REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.3 REMARK 3 AUTHORS : BRUNGER, ADAMS, CLORE, DELANO, REMARK 3 GROS, GROSSE-KUNSTLEVE, JIANG, REMARK 3 KUSZEWSKI, NILGES, PANNU, READ, REMARK 3 RICE, SIMONSON, WARREN REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.78 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 26.88 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.0 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 177648.74 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.000000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 93.2 REMARK 3 NUMBER OF REFLECTIONS : 86861 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.234 REMARK 3 FREE R VALUE : 0.261 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.6 REMARK 3 FREE R VALUE TEST SET COUNT : 8312 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.003 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.78 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.89 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 79.7 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 11405 REMARK 3 BIN R VALUE (WORKING SET) : 0.291 REMARK 3 BIN FREE R VALUE : 0.319 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 8.4 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 1042 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.010 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 0 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 0 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 16.2 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 19.1 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -3.00 REMARK 3 B22 (A**2) : -3.20 REMARK 3 B33 (A**2) : 6.20 REMARK 3 B12 (A**2) : 0.00 REMARK 3 B13 (A**2) : 0.00 REMARK 3 B23 (A**2) : 0.00 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.42 REMARK 3 BSOL : 15.6893 (A**2) REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.24 REMARK 3 ESD FROM SIGMAA (A) : 0.17 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.28 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.17 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.311 REMARK 3 BOND ANGLES (DEGREES) : 1.5 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 25.5 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.41 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 NCS MODEL : NONE REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : protein.param REMARK 3 PARAMETER FILE 2 : CNS_TOPPAR/dna-rna_rep.param REMARK 3 PARAMETER FILE 3 : CNS_TOPPAR/water_rep.param REMARK 3 PARAMETER FILE 4 : CNS_TOPPAR/ion.param REMARK 3 PARAMETER FILE 5 : CNS_TOPPAR/carbohydrate.param REMARK 3 PARAMETER FILE 6 : CNS_TOPPAR/act.param REMARK 3 TOPOLOGY FILE 1 : protein.top REMARK 3 TOPOLOGY FILE 2 : CNS_TOPPAR/dna-rna.top REMARK 3 TOPOLOGY FILE 3 : CNS_TOPPAR/water.top REMARK 3 TOPOLOGY FILE 4 : CNS_TOPPAR/ion.top REMARK 3 TOPOLOGY FILE 5 : CNS_TOPPAR/carbohydrate.top REMARK 3 TOPOLOGY FILE 6 : act.top REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: BULK SOLVENT MODEL USED SSBOND 1 CYS A 3 CYS A 26 SSBOND 2 CYS B 3 CYS B 26 SSBOND 3 CYS C 3 CYS C 26 SSBOND 4 CYS D 3 CYS D 26 CRYST1 47.265 98.030 108.797 90.00 90.00 90.00 P 21 21 21 0 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.021157 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010201 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009191 0.00000 HETATM 1 C CYS A 1 18.048 25.376 -16.051 1.00 16.26 A C HETATM 2 O CYS A 1 18.844 24.728 -16.739 1.00 16.30 A O HETATM 3 CB CYS A 1 17.513 26.771 -18.076 1.00 18.62 A C HETATM 4 SG CYS A 1 16.297 27.824 -18.923 1.00 20.77 A S HETATM 5 N CYS A 1 16.812 27.542 -15.832 1.00 18.53 A N HETATM 6 CA CYS A 1 17.051 26.343 -16.684 1.00 16.98 A C HETATM 7 N SER A 2 17.971 25.268 -14.729 1.00 16.81 A N HETATM 8 CA SER A 2 18.833 24.378 -13.964 1.00 17.24 A C HETATM 9 CB SER A 2 20.153 25.070 -13.585 1.00 18.99 A C HETATM 10 OG SER A 2 19.945 26.123 -12.656 1.00 22.01 A O HETATM 11 C SER A 2 18.137 23.909 -12.701 1.00 16.38 A C HETATM 12 O SER A 2 17.183 24.542 -12.228 1.00 17.75 A O HETATM 13 N VAL A 3 18.611 22.783 -12.176 1.00 14.58 A N HETATM 14 CA VAL A 3 18.094 22.227 -10.936 1.00 15.39 A C HETATM 15 CB VAL A 3 16.874 21.267 -11.166 1.00 15.63 A C HETATM 16 CG1 VAL A 3 17.283 19.987 -11.895 1.00 16.09 A C HETATM 17 CG2 VAL A 3 16.165 20.971 -9.840 1.00 16.39 A C HETATM 18 C VAL A 3 19.235 21.547 -10.175 1.00 16.41 A C HETATM 19 O VAL A 3 20.080 20.861 -10.767 1.00 15.46 A O HETATM 20 N ASP A 4 19.299 21.834 -8.878 1.00 16.48 A N HETATM 21 CA ASP A 4 20.302 21.244 -8.004 1.00 16.89 A C HETATM 22 CB ASP A 4 20.916 22.295 -7.076 1.00 18.54 A C HETATM 23 CG ASP A 4 22.161 22.937 -7.671 1.00 20.88 A C HETATM 24 OD1 ASP A 4 22.075 23.544 -8.764 1.00 19.71 A O HETATM 25 OD2 ASP A 4 23.240 22.807 -7.053 1.00 22.40 A O HETATM 26 C ASP A 4 19.648 20.117 -7.220 1.00 15.14 A C HETATM 27 O ASP A 4 18.646 20.329 -6.529 1.00 15.65 A O HETATM 28 N ILE A 5 20.164 18.906 -7.431 1.00 14.94 A N HETATM 29 CA ILE A 5 19.657 17.692 -6.783 1.00 13.39 A C HETATM 30 CB ILE A 5 19.374 16.527 -7.806 1.00 17.20 A C HETATM 31 CG2 ILE A 5 18.434 15.478 -7.196 1.00 15.59 A C HETATM 32 CG1 ILE A 5 18.846 17.037 -9.149 1.00 20.17 A C HETATM 33 CD1 ILE A 5 17.496 17.630 -9.125 1.00 23.61 A C HETATM 34 C ILE A 5 20.696 17.134 -5.818 1.00 13.81 A C HETATM 35 O ILE A 5 21.888 17.100 -6.121 1.00 14.39 A O HETATM 36 N GLN A 6 20.221 16.697 -4.657 1.00 13.05 A N HETATM 37 CA GLN A 6 21.066 16.071 -3.649 1.00 13.27 A C HETATM 38 CB GLN A 6 20.929 16.770 -2.291 1.00 13.92 A C HETATM 39 CG GLN A 6 21.481 18.188 -2.236 1.00 14.91 A C HETATM 40 CD GLN A 6 21.240 18.899 -0.907 1.00 18.42 A C HETATM 41 OE1 GLN A 6 21.461 20.108 -0.800 1.00 22.06 A O HETATM 42 NE2 GLN A 6 20.797 18.159 0.105 1.00 14.81 A N HETATM 43 C GLN A 6 20.608 14.625 -3.507 1.00 13.27 A C HETATM 44 O GLN A 6 19.417 14.341 -3.583 1.00 12.51 A O HETATM 45 N GLY A 7 21.571 13.718 -3.366 1.00 13.27 A N HETATM 46 CA GLY A 7 21.279 12.311 -3.157 1.00 13.61 A C HETATM 47 C GLY A 7 22.003 11.968 -1.867 1.00 13.49 A C HETATM 48 O GLY A 7 23.226 12.073 -1.829 1.00 12.17 A O HETATM 49 N ASN A 8 21.271 11.546 -0.833 1.00 12.55 A N HETATM 50 CA ASN A 8 21.864 11.235 0.471 1.00 12.91 A C HETATM 51 CB ASN A 8 20.925 11.710 1.605 1.00 11.55 A C HETATM 52 CG ASN A 8 19.567 10.998 1.609 1.00 12.25 A C HETATM 53 OD1 ASN A 8 19.433 9.859 1.149 1.00 12.80 A O HETATM 54 ND2 ASN A 8 18.561 11.662 2.167 1.00 10.51 A N HETATM 55 C ASN A 8 22.335 9.785 0.714 1.00 12.55 A C HETATM 56 O ASN A 8 22.261 8.932 -0.177 1.00 11.39 A O HETATM 57 N ASP A 9 22.788 9.517 1.942 1.00 12.73 A N HETATM 58 CA ASP A 9 23.268 8.186 2.346 1.00 13.45 A C HETATM 59 CB ASP A 9 24.064 8.279 3.650 1.00 13.71 A C HETATM 60 CG ASP A 9 25.513 8.679 3.438 1.00 15.79 A C HETATM 61 OD1 ASP A 9 26.016 8.628 2.292 1.00 14.58 A O HETATM 62 OD2 ASP A 9 26.168 9.012 4.448 1.00 15.65 A O HETATM 63 C ASP A 9 22.157 7.149 2.523 1.00 14.34 A C HETATM 64 O ASP A 9 22.430 5.950 2.664 1.00 14.75 A O HETATM 65 N GLN A 10 20.911 7.624 2.524 1.00 14.30 A N HETATM 66 CA GLN A 10 19.739 6.773 2.694 1.00 12.16 A C HETATM 67 CB GLN A 10 18.812 7.355 3.761 1.00 14.60 A C HETATM 68 CG GLN A 10 19.426 7.410 5.160 1.00 18.36 A C HETATM 69 CD GLN A 10 20.287 8.639 5.396 1.00 20.76 A C HETATM 70 OE1 GLN A 10 19.849 9.774 5.191 1.00 21.95 A O HETATM 71 NE2 GLN A 10 21.523 8.416 5.829 1.00 19.79 A N HETATM 72 C GLN A 10 18.989 6.534 1.385 1.00 12.30 A C HETATM 73 O GLN A 10 17.783 6.245 1.386 1.00 11.01 A O HETATM 74 N MET A 11 19.728 6.631 0.272 1.00 10.99 A N HETATM 75 CA MET A 11 19.225 6.405 -1.096 1.00 11.59 A C HETATM 76 CB MET A 11 18.938 4.907 -1.325 1.00 13.36 A C HETATM 77 CG MET A 11 20.105 3.991 -1.012 1.00 15.14 A C HETATM 78 SD MET A 11 19.665 2.329 -0.476 1.00 13.90 A S HETATM 79 CE MET A 11 18.758 2.733 1.023 1.00 15.77 A C HETATM 80 C MET A 11 17.988 7.241 -1.452 1.00 11.97 A C HETATM 81 O MET A 11 16.955 6.701 -1.869 1.00 10.33 A O HETATM 82 N GLN A 12 18.077 8.550 -1.231 1.00 12.69 A N HETATM 83 CA GLN A 12 16.967 9.461 -1.519 1.00 12.54 A C HETATM 84 CB GLN A 12 16.266 9.910 -0.220 1.00 12.53 A C HETATM 85 CG GLN A 12 15.629 8.807 0.628 1.00 13.59 A C HETATM 86 CD GLN A 12 15.304 9.253 2.042 1.00 15.48 A C HETATM 87 OE1 GLN A 12 16.043 10.030 2.658 1.00 13.46 A O HETATM 88 NE2 GLN A 12 14.193 8.758 2.570 1.00 17.84 A N HETATM 89 C GLN A 12 17.416 10.724 -2.233 1.00 12.92 A C HETATM 90 O GLN A 12 18.406 11.350 -1.840 1.00 14.09 A O HETATM 91 N PHE A 13 16.684 11.083 -3.290 1.00 10.29 A N HETATM 92 CA PHE A 13 16.912 12.328 -4.026 1.00 10.53 A C HETATM 93 CB PHE A 13 16.392 12.242 -5.468 1.00 11.04 A C HETATM 94 CG PHE A 13 17.307 11.530 -6.438 1.00 10.05 A C HETATM 95 CD1 PHE A 13 18.686 11.821 -6.506 1.00 10.98 A C HETATM 96 CD2 PHE A 13 16.763 10.619 -7.363 1.00 8.72 A C HETATM 97 CE1 PHE A 13 19.515 11.215 -7.497 1.00 10.77 A C HETATM 98 CE2 PHE A 13 17.575 10.003 -8.362 1.00 10.04 A C HETATM 99 CZ PHE A 13 18.950 10.303 -8.428 1.00 11.30 A C HETATM 100 C PHE A 13 16.036 13.343 -3.288 1.00 11.42 A C HETATM 101 O PHE A 13 15.017 12.949 -2.701 1.00 12.10 A O HETATM 102 N ASN A 14 16.403 14.628 -3.335 1.00 11.17 A N HETATM 103 CA ASN A 14 15.616 15.669 -2.671 1.00 11.83 A C HETATM 104 CB ASN A 14 16.519 16.710 -1.966 1.00 13.35 A C HETATM 105 CG ASN A 14 17.334 17.566 -2.929 1.00 13.08 A C HETATM 106 OD1 ASN A 14 17.422 17.286 -4.126 1.00 11.43 A O HETATM 107 ND2 ASN A 14 17.939 18.624 -2.394 1.00 12.73 A N HETATM 108 C ASN A 14 14.525 16.310 -3.559 1.00 13.02 A C HETATM 109 O ASN A 14 14.092 17.444 -3.327 1.00 13.87 A O HETATM 110 N THR A 15 14.152 15.578 -4.610 1.00 13.56 A N HETATM 111 CA THR A 15 13.080 15.945 -5.541 1.00 13.65 A C HETATM 112 CB THR A 15 13.465 17.053 -6.587 1.00 14.23 A C HETATM 113 OG1 THR A 15 12.293 17.428 -7.332 1.00 15.63 A O HETATM 114 CG2 THR A 15 14.521 16.570 -7.567 1.00 13.99 A C HETATM 115 C THR A 15 12.610 14.695 -6.278 1.00 12.85 A C HETATM 116 O THR A 15 13.384 13.749 -6.464 1.00 13.14 A O HETATM 117 N ASN A 16 11.321 14.674 -6.609 1.00 12.49 A N HETATM 118 CA ASN A 16 10.728 13.582 -7.370 1.00 13.87 A C HETATM 119 CB ASN A 16 9.841 12.671 -6.492 1.00 13.75 A C HETATM 120 CG ASN A 16 8.639 13.386 -5.890 1.00 15.28 A C HETATM 121 OD1 ASN A 16 7.782 13.904 -6.608 1.00 16.93 A O HETATM 122 ND2 ASN A 16 8.549 13.373 -4.567 1.00 17.55 A N HETATM 123 C ASN A 16 9.977 14.130 -8.587 1.00 13.03 A C HETATM 124 O ASN A 16 9.380 13.370 -9.351 1.00 14.15 A O HETATM 125 N ALA A 17 10.045 15.451 -8.770 