3.4421 -2.3697 {"}P -11.7329 3.4421 -2.3697 { n leu A 61 2ixcA_121F_59R}P -11.1368 4.4036 -0.1783 { ca leu A 61 2ixcA_121F_59R}P -11.1547 3.1062 0.4933 { n his A 119 2ixcA_121F_59R}P -11.2044 -1.6302 1.5253 { ca his A 119 2ixcA_121F_59R}P -10.6986 -2.1288 0.2542 { n gly A 120 2ixcA_121F_59R}P -9.7042 -1.0377 -1.6468 { ca gly A 120 2ixcA_121F_59R}P -9.6387 -0.0817 -2.7428 {"}P -9.6387 -0.0817 -2.7428 { n phe A 121 2ixcA_121F_59R}P -8.8176 0.0174 -5.0249 { ca phe A 121 2ixcA_121F_59R}P -7.8407 -0.2704 -6.0762 { n leu A 122 2ixcA_121F_59R}P -6.3754 0.8922 -7.6061 { ca leu A 122 2ixcA_121F_59R}P -5.9542 1.8834 -8.5795 { n ala A 123 2ixcA_121F_59R}P -6.508 1.6043 -10.9285 { ca ala A 123 2ixcA_121F_59R}P -6.4533 0.9884 -12.2494 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 57 2ixcA_121F_59R}P -8.7195 5.8534 -11.5323 {"}-8.7195 5.8534 -11.5323 { ca leu A 58 2ixcA_121F_59R}-8.6451 5.0632 -7.7899 { ca arg A 59 2ixcA_121F_59R}-11.7939 3.6001 -6.1871 { ca gly A 60 2ixcA_121F_59R}-11.7329 3.4421 -2.3697 { ca leu A 61 2ixcA_121F_59R}-11.1547 3.1062 0.4933 { ca his A 119 2ixcA_121F_59R}P -10.6986 -2.1288 0.2542 {"}-10.6986 -2.1288 0.2542 { ca gly A 120 2ixcA_121F_59R}-9.6387 -0.0817 -2.7428 { ca phe A 121 2ixcA_121F_59R}-7.8407 -0.2704 -6.0762 { ca leu A 122 2ixcA_121F_59R}-5.9542 1.8834 -8.5795 { ca ala A 123 2ixcA_121F_59R}-6.4533 0.9884 -12.2494 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 59 2ixcA_121F_59R}P -11.7939 3.6001 -6.1871 { cb arg A 59 2ixcA_121F_59R}-12.6599 2.5837 -6.9336 { cg arg A 59 2ixcA_121F_59R}-13.0169 2.9955 -8.3802 { cd arg A 59 2ixcA_121F_59R}-13.9289 1.9625 -9.0577 { ne arg A 59 2ixcA_121F_59R}-14.0884 2.2632 -10.479 { cz arg A 59 2ixcA_121F_59R}-15.2344 2.6374 -11.0405 { nh1 arg A 59 2ixcA_121F_59R}-16.3519 2.7232 -10.2993 { cz arg A 59 2ixcA_121F_59R}P -15.2344 2.6374 -11.0405 { nh2 arg A 59 2ixcA_121F_59R}-15.2642 2.9045 -12.3452 { ca phe A 121 2ixcA_121F_59R}P -7.8407 -0.2704 -6.0762 { cb phe A 121 2ixcA_121F_59R}-8.2512 -1.4771 -6.9292 { cg phe A 121 2ixcA_121F_59R}-9.5076 -1.26 -7.7184 { cd1 phe A 121 2ixcA_121F_59R}-9.4802 -0.587 -8.9505 { ce1 phe A 121 2ixcA_121F_59R}-10.6586 -0.3809 -9.6905 { cz phe A 121 2ixcA_121F_59R}-11.8791 -0.8552 -9.1861 { cg phe A 121 2ixcA_121F_59R}P -9.5076 -1.26 -7.7184 { cd2 phe A 121 2ixcA_121F_59R}-10.7207 -1.7122 -7.2295 { ce2 phe A 121 2ixcA_121F_59R}-11.917 -1.5065 -7.9666 { cz phe A 121 2ixcA_121F_59R}ghost -11.8791 -0.8552 -9.1861 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 59 2ixcA_121F_59R}P -12.6599 2.5837 -6.9336 {"}P -12.6599 2.5837 -6.9336 { cg arg A 59 2ixcA_121F_59R}P -13.0169 2.9955 -8.3802 {"}P -13.0169 2.9955 -8.3802 { cd arg A 59 2ixcA_121F_59R}P -13.9289 1.9625 -9.0577 {"}P -13.9289 1.9625 -9.0577 { ne arg A 59 2ixcA_121F_59R}P -14.0884 2.2632 -10.479 { nh1 arg A 59 2ixcA_121F_59R}P -16.3519 2.7232 -10.2993 {"}P -16.3519 2.7232 -10.2993 { nh2 arg A 59 2ixcA_121F_59R}P -15.2642 2.9045 -12.3452 {"}P -15.2642 2.9045 -12.3452 { cb phe A 121 2ixcA_121F_59R}P -8.2512 -1.4771 -6.9292 {"}P -8.2512 -1.4771 -6.9292 { cd1 phe A 121 2ixcA_121F_59R}P -9.4802 -0.587 -8.9505 { cd2 phe A 121 2ixcA_121F_59R}P -10.7207 -1.7122 -7.2295 { ce1 phe A 121 2ixcA_121F_59R}P -10.6586 -0.3809 -9.6905 { ce2 phe A 121 2ixcA_121F_59R}P -11.917 -1.5065 -7.9666 { cz phe A 121 2ixcA_121F_59R}P -11.8791 -0.8552 -9.1861 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 121 A}'S' blue -13.0373 -0.162 -7.9796 {"}'S' blue -13.1866 -0.3136 -8.1302 {"}'S' blue -12.1502 0.0761 -7.2572 {"}'S' blue -12.2981 0.1259 -7.4622 {"}'S' blue -11.8771 0.1137 -7.3061 {"}'S' blue -12.0195 0.1796 -7.5089 {"}'S' blue -12.1714 0.2068 -7.7125 {"}'S' blue -11.6809 0.1576 -7.4785 {"}'S' blue -11.8277 0.2183 -7.6862 { CZ PHE 121 A}'S' blue -12.0028 0.2688 -7.85 {"}'S' blue -12.1017 0.4345 -8.0247 {"}'S' blue -12.224 0.5608 -8.2171 {"}'S' blue -11.7616 0.3442 -7.9168 {"}'S' blue -11.8593 0.5081 -8.0894 @dotlist {x} color= white width= 1 master= {vdw contact} { HZ PHE 121 A}'S' green -13.5315 -0.1048 -9.4303 {"}'S' green -13.5012 0.0052 -9.6857 {"}'S' sea -13.4032 0.0766 -9.9217 {"}'S' sea -13.1153 0.2151 -9.987 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 121 A}'S' P -13.1046 0.1423 -8.4333 {"}'S' -13.0575 0.1037 -8.4626 {"}'S' P -13.268 0.046 -8.6175 {"}'S' -13.197 0.0003 -8.6467 {"}'S' P -13.4112 -0.1276 -8.7547 {"}'S' -13.3812 -0.141 -8.7636 {"}'S' P -12.7968 0.3508 -8.3113 {"}'S' -12.7838 0.3337 -8.3238 {"}'S' P -12.9545 0.3508 -8.5149 {"}'S' -12.8775 0.2647 -8.5626 {"}'S' P -13.1153 0.2865 -8.7046 {"}'S' -12.9875 0.1677 -8.754 {"}'S' P -13.2685 0.1593 -8.8679 {"}'S' -13.1348 0.0611 -8.8985 {"}'S' P -13.4051 -0.0195 -8.9933 {"}'S' -13.3226 -0.0641 -9.0037 {"}'S' P -12.5969 0.515 -8.3678 {"}'S' -12.5939 0.51 -8.3711 {"}'S' P -12.7512 0.5327 -8.5725 {"}'S' -12.6931 0.4398 -8.6137 {"}'S' P -13.3559 0.0821 -9.2294 {"}'S' -13.2557 0.0192 -9.2269 {"}'S' P -12.5169 0.6759 -8.6284 {"}'S' -12.499 0.6322 -8.6436 {"}'S' P -12.6779 0.661 -8.8314 {"}'S' -12.6128 0.5362 -8.8609 {"}'S' P -13.1486 0.3378 -9.3497 {"}'S' -13.0227 0.2198 -9.3335 {"}'S' P -13.2821 0.151 -9.4707 {"}'S' -13.2104 0.0991 -9.4565 {"}'S' P -12.416 0.7828 -8.8858 {"}'S' -12.4054 0.7505 -8.8912 {"}'S' P -12.5764 0.7466 -9.0831 {"}'S' -12.5348 0.6506 -9.0897 {"}'S' P -12.7371 0.6682 -9.2677 {"}'S' -12.6664 0.5427 -9.262 {"}'S' P -12.8922 0.5495 -9.4356 {"}'S' -12.8102 0.4365 -9.4155 {"}'S' P -13.0378 0.3954 -9.5805 {"}'S' -12.9723 0.3249 -9.5586 {"}'S' P -12.452 0.7924 -9.325 {"}'S' -12.4451 0.7751 -9.3237 {"}'S' P -12.6092 0.7026 -9.5041 {"}'S' -12.5923 0.6661 -9.4965 {"}'S' P -12.7624 0.5772 -9.666 {"}'S' -12.7459 0.5508 -9.658 { HZ PHE 121 A}'S' P -13.341 0.0963 -9.5028 {"}'S' -13.3067 0.044 -9.5192 {"}'S' P -13.2466 0.1887 -9.7503 {"}'S' -13.2412 0.1783 -9.7509 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { CZ PHE 121 A}'S' P -12.9125 0.4949 -8.7706 {"}'S' -12.7932 0.3393 -8.8182 {"}'S' P -13.071 0.4042 -8.9513 {"}'S' -12.9111 0.2346 -8.9827 {"}'S' P -13.2217 0.2648 -9.1065 {"}'S' -13.066 0.1348 -9.1153 {"}'S' P -12.8407 0.5983 -9.0242 {"}'S' -12.7271 0.4266 -9.0434 {"}'S' P -12.9993 0.4893 -9.1991 {"}'S' -12.8602 0.3214 -9.1979 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD ARG 59 A}'S' sky -12.6978 0.9669 -9.8033 {"}'S' sky -12.5352 1.0658 -9.6208 { HB2 ARG 59 A}'S' blue -12.3641 0.5567 -7.3944 {"}'S' blue -12.2275 0.4754 -7.1943 {"}'S' blue -12.0751 0.4504 -6.9906 {"}'S' blue -12.2899 0.7918 -7.7739 {"}'S' blue -12.1873 0.639 -7.5988 {"}'S' blue -12.0589 0.5382 -7.4036 {"}'S' blue -11.9116 0.4952 -7.2011 {"}'S' blue -12.0537 0.8728 -7.8575 {"}'S' blue -11.95 0.7141 -7.6795 {"}'S' blue -11.8151 0.6193 -7.4786 @dotlist {x} color= white width= 1 master= {vdw contact} { HD2 ARG 59 A}'S' sea -13.7325 -0.1059 -9.3715 {"}'S' green -13.5557 -0.0236 -9.5759 {"}'S' green -13.4222 0.2102 -9.8346 {"}'S' green -13.184 0.3171 -9.865 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HD2 ARG 59 A}'S' P -13.4436 -0.2122 -8.9677 {"}'S' -13.4449 -0.1899 -8.9677 {"}'S' P -13.2842 -0.1818 -8.7705 {"}'S' -13.2977 -0.1155 -8.7802 {"}'S' P -13.1262 -0.096 -8.5895 {"}'S' -13.1536 -0.0181 -8.6157 {"}'S' P -12.9761 0.0398 -8.4341 {"}'S' -13.0092 0.0968 -8.4651 {"}'S' P -12.842 0.2198 -8.3107 {"}'S' -12.8601 0.2393 -8.328 {"}'S' P -13.4273 -0.1244 -9.3808 {"}'S' -13.4293 -0.0932 -9.3684 {"}'S' P -13.28 -0.1674 -9.1782 {"}'S' -13.2983 -0.0762 -9.159 {"}'S' P -13.1219 -0.1497 -8.9797 {"}'S' -13.1721 -0.0053 -8.9737 {"}'S' P -12.9641 -0.0736 -8.7969 {"}'S' -13.0456 0.0839 -8.8177 {"}'S' P -12.8137 0.0578 -8.6384 {"}'S' -12.9121 0.1858 -8.6808 {"}'S' P -12.6809 0.2367 -8.5165 {"}'S' -12.7652 0.3102 -8.5597 {"}'S' P -12.5723 0.4518 -8.436 {"}'S' -12.6085 0.4714 -8.4557 {"}'S' P -13.3185 0.0515 -9.6567 {"}'S' -13.3239 0.0812 -9.6333 {"}'S' P -13.1836 -0.0434 -9.4558 {"}'S' -13.209 0.0381 -9.4134 {"}'S' P -13.0278 -0.0676 -9.2476 {"}'S' -13.0997 0.0881 -9.2002 {"}'S' P -12.5683 0.2766 -8.7493 {"}'S' -12.7097 0.3797 -8.7782 {"}'S' P -12.4582 0.4993 -8.6703 {"}'S' -12.5429 0.5358 -8.6918 {"}'S' P -13.0814 0.1643 -9.6899 {"}'S' -13.0984 0.1966 -9.659 {"}'S' P -12.9442 0.0893 -9.4904 {"}'S' -13.0143 0.198 -9.4213 {"}'S' P -12.4946 0.3637 -8.9864 {"}'S' -12.6544 0.4569 -8.9782 {"}'S' P -12.393 0.5848 -8.9168 {"}'S' -12.486 0.6161 -8.9177 {"}'S' P -12.9265 0.3872 -9.782 {"}'S' -12.9311 0.3915 -9.7756 {"}'S' P -12.7931 0.2845 -9.5813 {"}'S' -12.8654 0.3521 -9.5162 {"}'S' P -12.6295 0.3131 -9.378 {"}'S' -12.7589 0.4085 -9.3118 {"}'S' P -12.4789 0.467 -9.226 {"}'S' -12.6097 0.5287 -9.1899 {"}'S' P -12.3832 0.7041 -9.1681 {"}'S' -12.4365 0.7164 -9.1566 {"}'S' P -12.6681 0.51 -9.6261 {"}'S' -12.7088 0.5312 -9.5925 {"}'S' P -12.5077 0.6077 -9.4462 {"}'S' -12.566 0.628 -9.416 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {bad overlap} { HD2 ARG 59 A}'S' P -12.8646 -0.0187 -9.051 {"}'S' -12.987 0.1691 -9.0288 {"}'S' P -12.7073 0.0997 -8.8802 {"}'S' -12.8603 0.2641 -8.8909 {"}'S' P -12.7879 0.1001 -9.2912 {"}'S' -12.9182 0.2565 -9.2264 {"}'S' P -12.6318 0.1955 -9.1166 {"}'S' -12.8014 0.3431 -9.0814 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 121 A}'M' green -9.667 2.1447 -6.6765 {"}'M' green -9.4247 2.5403 -6.4733 {"}'M' green -9.7336 2.0376 -6.9225 {"}'M' green -9.2755 2.7705 -6.5355 {"}'M' green -9.5398 2.2712 -7.6765 {"}'M' green -9.0667 3.0437 -7.2797 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 121 A}'M' greentint -9.5733 2.3834 -6.6218 {"}'M' greentint -9.677 2.2871 -6.9193 {"}'M' greentint -9.4341 2.6773 -6.7139 {"}'M' greentint -9.5733 2.5094 -6.847 {"}'M' greentint -9.6466 2.3811 -7.1641 {"}'M' greentint -9.7178 2.136 -7.1883 {"}'M' greentint -9.2487 2.9014 -6.7953 {"}'M' greentint -9.4035 2.7783 -6.96 {"}'M' greentint -9.5392 2.6007 -7.0861 {"}'M' greentint -9.5687 2.4613 -7.4023 {"}'M' greentint -9.6499 2.2181 -7.4407 {"}'M' greentint -9.1678 2.9974 -7.0331 {"}'M' greentint -9.3201 2.8615 -7.193 {"}'M' greentint -9.4567 2.6799 -7.3178 {"}'M' greentint -9.4542 2.5061 -7.632 {"}'M' greentint -9.2129 2.9001 -7.4296 {"}'M' greentint -9.3437 2.7181 -7.548 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ARG 59 A}'M' green -9.764 2.0368 -6.9315 {"}'M' green -9.3019 2.7913 -6.5439 {"}'M' green -9.3753 2.5464 -7.7417 {"}'M' green -9.1603 2.8966 -7.5621 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 59 A}'M' greentint -9.6138 2.1612 -6.7716 {"}'M' greentint -9.4807 2.3368 -6.6486 {"}'M' greentint -9.3754 2.5515 -6.5708 {"}'M' greentint -9.7134 2.0343 -7.2651 {"}'M' greentint -9.5528 2.1102 -7.0782 {"}'M' greentint -9.4032 2.2556 -6.9258 {"}'M' greentint -9.2787 2.4556 -6.82 {"}'M' greentint -9.1901 2.6932 -6.7719 {"}'M' greentint -9.1456 2.9479 -6.7846 {"}'M' greentint -9.6197 2.1451 -7.5177 {"}'M' greentint -9.4574 2.19 -7.3198 {"}'M' greentint -9.3032 2.3226 -7.1581 {"}'M' greentint -9.1789 2.526 -7.0535 {"}'M' greentint -9.1006 2.7716 -7.0213 {"}'M' greentint -9.0797 3.0271 -7.0646 {"}'M' greentint -9.5088 2.3286 -7.6882 {"}'M' greentint -9.3478 2.3566 -7.4882 {"}'M' greentint -9.1997 2.5086 -7.3393 {"}'M' greentint -9.1049 2.7427 -7.282 {"}'M' greentint -9.0886 2.9964 -7.3313 {"}'M' greentint -9.2153 2.6433 -7.5623 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 121 A}'M' green -10.4397 0.7405 -4.871 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 121 A}'M' greentint -10.3064 0.8442 -4.6716 {"}'M' greentint -10.1205 0.9356 -4.5136 {"}'M' greentint -10.2248 1.0907 -4.6914 {"}'M' greentint -10.3847 0.9938 -4.8708 {"}'M' greentint -10.4951 0.8944 -5.1511 {"}'M' greentint -9.9595 1.2068 -4.5468 {"}'M' greentint -10.0913 1.3086 -4.7449 {"}'M' greentint -10.2523 1.2805 -4.9449 {"}'M' greentint -10.4003 1.1286 -5.0938 {"}'M' greentint -10.4668 0.9919 -5.4047 {"}'M' greentint -9.7679 1.3836 -4.6107 {"}'M' greentint -9.9028 1.4784 -4.8116 {"}'M' greentint -10.0617 1.4816 -5.0175 {"}'M' greentint -10.222 1.3905 -5.2003 {"}'M' greentint -10.3634 1.22 -5.3359 {"}'M' greentint -9.6543 1.5777 -4.8619 {"}'M' greentint -9.806 1.6131 -5.0671 {"}'M' greentint -9.9673 1.574 -5.2649 {"}'M' greentint -10.1239 1.4619 -5.4363 {"}'M' greentint -10.2625 1.2872 -5.5671 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 59 A}'M' green -10.3587 0.7443 -4.6672 {"}'M' green -9.79 1.1504 -4.4081 {"}'M' green -9.5921 1.4185 -4.544 {"}'M' green -9.6571 1.675 -5.2657 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 59 A}'M' greentint -10.413 0.8273 -5.1244 {"}'M' greentint -10.2558 0.8227 -4.9187 {"}'M' greentint -10.0932 0.8784 -4.7246 {"}'M' greentint -9.9354 0.9886 -4.5511 {"}'M' greentint -10.3294 1.0051 -5.3823 {"}'M' greentint -10.1814 0.9581 -5.1778 {"}'M' greentint -10.0222 0.9805 -4.9773 {"}'M' greentint -9.8625 1.0691 -4.7963 {"}'M' greentint -9.7158 1.2187 -4.6487 {"}'M' greentint -10.2012 1.2168 -5.5338 {"}'M' greentint -10.0628 1.14 -5.3323 {"}'M' greentint -9.904 1.151 -5.1314 {"}'M' greentint -9.7469 1.2469 -4.9541 {"}'M' greentint -9.6085 1.4175 -4.8225 {"}'M' greentint -10.0614 1.4514 -5.6083 {"}'M' greentint -9.9285 1.3479 -5.4081 {"}'M' greentint -9.7653 1.3771 -5.2054 {"}'M' greentint -9.6156 1.5308 -5.0546 {"}'M' greentint -9.8158 1.5777 -5.4433 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n val A 60 2ixkA_123F_62R}P -7.9119 5.7404 -12.4842 {"}-7.9119 5.7404 -12.4842 { ca val A 60 2ixkA_123F_62R}-9.0335 5.7432 -11.5809 { c val A 60 2ixkA_123F_62R}-8.6589 4.9826 -10.3125 { o val A 60 2ixkA_123F_62R}-8.1008 3.8784 -10.3641 { c val A 60 2ixkA_123F_62R}P -8.6589 4.9826 -10.3125 { n leu A 61 2ixkA_123F_62R}-8.9864 5.586 -9.172 { ca leu A 61 2ixkA_123F_62R}-8.8386 4.9321 -7.8808 { c leu A 61 2ixkA_123F_62R}-10.1934 4.9005 -7.2031 { o leu A 61 2ixkA_123F_62R}-10.8452 5.9329 -7.0925 { c leu A 61 2ixkA_123F_62R}P -10.1934 4.9005 -7.2031 { n arg A 62 2ixkA_123F_62R}-10.6475 3.7076 -6.8115 { ca arg A 62 2ixkA_123F_62R}-11.8748 3.5654 -6.0249 { c arg A 62 2ixkA_123F_62R}-11.4991 3.0628 -4.6293 { o arg A 62 2ixkA_123F_62R}-10.7891 2.0692 -4.495 { c arg A 62 2ixkA_123F_62R}P -11.4991 3.0628 -4.6293 { n gly A 63 2ixkA_123F_62R}-12.0067 3.7319 -3.603 { ca gly A 63 2ixkA_123F_62R}-11.7284 3.3442 -2.201 { c gly A 63 2ixkA_123F_62R}-11.3927 4.5473 -1.3247 { o gly A 63 2ixkA_123F_62R}-11.4152 5.6747 -1.7974 { c gly A 63 2ixkA_123F_62R}P -11.3927 4.5473 -1.3247 { n leu A 64 2ixkA_123F_62R}-11.0584 4.3286 -0.0489 { ca leu A 64 2ixkA_123F_62R}-10.9889 3.0109 0.5741 { c leu A 64 2ixkA_123F_62R}-12.312 2.7547 1.2491 { o leu A 64 2ixkA_123F_62R}-12.6961 3.5321 2.1205 { n his A 121 2ixkA_123F_62R}P -11.2472 -1.6104 1.5169 {"}-11.2472 -1.6104 1.5169 { ca his A 121 2ixkA_123F_62R}-10.7737 -2.0722 0.2257 { c his A 121 2ixkA_123F_62R}-10.6672 -0.9222 -0.7628 { o his A 121 2ixkA_123F_62R}-11.5211 -0.043 -0.801 { c his A 121 2ixkA_123F_62R}P -10.6672 -0.9222 -0.7628 { n gly A 122 2ixkA_123F_62R}-9.6059 -0.928 -1.558 { ca gly A 122 2ixkA_123F_62R}-9.5149 -0.0214 -2.7018 { c gly A 122 2ixkA_123F_62R}-8.6603 -0.586 -3.804 { o gly A 122 2ixkA_123F_62R}-7.9278 -1.5511 -3.6028 { c gly A 122 2ixkA_123F_62R}P -8.6603 -0.586 -3.804 { n phe A 123 2ixkA_123F_62R}-8.74 0.0395 -4.9684 { ca phe A 123 2ixkA_123F_62R}-7.8513 -0.3191 -6.0574 { c phe A 123 2ixkA_123F_62R}-7.6089 0.8583 -6.9637 { o phe A 123 2ixkA_123F_62R}-8.4307 1.7792 -7.0395 { c phe A 123 2ixkA_123F_62R}P -7.6089 0.8583 -6.9637 { n val A 124 2ixkA_123F_62R}-6.4601 0.8108 -7.6231 { ca val A 124 2ixkA_123F_62R}-6.1193 1.7791 -8.6463 { c val A 124 2ixkA_123F_62R}-5.8781 1.0482 -9.9679 { o val A 124 2ixkA_123F_62R}-5.3183 -0.0603 -9.9923 { c val A 124 2ixkA_123F_62R}P -5.8781 1.0482 -9.9679 { n val A 125 2ixkA_123F_62R}-6.295 1.6841 -11.0606 { ca val A 125 2ixkA_123F_62R}-6.2446 1.0591 -12.3767 { c val A 125 2ixkA_123F_62R}-4.919 1.3873 -13.0442 { o val A 125 2ixkA_123F_62R}-4.571 2.5664 -13.2086 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n val A 60 2ixkA_123F_62R}P -7.9119 5.7404 -12.4842 { ca val A 60 2ixkA_123F_62R}P -9.0335 5.7432 -11.5809 { n leu A 61 2ixkA_123F_62R}P -8.9864 5.586 -9.172 { ca leu A 61 2ixkA_123F_62R}P -8.8386 4.9321 -7.8808 { n arg A 62 2ixkA_123F_62R}P -10.6475 3.7076 -6.8115 { ca arg A 62 2ixkA_123F_62R}P -11.8748 3.5654 -6.0249 { n gly A 63 2ixkA_123F_62R}P -12.0067 3.7319 -3.603 { ca gly A 63 2ixkA_123F_62R}P -11.7284 3.3442 -2.201 {"}P -11.7284 3.3442 -2.201 { n leu A 64 2ixkA_123F_62R}P -11.0584 4.3286 -0.0489 { ca leu A 64 2ixkA_123F_62R}P -10.9889 3.0109 0.5741 { n his A 121 2ixkA_123F_62R}P -11.2472 -1.6104 1.5169 { ca his A 121 2ixkA_123F_62R}P -10.7737 -2.0722 0.2257 { n gly A 122 2ixkA_123F_62R}P -9.6059 -0.928 -1.558 { ca gly A 122 2ixkA_123F_62R}P -9.5149 -0.0214 -2.7018 {"}P -9.5149 -0.0214 -2.7018 { n phe A 123 2ixkA_123F_62R}P -8.74 0.0395 -4.9684 { ca phe A 123 2ixkA_123F_62R}P -7.8513 -0.3191 -6.0574 { n val A 124 2ixkA_123F_62R}P -6.4601 0.8108 -7.6231 { ca val A 124 2ixkA_123F_62R}P -6.1193 1.7791 -8.6463 { n val A 125 2ixkA_123F_62R}P -6.295 1.6841 -11.0606 { ca val A 125 2ixkA_123F_62R}P -6.2446 1.0591 -12.3767 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca val A 60 2ixkA_123F_62R}P -9.0335 5.7432 -11.5809 {"}-9.0335 5.7432 -11.5809 { ca leu A 61 2ixkA_123F_62R}-8.8386 4.9321 -7.8808 { ca arg A 62 2ixkA_123F_62R}-11.8748 3.5654 -6.0249 { ca gly A 63 2ixkA_123F_62R}-11.7284 3.3442 -2.201 { ca leu A 64 2ixkA_123F_62R}-10.9889 3.0109 0.5741 { ca his A 121 2ixkA_123F_62R}P -10.7737 -2.0722 0.2257 {"}-10.7737 -2.0722 0.2257 { ca gly A 122 2ixkA_123F_62R}-9.5149 -0.0214 -2.7018 { ca phe A 123 2ixkA_123F_62R}-7.8513 -0.3191 -6.0574 { ca val A 124 2ixkA_123F_62R}-6.1193 1.7791 -8.6463 { ca val A 125 2ixkA_123F_62R}-6.2446 1.0591 -12.3767 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca arg A 62 2ixkA_123F_62R}P -11.8748 3.5654 -6.0249 { cb arg A 62 2ixkA_123F_62R}-12.8697 2.6155 -6.6945 { cg arg A 62 2ixkA_123F_62R}-13.1066 2.872 -8.1482 { cd arg A 62 2ixkA_123F_62R}-14.2985 2.0752 -8.6847 { ne arg A 62 2ixkA_123F_62R}-14.531 2.311 -10.114 { cz arg A 62 2ixkA_123F_62R}-15.7041 2.5696 -10.6895 { nh1 arg A 62 2ixkA_123F_62R}-16.819 2.6218 -9.9849 { cz arg A 62 2ixkA_123F_62R}P -15.7041 2.5696 -10.6895 { nh2 arg A 62 2ixkA_123F_62R}-15.7726 2.7495 -12.0084 { ca phe A 123 2ixkA_123F_62R}P -7.8513 -0.3191 -6.0574 { cb phe A 123 2ixkA_123F_62R}-8.4059 -1.5103 -6.8733 { cg phe A 123 2ixkA_123F_62R}-9.6409 -1.1914 -7.6805 { cd1 phe A 123 2ixkA_123F_62R}-9.5477 -0.7082 -8.9775 { ce1 phe A 123 2ixkA_123F_62R}-10.6805 -0.4403 -9.7223 { cz phe A 123 2ixkA_123F_62R}-11.9312 -0.6429 -9.1793 { cg phe A 123 2ixkA_123F_62R}P -9.6409 -1.1914 -7.6805 { cd2 phe A 123 2ixkA_123F_62R}-10.8966 -1.3948 -7.1425 { ce2 phe A 123 2ixkA_123F_62R}-12.042 -1.1181 -7.8809 { cz phe A 123 2ixkA_123F_62R}ghost -11.9312 -0.6429 -9.1793 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb arg A 62 2ixkA_123F_62R}P -12.8697 2.6155 -6.6945 {"}P -12.8697 2.6155 -6.6945 { cg arg A 62 2ixkA_123F_62R}P -13.1066 2.872 -8.1482 {"}P -13.1066 2.872 -8.1482 { cd arg A 62 2ixkA_123F_62R}P -14.2985 2.0752 -8.6847 {"}P -14.2985 2.0752 -8.6847 { ne arg A 62 2ixkA_123F_62R}P -14.531 2.311 -10.114 { nh1 arg A 62 2ixkA_123F_62R}P -16.819 2.6218 -9.9849 {"}P -16.819 2.6218 -9.9849 { nh2 arg A 62 2ixkA_123F_62R}P -15.7726 2.7495 -12.0084 {"}P -15.7726 2.7495 -12.0084 { cb phe A 123 2ixkA_123F_62R}P -8.4059 -1.5103 -6.8733 {"}P -8.4059 -1.5103 -6.8733 { cd1 phe A 123 2ixkA_123F_62R}P -9.5477 -0.7082 -8.9775 { cd2 phe A 123 2ixkA_123F_62R}P -10.8966 -1.3948 -7.1425 { ce1 phe A 123 2ixkA_123F_62R}P -10.6805 -0.4403 -9.7223 { ce2 phe A 123 2ixkA_123F_62R}P -12.042 -1.1181 -7.8809 { cz phe A 123 2ixkA_123F_62R}P -11.9312 -0.6429 -9.1793 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 123 A}'S' blue -13.6308 -0.3966 -8.0092 {"}'S' blue -12.4961 0.0597 -6.6684 {"}'S' sky -12.6176 0.1817 -6.8607 {"}'S' sky -12.7599 0.2521 -7.0626 {"}'S' blue -12.9142 0.2698 -7.2673 {"}'S' sky -13.234 0.1413 -7.6461 {"}'S' sky -13.3846 0.0019 -7.8013 {"}'S' sky -13.5188 -0.1808 -7.9242 {"}'S' sky -13.5587 -0.3295 -8.2525 {"}'S' sky -12.2647 0.1716 -6.7195 {"}'S' blue -12.8409 0.398 -7.5262 {"}'S' blue -13.0037 0.3354 -7.719 {"}'S' sky -12.0222 0.2452 -6.7842 {"}'S' sky -12.579 0.5199 -7.5806 {"}'S' sky -12.9001 0.4052 -7.9625 {"}'S' blue -11.7615 0.2614 -6.8417 {"}'S' sky -12.2964 0.5951 -7.6268 {"}'S' blue -11.6715 0.4475 -7.1918 {"}'S' sky -11.8059 0.5459 -7.3928 {"}'S' blue -11.9527 0.6067 -7.6005 { CZ PHE 123 A}'S' sky -13.5391 -0.2951 -8.5821 {"}'S' blue -12.4159 0.854 -8.4132 {"}'S' sky -12.5689 0.8882 -8.6215 {"}'S' blue -12.1643 0.9397 -8.4699 {"}'S' blue -12.3122 0.9895 -8.6749 {"}'S' blue -12.4681 0.9951 -8.879 {"}'S' sky -12.6285 0.9589 -9.0762 {"}'S' sky -12.7892 0.8804 -9.2609 {"}'S' sky -12.9443 0.7618 -9.4287 {"}'S' sky -13.0899 0.6076 -9.5737 {"}'S' blue -12.0336 1.0432 -8.7216 {"}'S' blue -12.1855 1.0703 -8.9252 {"}'S' blue -12.3432 1.0572 -9.1257 {"}'S' blue -12.6613 0.9149 -9.4972 {"}'S' blue -11.8418 1.0819 -8.8989 {"}'S' blue -11.9984 1.1049 -9.1062 {"}'S' blue -12.16 1.0875 -9.3111 { HZ PHE 123 A}'S' sky -13.6918 -0.1121 -9.3674 {"}'S' sky -13.7073 0.0227 -9.5903 {"}'S' sky -13.529 0.2847 -9.6969 {"}'S' blue -13.2743 0.4681 -9.7615 @dotlist {x} color= white width= 1 master= {vdw contact} { CE2 PHE 123 A}'S' sea -12.3869 0.2979 -6.9119 {"}'S' sea -12.5268 0.3788 -7.1148 {"}'S' sea -12.6798 0.413 -7.3232 {"}'S' sea -13.1623 0.2264 -7.8939 {"}'S' green -13.3116 0.0748 -8.0445 {"}'S' sea -13.445 -0.1119 -8.1655 {"}'S' sea -12.1398 0.3743 -6.9727 {"}'S' green -12.2752 0.4645 -7.1715 {"}'S' sea -12.4231 0.5143 -7.3765 {"}'S' sea -13.0552 0.2866 -8.1304 {"}'S' sea -11.8741 0.3991 -7.0254 {"}'S' sea -12.0021 0.5021 -7.2204 {"}'S' sea -12.1445 0.568 -7.4232 { CZ PHE 123 A}'S' green -13.2916 0.1083 -8.3752 {"}'S' green -13.4436 -0.0518 -8.5259 {"}'S' green -13.5701 -0.1445 -8.8229 {"}'S' sea -12.9938 0.3624 -8.2192 {"}'S' green -13.5654 -0.027 -9.0655 {"}'S' sea -12.8489 0.5631 -8.3045 {"}'S' green -13.0066 0.563 -8.5081 {"}'S' sea -12.8033 0.745 -8.5657 {"}'S' green -12.9646 0.7072 -8.7638 {"}'S' green -13.4079 0.2944 -9.2226 {"}'S' sea -12.73 0.8733 -8.8246 {"}'S' sea -12.8928 0.8106 -9.0174 {"}'S' green -13.0514 0.7016 -9.1922 {"}'S' green -13.2007 0.55 -9.3429 { HZ PHE 123 A}'S' sea -13.5593 0.1747 -9.4415 {"}'S' sea -13.3688 0.3757 -9.514 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CZ PHE 123 A}'S' P -13.1567 0.3546 -8.4265 {"}'S' -13.1564 0.3537 -8.4275 {"}'S' P -13.32 0.2583 -8.6106 {"}'S' -13.2915 0.2395 -8.622 {"}'S' P -13.4632 0.0847 -8.7479 {"}'S' -13.4564 0.0819 -8.7499 {"}'S' P -13.1673 0.4988 -8.6978 {"}'S' -13.1414 0.4745 -8.708 {"}'S' P -13.3206 0.3716 -8.8611 {"}'S' -13.2845 0.3453 -8.8689 {"}'S' P -13.4571 0.1928 -8.9864 {"}'S' -13.4475 0.188 -8.9876 {"}'S' P -13.1231 0.6165 -8.9444 {"}'S' -13.1184 0.6105 -8.9452 {"}'S' P -13.2737 0.4771 -9.0997 {"}'S' -13.2698 0.4726 -9.1001 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CG ARG 62 A}'S' blue -12.6992 1.1716 -8.208 {"}'S' blue -12.6433 1.2319 -8.5436 {"}'S' blue -12.4847 1.248 -8.3424 {"}'S' blue -12.6977 1.4122 -9.0231 {"}'S' blue -12.5513 1.3534 -8.8164 {"}'S' blue -12.3935 1.3417 -8.6101 {"}'S' blue -12.2314 1.3797 -8.4108 { CD ARG 62 A}'S' blue -13.6498 0.7308 -9.5981 {"}'S' blue -13.3854 0.8703 -9.566 {"}'S' sky -12.7769 1.2334 -8.8803 {"}'S' sky -13.0674 1.0797 -9.4303 {"}'S' sky -12.9049 1.1785 -9.2478 {"}'S' blue -12.7629 1.354 -9.1126 { HB2 ARG 62 A}'S' blue -12.8522 0.4744 -6.7116 {"}'S' sky -12.8537 0.6541 -7.1937 {"}'S' sky -12.4485 0.416 -6.6045 {"}'S' sky -12.6633 0.7574 -7.3878 {"}'S' sky -12.1268 0.4786 -6.6165 {"}'S' sky -12.4271 0.8384 -7.4714 {"}'S' blue -11.8695 0.6096 -6.6878 {"}'S' blue -12.1889 0.9453 -7.5017 {"}'S' sky -11.7929 0.7283 -6.9279 {"}'S' blue -11.7981 0.9127 -7.2181 { HG3 ARG 62 A}'S' blue -12.2965 1.4642 -8.9532 {"}'S' blue -12.1441 1.4392 -8.7494 {"}'S' blue -11.9848 1.4697 -8.5522 {"}'S' blue -12.1279 1.5271 -9.1625 {"}'S' blue -11.9806 1.484 -8.9599 {"}'S' blue -11.8224 1.5018 -8.7615 { HD2 ARG 62 A}'S' blue -13.715 0.2049 -7.7643 {"}'S' sky -13.7478 -0.0489 -8.1682 {"}'S' sky -13.3534 0.4809 -7.8064 {"}'S' blue -13.1167 0.7388 -7.9827 {"}'S' sky -13.9401 0.0986 -9.2354 {"}'S' sky -13.8056 0.3642 -9.4437 {"}'S' blue -13.6159 0.6428 -9.5061 {"}'S' sky -13.3948 0.7135 -9.384 @dotlist {x} color= white width= 1 master= {vdw contact} { CD ARG 62 A}'S' sea -12.8823 1.0476 -8.6949 {"}'S' sea -13.2282 0.8682 -9.3625 {"}'S' sea -13.0671 0.9305 -9.1719 {"}'S' sea -12.9135 1.0557 -9.0076 { HB2 ARG 62 A}'S' sea -12.7375 0.5223 -7.0083 {"}'S' sea -12.6009 0.441 -6.8082 {"}'S' sea -12.5607 0.6046 -7.2127 {"}'S' green -12.4323 0.5038 -7.0175 {"}'S' sea -12.285 0.4608 -6.815 {"}'S' sea -12.3235 0.6797 -7.2934 {"}'S' green -12.1886 0.5849 -7.0926 {"}'S' sea -12.0328 0.5606 -6.8844 {"}'S' sea -12.0863 0.7926 -7.3266 {"}'S' sea -11.9492 0.7175 -7.1272 { HD2 ARG 62 A}'S' sea -13.5977 0.0869 -8.0129 {"}'S' sea -13.4636 0.2669 -7.8894 {"}'S' sea -13.7435 -0.1026 -8.5585 {"}'S' sea -13.5858 -0.0265 -8.3756 {"}'S' green -13.4353 0.1049 -8.2171 {"}'S' green -13.3025 0.2838 -8.0952 {"}'S' sea -13.1939 0.4989 -8.0147 {"}'S' sea -13.8052 0.0037 -9.0345 {"}'S' green -13.6494 -0.0205 -8.8263 {"}'S' green -13.4862 0.0284 -8.6297 {"}'S' green -13.329 0.1468 -8.459 {"}'S' green -13.1899 0.3237 -8.3281 {"}'S' green -13.0799 0.5464 -8.249 {"}'S' sea -13.703 0.2114 -9.2686 {"}'S' green -13.5658 0.1364 -9.0691 {"}'S' green -13.0147 0.6319 -8.4955 {"}'S' sea -12.9607 0.8798 -8.4937 {"}'S' sea -13.5481 0.4343 -9.3607 {"}'S' green -13.4147 0.3316 -9.16 {"}'S' green -13.0048 0.7512 -8.7468 {"}'S' green -13.2898 0.5571 -9.2048 {"}'S' green -13.1294 0.6548 -9.0249 {"}'S' sea -13.2116 0.8065 -9.2215 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HD2 ARG 62 A}'S' P -13.4095 0.1472 -8.8699 {"}'S' -13.4231 0.1639 -8.8633 {"}'S' P -13.2534 0.2426 -8.6954 {"}'S' -13.2858 0.2708 -8.688 {"}'S' P -13.1162 0.4108 -8.5651 {"}'S' -13.1371 0.4231 -8.5639 {"}'S' P -13.2512 0.3602 -8.9567 {"}'S' -13.2804 0.3812 -8.9416 {"}'S' P -13.1005 0.5141 -8.8048 {"}'S' -13.1282 0.527 -8.7976 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 123 A}'M' green -9.6192 2.1904 -7.6555 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 123 A}'M' greentint -9.7464 2.0639 -6.6556 {"}'M' greentint -9.5041 2.4595 -6.4523 {"}'M' greentint -9.6527 2.3026 -6.6008 {"}'M' greentint -9.7565 2.2062 -6.8983 {"}'M' greentint -9.813 1.9567 -6.9015 {"}'M' greentint -9.3549 2.6896 -6.5145 {"}'M' greentint -9.5135 2.5965 -6.6929 {"}'M' greentint -9.6527 2.4285 -6.8261 {"}'M' greentint -9.7261 2.3002 -7.1431 {"}'M' greentint -9.7972 2.0551 -7.1673 {"}'M' greentint -9.3281 2.8205 -6.7743 {"}'M' greentint -9.4829 2.6974 -6.939 {"}'M' greentint -9.6186 2.5199 -7.0652 {"}'M' greentint -9.6482 2.3804 -7.3813 {"}'M' greentint -9.7294 2.1373 -7.4197 {"}'M' greentint -9.2472 2.9166 -7.0121 {"}'M' greentint -9.3995 2.7806 -7.1721 {"}'M' greentint -9.5361 2.599 -7.2969 {"}'M' greentint -9.5337 2.4252 -7.611 {"}'M' greentint -9.2923 2.8193 -7.4086 {"}'M' greentint -9.4231 2.6373 -7.5271 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H ARG 62 A}'M' green -9.8316 1.9157 -7.1295 @dotlist {x} color= sky width= 1 master= {H-bonds} { H ARG 62 A}'M' greentint -9.732 2.0426 -6.6361 {"}'M' greentint -9.5988 2.2182 -6.513 {"}'M' greentint -9.4936 2.4329 -6.4353 {"}'M' greentint -9.671 1.9917 -6.9427 {"}'M' greentint -9.5214 2.137 -6.7903 {"}'M' greentint -9.3969 2.337 -6.6844 {"}'M' greentint -9.3083 2.5746 -6.6364 {"}'M' greentint -9.2638 2.8293 -6.6491 {"}'M' greentint -9.7379 2.0265 -7.3822 {"}'M' greentint -9.5756 2.0714 -7.1843 {"}'M' greentint -9.4214 2.2041 -7.0226 {"}'M' greentint -9.2971 2.4074 -6.9179 {"}'M' greentint -9.2188 2.6531 -6.8858 {"}'M' greentint -9.1979 2.9085 -6.9291 {"}'M' greentint -9.6269 2.21 -7.5527 {"}'M' greentint -9.4659 2.2381 -7.3527 {"}'M' greentint -9.3179 2.39 -7.2038 {"}'M' greentint -9.2231 2.6241 -7.1465 {"}'M' greentint -9.2068 2.8778 -7.1958 {"}'M' greentint -9.4934 2.4278 -7.6062 {"}'M' greentint -9.3335 2.5248 -7.4267 {"}'M' greentint -9.2785 2.778 -7.4265 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 123 A}'M' greentint -10.1683 0.9401 -4.573 {"}'M' greentint -10.3015 0.8365 -4.7725 {"}'M' greentint -9.9824 1.0315 -4.415 {"}'M' greentint -10.0866 1.1867 -4.5929 {"}'M' greentint -10.2466 1.0898 -4.7723 {"}'M' greentint -10.357 0.9904 -5.0526 {"}'M' greentint -9.8214 1.3028 -4.4482 {"}'M' greentint -9.9531 1.4045 -4.6464 {"}'M' greentint -10.1141 1.3765 -4.8464 {"}'M' greentint -10.2622 1.2245 -4.9952 {"}'M' greentint -10.3287 1.0878 -5.3062 {"}'M' greentint -9.6298 1.4796 -4.5121 {"}'M' greentint -9.7647 1.5744 -4.713 {"}'M' greentint -9.9236 1.5776 -4.9189 {"}'M' greentint -10.0838 1.4865 -5.1018 {"}'M' greentint -10.2253 1.316 -5.2374 {"}'M' greentint -9.5162 1.6736 -4.7634 {"}'M' greentint -9.6678 1.7091 -4.9685 {"}'M' greentint -9.8292 1.6699 -5.1664 {"}'M' greentint -9.9858 1.5579 -5.3378 {"}'M' greentint -10.1244 1.3832 -5.4685 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O ARG 62 A}'M' green -9.745 1.159 -4.2905 {"}'M' green -9.5471 1.4271 -4.4265 {"}'M' green -9.4606 1.6496 -4.6341 {"}'M' green -9.4753 1.7758 -4.8795 @dotlist {x} color= red width= 1 master= {H-bonds} { O ARG 62 A}'M' greentint -10.368 0.8359 -5.0068 {"}'M' greentint -10.2108 0.8313 -4.8011 {"}'M' greentint -10.0482 0.887 -4.607 {"}'M' greentint -9.8904 0.9973 -4.4335 {"}'M' greentint -10.2845 1.0138 -5.2647 {"}'M' greentint -10.1365 0.9667 -5.0602 {"}'M' greentint -9.9773 0.9892 -4.8597 {"}'M' greentint -9.8176 1.0778 -4.6787 {"}'M' greentint -9.6708 1.2274 -4.5312 {"}'M' greentint -10.1562 1.2255 -5.4163 {"}'M' greentint -10.0178 1.1487 -5.2147 {"}'M' greentint -9.859 1.1597 -5.0138 {"}'M' greentint -9.702 1.2556 -4.8365 {"}'M' greentint -9.5635 1.4261 -4.705 {"}'M' greentint -10.0165 1.4601 -5.4907 {"}'M' greentint -9.8835 1.3565 -5.2905 {"}'M' greentint -9.7204 1.3857 -5.0879 {"}'M' greentint -9.5706 1.5395 -4.937 {"}'M' greentint -9.7709 1.5863 -5.3257 {"}'M' greentint -9.6122 1.6837 -5.1481 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n his A 113 2nnuA_115Y_133}P -11.32 -1.0276 0.9016 {"}-11.32 -1.0276 0.9016 { ca his A 113 2nnuA_115Y_133}-10.9472 -1.9777 -0.185 { c his A 113 2nnuA_115Y_133}-10.6939 -1.2104 -1.4701 { o his A 113 2nnuA_115Y_133}-11.3295 -1.4512 -2.5076 { c his A 113 2nnuA_115Y_133}P -10.6939 -1.2104 -1.4701 { n gly A 114 2nnuA_115Y_133}-9.761 -0.2848 -1.3513 { ca gly A 114 2nnuA_115Y_133}-9.2994 0.5265 -2.4777 { c gly A 114 2nnuA_115Y_133}-8.4194 -0.2903 -3.3869 { o gly A 114 2nnuA_115Y_133}-7.7327 -1.2207 -2.9399 { c gly A 114 2nnuA_115Y_133}P -8.4194 -0.2903 -3.3869 { n tyr A 115 2nnuA_115Y_133}-8.4752 0.0291 -4.6742 { ca tyr A 115 2nnuA_115Y_133}-7.5575 -0.5864 -5.6358 { c tyr A 115 2nnuA_115Y_133}-7.2914 0.3868 -6.7589 { 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-14.0732 1.7799 -6.8431 { cg2 val A 16 2nyhA_59Y_16V}P -12.454 2.5457 -8.7282 {"}P -12.454 2.5457 -8.7282 {"}P -12.454 2.5457 -8.7282 { cb tyr A 59 2nyhA_59Y_16V}P -8.887 -2.0876 -7.2025 {"}P -8.887 -2.0876 -7.2025 { cd1 tyr A 59 2nyhA_59Y_16V}P -11.3879 -1.9993 -7.1138 { cd2 tyr A 59 2nyhA_59Y_16V}P -10.281 -1.1792 -9.0981 { ce1 tyr A 59 2nyhA_59Y_16V}P -12.6281 -1.7026 -7.6616 { ce2 tyr A 59 2nyhA_59Y_16V}P -11.5247 -0.8669 -9.6782 { oh tyr A 59 2nyhA_59Y_16V}P -13.9259 -0.8629 -9.5023 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 59 A}'S' blue -11.7689 -0.3669 -6.6094 {"}'S' blue -11.4904 -0.3133 -6.6561 {"}'S' sky -11.6423 -0.2861 -6.8597 {"}'S' blue -11.2985 -0.2745 -6.8334 {"}'S' sky -11.4551 -0.2515 -7.0407 {"}'S' blue -11.2762 -0.2571 -7.2375 {"}'S' sky -11.4383 -0.2806 -7.4401 { CE1 TYR 59 A}'S' blue -13.5002 -0.3147 -7.048 {"}'S' blue -13.6615 -0.3525 -7.2462 {"}'S' blue -13.1129 -0.2057 -6.8955 {"}'S' blue -13.2659 -0.1715 -7.1039 {"}'S' blue -13.4269 -0.1865 -7.3069 {"}'S' blue -13.5897 -0.2491 -7.4998 {"}'S' blue -13.7484 -0.3582 -7.6746 {"}'S' sky -12.8613 -0.12 -6.9522 {"}'S' sky -13.0092 -0.0702 -7.1572 {"}'S' blue -13.1651 -0.0647 -7.3613 {"}'S' blue -13.3255 -0.1009 -7.5586 { CE2 TYR 59 A}'S' sky -11.5766 0.0571 -8.1931 {"}'S' sky -11.6484 0.2571 -8.3421 {"}'S' sky -11.7473 0.4228 -8.5167 {"}'S' sky -11.8695 0.5491 -8.7092 {"}'S' sky -12.6449 0.4776 -9.6911 {"}'S' blue -11.3322 0.1377 -8.2586 {"}'S' blue -11.4072 0.3325 -8.4089 {"}'S' blue -11.5048 0.4964 -8.5815 {"}'S' sky -11.6224 0.6255 -8.7699 {"}'S' sky -12.5378 0.5378 -9.9276 {"}'S' sky -11.4847 0.7533 -9.0176 {"}'S' sky -11.9367 0.8332 -9.6246 {"}'S' sky -12.0975 0.7807 -9.817 {"}'S' sky -12.2548 0.6909 -9.9961 {"}'S' blue -12.408 0.5655 -10.1581 {"}'S' blue -11.2885 0.7971 -9.1901 {"}'S' sky -11.4353 0.8579 -9.3978 {"}'S' sky -11.5919 0.8809 -9.6051 {"}'S' blue -11.7535 0.8635 -9.81 {"}'S' blue -11.9174 0.8068 -10.0057 { CZ TYR 59 A}'S' blue -13.6266 -0.2101 -7.7676 {"}'S' sky -13.7678 -0.129 -7.9739 {"}'S' sky -13.9308 -0.1368 -8.1812 {"}'S' blue -13.4801 0.0052 -7.8557 {"}'S' sky -13.6229 0.0717 -8.0592 {"}'S' sky -13.7806 0.0717 -8.2628 {"}'S' blue -13.1592 0.0436 -7.7215 {"}'S' sky -13.2808 0.1656 -7.9138 {"}'S' blue -13.423 0.2359 -8.1157 {"}'S' sky -13.5773 0.2536 -8.3204 {"}'S' blue -13.7386 0.2158 -8.5185 {"}'S' blue -13.343 0.3968 -8.3763 {"}'S' blue -13.2422 0.5037 -8.6337 {"}'S' blue -13.4026 0.4675 -8.831 {"}'S' sky -12.9596 0.5789 -8.6799 {"}'S' sky -13.2591 0.4457 -9.4433 {"}'S' sky -12.2875 0.5406 -8.6429 {"}'S' sky -13.0801 0.4245 -9.6348 {"}'S' sky -11.63 -0.0671 -8.0583 {"}'S' sky -12.8711 0.3846 -9.7877 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 59 A}'S' sea -11.6167 -0.269 -7.2456 { CE1 TYR 59 A}'S' sea -12.4602 -0.1854 -6.8061 {"}'S' green -12.5882 -0.0825 -7.0011 {"}'S' green -12.7306 -0.0166 -7.204 {"}'S' sea -12.8825 0.0106 -7.4075 {"}'S' sea -12.1389 -0.2707 -6.7815 {"}'S' green -12.2576 -0.137 -6.9726 {"}'S' green -12.6954 0.0452 -7.5886 {"}'S' sea -11.9502 -0.2434 -6.9742 {"}'S' green -12.0725 -0.1188 -7.1681 {"}'S' green -11.8645 -0.1656 -7.3192 {"}'S' green -12.0017 -0.0747 -7.5222 {"}'S' sea -11.6545 -0.2645 -7.4487 {"}'S' sea -11.7894 -0.1669 -7.6502 { CE2 TYR 59 A}'S' sea -12.0094 0.63 -8.9121 {"}'S' sea -12.1624 0.6642 -9.1204 {"}'S' sea -12.3235 0.6493 -9.3235 {"}'S' sea -12.4863 0.5866 -9.5163 {"}'S' sea -11.7578 0.7157 -8.9688 {"}'S' sea -11.9057 0.7655 -9.1738 {"}'S' sea -12.0616 0.7711 -9.3779 {"}'S' sea -12.222 0.7349 -9.5751 {"}'S' sea -12.3827 0.6565 -9.7598 {"}'S' sea -11.6271 0.8192 -9.2205 {"}'S' sea -11.779 0.8464 -9.4241 { CZ TYR 59 A}'S' sea -12.9279 0.1554 -7.7726 {"}'S' sea -13.0501 0.2817 -7.965 {"}'S' sea -13.19 0.3626 -8.1679 {"}'S' green -12.5877 0.0651 -7.6647 {"}'S' green -12.6854 0.229 -7.8373 {"}'S' green -12.8029 0.3581 -8.0258 {"}'S' green -12.9383 0.4483 -8.2246 {"}'S' sea -13.0863 0.4981 -8.4296 {"}'S' green -12.5373 0.3829 -8.0785 {"}'S' green -12.6653 0.4859 -8.2735 {"}'S' sea -12.8077 0.5518 -8.4763 {"}'S' sea -13.1173 0.5658 -8.8804 {"}'S' sea -13.2781 0.5132 -9.0729 {"}'S' green -12.3347 0.4313 -8.2449 {"}'S' sea -12.469 0.5297 -8.4459 {"}'S' sea -12.6158 0.5905 -8.6536 {"}'S' sea -12.7725 0.6135 -8.8609 {"}'S' green -12.934 0.5961 -9.0658 {"}'S' green -13.0979 0.5394 -9.2615 {"}'S' green -11.8362 -0.0172 -7.9056 {"}'S' green -11.9223 0.1686 -8.0673 {"}'S' green -12.0273 0.325 -8.2466 {"}'S' sea -12.1496 0.4495 -8.4405 {"}'S' sea -12.4366 0.5936 -8.8502 {"}'S' sea -12.5935 0.6079 -9.0577 {"}'S' green -12.7557 0.5844 -9.2603 {"}'S' green -12.9193 0.523 -9.4545 {"}'S' sea -11.7144 0.1187 -8.2196 {"}'S' sea -12.5468 0.5417 -9.4127 {"}'S' sea -12.7099 0.481 -9.6065 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 TYR 59 A}'S' P -12.392 -0.0386 -7.1736 {"}'S' -12.393 -0.0447 -7.1753 {"}'S' P -12.5388 0.0222 -7.3812 {"}'S' -12.5385 0.0171 -7.3815 {"}'S' P -12.2105 -0.0278 -7.3705 {"}'S' -12.2172 -0.0558 -7.3751 {"}'S' P -12.3595 0.0252 -7.5779 {"}'S' -12.3618 0.0079 -7.5787 { CZ TYR 59 A}'S' P -12.3313 0.0762 -7.7269 {"}'S' -12.3344 0.0654 -7.7389 {"}'S' P -12.4246 0.2452 -7.8948 {"}'S' -12.4282 0.2234 -7.9117 {"}'S' P -12.1159 0.1312 -7.8791 {"}'S' -12.1223 0.1179 -7.8899 {"}'S' P -12.216 0.2977 -8.0539 {"}'S' -12.2208 0.2816 -8.0637 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 59 A}'S' blue -14.4526 -0.1788 -8.3995 {"}'S' sky -14.5543 -0.0234 -8.5757 {"}'S' blue -14.1798 -0.1851 -8.3038 {"}'S' sky -14.2569 0.0071 -8.4564 {"}'S' sky -14.3678 0.1477 -8.6402 {"}'S' blue -14.507 0.2261 -8.8414 {"}'S' sky -14.0204 0.1059 -8.4958 {"}'S' sky -14.132 0.2508 -8.6797 {"}'S' blue -14.2669 0.3442 -8.8803 {"}'S' blue -13.896 0.3238 -8.76 {"}'S' blue -13.5393 0.4352 -9.149 {"}'S' sky -13.6808 0.5068 -9.3518 {"}'S' blue -13.834 0.533 -9.5569 {"}'S' sky -13.4739 0.4625 -9.5015 {"}'S' blue -13.627 0.4901 -9.7069 {"}'S' blue -13.4175 0.3992 -9.832 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 16 A}'S' blue -13.0444 0.3505 -7.1989 {"}'S' blue -13.3581 0.7365 -8.1464 {"}'S' sky -13.2532 0.5787 -7.9669 {"}'S' sky -13.1313 0.4534 -7.7734 {"}'S' sky -12.9938 0.3615 -7.5714 {"}'S' blue -13.2005 0.856 -8.4043 {"}'S' sky -12.9483 0.8291 -8.4857 {"}'S' sky -12.0556 0.7855 -8.3852 { CG1 VAL 16 A}'S' blue -13.8234 0.0678 -7.1037 {"}'S' blue -13.6658 0.0795 -6.9029 {"}'S' blue -13.7631 0.166 -7.4436 {"}'S' blue -13.6104 0.1391 -7.2389 {"}'S' blue -13.4513 0.1559 -7.0374 {"}'S' blue -13.2899 0.2148 -6.8455 {"}'S' blue -13.6644 0.3201 -7.7181 {"}'S' blue -13.518 0.2613 -7.5113 {"}'S' blue -13.3602 0.2496 -7.305 {"}'S' blue -13.198 0.2876 -7.1057 {"}'S' blue -13.5572 0.5315 -7.9547 {"}'S' sky -13.4245 0.4355 -7.7565 {"}'S' blue -13.2742 0.3935 -7.5519 { CG2 VAL 16 A}'S' sky -12.9268 0.8623 -8.6536 {"}'S' blue -12.1378 0.8413 -8.4915 {"}'S' sky -11.8862 0.8956 -8.5958 {"}'S' sky -11.6707 0.9806 -8.7307 {"}'S' sky -12.0451 1.0859 -9.6032 {"}'S' sky -11.5788 1.0534 -8.9909 {"}'S' sky -11.8052 1.2013 -9.6417 {"}'S' sky -11.655 1.1592 -9.437 {"}'S' sky -11.4965 1.1712 -9.2351 { HB VAL 16 A}'S' sky -12.8974 0.2567 -7.2653 {"}'S' sky -11.9356 -0.0097 -6.7905 {"}'S' sky -11.676 0.0133 -6.8921 {"}'S' sky -11.5139 0.0357 -7.0995 {"}'S' blue -11.3635 0.1671 -6.941 {"}'S' sky -11.5776 0.0417 -7.5502 {"}'S' blue -11.4144 0.0906 -7.3536 {"}'S' sky -11.7888 0.6377 -8.2962 {"}'S' sky -11.6312 0.2736 -7.9925 {"}'S' blue -11.494 0.1986 -7.793 {"}'S' blue -11.5441 0.705 -8.23 {"}'S' sky -11.4763 0.4965 -8.0846 {HG11 VAL 16 A}'S' blue -14.7057 0.2664 -8.372 {"}'S' blue -14.6031 0.1136 -8.1969 {"}'S' blue -14.4747 0.0128 -8.0018 {"}'S' blue -14.534 0.5564 -8.5982 {"}'S' sky -14.4695 0.3475 -8.4556 {"}'S' sky -14.3658 0.1887 -8.2777 {"}'S' sky -14.2309 0.0939 -8.0768 {"}'S' blue -14.0752 0.0696 -7.8686 {"}'S' blue -13.9119 0.1186 -7.672 {"}'S' blue -14.2864 0.6656 -8.6146 {"}'S' sky -14.2313 0.4543 -8.486 {"}'S' sky -14.1287 0.3016 -8.3109 {"}'S' sky -13.9916 0.2265 -8.1114 {"}'S' sky -13.8352 0.2373 -7.9122 {"}'S' blue -13.9739 0.5245 -8.403 {"}'S' sky -13.8405 0.4217 -8.2023 {"}'S' sky -13.6769 0.4503 -7.999 {"}'S' blue -13.7155 0.6472 -8.2471 {HG21 VAL 16 A}'S' blue -13.6708 0.9296 -9.2382 {"}'S' blue -13.3662 0.9045 -8.8365 {"}'S' blue -13.591 0.8657 -9.5264 {"}'S' sky -13.4537 0.7842 -9.3269 {"}'S' sky -12.9839 0.8755 -8.7449 {"}'S' blue -13.43 0.8245 -9.7394 {"}'S' sky -13.2993 0.7301 -9.5444 {"}'S' blue -13.1845 0.778 -9.8411 {"}'S' blue -12.8793 0.7595 -9.8503 {"}'S' sky -12.6356 0.8406 -9.9253 {"}'S' sky -12.3962 0.9732 -9.96 {"}'S' blue -12.0816 1.197 -9.8476 @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 16 A}'S' sea -13.1096 0.6762 -8.2373 {"}'S' sea -12.9998 0.5271 -8.0531 {"}'S' green -12.873 0.4114 -7.8569 {"}'S' sea -12.8554 0.6593 -8.3183 {"}'S' green -12.7436 0.52 -8.1354 {"}'S' sea -12.6399 0.7428 -8.4529 {"}'S' green -12.5304 0.5968 -8.2717 {"}'S' sea -12.294 0.6794 -8.3468 { CG2 VAL 16 A}'S' sea -12.7275 0.8195 -8.8192 {"}'S' sea -12.5703 0.8032 -8.6108 {"}'S' sea -12.461 0.8039 -8.8991 {"}'S' sea -12.3016 0.8032 -8.6913 {"}'S' sea -12.2042 0.8335 -8.9889 {"}'S' sea -12.0466 0.8453 -8.7881 {"}'S' sea -12.1439 0.9318 -9.3287 {"}'S' sea -11.9911 0.9048 -9.1241 {"}'S' sea -11.8321 0.9217 -8.9225 {"}'S' sea -11.8987 1.0271 -9.3965 {"}'S' sea -11.7409 1.0154 -9.1901 { HB VAL 16 A}'S' sea -12.7686 0.155 -7.0712 {"}'S' sea -12.6213 0.112 -6.8686 {"}'S' sea -12.8042 0.2228 -7.5454 {"}'S' green -12.6888 0.0911 -7.3594 {"}'S' green -12.5514 0.0096 -7.1599 {"}'S' green -12.3995 -0.0162 -6.9566 {"}'S' sea -12.2401 0.0143 -6.7594 {"}'S' green -12.7177 0.3729 -7.9075 {"}'S' green -12.6365 0.1905 -7.7515 {"}'S' green -12.5278 0.0498 -7.5725 {"}'S' green -12.0942 -0.0742 -6.9772 {"}'S' green -11.9934 -0.1029 -7.2703 {"}'S' sea -11.834 -0.0725 -7.0731 {"}'S' green -12.2792 0.4348 -8.199 {"}'S' green -11.9771 -0.0151 -7.6834 {"}'S' green -11.8298 -0.0581 -7.4808 {"}'S' sea -11.6717 -0.0404 -7.2823 {"}'S' sea -12.0364 0.5284 -8.2798 {"}'S' green -11.972 0.3195 -8.1372 {"}'S' green -11.8683 0.1608 -7.9593 {"}'S' sea -11.7334 0.0659 -7.7584 {"}'S' sea -11.7338 0.4264 -8.1675 {HG21 VAL 16 A}'S' sea -13.3017 0.7585 -9.1236 {"}'S' sea -13.1423 0.7889 -8.9264 {"}'S' sea -13.152 0.6884 -9.3421 {"}'S' green -12.9965 0.7004 -9.1442 {"}'S' sea -12.8378 0.7649 -8.9575 {"}'S' sea -13.048 0.6967 -9.641 {"}'S' green -12.8956 0.6717 -9.4373 {"}'S' green -12.7362 0.7022 -9.24 {"}'S' sea -12.5782 0.7879 -9.0591 {"}'S' sea -12.7321 0.7165 -9.6478 {"}'S' sea -12.5743 0.7335 -9.4497 {"}'S' sea -12.4162 0.8103 -9.2665 {"}'S' sea -12.4798 0.8163 -9.7172 {"}'S' sea -12.3166 0.8653 -9.5206 {"}'S' sea -12.2399 0.984 -9.7607 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 16 A}'S' P -12.3971 -0.0445 -7.3774 {"}'S' -12.3896 -0.0198 -7.3746 {"}'S' P -12.2498 -0.0862 -7.1751 {"}'S' -12.2486 -0.0763 -7.1758 {"}'S' P -12.4861 0.3113 -8.023 {"}'S' -12.4816 0.3201 -8.0136 {"}'S' P -12.3985 0.1352 -7.8595 {"}'S' -12.3896 0.1587 -7.8442 {"}'S' P -12.2823 0.0034 -7.6741 {"}'S' -12.2817 0.0073 -7.6725 {"}'S' P -12.1458 -0.078 -7.474 {"}'S' -12.1441 -0.0557 -7.47 {"}'S' P -12.2081 0.2385 -8.0536 {"}'S' -12.2052 0.255 -8.038 {"}'S' P -12.1055 0.0857 -7.8785 {"}'S' -12.105 0.0973 -7.8701 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 59 A}'M' greentint -9.5991 1.8648 -6.6617 {"}'M' greentint -9.7477 1.7079 -6.8102 {"}'M' greentint -9.8514 1.6115 -7.1077 {"}'M' greentint -9.2919 2.1033 -6.5219 {"}'M' greentint -9.4499 2.095 -6.7239 {"}'M' greentint -9.6085 2.0018 -6.9023 {"}'M' greentint -9.7477 1.8338 -7.0354 {"}'M' greentint -9.821 1.7056 -7.3525 {"}'M' greentint -9.2629 2.2841 -6.7917 {"}'M' greentint -9.4231 2.2258 -6.9837 {"}'M' greentint -9.5779 2.1028 -7.1484 {"}'M' greentint -9.7136 1.9252 -7.2745 {"}'M' greentint -9.7431 1.7858 -7.5907 {"}'M' greentint -9.1801 2.4041 -7.0358 {"}'M' greentint -9.3422 2.3219 -7.2215 {"}'M' greentint -9.4944 2.1859 -7.3814 {"}'M' greentint -9.6311 2.0044 -7.5062 {"}'M' greentint -9.0853 2.4669 -7.2948 {"}'M' greentint -9.2411 2.3681 -7.4681 {"}'M' greentint -9.3873 2.2246 -7.618 {"}'M' greentint -9.518 2.0426 -7.7364 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 16 A}'M' greentint -9.881 1.468 -7.0487 {"}'M' greentint -9.7228 1.5317 -6.8624 {"}'M' greentint -9.5726 1.6562 -6.7026 {"}'M' greentint -9.4394 1.8318 -6.5795 {"}'M' greentint -9.3342 2.0464 -6.5017 {"}'M' greentint -9.8304 1.527 -7.3997 {"}'M' greentint -9.6722 1.5292 -7.196 {"}'M' greentint -9.5116 1.6052 -7.0091 {"}'M' greentint -9.362 1.7506 -6.8567 {"}'M' greentint -9.2375 1.9505 -6.7509 {"}'M' greentint -9.1489 2.1881 -6.7029 {"}'M' greentint -9.7273 1.6897 -7.6548 {"}'M' greentint -9.5785 1.6401 -7.4487 {"}'M' greentint -9.4162 1.685 -7.2507 {"}'M' greentint -9.262 1.8176 -7.089 {"}'M' greentint -9.1377 2.0209 -6.9844 {"}'M' greentint -9.0594 2.2666 -6.9523 {"}'M' greentint -9.4675 1.8235 -7.6191 {"}'M' greentint -9.3065 1.8516 -7.4191 {"}'M' greentint -9.1585 2.0036 -7.2703 {"}'M' greentint -9.0637 2.2377 -7.2129 {"}'M' greentint -9.334 2.0414 -7.6726 {"}'M' greentint -9.1741 2.1383 -7.4932 {"}'M' greentint -9.1191 2.3916 -7.493 {"}'M' greentint -9.2524 2.288 -7.6925 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 59 A}'M' -9.8888 0.9872 -5.0323 {"}'M' -10.497 0.6967 -5.7374 @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 59 A}'M' green -10.5409 0.2537 -4.8419 {"}'M' sea -10.6742 0.15 -5.0414 {"}'M' green -10.3551 0.3451 -4.6839 {"}'M' green -10.7296 0.304 -5.3215 {"}'M' sea -10.1274 0.4111 -4.5741 {"}'M' green -10.194 0.6163 -4.7171 {"}'M' sea -10.7013 0.4014 -5.5751 {"}'M' sea -10.0025 0.7931 -4.781 {"}'M' green -10.1374 0.888 -4.9819 {"}'M' green -10.4565 0.8 -5.3707 {"}'M' green -10.5979 0.6295 -5.5063 {"}'M' sea -10.0405 1.0227 -5.2374 {"}'M' sea -10.2018 0.9835 -5.4353 {"}'M' sea -10.3584 0.8714 -5.6067 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 59 A}'M' greentint -10.4593 0.5002 -4.8618 {"}'M' greentint -10.6192 0.4033 -5.0412 {"}'M' greentint -10.3258 0.7181 -4.9153 {"}'M' greentint -10.4868 0.69 -5.1153 {"}'M' greentint -10.6348 0.5381 -5.2641 {"}'M' greentint -10.2962 0.8911 -5.1878 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 16 A}'M' sky -10.4993 1.1117 -5.5568 {"}'M' sky -10.3214 1.2044 -5.3929 @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 16 A}'M' sea -10.8351 0.2015 -4.8544 {"}'M' sea -10.6725 0.2572 -4.6602 {"}'M' sea -10.9087 0.3839 -5.3179 {"}'M' green -10.7607 0.3369 -5.1135 {"}'M' green -10.6015 0.3594 -4.913 {"}'M' green -10.4418 0.4479 -4.732 {"}'M' green -10.2951 0.5975 -4.5844 {"}'M' green -10.7804 0.5957 -5.4695 {"}'M' green -10.1877 0.7963 -4.7582 {"}'M' sea -10.0848 1.0198 -4.6873 {"}'M' sea -10.6407 0.8303 -5.544 {"}'M' green -10.1948 0.9096 -4.9903 {"}'M' sea -10.0995 1.1459 -4.9328 {"}'M' green -10.3951 0.9565 -5.3789 {"}'M' green -10.2364 1.0539 -5.2013 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 16 A}'M' greentint -10.6421 0.5189 -5.268 {"}'M' greentint -10.4832 0.5299 -5.0671 {"}'M' greentint -10.3262 0.6257 -4.8897 {"}'M' greentint -10.5078 0.7267 -5.3437 {"}'M' greentint -10.3446 0.7559 -5.1411 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ala A 46 2o1qA_112F_48F}P -8.0295 5.6598 -12.6162 {"}-8.0295 5.6598 -12.6162 { ca ala A 46 2o1qA_112F_48F}-8.8664 6.0469 -11.5022 { c ala A 46 2o1qA_112F_48F}-8.5164 5.2143 -10.3143 { o ala A 46 2o1qA_112F_48F}-7.871 4.1167 -10.4547 { c ala A 46 2o1qA_112F_48F}P -8.5164 5.2143 -10.3143 { n ile A 47 2o1qA_112F_48F}-8.9161 5.7013 -9.1227 { ca ile A 47 2o1qA_112F_48F}-8.8133 4.9142 -7.8764 { c ile A 47 2o1qA_112F_48F}-10.195 4.832 -7.2648 { o ile A 47 2o1qA_112F_48F}-11.0446 5.7052 -7.5095 { c ile A 47 2o1qA_112F_48F}P -10.195 4.832 -7.2648 { n phe A 48 2o1qA_112F_48F}-10.468 3.6867 -6.6622 { ca phe A 48 2o1qA_112F_48F}-11.7673 3.3329 -6.1153 { c phe A 48 2o1qA_112F_48F}-11.6789 2.9243 -4.6623 { o phe A 48 2o1qA_112F_48F}-10.7397 2.2321 -4.2613 { c phe A 48 2o1qA_112F_48F}P -11.6789 2.9243 -4.6623 { n asp A 49 2o1qA_112F_48F}-12.7115 3.318 -3.9472 { ca asp A 49 2o1qA_112F_48F}-12.8974 3.0349 -2.52 { c asp A 49 2o1qA_112F_48F}-14.1887 2.2436 -2.4553 { o asp A 49 2o1qA_112F_48F}-15.2541 2.7668 -2.7527 { c asp A 49 2o1qA_112F_48F}P -14.1887 2.2436 -2.4553 { n cys A 50 2o1qA_112F_48F}-14.1013 0.9896 -2.0411 { ca cys A 50 2o1qA_112F_48F}-15.1837 0.0668 -2.2179 { c cys A 50 2o1qA_112F_48F}-15.5384 -0.5711 -0.9114 { o cys A 50 2o1qA_112F_48F}-14.7627 -1.3515 -0.3771 { n ser A 110 2o1qA_112F_48F}P -12.2109 -2.1647 0.4083 {"}-12.2109 -2.1647 0.4083 { ca ser A 110 2o1qA_112F_48F}-11.0469 -2.21 -0.47 { c ser A 110 2o1qA_112F_48F}-10.7215 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{"}'S' P -11.9557 0.2219 -7.199 {"}'S' -11.9282 0.3522 -7.1449 {"}'S' P -11.8192 0.1405 -6.9989 {"}'S' -11.8065 0.292 -6.9684 {"}'S' P -11.6668 0.1155 -6.7952 {"}'S' -11.6727 0.2328 -6.7924 {"}'S' P -11.5074 0.146 -6.598 {"}'S' -11.5152 0.1854 -6.604 {"}'S' P -11.3494 0.2317 -6.417 {"}'S' -11.3505 0.2352 -6.4176 {"}'S' P -11.8816 0.4569 -7.5785 {"}'S' -11.8755 0.492 -7.5441 {"}'S' P -11.779 0.3041 -7.4034 {"}'S' -11.7737 0.4067 -7.3358 {"}'S' P -11.6505 0.2034 -7.2083 {"}'S' -11.6606 0.3432 -7.1514 {"}'S' P -11.5033 0.1603 -7.0057 {"}'S' -11.528 0.2841 -6.9789 {"}'S' P -11.3455 0.1773 -6.8077 {"}'S' -11.3652 0.2352 -6.8051 {"}'S' P -11.1874 0.2541 -6.6244 {"}'S' -11.2036 0.2856 -6.6281 {"}'S' P -11.6454 0.538 -7.6621 {"}'S' -11.6457 0.5389 -7.6611 {"}'S' P -11.5417 0.3792 -7.4842 {"}'S' -11.5535 0.4372 -7.4383 {"}'S' P -11.4068 0.2844 -7.2833 {"}'S' -11.4322 0.3658 -7.2408 {"}'S' P -11.251 0.2602 -7.0751 {"}'S' -11.2747 0.312 -7.0595 {"}'S' P -11.0878 0.3091 -6.8785 {"}'S' -11.0994 0.3271 -6.8763 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 112 A}'M' greentint -9.5893 2.1737 -6.2557 {"}'M' greentint -9.7483 2.085 -6.4373 {"}'M' greentint -9.352 2.3064 -6.1035 {"}'M' greentint -9.4863 2.4062 -6.3047 {"}'M' greentint -9.6496 2.3728 -6.5066 {"}'M' greentint -9.7982 2.2159 -6.6551 {"}'M' greentint -9.9019 2.1196 -6.9525 {"}'M' greentint -9.2045 2.532 -6.1671 {"}'M' greentint -9.3424 2.6113 -6.3667 {"}'M' greentint -9.5003 2.603 -6.5687 {"}'M' greentint -9.6589 2.5098 -6.7471 {"}'M' greentint -9.7982 2.3419 -6.8803 {"}'M' greentint -9.0181 2.7031 -6.2315 {"}'M' greentint -9.1572 2.7814 -6.4327 {"}'M' greentint -9.3133 2.7921 -6.6366 {"}'M' greentint -9.4735 2.7339 -6.8286 {"}'M' greentint -9.6283 2.6108 -6.9932 {"}'M' greentint -9.764 2.4332 -7.1194 {"}'M' greentint -8.9172 2.8996 -6.4717 {"}'M' greentint -9.0701 2.9355 -6.6786 {"}'M' greentint -9.2302 2.9115 -6.88 {"}'M' greentint -9.3927 2.8299 -7.0663 {"}'M' greentint -9.5449 2.694 -7.2263 {"}'M' greentint -9.6816 2.5124 -7.3511 {"}'M' greentint -8.8214 3.0269 -6.7475 {"}'M' greentint -8.9766 3.026 -6.9475 {"}'M' greentint -9.1358 2.9749 -7.1396 {"}'M' greentint -9.2916 2.8762 -7.313 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 48 A}'M' greentint -9.7852 1.9823 -6.6967 {"}'M' greentint -9.6308 1.9816 -6.4976 {"}'M' greentint -9.4726 2.0453 -6.3113 {"}'M' greentint -9.3224 2.1698 -6.1515 {"}'M' greentint -9.1893 2.3454 -6.0284 {"}'M' greentint -9.8342 2.2556 -7.2362 {"}'M' greentint -9.7216 2.1136 -7.0517 {"}'M' greentint -9.5802 2.0406 -6.8487 {"}'M' greentint -9.4221 2.0428 -6.6449 {"}'M' greentint -9.2614 2.1188 -6.458 {"}'M' greentint -9.1119 2.2642 -6.3056 {"}'M' greentint -8.9873 2.4641 -6.1998 {"}'M' greentint -9.5932 2.3403 -7.2919 {"}'M' greentint -9.4771 2.2033 -7.1037 {"}'M' greentint -9.3284 2.1537 -6.8976 {"}'M' greentint -9.166 2.1986 -6.6996 {"}'M' greentint -9.0118 2.3312 -6.5379 {"}'M' greentint -8.8876 2.5345 -6.4333 {"}'M' greentint -8.8093 2.7802 -6.4012 {"}'M' greentint -9.4158 2.6442 -7.4093 {"}'M' greentint -9.3491 2.4389 -7.2662 {"}'M' greentint -9.2174 2.3371 -7.068 {"}'M' greentint -9.0564 2.3652 -6.868 {"}'M' greentint -8.9083 2.5172 -6.7192 {"}'M' greentint -8.8135 2.7513 -6.6618 {"}'M' greentint -8.7972 3.005 -6.7112 {"}'M' greentint -9.1881 2.7102 -7.2994 {"}'M' greentint -9.0839 2.555 -7.1215 {"}'M' greentint -8.9239 2.6519 -6.9421 {"}'M' greentint -8.869 2.9052 -6.9419 {"}'M' greentint -9.0022 2.8016 -7.1414 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 112 A}'M' green -10.0508 0.9879 -4.3361 {"}'M' green -10.184 0.8843 -4.5356 {"}'M' green -9.8649 1.0793 -4.1782 {"}'M' green -10.2394 1.0382 -4.8157 {"}'M' green -10.2112 1.1356 -5.0693 {"}'M' green -9.5123 1.5273 -4.2753 {"}'M' green -9.3986 1.7214 -4.5265 {"}'M' green -10.0068 1.431 -5.2316 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 112 A}'M' greentint -9.9691 1.2345 -4.356 {"}'M' greentint -10.1291 1.1376 -4.5354 {"}'M' greentint -9.7038 1.3506 -4.2114 {"}'M' greentint -9.8356 1.4523 -4.4095 {"}'M' greentint -9.9966 1.4243 -4.6095 {"}'M' greentint -10.1446 1.2723 -4.7584 {"}'M' greentint -9.6472 1.6222 -4.4762 {"}'M' greentint -9.8061 1.6253 -4.6821 {"}'M' greentint -9.9663 1.5343 -4.8649 {"}'M' greentint -10.1077 1.3638 -5.0005 {"}'M' greentint -9.5503 1.7569 -4.7316 {"}'M' greentint -9.7116 1.7177 -4.9295 {"}'M' greentint -9.8682 1.6057 -5.1009 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O PHE 48 A}'M' green -10.3187 0.9988 -4.7732 {"}'M' green -9.6957 1.3219 -4.0569 {"}'M' green -10.2351 1.1767 -5.0311 {"}'M' green -9.4978 1.59 -4.1928 {"}'M' green -10.1068 1.3884 -5.1826 {"}'M' green -9.4112 1.8125 -4.4005 {"}'M' green -9.9671 1.623 -5.2571 {"}'M' green -9.7215 1.7492 -5.0921 {"}'M' green -9.5628 1.8466 -4.9145 @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 48 A}'M' greentint -10.1615 0.9942 -4.5675 {"}'M' greentint -9.9989 1.0499 -4.3734 {"}'M' greentint -9.841 1.1602 -4.1999 {"}'M' greentint -10.0871 1.1296 -4.8266 {"}'M' greentint -9.9279 1.1521 -4.6261 {"}'M' greentint -9.7682 1.2406 -4.4451 {"}'M' greentint -9.6215 1.3902 -4.2975 {"}'M' greentint -9.9685 1.3116 -4.9811 {"}'M' greentint -9.8097 1.3226 -4.7802 {"}'M' greentint -9.6526 1.4185 -4.6029 {"}'M' greentint -9.5142 1.589 -4.4713 {"}'M' greentint -9.8342 1.5194 -5.0569 {"}'M' greentint -9.671 1.5486 -4.8542 {"}'M' greentint -9.5213 1.7024 -4.7034 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n arg A 395 2o36A_411F_397}P -6.5868 6.0553 -11.818 {"}-6.5868 6.0553 -11.818 { ca arg A 395 2o36A_411F_397}-7.8359 6.3216 -11.1134 { c arg A 395 2o36A_411F_397}-7.9317 5.449 -9.866 { o arg A 395 2o36A_411F_397}-7.6286 4.2591 -9.9183 { c arg A 395 2o36A_411F_397}P -7.9317 5.449 -9.866 { n leu A 396 2o36A_411F_397}-8.3503 6.0449 -8.7526 { ca leu A 396 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{"}-12.2074 -2.4283 0.5911 { ca gly A 409 2o36A_411F_397}-10.834 -2.1876 0.185 { c gly A 409 2o36A_411F_397}-10.7687 -1.1079 -0.8813 { o gly A 409 2o36A_411F_397}-11.7854 -0.4907 -1.2036 { c gly A 409 2o36A_411F_397}P -10.7687 -1.1079 -0.8813 { n lys A 410 2o36A_411F_397}-9.5826 -0.8839 -1.4388 { ca lys A 410 2o36A_411F_397}-9.3949 0.1323 -2.4755 { c lys A 410 2o36A_411F_397}-8.5171 -0.4093 -3.5974 { o lys A 410 2o36A_411F_397}-7.6716 -1.275 -3.3669 { c lys A 410 2o36A_411F_397}P -8.5171 -0.4093 -3.5974 { n phe A 411 2o36A_411F_397}-8.7093 0.0985 -4.8116 { ca phe A 411 2o36A_411F_397}-7.8921 -0.3542 -5.9291 { c phe A 411 2o36A_411F_397}-7.6525 0.7352 -6.9628 { o phe A 411 2o36A_411F_397}-8.5212 1.5684 -7.2124 { c phe A 411 2o36A_411F_397}P -7.6525 0.7352 -6.9628 { n tyr A 412 2o36A_411F_397}-6.4594 0.724 -7.5527 { ca tyr A 412 2o36A_411F_397}-6.0973 1.6867 -8.5831 { c tyr A 412 2o36A_411F_397}-6.1296 1.0099 -9.9424 { o tyr A 412 2o36A_411F_397}-5.8158 -0.1712 -10.0573 { c tyr A 412 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{"}'M' greentint -9.7833 1.3744 -5.2567 {"}'M' greentint -9.6335 1.5281 -5.1059 {"}'M' greentint -9.5382 1.7644 -5.0484 {"}'M' greentint -9.6751 1.6723 -5.317 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n gln A 275 2o4vA_298Y_277}P -7.7174 5.5495 -12.6037 {"}-7.7174 5.5495 -12.6037 { ca gln A 275 2o4vA_298Y_277}-8.9494 5.5246 -11.8296 { c gln A 275 2o4vA_298Y_277}-8.7811 4.6912 -10.5634 { o gln A 275 2o4vA_298Y_277}-7.9852 3.7474 -10.5214 { c gln A 275 2o4vA_298Y_277}P -8.7811 4.6912 -10.5634 { n ala A 276 2o4vA_298Y_277}-9.511 5.0795 -9.5256 { ca ala A 276 2o4vA_298Y_277}-9.4307 4.4204 -8.2298 { c ala A 276 2o4vA_298Y_277}-10.7333 4.5652 -7.468 { o ala A 276 2o4vA_298Y_277}-11.4284 5.5702 -7.6084 { c ala A 276 2o4vA_298Y_277}P -10.7333 4.5652 -7.468 { n glu A 277 2o4vA_298Y_277}-11.0422 3.5617 -6.6495 { ca glu A 277 2o4vA_298Y_277}-12.2072 3.5964 -5.7856 { c glu A 277 2o4vA_298Y_277}-11.8072 3.0371 -4.4465 { o glu A 277 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white width= 1 master= {vdw contact} { CD1 TYR 298 A}'S' blue -12.5404 0.267 -6.8242 {"}'S' sky -12.3083 0.4065 -6.6601 {"}'S' blue -12.0674 0.4862 -6.5285 {"}'S' sky -11.9073 0.7359 -6.6076 {"}'S' blue -11.7053 0.901 -6.6632 {"}'S' sky -11.7361 1.2201 -7.1095 { CE1 TYR 298 A}'S' sky -13.6387 0.8641 -9.3707 {"}'S' sky -12.1681 1.9832 -7.782 {"}'S' sky -12.3036 2.0734 -7.9808 {"}'S' sky -13.0836 1.8955 -8.9397 {"}'S' sky -13.2292 1.7413 -9.0847 {"}'S' sky -13.4356 1.1366 -9.574 {"}'S' blue -13.5088 0.8931 -9.6014 {"}'S' blue -12.3248 2.204 -8.4361 {"}'S' sky -12.4825 2.1909 -8.6367 {"}'S' blue -12.6433 2.1383 -8.8291 { CZ TYR 298 A}'S' blue -13.3086 1.1527 -9.7475 {"}'S' blue -12.484 2.241 -8.9851 {"}'S' blue -12.6417 2.241 -9.1887 {"}'S' blue -12.1418 2.3349 -8.8397 {"}'S' blue -12.2841 2.4053 -9.0416 {"}'S' blue -12.4384 2.423 -9.2463 { HE1 TYR 298 A}'S' sky -13.5016 0.7395 -7.4853 @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 TYR 298 A}'S' sea -12.4456 0.5077 -6.8657 {"}'S' sea -12.1727 0.6474 -6.7092 {"}'S' green -12.3139 0.7284 -6.9156 {"}'S' sea -12.0262 0.8627 -6.7973 {"}'S' sea -11.8269 1.023 -6.8554 { CE1 TYR 298 A}'S' green -13.0698 0.7043 -7.2699 {"}'S' green -13.133 1.4961 -7.7302 {"}'S' green -12.6168 0.6052 -7.0314 {"}'S' green -12.9881 1.6968 -7.8155 {"}'S' green -13.1458 1.6967 -8.019 {"}'S' green -13.3066 1.6325 -8.2087 {"}'S' green -12.3302 0.8177 -6.9907 {"}'S' green -12.646 1.7906 -7.67 {"}'S' green -12.7883 1.861 -7.872 {"}'S' green -12.9425 1.8787 -8.0766 {"}'S' green -13.1038 1.8409 -8.2748 {"}'S' green -13.2624 1.7502 -8.4554 {"}'S' green -13.413 1.6108 -8.6106 {"}'S' sea -13.5871 1.2794 -9.0618 {"}'S' green -12.0778 1.1877 -7.0856 {"}'S' green -12.2931 1.7805 -7.5288 {"}'S' green -12.4153 1.9068 -7.7213 {"}'S' sea -12.5552 1.9877 -7.9241 {"}'S' green -12.7082 2.0219 -8.1325 {"}'S' green -12.8692 2.0069 -8.3355 {"}'S' green -13.032 1.9443 -8.5284 {"}'S' sea -13.1907 1.8353 -8.7032 {"}'S' green -13.34 1.6837 -8.8539 {"}'S' green 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{"}'S' -12.8262 0.7768 -7.1535 {"}'S' P -12.8313 1.0326 -7.2102 {"}'S' -12.7918 1.0048 -7.2867 {"}'S' P -12.8866 1.2539 -7.3431 {"}'S' -12.8352 1.2062 -7.4279 {"}'S' P -12.9918 1.415 -7.5238 {"}'S' -12.9579 1.3817 -7.5655 {"}'S' P -12.5828 0.8583 -7.0582 {"}'S' -12.572 0.851 -7.0912 {"}'S' P -12.5899 1.1037 -7.1358 {"}'S' -12.5597 1.0668 -7.2279 {"}'S' P -12.6393 1.3235 -7.2604 {"}'S' -12.5971 1.262 -7.3663 {"}'S' P -12.7264 1.5036 -7.4222 {"}'S' -12.6868 1.4435 -7.4978 {"}'S' P -12.8453 1.6303 -7.6119 {"}'S' -12.8298 1.6078 -7.6334 {"}'S' P -12.3288 1.0664 -7.0574 {"}'S' -12.3224 1.0516 -7.1001 {"}'S' P -12.3623 1.2983 -7.1647 {"}'S' -12.3477 1.2585 -7.2399 {"}'S' P -12.4277 1.5015 -7.3074 {"}'S' -12.4101 1.451 -7.3778 {"}'S' P -12.5244 1.6686 -7.4777 {"}'S' -12.5113 1.6332 -7.5149 {"}'S' P -12.1223 1.4148 -7.2051 {"}'S' -12.1215 1.4096 -7.213 {"}'S' P -12.1942 1.6148 -7.3541 {"}'S' -12.1944 1.611 -7.3587 { HE1 TYR 298 A}'S' P -13.9763 0.9853 -8.0023 {"}'S' -13.9727 0.9842 -8.004 {"}'S' P -14.0867 0.8859 -8.2826 {"}'S' -14.079 0.8847 -8.2838 {"}'S' P -13.6829 1.3001 -7.8764 {"}'S' -13.6802 1.2973 -7.8789 {"}'S' P -13.8439 1.272 -8.0764 {"}'S' -13.7888 1.2253 -8.1015 {"}'S' P -13.9919 1.12 -8.2253 {"}'S' -13.9239 1.0853 -8.2389 {"}'S' P -14.0584 0.9834 -8.5362 {"}'S' -14.0248 0.9724 -8.5321 {"}'S' P -13.6533 1.4731 -8.149 {"}'S' -13.616 1.4161 -8.1669 {"}'S' P -13.8136 1.382 -8.3318 {"}'S' -13.7355 1.3019 -8.3401 {"}'S' P -13.955 1.2115 -8.4674 {"}'S' -13.8721 1.1577 -8.4614 {"}'S' P -13.9616 1.0576 -8.7762 {"}'S' -13.9502 1.0525 -8.7715 {"}'S' P -13.5589 1.5655 -8.3964 {"}'S' -13.5333 1.5134 -8.3974 {"}'S' P -13.7155 1.4534 -8.5678 {"}'S' -13.6644 1.3854 -8.5541 {"}'S' P -13.8541 1.2787 -8.6986 {"}'S' -13.8028 1.2363 -8.6785 {"}'S' P -13.5778 1.4674 -8.793 {"}'S' -13.5739 1.4607 -8.7895 @dotlist {x} color= red width= 1 master= {vdw contact} { HH TYR 298 A}'S' sky -13.0313 2.0777 -9.1029 {"}'S' sky -12.734 2.344 -9.1914 {"}'S' sky -12.9914 3.0998 -9.7346 {"}'S' sky -12.5865 2.8264 -9.5647 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 298 A}'S' sea -13.7697 1.5922 -10.6593 {"}'S' sea -13.7129 1.3802 -10.5264 { HH TYR 298 A}'S' sea -13.265 2.2257 -9.1024 {"}'S' green -13.244 2.4811 -9.1457 {"}'S' green -13.2827 2.7105 -9.2594 {"}'S' green -13.3758 2.8851 -9.4283 {"}'S' sea -12.9872 2.3317 -9.1161 {"}'S' green -12.99 2.5794 -9.1884 {"}'S' green -13.0407 2.7982 -9.3145 {"}'S' green -13.134 2.97 -9.4828 {"}'S' sea -13.2622 3.0791 -9.6795 {"}'S' sea -12.7412 2.5838 -9.268 {"}'S' green -12.7895 2.7991 -9.3899 {"}'S' sea -12.8742 2.9751 -9.5493 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HH TYR 298 A}'S' P -14.0476 2.242 -9.6887 {"}'S' -14.0318 2.2409 -9.6959 {"}'S' P -14.1193 2.1422 -9.9194 {"}'S' -14.1009 2.1434 -9.9219 {"}'S' P -14.0526 1.9369 -9.7763 {"}'S' -14.0506 1.9374 -9.7771 @dotlist {x} color= red width= 1 master= {H-bonds} { HH TYR 298 A}'S' greentint -13.9143 2.3456 -9.4892 {"}'S' 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-10.4623 {"}'S' greentint -14.0461 2.3186 -10.48 {"}'S' greentint -14.0666 2.0654 -10.4365 {"}'S' greentint -14.0404 1.8287 -10.3364 {"}'S' greentint -13.9668 1.6315 -10.1874 {"}'S' greentint -13.8542 1.4896 -10.0029 {"}'S' greentint -13.7133 1.4158 -9.8002 {"}'S' greentint -13.9317 1.8584 -10.6048 {"}'S' greentint -13.8839 1.6424 -10.4833 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB GLU 277 A}'S' sky -12.3755 2.2845 -7.724 { CG GLU 277 A}'S' sky -13.6833 3.0754 -9.3707 {"}'S' sky -13.0305 2.3552 -8.8148 {"}'S' sky -12.5619 2.3868 -8.2175 { HB2 GLU 277 A}'S' sky -12.6158 0.6219 -6.5691 {"}'S' sky -12.2013 0.8713 -6.4696 {"}'S' sky -11.9886 1.1352 -6.5757 { HG3 GLU 277 A}'S' sky -12.822 2.5326 -8.8693 {"}'S' blue -12.6662 2.5083 -8.6612 {"}'S' blue -12.5029 2.5573 -8.4646 {"}'S' sky -12.8778 3.3484 -9.4754 {"}'S' blue -12.5826 2.6652 -8.904 {"}'S' blue -12.4263 2.676 -8.7047 {"}'S' sky -12.6327 3.1716 -9.3409 {"}'S' sky -12.5649 2.9631 -9.1955 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-12.4948 1.6295 -7.5206 {"}'S' P -12.4883 1.3672 -7.5167 {"}'S' -12.5373 1.4026 -7.4209 {"}'S' P -12.4205 1.1588 -7.3713 {"}'S' -12.4781 1.2149 -7.2886 {"}'S' P -12.2871 1.056 -7.1707 {"}'S' -12.322 1.0889 -7.1388 {"}'S' P -12.2671 1.4379 -7.3946 {"}'S' -12.3084 1.4548 -7.3455 {"}'S' P -12.1621 1.2815 -7.2154 {"}'S' -12.1885 1.2958 -7.1933 @dotlist {x} color= red width= 1 master= {vdw contact} { OE2 GLU 277 A}'S' sky -14.155 0.9927 -9.0547 {"}'S' sky -14.0084 1.009 -9.27 {"}'S' sky -13.895 1.0587 -9.5005 {"}'S' blue -13.8222 1.1391 -9.7458 @dotlist {x} color= red width= 1 master= {vdw contact} { OE2 GLU 277 A}'S' sea -13.8681 1.171 -9.134 {"}'S' sea -13.7496 1.2204 -9.3576 {"}'S' green -13.625 1.4228 -9.254 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { OE2 GLU 277 A}'S' P -13.4635 2.0936 -9.9964 {"}'S' -13.4854 2.0942 -9.9888 @dotlist {x} color= red width= 1 master= {H-bonds} { OE2 GLU 277 A}'S' greentint -13.4375 2.1624 -9.2161 {"}'S' greentint -13.4471 2.4086 -9.2974 {"}'S' greentint -13.4944 2.6321 -9.4215 {"}'S' greentint -13.5758 2.8206 -9.5792 {"}'S' greentint -13.4599 1.7226 -9.4402 {"}'S' greentint -13.4079 1.9735 -9.4418 {"}'S' greentint -13.398 2.2237 -9.4991 {"}'S' greentint -13.4324 2.4541 -9.6072 {"}'S' greentint -13.5074 2.6472 -9.7589 {"}'S' greentint -13.6187 2.7901 -9.9419 {"}'S' greentint -13.7573 2.8706 -10.1429 {"}'S' greentint -13.5681 1.4875 -9.772 {"}'S' greentint -13.4652 1.711 -9.7011 {"}'S' greentint -13.4108 1.9607 -9.7008 {"}'S' greentint -13.4111 2.2076 -9.7695 {"}'S' greentint -13.4666 2.4206 -9.9008 {"}'S' greentint -13.57 2.5745 -10.0773 {"}'S' greentint -13.7091 2.6515 -10.2782 {"}'S' greentint -13.8671 2.6403 -10.4797 {"}'S' greentint -13.725 1.4471 -10.1549 {"}'S' greentint -13.5752 1.6008 -10.0041 {"}'S' greentint -13.4799 1.8371 -9.9465 {"}'S' greentint -13.531 2.3015 -10.1411 {"}'S' greentint -13.6631 2.4049 -10.3419 {"}'S' greentint -13.8263 2.3757 -10.5446 {"}'S' greentint -13.8797 1.8029 -10.5706 {"}'S' greentint -13.7755 1.6477 -10.3927 {"}'S' greentint -13.6168 1.745 -10.2151 {"}'S' greentint -13.5614 1.9963 -10.2139 {"}'S' greentint -13.6656 2.1515 -10.3918 {"}'S' greentint -13.8244 2.0542 -10.5694 {"}'S' greentint -13.7018 1.8956 -10.4067 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 298 A}'M' sky -9.3639 2.1708 -6.164 {"}'M' blue -9.5213 1.8071 -6.3833 {"}'M' sky -9.2652 2.4587 -6.2332 {"}'M' blue -9.5755 1.7086 -6.616 {"}'M' sky -9.5889 1.8005 -6.9167 {"}'M' sky -9.244 2.6966 -6.7199 {"}'M' sky -9.4093 2.3796 -7.1623 {"}'M' sky -9.4905 2.1364 -7.2006 {"}'M' sky -9.2972 2.5982 -7.0778 @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 298 A}'M' sea -9.5075 2.063 -6.4365 {"}'M' sea -9.4138 2.3018 -6.3817 {"}'M' green -9.5175 2.2054 -6.6792 {"}'M' sea -9.5741 1.9559 -6.6825 {"}'M' sea -9.2746 2.5957 -6.4738 {"}'M' green -9.4138 2.4277 -6.607 {"}'M' sea -9.4871 2.2994 -6.924 {"}'M' sea -9.5583 2.0543 -6.9482 {"}'M' sea -9.3797 2.5191 -6.8461 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLU 277 A}'M' -9.8316 2.0194 -6.3398 {"}'M' -9.7071 2.2193 -6.234 {"}'M' -9.6185 2.4569 -6.1859 {"}'M' blue -9.574 2.7117 -6.1986 {"}'M' -9.8858 1.9538 -6.7338 {"}'M' -9.5081 2.7908 -6.4786 {"}'M' -9.517 2.7602 -6.7453 {"}'M' -9.8036 2.3102 -7.1557 {"}'M' -9.5887 2.6604 -6.9761 {"}'M' blue -9.722 2.5568 -7.1755 @dotlist {x} color= sky width= 1 master= {vdw contact} { H GLU 277 A}'M' sea -9.7316 2.0864 -6.5721 {"}'M' green -9.6073 2.2897 -6.4675 {"}'M' sea -9.529 2.5354 -6.4353 {"}'M' sea -9.7761 2.1204 -6.9022 {"}'M' green -9.6281 2.2724 -6.7533 {"}'M' green -9.5333 2.5065 -6.696 {"}'M' sea -9.6437 2.4071 -6.9763 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 298 A}'M' green -10.3527 0.7885 -4.7597 {"}'M' sea -10.4859 0.6849 -4.9592 {"}'M' green -10.1668 0.8799 -4.6017 {"}'M' green -10.431 0.9382 -4.959 {"}'M' sea -10.5414 0.8388 -5.2393 {"}'M' sea -9.9391 0.9459 -4.4918 {"}'M' green -10.0058 1.1512 -4.6349 {"}'M' green -10.4466 1.073 -5.1819 {"}'M' sea -9.7211 1.1534 -4.53 {"}'M' green -9.8142 1.328 -4.6988 {"}'M' green -10.2682 1.3349 -5.2885 {"}'M' green -10.4097 1.1644 -5.424 {"}'M' sea -9.7006 1.522 -4.9501 {"}'M' green -9.8522 1.5575 -5.1552 {"}'M' green -10.0136 1.5184 -5.3531 {"}'M' sea -10.1702 1.4063 -5.5245 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 298 A}'M' greentint -10.271 1.0351 -4.7796 {"}'M' greentint -10.1375 1.253 -4.8331 {"}'M' greentint -10.2985 1.2249 -5.0331 {"}'M' greentint -9.9491 1.4228 -4.8997 {"}'M' greentint -10.108 1.426 -5.1056 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLU 277 A}'M' sky -10.1564 1.7321 -5.3904 @dotlist {x} color= red width= 1 master= {vdw contact} { O GLU 277 A}'M' sea -10.6494 0.8266 -4.8936 {"}'M' sea -10.4922 0.822 -4.688 {"}'M' sea -10.3296 0.8777 -4.4938 {"}'M' sea -10.6914 1.1168 -5.3454 {"}'M' green -10.5658 1.0044 -5.1516 {"}'M' green -10.4178 0.9574 -4.9471 {"}'M' green -10.0989 1.0684 -4.5656 {"}'M' sea -9.9522 1.218 -4.418 {"}'M' sea -10.541 1.3701 -5.4796 {"}'M' green -10.4376 1.2161 -5.3031 {"}'M' green -9.8449 1.4167 -4.5918 {"}'M' green -10.2978 1.4507 -5.3776 {"}'M' green -9.852 1.5301 -4.8239 {"}'M' green -10.0522 1.577 -5.2126 {"}'M' green -9.8935 1.6743 -5.0349 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLU 277 A}'M' greentint -10.2586 0.9798 -4.7466 {"}'M' greentint -10.2992 1.1393 -5.1016 {"}'M' greentint -10.1404 1.1503 -4.9007 {"}'M' greentint -9.9833 1.2462 -4.7233 {"}'M' greentint -10.1649 1.3471 -5.1773 {"}'M' greentint -10.0017 1.3764 -4.9747 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n pro A 594 2odpA_664F_596}P -5.8866 9.1914 -8.3951 {"}-5.8866 9.1914 -8.3951 { ca pro A 594 2odpA_664F_596}-7.2391 8.6589 -8.6011 { c pro A 594 2odpA_664F_596}-7.3399 7.1674 -8.2651 { o pro A 594 2odpA_664F_596}-6.4677 6.3451 -8.6318 { c pro A 594 2odpA_664F_596}P -7.3399 7.1674 -8.2651 { n ala A 595 2odpA_664F_596}-8.3603 6.86 -7.4639 { ca ala A 595 2odpA_664F_596}-8.5491 5.5313 -6.9009 { c ala A 595 2odpA_664F_596}-10.0722 5.3164 -6.7052 { o ala A 595 2odpA_664F_596}-10.8948 6.1756 -7.1302 { c ala A 595 2odpA_664F_596}P -10.0722 5.3164 -6.7052 { n his A 596 2odpA_664F_596}-10.4482 4.1689 -6.1369 { ca his A 596 2odpA_664F_596}-11.838 3.7437 -6.0665 { c his A 596 2odpA_664F_596}-12.0639 2.9333 -4.8147 { o his A 596 2odpA_664F_596}-11.1366 2.2906 -4.2635 { c his A 596 2odpA_664F_596}P -12.0639 2.9333 -4.8147 { n phe A 597 2odpA_664F_596}-13.3375 2.9015 -4.4154 { ca phe A 597 2odpA_664F_596}-13.8407 1.8244 -3.5705 { c phe A 597 2odpA_664F_596}-15.2388 1.4172 -4.0727 { o phe A 597 2odpA_664F_596}-15.8166 2.128 -4.8999 { c phe A 597 2odpA_664F_596}P -15.2388 1.4172 -4.0727 { n val A 598 2odpA_664F_596}-15.7581 0.2911 -3.589 { ca val A 598 2odpA_664F_596}-17.0695 -0.2341 -4.055 { c 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0.3131 -7.7039 {"}'S' green -10.1016 0.2981 -7.9069 {"}'S' sea -9.8398 0.4199 -7.9613 {"}'S' green -10.0002 0.3837 -8.1586 {"}'S' sea -9.7149 0.4821 -8.208 {"}'S' sea -9.8757 0.4295 -8.4005 { CE1 TYR 143 A}'S' sea -11.611 0.4285 -6.9784 {"}'S' sea -11.7747 0.367 -7.1726 {"}'S' sea -11.4021 0.3857 -7.1308 {"}'S' sea -11.0253 0.3265 -7.0551 {"}'S' sea -11.1869 0.3077 -7.2598 {"}'S' sea -10.8134 0.208 -7.1623 {"}'S' sea -10.971 0.1963 -7.3631 { CE2 TYR 143 A}'S' green -10.5399 0.1438 -7.7427 {"}'S' green -11.0967 0.4185 -8.539 {"}'S' sea -11.2571 0.3823 -8.7363 {"}'S' sea -10.2791 0.16 -7.8001 {"}'S' green -10.8141 0.4938 -8.5853 {"}'S' sea -10.9718 0.4806 -8.7858 {"}'S' green -10.1892 0.3461 -8.1503 {"}'S' green -10.4703 0.5053 -8.5589 {"}'S' green -10.627 0.5283 -8.7663 {"}'S' green -10.142 0.4554 -8.5483 {"}'S' sea -10.2911 0.5084 -8.7556 { CZ TYR 143 A}'S' green -12.3354 0.2737 -7.4666 {"}'S' green -12.4964 0.2588 -7.6696 {"}'S' sea -12.6592 0.1962 -7.8625 {"}'S' sea -11.9308 0.3252 -7.3149 {"}'S' green -12.0787 0.375 -7.5199 {"}'S' green -12.2346 0.3806 -7.724 {"}'S' green -12.395 0.3444 -7.9213 {"}'S' sea -12.5557 0.266 -8.1059 {"}'S' green -11.6577 0.3628 -7.3638 {"}'S' green -12.1097 0.4427 -7.9708 {"}'S' green -12.2705 0.3902 -8.1632 {"}'S' sea -12.4278 0.3005 -8.3423 {"}'S' sea -11.3271 0.3083 -7.3353 {"}'S' green -11.4615 0.4067 -7.5362 {"}'S' green -12.0903 0.4163 -8.3519 {"}'S' green -11.142 0.3265 -7.5308 {"}'S' green -11.9117 0.3999 -8.5448 {"}'S' green -10.8118 0.1534 -7.4894 {"}'S' green -11.5392 0.4186 -8.503 {"}'S' sea -11.7023 0.358 -8.6968 {"}'S' sea -10.6049 0.0479 -7.62 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 TYR 143 A}'S' P -10.6574 0.2729 -7.9311 {"}'S' -10.6572 0.2614 -7.9384 {"}'S' P -10.7929 0.3631 -8.1299 {"}'S' -10.7872 0.325 -8.1476 {"}'S' P -10.9408 0.4129 -8.3349 {"}'S' -10.9358 0.393 -8.3407 {"}'S' P -10.3918 0.2977 -7.9838 {"}'S' -10.391 0.2976 -7.9844 {"}'S' P -10.5198 0.4007 -8.1788 {"}'S' -10.5219 0.3593 -8.1962 {"}'S' P -10.6622 0.4666 -8.3817 {"}'S' -10.6598 0.4241 -8.3926 {"}'S' P -10.3236 0.4445 -8.3513 {"}'S' -10.3242 0.4393 -8.3526 { CZ TYR 143 A}'S' P -11.8001 0.4287 -7.5667 {"}'S' -11.7998 0.425 -7.5672 {"}'S' P -11.952 0.4559 -7.7702 {"}'S' -11.9497 0.4389 -7.7718 {"}'S' P -11.6082 0.4675 -7.7439 {"}'S' -11.6102 0.4238 -7.7504 {"}'S' P -11.7649 0.4904 -7.9513 {"}'S' -11.7626 0.4368 -7.953 {"}'S' P -11.9264 0.473 -8.1562 {"}'S' -11.9235 0.4496 -8.1536 {"}'S' P -11.2799 0.4175 -7.7332 {"}'S' -11.2825 0.4049 -7.7355 {"}'S' P -11.429 0.4705 -7.9406 {"}'S' -11.4359 0.4235 -7.9427 {"}'S' P -11.5859 0.4848 -8.148 {"}'S' -11.5895 0.4358 -8.1452 {"}'S' P -11.7481 0.4614 -8.3506 {"}'S' -11.7476 0.4487 -8.3488 {"}'S' P -10.934 0.2797 -7.6819 {"}'S' -10.935 0.2767 -7.6824 {"}'S' P -11.0712 0.3706 -7.8849 {"}'S' -11.085 0.3367 -7.8875 {"}'S' P -11.2198 0.4244 -8.0918 {"}'S' -11.2262 0.4046 -8.0908 {"}'S' P -11.3774 0.4416 -8.2992 {"}'S' -11.3789 0.4327 -8.2975 @dotlist {x} color= red width= 1 master= {vdw contact} { OH TYR 143 A}'S' blue -12.9006 0.0671 -8.2398 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 154 A}'S' sky -11.9884 0.6868 -7.0063 {"}'S' sky -11.8299 0.7772 -6.8274 {"}'S' sky -11.5382 0.7316 -6.8523 {"}'S' sky -11.2378 0.7374 -6.8942 {"}'S' sky -11.9917 0.6134 -8.6961 {"}'S' sky -11.7356 0.6063 -8.7784 {"}'S' blue -11.5227 0.6837 -8.9153 {"}'S' blue -11.2859 0.7658 -8.9898 {"}'S' blue -11.0475 0.8719 -9.0282 {"}'S' sky -10.9148 0.7759 -8.8299 { HB2 TYR 154 A}'S' blue -10.828 0.683 -6.9438 {"}'S' blue -10.6054 0.5827 -7.037 {"}'S' sky -10.6086 0.3362 -7.4055 {"}'S' blue -10.4557 0.4522 -7.24 {"}'S' blue -10.3162 0.613 -7.1032 {"}'S' sky -10.349 0.3591 -7.507 {"}'S' sky -10.1989 0.495 -7.3517 {"}'S' blue -10.0648 0.6749 -7.2283 {"}'S' sky -10.0366 0.5129 -7.5559 {"}'S' blue -9.9037 0.6919 -7.4341 {"}'S' sky -9.7911 0.7318 -7.6669 {"}'S' blue -9.7175 0.8188 -7.904 {"}'S' sky -9.8524 0.7683 -8.2955 { HB3 TYR 154 A}'S' blue -12.512 0.5875 -7.0516 {"}'S' blue -12.3627 0.7235 -6.8957 {"}'S' sky -12.8274 0.4422 -7.851 {"}'S' sky -12.3659 0.477 -7.2641 {"}'S' sky -12.2129 0.593 -7.0987 {"}'S' sky -12.7126 0.4901 -8.1477 {"}'S' sky -12.5358 0.5724 -8.3521 @dotlist {x} color= white width= 1 master= {vdw contact} { CB TYR 154 A}'S' green -12.0234 0.5074 -7.4165 {"}'S' sea -11.8605 0.5442 -7.2158 {"}'S' sea -11.6969 0.6198 -7.0266 {"}'S' green -11.7165 0.4459 -7.4324 {"}'S' green -11.5537 0.5075 -7.2376 {"}'S' sea -11.3933 0.6052 -7.0577 {"}'S' green -12.1232 0.5397 -8.4164 {"}'S' green -11.3554 0.4606 -7.4019 {"}'S' green -11.865 0.4978 -8.4999 {"}'S' green -11.6072 0.5027 -8.5827 {"}'S' sea -11.3954 0.5744 -8.7197 {"}'S' green -11.2534 0.5064 -8.517 {"}'S' sea -11.1547 0.6605 -8.7915 { HB2 TYR 154 A}'S' sea -11.137 0.4758 -7.2845 {"}'S' sea -10.9788 0.5526 -7.1013 {"}'S' green -11.0726 0.3297 -7.5716 {"}'S' sea -10.9132 0.3602 -7.3743 {"}'S' sea -10.7547 0.4467 -7.1929 {"}'S' green -10.7673 0.2717 -7.5922 {"}'S' green -11.0715 0.4811 -8.4745 {"}'S' green -10.507 0.2734 -7.688 {"}'S' green -10.8812 0.5843 -8.6686 {"}'S' green -10.3447 0.3055 -7.8973 {"}'S' sea -10.187 0.3815 -7.7145 {"}'S' green -10.645 0.6654 -8.7522 {"}'S' green -10.2507 0.3876 -8.1651 {"}'S' green -10.0874 0.4365 -7.9686 {"}'S' sea -9.9302 0.5549 -7.7978 {"}'S' sea -10.4068 0.7723 -8.7825 {"}'S' green -10.3042 0.6195 -8.6074 {"}'S' green -10.1671 0.5445 -8.408 {"}'S' sea -10.0107 0.5553 -8.2087 {"}'S' sea -9.8546 0.6506 -8.0342 { HB3 TYR 154 A}'S' sea -12.68 0.4005 -7.6487 {"}'S' sea -12.5245 0.4125 -7.4509 {"}'S' green -12.576 0.4087 -7.9477 {"}'S' green -12.4237 0.3838 -7.7439 {"}'S' green -12.2643 0.4142 -7.5467 {"}'S' sea -12.1063 0.5 -7.3657 {"}'S' green -12.4074 0.4716 -8.157 {"}'S' green -12.2601 0.4286 -7.9544 {"}'S' green -12.1019 0.4463 -7.756 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CB TYR 154 A}'S' P -12.0363 0.4369 -7.8418 {"}'S' -12.0349 0.4431 -7.8431 {"}'S' P -11.8786 0.4224 -7.635 {"}'S' -11.8772 0.43 -7.6364 {"}'S' P -11.9858 0.4479 -8.2144 {"}'S' -11.9851 0.4531 -8.2131 {"}'S' P -11.8371 0.3941 -8.0075 {"}'S' -11.8302 0.4397 -8.0051 {"}'S' P -11.6798 0.3778 -7.7991 {"}'S' -11.6767 0.4274 -7.8026 {"}'S' P -11.5178 0.3998 -7.5963 {"}'S' -11.5186 0.4145 -7.599 {"}'S' P -11.7229 0.4194 -8.2946 {"}'S' -11.7207 0.4442 -8.2888 {"}'S' P -11.5706 0.3785 -8.0873 {"}'S' -11.5699 0.4321 -8.0816 {"}'S' P -11.4111 0.3778 -7.8796 {"}'S' -11.4147 0.4196 -7.8803 {"}'S' P -11.466 0.4359 -8.3814 {"}'S' -11.4656 0.4381 -8.3812 {"}'S' P -11.3137 0.4081 -8.1772 {"}'S' -11.3164 0.4246 -8.1743 { HB2 TYR 154 A}'S' P -11.2245 0.3555 -7.7749 {"}'S' -11.2136 0.3785 -7.7772 {"}'S' P -11.2008 0.3957 -8.1874 {"}'S' -11.1976 0.4026 -8.1847 {"}'S' P -11.0701 0.3013 -7.9924 {"}'S' -11.0603 0.3342 -7.9883 {"}'S' P -10.9228 0.2597 -7.7901 {"}'S' -10.9211 0.2745 -7.7911 {"}'S' P -10.9553 0.3493 -8.2891 {"}'S' -10.9513 0.368 -8.2809 {"}'S' P -10.8188 0.2679 -8.089 {"}'S' -10.8164 0.3 -8.0827 {"}'S' P -10.6664 0.2429 -7.8853 {"}'S' -10.6664 0.2429 -7.8853 {"}'S' P -10.7786 0.4316 -8.4935 {"}'S' -10.7776 0.4528 -8.4799 {"}'S' P -10.6501 0.3308 -8.2983 {"}'S' -10.6534 0.3801 -8.2781 {"}'S' P -10.5029 0.2877 -8.0958 {"}'S' -10.509 0.3208 -8.0895 {"}'S' P -10.5413 0.5067 -8.5742 {"}'S' -10.5412 0.5084 -8.5728 {"}'S' P -10.4064 0.4118 -8.3733 {"}'S' -10.4117 0.4319 -8.3629 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 143 A}'M' green -8.378 3.2545 -6.9915 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 143 A}'M' greentint -8.8347 2.4633 -6.1158 {"}'M' greentint -8.9783 2.3556 -6.3883 {"}'M' greentint -8.736 2.7512 -6.1851 {"}'M' greentint -8.8846 2.5943 -6.3336 {"}'M' greentint -8.9883 2.498 -6.631 {"}'M' greentint -9.0449 2.2485 -6.6343 {"}'M' greentint -8.5868 2.9814 -6.2472 {"}'M' greentint -8.7454 2.8882 -6.4256 {"}'M' greentint -8.8846 2.7202 -6.5588 {"}'M' greentint -8.9579 2.592 -6.8758 {"}'M' greentint -9.0291 2.3469 -6.9 {"}'M' greentint -8.3998 3.1705 -6.3151 {"}'M' greentint -8.56 3.1122 -6.5071 {"}'M' greentint -8.7148 2.9892 -6.6717 {"}'M' greentint -8.8505 2.8116 -6.7979 {"}'M' greentint -8.88 2.6722 -7.1141 {"}'M' greentint -8.9613 2.429 -7.1525 {"}'M' greentint -8.4791 3.2083 -6.7448 {"}'M' greentint -8.6314 3.0723 -6.9048 {"}'M' greentint -8.768 2.8908 -7.0296 {"}'M' greentint -8.7656 2.7169 -7.3438 {"}'M' greentint -8.5242 3.111 -7.1414 {"}'M' greentint -8.655 2.929 -7.2598 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 154 A}'M' greentint -8.861 2.3388 -6.2498 {"}'M' greentint -8.7278 2.5144 -6.1267 {"}'M' greentint -8.6226 2.729 -6.0489 {"}'M' greentint -8.9606 2.2118 -6.7432 {"}'M' greentint -8.8 2.2878 -6.5563 {"}'M' greentint -8.6504 2.4332 -6.4039 {"}'M' greentint -8.5259 2.6331 -6.2981 {"}'M' greentint -8.4373 2.8707 -6.25 {"}'M' greentint -8.3928 3.1254 -6.2627 {"}'M' greentint -8.8669 2.3226 -6.9959 {"}'M' greentint -8.7046 2.3675 -6.7979 {"}'M' greentint -8.5504 2.5002 -6.6362 {"}'M' greentint -8.4261 2.7035 -6.5316 {"}'M' greentint -8.3478 2.9492 -6.4995 {"}'M' greentint -8.3269 3.2046 -6.5428 {"}'M' greentint -8.7559 2.5061 -7.1663 {"}'M' greentint -8.5949 2.5342 -6.9663 {"}'M' greentint -8.4469 2.6861 -6.8175 {"}'M' greentint -8.3521 2.9202 -6.7601 {"}'M' greentint -8.3358 3.1739 -6.8094 {"}'M' greentint -8.6225 2.7239 -7.2198 {"}'M' greentint -8.4625 2.8209 -7.0404 {"}'M' greentint -8.4075 3.0742 -7.0402 {"}'M' greentint -8.5408 2.9705 -7.2397 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 143 A}'M' green -9.4841 1.458 -4.2072 {"}'M' green -9.6364 1.1778 -5.1546 {"}'M' green -9.1449 2.1878 -4.8006 {"}'M' green -9.4757 1.4598 -5.4249 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 143 A}'M' greentint -9.6173 1.3544 -4.4067 {"}'M' greentint -9.4024 1.7046 -4.2271 {"}'M' greentint -9.5624 1.6077 -4.4065 {"}'M' greentint -9.6728 1.5083 -4.6868 {"}'M' greentint -9.689 1.2546 -4.6374 {"}'M' greentint -9.4299 1.8944 -4.4806 {"}'M' greentint -9.5779 1.7424 -4.6294 {"}'M' greentint -9.6445 1.6058 -4.9404 {"}'M' greentint -9.6949 1.3511 -4.9357 {"}'M' greentint -9.6862 1.1033 -4.8553 {"}'M' greentint -9.2394 2.0955 -4.5531 {"}'M' greentint -9.3996 2.0044 -4.736 {"}'M' greentint -9.541 1.8339 -4.8715 {"}'M' greentint -9.5476 1.68 -5.1804 {"}'M' greentint -9.6159 1.431 -5.1981 {"}'M' greentint -9.3016 2.0758 -4.972 {"}'M' greentint -9.4401 1.9011 -5.1027 {"}'M' greentint -9.4022 1.6996 -5.398 {"}'M' greentint -9.297 1.9142 -5.3202 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O TYR 154 A}'M' green -9.6322 1.2363 -4.3864 {"}'M' green -9.6278 1.2863 -5.3333 {"}'M' green -9.4891 1.5124 -5.4073 {"}'M' green -9.3809 1.8103 -5.4676 @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 154 A}'M' greentint -9.5103 1.4329 -4.2834 {"}'M' greentint -9.4119 1.6577 -4.2174 {"}'M' greentint -9.6591 1.1239 -4.753 {"}'M' greentint -9.5138 1.2857 -4.61 {"}'M' greentint -9.3892 1.4881 -4.5064 {"}'M' greentint -9.2927 1.7212 -4.4466 {"}'M' greentint -9.2289 1.973 -4.434 {"}'M' greentint -9.5863 1.2044 -4.9982 {"}'M' greentint -9.4396 1.354 -4.8506 {"}'M' greentint -9.3159 1.5538 -4.7459 {"}'M' greentint -9.224 1.7879 -4.6926 {"}'M' greentint -9.172 2.0388 -4.6942 {"}'M' greentint -9.4707 1.3822 -5.156 {"}'M' greentint -9.3323 1.5528 -5.0244 {"}'M' greentint -9.2293 1.7763 -4.9536 {"}'M' greentint -9.1749 2.026 -4.9533 {"}'M' greentint -9.3393 1.6661 -5.2565 {"}'M' greentint -9.2441 1.9024 -5.199 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n ser A 21 2ojhA_286Y_23E}P -7.0347 5.9292 -11.6888 {"}-7.0347 5.9292 -11.6888 { ca ser A 21 2ojhA_286Y_23E}-8.3702 6.026 -11.1062 { c ser A 21 2ojhA_286Y_23E}-8.3303 5.3011 -9.7687 { o ser A 21 2ojhA_286Y_23E}-8.218 4.0755 -9.7114 { c ser A 21 2ojhA_286Y_23E}P -8.3303 5.3011 -9.7687 { n 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-6.9892 {"}'M' greentint -9.2593 2.6765 -6.8097 {"}'M' greentint -9.2043 2.9298 -6.8095 {"}'M' greentint -9.3376 2.8262 -7.009 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 262 A}'M' greentint -10.2602 1.175 -4.2925 {"}'M' greentint -10.4201 1.0781 -4.4719 {"}'M' greentint -10.5305 0.9787 -4.7522 {"}'M' greentint -9.9949 1.2911 -4.1479 {"}'M' greentint -10.1267 1.3928 -4.346 {"}'M' greentint -10.2877 1.3648 -4.546 {"}'M' greentint -10.4357 1.2128 -4.6949 {"}'M' greentint -10.5022 1.0761 -5.0058 {"}'M' greentint -9.8033 1.4678 -4.2118 {"}'M' greentint -9.9382 1.5627 -4.4127 {"}'M' greentint -10.0971 1.5658 -4.6186 {"}'M' greentint -10.2574 1.4748 -4.8014 {"}'M' greentint -10.3988 1.3042 -4.937 {"}'M' greentint -9.6897 1.6619 -4.463 {"}'M' greentint -9.8414 1.6974 -4.6682 {"}'M' greentint -10.0027 1.6582 -4.866 {"}'M' greentint -10.1593 1.5462 -5.0374 {"}'M' greentint -10.2979 1.3714 -5.1682 {"}'M' greentint -9.5589 1.7476 -4.7173 {"}'M' greentint -9.7132 1.7483 -4.9164 {"}'M' greentint -9.8714 1.6846 -5.1027 {"}'M' greentint -10.0216 1.5602 -5.2626 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O GLN 250 A}'M' green -10.0059 1.1538 -4.0683 {"}'M' green -10.5163 1.1054 -5.0779 @dotlist {x} color= red width= 1 master= {H-bonds} { O GLN 250 A}'M' greentint -10.4737 0.9352 -4.6116 {"}'M' greentint -10.3158 0.9591 -4.4149 {"}'M' greentint -10.1577 1.0331 -4.2311 {"}'M' greentint -10.3701 1.0421 -4.8721 {"}'M' greentint -10.2129 1.0375 -4.6665 {"}'M' greentint -10.0503 1.0932 -4.4723 {"}'M' greentint -9.8925 1.2035 -4.2989 {"}'M' greentint -9.7471 1.3652 -4.1559 {"}'M' greentint -10.2865 1.2199 -5.13 {"}'M' greentint -10.1385 1.1729 -4.9256 {"}'M' greentint -9.9793 1.1954 -4.7251 {"}'M' greentint -9.8196 1.2839 -4.5441 {"}'M' greentint -9.6729 1.4335 -4.3965 {"}'M' greentint -10.1583 1.4317 -5.2816 {"}'M' greentint -10.0199 1.3548 -5.08 {"}'M' greentint -9.8611 1.3659 -4.8792 {"}'M' greentint -9.704 1.4617 -4.7018 {"}'M' greentint -9.5656 1.6323 -4.5703 {"}'M' greentint -9.8856 1.5627 -5.1558 {"}'M' greentint -9.7224 1.5919 -4.9532 {"}'M' greentint -9.5727 1.7456 -4.8024 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 46 4bclA_258F_48C}P -9.012 4.6713 -13.3165 {"}-9.012 4.6713 -13.3165 { ca thr A 46 4bclA_258F_48C}-10.1479 4.6491 -12.4527 { c thr A 46 4bclA_258F_48C}-9.6666 4.1423 -11.1358 { o thr A 46 4bclA_258F_48C}-9.012 3.1049 -11.0622 { c thr A 46 4bclA_258F_48C}P -9.6666 4.1423 -11.1358 { n asp A 47 4bclA_258F_48C}-10.0192 4.8549 -10.0955 { ca asp A 47 4bclA_258F_48C}-9.6066 4.4366 -8.7815 { c asp A 47 4bclA_258F_48C}-10.8045 4.3638 -7.8748 { o asp A 47 4bclA_258F_48C}-11.6738 5.1908 -8.0162 { c asp A 47 4bclA_258F_48C}P -10.8045 4.3638 -7.8748 { n cys A 48 4bclA_258F_48C}-10.732 3.5325 -6.8784 { ca cys A 48 4bclA_258F_48C}-11.8674 3.4821 -6.0076 { c cys A 48 4bclA_258F_48C}-11.494 2.9415 -4.6989 { o cys A 48 4bclA_258F_48C}-10.7628 1.977 -4.5748 { c cys A 48 4bclA_258F_48C}P -11.494 2.9415 -4.6989 { n asn A 49 4bclA_258F_48C}-12.2032 3.4682 -3.7412 { ca asn A 49 4bclA_258F_48C}-12.0079 3.0309 -2.3628 { c asn A 49 4bclA_258F_48C}-13.3606 2.7269 -1.7397 { o asn A 49 4bclA_258F_48C}-14.2613 3.4738 -2.0168 { c asn A 49 4bclA_258F_48C}P -13.3606 2.7269 -1.7397 { n ile A 50 4bclA_258F_48C}-13.4547 1.7155 -0.8958 { ca ile A 50 4bclA_258F_48C}-14.7207 1.4501 -0.303 { c ile A 50 4bclA_258F_48C}-14.5487 1.0449 1.12 { o ile A 50 4bclA_258F_48C}-13.6477 0.3419 1.4541 { n gly A 256 4bclA_258F_48C}P -11.5013 -1.6069 1.2525 {"}-11.5013 -1.6069 1.2525 { ca gly A 256 4bclA_258F_48C}-10.7994 -2.0046 0.0691 { c gly A 256 4bclA_258F_48C}-10.5657 -0.8535 -0.8755 { o gly A 256 4bclA_258F_48C}-11.2302 0.202 -0.8388 { c gly A 256 4bclA_258F_48C}P -10.5657 -0.8535 -0.8755 { n gly A 257 4bclA_258F_48C}-9.5663 -1.055 -1.721 { ca gly A 257 4bclA_258F_48C}-9.312 -0.0132 -2.6844 { c gly A 257 4bclA_258F_48C}-8.5655 -0.5447 -3.8873 { o gly A 257 4bclA_258F_48C}-7.8747 -1.5607 -3.8135 { c gly A 257 4bclA_258F_48C}P -8.5655 -0.5447 -3.8873 { n phe A 258 4bclA_258F_48C}-8.7425 0.1599 -5.0215 { ca phe A 258 4bclA_258F_48C}-8.0051 -0.3073 -6.1745 { c phe A 258 4bclA_258F_48C}-7.64 0.9088 -6.987 { o phe A 258 4bclA_258F_48C}-8.3234 1.9367 -6.9475 { c phe A 258 4bclA_258F_48C}P -7.64 0.9088 -6.987 { n arg A 259 4bclA_258F_48C}-6.5476 0.7673 -7.7071 { ca arg A 259 4bclA_258F_48C}-6.1148 1.8465 -8.5974 { c arg A 259 4bclA_258F_48C}-5.9383 1.1623 -9.9071 { o arg A 259 4bclA_258F_48C}-5.3883 0.0536 -9.9259 { c arg A 259 4bclA_258F_48C}P -5.9383 1.1623 -9.9071 { n ser A 260 4bclA_258F_48C}-6.4365 1.7597 -10.9756 { ca ser A 260 4bclA_258F_48C}-6.2799 0.9877 -12.1848 { c ser A 260 4bclA_258F_48C}-6.0889 1.9199 -13.3533 { o ser A 260 4bclA_258F_48C}-6.5338 3.0626 -13.378 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n thr A 46 4bclA_258F_48C}P -9.012 4.6713 -13.3165 { ca thr A 46 4bclA_258F_48C}P -10.1479 4.6491 -12.4527 { n asp A 47 4bclA_258F_48C}P -10.0192 4.8549 -10.0955 { ca asp A 47 4bclA_258F_48C}P -9.6066 4.4366 -8.7815 { n cys A 48 4bclA_258F_48C}P -10.732 3.5325 -6.8784 { ca cys A 48 4bclA_258F_48C}P -11.8674 3.4821 -6.0076 { n asn A 49 4bclA_258F_48C}P -12.2032 3.4682 -3.7412 { ca asn A 49 4bclA_258F_48C}P -12.0079 3.0309 -2.3628 { n ile A 50 4bclA_258F_48C}P -13.4547 1.7155 -0.8958 { ca ile A 50 4bclA_258F_48C}P -14.7207 1.4501 -0.303 { n gly A 256 4bclA_258F_48C}P -11.5013 -1.6069 1.2525 { ca gly A 256 