1.00 12.94 A N HETATM 126 CA ALA A 17 9.369 16.133 -9.873 1.00 15.22 A C HETATM 127 CB ALA A 17 7.967 16.582 -9.448 1.00 14.57 A C HETATM 128 C ALA A 17 10.172 17.327 -10.373 1.00 15.38 A C HETATM 129 O ALA A 17 10.417 18.286 -9.631 1.00 15.99 A O HETATM 130 N ILE A 18 10.588 17.251 -11.635 1.00 15.65 A N HETATM 131 CA ILE A 18 11.365 18.315 -12.269 1.00 16.54 A C HETATM 132 CB ILE A 18 12.745 17.799 -12.816 1.00 17.55 A C HETATM 133 CG2 ILE A 18 13.480 18.908 -13.578 1.00 17.47 A C HETATM 134 CG1 ILE A 18 13.651 17.318 -11.677 1.00 17.25 A C HETATM 135 CD1 ILE A 18 14.933 16.613 -12.145 1.00 20.01 A C HETATM 136 C ILE A 18 10.568 18.932 -13.415 1.00 19.41 A C HETATM 137 O ILE A 18 10.092 18.228 -14.307 1.00 20.49 A O HETATM 138 N THR A 19 10.448 20.256 -13.381 1.00 19.79 A N HETATM 139 CA THR A 19 9.752 21.012 -14.413 1.00 22.32 A C HETATM 140 CB THR A 19 8.758 22.033 -13.811 1.00 24.19 A C HETATM 141 OG1 THR A 19 9.329 22.636 -12.640 1.00 29.81 A O HETATM 142 CG2 THR A 19 7.444 21.364 -13.458 1.00 21.90 A C HETATM 143 C THR A 19 10.783 21.760 -15.252 1.00 22.27 A C HETATM 144 O THR A 19 11.605 22.512 -14.714 1.00 22.73 A O HETATM 145 N VAL A 20 10.788 21.483 -16.555 1.00 22.12 A N HETATM 146 CA VAL A 20 11.697 22.150 -17.490 1.00 22.13 A C HETATM 147 CB VAL A 20 12.337 21.150 -18.511 1.00 20.80 A C HETATM 148 CG1 VAL A 20 13.269 21.877 -19.477 1.00 20.68 A C HETATM 149 CG2 VAL A 20 13.114 20.068 -17.784 1.00 19.02 A C HETATM 150 C VAL A 20 10.850 23.189 -18.223 1.00 23.96 A C HETATM 151 O VAL A 20 9.874 22.839 -18.886 1.00 23.51 A O HETATM 152 N ASP A 21 11.221 24.461 -18.069 1.00 25.67 A N HETATM 153 CA ASP A 21 10.518 25.583 -18.699 1.00 28.75 A C HETATM 154 CB ASP A 21 11.053 26.912 -18.148 1.00 30.62 A C HETATM 155 CG ASP A 21 10.093 28.072 -18.366 1.00 33.93 A C HETATM 156 OD1 ASP A 21 10.063 28.627 -19.487 1.00 34.37 A O HETATM 157 OD2 ASP A 21 9.367 28.425 -17.413 1.00 36.83 A O HETATM 158 C ASP A 21 10.671 25.533 -20.224 1.00 28.67 A C HETATM 159 O ASP A 21 11.723 25.138 -20.732 1.00 28.47 A O HETATM 160 N LYS A 22 9.604 25.921 -20.929 1.00 30.58 A N HETATM 161 CA LYS A 22 9.541 25.936 -22.398 1.00 30.97 A C HETATM 162 CB LYS A 22 8.140 26.354 -22.861 1.00 32.33 A C HETATM 163 CG LYS A 22 7.140 25.212 -22.969 1.00 34.93 A C HETATM 164 CD LYS A 22 5.741 25.692 -23.377 1.00 36.94 A C HETATM 165 CE LYS A 22 5.684 26.181 -24.824 1.00 38.49 A C HETATM 166 NZ LYS A 22 4.311 26.607 -25.217 1.00 40.66 A N HETATM 167 C LYS A 22 10.570 26.813 -23.105 1.00 30.45 A C HETATM 168 O LYS A 22 11.057 26.456 -24.182 1.00 30.38 A O HETATM 169 N SER A 23 10.913 27.938 -22.475 1.00 29.45 A N HETATM 170 CA SER A 23 11.867 28.904 -23.019 1.00 28.62 A C HETATM 171 CB SER A 23 11.708 30.259 -22.318 1.00 30.86 A C HETATM 172 OG SER A 23 12.023 30.172 -20.938 1.00 32.73 A O HETATM 173 C SER A 23 13.326 28.455 -22.964 1.00 27.61 A C HETATM 174 O SER A 23 14.177 29.040 -23.638 1.00 27.86 A O HETATM 175 N CYS A 24 13.603 27.412 -22.176 1.00 25.53 A N HETATM 176 CA CYS A 24 14.957 26.873 -22.028 1.00 23.60 A C HETATM 177 C CYS A 24 15.434 26.178 -23.299 1.00 23.08 A C HETATM 178 O CYS A 24 14.702 25.382 -23.889 1.00 21.45 A O HETATM 179 CB CYS A 24 15.025 25.883 -20.860 1.00 21.75 A C HETATM 180 SG CYS A 24 14.713 26.590 -19.214 1.00 20.32 A S HETATM 181 N LYS A 25 16.641 26.527 -23.739 1.00 22.64 A N HETATM 182 CA LYS A 25 17.241 25.928 -24.930 1.00 24.09 A C HETATM 183 CB LYS A 25 18.065 26.975 -25.693 1.00 27.81 A C HETATM 184 CG LYS A 25 17.897 26.940 -27.217 1.00 32.40 A C HETATM 185 CD LYS A 25 16.522 27.442 -27.691 1.00 34.36 A C HETATM 186 CE LYS A 25 16.400 28.968 -27.639 1.00 36.81 A C HETATM 187 NZ LYS A 25 15.073 29.436 -28.133 1.00 37.29 A N HETATM 188 C LYS A 25 18.124 24.769 -24.456 1.00 23.09 A C HETATM 189 O LYS A 25 18.332 23.786 -25.171 1.00 20.89 A O HETATM 190 N GLN A 26 18.613 24.905 -23.222 1.00 20.99 A N HETATM 191 CA GLN A 26 19.455 23.916 -22.555 1.00 21.01 A C HETATM 192 CB GLN A 26 20.920 24.375 -22.548 1.00 24.32 A C HETATM 193 CG GLN A 26 21.678 24.132 -23.852 1.00 29.30 A C HETATM 194 CD GLN A 26 22.987 24.894 -23.919 1.00 33.21 A C HETATM 195 OE1 GLN A 26 23.001 26.110 -24.129 1.00 36.20 A O HETATM 196 NE2 GLN A 26 24.098 24.182 -23.748 1.00 35.04 A N HETATM 197 C GLN A 26 18.961 23.752 -21.113 1.00 19.61 A C HETATM 198 O GLN A 26 18.362 24.675 -20.553 1.00 18.89 A O HETATM 199 N PHE A 27 19.145 22.557 -20.547 1.00 17.78 A N HETATM 200 CA PHE A 27 18.758 22.283 -19.160 1.00 15.77 A C HETATM 201 CB PHE A 27 17.499 21.402 -19.070 1.00 16.35 A C HETATM 202 CG PHE A 27 16.877 21.366 -17.687 1.00 15.11 A C HETATM 203 CD2 PHE A 27 17.052 20.249 -16.845 1.00 13.90 A C HETATM 204 CD1 PHE A 27 16.142 22.465 -17.209 1.00 16.94 A C HETATM 205 CE2 PHE A 27 16.501 20.233 -15.533 1.00 14.38 A C HETATM 206 CE1 PHE A 27 15.584 22.469 -15.904 1.00 16.66 A C HETATM 207 CZ PHE A 27 15.765 21.352 -15.065 1.00 15.20 A C HETATM 208 C PHE A 27 19.930 21.616 -18.451 1.00 15.25 A C HETATM 209 O PHE A 27 20.515 20.667 -18.972 1.00 15.01 A O HETATM 210 N THR A 28 20.235 22.104 -17.250 1.00 14.75 A N HETATM 211 CA THR A 28 21.347 21.590 -16.457 1.00 14.69 A C HETATM 212 CB THR A 28 22.393 22.717 -16.191 1.00 15.77 A C HETATM 213 OG1 THR A 28 22.767 23.302 -17.442 1.00 17.47 A O HETATM 214 CG2 THR A 28 23.666 22.176 -15.515 1.00 16.17 A C HETATM 215 C THR A 28 20.908 20.970 -15.135 1.00 13.31 A C HETATM 216 O THR A 28 19.980 21.445 -14.488 1.00 12.77 A O HETATM 217 N VAL A 29 21.557 19.863 -14.781 1.00 12.56 A N HETATM 218 CA VAL A 29 21.307 19.171 -13.524 1.00 12.38 A C HETATM 219 CB VAL A 29 20.768 17.723 -13.748 1.00 11.46 A C HETATM 220 CG1 VAL A 29 20.735 16.938 -12.429 1.00 11.80 A C HETATM 221 CG2 VAL A 29 19.366 17.772 -14.331 1.00 12.21 A C HETATM 222 C VAL A 29 22.659 19.128 -12.814 1.00 10.41 A C HETATM 223 O VAL A 29 23.647 18.674 -13.393 1.00 11.74 A O HETATM 224 N ASN A 30 22.698 19.662 -11.594 1.00 10.72 A N HETATM 225 CA ASN A 30 23.903 19.675 -10.767 1.00 11.10 A C HETATM 226 CB ASN A 30 24.212 21.089 -10.259 1.00 11.56 A C HETATM 227 CG ASN A 30 24.374 22.091 -11.379 1.00 11.70 A C HETATM 228 OD1 ASN A 30 25.181 21.902 -12.290 1.00 13.95 A O HETATM 229 ND2 ASN A 30 23.604 23.168 -11.319 1.00 12.59 A N HETATM 230 C ASN A 30 23.625 18.744 -9.597 1.00 10.20 A C HETATM 231 O ASN A 30 22.839 19.067 -8.692 1.00 10.31 A O HETATM 232 N LEU A 31 24.248 17.572 -9.643 1.00 11.92 A N HETATM 233 CA LEU A 31 24.067 16.551 -8.617 1.00 12.84 A C HETATM 234 CB LEU A 31 24.049 15.165 -9.278 1.00 13.15 A C HETATM 235 CG LEU A 31 23.735 13.907 -8.460 1.00 14.50 A C HETATM 236 CD1 LEU A 31 22.274 13.866 -8.056 1.00 12.84 A C HETATM 237 CD2 LEU A 31 24.092 12.681 -9.268 1.00 12.94 A C HETATM 238 C LEU A 31 25.146 16.601 -7.537 1.00 12.48 A C HETATM 239 O LEU A 31 26.324 16.763 -7.845 1.00 14.49 A O HETATM 240 N SER A 32 24.721 16.528 -6.275 1.00 13.19 A N HETATM 241 CA SER A 32 25.648 16.497 -5.140 1.00 14.05 A C HETATM 242 CB SER A 32 25.681 17.821 -4.361 1.00 14.27 A C HETATM 243 OG SER A 32 24.449 18.142 -3.754 1.00 12.84 A O HETATM 244 C SER A 32 25.268 15.316 -4.249 1.00 15.47 A C HETATM 245 O SER A 32 24.184 14.733 -4.403 1.00 13.93 A O HETATM 246 N HIS A 33 26.158 14.966 -3.322 1.00 14.42 A N HETATM 247 CA HIS A 33 25.939 13.825 -2.447 1.00 14.10 A C HETATM 248 CB HIS A 33 26.704 12.614 -3.033 1.00 13.72 A C HETATM 249 CG HIS A 33 26.425 11.291 -2.373 1.00 13.28 A C HETATM 250 CD2 HIS A 33 26.558 10.028 -2.844 1.00 14.44 A C HETATM 251 ND1 HIS A 33 26.025 11.163 -1.059 1.00 15.02 A N HETATM 252 CE1 HIS A 33 25.922 9.882 -0.751 1.00 13.86 A C HETATM 253 NE2 HIS A 33 26.241 9.172 -1.816 1.00 14.81 A N HETATM 254 C HIS A 33 26.321 14.086 -0.982 1.00 13.79 A C HETATM 255 O HIS A 33 27.455 13.820 -0.576 1.00 14.10 A O HETATM 256 N PRO A 34 25.384 14.624 -0.172 1.00 15.08 A N HETATM 257 CD PRO A 34 24.088 15.238 -0.520 1.00 15.59 A C HETATM 258 CA PRO A 34 25.711 14.864 1.240 1.00 16.63 A C HETATM 259 CB PRO A 34 24.520 15.693 1.738 1.00 17.99 A C HETATM 260 CG PRO A 34 23.403 15.325 0.810 1.00 18.45 A C HETATM 261 C PRO A 34 25.842 13.512 1.973 1.00 18.78 A C HETATM 262 O PRO A 34 25.317 12.494 1.500 1.00 18.30 A O HETATM 263 N GLY A 35 26.624 13.491 3.049 1.00 18.52 A N HETATM 264 CA GLY A 35 26.820 12.265 3.805 1.00 19.41 A C HETATM 265 C GLY A 35 28.273 11.835 3.906 1.00 19.52 A C HETATM 266 O GLY A 35 29.174 12.644 3.668 1.00 20.96 A O HETATM 267 N ASN A 36 28.497 10.551 4.199 1.00 19.61 A N HETATM 268 CA ASN A 36 29.849 10.002 4.360 1.00 20.02 A C HETATM 269 CB ASN A 36 30.218 9.934 5.856 1.00 24.10 A C HETATM 270 CG ASN A 36 29.194 9.170 6.691 1.00 28.89 A C HETATM 271 OD1 ASN A 36 29.060 7.947 6.574 1.00 32.57 A O HETATM 272 ND2 ASN A 36 28.476 9.891 7.548 1.00 31.58 A N HETATM 273 C ASN A 36 30.161 8.657 3.668 1.00 18.76 A C HETATM 274 O ASN A 36 31.301 8.191 3.709 1.00 18.17 A O HETATM 275 N LEU A 37 29.178 8.064 2.988 1.00 18.33 A N HETATM 276 CA LEU A 37 29.383 6.771 2.321 1.00 17.06 A C HETATM 277 CB LEU A 37 28.068 5.986 2.268 1.00 15.53 A C HETATM 278 CG LEU A 37 27.503 5.426 3.578 1.00 14.67 A C HETATM 279 CD1 LEU A 37 26.099 4.906 3.307 1.00 13.10 A C HETATM 280 CD2 LEU A 37 28.398 4.319 4.140 1.00 16.09 A C HETATM 281 C LEU A 37 30.045 6.820 0.932 1.00 17.27 A C HETATM 282 O LEU A 37 29.700 7.675 0.110 1.00 16.83 A O HETATM 283 N PRO A 38 31.006 5.905 0.654 1.00 17.57 A N HETATM 284 CD PRO A 38 31.624 4.939 1.586 1.00 18.79 A C HETATM 285 CA PRO A 38 31.703 5.865 -0.642 1.00 17.41 A C HETATM 286 CB PRO A 38 32.872 4.914 -0.370 1.00 19.07 A C HETATM 287 CG PRO A 38 32.331 3.993 0.652 1.00 18.58 A C HETATM 288 C PRO A 38 30.884 5.423 -1.862 1.00 17.60 A C HETATM 289 O PRO A 38 29.786 4.874 -1.724 1.00 15.46 A O HETATM 290 N LYS A 39 31.478 5.628 -3.040 1.00 16.84 A N HETATM 291 CA LYS A 39 30.894 5.313 -4.352 1.00 16.84 A C HETATM 292 CB LYS A 39 31.840 5.806 -5.463 1.00 18.49 A C HETATM 293 CG LYS A 39 31.180 6.024 -6.833 1.00 20.34 A C HETATM 294 CD LYS A 39 32.137 6.631 -7.870 1.00 21.64 A C HETATM 295 CE LYS A 39 33.119 5.614 -8.440 1.00 24.14 A C HETATM 296 NZ LYS A 39 33.970 6.215 -9.512 1.00 26.63 A N HETATM 297 C LYS A 39 30.506 3.855 -4.616 1.00 15.81 A C HETATM 298 O LYS A 39 29.476 3.590 -5.249 1.00 13.72 A O HETATM 299 N ASN A 40 31.317 2.919 -4.125 1.00 15.12 A N HETATM 300 CA ASN A 40 31.062 1.495 -4.335 1.00 15.54 A C HETATM 301 CB ASN A 40 32.311 0.657 -3.999 1.00 18.53 A C HETATM 302 CG ASN A 40 32.587 0.575 -2.509 1.00 18.93 A C HETATM 303 OD1 ASN A 40 32.747 1.591 -1.837 1.00 22.54 A O HETATM 304 ND2 ASN A 40 32.617 -0.643 -1.983 1.00 21.92 A N HETATM 305 C ASN A 40 29.822 0.946 -3.619 1.00 14.85 A C HETATM 306 O ASN A 40 29.294 -0.092 -4.019 1.00 15.80 A O HETATM 307 N VAL A 41 29.379 1.643 -2.570 1.00 14.62 A N HETATM 308 CA VAL A 41 28.200 1.232 -1.800 1.00 15.11 A C HETATM 309 CB VAL A 41 28.518 0.989 -0.275 1.00 15.27 A C HETATM 310 CG1 VAL A 41 29.642 -0.029 -0.106 1.00 15.53 A C HETATM 311 CG2 VAL A 41 28.859 2.283 0.452 1.00 16.91 A C HETATM 312 C VAL A 41 27.024 2.204 -1.914 1.00 15.55 A C HETATM 313 O VAL A 41 25.867 1.801 -1.773 1.00 15.24 A O HETATM 314 N MET A 42 27.323 3.475 -2.185 1.00 14.74 A N HETATM 315 CA MET A 42 26.288 4.502 -2.261 1.00 14.66 A C HETATM 316 CB MET A 42 26.180 5.174 -0.883 1.00 15.19 A C HETATM 317 CG MET A 42 24.866 5.878 -0.553 1.00 17.23 A C HETATM 318 SD MET A 42 23.395 4.883 -0.780 1.00 14.70 A S HETATM 319 CE MET A 42 23.561 3.674 0.606 1.00 13.73 A C HETATM 320 C MET A 42 26.543 5.526 -3.373 1.00 13.19 A C HETATM 321 O MET A 42 26.340 6.731 -3.198 1.00 13.06 A O HETATM 322 N GLY A 43 26.972 5.027 -4.529 1.00 14.23 A N HETATM 323 CA GLY A 43 27.227 5.897 -5.667 1.00 13.98 A C HETATM 324 C GLY A 43 25.942 6.275 -6.362 1.00 13.86 A C HETATM 325 O GLY A 43 25.185 5.399 -6.776 1.00 14.20 A O HETATM 326 N HIS A 44 25.706 7.579 -6.498 1.00 13.71 A N HETATM 327 CA HIS A 44 24.497 8.078 -7.145 1.00 14.19 A C HETATM 328 CB HIS A 44 23.802 9.140 -6.283 1.00 13.65 A C HETATM 329 CG HIS A 44 23.452 8.693 -4.899 1.00 12.24 A C HETATM 330 CD2 HIS A 44 23.377 9.390 -3.744 1.00 10.77 A C HETATM 331 ND1 HIS A 44 23.074 7.405 -4.591 1.00 10.67 A N HETATM 332 CE1 HIS A 44 22.780 7.330 -3.306 1.00 10.59 A C HETATM 333 NE2 HIS A 44 22.956 8.523 -2.769 1.00 12.45 A N HETATM 334 C HIS A 44 24.767 8.727 -8.489 1.00 14.57 A C HETATM 335 O HIS A 44 25.782 9.400 -8.677 1.00 15.67 A O HETATM 336 N ASN A 45 23.858 8.493 -9.429 1.00 13.39 A N HETATM 337 CA ASN A 45 23.916 9.131 -10.736 1.00 12.48 A C HETATM 338 CB ASN A 45 24.484 8.217 -11.855 1.00 12.78 A C HETATM 339 CG ASN A 45 23.700 6.915 -12.059 1.00 13.90 A C HETATM 340 OD1 ASN A 45 22.657 6.690 -11.454 1.00 13.02 A O HETATM 341 ND2 ASN A 45 24.215 6.058 -12.934 1.00 12.51 A N HETATM 342 C ASN A 45 22.505 9.628 -11.029 1.00 12.97 A C HETATM 343 O ASN A 45 21.565 9.302 -10.292 1.00 12.75 A O HETATM 344 N TRP A 46 22.382 10.504 -12.018 1.00 12.97 A N HETATM 345 CA TRP A 46 21.092 11.035 -12.430 1.00 12.41 A C HETATM 346 CB TRP A 46 21.053 12.559 -12.251 1.00 12.76 A C HETATM 347 CG TRP A 46 19.729 13.183 -12.584 1.00 12.26 A C HETATM 348 CD2 TRP A 46 19.317 13.705 -13.858 1.00 11.97 A C HETATM 349 CE2 TRP A 46 17.984 14.170 -13.704 1.00 11.45 A C HETATM 350 CE3 TRP A 46 19.945 13.823 -15.120 1.00 10.88 A C HETATM 351 CD1 TRP A 46 18.674 13.351 -11.741 1.00 11.35 A C HETATM 352 NE1 TRP A 46 17.620 13.939 -12.404 1.00 13.12 A N HETATM 353 CZ2 TRP A 46 17.252 14.749 -14.768 1.00 10.95 A C HETATM 354 CZ3 TRP A 46 19.217 14.403 -16.192 1.00 11.94 A C HETATM 355 CH2 TRP A 46 17.881 14.857 -16.000 1.00 12.10 A C HETATM 356 C TRP A 46 21.026 10.639 -13.898 1.00 12.41 A C HETATM 357 O TRP A 46 21.872 11.051 -14.692 1.00 13.14 A O HETATM 358 N VAL A 47 20.040 9.811 -14.240 1.00 13.16 A N HETATM 359 CA VAL A 47 19.865 9.303 -15.605 1.00 11.19 A C HETATM 360 CB VAL A 47 20.076 7.755 -15.650 1.00 12.98 A C HETATM 361 CG1 VAL A 47 20.022 7.230 -17.079 1.00 10.74 A C HETATM 362 CG2 VAL A 47 21.401 7.368 -15.007 1.00 13.27 A C HETATM 363 C VAL A 47 18.451 9.626 -16.065 1.00 12.77 A C HETATM 364 O VAL A 47 17.503 9.446 -15.305 1.00 11.09 A O HETATM 365 N LEU A 48 18.322 10.059 -17.319 1.00 12.60 A N HETATM 366 CA LEU A 48 17.034 10.412 -17.908 1.00 12.30 A C HETATM 367 CB LEU A 48 17.031 11.889 -18.325 1.00 12.64 A C HETATM 368 CG LEU A 48 15.745 12.537 -18.867 1.00 11.85 A C HETATM 369 CD1 LEU A 48 14.695 12.646 -17.768 1.00 12.16 A C HETATM 370 CD2 LEU A 48 16.069 13.910 -19.427 1.00 12.98 A C HETATM 371 C LEU A 48 16.679 9.542 -19.115 1.00 11.88 A C HETATM 372 O LEU A 48 17.506 9.316 -19.998 1.00 13.58 A O HETATM 373 N SER A 49 15.430 9.079 -19.141 1.00 12.48 A N HETATM 374 CA SER A 49 14.911 8.253 -20.230 1.00 12.82 A C HETATM 375 CB SER A 49 15.290 6.776 -20.021 1.00 13.42 A C HETATM 376 OG SER A 49 14.499 6.166 -19.008 1.00 13.68 A O HETATM 377 C SER A 49 13.394 8.387 -20.264 1.00 12.97 A C HETATM 378 O SER A 49 12.800 9.020 -19.384 1.00 14.56 A O HETATM 379 N THR A 50 12.765 7.775 -21.268 1.00 14.29 A N HETATM 380 CA THR A 50 11.302 7.772 -21.365 1.00 15.36 A C HETATM 381 CB THR A 50 10.800 7.317 -22.760 1.00 15.71 A C HETATM 382 OG1 THR A 50 11.212 5.968 -23.009 1.00 15.12 A O HETATM 383 CG2 THR A 50 11.343 8.223 -23.856 1.00 17.92 A C HETATM 384 C THR A 50 10.818 6.762 -20.318 1.00 16.38 A C HETATM 385 O THR A 50 11.602 5.911 -19.874 1.00 16.88 A O HETATM 386 N ALA A 51 9.550 6.862 -19.921 1.00 16.75 A N HETATM 387 CA ALA A 51 8.973 5.952 -18.927 1.00 17.98 A C HETATM 388 CB ALA A 51 7.539 6.351 -18.624 1.00 18.83 A C HETATM 389 C ALA A 51 9.053 4.482 -19.340 1.00 17.81 A C HETATM 390 O ALA A 51 9.398 3.620 -18.525 1.00 17.75 A O HETATM 391 N ALA A 52 8.849 4.236 -20.635 1.00 16.74 A N HETATM 392 CA ALA A 52 8.891 2.896 -21.217 1.00 16.14 A C HETATM 393 CB ALA A 52 8.283 2.916 -22.617 1.00 17.12 A C HETATM 394 C ALA A 52 10.298 2.291 -21.262 1.00 15.87 A C HETATM 395 O ALA A 52 10.457 1.076 -21.118 1.00 16.85 A O HETATM 396 N ASP A 53 11.304 3.156 -21.400 1.00 15.88 A N HETATM 397 CA ASP A 53 12.712 2.750 -21.486 1.00 15.05 A C HETATM 398 CB ASP A 53 13.493 3.734 -22.366 1.00 17.08 A C HETATM 399 CG ASP A 53 13.188 3.585 -23.853 1.00 18.29 A C HETATM 400 OD1 ASP A 53 12.657 2.536 -24.282 1.00 17.83 A O HETATM 401 OD2 ASP A 53 13.523 4.529 -24.600 1.00 19.31 A O HETATM 402 C ASP A 53 13.476 2.594 -20.173 1.00 13.82 A C HETATM 403 O ASP A 53 14.562 2.006 -20.170 1.00 13.57 A O HETATM 404 N MET A 54 12.923 3.109 -19.072 1.00 12.93 A N HETATM 405 CA MET A 54 13.579 3.044 -17.760 1.00 11.85 A C HETATM 406 CB MET A 54 12.671 3.603 -16.656 1.00 11.04 A C HETATM 407 CG MET A 54 13.324 3.547 -15.274 1.00 12.91 A C HETATM 408 SD MET A 54 12.473 4.340 -13.955 1.00 15.10 A S HETATM 409 CE MET A 54 13.226 3.479 -12.552 1.00 13.89 A C HETATM 410 C MET A 54 14.127 1.679 -17.329 1.00 12.01 A C HETATM 411 O MET A 54 15.318 1.559 -17.026 1.00 10.88 A O HETATM 412 N GLN A 55 13.271 0.658 -17.344 1.00 11.99 A N HETATM 413 CA GLN A 55 13.670 -0.683 -16.927 1.00 13.74 A C HETATM 414 CB GLN A 55 12.485 -1.648 -16.977 1.00 14.27 A C HETATM 415 CG GLN A 55 12.796 -3.021 -16.373 1.00 14.85 A C HETATM 416 CD GLN A 55 13.257 -2.946 -14.920 1.00 16.09 A C HETATM 417 OE1 GLN A 55 12.510 -2.519 -14.051 1.00 15.62 A O HETATM 418 NE2 GLN A 55 14.496 -3.356 -14.663 1.00 13.11 A N HETATM 419 C GLN A 55 14.847 -1.268 -17.698 1.00 12.46 A C HETATM 420 O GLN A 55 15.758 -1.844 -17.092 1.00 12.77 A O HETATM 421 N GLY A 56 14.820 -1.095 -19.019 1.00 13.92 A N HETATM 422 CA GLY A 56 15.886 -1.581 -19.883 1.00 14.93 A C HETATM 423 C GLY A 56 17.219 -0.944 -19.540 1.00 14.04 A C HETATM 424 O GLY A 56 18.232 -1.639 -19.438 1.00 13.79 A O HETATM 425 N VAL A 57 17.190 0.366 -19.279 1.00 14.21 A N HETATM 426 CA VAL A 57 18.383 1.136 -18.907 1.00 13.11 A C HETATM 427 CB VAL A 57 18.080 2.666 -18.881 1.00 13.50 A C HETATM 428 CG1 VAL A 57 19.277 3.463 -18.369 1.00 13.82 A C HETATM 429 CG2 VAL A 57 17.707 3.152 -20.265 1.00 14.45 A C HETATM 430 C VAL A 57 18.914 0.666 -17.543 1.00 12.57 A C HETATM 431 O VAL A 57 20.117 0.483 -17.384 1.00 12.15 A O HETATM 432 N VAL A 58 18.004 0.430 -16.591 1.00 13.02 A N HETATM 433 CA VAL A 58 18.351 -0.031 -15.234 1.00 12.72 A C HETATM 434 CB VAL A 58 17.103 0.036 -14.280 1.00 13.58 A C HETATM 435 CG1 VAL A 58 17.401 -0.542 -12.883 1.00 13.73 A C HETATM 436 CG2 VAL A 58 16.666 1.476 -14.117 1.00 11.27 A C HETATM 437 C VAL A 58 18.968 -1.441 -15.229 1.00 13.47 A C HETATM 438 O VAL A 58 19.978 -1.676 -14.560 1.00 14.21 A O HETATM 439 N THR A 59 18.381 -2.354 -16.004 1.00 13.74 A N HETATM 440 CA THR A 59 18.865 -3.734 -16.090 1.00 14.18 A C HETATM 441 CB THR A 59 17.840 -4.642 -16.823 1.00 13.90 A C HETATM 442 OG1 THR A 59 16.599 -4.624 -16.104 1.00 14.58 A O HETATM 443 CG2 THR A 59 18.336 -6.098 -16.919 1.00 15.13 A C HETATM 444 C THR A 59 20.233 -3.802 -16.773 1.00 13.71 A C HETATM 445 O THR A 59 21.176 -4.368 -16.214 1.00 14.07 A O HETATM 446 N ASP A 60 20.346 -3.157 -17.935 1.00 15.66 A N HETATM 447 CA ASP A 60 21.594 -3.130 -18.708 1.00 16.54 A C HETATM 448 CB ASP A 60 21.356 -2.550 -20.102 1.00 16.37 A C HETATM 449 CG ASP A 60 20.565 -3.489 -21.010 1.00 18.96 A C HETATM 450 OD1 ASP A 60 20.307 -4.650 -20.624 1.00 20.60 A O HETATM 451 OD2 ASP A 60 20.199 -3.059 -22.123 1.00 16.52 A O HETATM 452 C ASP A 60 22.660 -2.329 -17.986 1.00 16.81 A C HETATM 453 O ASP A 60 23.853 -2.612 -18.109 1.00 16.16 A O HETATM 454 N GLY A 61 22.195 -1.364 -17.193 1.00 17.18 A N HETATM 455 CA GLY A 61 23.073 -0.528 -16.403 1.00 16.20 A C HETATM 456 C GLY A 61 23.760 -1.294 -15.286 1.00 17.27 A C HETATM 457 O GLY A 61 24.984 -1.210 -15.150 1.00 14.86 A O HETATM 458 N MET A 62 22.981 -2.063 -14.517 1.00 17.01 A N HETATM 459 CA MET A 62 23.496 -2.888 -13.410 1.00 20.12 A C HETATM 460 CB MET A 62 22.349 -3.695 -12.770 1.00 22.77 A C HETATM 461 CG MET A 62 22.801 -4.769 -11.766 1.00 26.71 A C HETATM 462 SD MET A 62 21.565 -5.998 -11.355 1.00 33.84 A S HETATM 463 CE MET A 62 20.841 -5.204 -10.010 1.00 27.15 A C HETATM 464 C MET A 62 24.583 -3.851 -13.911 1.00 20.53 A C HETATM 465 O MET A 62 25.637 -4.002 -13.282 1.00 20.84 A O HETATM 466 N ALA A 63 24.323 -4.429 -15.083 1.00 19.78 A N HETATM 467 CA ALA A 63 25.206 -5.385 -15.744 1.00 19.05 A C HETATM 468 CB ALA A 63 24.421 -6.142 -16.818 1.00 19.83 A C HETATM 469 C ALA A 63 26.482 -4.786 -16.347 1.00 17.97 A C HETATM 470 O ALA A 63 27.371 -5.529 -16.767 1.00 18.29 A O HETATM 471 N SER A 64 26.575 -3.455 -16.372 1.00 16.01 A N HETATM 472 CA SER A 64 27.739 -2.764 -16.936 1.00 14.90 A C HETATM 473 CB SER A 64 27.302 -1.481 -17.635 1.00 13.40 A C HETATM 474 OG SER A 64 26.390 -1.768 -18.683 1.00 13.35 A O HETATM 475 C SER A 64 28.898 -2.478 -15.972 1.00 15.75 A C HETATM 476 O SER A 64 29.996 -2.136 -16.416 1.00 16.58 A O HETATM 477 N GLY A 65 28.646 -2.572 -14.664 1.00 16.82 A N HETATM 478 CA GLY A 65 29.696 -2.348 -13.675 1.00 16.39 A C HETATM 479 C GLY A 65 29.959 -0.917 -13.228 1.00 17.70 A C HETATM 480 O GLY A 65 29.519 0.041 -13.876 1.00 16.26 A O HETATM 481 N LEU A 66 30.689 -0.791 -12.115 1.00 16.92 A N HETATM 482 CA LEU A 66 31.059 