4bclA_258F_48C}P -10.7994 -2.0046 0.0691 {"}P -10.7994 -2.0046 0.0691 { n gly A 257 4bclA_258F_48C}P -9.5663 -1.055 -1.721 { ca gly A 257 4bclA_258F_48C}P -9.312 -0.0132 -2.6844 {"}P -9.312 -0.0132 -2.6844 { n phe A 258 4bclA_258F_48C}P -8.7425 0.1599 -5.0215 { ca phe A 258 4bclA_258F_48C}P -8.0051 -0.3073 -6.1745 { n arg A 259 4bclA_258F_48C}P -6.5476 0.7673 -7.7071 { ca arg A 259 4bclA_258F_48C}P -6.1148 1.8465 -8.5974 { n ser A 260 4bclA_258F_48C}P -6.4365 1.7597 -10.9756 { ca ser A 260 4bclA_258F_48C}P -6.2799 0.9877 -12.1848 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca thr A 46 4bclA_258F_48C}P -10.1479 4.6491 -12.4527 {"}-10.1479 4.6491 -12.4527 { ca asp A 47 4bclA_258F_48C}-9.6066 4.4366 -8.7815 { ca cys A 48 4bclA_258F_48C}-11.8674 3.4821 -6.0076 { ca asn A 49 4bclA_258F_48C}-12.0079 3.0309 -2.3628 { ca ile A 50 4bclA_258F_48C}-14.7207 1.4501 -0.303 { ca gly A 256 4bclA_258F_48C}P -10.7994 -2.0046 0.0691 {"}-10.7994 -2.0046 0.0691 { ca gly A 257 4bclA_258F_48C}-9.312 -0.0132 -2.6844 { ca phe A 258 4bclA_258F_48C}-8.0051 -0.3073 -6.1745 { ca arg A 259 4bclA_258F_48C}-6.1148 1.8465 -8.5974 { ca ser A 260 4bclA_258F_48C}-6.2799 0.9877 -12.1848 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca cys A 48 4bclA_258F_48C}P -11.8674 3.4821 -6.0076 { cb cys A 48 4bclA_258F_48C}-12.8945 2.4724 -6.5828 { sg cys A 48 4bclA_258F_48C}-14.5163 2.4044 -5.6774 { ca phe A 258 4bclA_258F_48C}P -8.0051 -0.3073 -6.1745 { cb phe A 258 4bclA_258F_48C}-8.8178 -1.3852 -6.9334 { cg phe A 258 4bclA_258F_48C}-10.0049 -0.8021 -7.6876 { cd1 phe A 258 4bclA_258F_48C}-9.7978 -0.0021 -8.814 { ce1 phe A 258 4bclA_258F_48C}-10.8538 0.5693 -9.5333 { cz phe A 258 4bclA_258F_48C}-12.1401 0.1294 -9.1969 { cg phe A 258 4bclA_258F_48C}P -10.0049 -0.8021 -7.6876 { cd2 phe A 258 4bclA_258F_48C}-11.3095 -1.1956 -7.3593 { ce2 phe A 258 4bclA_258F_48C}-12.3748 -0.6453 -8.0626 { cz phe A 258 4bclA_258F_48C}ghost -12.1401 0.1294 -9.1969 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb cys A 48 4bclA_258F_48C}P -12.8945 2.4724 -6.5828 {"}P -12.8945 2.4724 -6.5828 { sg cys A 48 4bclA_258F_48C}P -14.5163 2.4044 -5.6774 { cb phe A 258 4bclA_258F_48C}P -8.8178 -1.3852 -6.9334 {"}P -8.8178 -1.3852 -6.9334 { cd1 phe A 258 4bclA_258F_48C}P -9.7978 -0.0021 -8.814 { cd2 phe A 258 4bclA_258F_48C}P -11.3095 -1.1956 -7.3593 { ce1 phe A 258 4bclA_258F_48C}P -10.8538 0.5693 -9.5333 { ce2 phe A 258 4bclA_258F_48C}P -12.3748 -0.6453 -8.0626 { cz phe A 258 4bclA_258F_48C}P -12.1401 0.1294 -9.1969 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 258 A}'S' sky -11.8851 0.1042 -6.3391 {"}'S' sky -11.6544 0.2204 -6.3903 {"}'S' sky -11.412 0.4905 -6.9017 { CE2 PHE 258 A}'S' blue -13.4082 0.7048 -7.6471 {"}'S' sky -13.0722 0.9564 -7.9596 { CZ PHE 258 A}'S' sky -13.0615 1.0536 -8.0304 {"}'S' blue -13.2027 1.1346 -8.2368 {"}'S' sky -13.0578 1.3354 -8.3221 {"}'S' sky -12.8579 1.4996 -8.3786 {"}'S' blue -13.0122 1.5173 -8.5832 {"}'S' sky -12.6249 1.6263 -8.4307 {"}'S' sky -12.7779 1.6605 -8.6391 {"}'S' sky -12.2378 1.6218 -8.2886 {"}'S' sky -12.3733 1.712 -8.4874 {"}'S' blue -12.5212 1.7618 -8.6924 {"}'S' sky -11.6449 0.9253 -7.719 {"}'S' sky -11.6939 1.1445 -7.8429 {"}'S' blue -11.7662 1.3399 -7.9898 {"}'S' blue -11.8595 1.5089 -8.1576 {"}'S' blue -11.9722 1.6466 -8.3413 @dotlist {x} color= white width= 1 master= {vdw contact} { CD2 PHE 258 A}'S' sea -12.0274 0.1746 -6.541 {"}'S' sea -11.7943 0.3013 -6.5932 {"}'S' sea -11.5427 0.387 -6.6499 {"}'S' green -11.6906 0.4368 -6.8549 { CE2 PHE 258 A}'S' green -13.0308 0.3674 -6.7946 {"}'S' green -13.0927 0.7249 -7.2443 {"}'S' sea -13.247 0.7425 -7.449 {"}'S' green -12.4268 0.2786 -6.5775 {"}'S' green -13.0126 0.8858 -7.5049 {"}'S' sea -13.1736 0.8708 -7.7079 {"}'S' green -12.9118 0.9926 -7.7623 {"}'S' green -11.9286 0.3698 -6.7086 { CZ PHE 258 A}'S' green -12.7961 1.1421 -7.9288 {"}'S' sea -12.915 1.2689 -8.1185 {"}'S' green -12.4974 1.1401 -7.814 {"}'S' green -12.5941 1.3072 -7.9844 {"}'S' sea -12.7157 1.4292 -8.1766 {"}'S' green -12.2639 1.2534 -7.8607 {"}'S' green -12.3628 1.419 -8.0354 {"}'S' sea -12.485 1.5453 -8.2279 {"}'S' sea -11.9477 1.134 -7.7773 {"}'S' sea -12.0226 1.3288 -7.9276 {"}'S' sea -12.1203 1.4927 -8.1002 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE2 PHE 258 A}'S' P -12.7322 0.3653 -6.6798 {"}'S' -12.7306 0.3584 -6.6897 {"}'S' P -12.8289 0.5325 -6.8501 {"}'S' -12.8127 0.4917 -6.8923 {"}'S' P -12.9504 0.6545 -7.0424 {"}'S' -12.9336 0.6153 -7.0719 {"}'S' P -12.4986 0.4786 -6.7265 {"}'S' -12.4932 0.4253 -6.7907 {"}'S' P -12.5975 0.6443 -6.9012 {"}'S' -12.5807 0.5449 -6.9905 {"}'S' P -12.7197 0.7706 -7.0936 {"}'S' -12.6941 0.6665 -7.1647 {"}'S' P -12.8596 0.8516 -7.2965 {"}'S' -12.8409 0.795 -7.3263 {"}'S' P -12.1824 0.3593 -6.6431 {"}'S' -12.1846 0.3514 -6.6545 {"}'S' P -12.2573 0.5541 -6.7933 {"}'S' -12.2643 0.4815 -6.87 {"}'S' P -12.355 0.718 -6.9659 {"}'S' -12.3572 0.5941 -7.0654 {"}'S' P -12.4726 0.847 -7.1544 {"}'S' -12.4646 0.711 -7.2372 {"}'S' P -12.608 0.9372 -7.3532 {"}'S' -12.5937 0.8414 -7.3973 {"}'S' P -12.7559 0.9871 -7.5582 {"}'S' -12.752 0.9723 -7.5632 {"}'S' P -12.0009 0.5651 -6.8555 {"}'S' -12.0135 0.5221 -6.8988 {"}'S' P -12.0943 0.7341 -7.0234 {"}'S' -12.1132 0.6399 -7.0945 {"}'S' P -12.2069 0.8719 -7.2071 {"}'S' -12.2192 0.7555 -7.2724 {"}'S' P -12.3349 0.9748 -7.4021 {"}'S' -12.3379 0.8828 -7.4399 {"}'S' P -12.4773 1.0407 -7.6049 {"}'S' -12.4763 1.0143 -7.6112 {"}'S' P -11.7855 0.6202 -7.0077 {"}'S' -11.7874 0.6167 -7.0111 {"}'S' P -11.8856 0.7866 -7.1825 {"}'S' -11.8994 0.7456 -7.2073 {"}'S' P -12.0043 0.9203 -7.3735 {"}'S' -12.0149 0.8728 -7.3943 {"}'S' P -12.1387 1.0187 -7.5745 {"}'S' -12.1409 1.0035 -7.5792 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 48 A}'S' blue -13.4542 0.8918 -7.0827 {"}'S' blue -13.4325 1.1146 -7.5466 {"}'S' blue -13.2711 1.2675 -7.795 {"}'S' sky -13.1131 1.567 -8.0644 {"}'S' sky -12.8704 1.6659 -8.1362 {"}'S' sky -12.376 1.8668 -8.1404 {"}'S' blue -12.133 1.9225 -8.0601 {"}'S' sky -12.076 1.7029 -7.9253 {"}'S' sky -11.9694 1.5442 -7.7433 { HB2 CYS 48 A}'S' blue -13.1428 1.7485 -8.2745 {"}'S' blue -13.0092 1.9823 -8.5332 {"}'S' sky -12.9056 1.8236 -8.3553 {"}'S' blue -12.771 2.0892 -8.5636 {"}'S' sky -12.6684 1.9364 -8.3885 {"}'S' sky -12.5313 1.8614 -8.189 {"}'S' blue -12.5136 2.1593 -8.4806 {"}'S' blue -12.3802 2.0566 -8.2799 { HB3 CYS 48 A}'S' blue -12.0684 0.4172 -6.227 {"}'S' blue -11.7559 0.571 -6.2759 {"}'S' sky -11.6495 0.613 -6.5177 {"}'S' sky -11.574 0.7087 -6.7541 {"}'S' sky -11.9201 1.3668 -7.615 @dotlist {x} color= white width= 1 master= {vdw contact} { CB CYS 48 A}'S' sea -13.3227 0.9655 -7.3624 {"}'S' sea -13.1783 1.0977 -7.6276 {"}'S' green -13.0673 0.9586 -7.4441 {"}'S' sea -13.0495 1.3604 -7.9251 {"}'S' sea -12.9627 1.1813 -7.7622 {"}'S' sea -12.8128 1.4514 -8.0017 {"}'S' green -12.7275 1.2657 -7.8394 {"}'S' sea -12.6228 1.771 -8.1636 {"}'S' green -12.5712 1.5523 -8.0364 {"}'S' green -12.4885 1.3675 -7.8776 {"}'S' sea -12.3279 1.6461 -8.0174 {"}'S' green -12.2417 1.4645 -7.8564 { HB3 CYS 48 A}'S' green -13.1101 0.7769 -7.2425 {"}'S' green -12.9349 0.9269 -7.4884 {"}'S' green -12.7061 1.0664 -7.6415 {"}'S' green -12.064 0.3636 -6.6173 {"}'S' sea -11.9063 0.4396 -6.4344 {"}'S' green -12.4482 1.1747 -7.7068 {"}'S' green -12.1816 1.2858 -7.6993 {"}'S' green -12.1812 1.0416 -7.6311 {"}'S' green -11.7353 0.7977 -7.2188 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB3 CYS 48 A}'S' P -13.0289 0.5945 -7.0865 {"}'S' -13.0184 0.6103 -7.0774 {"}'S' P -12.9202 0.4538 -6.9074 {"}'S' -12.9076 0.4811 -6.8982 {"}'S' P -12.7895 0.3594 -6.7123 {"}'S' -12.7871 0.3675 -6.711 {"}'S' P -12.8785 0.7153 -7.3579 {"}'S' -12.8532 0.7594 -7.3111 {"}'S' P -12.7909 0.5391 -7.1945 {"}'S' -12.7576 0.6278 -7.1351 {"}'S' P -12.6747 0.4074 -7.009 {"}'S' -12.6519 0.512 -6.9659 {"}'S' P -12.5382 0.326 -6.8089 {"}'S' -12.5316 0.4028 -6.7936 {"}'S' P -12.3858 0.301 -6.6052 {"}'S' -12.386 0.3075 -6.6052 {"}'S' P -12.6716 0.8388 -7.5339 {"}'S' -12.6571 0.8778 -7.4735 {"}'S' P -12.6005 0.6424 -7.3885 {"}'S' -12.5821 0.7408 -7.2917 {"}'S' P -12.4979 0.4896 -7.2134 {"}'S' -12.491 0.6265 -7.1242 {"}'S' P -12.3695 0.3889 -7.0183 {"}'S' -12.3779 0.5186 -6.9654 {"}'S' P -12.2222 0.3458 -6.8157 {"}'S' -12.2367 0.4182 -6.8007 {"}'S' P -12.4288 0.9324 -7.6148 {"}'S' -12.4302 0.9575 -7.5659 {"}'S' P -12.3644 0.7235 -7.4721 {"}'S' -12.3733 0.8057 -7.3733 {"}'S' P -12.2607 0.5647 -7.2942 {"}'S' -12.2852 0.6851 -7.198 {"}'S' P -12.1258 0.4699 -7.0933 {"}'S' -12.1594 0.5779 -7.0374 {"}'S' P -11.97 0.4456 -6.8851 {"}'S' -11.9888 0.4875 -6.8724 {"}'S' P -12.1262 0.8304 -7.5025 {"}'S' -12.1467 0.8721 -7.441 {"}'S' P -12.0236 0.6776 -7.3274 {"}'S' -12.0588 0.7445 -7.2643 {"}'S' P -11.8864 0.6026 -7.1279 {"}'S' -11.9142 0.6453 -7.1005 {"}'S' P -11.8687 0.9005 -7.4195 {"}'S' -11.8687 0.9005 -7.4195 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 258 A}'M' greentint -9.3366 2.4178 -6.1095 {"}'M' greentint -9.4955 2.3291 -6.2911 {"}'M' greentint -9.6391 2.2214 -6.5636 {"}'M' greentint -9.2335 2.6504 -6.1585 {"}'M' greentint -9.3968 2.617 -6.3604 {"}'M' greentint -9.5454 2.4601 -6.5089 {"}'M' greentint -9.6491 2.3637 -6.8063 {"}'M' greentint -9.7057 2.1143 -6.8096 {"}'M' greentint -9.0896 2.8555 -6.2205 {"}'M' greentint -9.2476 2.8472 -6.4225 {"}'M' greentint -9.4062 2.754 -6.6009 {"}'M' greentint -9.5454 2.586 -6.7341 {"}'M' greentint -9.6187 2.4578 -7.0511 {"}'M' greentint -9.6899 2.2126 -7.0753 {"}'M' greentint -9.0606 3.0363 -6.4904 {"}'M' greentint -9.2208 2.978 -6.6824 {"}'M' greentint -9.3756 2.855 -6.847 {"}'M' greentint -9.5113 2.6774 -6.9732 {"}'M' greentint -9.5408 2.538 -7.2894 {"}'M' greentint -9.622 2.2948 -7.3278 {"}'M' greentint -9.1399 3.0741 -6.9201 {"}'M' greentint -9.2921 2.9381 -7.0801 {"}'M' greentint -9.4288 2.7565 -7.2049 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H CYS 48 A}'M' greentint -9.5063 2.1276 -6.2735 {"}'M' greentint -9.3731 2.3032 -6.1504 {"}'M' greentint -9.6059 2.0006 -6.7669 {"}'M' greentint -9.4453 2.0766 -6.5801 {"}'M' greentint -9.2957 2.222 -6.4277 {"}'M' greentint -9.1712 2.4219 -6.3219 {"}'M' greentint -9.0826 2.6595 -6.2738 {"}'M' greentint -9.0381 2.9143 -6.2865 {"}'M' greentint -9.661 2.1611 -7.2257 {"}'M' greentint -9.5122 2.1115 -7.0196 {"}'M' greentint -9.3499 2.1564 -6.8217 {"}'M' greentint -9.1957 2.289 -6.66 {"}'M' greentint -9.0714 2.4923 -6.5554 {"}'M' greentint -8.9931 2.738 -6.5232 {"}'M' greentint -8.9722 2.9934 -6.5665 {"}'M' greentint -9.533 2.3967 -7.3882 {"}'M' greentint -9.4012 2.295 -7.1901 {"}'M' greentint -9.2402 2.323 -6.9901 {"}'M' greentint -9.0922 2.475 -6.8412 {"}'M' greentint -8.9974 2.7091 -6.7839 {"}'M' greentint -8.9811 2.9628 -6.8332 {"}'M' greentint -9.3719 2.668 -7.4214 {"}'M' greentint -9.2677 2.5128 -7.2436 {"}'M' greentint -9.1078 2.6097 -7.0642 {"}'M' greentint -9.0528 2.863 -7.064 {"}'M' greentint -9.157 3.0182 -7.2418 {"}'M' greentint -9.1861 2.7594 -7.2634 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 258 A}'M' greentint -10.1053 1.1319 -4.5427 {"}'M' greentint -10.2386 1.0283 -4.7422 {"}'M' greentint -10.1344 0.8731 -4.5643 {"}'M' greentint -9.9744 0.97 -4.3849 {"}'M' greentint -9.9194 1.2233 -4.3847 {"}'M' greentint -10.0236 1.3785 -4.5625 {"}'M' greentint -10.1836 1.2816 -4.7419 {"}'M' greentint -10.294 1.1822 -5.0222 {"}'M' greentint -10.3103 0.9285 -4.9729 {"}'M' greentint -10.2436 0.7232 -4.8298 {"}'M' greentint -9.6917 1.2893 -4.2748 {"}'M' greentint -9.7584 1.4946 -4.4179 {"}'M' greentint -9.8901 1.5963 -4.616 {"}'M' greentint -10.0511 1.5683 -4.816 {"}'M' greentint -10.1992 1.4163 -4.9649 {"}'M' greentint -10.2657 1.2796 -5.2758 {"}'M' greentint -10.3161 1.025 -5.2712 {"}'M' greentint -9.5668 1.6714 -4.4818 {"}'M' greentint -9.7017 1.7662 -4.6827 {"}'M' greentint -9.8606 1.7694 -4.8886 {"}'M' greentint -10.0209 1.6783 -5.0715 {"}'M' greentint -10.1623 1.5078 -5.207 {"}'M' greentint -10.1689 1.3539 -5.5158 {"}'M' greentint -10.2371 1.1049 -5.5335 {"}'M' greentint -9.4532 1.8654 -4.733 {"}'M' greentint -9.6048 1.9009 -4.9382 {"}'M' greentint -9.7662 1.8617 -5.1361 {"}'M' greentint -9.9228 1.7497 -5.3074 {"}'M' greentint -10.0614 1.575 -5.4382 {"}'M' greentint -9.6349 1.8881 -5.3727 {"}'M' greentint -9.7851 1.7637 -5.5326 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O CYS 48 A}'M' greentint -10.1846 0.7392 -4.8809 {"}'M' greentint -10.022 0.7949 -4.6868 {"}'M' greentint -9.8642 0.9052 -4.5133 {"}'M' greentint -9.7188 1.0669 -4.3704 {"}'M' greentint -9.5942 1.2693 -4.2668 {"}'M' greentint -10.2582 0.9216 -5.3445 {"}'M' greentint -10.1102 0.8746 -5.14 {"}'M' greentint -9.951 0.897 -4.9395 {"}'M' greentint -9.7913 0.9856 -4.7585 {"}'M' greentint -9.6446 1.1352 -4.611 {"}'M' greentint -9.5209 1.335 -4.5063 {"}'M' greentint -9.429 1.5691 -4.453 {"}'M' greentint -10.13 1.1334 -5.4961 {"}'M' greentint -9.9916 1.0565 -5.2945 {"}'M' greentint -9.8328 1.0676 -5.0936 {"}'M' greentint -9.6757 1.1634 -4.9163 {"}'M' greentint -9.5373 1.334 -4.7848 {"}'M' greentint -9.4343 1.5575 -4.7139 {"}'M' greentint -9.3799 1.8072 -4.7136 {"}'M' greentint -9.9902 1.3679 -5.5705 {"}'M' greentint -9.8573 1.2644 -5.3703 {"}'M' greentint -9.6941 1.2936 -5.1677 {"}'M' greentint -9.5444 1.4473 -5.0168 {"}'M' greentint -9.4491 1.6836 -4.9593 {"}'M' greentint -9.4327 1.9401 -5.0092 {"}'M' greentint -9.8488 1.6494 -5.5834 {"}'M' greentint -9.7446 1.4942 -5.4055 {"}'M' greentint -9.5859 1.5915 -5.2279 {"}'M' greentint -9.5306 1.8428 -5.2267 {"}'M' greentint -9.671 1.7421 -5.4195 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n phe A 127 6celA_129F_290}P -12.1538 -1.7261 0.6545 {"}-12.1538 -1.7261 0.6545 { ca phe A 127 6celA_129F_290}-11.1962 -2.2366 -0.3057 { c phe A 127 6celA_129F_290}-10.895 -1.0966 -1.2718 { o phe A 127 6celA_129F_290}-11.8147 -0.4679 -1.7889 { c phe A 127 6celA_129F_290}P -10.895 -1.0966 -1.2718 { n ser A 128 6celA_129F_290}-9.6145 -0.8342 -1.4972 { ca ser A 128 6celA_129F_290}-9.1774 0.2275 -2.3879 { c ser A 128 6celA_129F_290}-8.2237 -0.3284 -3.4405 { o ser A 128 6celA_129F_290}-7.4707 -1.26 -3.1727 { c ser A 128 6celA_129F_290}P -8.2237 -0.3284 -3.4405 { n phe A 129 6celA_129F_290}-8.2582 0.2441 -4.6384 { ca phe A 129 6celA_129F_290}-7.3716 -0.1786 -5.7124 { c phe A 129 6celA_129F_290}-7.2939 0.8921 -6.7938 { o phe A 129 6celA_129F_290}-8.1916 1.729 -6.9216 { c phe A 129 6celA_129F_290}P -7.2939 0.8921 -6.7938 { n asp A 130 6celA_129F_290}-6.1818 0.8999 -7.5125 { ca asp A 130 6celA_129F_290}-5.9657 1.8226 -8.6171 { c asp A 130 6celA_129F_290}-6.2187 1.0282 -9.8975 { o asp A 130 6celA_129F_290}-5.9494 -0.1764 -9.9602 { c asp A 130 6celA_129F_290}P -6.2187 1.0282 -9.8975 { n val A 131 6celA_129F_290}-6.7524 1.692 -10.9134 { ca val A 131 6celA_129F_290}-7.0231 1.0117 -12.1636 { c val A 131 6celA_129F_290}-6.8587 1.9274 -13.3629 { o val A 131 6celA_129F_290}-7.1214 3.1308 -13.2978 { n leu A 288 6celA_129F_290}P -7.1388 5.9367 -11.9781 {"}-7.1388 5.9367 -11.9781 { ca leu A 288 6celA_129F_290}-7.9883 6.4427 -10.9068 { c leu A 288 6celA_129F_290}-8.017 5.4503 -9.7539 { o leu A 288 6celA_129F_290}-7.7424 4.2633 -9.9365 { c leu A 288 6celA_129F_290}P -8.017 5.4503 -9.7539 { n thr A 289 6celA_129F_290}-8.3483 5.9585 -8.5695 { ca thr A 289 6celA_129F_290}-8.4406 5.1517 -7.358 { c thr A 289 6celA_129F_290}-9.9135 4.9529 -7.0427 { o thr A 289 6celA_129F_290}-10.7049 5.9017 -7.0917 { c thr A 289 6celA_129F_290}P -9.9135 4.9529 -7.0427 { n val A 290 6celA_129F_290}-10.2716 3.7139 -6.7128 { ca val A 290 6celA_129F_290}-11.6442 3.3468 -6.3929 { c val A 290 6celA_129F_290}-11.6996 2.7389 -4.9918 { o val A 290 6celA_129F_290}-11.0306 1.7477 -4.721 { c val A 290 6celA_129F_290}P -11.6996 2.7389 -4.9918 { n val A 291 6celA_129F_290}-12.4853 3.3463 -4.1058 { ca val A 291 6celA_129F_290}-12.6239 2.8522 -2.7367 { c val A 291 6celA_129F_290}-14.0583 2.4322 -2.4774 { o val A 291 6celA_129F_290}-14.9899 3.1877 -2.7405 { c val A 291 6celA_129F_290}P -14.0583 2.4322 -2.4774 { n thr A 292 6celA_129F_290}-14.2338 1.2334 -1.9292 { ca thr A 292 6celA_129F_290}-15.5567 0.6913 -1.6518 { c thr A 292 6celA_129F_290}-15.6029 0.2507 -0.1943 { o thr A 292 6celA_129F_290}-14.7958 -0.575 0.2343 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n phe A 127 6celA_129F_290}P -12.1538 -1.7261 0.6545 { ca phe A 127 6celA_129F_290}P -11.1962 -2.2366 -0.3057 { n ser A 128 6celA_129F_290}P -9.6145 -0.8342 -1.4972 { ca ser A 128 6celA_129F_290}P -9.1774 0.2275 -2.3879 { n phe A 129 6celA_129F_290}P -8.2582 0.2441 -4.6384 { ca phe A 129 6celA_129F_290}P -7.3716 -0.1786 -5.7124 { n asp A 130 6celA_129F_290}P -6.1818 0.8999 -7.5125 { ca asp A 130 6celA_129F_290}P -5.9657 1.8226 -8.6171 { n val A 131 6celA_129F_290}P -6.7524 1.692 -10.9134 { ca val A 131 6celA_129F_290}P -7.0231 1.0117 -12.1636 { n leu A 288 6celA_129F_290}P -7.1388 5.9367 -11.9781 { ca leu A 288 6celA_129F_290}P -7.9883 6.4427 -10.9068 { n thr A 289 6celA_129F_290}P -8.3483 5.9585 -8.5695 { ca thr A 289 6celA_129F_290}P -8.4406 5.1517 -7.358 { n val A 290 6celA_129F_290}P -10.2716 3.7139 -6.7128 { ca val A 290 6celA_129F_290}P -11.6442 3.3468 -6.3929 { n val A 291 6celA_129F_290}P -12.4853 3.3463 -4.1058 { ca val A 291 6celA_129F_290}P -12.6239 2.8522 -2.7367 { n thr A 292 6celA_129F_290}P -14.2338 1.2334 -1.9292 { ca thr A 292 6celA_129F_290}P -15.5567 0.6913 -1.6518 @subgroup {mainchain} @vectorlist {Calphas} off color= white alpha= 0.3529 { ca phe A 127 6celA_129F_290}P -11.1962 -2.2366 -0.3057 {"}-11.1962 -2.2366 -0.3057 { ca ser A 128 6celA_129F_290}-9.1774 0.2275 -2.3879 { ca phe A 129 6celA_129F_290}-7.3716 -0.1786 -5.7124 { ca asp A 130 6celA_129F_290}-5.9657 1.8226 -8.6171 { ca val A 131 6celA_129F_290}-7.0231 1.0117 -12.1636 { ca leu A 288 6celA_129F_290}P -7.9883 6.4427 -10.9068 {"}-7.9883 6.4427 -10.9068 { ca thr A 289 6celA_129F_290}-8.4406 5.1517 -7.358 { ca val A 290 6celA_129F_290}-11.6442 3.3468 -6.3929 { ca val A 291 6celA_129F_290}-12.6239 2.8522 -2.7367 { ca thr A 292 6celA_129F_290}-15.5567 0.6913 -1.6518 @subgroup {sidechain} @vectorlist {sc} color= green alpha= 0.1176 master= {sidechain} { ca phe A 129 6celA_129F_290}P -7.3716 -0.1786 -5.7124 { cb phe A 129 6celA_129F_290}-7.8294 -1.5145 -6.327 { cg phe A 129 6celA_129F_290}-9.0912 -1.4181 -7.1457 { cd1 phe A 129 6celA_129F_290}-10.3406 -1.4778 -6.5397 { ce1 phe A 129 6celA_129F_290}-11.5154 -1.3947 -7.2979 { cz phe A 129 6celA_129F_290}-11.4364 -1.2499 -8.6772 { cg phe A 129 6celA_129F_290}P -9.0912 -1.4181 -7.1457 { cd2 phe A 129 6celA_129F_290}-9.0284 -1.275 -8.5331 { ce2 phe A 129 6celA_129F_290}-10.1934 -1.1915 -9.2951 { cz phe A 129 6celA_129F_290}ghost -11.4364 -1.2499 -8.6772 { ca val A 290 6celA_129F_290}P -11.6442 3.3468 -6.3929 { cb val A 290 6celA_129F_290}-12.1945 2.3139 -7.4185 { cg1 val A 290 6celA_129F_290}-13.6269 1.9719 -7.1039 { cb val A 290 6celA_129F_290}P -12.1945 2.3139 -7.4185 { cg2 val A 290 6celA_129F_290}-12.0632 2.8539 -8.8507 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 129 6celA_129F_290}P -7.8294 -1.5145 -6.327 {"}P -7.8294 -1.5145 -6.327 { cd1 phe A 129 6celA_129F_290}P -10.3406 -1.4778 -6.5397 { cd2 phe A 129 6celA_129F_290}P -9.0284 -1.275 -8.5331 { ce1 phe A 129 6celA_129F_290}P -11.5154 -1.3947 -7.2979 { ce2 phe A 129 6celA_129F_290}P -10.1934 -1.1915 -9.2951 { cz phe A 129 6celA_129F_290}P -11.4364 -1.2499 -8.6772 { cb val A 290 6celA_129F_290}P -12.1945 2.3139 -7.4185 { cg1 val A 290 6celA_129F_290}P -13.6269 1.9719 -7.1039 {"}P -13.6269 1.9719 -7.1039 {"}P -13.6269 1.9719 -7.1039 { cg2 val A 290 6celA_129F_290}P -12.0632 2.8539 -8.8507 {"}P -12.0632 2.8539 -8.8507 {"}P -12.0632 2.8539 -8.8507 @subgroup {1->2} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CD1 PHE 129 A}'S' blue -10.9135 0.1697 -6.6786 {"}'S' blue -10.7334 0.1959 -6.8672 { CE1 PHE 129 A}'S' blue -12.477 0.0588 -7.136 {"}'S' sky -11.7485 0.1879 -6.5884 {"}'S' sky -10.8242 0.2006 -7.4932 { CZ PHE 129 A}'S' sky -12.0742 0.2812 -8.1195 {"}'S' sky -11.9733 0.3881 -8.3769 {"}'S' sky -11.6908 0.4633 -8.4231 {"}'S' blue -11.5036 0.4979 -8.6041 {"}'S' blue -10.8808 0.3339 -8.1837 {"}'S' blue -11.0187 0.4249 -8.3861 @dotlist {x} color= white width= 1 master= {vdw contact} { CE1 PHE 129 A}'S' green -11.8964 0.2377 -6.7934 {"}'S' green -12.0523 0.2432 -6.9975 {"}'S' sea -12.2127 0.207 -7.1948 {"}'S' sea -11.4754 0.2254 -6.6373 {"}'S' green -11.6178 0.2913 -6.8402 {"}'S' green -12.0882 0.2528 -7.4367 {"}'S' sea -12.2455 0.1631 -7.6158 {"}'S' green -11.2792 0.2693 -6.8098 {"}'S' green -11.9081 0.2789 -7.6254 {"}'S' sea -12.0692 0.1852 -7.8071 {"}'S' green -11.0977 0.2801 -7.0068 {"}'S' green -11.7294 0.2625 -7.8183 {"}'S' sea -10.8889 0.2332 -7.1584 {"}'S' green -11.0375 0.287 -7.3653 {"}'S' green -11.1952 0.3043 -7.5727 {"}'S' green -11.3569 0.2813 -7.7766 {"}'S' sea -10.9801 0.222 -7.7009 { CZ PHE 129 A}'S' green -11.9212 0.247 -7.9111 {"}'S' green -11.6695 0.3327 -7.9678 {"}'S' sea -11.8174 0.3825 -8.1728 {"}'S' green -11.2685 0.2673 -7.8217 {"}'S' green -11.3964 0.3703 -8.0167 {"}'S' green -11.5389 0.4362 -8.2195 {"}'S' sea -11.0659 0.3157 -7.9881 {"}'S' sea -11.2002 0.4141 -8.1891 {"}'S' sea -11.347 0.4749 -8.3968 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CE1 PHE 129 A}'S' P -11.7697 0.3185 -7.0437 {"}'S' -11.7672 0.2979 -7.0458 {"}'S' P -11.9274 0.3054 -7.2443 {"}'S' -11.9246 0.2909 -7.244 {"}'S' P -11.426 0.3301 -7.0174 {"}'S' -11.4268 0.308 -7.0203 {"}'S' P -11.5826 