0.492 -11.495 1.00 18.04 A C HETATM 483 CB LEU A 66 31.801 0.239 -10.170 1.00 19.89 A C HETATM 484 CG LEU A 66 32.310 1.394 -9.292 1.00 22.29 A C HETATM 485 CD1 LEU A 66 31.186 1.977 -8.475 1.00 23.43 A C HETATM 486 CD2 LEU A 66 33.390 0.890 -8.360 1.00 24.04 A C HETATM 487 C LEU A 66 31.903 1.398 -12.394 1.00 18.53 A C HETATM 488 O LEU A 66 31.704 2.612 -12.410 1.00 17.13 A O HETATM 489 N ASP A 67 32.800 0.796 -13.175 1.00 18.72 A N HETATM 490 CA ASP A 67 33.682 1.544 -14.076 1.00 19.92 A C HETATM 491 CB ASP A 67 34.783 0.633 -14.635 1.00 21.59 A C HETATM 492 CG ASP A 67 34.249 -0.477 -15.534 1.00 23.19 A C HETATM 493 OD1 ASP A 67 33.436 -1.301 -15.064 1.00 26.44 A O HETATM 494 OD2 ASP A 67 34.656 -0.521 -16.714 1.00 23.66 A O HETATM 495 C ASP A 67 32.960 2.267 -15.213 1.00 19.95 A C HETATM 496 O ASP A 67 33.483 3.231 -15.774 1.00 21.75 A O HETATM 497 N LYS A 68 31.767 1.774 -15.549 1.19 19.71 A N HETATM 498 CA LYS A 68 30.937 2.356 -16.601 0.97 18.53 A C HETATM 499 CB LYS A 68 30.395 1.260 -17.538 0.92 19.06 A C HETATM 500 CG LYS A 68 31.447 0.385 -18.239 1.07 18.45 A C HETATM 501 CD LYS A 68 32.424 1.188 -19.094 0.98 19.08 A C HETATM 502 CE LYS A 68 33.382 0.281 -19.851 0.68 19.18 A C HETATM 503 NZ LYS A 68 34.414 1.062 -20.596 0.89 19.21 A N HETATM 504 C LYS A 68 29.777 3.155 -15.995 1.22 17.96 A C HETATM 505 O LYS A 68 28.765 3.385 -16.658 1.16 17.61 A O HETATM 506 N ASP A 69 29.942 3.572 -14.731 1.00 17.20 A N HETATM 507 CA ASP A 69 28.955 4.360 -13.959 1.00 16.67 A C HETATM 508 CB ASP A 69 28.841 5.798 -14.512 1.00 17.69 A C HETATM 509 CG ASP A 69 30.139 6.577 -14.406 1.00 20.51 A C HETATM 510 OD1 ASP A 69 30.671 6.700 -13.286 1.00 22.33 A O HETATM 511 OD2 ASP A 69 30.621 7.071 -15.452 1.00 22.79 A O HETATM 512 C ASP A 69 27.567 3.712 -13.901 1.00 15.62 A C HETATM 513 O ASP A 69 26.539 4.403 -13.821 1.00 15.47 A O HETATM 514 N TYR A 70 27.564 2.377 -13.958 1.00 14.16 A N HETATM 515 CA TYR A 70 26.359 1.546 -13.972 1.00 14.16 A C HETATM 516 CB TYR A 70 25.664 1.493 -12.600 1.00 12.73 A C HETATM 517 CG TYR A 70 26.399 0.637 -11.599 1.00 13.12 A C HETATM 518 CD1 TYR A 70 26.528 -0.760 -11.790 1.00 12.39 A C HETATM 519 CE1 TYR A 70 27.235 -1.568 -10.860 1.00 11.96 A C HETATM 520 CD2 TYR A 70 26.985 1.210 -10.457 1.00 12.79 A C HETATM 521 CE2 TYR A 70 27.695 0.410 -9.513 1.00 13.05 A C HETATM 522 CZ TYR A 70 27.811 -0.973 -9.726 1.00 11.66 A C HETATM 523 OH TYR A 70 28.472 -1.751 -8.810 1.00 12.33 A O HETATM 524 C TYR A 70 25.398 1.940 -15.086 1.00 15.53 A C HETATM 525 O TYR A 70 24.184 2.018 -14.896 1.00 15.12 A O HETATM 526 N LEU A 71 25.973 2.202 -16.258 1.00 15.63 A N HETATM 527 CA LEU A 71 25.225 2.586 -17.453 1.00 15.83 A C HETATM 528 CB LEU A 71 25.283 4.101 -17.670 1.00 15.26 A C HETATM 529 CG LEU A 71 24.344 4.973 -16.842 1.00 16.10 A C HETATM 530 CD1 LEU A 71 24.769 6.403 -16.962 1.00 16.89 A C HETATM 531 CD2 LEU A 71 22.902 4.768 -17.286 1.00 13.83 A C HETATM 532 C LEU A 71 25.837 1.896 -18.652 1.00 15.53 A C HETATM 533 O LEU A 71 27.066 1.827 -18.761 1.00 18.13 A O HETATM 534 N LYS A 72 24.989 1.382 -19.544 1.00 15.10 A N HETATM 535 CA LYS A 72 25.462 0.713 -20.758 1.00 16.10 A C HETATM 536 CB LYS A 72 24.315 -0.030 -21.464 1.00 17.15 A C HETATM 537 CG LYS A 72 24.739 -0.818 -22.717 1.00 20.45 A C HETATM 538 CD LYS A 72 23.666 -1.774 -23.225 1.00 22.82 A C HETATM 539 CE LYS A 72 22.480 -1.055 -23.835 1.00 25.01 A C HETATM 540 NZ LYS A 72 21.431 -2.013 -24.284 1.00 26.05 A N HETATM 541 C LYS A 72 26.071 1.766 -21.683 1.00 15.82 A C HETATM 542 O LYS A 72 25.426 2.778 -21.961 1.00 13.70 A O HETATM 543 N PRO A 73 27.349 1.584 -22.099 1.00 17.10 A N HETATM 544 CD PRO A 73 28.321 0.556 -21.670 1.00 17.39 A C HETATM 545 CA PRO A 73 28.005 2.548 -22.994 1.00 18.98 A C HETATM 546 CB PRO A 73 29.370 1.904 -23.240 1.00 19.06 A C HETATM 547 CG PRO A 73 29.645 1.229 -21.954 1.00 18.39 A C HETATM 548 C PRO A 73 27.231 2.712 -24.298 1.00 19.42 A C HETATM 549 O PRO A 73 26.731 1.731 -24.853 1.00 20.92 A O HETATM 550 N ASP A 74 27.062 3.971 -24.712 1.00 21.19 A N HETATM 551 CA ASP A 74 26.350 4.368 -25.938 1.00 22.99 A C HETATM 552 CB ASP A 74 27.090 3.879 -27.206 1.00 25.10 A C HETATM 553 CG ASP A 74 28.558 4.276 -27.230 1.00 27.22 A C HETATM 554 OD2 ASP A 74 29.405 3.372 -27.399 1.00 29.34 A O HETATM 555 OD1 ASP A 74 28.864 5.477 -27.075 1.00 30.45 A O HETATM 556 C ASP A 74 24.867 3.961 -25.993 1.00 23.05 A C HETATM 557 O ASP A 74 24.302 3.795 -27.082 1.00 23.16 A O HETATM 558 N ASP A 75 24.245 3.803 -24.817 1.00 21.86 A N HETATM 559 CA ASP A 75 22.823 3.428 -24.699 1.00 21.22 A C HETATM 560 CB ASP A 75 22.446 3.246 -23.214 1.00 20.67 A C HETATM 561 CG ASP A 75 21.115 2.505 -23.005 1.00 19.98 A C HETATM 562 OD1 ASP A 75 20.182 2.635 -23.829 1.00 18.34 A O HETATM 563 OD2 ASP A 75 20.998 1.795 -21.987 1.00 19.91 A O HETATM 564 C ASP A 75 21.976 4.537 -25.336 1.00 20.55 A C HETATM 565 O ASP A 75 21.986 5.677 -24.872 1.00 21.33 A O HETATM 566 N SER A 76 21.262 4.179 -26.405 1.00 20.35 A N HETATM 567 CA SER A 76 20.418 5.110 -27.160 1.00 21.18 A C HETATM 568 CB SER A 76 20.056 4.505 -28.524 1.00 23.37 A C HETATM 569 OG SER A 76 19.254 3.344 -28.389 1.00 26.79 A O HETATM 570 C SER A 76 19.146 5.559 -26.439 1.00 19.91 A C HETATM 571 O SER A 76 18.463 6.482 -26.890 1.00 20.14 A O HETATM 572 N ARG A 77 18.842 4.902 -25.323 1.00 18.07 A N HETATM 573 CA ARG A 77 17.653 5.209 -24.535 1.00 17.81 A C HETATM 574 CB ARG A 77 17.109 3.930 -23.900 1.00 18.37 A C HETATM 575 CG ARG A 77 16.782 2.813 -24.893 1.00 19.06 A C HETATM 576 CD ARG A 77 16.569 1.483 -24.178 1.00 19.40 A C HETATM 577 NE ARG A 77 17.791 1.041 -23.509 1.00 18.53 A N HETATM 578 CZ ARG A 77 18.013 -0.189 -23.053 1.00 19.12 A C HETATM 579 NH1 ARG A 77 17.095 -1.144 -23.181 1.00 19.79 A N HETATM 580 NH2 ARG A 77 19.163 -0.466 -22.460 1.00 16.36 A N HETATM 581 C ARG A 77 17.935 6.267 -23.467 1.00 17.57 A C HETATM 582 O ARG A 77 17.007 6.880 -22.929 1.00 17.09 A O HETATM 583 N VAL A 78 19.220 6.473 -23.168 1.00 16.86 A N HETATM 584 CA VAL A 78 19.646 7.467 -22.184 1.00 16.78 A C HETATM 585 CB VAL A 78 20.988 7.075 -21.493 1.00 18.24 A C HETATM 586 CG1 VAL A 78 21.391 8.126 -20.474 1.00 16.34 A C HETATM 587 CG2 VAL A 78 20.852 5.732 -20.794 1.00 17.62 A C HETATM 588 C VAL A 78 19.778 8.822 -22.881 1.00 16.65 A C HETATM 589 O VAL A 78 20.694 9.044 -23.684 1.00 15.46 A O HETATM 590 N ILE A 79 18.844 9.712 -22.552 1.00 15.20 A N HETATM 591 CA ILE A 79 18.773 11.065 -23.108 1.00 16.64 A C HETATM 592 CB ILE A 79 17.366 11.680 -22.837 1.00 14.85 A C HETATM 593 CG2 ILE A 79 17.255 13.108 -23.415 1.00 14.58 A C HETATM 594 CG1 ILE A 79 16.298 10.760 -23.445 1.00 16.19 A C HETATM 595 CD1 ILE A 79 14.876 11.094 -23.081 1.00 14.58 A C HETATM 596 C ILE A 79 19.884 11.949 -22.537 1.00 15.33 A C HETATM 597 O ILE A 79 20.531 12.698 -23.274 1.00 16.78 A O HETATM 598 N ALA A 80 20.088 11.844 -21.226 1.00 14.79 A N HETATM 599 CA ALA A 80 21.110 12.605 -20.512 1.00 14.39 A C HETATM 600 CB ALA A 80 20.609 13.990 -20.194 1.00 13.37 A C HETATM 601 C ALA A 80 21.464 11.891 -19.222 1.00 15.17 A C HETATM 602 O ALA A 80 20.604 11.245 -18.612 1.00 14.84 A O HETATM 603 N HIS A 81 22.724 12.030 -18.803 1.00 14.09 A N HETATM 604 CA HIS A 81 23.205 11.411 -17.572 1.00 14.26 A C HETATM 605 CB HIS A 81 23.498 9.916 -17.795 1.00 15.38 A C HETATM 606 CG HIS A 81 24.692 9.645 -18.662 1.00 15.45 A C HETATM 607 CD2 HIS A 81 24.814 9.511 -20.004 1.00 14.83 A C HETATM 608 ND1 HIS A 81 25.956 9.468 -18.142 1.00 16.42 A N HETATM 609 CE1 HIS A 81 26.805 9.233 -19.127 1.00 16.66 A C HETATM 610 NE2 HIS A 81 26.137 9.254 -20.266 1.00 15.36 A N HETATM 611 C HIS A 81 24.435 12.058 -16.943 1.00 15.36 A C HETATM 612 O HIS A 81 25.282 12.620 -17.645 1.00 14.48 A O HETATM 613 N THR A 82 24.536 11.938 -15.618 1.00 14.47 A N HETATM 614 CA THR A 82 25.697 12.427 -14.876 1.00 16.17 A C HETATM 615 CB THR A 82 25.336 12.952 -13.450 1.00 15.08 A C HETATM 616 OG1 THR A 82 24.843 11.878 -12.641 1.00 16.76 A O HETATM 617 CG2 THR A 82 24.331 14.072 -13.497 1.00 15.42 A C HETATM 618 C THR A 82 26.586 11.194 -14.682 1.00 16.50 A C HETATM 619 O THR A 82 26.230 10.093 -15.114 1.00 16.14 A O HETATM 620 N LYS A 83 27.734 11.381 -14.033 1.00 18.24 A N HETATM 621 CA LYS A 83 28.632 10.271 -13.715 1.00 18.22 A C HETATM 622 CB LYS A 83 30.084 10.748 -13.604 1.00 21.47 A C HETATM 623 CG LYS A 83 30.686 11.230 -14.906 1.00 25.94 A C HETATM 624 CD LYS A 83 32.124 11.687 -14.707 1.00 30.91 A C HETATM 625 CE LYS A 83 32.806 11.961 -16.042 1.00 33.54 A C HETATM 626 NZ LYS A 83 32.874 10.737 -16.900 1.00 34.59 A N HETATM 627 C LYS A 83 28.165 9.757 -12.352 1.00 19.07 A C HETATM 628 O LYS A 83 27.280 10.356 -11.724 1.00 16.77 A O HETATM 629 N LEU A 84 28.747 8.648 -11.902 1.00 17.91 A N HETATM 630 CA LEU A 84 28.401 8.075 -10.606 1.00 17.98 A C HETATM 631 CB LEU A 84 28.696 6.575 -10.596 1.00 18.17 A C HETATM 632 CG LEU A 84 27.962 5.683 -9.598 1.00 18.76 A C HETATM 633 CD1 LEU A 84 26.516 5.455 -10.014 1.00 18.47 A C HETATM 634 CD2 LEU A 84 28.671 4.367 -9.511 1.00 18.42 A C HETATM 635 C LEU A 84 29.259 8.794 -9.573 1.00 17.57 A C HETATM 636 O LEU A 84 30.472 8.940 -9.771 1.00 18.03 A O HETATM 637 N ILE A 85 28.616 9.330 -8.535 1.00 15.59 A N HETATM 638 CA ILE A 85 29.331 10.053 -7.488 1.00 15.47 A C HETATM 639 CB ILE A 85 29.002 11.586 -7.472 1.00 16.68 A C HETATM 640 CG2 ILE A 85 29.527 12.254 -8.740 1.00 16.80 A C HETATM 641 CG1 ILE A 85 27.508 11.845 -7.233 1.00 14.52 A C HETATM 642 CD1 ILE A 85 27.179 13.274 -6.864 1.00 14.27 A C HETATM 643 C ILE A 85 29.167 9.515 -6.074 1.00 16.38 A C HETATM 644 O ILE A 85 28.074 9.106 -5.665 1.00 15.66 A O HETATM 645 N GLY A 86 30.277 9.537 -5.339 1.00 16.31 A N HETATM 646 CA GLY A 86 30.292 9.119 -3.947 1.00 17.15 A C HETATM 647 C GLY A 86 30.038 10.342 -3.092 1.00 18.08 A C HETATM 648 O GLY A 86 29.816 11.427 -3.631 1.00 17.79 A O HETATM 649 N SER A 87 30.054 10.185 -1.769 1.00 18.48 A N HETATM 650 CA SER A 87 29.817 11.313 -0.872 1.00 17.25 A C HETATM 651 CB SER A 87 29.632 10.838 0.557 1.00 17.46 A C HETATM 652 OG SER A 87 30.790 10.169 1.022 1.00 17.54 A O HETATM 653 C SER A 87 30.894 12.383 -0.942 1.00 17.37 A C HETATM 654 O SER A 87 32.081 12.071 -1.087 1.00 19.55 A O HETATM 655 N GLY A 88 30.451 13.640 -0.901 1.00 17.65 A N HETATM 656 CA GLY A 88 31.358 14.776 -0.966 1.00 18.21 A C HETATM 657 C GLY A 88 31.731 15.183 -2.382 1.00 18.88 A C HETATM 658 O GLY A 88 32.380 16.214 -2.572 1.00 20.33 A O HETATM 659 N GLU A 89 31.326 14.371 -3.364 1.00 17.58 A N HETATM 660 CA GLU A 89 31.607 14.617 -4.781 1.00 17.97 A C HETATM 661 CB GLU A 89 31.949 13.310 -5.506 1.00 20.58 A C HETATM 662 CG GLU A 89 33.109 12.503 -4.934 1.00 22.06 A C HETATM 663 CD GLU A 89 33.521 11.338 -5.836 1.00 25.38 A C HETATM 664 OE1 GLU A 89 32.636 10.638 -6.382 1.00 23.13 A O HETATM 665 OE2 GLU A 89 34.741 11.125 -6.007 1.00 28.17 A O HETATM 666 C GLU A 89 30.423 15.284 -5.490 1.00 18.14 A C HETATM 667 O GLU A 89 29.289 15.239 -5.003 1.00 17.68 A O HETATM 668 N LYS A 90 30.707 15.931 -6.623 1.00 16.76 A N HETATM 669 CA LYS A 90 29.693 16.626 -7.422 1.00 17.31 A C HETATM 670 CB LYS A 90 29.725 18.151 -7.171 1.00 19.38 A C HETATM 671 CG LYS A 90 29.360 18.619 -5.752 1.00 24.53 A C HETATM 672 CD LYS A 90 28.900 20.081 -5.683 1.00 29.06 A C HETATM 673 CE LYS A 90 30.041 21.079 -5.776 1.00 31.79 A C HETATM 674 NZ LYS A 90 29.557 22.477 -5.549 1.00 33.15 A N HETATM 675 C LYS A 90 29.899 16.371 -8.916 1.00 15.88 A C HETATM 676 O LYS A 90 31.017 16.093 -9.359 1.00 16.85 A O HETATM 677 N ASP A 91 28.803 16.399 -9.673 1.00 16.39 A N HETATM 678 CA ASP A 91 28.845 16.228 -11.127 1.00 15.47 A C HETATM 679 CB ASP A 91 28.872 14.751 -11.541 1.00 16.95 A C HETATM 680 CG ASP A 91 29.339 14.561 -12.977 1.00 20.30 A C HETATM 681 OD1 ASP A 91 30.467 14.983 -13.296 1.00 22.54 A O HETATM 682 OD2 ASP A 91 28.576 14.018 -13.792 1.00 20.97 A O HETATM 683 C ASP A 91 27.643 16.911 -11.759 1.00 15.35 A C HETATM 684 O ASP A 91 26.538 16.875 -11.213 1.00 15.11 A O HETATM 685 N SER A 92 27.878 17.522 -12.917 1.00 14.81 A N HETATM 686 CA SER A 92 26.841 18.226 -13.660 1.00 15.46 A C HETATM 687 CB SER A 92 27.162 19.719 -13.749 1.00 15.40 A C HETATM 688 OG SER A 92 27.439 20.288 -12.484 1.00 17.85 A O HETATM 689 C SER A 92 26.720 17.700 -15.079 1.00 14.83 A C HETATM 690 O SER A 92 27.682 17.167 -15.637 1.00 15.95 A O HETATM 691 N VAL A 93 25.520 17.840 -15.641 1.00 15.81 A N HETATM 692 CA VAL A 93 25.248 17.460 -17.022 1.00 14.32 A C HETATM 693 CB VAL A 93 24.668 16.007 -17.169 1.00 14.65 A C HETATM 694 CG1 VAL A 93 23.291 15.859 -16.497 1.00 14.53 A C HETATM 695 CG2 VAL A 93 24.593 15.607 -18.650 1.00 17.36 A C HETATM 696 C VAL A 93 24.292 18.486 -17.623 1.00 15.42 A C HETATM 697 O VAL A 93 23.382 18.971 -16.954 1.00 13.35 A O HETATM 698 N THR A 94 24.566 18.861 -18.865 1.00 16.33 A N HETATM 699 CA THR A 94 23.717 19.792 -19.588 1.00 16.96 A C HETATM 700 CB THR A 94 24.443 21.130 -19.884 1.00 15.89 A C HETATM 701 OG1 THR A 94 24.839 21.733 -18.647 1.00 16.85 A O HETATM 702 CG2 THR A 94 23.521 22.108 -20.617 1.00 13.90 A C HETATM 703 C THR A 94 23.301 19.102 -20.883 1.00 16.55 A C HETATM 704 O THR A 94 24.107 18.423 -21.522 1.00 17.68 A O HETATM 705 N PHE A 95 22.020 19.220 -21.216 1.00 16.98 A N HETATM 706 CA PHE A 95 21.490 18.635 -22.445 1.00 16.88 A C HETATM 707 CB PHE A 95 20.754 17.304 -22.177 1.00 16.15 A C HETATM 708 CG PHE A 95 19.542 17.415 -21.272 1.00 13.63 A C HETATM 709 CD1 PHE A 95 19.692 17.469 -19.872 1.00 15.12 A C HETATM 710 CD2 PHE A 95 18.238 17.417 -21.814 1.00 14.10 A C HETATM 711 CE1 PHE A 95 18.559 17.521 -19.014 1.00 15.74 A C HETATM 712 CE2 PHE A 95 17.096 17.472 -20.971 1.00 13.63 A C HETATM 713 CZ PHE A 95 17.257 17.523 -19.569 1.00 13.81 A C HETATM 714 C PHE A 95 20.585 19.635 -23.140 1.00 16.95 A C HETATM 715 O PHE A 95 20.048 20.540 -22.496 1.00 16.70 A O HETATM 716 N ASP A 96 20.400 19.443 -24.445 1.00 18.68 A N HETATM 717 CA ASP A 96 19.549 20.309 -25.256 1.00 18.96 A C HETATM 718 CB ASP A 96 19.918 20.184 -26.742 1.00 20.49 A C HETATM 719 CG ASP A 96 21.329 20.681 -27.054 1.00 23.86 A C HETATM 720 OD1 ASP A 96 21.853 21.559 -26.330 1.00 21.92 A O HETATM 721 OD2 ASP A 96 21.911 20.196 -28.049 1.00 25.18 A O HETATM 722 C ASP A 96 18.082 19.944 -25.055 1.00 19.43 A C HETATM 723 O ASP A 96 17.712 18.772 -25.151 1.00 20.32 A O HETATM 724 N VAL A 97 17.256 20.956 -24.783 1.00 18.76 A N HETATM 725 CA VAL A 97 15.814 20.787 -24.557 1.00 19.49 A C HETATM 726 CB VAL A 97 15.205 22.097 -23.965 1.00 18.52 A C HETATM 727 CG1 VAL A 97 13.692 22.041 -23.839 1.00 20.25 A C HETATM 728 CG2 VAL A 97 15.782 22.342 -22.588 1.00 17.96 A C HETATM 729 C VAL A 97 15.071 20.300 -25.818 1.00 20.31 A C HETATM 730 O VAL A 97 13.963 19.751 -25.728 1.00 20.71 A O HETATM 731 N SER A 98 15.736 20.416 -26.970 1.00 20.48 A N HETATM 732 CA SER A 98 15.195 19.963 -28.256 1.00 21.17 A C HETATM 733 CB SER A 98 16.094 20.424 -29.405 1.00 20.00 A C HETATM 734 OG SER A 98 17.416 19.935 -29.265 1.00 22.96 A O HETATM 735 C SER A 98 15.035 18.432 -28.286 1.00 21.28 A C HETATM 736 O SER A 98 14.326 17.893 -29.135 1.00 19.60 A O HETATM 737 N LYS A 99 15.688 17.755 -27.337 1.00 20.02 A N HETATM 738 CA LYS A 99 15.622 16.296 -27.201 1.00 19.70 A C HETATM 739 CB LYS A 99 16.890 15.756 -26.525 1.00 19.02 A C HETATM 740 CG LYS A 99 18.152 15.889 -27.363 1.00 17.65 A C HETATM 741 CD LYS A 99 19.361 15.307 -26.649 1.00 19.32 A C HETATM 742 CE LYS A 99 20.585 15.327 -27.550 1.00 19.92 A C HETATM 743 NZ LYS A 99 21.800 14.781 -26.881 1.00 20.17 A N HETATM 744 C LYS A 99 14.379 15.853 -26.413 1.00 18.03 A C HETATM 745 O LYS A 99 14.116 14.654 -26.284 1.00 19.53 A O HETATM 746 N LEU A 100 13.632 16.823 -25.881 1.00 17.44 A N HETATM 747 CA LEU A 100 12.412 16.551 -25.115 1.00 18.51 A C HETATM 748 CB LEU A 100 12.415 17.304 -23.777 1.00 18.39 A C HETATM 749 CG LEU A 100 13.555 17.106 -22.771 1.00 16.66 A C HETATM 750 CD1 LEU A 100 13.316 18.014 -21.573 1.00 18.45 A C HETATM 751 CD2 LEU A 100 13.671 15.651 -22.332 1.00 19.07 A C HETATM 752 C LEU A 100 11.146 16.919 -25.889 1.00 21.26 A C HETATM 753 O LEU A 100 11.115 17.915 -26.615 1.00 21.14 A O HETATM 754 N LYS A 101 10.111 16.098 -25.715 1.00 23.67 A N HETATM 755 CA LYS A 101 8.809 16.288 -26.351 1.00 26.62 A C HETATM 756 CB LYS A 101 8.253 14.938 -26.829 1.00 28.81 A C HETATM 757 CG LYS A 101 7.006 15.002 -27.704 1.00 32.12 A C HETATM 758 CD LYS A 101 6.727 13.663 -28.386 1.00 35.41 A C HETATM 759 CE LYS A 101 5.717 12.808 -27.629 1.00 37.38 A C HETATM 760 NZ LYS A 101 4.343 13.387 -27.667 1.00 39.76 A N HETATM 761 C LYS A 101 7.875 16.889 -25.310 1.00 27.72 A C HETATM 762 O LYS A 101 7.808 16.403 -24.179 1.00 25.46 A O HETATM 763 N GLU A 102 7.151 17.935 -25.708 1.00 30.39 A N HETATM 764 CA GLU A 102 6.192 18.620 -24.839 1.00 32.36 A C HETATM 765 CB GLU A 102 5.668 19.881 -25.537 1.00 34.29 A C HETATM 766 CG GLU A 102 4.945 20.870 -24.626 1.00 35.93 A C HETATM 767 CD GLU A 102 4.481 22.104 -25.370 1.00 37.58 A C HETATM 768 OE1 GLU A 102 5.340 22.934 -25.738 1.00 39.04 A O HETATM 769 OE2 GLU A 102 3.259 22.239 -25.593 1.00 39.58 A O HETATM 770 C GLU A 102 5.027 17.688 -24.495 1.00 32.82 A C HETATM 771 O GLU A 102 4.508 16.984 -25.366 1.00 32.34 A O HETATM 772 N GLY A 103 4.685 17.635 -23.208 1.00 33.94 A N HETATM 773 CA GLY A 103 3.591 16.792 -22.752 1.00 34.13 A C HETATM 774 C GLY A 103 3.994 15.393 -22.322 1.00 34.15 A C HETATM 775 O GLY A 103 3.291 14.774 -21.516 1.00 35.29 A O HETATM 776 N GLU A 104 5.108 14.891 -22.864 1.00 32.63 A N HETATM 777 CA GLU A 104 5.612 13.557 -22.532 1.00 30.97 A C HETATM 778 CB GLU A 104 6.581 13.042 -23.614 1.00 32.39 A C HETATM 779 CG GLU A 104 7.021 11.570 -23.433 1.00 33.30 A C HETATM 780 CD GLU A 104 7.907 11.024 -24.558 1.00 35.24 A C HETATM 781 OE1 GLU A 104 8.080 9.788 -24.615 1.00 36.52 A O HETATM 782 OE2 GLU A 104 8.447 11.805 -25.372 1.00 34.37 A O HETATM 783 C GLU A 104 6.298 13.582 -21.167 1.00 28.82 A C HETATM 784 O GLU A 104 7.157 14.430 -20.901 1.00 28.15 A O HETATM 785 N GLN A 105 5.867 12.677 -20.295 1.00 27.58 A N HETATM 786 CA GLN A 105 6.427 12.572 -18.956 1.00 25.07 A C HETATM 787 CB GLN A 105 5.340 12.193 -17.948 1.00 26.30 A C HETATM 788 CG GLN A 105 5.773 12.350 -16.506 1.00 27.39 A C HETATM 789 CD GLN A 105 4.662 12.062 -15.525 1.00 28.62 A C HETATM 790 OE1 GLN A 105 4.320 10.904 -15.278 1.00 31.25 A O HETATM 791 NE2 GLN A 105 4.110 13.116 -14.934 1.00 29.56 A N HETATM 792 C GLN A 105 7.572 11.560 -18.946 1.00 22.93 A C HETATM 793 O GLN A 105 7.376 10.364 -19.171 1.00 22.87 A O HETATM 794 N TYR A 106 8.772 12.078 -18.704 1.00 19.98 A N HETATM 795 CA TYR A 106 9.991 11.281 -18.653 1.00 16.59 A C HETATM 796 CB TYR A 106 11.172 12.116 -19.163 1.00 16.47 A C HETATM 797 CG TYR A 106 11.043 12.524 -20.611 1.00 17.10 A C HETATM 798 CD1 TYR A 106 11.502 11.679 -21.635 1.00 17.97 A C HETATM 799 CE1 TYR A 106 11.335 12.022 -23.003 1.00 17.82 A C HETATM 800 CD2 TYR A 106 10.417 13.734 -20.973 1.00 19.43 A C HETATM 801 CE2 TYR A 106 10.242 14.087 -22.343 1.00 18.49 A C HETATM 802 CZ TYR A 106 10.705 13.221 -23.341 1.00 18.49 A C HETATM 803 OH TYR A 106 10.530 13.528 -24.671 1.00 17.76 A O HETATM 804 C TYR A 106 10.275 10.824 -17.232 1.00 15.17 A C HETATM 805 O TYR A 106 9.613 11.256 -16.287 1.00 14.20 A O HETATM 806 N MET A 107 11.221 9.899 -17.101 1.00 14.10 A N HETATM 807 CA MET A 107 11.628 9.385 -15.802 1.00 12.94 A C HETATM 808 CB MET A 107 11.397 7.870 -15.702 1.00 13.97 A C HETATM 809 CG MET A 107 9.946 7.438 -15.552 1.00 13.52 A C HETATM 810 SD MET A 107 9.181 7.978 -14.045 1.00 18.89 A S HETATM 811 CE MET A 107 10.171 7.040 -12.854 1.00 16.56 A C HETATM 812 C MET A 107 13.100 9.649 -15.551 1.00 11.18 A C HETATM 813 O MET A 107 13.926 9.494 -16.459 1.00 12.04 A O HETATM 814 N PHE A 108 13.409 10.147 -14.354 1.00 10.89 A N HETATM 815 CA PHE A 108 14.795 10.339 -13.957 1.00 9.47 A C HETATM 816 CB PHE A 108 15.163 11.792 -13.596 1.00 11.13 A C HETATM 817 CG PHE A 108 14.603 12.298 -12.290 1.00 13.36 A C HETATM 818 CD1 PHE A 108 15.287 12.080 -11.069 1.00 12.65 A C HETATM 819 CD2 PHE A 108 13.433 13.070 -12.279 1.00 13.27 A C HETATM 820 CE1 PHE A 108 14.810 12.628 -9.858 1.00 12.97 A C HETATM 821 CE2 PHE A 108 12.945 13.629 -11.071 1.00 12.89 A C HETATM 822 CZ PHE A 108 13.636 13.406 -9.862 1.00 14.69 A C HETATM 823 C PHE A 108 15.019 9.341 -12.829 1.00 9.12 A C HETATM 824 O PHE A 108 14.094 9.053 -12.070 1.00 7.81 A O HETATM 825 N PHE A 109 16.227 8.782 -12.767 1.00 10.95 A N HETATM 826 CA PHE A 109 16.563 7.754 -11.783 1.00 11.13 A C HETATM 827 CB PHE A 109 15.913 6.407 -12.197 1.00 12.29 A C HETATM 828 CG PHE A 109 16.128 6.038 -13.659 1.00 13.58 A C HETATM 829 CD1 PHE A 109 15.311 6.591 -14.665 1.00 14.73 A C HETATM 830 CD2 PHE A 109 17.180 5.192 -14.042 1.00 12.49 A C HETATM 831 CE1 PHE A 109 15.541 6.322 -16.034 1.00 15.35 A C HETATM 832 CE2 PHE A 109 17.423 4.909 -15.410 1.00 15.56 A C HETATM 833 CZ PHE A 109 16.600 5.480 -16.407 1.00 17.00 A C HETATM 834 C PHE A 109 18.058 7.522 -11.599 1.00 10.82 A C HETATM 835 O PHE A 109 18.876 7.986 -12.397 1.00 11.24 A O HETATM 836 N CYS A 110 