0.3531 -7.2248 {"}'S' -11.5802 0.2912 -7.2279 {"}'S' P -11.7442 0.3356 -7.4297 {"}'S' -11.7379 0.2866 -7.4253 {"}'S' P -11.2468 0.3331 -7.2141 {"}'S' -11.25 0.31 -7.2149 {"}'S' P -11.4037 0.3475 -7.4216 {"}'S' -11.4074 0.2956 -7.4182 {"}'S' P -11.5658 0.324 -7.6241 {"}'S' -11.5647 0.2926 -7.6188 @subgroup {2->1} dominant @dotlist {x} color= white width= 1 master= {vdw contact} { CB VAL 290 A}'S' blue -12.2382 0.6963 -8.0847 { CG1 VAL 290 A}'S' blue -12.5903 0.5647 -7.1808 { HB VAL 290 A}'S' sky -12.1814 0.5184 -7.8554 {"}'S' sky -12.031 0.6392 -8.1268 {"}'S' sky -11.8241 0.7627 -8.3028 {"}'S' blue -11.5813 0.8563 -8.3837 {"}'S' sky -11.2786 0.7543 -8.2714 @dotlist {x} color= white width= 1 master= {vdw contact} { HB VAL 290 A}'S' sea -12.1662 0.4399 -6.9725 {"}'S' sea -12.0088 0.4578 -6.7734 {"}'S' sea -12.2337 0.419 -7.4633 {"}'S' green -12.0963 0.3375 -7.2638 {"}'S' green -11.9444 0.3117 -7.0605 {"}'S' green -11.785 0.3422 -6.8632 {"}'S' sea -11.6266 0.4287 -6.6818 {"}'S' green -12.0726 0.3777 -7.6763 {"}'S' green -11.4805 0.3182 -6.8944 {"}'S' sea -11.3275 0.4342 -6.7289 {"}'S' sea -11.9434 0.4631 -7.9634 {"}'S' green -11.8272 0.3313 -7.778 {"}'S' green -11.2209 0.3412 -6.9959 {"}'S' sea -11.0708 0.477 -6.8406 {"}'S' sea -11.753 0.5664 -8.1575 {"}'S' green -11.6504 0.4136 -7.9824 {"}'S' green -11.522 0.3128 -7.7872 {"}'S' green -11.0588 0.3636 -7.2034 {"}'S' sea -11.5168 0.6474 -8.2411 {"}'S' green -11.4132 0.4887 -8.0631 {"}'S' green -11.2783 0.3938 -7.8622 {"}'S' green -11.1225 0.3696 -7.654 {"}'S' sea -10.9592 0.4185 -7.4575 {"}'S' sea -11.1761 0.6015 -8.0963 {"}'S' sea -11.0389 0.5265 -7.8969 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { HB VAL 290 A}'S' P -11.9419 0.2834 -7.4813 {"}'S' -11.941 0.2877 -7.4809 {"}'S' P -11.7946 0.2417 -7.279 {"}'S' -11.7879 0.2863 -7.2817 {"}'S' P -11.6391 0.2537 -7.0811 {"}'S' -11.6375 0.2944 -7.09 {"}'S' P -11.6906 0.2499 -7.5779 {"}'S' -11.6873 0.285 -7.5711 {"}'S' P -11.5382 0.225 -7.3742 {"}'S' -11.5418 0.2886 -7.3731 {"}'S' P -11.3789 0.2554 -7.1769 {"}'S' -11.3874 0.2991 -7.1831 {"}'S' P -11.3747 0.2698 -7.5847 {"}'S' -11.3798 0.2962 -7.5789 {"}'S' P -11.2165 0.2875 -7.3862 {"}'S' -11.2229 0.3059 -7.3854 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O PHE 129 A}'M' greentint -9.3637 2.1214 -6.2652 {"}'M' greentint -9.5073 2.0137 -6.5377 {"}'M' greentint -9.1017 2.4427 -6.1326 {"}'M' greentint -9.265 2.4093 -6.3345 {"}'M' greentint -9.4136 2.2524 -6.483 {"}'M' greentint -9.5173 2.1561 -6.7804 {"}'M' greentint -8.9578 2.6478 -6.1946 {"}'M' greentint -9.1158 2.6395 -6.3966 {"}'M' greentint -9.2744 2.5463 -6.575 {"}'M' greentint -9.4136 2.3783 -6.7082 {"}'M' greentint -9.4869 2.2501 -7.0252 {"}'M' greentint -8.7727 2.8179 -6.2606 {"}'M' greentint -8.9288 2.8286 -6.4645 {"}'M' greentint -9.089 2.7703 -6.6565 {"}'M' greentint -9.2438 2.6473 -6.8211 {"}'M' greentint -9.3795 2.4697 -6.9473 {"}'M' greentint -9.409 2.3303 -7.2635 {"}'M' greentint -8.6855 2.972 -6.5065 {"}'M' greentint -8.846 2.9486 -6.7086 {"}'M' greentint -9.0081 2.8664 -6.8942 {"}'M' greentint -9.1603 2.7304 -7.0542 {"}'M' greentint -9.297 2.5489 -7.179 {"}'M' greentint -8.7512 3.0114 -6.9676 {"}'M' greentint -8.907 2.9126 -7.1409 {"}'M' greentint -9.0532 2.7691 -7.2908 {"}'M' greentint -9.1839 2.5871 -7.4092 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 290 A}'M' greentint -9.4764 1.964 -6.6209 {"}'M' greentint -9.3182 2.0277 -6.4346 {"}'M' greentint -9.168 2.1521 -6.2748 {"}'M' greentint -9.0349 2.3277 -6.1517 {"}'M' greentint -8.9296 2.5424 -6.0739 {"}'M' greentint -9.4258 2.023 -6.9719 {"}'M' greentint -9.2677 2.0252 -6.7682 {"}'M' greentint -9.107 2.1012 -6.5813 {"}'M' greentint -8.9575 2.2465 -6.4289 {"}'M' greentint -8.8329 2.4465 -6.3231 {"}'M' greentint -8.7443 2.6841 -6.2751 {"}'M' greentint -9.3227 2.1856 -7.227 {"}'M' greentint -9.174 2.136 -7.0209 {"}'M' greentint -9.0116 2.1809 -6.8229 {"}'M' greentint -8.8574 2.3135 -6.6612 {"}'M' greentint -8.7332 2.5169 -6.5566 {"}'M' greentint -8.6549 2.7625 -6.5245 {"}'M' greentint -9.1947 2.4212 -7.3895 {"}'M' greentint -9.063 2.3195 -7.1913 {"}'M' greentint -8.902 2.3475 -6.9913 {"}'M' greentint -8.7539 2.4995 -6.8425 {"}'M' greentint -8.6591 2.7336 -6.7851 {"}'M' greentint -8.6428 2.9873 -6.8344 {"}'M' greentint -9.0337 2.6925 -7.4227 {"}'M' greentint -8.9295 2.5373 -7.2448 {"}'M' greentint -8.7695 2.6342 -7.0654 {"}'M' greentint -8.7145 2.8875 -7.0652 {"}'M' greentint -8.8478 2.7839 -7.2647 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H PHE 129 A}'M' sea -9.6587 1.1564 -4.2796 {"}'M' green -9.7919 1.0528 -4.4791 {"}'M' sea -9.6877 0.8976 -4.3012 {"}'M' sea -9.577 1.403 -4.2994 {"}'M' green -9.8636 0.953 -4.7098 {"}'M' sea -9.797 0.7477 -4.5667 {"}'M' sea -9.4435 1.6208 -4.353 {"}'M' green -9.6045 1.5928 -4.5529 {"}'M' green -9.8608 0.8017 -4.9277 {"}'M' sea -9.414 1.7939 -4.6255 {"}'M' green -9.5742 1.7028 -4.8084 {"}'M' green -9.7222 1.3784 -5.2527 {"}'M' green -9.7905 1.1294 -5.2704 {"}'M' sea -9.811 0.8762 -5.227 {"}'M' sea -9.4761 1.7742 -5.0443 {"}'M' green -9.6147 1.5995 -5.1751 @dotlist {x} color= sky width= 1 master= {H-bonds} { H PHE 129 A}'M' greentint -9.737 1.3061 -4.4789 {"}'M' greentint -9.8473 1.2067 -4.7591 {"}'M' greentint -9.7525 1.4408 -4.7018 {"}'M' greentint -9.8191 1.3041 -5.0127 {"}'M' greentint -9.8695 1.0495 -5.0081 {"}'M' greentint -9.7156 1.5323 -4.9439 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 290 A}'M' sea -9.9866 0.8375 -4.5166 {"}'M' green -9.862 1.0399 -4.413 {"}'M' green -9.7655 1.2731 -4.3531 {"}'M' green -9.7018 1.5248 -4.3405 {"}'M' sea -9.6745 1.7796 -4.3751 {"}'M' sea -10.0591 0.7563 -4.9047 {"}'M' green -9.9124 0.9059 -4.7572 {"}'M' green -9.6448 1.5907 -4.6008 {"}'M' sea -9.635 1.8409 -4.6581 {"}'M' green -9.9435 0.9341 -5.0625 {"}'M' green -9.648 1.8248 -4.9285 {"}'M' sea -9.9619 1.0643 -5.3139 {"}'M' green -9.8122 1.218 -5.163 {"}'M' green -9.7005 1.7108 -5.1554 {"}'M' sea -9.8537 1.3622 -5.3741 {"}'M' sea -9.7984 1.6135 -5.3729 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 290 A}'M' greentint -9.7887 1.1056 -4.6525 {"}'M' greentint -9.6968 1.3398 -4.5992 {"}'M' greentint -9.8051 1.1047 -4.931 {"}'M' greentint -9.7021 1.3281 -4.8601 {"}'M' greentint -9.6477 1.5779 -4.8598 {"}'M' greentint -9.7169 1.4543 -5.1055 @subgroup {mainchain} @vectorlist {mc} color= green alpha= 0.1176 master= {mainchain} { n thr A 289 6celA_303Y_291}P -6.835 6.2047 -11.812 {"}-6.835 6.2047 -11.812 { ca thr A 289 6celA_303Y_291}-8.1779 6.003 -11.2825 { c thr A 289 6celA_303Y_291}-8.0451 5.3894 -9.898 { o thr A 289 6celA_303Y_291}-7.2634 4.4536 -9.6943 { c thr A 289 6celA_303Y_291}P -8.0451 5.3894 -9.898 { n val A 290 6celA_303Y_291}-8.8173 5.921 -8.9541 { ca val A 290 6celA_303Y_291}-8.8057 5.4609 -7.5721 { c val A 290 6celA_303Y_291}-10.2119 5.0195 -7.1667 { o val A 290 6celA_303Y_291}-11.1509 5.8037 -7.2364 { c val A 290 6celA_303Y_291}P -10.2119 5.0195 -7.1667 { n val A 291 6celA_303Y_291}-10.3497 3.7588 -6.7614 { ca val A 291 6celA_303Y_291}-11.6451 3.2246 -6.3423 { c val A 291 6celA_303Y_291}-11.5922 2.8147 -4.8827 { o val A 291 6celA_303Y_291}-10.6926 2.0894 -4.4686 { c val A 291 6celA_303Y_291}P -11.5922 2.8147 -4.8827 { n thr A 292 6celA_303Y_291}-12.5787 3.2557 -4.1085 { ca thr A 292 6celA_303Y_291}-12.639 2.9627 -2.6836 { c thr A 292 6celA_303Y_291}-14.0081 2.3723 -2.3676 { o thr A 292 6celA_303Y_291}-15.0342 2.9997 -2.6334 { c thr A 292 6celA_303Y_291}P -14.0081 2.3723 -2.3676 { n gln A 293 6celA_303Y_291}-14.0077 1.1672 -1.8032 { ca gln A 293 6celA_303Y_291}-15.228 0.4252 -1.4818 { c gln A 293 6celA_303Y_291}-15.4764 0.2811 0.0092 { o gln A 293 6celA_303Y_291}-14.5947 -0.1395 0.7532 { n asn A 301 6celA_303Y_291}P -11.9453 -1.2395 1.2659 {"}-11.9453 -1.2395 1.2659 { ca asn A 301 6celA_303Y_291}-11.0825 -1.8152 0.2508 { c asn A 301 6celA_303Y_291}-10.7258 -0.762 -0.7888 { o asn A 301 6celA_303Y_291}-11.4502 0.2187 -0.9826 { c asn A 301 6celA_303Y_291}P -10.7258 -0.762 -0.7888 { n arg A 302 6celA_303Y_291}-9.6194 -0.9899 -1.4837 { ca arg A 302 6celA_303Y_291}-9.1233 -0.0251 -2.4442 { c arg A 302 6celA_303Y_291}-8.3521 -0.6488 -3.5941 { o arg A 302 6celA_303Y_291}-7.6164 -1.623 -3.4171 { c arg A 302 6celA_303Y_291}P -8.3521 -0.6488 -3.5941 { n tyr A 303 6celA_303Y_291}-8.5812 -0.1221 -4.7861 { ca tyr A 303 6celA_303Y_291}-7.851 -0.564 -5.9549 { c tyr A 303 6celA_303Y_291}-7.6692 0.6385 -6.8678 { o tyr A 303 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-13.5424 -0.4655 -7.2506 {"}'S' green -13.3844 -0.3798 -7.0696 {"}'S' green -13.2343 -0.2439 -6.9143 {"}'S' sea -13.6855 -0.4081 -7.8609 {"}'S' green -13.5382 -0.4512 -7.6584 {"}'S' sea -13.5767 -0.2323 -8.1368 {"}'S' green -13.4418 -0.3271 -7.9359 {"}'S' sea -13.4422 0.0334 -8.3451 {"}'S' green -13.3396 -0.1194 -8.17 {"}'S' green -13.2024 -0.1944 -7.9706 {"}'S' sea -13.2525 0.312 -8.4075 {"}'S' green -13.1847 0.1035 -8.2621 {"}'S' green -13.0513 0.0007 -8.0615 {"}'S' green -12.8877 0.0294 -7.8581 {"}'S' green -12.7371 0.1833 -7.7062 {"}'S' sea -13.0313 0.3826 -8.2854 {"}'S' green -12.9263 0.2263 -8.1062 {"}'S' sea -12.7659 0.324 -7.9264 {HG21 VAL 291 A}'S' sea -12.9442 0.5963 -8.9175 {"}'S' sea -12.7869 0.6142 -8.7184 {"}'S' sea -13.2156 0.8833 -9.7571 {"}'S' green -13.1271 0.7071 -9.5943 {"}'S' sea -13.0117 0.5754 -9.4083 {"}'S' green -12.8744 0.4939 -9.2088 {"}'S' green -12.7224 0.4682 -9.0055 {"}'S' green -12.563 0.4986 -8.8082 {"}'S' green -12.4046 0.5851 -8.6268 {"}'S' green -13.0406 0.8572 -9.9564 {"}'S' green -12.9595 0.6748 -9.8004 {"}'S' green -12.8507 0.5341 -9.6213 {"}'S' green -12.72 0.4398 -9.4263 {"}'S' green -12.1056 0.5906 -8.6739 {"}'S' green -12.8091 0.7956 -10.0718 {"}'S' green -12.7214 0.6195 -9.9084 {"}'S' green -12.6052 0.4877 -9.723 {"}'S' green -12.4687 0.4063 -9.5229 {"}'S' green -11.8488 0.6334 -8.7856 {"}'S' sea -12.5311 0.7228 -10.1025 {"}'S' green -12.4285 0.57 -9.9274 {"}'S' green -12.3 0.4692 -9.7322 {"}'S' green -11.8369 0.52 -9.1484 {"}'S' green -11.6864 0.6514 -8.9898 {"}'S' sea -12.0563 0.5502 -9.8072 {"}'S' green -11.9005 0.526 -9.599 {"}'S' green -11.7373 0.575 -9.4025 {"}'S' green -11.5801 0.6933 -9.2317 {"}'S' sea -11.8169 0.6829 -9.8419 {"}'S' green -11.6606 0.6937 -9.6426 {"}'S' green -11.5045 0.7891 -9.4681 {"}'S' sea -11.5023 0.9067 -9.7294 @vectorlist {x} color= green width= 1 alpha= 0.1176 master= {small overlap} { CG1 VAL 291 A}'S' P -12.7533 -0.0047 -7.2514 {"}'S' -12.7575 0.0038 -7.2488 {HG11 VAL 291 A}'S' P -13.3801 -0.4334 -7.4599 {"}'S' -13.3931 -0.3975 -7.4586 {"}'S' P -13.2223 -0.3574 -7.2771 {"}'S' -13.2455 -0.3132 -7.283 {"}'S' P -13.0719 -0.226 -7.1185 {"}'S' -13.0862 -0.2081 -7.125 {"}'S' P -13.286 -0.3513 -7.7277 {"}'S' -13.3026 -0.3158 -7.7175 {"}'S' P -13.1228 -0.3024 -7.5312 {"}'S' -13.163 -0.2407 -7.5234 {"}'S' P -12.9655 -0.184 -7.3604 {"}'S' -13.0047 -0.1424 -7.3636 {"}'S' P -13.0461 -0.1836 -7.7713 {"}'S' -13.071 -0.1533 -7.7593 {"}'S' P -12.8899 -0.0883 -7.5968 {"}'S' -12.9196 -0.0624 -7.5902 {HG21 VAL 291 A}'S' P -12.5727 0.3981 -9.224 {"}'S' -12.5682 0.4243 -9.2255 {"}'S' P -12.4172 0.4101 -9.0261 {"}'S' -12.4154 0.4592 -9.0365 {"}'S' P -12.2585 0.4746 -8.8394 {"}'S' -12.2619 0.5028 -8.8505 {"}'S' P -12.3163 0.3814 -9.3192 {"}'S' -12.3183 0.4313 -9.3179 {"}'S' P -12.1569 0.4118 -9.1219 {"}'S' -12.1687 0.4688 -9.1306 {"}'S' P -11.9989 0.4976 -8.9409 {"}'S' -12.0054 0.516 -8.9472 {"}'S' P -12.1528 0.4262 -9.5297 {"}'S' -12.153 0.4299 -9.5292 {"}'S' P -11.9946 0.4439 -9.3312 {"}'S' -12.0021 0.4644 -9.3307 @subgroup {1->2} dominant @dotlist {x} color= red width= 1 master= {H-bonds} { O TYR 303 A}'M' greentint -9.4476 2.3278 -6.1536 {"}'M' greentint -9.1404 2.5663 -6.0137 {"}'M' greentint -9.2983 2.558 -6.2157 {"}'M' greentint -9.4569 2.4648 -6.3941 {"}'M' greentint -9.5962 2.2968 -6.5273 {"}'M' greentint -9.6695 2.1686 -6.8443 {"}'M' greentint -8.9552 2.7364 -6.0797 {"}'M' greentint -9.1113 2.7471 -6.2836 {"}'M' greentint -9.2715 2.6888 -6.4756 {"}'M' greentint -9.4263 2.5657 -6.6402 {"}'M' greentint -9.562 2.3882 -6.7664 {"}'M' greentint -9.5916 2.2488 -7.0826 {"}'M' greentint -8.8681 2.8905 -6.3256 {"}'M' greentint -9.0282 2.8665 -6.527 {"}'M' greentint -9.1907 2.7849 -6.7133 {"}'M' greentint -9.3429 2.6489 -6.8733 {"}'M' greentint -9.4795 2.4673 -6.9981 {"}'M' greentint -8.7746 2.981 -6.5945 {"}'M' greentint -8.9338 2.9299 -6.7866 {"}'M' greentint -9.0896 2.8311 -6.96 {"}'M' greentint -9.2357 2.6876 -7.1098 {"}'M' greentint -9.3665 2.5056 -7.2283 {"}'M' greentint -8.6168 3.025 -6.8023 {"}'M' greentint -8.777 2.9643 -6.9921 {"}'M' greentint -8.9338 2.8584 -7.1652 {"}'M' greentint -9.0805 2.7113 -7.315 {"}'M' greentint -9.2126 2.5283 -7.435 @subgroup {2->1} dominant @dotlist {x} color= sky width= 1 master= {H-bonds} { H VAL 291 A}'M' greentint -9.5568 2.1538 -6.3981 {"}'M' greentint -9.4018 2.251 -6.2256 {"}'M' greentint -9.2605 2.4018 -6.084 {"}'M' greentint -9.6004 2.1144 -6.8725 {"}'M' greentint -9.4461 2.1137 -6.6734 {"}'M' greentint -9.2879 2.1774 -6.4871 {"}'M' greentint -9.1377 2.3019 -6.3273 {"}'M' greentint -9.0045 2.4775 -6.2042 {"}'M' greentint -8.8993 2.6921 -6.1264 {"}'M' greentint -9.5369 2.2457 -7.2275 {"}'M' greentint -9.3955 2.1727 -7.0244 {"}'M' greentint -9.2373 2.1749 -6.8207 {"}'M' greentint -9.0766 2.2509 -6.6338 {"}'M' greentint -8.9271 2.3963 -6.4814 {"}'M' greentint -8.8025 2.5962 -6.3756 {"}'M' greentint -8.7139 2.8338 -6.3276 {"}'M' greentint -9.2924 2.3354 -7.2795 {"}'M' greentint -9.1436 2.2858 -7.0734 {"}'M' greentint -8.9813 2.3307 -6.8754 {"}'M' greentint -8.8271 2.4633 -6.7137 {"}'M' greentint -8.7028 2.6666 -6.6091 {"}'M' greentint -8.6245 2.9123 -6.577 {"}'M' greentint -9.0326 2.4692 -7.2438 {"}'M' greentint -8.8716 2.4973 -7.0438 {"}'M' greentint -8.7236 2.6492 -6.895 {"}'M' greentint -8.6288 2.8834 -6.8376 {"}'M' greentint -8.8991 2.6871 -7.2973 {"}'M' greentint -8.7392 2.784 -7.1179 @subgroup {1->2} dominant @dotlist {x} color= sky width= 1 master= {vdw contact} { H TYR 303 A}'M' green -10.0333 0.7643 -4.3587 {"}'M' green -10.222 0.8146 -4.8382 {"}'M' green -9.6864 1.127 -4.2339 {"}'M' green -10.1937 0.912 -5.0918 {"}'M' green -9.4948 1.3037 -4.2978 {"}'M' green -9.3812 1.4978 -4.549 {"}'M' green -9.4047 1.5842 -5.0024 {"}'M' green -9.5629 1.5205 -5.1887 {"}'M' green -9.7131 1.3961 -5.3486 @dotlist {x} color= sky width= 1 master= {H-bonds} { H TYR 303 A}'M' greentint -9.9517 1.0109 -4.3785 {"}'M' greentint -10.1116 0.914 -4.5579 {"}'M' greentint -9.8182 1.2287 -4.432 {"}'M' greentint -9.9792 1.2007 -4.632 {"}'M' greentint -10.1272 1.0487 -4.7809 {"}'M' greentint -9.6297 1.3986 -4.4987 {"}'M' greentint -9.7886 1.4017 -4.7046 {"}'M' greentint -9.9489 1.3107 -4.8875 {"}'M' greentint -10.0903 1.1402 -5.023 {"}'M' greentint -9.5329 1.5333 -4.7542 {"}'M' greentint -9.6942 1.4941 -4.9521 {"}'M' greentint -9.8508 1.3821 -5.1234 {"}'M' greentint -9.9894 1.2074 -5.2542 @subgroup {2->1} dominant @dotlist {x} color= red width= 1 master= {vdw contact} { O VAL 291 A}'M' green -10.2172 0.7731 -4.5232 {"}'M' green -10.0592 0.8472 -4.3394 {"}'M' green -9.9074 0.9678 -4.1766 {"}'M' green -10.2716 0.8561 -4.9804 {"}'M' green -10.188 1.034 -5.2383 {"}'M' green -9.4507 1.4473 -4.4001 {"}'M' green -10.0598 1.2457 -5.3899 @dotlist {x} color= red width= 1 master= {H-bonds} { O VAL 291 A}'M' greentint -10.1144 0.8515 -4.7747 {"}'M' greentint -9.9518 0.9072 -4.5806 {"}'M' greentint -9.7939 1.0175 -4.4071 {"}'M' greentint -9.6486 1.1792 -4.2642 {"}'M' greentint -10.04 0.9869 -5.0338 {"}'M' greentint -9.8808 1.0094 -4.8333 {"}'M' greentint -9.7211 1.0979 -4.6523 {"}'M' greentint -9.5744 1.2475 -4.5048 {"}'M' greentint -9.9214 1.1689 -5.1883 {"}'M' greentint -9.7626 1.1799 -4.9874 {"}'M' greentint -9.6055 1.2758 -4.8101 {"}'M' greentint -9.4671 1.4463 -4.6786 {"}'M' greentint -9.7871 1.3767 -5.2641 {"}'M' greentint -9.6239 1.4059 -5.0615 {"}'M' greentint -9.4742 1.5596 -4.9106 @group {avg Gly} dominant @subgroup {mainchain} @vectorlist {mc} color= blue width= 4 master= {mainchain} { n ala 1 B85.73 gly_avg_renumr}P -11.9127 -1.9184 0.6862 {"}-11.9127 -1.9184 0.6862 { ca ala 1 B46.64 gly_avg_renumr}-10.9342 -2.1575 -0.1614 { c ala 1 B33.25 gly_avg_renumr}-10.7219 -1.0085 -1.1017 { o ala 1 B75.48 gly_avg_renumr}-11.5805 -0.4147 -1.5441 { c ala 1 B33.25 gly_avg_renumr}P -10.7219 -1.0085 -1.1017 { n ala 2 B31.05 gly_avg_renumr}-9.5801 -0.7016 -1.3931 { ca ala 2 B38.55 gly_avg_renumr}-9.2304 0.3447 -2.3184 { c ala 2 B40.33 gly_avg_renumr}-8.4768 -0.2596 -3.4739 { o ala 2 B59.19 gly_avg_renumr}-7.7828 -1.2388 -3.3098 { c ala 2 B40.33 gly_avg_renumr}P -8.4768 -0.2596 -3.4739 { n phe 3 B33.87 gly_avg_renumr}-8.6082 0.3182 -4.6423 { ca phe 3 B40.97 gly_avg_renumr}-7.8965 -0.1827 -5.7993 { c phe 3 B33.57 gly_avg_renumr}-7.5234 0.9453 -6.7254 { o phe 3 B33.85 gly_avg_renumr}-8.1107 2.0125 -6.6786 { c phe 3 B33.57 gly_avg_renumr}P -7.5234 0.9453 -6.7254 { n ala 4 B39.87 gly_avg_renumr}-6.5423 0.6868 -7.5651 { ca ala 4 B41.41 gly_avg_renumr}-6.1213 1.6279 -8.5721 { c ala 4 B27.37 gly_avg_renumr}-6.1118 0.9757 -9.8721 { o ala 4 B59.59 gly_avg_renumr}-5.7135 -0.1219 -9.9612 { c ala 4 B27.37 gly_avg_renumr}P -6.1118 0.9757 -9.8721 { n ala 5 B35.72 gly_avg_renumr}-6.5593 1.6448 -10.8716 { ca ala 5 B70.18 gly_avg_renumr}-6.5665 1.1567 -12.1669 { c ala 5 B77.00 gly_avg_renumr}-6.0241 2.0965 -13.1099 { o ala 5 B76.81 gly_avg_renumr}-6.2106 3.2198 -13.0546 { n ala 6 B127.79 gly_avg_renumr}P -7.4923 5.5125 -12.3324 {"}-7.4923 5.5125 -12.3324 { ca ala 6 B141.39 gly_avg_renumr}-8.5658 5.6652 -11.4688 { c ala 6 B102.13 gly_avg_renumr}-8.3908 5.0072 -10.1928 { o ala 6 B79.26 gly_avg_renumr}-7.713 4.0662 -10.1462 { c ala 6 B102.13 gly_avg_renumr}P -8.3908 5.0072 -10.1928 { n ala 7 B107.82 gly_avg_renumr}-8.9887 5.5132 -9.1585 { ca ala 7 B80.31 gly_avg_renumr}-8.9372 4.9601 -7.8751 { c ala 7 B56.23 gly_avg_renumr}-10.3265 4.7357 -7.4107 { o ala 7 B75.99 gly_avg_renumr}-11.2239 5.5055 -7.6377 { c ala 7 B56.23 gly_avg_renumr}P -10.3265 4.7357 -7.4107 { n gly 8 B35.41 gly_avg_renumr}-10.501 3.6805 -6.7718 { ca gly 8 B47.73 gly_avg_renumr}-11.7904 3.3692 -6.2772 { c gly 8 B47.57 gly_avg_renumr}-11.7232 2.7837 -4.92 { o gly 8 B37.24 gly_avg_renumr}-10.7106 2.3531 -4.4403 { c gly 8 B47.57 gly_avg_renumr}P -11.7232 2.7837 -4.92 { n ala 9 B82.70 gly_avg_renumr}-12.8186 2.7802 -4.2999 { ca ala 9 B106.62 gly_avg_renumr}-12.9251 2.2189 -3.0067 { c ala 9 B144.09 gly_avg_renumr}-14.12 1.5009 -2.9088 { o ala 9 B168.49 gly_avg_renumr}-15.0841 1.921 -3.4343 { c ala 9 B144.09 gly_avg_renumr}P -14.12 1.5009 -2.9088 { n ala 10 B162.25 gly_avg_renumr}-14.0529 0.4269 -2.2352 { ca ala 10 B210.77 gly_avg_renumr}-15.1532 -0.3073 -2.0228 { c ala 10 B201.60 gly_avg_renumr}-15.3463 -0.8093 -0.768 { o ala 10 B183.09 gly_avg_renumr}-14.5897 -1.0857 -0.136 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala 1 B85.73 gly_avg_renumr}P -11.9127 -1.9184 0.6862 { ca ala 1 B46.64 gly_avg_renumr}P -10.9342 -2.1575 -0.1614 { n ala 2 B31.05 gly_avg_renumr}P -9.5801 -0.7016 -1.3931 { ca ala 2 B38.55 gly_avg_renumr}P -9.2304 0.3447 -2.3184 { n phe 3 B33.87 gly_avg_renumr}P -8.6082 0.3182 -4.6423 { ca phe 3 B40.97 gly_avg_renumr}P -7.8965 -0.1827 -5.7993 { n ala 4 B39.87 gly_avg_renumr}P -6.5423 0.6868 -7.5651 { ca ala 4 B41.41 gly_avg_renumr}P -6.1213 1.6279 -8.5721 { n ala 5 B35.72 gly_avg_renumr}P -6.5593 1.6448 -10.8716 { ca ala 5 B70.18 gly_avg_renumr}P -6.5665 1.1567 -12.1669 { n ala 6 B127.79 gly_avg_renumr}P -7.4923 5.5125 -12.3324 { ca ala 6 B141.39 gly_avg_renumr}P -8.5658 5.6652 -11.4688 { n ala 7 B107.82 gly_avg_renumr}P -8.9887 5.5132 -9.1585 { ca ala 7 B80.31 gly_avg_renumr}P -8.9372 4.9601 -7.8751 { n gly 8 B35.41 gly_avg_renumr}P -10.501 3.6805 -6.7718 { ca gly 8 B47.73 gly_avg_renumr}P -11.7904 3.3692 -6.2772 {"}P -11.7904 3.3692 -6.2772 { n ala 9 B82.70 gly_avg_renumr}P -12.8186 2.7802 -4.2999 { ca ala 9 B106.62 gly_avg_renumr}P -12.9251 2.2189 -3.0067 { n ala 10 B162.25 gly_avg_renumr}P -14.0529 0.4269 -2.2352 { ca ala 10 B210.77 gly_avg_renumr}P -15.1532 -0.3073 -2.0228 @subgroup {sidechain} @vectorlist {sc} color= blue width= 4 master= {sidechain} { ca ala 2 B38.55 gly_avg_renumr}P -9.2304 0.3447 -2.3184 { ca phe 3 B40.97 gly_avg_renumr}P -7.8965 -0.1827 -5.7993 { cb phe 3 B30.00 gly_avg_renumr}-8.7306 -1.2264 -6.5452 { cg phe 3 B30.00 gly_avg_renumr}-9.9913 -0.6782 -7.1473 { cd2 phe 3 B30.00 gly_avg_renumr}-11.2112 -0.8541 -6.5178 { ce2 phe 3 B30.00 gly_avg_renumr}-12.3743 -0.3499 -7.0693 { cz phe 3 B30.00 gly_avg_renumr}ghost -12.3283 0.3368 -8.2615 { ce1 phe 3 B30.00 gly_avg_renumr}P -11.1195 0.5188 -8.9008 { cz phe 3 B30.00 gly_avg_renumr}-12.3283 0.3368 -8.2615 { cd1 phe 3 B30.00 gly_avg_renumr}P -9.9588 0.0125 -8.3453 { ce1 phe 3 B30.00 gly_avg_renumr}-11.1195 0.5188 -8.9008 { cg phe 3 B30.00 gly_avg_renumr}P -9.9913 -0.6782 -7.1473 { cd1 phe 3 B30.00 gly_avg_renumr}-9.9588 0.0125 -8.3453 { ca ala 7 B80.31 gly_avg_renumr}P -8.9372 4.9601 -7.8751 { ca ala 9 B106.62 gly_avg_renumr}P -12.9251 2.2189 -3.0067 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe 3 B30.00 gly_avg_renumr}P -8.7306 -1.2264 -6.5452 {"}P -8.7306 -1.2264 -6.5452 { cd2 phe 3 B30.00 gly_avg_renumr}P -11.2112 -0.8541 -6.5178 { cd1 phe 3 B30.00 gly_avg_renumr}P -9.9588 0.0125 -8.3453 { ce1 phe 3 B30.00 gly_avg_renumr}P -11.1195 0.5188 -8.9008 { ce2 phe 3 B30.00 gly_avg_renumr}P -12.3743 -0.3499 -7.0693 { cz phe 3 B30.00 gly_avg_renumr}P -12.3283 