18.383 6.750 -10.564 1.00 10.23 A N HETATM 837 CA CYS A 110 19.755 6.344 -10.274 1.00 10.55 A C HETATM 838 CB CYS A 110 20.092 6.500 -8.790 1.00 11.17 A C HETATM 839 SG CYS A 110 21.736 5.881 -8.338 1.00 12.10 A S HETATM 840 C CYS A 110 19.829 4.874 -10.671 1.00 11.48 A C HETATM 841 O CYS A 110 18.901 4.114 -10.389 1.00 11.49 A O HETATM 842 N THR A 111 20.922 4.474 -11.321 1.00 11.14 A N HETATM 843 CA THR A 111 21.065 3.090 -11.766 1.00 11.00 A C HETATM 844 CB THR A 111 21.541 2.987 -13.219 1.00 12.24 A C HETATM 845 OG1 THR A 111 22.801 3.653 -13.356 1.00 12.59 A O HETATM 846 CG2 THR A 111 20.536 3.568 -14.167 1.00 12.53 A C HETATM 847 C THR A 111 21.952 2.192 -10.920 1.00 12.50 A C HETATM 848 O THR A 111 22.302 1.091 -11.363 1.00 12.52 A O HETATM 849 N PHE A 112 22.322 2.651 -9.720 1.00 10.36 A N HETATM 850 CA PHE A 112 23.133 1.842 -8.801 1.00 11.54 A C HETATM 851 CB PHE A 112 23.501 2.638 -7.527 1.00 11.16 A C HETATM 852 CG PHE A 112 24.521 1.946 -6.646 1.00 13.57 A C HETATM 853 CD1 PHE A 112 24.128 0.932 -5.740 1.00 13.57 A C HETATM 854 CD2 PHE A 112 25.891 2.230 -6.785 1.00 13.05 A C HETATM 855 CE1 PHE A 112 25.077 0.196 -4.992 1.00 15.38 A C HETATM 856 CE2 PHE A 112 26.858 1.507 -6.042 1.00 14.39 A C HETATM 857 CZ PHE A 112 26.443 0.481 -5.146 1.00 15.07 A C HETATM 858 C PHE A 112 22.252 0.628 -8.435 1.00 11.15 A C HETATM 859 O PHE A 112 21.055 0.791 -8.201 1.00 10.90 A O HETATM 860 N PRO A 113 22.828 -0.596 -8.413 1.00 11.93 A N HETATM 861 CD PRO A 113 24.198 -0.940 -8.835 1.00 13.12 A C HETATM 862 CA PRO A 113 22.107 -1.828 -8.085 1.00 13.01 A C HETATM 863 CB PRO A 113 23.238 -2.819 -7.893 1.00 13.26 A C HETATM 864 CG PRO A 113 24.159 -2.437 -8.944 1.00 13.31 A C HETATM 865 C PRO A 113 21.202 -1.775 -6.862 1.00 13.27 A C HETATM 866 O PRO A 113 21.639 -1.395 -5.766 1.00 15.34 A O HETATM 867 N GLY A 114 19.919 -2.046 -7.109 1.00 14.17 A N HETATM 868 CA GLY A 114 18.905 -2.071 -6.064 1.00 15.44 A C HETATM 869 C GLY A 114 18.459 -0.750 -5.470 1.00 14.65 A C HETATM 870 O GLY A 114 17.689 -0.737 -4.506 1.00 14.47 A O HETATM 871 N HIS A 115 18.940 0.357 -6.035 1.00 14.05 A N HETATM 872 CA HIS A 115 18.607 1.690 -5.535 1.00 12.91 A C HETATM 873 CB HIS A 115 19.881 2.546 -5.388 1.00 15.47 A C HETATM 874 CG HIS A 115 20.830 2.080 -4.319 1.00 14.07 A C HETATM 875 CD2 HIS A 115 20.850 0.963 -3.552 1.00 13.42 A C HETATM 876 ND1 HIS A 115 21.924 2.823 -3.933 1.00 12.27 A N HETATM 877 CE1 HIS A 115 22.572 2.189 -2.973 1.00 11.17 A C HETATM 878 NE2 HIS A 115 21.942 1.056 -2.725 1.00 12.25 A N HETATM 879 C HIS A 115 17.588 2.459 -6.373 1.00 13.22 A C HETATM 880 O HIS A 115 16.992 3.415 -5.873 1.00 14.59 A O HETATM 881 N SER A 116 17.356 2.025 -7.618 1.00 13.73 A N HETATM 882 CA SER A 116 16.425 2.710 -8.533 1.00 12.69 A C HETATM 883 CB SER A 116 16.423 2.057 -9.926 1.00 14.34 A C HETATM 884 OG SER A 116 15.830 0.772 -9.915 1.00 15.97 A O HETATM 885 C SER A 116 14.988 2.886 -8.041 1.00 13.04 A C HETATM 886 O SER A 116 14.369 3.905 -8.323 1.00 11.60 A O HETATM 887 N ALA A 117 14.489 1.917 -7.269 1.00 13.76 A N HETATM 888 CA ALA A 117 13.128 1.971 -6.727 1.00 14.20 A C HETATM 889 CB ALA A 117 12.767 0.642 -6.077 1.00 14.33 A C HETATM 890 C ALA A 117 12.949 3.112 -5.722 1.00 14.42 A C HETATM 891 O ALA A 117 11.891 3.740 -5.657 1.00 14.57 A O HETATM 892 N LEU A 118 14.013 3.399 -4.978 1.00 12.40 A N HETATM 893 CA LEU A 118 14.000 4.454 -3.970 1.00 13.95 A C HETATM 894 CB LEU A 118 14.910 4.070 -2.792 1.00 15.86 A C HETATM 895 CG LEU A 118 14.558 2.859 -1.916 1.00 18.76 A C HETATM 896 CD1 LEU A 118 14.840 1.549 -2.636 1.00 23.06 A C HETATM 897 CD2 LEU A 118 15.374 2.920 -0.642 1.00 20.10 A C HETATM 898 C LEU A 118 14.455 5.791 -4.539 1.00 13.29 A C HETATM 899 O LEU A 118 14.180 6.849 -3.966 1.00 14.46 A O HETATM 900 N MET A 119 15.177 5.730 -5.658 1.00 13.03 A N HETATM 901 CA MET A 119 15.726 6.917 -6.302 1.00 11.91 A C HETATM 902 CB MET A 119 17.255 6.833 -6.316 1.00 11.57 A C HETATM 903 CG MET A 119 17.873 6.576 -4.966 1.00 12.10 A C HETATM 904 SD MET A 119 19.641 6.749 -4.880 1.00 12.00 A S HETATM 905 CE MET A 119 19.737 8.515 -4.920 1.00 11.24 A C HETATM 906 C MET A 119 15.203 7.129 -7.715 1.00 12.70 A C HETATM 907 O MET A 119 15.866 6.780 -8.698 1.00 13.61 A O HETATM 908 N LYS A 120 13.989 7.664 -7.801 1.00 11.62 A N HETATM 909 CA LYS A 120 13.338 7.940 -9.082 1.00 12.95 A C HETATM 910 CB LYS A 120 12.693 6.676 -9.684 1.00 12.93 A C HETATM 911 CG LYS A 120 11.749 5.901 -8.760 1.00 14.91 A C HETATM 912 CD LYS A 120 11.059 4.778 -9.522 1.00 15.59 A C HETATM 913 CE LYS A 120 10.106 3.991 -8.644 1.00 19.44 A C HETATM 914 NZ LYS A 120 9.032 4.832 -8.060 1.00 21.96 A N HETATM 915 C LYS A 120 12.309 9.048 -8.990 1.00 11.61 A C HETATM 916 O LYS A 120 11.861 9.407 -7.897 1.00 10.73 A O HETATM 917 N GLY A 121 11.939 9.572 -10.156 1.00 12.03 A N HETATM 918 CA GLY A 121 10.949 10.628 -10.237 1.00 12.03 A C HETATM 919 C GLY A 121 10.587 10.970 -11.667 1.00 12.00 A C HETATM 920 O GLY A 121 11.061 10.326 -12.603 1.00 11.28 A O HETATM 921 N THR A 122 9.827 12.052 -11.826 1.00 12.15 A N HETATM 922 CA THR A 122 9.349 12.515 -13.126 1.00 13.87 A C HETATM 923 CB THR A 122 7.811 12.716 -13.093 1.00 13.71 A C HETATM 924 OG1 THR A 122 7.470 13.701 -12.107 1.00 14.55 A O HETATM 925 CG2 THR A 122 7.098 11.403 -12.759 1.00 16.64 A C HETATM 926 C THR A 122 9.977 13.824 -13.617 1.00 14.70 A C HETATM 927 O THR A 122 10.398 14.659 -12.816 1.00 15.20 A O HETATM 928 N LEU A 123 10.034 13.982 -14.939 1.00 13.83 A N HETATM 929 CA LEU A 123 10.552 15.188 -15.590 1.00 15.49 A C HETATM 930 CB LEU A 123 12.016 15.012 -16.041 1.00 14.77 A C HETATM 931 CG LEU A 123 12.720 16.184 -16.757 1.00 15.39 A C HETATM 932 CD1 LEU A 123 14.169 16.260 -16.333 1.00 17.16 A C HETATM 933 CD2 LEU A 123 12.639 16.067 -18.284 1.00 14.85 A C HETATM 934 C LEU A 123 9.648 15.484 -16.786 1.00 17.66 A C HETATM 935 O LEU A 123 9.400 14.603 -17.612 1.00 19.32 A O HETATM 936 N THR A 124 9.184 16.730 -16.893 1.00 18.90 A N HETATM 937 CA THR A 124 8.309 17.129 -17.998 1.00 21.35 A C HETATM 938 CB THR A 124 6.805 17.042 -17.599 1.00 22.40 A C HETATM 939 OG1 THR A 124 6.557 15.803 -16.928 1.00 23.80 A O HETATM 940 CG2 THR A 124 5.903 17.100 -18.838 1.00 23.11 A C HETATM 941 C THR A 124 8.602 18.543 -18.479 1.00 21.56 A C HETATM 942 O THR A 124 8.902 19.429 -17.680 1.00 17.95 A O HETATM 943 N LEU A 125 8.506 18.726 -19.797 1.00 24.60 A N HETATM 944 CA LEU A 125 8.708 20.009 -20.463 1.00 28.06 A C HETATM 945 CB LEU A 125 9.290 19.778 -21.875 1.00 28.58 A C HETATM 946 CG LEU A 125 9.879 20.851 -22.816 1.00 30.21 A C HETATM 947 CD1 LEU A 125 8.870 21.336 -23.827 1.00 31.74 A C HETATM 948 CD2 LEU A 125 10.470 22.018 -22.058 1.00 30.65 A C HETATM 949 C LEU A 125 7.334 20.695 -20.509 1.00 30.07 A C HETATM 950 O LEU A 125 6.489 20.365 -21.349 1.00 32.15 A O HETATM 951 N LYS A 126 7.106 21.587 -19.543 1.00 31.70 A N HETATM 952 CA LYS A 126 5.849 22.335 -19.399 1.00 34.23 A C HETATM 953 CB LYS A 126 5.256 22.126 -17.998 1.00 36.47 A C HETATM 954 CG LYS A 126 4.725 20.732 -17.708 1.00 39.45 A C HETATM 955 CD LYS A 126 4.343 20.598 -16.243 1.00 41.09 A C HETATM 956 CE LYS A 126 3.748 19.231 -15.938 1.00 42.09 A C HETATM 957 NZ LYS A 126 3.534 19.036 -14.477 1.00 43.26 A N HETATM 958 C LYS A 126 6.045 23.830 -19.618 1.00 34.39 A C HETATM 959 O LYS A 126 5.088 24.482 -20.085 1.00 34.52 A O HETATM 960 OXT LYS A 126 7.141 24.339 -19.298 1.00 34.41 A O TER HETATM 961 CB GLU B 1 13.291 -27.425 -12.465 1.00 41.69 B C HETATM 962 CG GLU B 1 12.483 -26.498 -11.536 1.00 44.04 B C HETATM 963 CD GLU B 1 11.681 -27.247 -10.479 1.00 46.33 B C HETATM 964 OE1 GLU B 1 10.500 -27.563 -10.733 1.00 46.88 B O HETATM 965 OE2 GLU B 1 12.231 -27.506 -9.388 1.00 49.05 B O HETATM 966 C GLU B 1 11.892 -27.184 -14.552 1.00 36.34 B C HETATM 967 O GLU B 1 12.624 -26.466 -15.243 1.00 36.86 B O HETATM 968 N GLU B 1 13.342 -29.169 -14.238 1.00 39.74 B N HETATM 969 CA GLU B 1 12.481 -28.170 -13.542 1.00 38.68 B C HETATM 970 N CYS B 2 10.563 -27.175 -14.633 1.00 32.65 B N HETATM 971 CA CYS B 2 9.824 -26.298 -15.538 1.00 29.40 B C HETATM 972 C CYS B 2 8.713 -25.569 -14.782 1.00 27.65 B C HETATM 973 O CYS B 2 7.623 -25.328 -15.313 1.00 25.87 B O HETATM 974 CB CYS B 2 9.251 -27.106 -16.708 1.00 29.99 B C HETATM 975 SG CYS B 2 10.532 -27.916 -17.716 1.00 31.64 B S HETATM 976 N SER B 3 9.020 -25.206 -13.539 1.00 26.23 B N HETATM 977 CA SER B 3 8.096 -24.497 -12.662 1.00 24.37 B C HETATM 978 CB SER B 3 7.111 -25.467 -11.990 1.00 24.41 B C HETATM 979 OG SER B 3 7.774 -26.402 -11.160 1.00 26.94 B O HETATM 980 C SER B 3 8.829 -23.690 -11.599 1.00 22.54 B C HETATM 981 O SER B 3 9.996 -23.953 -11.295 1.00 22.20 B O HETATM 982 N VAL B 4 8.137 -22.689 -11.060 1.00 21.27 B N HETATM 983 CA VAL B 4 8.682 -21.835 -10.006 1.00 17.50 B C HETATM 984 CB VAL B 4 9.468 -20.599 -10.592 1.00 17.52 B C HETATM 985 CG1 VAL B 4 8.541 -19.623 -11.314 1.00 16.01 B C HETATM 986 CG2 VAL B 4 10.287 -19.905 -9.501 1.00 17.77 B C HETATM 987 C VAL B 4 7.540 -21.419 -9.075 1.00 17.43 B C HETATM 988 O VAL B 4 6.421 -21.166 -9.529 1.00 15.51 B O HETATM 989 N ASP B 5 7.813 -21.442 -7.772 1.00 15.67 B N HETATM 990 CA ASP B 5 6.827 -21.060 -6.767 1.00 17.07 B C HETATM 991 CB ASP B 5 6.866 -22.017 -5.565 1.00 17.93 B C HETATM 992 CG ASP B 5 6.615 -23.475 -5.954 1.00 22.73 B C HETATM 993 OD1 ASP B 5 5.813 -23.743 -6.875 1.00 24.33 B O HETATM 994 OD2 ASP B 5 7.228 -24.363 -5.327 1.00 25.06 B O HETATM 995 C ASP B 5 7.123 -19.626 -6.336 1.00 16.63 B C HETATM 996 O ASP B 5 8.168 -19.349 -5.741 1.00 17.34 B O HETATM 997 N ILE B 6 6.223 -18.715 -6.709 1.00 15.25 B N HETATM 998 CA ILE B 6 6.349 -17.292 -6.400 1.00 14.42 B C HETATM 999 CB ILE B 6 5.992 -16.390 -7.639 1.00 15.36 B C HETATM 1000 CG2 ILE B 6 6.327 -14.916 -7.364 1.00 12.79 B C HETATM 1001 CG1 ILE B 6 6.729 -16.855 -8.902 1.00 15.40 B C HETATM 1002 CD1 ILE B 6 8.219 -16.721 -8.871 1.00 19.07 B C HETATM 1003 C ILE B 6 5.449 -16.897 -5.229 1.00 14.44 B C HETATM 1004 O ILE B 6 4.289 -17.297 -5.156 1.00 13.11 B O HETATM 1005 N GLN B 7 6.010 -16.118 -4.309 1.00 14.54 B N HETATM 1006 CA GLN B 7 5.279 -15.622 -3.146 1.00 15.59 B C HETATM 1007 CB GLN B 7 5.946 -16.061 -1.831 1.00 17.21 B C HETATM 1008 CG GLN B 7 5.931 -17.561 -1.524 1.00 20.28 B C HETATM 1009 CD GLN B 7 6.500 -17.906 -0.140 1.00 23.03 B C HETATM 1010 OE1 GLN B 7 6.246 -18.989 0.390 1.00 23.35 B O HETATM 1011 NE2 GLN B 7 7.273 -16.991 0.441 1.00 22.11 B N HETATM 1012 C GLN B 7 5.281 -14.102 -3.188 1.00 15.13 B C HETATM 1013 O GLN B 7 6.274 -13.490 -3.571 1.00 14.49 B O HETATM 1014 N GLY B 8 4.145 -13.515 -2.835 1.00 15.35 B N HETATM 1015 CA GLY B 8 4.011 -12.072 -2.758 1.00 14.87 B C HETATM 1016 C GLY B 8 3.485 -11.866 -1.350 1.00 15.25 B C HETATM 1017 O GLY B 8 2.433 -12.413 -1.023 1.00 14.96 B O HETATM 1018 N ASN B 9 4.170 -11.071 -0.531 1.00 13.85 B N HETATM 1019 CA ASN B 9 3.749 -10.877 0.862 1.00 14.70 B C HETATM 1020 CB ASN B 9 4.942 -11.143 1.803 1.00 15.72 B C HETATM 1021 CG ASN B 9 6.128 -10.215 1.549 1.00 14.78 B C HETATM 1022 OD1 ASN B 9 5.974 -9.095 1.048 1.00 14.88 B O HETATM 1023 ND2 ASN B 9 7.319 -10.681 1.901 1.00 17.46 B N HETATM 1024 C ASN B 9 3.039 -9.570 1.241 1.00 15.01 B C HETATM 1025 O ASN B 9 2.665 -8.770 0.377 1.00 15.20 B O HETATM 1026 N ASP B 10 2.881 -9.366 2.553 1.00 14.43 B N HETATM 1027 CA ASP B 10 2.234 -8.181 3.124 1.00 15.29 B C HETATM 1028 CB ASP B 10 1.865 -8.441 4.592 1.00 16.60 B C HETATM 1029 CG ASP B 10 0.605 -9.284 4.753 1.00 19.24 B C HETATM 1030 OD1 ASP B 10 -0.072 -9.605 3.748 1.00 18.50 B O HETATM 1031 OD2 ASP B 10 0.259 -9.600 5.912 1.00 21.01 B O HETATM 1032 C ASP B 10 3.098 -6.925 3.038 1.00 14.41 B C HETATM 1033 O ASP B 10 2.602 -5.804 3.217 1.00 14.34 B O HETATM 1034 N GLN B 11 4.385 -7.129 2.759 1.00 13.81 B N HETATM 1035 CA GLN B 11 5.363 -6.047 2.659 1.00 15.50 B C HETATM 1036 CB GLN B 11 6.646 -6.416 3.412 1.00 20.03 B C HETATM 1037 CG GLN B 11 6.502 -6.398 4.932 1.00 27.21 B C HETATM 1038 CD GLN B 11 7.761 -5.918 5.633 1.00 31.32 B C HETATM 1039 OE1 GLN B 11 8.164 -4.763 5.484 1.00 36.55 B O HETATM 1040 NE2 GLN B 11 8.382 -6.798 6.409 1.00 34.24 B N HETATM 1041 C GLN B 11 5.673 -5.602 1.227 1.00 14.77 B C HETATM 1042 O GLN B 11 6.723 -4.996 0.961 1.00 13.68 B O HETATM 1043 N MET B 12 4.733 -5.884 0.319 1.00 12.47 B N HETATM 1044 CA MET B 12 4.810 -5.500 -1.097 1.00 13.08 B C HETATM 1045 CB MET B 12 4.642 -3.969 -1.222 1.00 12.31 B C HETATM 1046 CG MET B 12 4.203 -3.485 -2.580 1.00 13.68 B C HETATM 1047 SD MET B 12 3.936 -1.707 -2.706 1.00 14.76 B S HETATM 1048 CE MET B 12 5.572 -1.156 -3.075 1.00 12.83 B C HETATM 1049 C MET B 12 6.085 -5.995 -1.810 1.00 12.14 B C HETATM 1050 O MET B 12 6.736 -5.254 -2.555 1.00 12.55 B O HETATM 1051 N GLN B 13 6.442 -7.252 -1.574 1.00 12.03 B N HETATM 1052 CA GLN B 13 7.637 -7.836 -2.187 1.00 12.16 B C HETATM 1053 CB GLN B 13 8.827 -7.817 -1.208 1.00 12.48 B C HETATM 1054 CG GLN B 13 9.515 -6.464 -1.032 1.00 17.04 B C HETATM 1055 CD GLN B 13 10.685 -6.500 -0.063 1.00 18.39 B C HETATM 1056 OE1 GLN B 13 10.778 -5.672 0.845 1.00 22.42 B O HETATM 1057 NE2 GLN B 13 11.597 -7.442 -0.267 1.00 18.74 B N HETATM 1058 C GLN B 13 7.432 -9.259 -2.673 1.00 12.16 B C HETATM 1059 O GLN B 13 6.650 -10.017 -2.089 1.00 12.80 B O HETATM 1060 N PHE B 14 8.099 -9.586 -3.784 1.00 10.45 B N HETATM 1061 CA PHE B 14 8.093 -10.933 -4.354 1.00 10.27 B C HETATM 1062 CB PHE B 14 8.347 -10.926 -5.871 1.00 8.84 B C HETATM 1063 CG PHE B 14 7.109 -10.775 -6.726 1.00 12.64 B C HETATM 1064 CD1 PHE B 14 5.924 -11.492 -6.451 1.00 11.45 B C HETATM 1065 CD2 PHE B 14 7.149 -9.956 -7.865 1.00 12.04 B C HETATM 1066 CE1 PHE B 14 4.787 -11.393 -7.311 1.00 12.31 B C HETATM 1067 CE2 PHE B 14 6.027 -9.843 -8.738 1.00 12.98 B C HETATM 1068 CZ PHE B 14 4.844 -10.562 -8.461 1.00 12.60 B C HETATM 1069 C PHE B 14 9.266 -11.658 -3.697 1.00 10.94 B C HETATM 1070 O PHE B 14 10.200 -11.012 -3.200 1.00 12.35 B O HETATM 1071 N ASN B 15 9.235 -12.991 -3.732 1.00 12.75 B N HETATM 1072 CA ASN B 15 10.305 -13.807 -3.157 1.00 13.10 B C HETATM 1073 CB ASN B 15 9.788 -15.205 -2.766 1.00 13.89 B C HETATM 1074 CG ASN B 15 9.365 -16.039 -3.958 1.00 15.15 B C HETATM 1075 OD1 ASN B 15 8.721 -15.544 -4.876 1.00 16.26 B O HETATM 1076 ND2 ASN B 15 9.735 -17.315 -3.947 1.00 19.36 B N HETATM 1077 C ASN B 15 11.539 -13.910 -4.065 1.00 13.69 B C HETATM 1078 O ASN B 15 12.606 -14.334 -3.631 1.00 15.40 B O HETATM 1079 N THR B 16 11.368 -13.551 -5.332 1.00 13.80 B N HETATM 1080 CA THR B 16 12.463 -13.567 -6.296 1.00 14.76 B C HETATM 1081 CB THR B 16 12.514 -14.896 -7.126 1.00 15.55 B C HETATM 1082 OG1 THR B 16 13.566 -14.822 -8.099 1.00 16.29 B O HETATM 1083 CG2 THR B 16 11.203 -15.156 -7.839 1.00 16.62 B C HETATM 1084 C THR B 16 12.352 -12.369 -7.228 1.00 15.37 B C HETATM 1085 O THR B 16 11.263 -11.838 -7.448 1.00 16.42 B O HETATM 1086 N ASN B 17 13.497 -11.927 -7.737 1.00 14.94 B N HETATM 1087 CA ASN B 17 13.542 -10.809 -8.664 1.00 14.06 B C HETATM 1088 CB ASN B 17 14.213 -9.587 -8.022 1.00 15.51 B C HETATM 1089 CG ASN B 17 13.442 -9.054 -6.822 1.00 15.60 B C HETATM 1090 OD1 ASN B 17 12.356 -8.478 -6.958 1.00 19.48 B O HETATM 1091 ND2 ASN B 17 13.980 -9.284 -5.638 1.00 13.44 B N HETATM 1092 C ASN B 17 14.243 -11.220 -9.965 1.00 13.69 B C HETATM 1093 O ASN B 17 14.591 -10.367 -10.782 1.00 13.65 B O HETATM 1094 N ALA B 18 14.408 -12.533 -10.158 1.00 14.45 B N HETATM 1095 CA ALA B 18 15.049 -13.098 -11.353 1.00 15.95 B C HETATM 1096 CB ALA B 18 16.581 -12.948 -11.278 1.00 14.71 B C HETATM 1097 C ALA B 18 14.678 -14.566 -11.546 1.00 15.74 B C HETATM 1098 O ALA B 18 14.988 -15.407 -10.699 1.00 17.95 B O HETATM 1099 N ILE B 19 13.985 -14.852 -12.651 1.00 17.37 B N HETATM 1100 CA ILE B 19 13.555 -16.209 -13.012 1.00 18.32 B C HETATM 1101 CB ILE B 19 11.996 -16.294 -13.262 1.00 18.69 B C HETATM 1102 CG2 ILE B 19 11.593 -17.677 -13.808 1.00 20.48 B C HETATM 1103 CG1 ILE B 19 11.211 -16.039 -11.973 1.00 19.12 B C HETATM 1104 CD1 ILE B 19 9.699 -15.826 -12.198 1.00 18.72 B C HETATM 1105 C ILE B 19 14.262 -16.621 -14.303 1.00 19.55 B C HETATM 1106 O ILE B 19 14.360 -15.832 -15.243 1.00 19.74 B O HETATM 1107 N THR B 20 14.737 -17.864 -14.339 1.00 20.10 B N HETATM 1108 CA THR B 20 15.389 -18.419 -15.522 1.00 23.07 B C HETATM 1109 CB THR B 20 16.855 -18.847 -15.249 1.00 22.71 B C HETATM 1110 OG1 THR B 20 16.939 -19.551 -14.004 1.00 28.34 B O HETATM 1111 CG2 THR B 20 17.772 -17.638 -15.216 1.00 23.12 B C HETATM 1112 C THR B 20 14.573 -19.610 -16.021 1.00 22.98 B C HETATM 1113 O THR B 20 14.285 -20.537 -15.257 1.00 24.67 B O HETATM 1114 N VAL B 21 14.129 -19.531 -17.275 1.00 24.40 B N HETATM 1115 CA VAL B 21 13.343 -20.596 -17.911 1.00 26.21 B C HETATM 1116 CB VAL B 21 12.201 -20.010 -18.808 1.00 25.79 B C HETATM 1117 CG1 VAL B 21 11.369 -21.127 -19.455 1.00 24.55 B C HETATM 1118 CG2 VAL B 21 11.289 -19.112 -17.984 1.00 22.63 B C HETATM 1119 C VAL B 21 14.287 -21.451 -18.762 1.00 29.12 B C HETATM 1120 O VAL B 21 15.040 -20.919 -19.581 1.00 30.63 B O HETATM 1121 N ASP B 22 14.235 -22.770 -18.561 1.00 32.22 B N HETATM 1122 CA ASP B 22 15.075 -23.721 -19.296 1.00 35.08 B C HETATM 1123 CB ASP B 22 15.130 -25.063 -18.548 1.00 37.42 B C HETATM 1124 CG ASP B 22 16.370 -25.890 -18.892 1.00 40.01 B C HETATM 1125 OD1 ASP B 22 16.584 -26.213 -20.081 1.00 41.52 B O HETATM 1126 OD2 ASP B 22 17.126 -26.233 -17.960 1.00 41.55 B O HETATM 1127 C ASP B 22 14.538 -23.925 -20.719 1.00 36.15 B C HETATM 1128 O ASP B 22 13.326 -24.018 -20.928 1.00 35.01 B O HETATM 1129 N LYS B 23 15.464 -24.004 -21.678 1.00 37.79 B N HETATM 1130 CA LYS B 23 15.172 -24.196 -23.105 1.00 39.13 B C HETATM 1131 CB LYS B 23 16.474 -24.040 -23.911 1.00 41.67 B C HETATM 1132 CG LYS B 23 16.330 -24.006 -25.437 1.00 44.43 B C HETATM 1133 CD LYS B 23 17.696 -24.011 -26.117 1.00 46.13 B C HETATM 1134 CE LYS B 23 17.571 -24.179 -27.627 1.00 48.01 B C HETATM 1135 NZ LYS B 23 18.902 -24.236 -28.302 1.00 48.47 B N HETATM 1136 C LYS B 23 14.521 -25.559 -23.393 1.00 38.12 B C HETATM 1137 O LYS B 23 13.671 -25.671 -24.284 1.00 38.02 B O HETATM 1138 N SER B 24 14.886 -26.565 -22.592 1.00 37.62 B N HETATM 1139 CA SER B 24 14.370 -27.933 -22.722 1.00 36.57 B C HETATM 1140 CB SER B 24 15.267 -28.922 -21.963 1.00 37.25 B C HETATM 1141 OG SER B 24 15.296 -28.654 -20.570 1.00 38.11 B O HETATM 1142 C SER B 24 12.909 -28.093 -22.287 1.00 35.93 B C HETATM 1143 O SER B 24 12.290 -29.131 -22.543 1.00 35.40 B O HETATM 1144 N CYS B 25 12.373 -27.067 -21.620 1.00 34.93 B N HETATM 1145 CA CYS B 25 10.980 -27.061 -21.169 1.00 33.68 B C HETATM 1146 C CYS B 25 10.075 -26.697 -22.336 1.00 33.84 B C HETATM 1147 O CYS B 25 10.439 -25.865 -23.173 1.00 34.72 B O HETATM 1148 CB CYS B 25 10.758 -26.030 -20.058 1.00 32.58 B C HETATM 1149 SG CYS B 25 11.586 -26.363 -18.477 1.00 28.57 B S HETATM 1150 N LYS B 26 8.919 -27.349 -22.406 1.00 34.21 B N HETATM 1151 CA LYS B 26 7.937 -27.071 -23.449 1.00 33.82 B C HETATM 1152 CB LYS B 26 7.306 -28.368 -23.986 1.00 36.71 B C HETATM 1153 CG LYS B 26 6.781 -29.353 -22.937 1.00 40.04 B C HETATM 1154 CD LYS B 26 6.090 -30.543 -23.598 1.00 42.27 B C HETATM 1155 CE LYS B 26 5.558 -31.534 -22.569 1.00 42.80 B C HETATM 1156 NZ LYS B 26 6.644 -32.172 -21.770 1.00 43.29 B N HETATM 1157 C LYS B 26 6.877 -26.133 -22.875 1.00 32.80 B C HETATM 1158 O LYS B 26 6.346 -25.272 -23.580 1.00 32.16 B O HETATM 1159 N GLN B 27 6.617 -26.299 -21.576 1.00 31.56 B N HETATM 1160 CA GLN B 27 5.638 -25.516 -20.818 1.00 29.72 B C HETATM 1161 CB GLN B 27 4.454 -26.405 -20.389 1.00 32.58 B C HETATM 1162 CG GLN B 27 3.693 -27.173 -21.475 1.00 36.41 B C HETATM 1163 CD GLN B 27 2.806 -26.294 -22.325 1.00 38.36 B C HETATM 1164 OE1 GLN B 27 1.705 -25.915 -21.916 1.00 40.30 B O HETATM 1165 NE2 GLN B 27 3.270 -25.983 -23.528 1.00 40.44 B N HETATM 1166 C GLN B 27 6.301 -25.000 -19.535 1.00 26.69 B C HETATM 1167 O GLN B 27 7.050 -25.737 -18.890 1.00 27.65 B O HETATM 1168 N PHE B 28 6.033 -23.746 -19.167 1.00 23.11 B N HETATM 1169 CA PHE B 28 6.573 -23.182 -17.924 1.00 19.61 B C HETATM 1170 CB PHE B 28 7.504 -21.987 -18.181 1.00 21.32 B C HETATM 1171 CG PHE B 28 8.301 -21.565 -16.965 1.00 19.29 B C HETATM 1172 CD1 PHE B 28 9.368 -22.357 -16.504 1.00 19.90 B C HETATM 1173 CD2 PHE B 28 7.968 -20.393 -16.256 1.00 19.04 B C HETATM 1174 CE1 PHE B 28 10.101 -21.996 -15.344 1.00 20.17 B C HETATM 1175 CE2 PHE B 28 8.686 -20.015 -15.096 1.00 19.27 B C HETATM 1176 CZ PHE B 28 9.759 -20.824 -14.639 1.00 19.75 B C HETATM 1177 C PHE B 28 5.409 -22.765 -17.030 1.00 17.23 B C HETATM 1178 O PHE B 28 4.520 -22.039 -17.471 1.00 15.68 B O HETATM 1179 N THR B 29 5.458 -23.188 -15.768 1.00 16.02 B N HETATM 1180 CA THR B 29 4.402 -22.893 -14.798 1.00 15.68 B C HETATM 1181 CB THR B 29 3.797 -24.215 -14.240 1.00 18.37 B C HETATM 1182 OG1 THR B 29 3.445 -25.061 -15.339 1.00 19.57 B O HETATM 1183 CG2 THR B 29 2.538 -23.960 -13.394 1.00 19.39 B C HETATM 1184 C THR B 29 4.851 -22.008 -13.641 1.00 14.64 B C HETATM 1185 O THR B 29 5.944 -22.167 -13.105 1.00 15.50 B O HETATM 1186 N VAL B 30 3.990 -21.062 -13.280 1.00 13.69 B N HETATM 1187 CA VAL B 30 4.232 -20.147 -12.169 1.00 13.42 B C HETATM 1188 CB