0.3368 -8.2615 @subgroup {balls} dominant master= {balls} @balllist {Drawn balls} color= blue radius= 0.089 {drawn}-10.501 3.6805 -6.7718 {"}-8.6082 0.3182 -4.6423 @balllist {Drawn balls} color= red radius= 0.089 {drawn}-10.7106 2.3531 -4.4403 {"}-8.1107 2.0125 -6.6786 @group {avg oth} dominant @subgroup {mainchain} @vectorlist {mc} color= green width= 4 master= {mainchain} { n ala 1 B100.65 ee_avg_renumre}P -11.9091 -1.8286 0.6478 {"}-11.9091 -1.8286 0.6478 { ca ala 1 B57.11 ee_avg_renumre}-10.9523 -2.0953 -0.1632 { c ala 1 B38.33 ee_avg_renumre}-10.7282 -0.9921 -1.1273 { o ala 1 B81.81 ee_avg_renumre}-11.5753 -0.3944 -1.5807 { c ala 1 B38.33 ee_avg_renumre}P -10.7282 -0.9921 -1.1273 { n ala 2 B26.03 ee_avg_renumre}-9.5864 -0.7236 -1.4307 { ca ala 2 B44.41 ee_avg_renumre}-9.2437 0.2966 -2.3637 { c ala 2 B48.34 ee_avg_renumre}-8.3456 -0.2794 -3.4231 { o ala 2 B65.35 ee_avg_renumre}-7.5222 -1.1256 -3.1415 { c ala 2 B48.34 ee_avg_renumre}P -8.3456 -0.2794 -3.4231 { n phe 3 B42.86 ee_avg_renumre}-8.5075 0.1685 -4.6435 { ca phe 3 B47.94 ee_avg_renumre}-7.6476 -0.278 -5.7189 { c phe 3 B36.90 ee_avg_renumre}-7.4427 0.8198 -6.7293 { o phe 3 B37.23 ee_avg_renumre}-8.2242 1.7529 -6.8058 { c phe 3 B36.90 ee_avg_renumre}P -7.4427 0.8198 -6.7293 { n ala 4 B38.71 ee_avg_renumre}-6.3715 0.7074 -7.484 { ca ala 4 B35.12 ee_avg_renumre}-6.0579 1.6566 -8.523 { c ala 4 B24.05 ee_avg_renumre}-6.114 0.9973 -9.8361 { o ala 4 B50.09 ee_avg_renumre}-5.7059 -0.1108 -9.9745 { c ala 4 B24.05 ee_avg_renumre}P -6.114 0.9973 -9.8361 { n ala 5 B38.89 ee_avg_renumre}-6.6304 1.6769 -10.7923 { ca ala 5 B67.94 ee_avg_renumre}-6.6964 1.1898 -12.1104 { c ala 5 B86.96 ee_avg_renumre}-6.0513 2.0994 -13.0026 { o ala 5 B98.16 ee_avg_renumre}-6.1716 3.228 -12.9191 { n ala 6 B132.42 ee_avg_renumre}P -7.1349 5.8426 -11.7966 {"}-7.1349 5.8426 -11.7966 { ca ala 6 B129.34 ee_avg_renumre}-8.1905 6.0598 -10.974 { c ala 6 B94.81 ee_avg_renumre}-8.1583 5.2349 -9.7784 { o ala 6 B85.97 ee_avg_renumre}-7.7472 4.1494 -9.8536 { c ala 6 B94.81 ee_avg_renumre}P -8.1583 5.2349 -9.7784 { n ala 7 B93.70 ee_avg_renumre}-8.586 5.7553 -8.6811 { ca ala 7 B74.72 ee_avg_renumre}-8.6562 5.0488 -7.4676 { c ala 7 B51.32 ee_avg_renumre}-10.0809 4.8303 -7.1127 { o ala 7 B65.70 ee_avg_renumre}-10.8983 5.7131 -7.2092 { c ala 7 B51.32 ee_avg_renumre}P -10.0809 4.8303 -7.1127 { n ala 8 B34.17 ee_avg_renumre}-10.3715 3.651 -6.7132 { ca ala 8 B41.12 ee_avg_renumre}-11.6927 3.2933 -6.3357 { c ala 8 B44.78 ee_avg_renumre}-11.678 2.6961 -4.9676 { o ala 8 B43.36 ee_avg_renumre}-10.7892 2.0024 -4.5767 { c ala 8 B44.78 ee_avg_renumre}P -11.678 2.6961 -4.9676 { n ala 9 B78.87 ee_avg_renumre}-12.6621 2.9727 -4.247 { ca ala 9 B102.92 ee_avg_renumre}-12.7955 2.4151 -2.9452 { c ala 9 B150.14 ee_avg_renumre}-14.0116 1.7938 -2.8419 { o ala 9 B181.66 ee_avg_renumre}-14.946 2.3328 -3.2896 { c ala 9 B150.14 ee_avg_renumre}P -14.0116 1.7938 -2.8419 { n ala 10 B166.85 ee_avg_renumre}-13.9924 0.6595 -2.263 { ca ala 10 B211.25 ee_avg_renumre}-15.1062 -0.0749 -2.0858 { c ala 10 B223.24 ee_avg_renumre}-15.2871 -0.5059 -0.7639 { o ala 10 B208.77 ee_avg_renumre}-14.4702 -0.8355 -0.1093 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ala 1 B100.65 ee_avg_renumre}P -11.9091 -1.8286 0.6478 { ca ala 1 B57.11 ee_avg_renumre}P -10.9523 -2.0953 -0.1632 { n ala 2 B26.03 ee_avg_renumre}P -9.5864 -0.7236 -1.4307 { ca ala 2 B44.41 ee_avg_renumre}P -9.2437 0.2966 -2.3637 { n phe 3 B42.86 ee_avg_renumre}P -8.5075 0.1685 -4.6435 { ca phe 3 B47.94 ee_avg_renumre}P -7.6476 -0.278 -5.7189 { n ala 4 B38.71 ee_avg_renumre}P -6.3715 0.7074 -7.484 { ca ala 4 B35.12 ee_avg_renumre}P -6.0579 1.6566 -8.523 { n ala 5 B38.89 ee_avg_renumre}P -6.6304 1.6769 -10.7923 { ca ala 5 B67.94 ee_avg_renumre}P -6.6964 1.1898 -12.1104 { n ala 6 B132.42 ee_avg_renumre}P -7.1349 5.8426 -11.7966 { ca ala 6 B129.34 ee_avg_renumre}P -8.1905 6.0598 -10.974 { n ala 7 B93.70 ee_avg_renumre}P -8.586 5.7553 -8.6811 { ca ala 7 B74.72 ee_avg_renumre}P -8.6562 5.0488 -7.4676 { n ala 8 B34.17 ee_avg_renumre}P -10.3715 3.651 -6.7132 { ca ala 8 B41.12 ee_avg_renumre}P -11.6927 3.2933 -6.3357 { n ala 9 B78.87 ee_avg_renumre}P -12.6621 2.9727 -4.247 { ca ala 9 B102.92 ee_avg_renumre}P -12.7955 2.4151 -2.9452 { n ala 10 B166.85 ee_avg_renumre}P -13.9924 0.6595 -2.263 { ca ala 10 B211.25 ee_avg_renumre}P -15.1062 -0.0749 -2.0858 @subgroup {sidechain} @vectorlist {sc} color= green width= 4 master= {sidechain} { ca ala 2 B44.41 ee_avg_renumre}P -9.2437 0.2966 -2.3637 { ca phe 3 B47.94 ee_avg_renumre}P -7.6476 -0.278 -5.7189 { cb phe 3 B30.00 ee_avg_renumre}-8.1905 -1.5335 -6.4049 { cg phe 3 B30.00 ee_avg_renumre}-9.4824 -1.3136 -7.1382 { cd2 phe 3 B30.00 ee_avg_renumre}-10.694 -1.6069 -6.5396 { ce2 phe 3 B30.00 ee_avg_renumre}-11.8844 -1.4047 -7.2124 { cz phe 3 B30.00 ee_avg_renumre}ghost -11.8732 -0.9059 -8.4968 { ce1 phe 3 B30.00 ee_avg_renumre}P -10.6723 -0.6102 -9.1058 { cz phe 3 B30.00 ee_avg_renumre}-11.8732 -0.9059 -8.4968 { cd1 phe 3 B30.00 ee_avg_renumre}P -9.4843 -0.8144 -8.4289 { ce1 phe 3 B30.00 ee_avg_renumre}-10.6723 -0.6102 -9.1058 { cg phe 3 B30.00 ee_avg_renumre}P -9.4824 -1.3136 -7.1382 { cd1 phe 3 B30.00 ee_avg_renumre}-9.4843 -0.8144 -8.4289 { ca ala 7 B74.72 ee_avg_renumre}P -8.6562 5.0488 -7.4676 { ca ala 8 B41.12 ee_avg_renumre}P -11.6927 3.2933 -6.3357 { cb ala 8 B73.13 ee_avg_renumre}-12.2437 2.292 -7.2826 { ca ala 9 B102.92 ee_avg_renumre}P -12.7955 2.4151 -2.9452 { cb ala 10 B244.71 ee_avg_renumre}P -15.0769 -1.1513 -2.8047 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe 3 B30.00 ee_avg_renumre}P -8.1905 -1.5335 -6.4049 {"}P -8.1905 -1.5335 -6.4049 { cd2 phe 3 B30.00 ee_avg_renumre}P -10.694 -1.6069 -6.5396 { cd1 phe 3 B30.00 ee_avg_renumre}P -9.4843 -0.8144 -8.4289 { ce1 phe 3 B30.00 ee_avg_renumre}P -10.6723 -0.6102 -9.1058 { ce2 phe 3 B30.00 ee_avg_renumre}P -11.8844 -1.4047 -7.2124 { cz phe 3 B30.00 ee_avg_renumre}P -11.8732 -0.9059 -8.4968 @subgroup {balls} dominant master= {balls} @balllist {Drawn balls} color= blue radius= 0.089 {drawn}-8.5075 0.1685 -4.6435 {"}-10.3715 3.651 -6.7132 @balllist {Drawn balls} color= red radius= 0.089 {drawn}-10.7892 2.0024 -4.5767 {"}-8.2242 1.7529 -6.8058 @group {avg b'rub axis} dominant @subgroup {Drawn objs 6} dominant @vectorlist {Drawn vectors} color= magenta width= 3 {drawn}P -9.141 0.3817 -2.4934 {"}-6.1474 1.6196 -8.3481 @group {avg HB dots} dominant @subgroup {Drawn objs 1} dominant @dotlist {Drawn dots} color= greentint width= 4 {drawn}-10.5489 2.1965 -4.4559 {"}-10.3872 2.04 -4.4714 {"}-10.2255 1.8835 -4.4869 {"}-10.0637 1.7269 -4.5025 {"}-9.902 1.5704 -4.518 {"}-9.7403 1.4139 -4.5336 {"}-9.5786 1.2574 -4.5491 {"}-9.4168 1.1008 -4.5646 {"}-9.2551 0.9443 -4.5802 {"}-9.0934 0.7878 -4.5957 {"}-8.9317 0.6312 -4.6113 {"}-8.77 0.4747 -4.6268 {"}-8.2946 2.1408 -6.6858 {"}-8.4784 2.2691 -6.693 {"}-8.6623 2.3975 -6.7001 {"}-8.8462 2.5258 -6.7073 {"}-9.03 2.6541 -6.7145 {"}-9.2139 2.7824 -6.7216 {"}-9.3978 2.9107 -6.7288 {"}-9.5816 3.039 -6.7359 {"}-9.7655 3.1673 -6.7431 {"}-9.9494 3.2956 -6.7503 {"}-10.1332 3.4239 -6.7574 {"}-10.3171 3.5522 -6.7646 @group {BRDEE 1gyh G122} off dominant @subgroup {mainchain} @vectorlist {mc} color= bluetint width= 6 master= {mainchain} { n leu A 107 savedMol1_1gyh}P -12.084 -1.804 0.61 {"}-12.084 -1.804 0.61 { ca leu A 107 savedMol1_1gyh}-10.966 -2.236 -0.199 { c leu A 107 savedMol1_1gyh}-10.757 -1.183 -1.295 { o leu A 107 savedMol1_1gyh}-11.539 -1.099 -2.236 { c leu A 107 savedMol1_1gyh}P -10.757 -1.183 -1.295 { n tyr A 108 savedMol1_1gyh}-9.709 -0.393 -1.14 { ca tyr A 108 savedMol1_1gyh}-9.264 0.59 -2.121 { c tyr A 108 savedMol1_1gyh}-8.339 -0.093 -3.126 { o tyr A 108 savedMol1_1gyh}-7.652 -1.029 -2.778 { c tyr A 108 savedMol1_1gyh}P -8.339 -0.093 -3.126 { n tyr A 109 savedMol1_1gyh}-8.354 0.371 -4.386 { ca tyr A 109 savedMol1_1gyh}-7.656 -0.306 -5.46 { c tyr A 109 savedMol1_1gyh}-7.393 0.729 -6.572 { o tyr A 109 savedMol1_1gyh}-8.084 1.757 -6.624 { c tyr A 109 savedMol1_1gyh}P -7.393 0.729 -6.572 { n ser A 110 savedMol1_1gyh}-6.397 0.453 -7.426 { ca ser A 110 savedMol1_1gyh}-5.939 1.392 -8.465 { c ser A 110 savedMol1_1gyh}-6.19 0.819 -9.877 { o ser A 110 savedMol1_1gyh}-5.922 -0.348 -10.141 { c ser A 110 savedMol1_1gyh}P -6.19 0.819 -9.877 { n val A 111 savedMol1_1gyh}-6.742 1.655 -10.741 { ca val A 111 savedMol1_1gyh}-6.842 1.415 -12.207 { c val A 111 savedMol1_1gyh}-5.825 2.346 -12.882 { o val A 111 savedMol1_1gyh}-5.816 3.552 -12.669 { n ala A 120 savedMol1_1gyh}P -6.851 6.102 -11.567 {"}-6.851 6.102 -11.567 { ca ala A 120 savedMol1_1gyh}-7.852 6.434 -10.564 { c ala A 120 savedMol1_1gyh}-7.853 5.374 -9.461 { o ala A 120 savedMol1_1gyh}-7.609 4.164 -9.718 { c ala A 120 savedMol1_1gyh}P -7.853 5.374 -9.461 { n ile A 121 savedMol1_1gyh}-8.166 5.857 -8.259 { ca ile A 121 savedMol1_1gyh}-8.395 5.003 -7.091 { c ile A 121 savedMol1_1gyh}-9.875 4.829 -6.857 { o ile A 121 savedMol1_1gyh}-10.635 5.806 -6.763 { c ile A 121 savedMol1_1gyh}P -9.875 4.829 -6.857 { n gly A 122 savedMol1_1gyh}-10.285 3.568 -6.815 { ca gly A 122 savedMol1_1gyh}-11.631 3.18 -6.503 { c gly A 122 savedMol1_1gyh}-11.773 2.581 -5.095 { o gly A 122 savedMol1_1gyh}-10.782 2.298 -4.437 { c gly A 122 savedMol1_1gyh}P -11.773 2.581 -5.095 { n val A 123 savedMol1_1gyh}-13.002 2.383 -4.668 { ca val A 123 savedMol1_1gyh}-13.255 1.63 -3.434 { c val A 123 savedMol1_1gyh}-14.485 0.746 -3.546 { o val A 123 savedMol1_1gyh}-15.537 1.183 -4.022 { c val A 123 savedMol1_1gyh}P -14.485 0.746 -3.546 { n thr A 124 savedMol1_1gyh}-14.323 -0.516 -3.144 { ca thr A 124 savedMol1_1gyh}-15.412 -1.462 -3.046 { c thr A 124 savedMol1_1gyh}-15.528 -2.005 -1.605 { o thr A 124 savedMol1_1gyh}-14.538 -2.187 -0.924 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 107 savedMol1_1gyh}P -12.084 -1.804 0.61 { ca leu A 107 savedMol1_1gyh}P -10.966 -2.236 -0.199 { n tyr A 108 savedMol1_1gyh}P -9.709 -0.393 -1.14 { ca tyr A 108 savedMol1_1gyh}P -9.264 0.59 -2.121 { n tyr A 109 savedMol1_1gyh}P -8.354 0.371 -4.386 { ca tyr A 109 savedMol1_1gyh}P -7.656 -0.306 -5.46 { n ser A 110 savedMol1_1gyh}P -6.397 0.453 -7.426 { ca ser A 110 savedMol1_1gyh}P -5.939 1.392 -8.465 { n val A 111 savedMol1_1gyh}P -6.742 1.655 -10.741 { ca val A 111 savedMol1_1gyh}P -6.842 1.415 -12.207 { n ala A 120 savedMol1_1gyh}P -6.851 6.102 -11.567 { ca ala A 120 savedMol1_1gyh}P -7.852 6.434 -10.564 { n ile A 121 savedMol1_1gyh}P -8.166 5.857 -8.259 { ca ile A 121 savedMol1_1gyh}P -8.395 5.003 -7.091 { n gly A 122 savedMol1_1gyh}P -10.285 3.568 -6.815 { ca gly A 122 savedMol1_1gyh}P -11.631 3.18 -6.503 {"}P -11.631 3.18 -6.503 { n val A 123 savedMol1_1gyh}P -13.002 2.383 -4.668 { ca val A 123 savedMol1_1gyh}P -13.255 1.63 -3.434 { n thr A 124 savedMol1_1gyh}P -14.323 -0.516 -3.144 { ca thr A 124 savedMol1_1gyh}P -15.412 -1.462 -3.046 @vectorlist {Calphas} off color= white { ca leu A 107 savedMol1_1gyh}P -10.966 -2.236 -0.199 {"}-10.966 -2.236 -0.199 { ca tyr A 108 savedMol1_1gyh}-9.264 0.59 -2.121 { ca tyr A 109 savedMol1_1gyh}-7.656 -0.306 -5.46 { ca ser A 110 savedMol1_1gyh}-5.939 1.392 -8.465 { ca val A 111 savedMol1_1gyh}-6.842 1.415 -12.207 { ca ala A 120 savedMol1_1gyh}P -7.852 6.434 -10.564 {"}-7.852 6.434 -10.564 { ca ile A 121 savedMol1_1gyh}-8.395 5.003 -7.091 { ca gly A 122 savedMol1_1gyh}-11.631 3.18 -6.503 { ca val A 123 savedMol1_1gyh}-13.255 1.63 -3.434 { ca thr A 124 savedMol1_1gyh}-15.412 -1.462 -3.046 @subgroup {sidechain} @vectorlist {sc} color= bluetint width= 6 master= {sidechain} { ca tyr A 108 savedMol1_1gyh}P -9.264 0.59 -2.121 { oh tyr A 108 savedMol1_1gyh}P -12.075 4.317 2.168 { ca tyr A 109 savedMol1_1gyh}P -7.656 -0.306 -5.46 { cb tyr A 109 savedMol1_1gyh}-8.444 -1.503 -5.982 { cg tyr A 109 savedMol1_1gyh}-9.758 -1.028 -6.554 { cd1 tyr A 109 savedMol1_1gyh}-9.845 -0.678 -7.908 { ce1 tyr A 109 savedMol1_1gyh}-11.062 -0.236 -8.44 { cz tyr A 109 savedMol1_1gyh}-12.192 -0.142 -7.619 { oh tyr A 109 savedMol1_1gyh}-13.375 0.286 -8.136 { cg tyr A 109 savedMol1_1gyh}P -9.758 -1.028 -6.554 { cd2 tyr A 109 savedMol1_1gyh}-10.888 -0.935 -5.734 { ce2 tyr A 109 savedMol1_1gyh}-12.106 -0.492 -6.266 { cz tyr A 109 savedMol1_1gyh}ghost -12.192 -0.142 -7.619 { cg1 val A 111 savedMol1_1gyh}P -8.316 1.817 -14.214 { ca ile A 121 savedMol1_1gyh}P -8.395 5.003 -7.091 { cg2 ile A 121 savedMol1_1gyh}P -8.077 4.821 -4.595 { ca val A 123 savedMol1_1gyh}P -13.255 1.63 -3.434 { cg2 thr A 124 savedMol1_1gyh}P -13.974 -3.399 -3.934 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { oh tyr A 108 savedMol1_1gyh}P -12.075 4.317 2.168 { cb tyr A 109 savedMol1_1gyh}P -8.444 -1.503 -5.982 {"}P -8.444 -1.503 -5.982 { cd1 tyr A 109 savedMol1_1gyh}P -9.845 -0.678 -7.908 { cd2 tyr A 109 savedMol1_1gyh}P -10.888 -0.935 -5.734 { ce1 tyr A 109 savedMol1_1gyh}P -11.062 -0.236 -8.44 { ce2 tyr A 109 savedMol1_1gyh}P -12.106 -0.492 -6.266 { oh tyr A 109 savedMol1_1gyh}P -13.375 0.286 -8.136 { cg1 val A 111 savedMol1_1gyh}P -8.316 1.817 -14.214 {"}P -8.316 1.817 -14.214 {"}P -8.316 1.817 -14.214 { cg2 ile A 121 savedMol1_1gyh}P -8.077 4.821 -4.595 {"}P -8.077 4.821 -4.595 {"}P -8.077 4.821 -4.595 { cg2 thr A 124 savedMol1_1gyh}P -13.974 -3.399 -3.934 {"}P -13.974 -3.399 -3.934 {"}P -13.974 -3.399 -3.934 @group {BRDEE 1gyh G122A} off dominant @subgroup {mainchain} @vectorlist {mc} color= greentint width= 6 master= {mainchain} { n leu A 107 savedMol1_1gyh}P -12.061 -1.837 0.602 {"}-12.061 -1.837 0.602 { ca leu A 107 savedMol1_1gyh}-10.935 -2.26 -0.2 { c leu A 107 savedMol1_1gyh}-10.734 -1.211 -1.301 { o leu A 107 savedMol1_1gyh}-11.513 -1.141 -2.246 { c leu A 107 savedMol1_1gyh}P -10.734 -1.211 -1.301 { n tyr A 108 savedMol1_1gyh}-9.696 -0.407 -1.145 { ca tyr A 108 savedMol1_1gyh}-9.259 0.576 -2.131 { c tyr A 108 savedMol1_1gyh}-8.253 -0.089 -3.069 { o tyr A 108 savedMol1_1gyh}-7.553 -0.992 -2.663 { c tyr A 108 savedMol1_1gyh}P -8.253 -0.089 -3.069 { n tyr A 109 savedMol1_1gyh}-8.215 0.349 -4.336 { ca tyr A 109 savedMol1_1gyh}-7.432 -0.319 -5.357 { c tyr A 109 savedMol1_1gyh}-7.284 0.678 -6.523 { o tyr A 109 savedMol1_1gyh}-8.077 1.626 -6.621 { c tyr A 109 savedMol1_1gyh}P -7.284 0.678 -6.523 { n ser A 110 savedMol1_1gyh}-6.27 0.459 -7.373 { ca ser A 110 savedMol1_1gyh}-5.916 1.383 -8.465 { c ser A 110 savedMol1_1gyh}-6.154 0.8 -9.874 { o ser A 110 savedMol1_1gyh}-5.871 -0.366 -10.131 { c ser A 110 savedMol1_1gyh}P -6.154 0.8 -9.874 { n val A 111 savedMol1_1gyh}-6.713 1.624 -10.746 { ca val A 111 savedMol1_1gyh}-6.804 1.374 -12.211 { c val A 111 savedMol1_1gyh}-5.795 2.314 -12.887 { o val A 111 savedMol1_1gyh}-5.801 3.522 -12.68 { n ala A 120 savedMol1_1gyh}P -6.871 6.064 -11.596 {"}-6.871 6.064 -11.596 { ca ala A 120 savedMol1_1gyh}-7.881 6.39 -10.6 { c ala A 120 savedMol1_1gyh}-7.874 5.337 -9.491 { o ala A 120 savedMol1_1gyh}-7.614 4.128 -9.74 { c ala A 120 savedMol1_1gyh}P -7.874 5.337 -9.491 { n ile A 121 savedMol1_1gyh}-8.198 5.822 -8.293 { ca ile A 121 savedMol1_1gyh}-8.422 4.971 -7.121 { c ile A 121 savedMol1_1gyh}-9.902 4.853 -6.865 { o ile A 121 savedMol1_1gyh}-10.624 5.858 -6.753 { c ile A 121 savedMol1_1gyh}P -9.902 4.853 -6.865 { n ala A 122 savedMol1_1gyh}-10.361 3.608 -6.824 { ca ala A 122 savedMol1_1gyh}-11.729 3.267 -6.489 { c ala A 122 savedMol1_1gyh}-11.818 2.587 -5.119 { o ala A 122 savedMol1_1gyh}-10.809 2.245 -4.519 { c ala A 122 savedMol1_1gyh}P -11.818 2.587 -5.119 { n val A 123 savedMol1_1gyh}-13.035 2.385 -4.66 { ca val A 123 savedMol1_1gyh}-13.256 1.56 -3.466 { c val A 123 savedMol1_1gyh}-14.475 0.661 -3.578 { o val A 123 savedMol1_1gyh}-15.53 1.082 -4.061 { c val A 123 savedMol1_1gyh}P -14.475 0.661 -3.578 { n thr A 124 savedMol1_1gyh}-14.299 -0.597 -3.168 { ca thr A 124 savedMol1_1gyh}-15.377 -1.555 -3.07 { c thr A 124 savedMol1_1gyh}-15.493 -2.091 -1.626 { o thr A 124 savedMol1_1gyh}-14.503 -2.258 -0.94 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n leu A 107 savedMol1_1gyh}P -12.061 -1.837 0.602 { ca leu A 107 savedMol1_1gyh}P -10.935 -2.26 -0.2 { n tyr A 108 savedMol1_1gyh}P -9.696 -0.407 -1.145 { ca tyr A 108 savedMol1_1gyh}P -9.259 0.576 -2.131 { n tyr A 109 savedMol1_1gyh}P -8.215 0.349 -4.336 { ca tyr A 109 savedMol1_1gyh}P -7.432 -0.319 -5.357 { n ser A 110 savedMol1_1gyh}P -6.27 0.459 -7.373 { ca ser A 110 savedMol1_1gyh}P -5.916 1.383 -8.465 { n val A 111 savedMol1_1gyh}P -6.713 1.624 -10.746 { ca val A 111 savedMol1_1gyh}P -6.804 1.374 -12.211 { n ala A 120 savedMol1_1gyh}P -6.871 6.064 -11.596 { ca ala A 120 savedMol1_1gyh}P -7.881 6.39 -10.6 { n ile A 121 savedMol1_1gyh}P -8.198 5.822 -8.293 { ca ile A 121 savedMol1_1gyh}P -8.422 4.971 -7.121 { n ala A 122 savedMol1_1gyh}P -10.361 3.608 -6.824 { ca ala A 122 savedMol1_1gyh}P -11.729 3.267 -6.489 { n val A 123 savedMol1_1gyh}P -13.035 2.385 -4.66 { ca val A 123 savedMol1_1gyh}P -13.256 1.56 -3.466 { n thr A 124 savedMol1_1gyh}P -14.299 -0.597 -3.168 { ca thr A 124 savedMol1_1gyh}P -15.377 -1.555 -3.07 @vectorlist {Calphas} off color= white { ca leu A 107 savedMol1_1gyh}P -10.935 -2.26 -0.2 {"}-10.935 -2.26 -0.2 { ca tyr A 108 savedMol1_1gyh}-9.259 0.576 -2.131 { ca tyr A 109 savedMol1_1gyh}-7.432 -0.319 -5.357 { ca ser A 110 savedMol1_1gyh}-5.916 1.383 -8.465 { ca val A 111 savedMol1_1gyh}-6.804 1.374 -12.211 { ca ala A 120 savedMol1_1gyh}P -7.881 6.39 -10.6 {"}-7.881 6.39 -10.6 { ca ile A 121 savedMol1_1gyh}-8.422 4.971 -7.121 { ca ala A 122 savedMol1_1gyh}-11.729 3.267 -6.489 { ca val A 123 savedMol1_1gyh}-13.256 1.56 -3.466 { ca thr A 124 savedMol1_1gyh}-15.377 -1.555 -3.07 @subgroup {sidechain} @vectorlist {sc} color= greentint width= 6 master= {sidechain} { ca tyr A 108 savedMol1_1gyh}P -9.259 0.576 -2.131 { oh tyr A 108 savedMol1_1gyh}P -12.132 4.293 2.126 { ca tyr A 109 savedMol1_1gyh}P -7.432 -0.319 -5.357 { cb tyr A 109 savedMol1_1gyh}-8.01 -1.663 -5.789 { cg tyr A 109 savedMol1_1gyh}-9.364 -1.449 -6.421 { cd1 tyr A 109 savedMol1_1gyh}-9.465 -1.226 -7.799 { ce1 tyr A 109 savedMol1_1gyh}-10.721 -1.026 -8.387 { cz tyr A 109 savedMol1_1gyh}-11.875 -1.047 -7.595 { oh tyr A 109 savedMol1_1gyh}-13.094 -0.854 -8.164 { cg tyr A 109 savedMol1_1gyh}P -9.364 -1.449 -6.421 { cd2 tyr A 109 savedMol1_1gyh}-10.518 -1.47 -5.628 { ce2 tyr A 109 savedMol1_1gyh}-11.775 -1.27 -6.215 { cz tyr A 109 savedMol1_1gyh}ghost -11.875 -1.047 -7.595 { cg1 val A 111 savedMol1_1gyh}P -8.274 1.747 -14.226 { ca ile A 121 savedMol1_1gyh}P -8.422 4.971 -7.121 { cg2 ile A 121 savedMol1_1gyh}P -8.112 4.807 -4.623 { ca ala A 122 savedMol1_1gyh}P -11.729 3.267 -6.489 { cb ala A 122 savedMol1_1gyh}-12.364 2.382 -7.557 { ca val A 123 savedMol1_1gyh}P -13.256 1.56 -3.466 { cg2 thr A 124 savedMol1_1gyh}P -13.912 -3.48 -3.941 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { oh tyr A 108 savedMol1_1gyh}P -12.132 4.293 2.126 { cb tyr A 109 savedMol1_1gyh}P -8.01 -1.663 -5.789 {"}P -8.01 -1.663 -5.789 { cd1 tyr A 109 savedMol1_1gyh}P -9.465 -1.226 -7.799 { cd2 tyr A 109 savedMol1_1gyh}P -10.518 -1.47 -5.628 { ce1 tyr A 109 savedMol1_1gyh}P -10.721 -1.026 -8.387 { ce2 tyr A 109 savedMol1_1gyh}P -11.775 -1.27 -6.215 { oh tyr A 109 savedMol1_1gyh}P -13.094 -0.854 -8.164 { cg1 val A 111 savedMol1_1gyh}P -8.274 1.747 -14.226 {"}P -8.274 1.747 -14.226 {"}P -8.274 1.747 -14.226 { cg2 ile A 121 savedMol1_1gyh}P -8.112 4.807 -4.623 {"}P -8.112 4.807 -4.623 {"}P -8.112 4.807 -4.623 { cb ala A 122 savedMol1_1gyh}P -12.364 2.382 -7.557 {"}P -12.364 2.382 -7.557 {"}P -12.364 2.382 -7.557 { cg2 thr A 124 savedMol1_1gyh}P -13.912 -3.48 -3.941 {"}P -13.912 -3.48 -3.941 {"}P -13.912 -3.48 -3.941 @group {BRDEE 1khb G157} off dominant @subgroup {mainchain} @vectorlist {mc} color= bluetint width= 6 master= {mainchain} { n ile A 142 savedMol1_1khb}P -12.053 -2.072 0.168 {"}-12.053 -2.072 0.168 { ca ile A 142 savedMol1_1khb}-10.954 -2.354 -0.752 { c ile A 142 savedMol1_1khb}-10.545 -1.07 -1.497 { o ile A 142 savedMol1_1khb}-11.277 -0.621 -2.388 { c ile A 142 savedMol1_1khb}P -10.545 -1.07 -1.497 { n pro A 143 savedMol1_1khb}-9.411 -0.447 -1.145 { ca pro A 143 savedMol1_1khb}-8.936 0.706 -1.907 { c pro A 143 savedMol1_1khb}-8.19 0.133 -3.122 { o pro A 143 savedMol1_1khb}-7.266 -0.677 -2.966 { c pro A 143 savedMol1_1khb}P -8.19 0.133 -3.122 { n phe A 144 savedMol1_1khb}-8.557 0.561 -4.32 { ca phe A 144 savedMol1_1khb}-7.868 -0.001 -5.464 { c phe A 144 savedMol1_1khb}-7.49 1.038 -6.525 { o phe A 144 savedMol1_1khb}-8.221 1.999 -6.779 { c phe A 144 savedMol1_1khb}P -7.49 1.038 -6.525 { n ser A 145 savedMol1_1khb}-6.43 0.728 -7.244 { ca ser A 145 savedMol1_1khb}-5.973 1.584 -8.342 { c ser A 145 savedMol1_1khb}-6.109 0.835 -9.671 { o ser A 145 savedMol1_1khb}-5.59 -0.317 -9.791 { c ser A 145 savedMol1_1khb}P -6.109 0.835 -9.671 { n met A 146 savedMol1_1khb}-6.767 1.473 -10.647 { ca met A 146 savedMol1_1khb}-6.859 0.974 -12.031 { c met A 146 savedMol1_1khb}-5.757 1.712 -12.795 { o met A 146 savedMol1_1khb}-5.819 2.935 -12.937 { n lys A 155 savedMol1_1khb}P -6.892 5.671 -12.22 {"}-6.892 5.671 -12.22 { ca lys A 155 savedMol1_1khb}-8.065 6.135 -11.518 { c lys A 155 savedMol1_1khb}-8.204 5.221 -10.308 { o lys A 155 savedMol1_1khb}-7.858 4.032 -10.416 { c lys A 155 savedMol1_1khb}P -8.204 5.221 -10.308 { n ile A 156 savedMol1_1khb}-8.661 5.782 -9.205 { ca ile A 156 savedMol1_1khb}-8.832 5.007 -7.972 { c ile A 156 savedMol1_1khb}-10.301 4.787 -7.601 { o ile A 156 savedMol1_1khb}-11.18 5.635 -7.863 { c ile A 156 savedMol1_1khb}P -10.301 4.787 -7.601 { n gly A 157 savedMol1_1khb}-10.581 3.683 -6.925 { ca gly A 157 savedMol1_1khb}-11.921 3.43 -6.463 { c gly A 157 savedMol1_1khb}-11.825 2.852 -5.075 { o gly A 157 savedMol1_1khb}-10.745 2.474 -4.584 { c gly A 157 savedMol1_1khb}P -11.825 2.852 -5.075 { n ile A 158 savedMol1_1khb}-12.959 2.825 -4.405 { ca ile A 158 savedMol1_1khb}-13.044 2.167 -3.111 { c ile A 158 savedMol1_1khb}-14.165 1.18 -3.273 { o ile A 158 savedMol1_1khb}-15.249 1.613 -3.633 { c ile A 158 savedMol1_1khb}P -14.165 1.18 -3.273 { n glu A 159 savedMol1_1khb}-13.951 -0.135 -3.068 { ca glu A 159 savedMol1_1khb}-15.107 -1.029 -3.236 { c glu A 159 savedMol1_1khb}-15.482 -1.545 -1.871 { o glu A 159 savedMol1_1khb}-14.636 -2.103 -1.21 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 142 savedMol1_1khb}P -12.053 -2.072 0.168 { ca ile A 142 savedMol1_1khb}P -10.954 -2.354 -0.752 { ca pro A 143 savedMol1_1khb}P -8.936 0.706 -1.907 { n phe A 144 savedMol1_1khb}P -8.557 0.561 -4.32 { ca phe A 144 savedMol1_1khb}P -7.868 -0.001 -5.464 { n ser A 145 savedMol1_1khb}P -6.43 0.728 -7.244 { ca ser A 145 savedMol1_1khb}P -5.973 1.584 -8.342 { n met A 146 savedMol1_1khb}P -6.767 1.473 -10.647 { ca met A 146 savedMol1_1khb}P -6.859 0.974 -12.031 { n lys A 155 savedMol1_1khb}P -6.892 5.671 -12.22 { ca lys A 155 savedMol1_1khb}P -8.065 6.135 -11.518 { n ile A 156 savedMol1_1khb}P -8.661 5.782 -9.205 { ca ile A 156 savedMol1_1khb}P -8.832 5.007 -7.972 { n gly A 157 savedMol1_1khb}P -10.581 3.683 -6.925 { ca gly A 157 savedMol1_1khb}P -11.921 3.43 -6.463 {"}P -11.921 3.43 -6.463 { n ile A 158 savedMol1_1khb}P -12.959 2.825 -4.405 { ca ile A 158 savedMol1_1khb}P -13.044 2.167 -3.111 { n glu A 159 savedMol1_1khb}P -13.951 -0.135 -3.068 { ca glu A 159 savedMol1_1khb}P -15.107 -1.029 -3.236 @vectorlist {Calphas} off color= white { ca ile A 142 savedMol1_1khb}P -10.954 -2.354 -0.752 {"}-10.954 -2.354 -0.752 { ca pro A 143 savedMol1_1khb}-8.936 0.706 -1.907 { ca phe A 144 savedMol1_1khb}-7.868 -0.001 -5.464 { ca ser A 145 savedMol1_1khb}-5.973 1.584 -8.342 { ca met A 146 savedMol1_1khb}-6.859 0.974 -12.031 { ca lys A 155 savedMol1_1khb}P -8.065 6.135 -11.518 {"}-8.065 6.135 -11.518 { ca ile A 156 savedMol1_1khb}-8.832 5.007 -7.972 { ca gly A 157 savedMol1_1khb}-11.921 3.43 -6.463 { ca ile A 158 savedMol1_1khb}-13.044 2.167 -3.111 { ca glu A 159 savedMol1_1khb}-15.107 -1.029 -3.236 @subgroup {sidechain} @vectorlist {sc} color= bluetint width= 6 master= {sidechain} { ca phe A 144 savedMol1_1khb}P -7.868 -0.001 -5.464 { cb phe A 144 savedMol1_1khb}-8.716 -1.093 -6.109 { cg phe A 144 savedMol1_1khb}-10.043 -0.629 -6.658 { cd1 phe A 144 savedMol1_1khb}-10.136 -0.185 -7.983 { ce1 phe A 144 savedMol1_1khb}-11.365 0.248 -8.492 { cz phe A 144 savedMol1_1khb}-12.503 0.237 -7.678 { cg phe A 144 savedMol1_1khb}P -10.043 -0.629 -6.658 { cd2 phe A 144 savedMol1_1khb}-11.182 -0.639 -5.844 { ce2 phe A 144 savedMol1_1khb}-12.411 -0.207 -6.352 { cz phe A 144 savedMol1_1khb}ghost -12.503 0.237 -7.678 { ca ile A 156 savedMol1_1khb}P -8.832 5.007 -7.972 { ca ile A 158 savedMol1_1khb}P -13.044 2.167 -3.111 { oe1 glu A 159 savedMol1_1khb}P -15.172 -4.114 -6.21 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 144 savedMol1_1khb}P -8.716 -1.093 -6.109 {"}P -8.716 -1.093 -6.109 { cd1 phe A 144 savedMol1_1khb}P -10.136 -0.185 -7.983 { cd2 phe A 144 savedMol1_1khb}P -11.182 -0.639 -5.844 { ce1 phe A 144 savedMol1_1khb}P -11.365 0.248 -8.492 { ce2 phe A 144 savedMol1_1khb}P -12.411 -0.207 -6.352 { cz phe A 144 savedMol1_1khb}P -12.503 0.237 -7.678 @group {BRDEE 1khb G157A} off dominant @subgroup {mainchain} @vectorlist {mc} color= greentint width= 6 master= {mainchain} { n ile A 142 savedMol1_1khb}P -12.037 -2.094 0.164 {"}-12.037 -2.094 0.164 { ca ile A 142 savedMol1_1khb}-10.933 -2.371 -0.752 { c ile A 142 savedMol1_1khb}-10.532 -1.086 -1.501 { o ile A 142 savedMol1_1khb}-11.265 -0.646 -2.394 { c ile A 142 savedMol1_1khb}P -10.532 -1.086 -1.501 { n pro A 143 savedMol1_1khb}-9.405 -0.454 -1.148 { ca pro A 143 savedMol1_1khb}-8.936 0.701 -1.912 { c pro A 143 savedMol1_1khb}-8.106 0.12 -3.067 { o pro A 143 savedMol1_1khb}-7.156 -0.642 -2.837 { c pro A 143 savedMol1_1khb}P -8.106 0.12 -3.067 { n phe A 144 savedMol1_1khb}-8.43 0.489 -4.297 { ca phe A 144 savedMol1_1khb}-7.661 -0.08 -5.384 { c phe A 144 savedMol1_1khb}-7.398 0.953 -6.485 { o phe A 144 savedMol1_1khb}-8.22 1.831 -6.757 { c phe A 144 savedMol1_1khb}P -7.398 0.953 -6.485 { n ser A 145 savedMol1_1khb}-6.321 0.722 -7.21 { ca ser A 145 savedMol1_1khb}-5.964 1.579 -8.343 { c ser A 145 savedMol1_1khb}-6.091 0.825 -9.67 { o ser A 145 savedMol1_1khb}-5.563 -0.324 -9.784 { c ser A 145 savedMol1_1khb}P -6.091 0.825 -9.67 { n met A 146 savedMol1_1khb}-6.751 1.454 -10.649 { ca met A 146 savedMol1_1khb}-6.836 0.949 -12.032 { c met A 146 savedMol1_1khb}-5.738 1.694 -12.796 { o met A 146 savedMol1_1khb}-5.809 2.915 -12.943 { n lys A 155 savedMol1_1khb}P -6.904 5.646 -12.237 {"}-6.904 5.646 -12.237 { ca lys A 155 savedMol1_1khb}-8.083 6.103 -11.54 { c lys A 155 savedMol1_1khb}-8.218 5.192 -10.327 { o lys A 155 savedMol1_1khb}-7.863 4.005 -10.43 { c lys A 155 savedMol1_1khb}P -8.218 5.192 -10.327 { n ile A 156 savedMol1_1khb}-8.681 5.754 -9.228 { ca ile A 156 savedMol1_1khb}-8.85 4.982 -7.992 { c ile A 156 savedMol1_1khb}-10.321 4.796 -7.614 { o ile A 156 savedMol1_1khb}-11.183 5.661 -7.88 { c ile A 156 savedMol1_1khb}P -10.321 4.796 -7.614 { n ala A 157 savedMol1_1khb}-10.622 3.704 -6.928 { ca ala A 157 savedMol1_1khb}-11.974 3.482 -6.456 { c ala A 157 savedMol1_1khb}-11.856 2.856 -5.094 { o ala A 157 savedMol1_1khb}-10.774 2.441 -4.636 { c ala A 157 savedMol1_1khb}P -11.856 2.856 -5.094 { n ile A 158 savedMol1_1khb}-12.977 2.828 -4.404 { ca ile A 158 savedMol1_1khb}-13.052 2.126 -3.131 { c ile A 158 savedMol1_1khb}-14.165 1.13 -3.293 { o ile A 158 savedMol1_1khb}-15.251 1.553 -3.657 { c ile A 158 savedMol1_1khb}P -14.165 1.13 -3.293 { n glu A 159 savedMol1_1khb}-13.942 -0.183 -3.083 { ca glu A 159 savedMol1_1khb}-15.09 -1.086 -3.25 { c glu A 159 savedMol1_1khb}-15.465 -1.6 -1.885 { o glu A 159 savedMol1_1khb}-14.617 -2.15 -1.22 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n ile A 142 savedMol1_1khb}P -12.037 -2.094 0.164 { ca ile A 142 savedMol1_1khb}P -10.933 -2.371 -0.752 { ca pro A 143 savedMol1_1khb}P -8.936 0.701 -1.912 { n phe A 144 savedMol1_1khb}P -8.43 0.489 -4.297 { ca phe A 144 savedMol1_1khb}P -7.661 -0.08 -5.384 { n ser A 145 savedMol1_1khb}P -6.321 0.722 -7.21 { ca ser A 145 savedMol1_1khb}P -5.964 1.579 -8.343 { n met A 146 savedMol1_1khb}P -6.751 1.454 -10.649 { ca met A 146 savedMol1_1khb}P -6.836 0.949 -12.032 { n lys A 155 savedMol1_1khb}P -6.904 5.646 -12.237 { ca lys A 155 savedMol1_1khb}P -8.083 6.103 -11.54 { n ile A 156 savedMol1_1khb}P -8.681 5.754 -9.228 { ca ile A 156 savedMol1_1khb}P -8.85 4.982 -7.992 { n ala A 157 savedMol1_1khb}P -10.622 3.704 -6.928 { ca ala A 157 savedMol1_1khb}P -11.974 3.482 -6.456 { n ile A 158 savedMol1_1khb}P -12.977 2.828 -4.404 { ca ile A 158 savedMol1_1khb}P -13.052 2.126 -3.131 { n glu A 159 savedMol1_1khb}P -13.942 -0.183 -3.083 { ca glu A 159 savedMol1_1khb}P -15.09 -1.086 -3.25 @vectorlist {Calphas} off color= white { ca ile A 142 savedMol1_1khb}P -10.933 -2.371 -0.752 {"}-10.933 -2.371 -0.752 { ca pro A 143 savedMol1_1khb}-8.936 0.701 -1.912 { ca phe A 144 savedMol1_1khb}-7.661 -0.08 -5.384 { ca ser A 145 savedMol1_1khb}-5.964 1.579 -8.343 { ca met A 146 savedMol1_1khb}-6.836 0.949 -12.032 { ca lys A 155 savedMol1_1khb}P -8.083 6.103 -11.54 {"}-8.083 6.103 -11.54 { ca ile A 156 savedMol1_1khb}-8.85 4.982 -7.992 { ca ala A 157 savedMol1_1khb}-11.974 3.482 -6.456 { ca ile A 158 savedMol1_1khb}-13.052 2.126 -3.131 { ca glu A 159 savedMol1_1khb}-15.09 -1.086 -3.25 @subgroup {sidechain} @vectorlist {sc} color= greentint width= 6 master= {sidechain} { ca phe A 144 savedMol1_1khb}P -7.661 -0.08 -5.384 { cb phe A 144 savedMol1_1khb}-8.299 -1.342 -5.958 { cg phe A 144 savedMol1_1khb}-9.668 -1.144 -6.564 { cd1 phe A 144 savedMol1_1khb}-9.79 -0.821 -7.921 { ce1 phe A 144 savedMol1_1khb}-11.059 -0.636 -8.484 { cz phe A 144 savedMol1_1khb}-12.205 -0.774 -7.691 { cg phe A 144 savedMol1_1khb}P -9.668 -1.144 -6.564 { cd2 phe A 144 savedMol1_1khb}-10.813 -1.282 -5.772 { ce2 phe A 144 savedMol1_1khb}-12.081 -1.097 -6.334 { cz phe A 144 savedMol1_1khb}ghost -12.205 -0.774 -7.691 { ca ile A 156 savedMol1_1khb}P -8.85 4.982 -7.992 { ca ala A 157 savedMol1_1khb}P -11.974 3.482 -6.456 { cb ala A 157 savedMol1_1khb}-12.785 2.623 -7.421 { ca ile A 158 savedMol1_1khb}P -13.052 2.126 -3.131 { oe1 glu A 159 savedMol1_1khb}P -15.125 -4.182 -6.214 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cb phe A 144 savedMol1_1khb}P -8.299 -1.342 -5.958 {"}P -8.299 -1.342 -5.958 { cd1 phe A 144 savedMol1_1khb}P -9.79 -0.821 -7.921 { cd2 phe A 144 savedMol1_1khb}P -10.813 -1.282 -5.772 { ce1 phe A 144 savedMol1_1khb}P -11.059 -0.636 -8.484 { ce2 phe A 144 savedMol1_1khb}P -12.081 -1.097 -6.334 { cz phe A 144 savedMol1_1khb}P -12.205 -0.774 -7.691 { cb ala A 157 savedMol1_1khb}P -12.785 2.623 -7.421 {"}P -12.785 2.623 -7.421 {"}P -12.785 2.623 -7.421 @group {BRDEE 1z84 Q188G} off dominant @subgroup {mainchain} @vectorlist {mc} color= bluetint width= 6 master= {mainchain} { n gln A 169 savedMol1_1z84}P -12.043 -2.248 0.337 {"}-12.043 -2.248 0.337 { ca gln A 169 savedMol1_1z84}-10.969 -2.398 -0.646 { c gln A 169 savedMol1_1z84}-10.669 -1.076 -1.4 { o gln A 169 savedMol1_1z84}-11.478 -0.573 -2.226 { c gln A 169 savedMol1_1z84}P -10.669 -1.076 -1.4 { n val A 170 savedMol1_1z84}-9.501 -0.529 -1.138 { ca val A 170 savedMol1_1z84}-9.016 0.647 -1.861 { c val A 170 savedMol1_1z84}-8.225 0.124 -3.057 { o val A 170 savedMol1_1z84}-7.349 -0.742 -2.919 { c val A 170 savedMol1_1z84}P -8.225 0.124 -3.057 { n phe A 171 savedMol1_1z84}-8.55 0.601 -4.25 { ca phe A 171 savedMol1_1z84}-7.804 0.13 -5.399 { c phe A 171 savedMol1_1z84}-7.561 1.163 -6.505 { o phe A 171 savedMol1_1z84}-8.268 2.167 -6.573 { c phe A 171 savedMol1_1z84}P -7.561 1.163 -6.505 { n lys A 172 savedMol1_1z84}-6.589 0.904 -7.386 { ca lys A 172 savedMol1_1z84}-6.346 1.814 -8.495 { c lys A 172 savedMol1_1z84}-6.131 0.993 -9.756 { o lys A 172 savedMol1_1z84}-5.436 -0.029 -9.725 { c lys A 172 savedMol1_1z84}P -6.131 0.993 -9.756 { n asn A 173 savedMol1_1z84}-6.769 1.411 -10.838 { ca asn A 173 savedMol1_1z84}-6.556 0.825 -12.186 { c asn A 173 savedMol1_1z84}-5.957 1.901 -13.114 { o asn A 173 savedMol1_1z84}-6.496 3.027 -13.192 { n hid A 186 savedMol1_1z84}P -7.696 8.352 -11.486 {"}-7.696 8.352 -11.486 { ca hid A 186 savedMol1_1z84}-8.6 8.136 -10.353 { c hid A 186 savedMol1_1z84}-8.358 6.77 -9.775 { o hid A 186 savedMol1_1z84}-7.712 5.915 -10.419 { c hid A 186 savedMol1_1z84}P -8.358 6.77 -9.775 { n ser A 187 savedMol1_1z84}-8.881 6.576 -8.567 { ca ser A 187 savedMol1_1z84}-8.825 5.299 -7.898 { c ser A 187 savedMol1_1z84}-10.203 5.045 -7.302 { o ser A 187 savedMol1_1z84}-11.107 5.896 -7.454 { c ser A 187 savedMol1_1z84}P -10.203 5.045 -7.302 { n gly A 188 savedMol1_1z84}-10.414 3.867 -6.716 { ca gly A 188 savedMol1_1z84}-11.757 3.454 -6.308 { c gly A 188 savedMol1_1z84}-11.727 2.894 -4.897 { o gly A 188 savedMol1_1z84}-10.659 2.471 -4.398 { c gly A 188 savedMol1_1z84}P -11.727 2.894 -4.897 { n met A 189 savedMol1_1z84}-12.9 2.894 -4.257 { ca met A 189 savedMol1_1z84}-13.067 2.318 -2.929 { c met A 189 savedMol1_1z84}-14.345 1.496 -2.948 { o met A 189 savedMol1_1z84}-15.373 1.989 -3.33 { c met A 189 savedMol1_1z84}P -14.345 1.496 -2.948 { n met A 190 savedMol1_1z84}-14.252 0.232 -2.572 { ca met A 190 savedMol1_1z84}-15.411 -0.642 -2.487 { c met A 190 savedMol1_1z84}-15.529 -1.136 -1.06 { o met A 190 savedMol1_1z84}-14.647 -1.867 -0.581 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gln A 169 savedMol1_1z84}P -12.043 -2.248 0.337 { ca gln A 169 savedMol1_1z84}P -10.969 -2.398 -0.646 { n val A 170 savedMol1_1z84}P -9.501 -0.529 -1.138 { ca val A 170 savedMol1_1z84}P -9.016 0.647 -1.861 { n phe A 171 savedMol1_1z84}P -8.55 0.601 -4.25 { ca phe A 171 savedMol1_1z84}P -7.804 0.13 -5.399 { n lys A 172 savedMol1_1z84}P -6.589 0.904 -7.386 { ca lys A 172 savedMol1_1z84}P -6.346 1.814 -8.495 { n asn A 173 savedMol1_1z84}P -6.769 1.411 -10.838 { ca asn A 173 savedMol1_1z84}P -6.556 0.825 -12.186 { n hid A 186 savedMol1_1z84}P -7.696 8.352 -11.486 { ca hid A 186 savedMol1_1z84}P -8.6 8.136 -10.353 { n ser A 187 savedMol1_1z84}P -8.881 6.576 -8.567 { ca ser A 187 savedMol1_1z84}P -8.825 5.299 -7.898 { n gly A 188 savedMol1_1z84}P -10.414 3.867 -6.716 { ca gly A 188 savedMol1_1z84}P -11.757 3.454 -6.308 {"}P -11.757 3.454 -6.308 { n met A 189 savedMol1_1z84}P -12.9 2.894 -4.257 { ca met A 189 savedMol1_1z84}P -13.067 2.318 -2.929 { n met A 190 savedMol1_1z84}P -14.252 0.232 -2.572 { ca met A 190 savedMol1_1z84}P -15.411 -0.642 -2.487 @vectorlist {Calphas} off color= white { ca gln A 169 savedMol1_1z84}P -10.969 -2.398 -0.646 {"}-10.969 -2.398 -0.646 { ca val A 170 savedMol1_1z84}-9.016 0.647 -1.861 { ca phe A 171 savedMol1_1z84}-7.804 0.13 -5.399 { ca lys A 172 savedMol1_1z84}-6.346 1.814 -8.495 { ca asn A 173 savedMol1_1z84}-6.556 0.825 -12.186 { ca hid A 186 savedMol1_1z84}P -8.6 8.136 -10.353 {"}-8.6 8.136 -10.353 { ca ser A 187 savedMol1_1z84}-8.825 5.299 -7.898 { ca gly A 188 savedMol1_1z84}-11.757 3.454 -6.308 { ca met A 189 savedMol1_1z84}-13.067 2.318 -2.929 { ca met A 190 savedMol1_1z84}-15.411 -0.642 -2.487 @subgroup {sidechain} @vectorlist {sc} color= bluetint width= 6 master= {sidechain} { cg1 val A 170 savedMol1_1z84}P -7.697 2.853 -1.749 { ca phe A 171 savedMol1_1z84}P -7.804 0.13 -5.399 { cb phe A 171 savedMol1_1z84}-8.561 -1.04 -6.022 { cg phe A 171 savedMol1_1z84}-9.938 -0.704 -6.54 { cd1 phe A 171 savedMol1_1z84}-10.102 -0.278 -7.865 { ce1 phe A 171 savedMol1_1z84}-11.378 0.035 -8.346 { cz phe A 171 savedMol1_1z84}-12.491 -0.078 -7.506 { cg phe A 171 savedMol1_1z84}P -9.938 -0.704 -6.54 { cd2 phe A 171 savedMol1_1z84}-11.051 -0.816 -5.701 { ce2 phe A 171 savedMol1_1z84}-12.328 -0.504 -6.182 { cz phe A 171 savedMol1_1z84}ghost -12.491 -0.078 -7.506 { nz lys A 172 savedMol1_1z84}P -4.742 6.483 -10.995 { cd2 hid A 186 savedMol1_1z84}P -10.954 5.891 -11.637 { ca ser A 187 savedMol1_1z84}P -8.825 5.299 -7.898 { ca met A 189 savedMol1_1z84}P -13.067 2.318 -2.929 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cg1 val A 170 savedMol1_1z84}P -7.697 2.853 -1.749 {"}P -7.697 2.853 -1.749 {"}P -7.697 2.853 -1.749 { cb phe A 171 savedMol1_1z84}P -8.561 -1.04 -6.022 {"}P -8.561 -1.04 -6.022 { cd1 phe A 171 savedMol1_1z84}P -10.102 -0.278 -7.865 { cd2 phe A 171 savedMol1_1z84}P -11.051 -0.816 -5.701 { ce1 phe A 171 savedMol1_1z84}P -11.378 0.035 -8.346 { ce2 phe A 171 savedMol1_1z84}P -12.328 -0.504 -6.182 { cz phe A 171 savedMol1_1z84}P -12.491 -0.078 -7.506 { nz lys A 172 savedMol1_1z84}P -4.742 6.483 -10.995 {"}P -4.742 6.483 -10.995 {"}P -4.742 6.483 -10.995 { cd2 hid A 186 savedMol1_1z84}P -10.954 5.891 -11.637 @group {BRDEE 1z84 Q188} off dominant @subgroup {mainchain} @vectorlist {mc} color= greentint width= 6 master= {mainchain} { n gln A 169 savedMol1_1z84}P -12.062 -2.228 0.337 {"}-12.062 -2.228 0.337 { ca gln A 169 savedMol1_1z84}-10.991 -2.38 -0.648 { c gln A 169 savedMol1_1z84}-10.686 -1.058 -1.399 { o gln A 169 savedMol1_1z84}-11.494 -0.549 -2.223 { c gln A 169 savedMol1_1z84}P -10.686 -1.058 -1.399 { n val A 170 savedMol1_1z84}-9.515 -0.517 -1.138 { ca val A 170 savedMol1_1z84}-9.025 0.658 -1.859 { c val A 170 savedMol1_1z84}-8.16 0.141 -3.005 { o val A 170 savedMol1_1z84}-7.266 -0.695 -2.808 { c val A 170 savedMol1_1z84}P -8.16 0.141 -3.005 { n phe A 171 savedMol1_1z84}-8.438 0.589 -4.22 { ca phe A 171 savedMol1_1z84}-7.62 0.125 -5.323 { c phe A 171 savedMol1_1z84}-7.49 1.135 -6.468 { o phe A 171 savedMol1_1z84}-8.291 2.062 -6.562 { c phe A 171 savedMol1_1z84}P -7.49 1.135 -6.468 { n lys A 172 savedMol1_1z84}-6.505 0.938 -7.351 { ca lys A 172 savedMol1_1z84}-6.361 1.826 -8.495 { c lys A 172 savedMol1_1z84}-6.152 1.008 -9.758 { o lys A 172 savedMol1_1z84}-5.462 -0.018 -9.731 { c lys A 172 savedMol1_1z84}P -6.152 1.008 -9.758 { n asn A 173 savedMol1_1z84}-6.789 1.431 -10.838 { ca asn A 173 savedMol1_1z84}-6.581 0.847 -12.188 { c asn A 173 savedMol1_1z84}-5.979 1.922 -13.114 { o asn A 173 savedMol1_1z84}-6.512 3.051 -13.189 { n hid A 186 savedMol1_1z84}P -7.684 8.378 -11.469 {"}-7.684 8.378 -11.469 { ca hid A 186 savedMol1_1z84}-8.587 8.164 -10.334 { c hid A 186 savedMol1_1z84}-8.351 6.795 -9.76 { o hid A 186 savedMol1_1z84}-7.71 5.938 -10.407 { c hid A 186 savedMol1_1z84}P -8.351 6.795 -9.76 { n ser A 187 savedMol1_1z84}-8.872 6.601 -8.552 { ca ser A 187 savedMol1_1z84}-8.821 5.323 -7.886 { c ser A 187 savedMol1_1z84}-10.193 5.024 -7.295 { o ser A 187 savedMol1_1z84}-11.125 5.844 -7.454 { c ser A 187 savedMol1_1z84}P -10.193 5.024 -7.295 { n gln A 188 savedMol1_1z84}-10.368 3.842 -6.707 { ca gln A 188 savedMol1_1z84}-11.685 3.39 -6.306 { c gln A 188 savedMol1_1z84}-11.692 2.882 -4.872 { o gln A 188 savedMol1_1z84}-10.628 2.505 -4.329 { c gln A 188 savedMol1_1z84}P -11.692 2.882 -4.872 { n met A 189 savedMol1_1z84}-12.882 2.878 -4.262 { ca met A 189 savedMol1_1z84}-13.07 2.352 -2.916 { c met A 189 savedMol1_1z84}-14.352 1.536 -2.936 { o met A 189 savedMol1_1z84}-15.378 2.035 -3.315 { c met A 189 savedMol1_1z84}P -14.352 1.536 -2.936 { n met A 190 savedMol1_1z84}-14.264 0.271 -2.562 { ca met A 190 savedMol1_1z84}-15.428 -0.598 -2.477 { c met A 190 savedMol1_1z84}-15.545 -1.094 -1.051 { o met A 190 savedMol1_1z84}-14.666 -1.831 -0.575 @vectorlist {mc H} off nobutton color= gray master= {mainchain} { n gln A 169 savedMol1_1z84}P -12.062 -2.228 0.337 { ca gln A 169 savedMol1_1z84}P -10.991 -2.38 -0.648 { n val A 170 savedMol1_1z84}P -9.515 -0.517 -1.138 { ca val A 170 savedMol1_1z84}P -9.025 0.658 -1.859 { n phe A 171 savedMol1_1z84}P -8.438 0.589 -4.22 { ca phe A 171 savedMol1_1z84}P -7.62 0.125 -5.323 { n lys A 172 savedMol1_1z84}P -6.505 0.938 -7.351 { ca lys A 172 savedMol1_1z84}P -6.361 1.826 -8.495 { n asn A 173 savedMol1_1z84}P -6.789 1.431 -10.838 { ca asn A 173 savedMol1_1z84}P -6.581 0.847 -12.188 { n hid A 186 savedMol1_1z84}P -7.684 8.378 -11.469 { ca hid A 186 savedMol1_1z84}P -8.587 8.164 -10.334 { n ser A 187 savedMol1_1z84}P -8.872 6.601 -8.552 { ca ser A 187 savedMol1_1z84}P -8.821 5.323 -7.886 { n gln A 188 savedMol1_1z84}P -10.368 3.842 -6.707 { ca gln A 188 savedMol1_1z84}P -11.685 3.39 -6.306 { n met A 189 savedMol1_1z84}P -12.882 2.878 -4.262 { ca met A 189 savedMol1_1z84}P -13.07 2.352 -2.916 { n met A 190 savedMol1_1z84}P -14.264 0.271 -2.562 { ca met A 190 savedMol1_1z84}P -15.428 -0.598 -2.477 @vectorlist {Calphas} off color= white { ca gln A 169 savedMol1_1z84}P -10.991 -2.38 -0.648 {"}-10.991 -2.38 -0.648 { ca val A 170 savedMol1_1z84}-9.025 0.658 -1.859 { ca phe A 171 savedMol1_1z84}-7.62 0.125 -5.323 { ca lys A 172 savedMol1_1z84}-6.361 1.826 -8.495 { ca asn A 173 savedMol1_1z84}-6.581 0.847 -12.188 { ca hid A 186 savedMol1_1z84}P -8.587 8.164 -10.334 {"}-8.587 8.164 -10.334 { ca ser A 187 savedMol1_1z84}-8.821 5.323 -7.886 { ca gln A 188 savedMol1_1z84}-11.685 3.39 -6.306 { ca met A 189 savedMol1_1z84}-13.07 2.352 -2.916 { ca met A 190 savedMol1_1z84}-15.428 -0.598 -2.477 @subgroup {sidechain} @vectorlist {sc} color= greentint width= 6 master= {sidechain} { cg1 val A 170 savedMol1_1z84}P -7.695 2.857 -1.744 { ca phe A 171 savedMol1_1z84}P -7.62 0.125 -5.323 { cb phe A 171 savedMol1_1z84}-8.146 -1.196 -5.879 { cg phe A 171 savedMol1_1z84}-9.541 -1.134 -6.452 { cd1 phe A 171 savedMol1_1z84}-9.728 -0.831 -7.806 { ce1 phe A 171 savedMol1_1z84}-11.021 -0.772 -8.339 { cz phe A 171 savedMol1_1z84}-12.129 -1.018 -7.518 { cg phe A 171 savedMol1_1z84}P -9.541 -1.134 -6.452 { cd2 phe A 171 savedMol1_1z84}-10.649 -1.38 -5.632 { ce2 phe A 171 savedMol1_1z84}-11.942 -1.323 -6.164 { cz phe A 171 savedMol1_1z84}ghost -12.129 -1.018 -7.518 { nz lys A 172 savedMol1_1z84}P -4.738 6.493 -10.987 { cd2 hid A 186 savedMol1_1z84}P -10.954 5.934 -11.62 { ca ser A 187 savedMol1_1z84}P -8.821 5.323 -7.886 { ca gln A 188 savedMol1_1z84}P -11.685 3.39 -6.306 { cb gln A 188 savedMol1_1z84}-12.098 2.211 -7.183 { cg gln A 188 savedMol1_1z84}-12.244 2.68 -8.626 { cd gln A 188 savedMol1_1z84}-10.903 2.661 -9.346 { oe1 gln A 188 savedMol1_1z84}-9.885 2.299 -8.761 { cd gln A 188 savedMol1_1z84}P -10.903 2.661 -9.346 { ne2 gln A 188 savedMol1_1z84}-10.904 3.052 -10.623 { ca met A 189 savedMol1_1z84}P -13.07 2.352 -2.916 @vectorlist {sc H} off nobutton color= gray master= {sidechain} { cg1 val A 170 savedMol1_1z84}P -7.695 2.857 -1.744 {"}P -7.695 2.857 -1.744 {"}P -7.695 2.857 -1.744 { cb phe A 171 savedMol1_1z84}P -8.146 -1.196 -5.879 {"}P -8.146 -1.196 -5.879 { cd1 phe A 171 savedMol1_1z84}P -9.728 -0.831 -7.806 { cd2 phe A 171 savedMol1_1z84}P -10.649 -1.38 -5.632 { ce1 phe A 171 savedMol1_1z84}P -11.021 -0.772 -8.339 { ce2 phe A 171 savedMol1_1z84}P -11.942 -1.323 -6.164 { cz phe A 171 savedMol1_1z84}P -12.129 -1.018 -7.518 { nz lys A 172 savedMol1_1z84}P -4.738 6.493 -10.987 {"}P -4.738 6.493 -10.987 {"}P -4.738 6.493 -10.987 { cd2 hid A 186 savedMol1_1z84}P -10.954 5.934 -11.62 { cb gln A 188 savedMol1_1z84}P -12.098 2.211 -7.183 {"}P -12.098 2.211 -7.183 { cg gln A 188 savedMol1_1z84}P -12.244 2.68 -8.626 {"}P -12.244 2.68 -8.626 { ne2 gln A 188 savedMol1_1z84}P -10.904 3.052 -10.623 {"}P -10.904 3.052 -10.623