VAL B 30 4.191 -18.669 -12.638 1.00 12.85 B C HETATM 1189 CG1 VAL B 30 4.140 -17.710 -11.445 1.00 12.31 B C HETATM 1190 CG2 VAL B 30 5.414 -18.372 -13.474 1.00 15.26 B C HETATM 1191 C VAL B 30 3.130 -20.399 -11.143 1.00 11.21 B C HETATM 1192 O VAL B 30 1.951 -20.285 -11.470 1.00 12.74 B O HETATM 1193 N ASN B 31 3.525 -20.774 -9.926 1.00 11.13 B N HETATM 1194 CA ASN B 31 2.574 -21.033 -8.839 1.00 11.45 B C HETATM 1195 CB ASN B 31 2.882 -22.369 -8.152 1.00 12.30 B C HETATM 1196 CG ASN B 31 2.847 -23.541 -9.112 1.00 14.93 B C HETATM 1197 OD1 ASN B 31 1.837 -23.791 -9.777 1.00 13.12 B O HETATM 1198 ND2 ASN B 31 3.957 -24.270 -9.191 1.00 15.83 B N HETATM 1199 C ASN B 31 2.668 -19.884 -7.839 1.00 13.11 B C HETATM 1200 O ASN B 31 3.624 -19.798 -7.064 1.00 15.26 B O HETATM 1201 N LEU B 32 1.690 -18.983 -7.896 1.00 13.33 B N HETATM 1202 CA LEU B 32 1.650 -17.812 -7.029 1.00 12.69 B C HETATM 1203 CB LEU B 32 1.071 -16.615 -7.794 1.00 11.32 B C HETATM 1204 CG LEU B 32 1.074 -15.228 -7.141 1.00 12.41 B C HETATM 1205 CD1 LEU B 32 2.477 -14.657 -7.056 1.00 10.43 B C HETATM 1206 CD2 LEU B 32 0.187 -14.308 -7.935 1.00 13.81 B C HETATM 1207 C LEU B 32 0.863 -18.026 -5.739 1.00 13.30 B C HETATM 1208 O LEU B 32 -0.261 -18.522 -5.766 1.00 13.33 B O HETATM 1209 N SER B 33 1.467 -17.632 -4.620 1.00 11.38 B N HETATM 1210 CA SER B 33 0.826 -17.723 -3.306 1.00 12.22 B C HETATM 1211 CB SER B 33 1.420 -18.858 -2.465 1.00 12.42 B C HETATM 1212 OG SER B 33 2.779 -18.623 -2.147 1.00 12.46 B O HETATM 1213 C SER B 33 0.996 -16.370 -2.613 1.00 12.92 B C HETATM 1214 O SER B 33 1.755 -15.513 -3.087 1.00 12.79 B O HETATM 1215 N HIS B 34 0.302 -16.177 -1.495 1.00 13.77 B N HETATM 1216 CA HIS B 34 0.376 -14.906 -0.778 1.00 14.80 B C HETATM 1217 CB HIS B 34 -0.810 -14.016 -1.202 1.00 15.06 B C HETATM 1218 CG HIS B 34 -0.760 -12.595 -0.710 1.00 15.57 B C HETATM 1219 CD2 HIS B 34 -1.341 -11.475 -1.202 1.00 16.47 B C HETATM 1220 ND1 HIS B 34 -0.145 -12.215 0.466 1.00 14.84 B N HETATM 1221 CE1 HIS B 34 -0.354 -10.929 0.676 1.00 15.59 B C HETATM 1222 NE2 HIS B 34 -1.076 -10.456 -0.321 1.00 14.97 B N HETATM 1223 C HIS B 34 0.450 -15.066 0.740 1.00 16.16 B C HETATM 1224 O HIS B 34 -0.584 -15.133 1.413 1.00 17.58 B O HETATM 1225 N PRO B 35 1.679 -15.143 1.303 1.00 17.96 B N HETATM 1226 CD PRO B 35 2.982 -15.340 0.640 1.00 18.40 B C HETATM 1227 CA PRO B 35 1.815 -15.277 2.762 1.00 19.17 B C HETATM 1228 CB PRO B 35 3.304 -15.594 2.950 1.00 20.31 B C HETATM 1229 CG PRO B 35 3.959 -15.021 1.741 1.00 20.91 B C HETATM 1230 C PRO B 35 1.398 -13.965 3.446 1.00 19.58 B C HETATM 1231 O PRO B 35 1.337 -12.915 2.794 1.00 18.32 B O HETATM 1232 N GLY B 36 1.055 -14.047 4.728 1.00 19.56 B N HETATM 1233 CA GLY B 36 0.621 -12.874 5.466 1.00 20.51 B C HETATM 1234 C GLY B 36 -0.862 -12.932 5.787 1.00 21.31 B C HETATM 1235 O GLY B 36 -1.479 -13.989 5.608 1.00 19.81 B O HETATM 1236 N ASN B 37 -1.446 -11.799 6.194 1.00 23.02 B N HETATM 1237 CA ASN B 37 -2.866 -11.738 6.567 1.00 24.81 B C HETATM 1238 CB ASN B 37 -3.001 -11.753 8.104 1.00 30.03 B C HETATM 1239 CG ASN B 37 -4.287 -12.437 8.582 1.00 33.81 B C HETATM 1240 OD1 ASN B 37 -5.045 -11.875 9.377 1.00 37.22 B O HETATM 1241 ND2 ASN B 37 -4.532 -13.653 8.098 1.00 35.50 B N HETATM 1242 C ASN B 37 -3.688 -10.580 5.959 1.00 24.29 B C HETATM 1243 O ASN B 37 -4.868 -10.413 6.291 1.00 24.18 B O HETATM 1244 N LEU B 38 -3.113 -9.843 5.007 1.00 22.08 B N HETATM 1245 CA LEU B 38 -3.822 -8.715 4.387 1.00 22.59 B C HETATM 1246 CB LEU B 38 -2.843 -7.611 3.988 1.00 23.42 B C HETATM 1247 CG LEU B 38 -2.239 -6.765 5.106 1.00 23.84 B C HETATM 1248 CD1 LEU B 38 -1.120 -5.981 4.490 1.00 22.61 B C HETATM 1249 CD2 LEU B 38 -3.262 -5.831 5.760 1.00 23.97 B C HETATM 1250 C LEU B 38 -4.734 -9.057 3.202 1.00 22.72 B C HETATM 1251 O LEU B 38 -4.356 -9.849 2.336 1.00 23.66 B O HETATM 1252 N PRO B 39 -5.948 -8.455 3.147 1.00 22.59 B N HETATM 1253 CD PRO B 39 -6.599 -7.640 4.195 1.00 24.04 B C HETATM 1254 CA PRO B 39 -6.896 -8.713 2.054 1.00 23.10 B C HETATM 1255 CB PRO B 39 -8.186 -8.067 2.567 1.00 23.24 B C HETATM 1256 CG PRO B 39 -7.706 -6.972 3.441 1.00 24.76 B C HETATM 1257 C PRO B 39 -6.490 -8.198 0.666 1.00 20.87 B C HETATM 1258 O PRO B 39 -5.584 -7.375 0.536 1.00 20.57 B O HETATM 1259 N LYS B 40 -7.202 -8.676 -0.353 1.00 21.79 B N HETATM 1260 CA LYS B 40 -6.956 -8.341 -1.754 1.00 20.93 B C HETATM 1261 CB LYS B 40 -7.849 -9.212 -2.651 1.00 22.75 B C HETATM 1262 CG LYS B 40 -7.447 -9.266 -4.125 1.00 23.02 B C HETATM 1263 CD LYS B 40 -8.231 -10.319 -4.905 1.00 24.38 B C HETATM 1264 CE LYS B 40 -9.695 -9.955 -5.098 1.00 23.90 B C HETATM 1265 NZ LYS B 40 -10.402 -11.045 -5.822 1.00 23.52 B N HETATM 1266 C LYS B 40 -7.076 -6.867 -2.146 1.00 19.77 B C HETATM 1267 O LYS B 40 -6.309 -6.402 -2.986 1.00 19.84 B O HETATM 1268 N ASN B 41 -7.988 -6.127 -1.511 1.00 19.33 B N HETATM 1269 CA ASN B 41 -8.188 -4.710 -1.837 1.00 18.90 B C HETATM 1270 CB ASN B 41 -9.534 -4.189 -1.294 1.00 21.31 B C HETATM 1271 CG ASN B 41 -9.527 -3.976 0.212 1.00 22.63 B C HETATM 1272 OD1 ASN B 41 -9.484 -4.929 0.988 1.00 25.16 B O HETATM 1273 ND2 ASN B 41 -9.573 -2.715 0.627 1.00 25.62 B N HETATM 1274 C ASN B 41 -7.043 -3.786 -1.412 1.00 18.13 B C HETATM 1275 O ASN B 41 -6.889 -2.698 -1.973 1.00 18.54 B O HETATM 1276 N VAL B 42 -6.266 -4.217 -0.414 1.00 16.60 B N HETATM 1277 CA VAL B 42 -5.137 -3.427 0.079 1.00 16.99 B C HETATM 1278 CB VAL B 42 -5.166 -3.221 1.635 1.00 20.11 B C HETATM 1279 CG1 VAL B 42 -6.452 -2.518 2.065 1.00 18.78 B C HETATM 1280 CG2 VAL B 42 -5.000 -4.534 2.380 1.00 20.35 B C HETATM 1281 C VAL B 42 -3.758 -3.948 -0.342 1.00 16.57 B C HETATM 1282 O VAL B 42 -2.849 -3.151 -0.585 1.00 17.54 B O HETATM 1283 N MET B 43 -3.622 -5.271 -0.462 1.00 15.12 B N HETATM 1284 CA MET B 43 -2.344 -5.895 -0.821 1.00 14.91 B C HETATM 1285 CB MET B 43 -1.603 -6.301 0.470 1.00 14.03 B C HETATM 1286 CG MET B 43 -0.092 -6.538 0.346 1.00 15.45 B C HETATM 1287 SD MET B 43 0.851 -5.226 -0.450 1.00 15.92 B S HETATM 1288 CE MET B 43 0.774 -3.943 0.724 1.00 15.29 B C HETATM 1289 C MET B 43 -2.497 -7.081 -1.786 1.00 15.15 B C HETATM 1290 O MET B 43 -1.910 -8.153 -1.592 1.00 15.64 B O HETATM 1291 N GLY B 44 -3.277 -6.869 -2.844 1.00 15.84 B N HETATM 1292 CA GLY B 44 -3.488 -7.911 -3.837 1.00 15.76 B C HETATM 1293 C GLY B 44 -2.290 -8.019 -4.760 1.00 13.51 B C HETATM 1294 O GLY B 44 -1.653 -7.008 -5.070 1.00 13.98 B O HETATM 1295 N HIS B 45 -1.941 -9.245 -5.138 1.00 13.89 B N HETATM 1296 CA HIS B 45 -0.807 -9.481 -6.033 1.00 12.38 B C HETATM 1297 CB HIS B 45 0.359 -10.166 -5.317 1.00 10.41 B C HETATM 1298 CG HIS B 45 0.847 -9.451 -4.102 1.00 10.94 B C HETATM 1299 CD2 HIS B 45 1.117 -9.912 -2.863 1.00 10.16 B C HETATM 1300 ND1 HIS B 45 1.140 -8.106 -4.083 1.00 9.65 B N HETATM 1301 CE1 HIS B 45 1.575 -7.774 -2.879 1.00 9.57 B C HETATM 1302 NE2 HIS B 45 1.568 -8.853 -2.121 1.00 10.47 B N HETATM 1303 C HIS B 45 -1.151 -10.373 -7.203 1.00 12.86 B C HETATM 1304 O HIS B 45 -1.985 -11.272 -7.093 1.00 12.16 B O HETATM 1305 N ASN B 46 -0.482 -10.108 -8.322 1.00 12.78 B N HETATM 1306 CA ASN B 46 -0.605 -10.911 -9.529 1.00 12.30 B C HETATM 1307 CB ASN B 46 -1.642 -10.355 -10.548 1.00 11.98 B C HETATM 1308 CG ASN B 46 -1.375 -8.911 -10.997 1.00 11.83 B C HETATM 1309 OD1 ASN B 46 -0.350 -8.316 -10.691 1.00 10.68 B O HETATM 1310 ND2 ASN B 46 -2.308 -8.364 -11.768 1.00 10.71 B N HETATM 1311 C ASN B 46 0.799 -11.062 -10.117 1.00 12.10 B C HETATM 1312 O ASN B 46 1.744 -10.417 -9.650 1.00 12.33 B O HETATM 1313 N TRP B 47 0.956 -12.014 -11.027 1.00 11.46 B N HETATM 1314 CA TRP B 47 2.227 -12.247 -11.701 1.00 11.20 B C HETATM 1315 CB TRP B 47 2.720 -13.683 -11.449 1.00 11.92 B C HETATM 1316 CG TRP B 47 4.086 -13.977 -12.010 1.00 12.95 B C HETATM 1317 CD2 TRP B 47 4.396 -14.479 -13.323 1.00 12.56 B C HETATM 1318 CE2 TRP B 47 5.808 -14.595 -13.399 1.00 11.84 B C HETATM 1319 CE3 TRP B 47 3.618 -14.842 -14.447 1.00 13.71 B C HETATM 1320 CD1 TRP B 47 5.280 -13.821 -11.368 1.00 12.53 B C HETATM 1321 NE1 TRP B 47 6.317 -14.188 -12.195 1.00 10.77 B N HETATM 1322 CZ2 TRP B 47 6.471 -15.058 -14.560 1.00 13.59 B C HETATM 1323 CZ3 TRP B 47 4.277 -15.306 -15.614 1.00 14.64 B C HETATM 1324 CH2 TRP B 47 5.694 -15.407 -15.652 1.00 14.44 B C HETATM 1325 C TRP B 47 1.871 -12.029 -13.167 1.00 11.05 B C HETATM 1326 O TRP B 47 1.055 -12.759 -13.720 1.00 10.73 B O HETATM 1327 N VAL B 48 2.449 -10.994 -13.770 1.00 11.60 B N HETATM 1328 CA VAL B 48 2.177 -10.637 -15.164 1.00 10.22 B C HETATM 1329 CB VAL B 48 1.479 -9.235 -15.237 1.00 11.26 B C HETATM 1330 CG1 VAL B 48 1.156 -8.847 -16.672 1.00 9.39 B C HETATM 1331 CG2 VAL B 48 0.196 -9.223 -14.407 1.00 9.27 B C HETATM 1332 C VAL B 48 3.500 -10.606 -15.925 1.00 11.15 B C HETATM 1333 O VAL B 48 4.473 -10.040 -15.430 1.00 11.26 B O HETATM 1334 N LEU B 49 3.512 -11.187 -17.128 1.00 10.30 B N HETATM 1335 CA LEU B 49 4.709 -11.246 -17.972 1.00 10.73 B C HETATM 1336 CB LEU B 49 5.057 -12.705 -18.313 1.00 11.08 B C HETATM 1337 CG LEU B 49 6.353 -13.011 -19.086 1.00 10.71 B C HETATM 1338 CD1 LEU B 49 7.564 -12.607 -18.255 1.00 10.44 B C HETATM 1339 CD2 LEU B 49 6.425 -14.479 -19.450 1.00 14.01 B C HETATM 1340 C LEU B 49 4.583 -10.465 -19.276 1.00 11.44 B C HETATM 1341 O LEU B 49 3.606 -10.610 -19.997 1.00 11.30 B O HETATM 1342 N SER B 50 5.612 -9.676 -19.583 1.00 13.33 B N HETATM 1343 CA SER B 50 5.672 -8.894 -20.822 1.00 13.68 B C HETATM 1344 CB SER B 50 4.914 -7.559 -20.683 1.00 15.23 B C HETATM 1345 OG SER B 50 5.635 -6.591 -19.935 1.00 14.24 B O HETATM 1346 C SER B 50 7.136 -8.634 -21.123 1.00 14.79 B C HETATM 1347 O SER B 50 8.013 -9.021 -20.339 1.00 14.30 B O HETATM 1348 N THR B 51 7.412 -7.997 -22.263 1.00 14.79 B N HETATM 1349 CA THR B 51 8.788 -7.641 -22.609 1.00 14.04 B C HETATM 1350 CB THR B 51 8.943 -7.197 -24.087 1.00 13.82 B C HETATM 1351 OG1 THR B 51 8.103 -6.067 -24.344 1.00 14.19 B O HETATM 1352 CG2 THR B 51 8.581 -8.330 -25.042 1.00 14.93 B C HETATM 1353 C THR B 51 9.119 -6.452 -21.707 1.00 13.38 B C HETATM 1354 O THR B 51 8.201 -5.762 -21.253 1.00 14.92 B O HETATM 1355 N ALA B 52 10.409 -6.214 -21.464 1.00 13.97 B N HETATM 1356 CA ALA B 52 10.870 -5.106 -20.623 1.00 15.68 B C HETATM 1357 CB ALA B 52 12.399 -5.093 -20.555 1.00 15.54 B C HETATM 1358 C ALA B 52 10.348 -3.747 -21.089 1.00 16.55 B C HETATM 1359 O ALA B 52 9.913 -2.929 -20.278 1.00 15.85 B O HETATM 1360 N ALA B 53 10.316 -3.574 -22.410 1.00 17.40 B N HETATM 1361 CA ALA B 53 9.849 -2.357 -23.071 1.00 17.50 B C HETATM 1362 CB ALA B 53 10.173 -2.434 -24.561 1.00 18.31 B C HETATM 1363 C ALA B 53 8.358 -2.068 -22.880 1.00 16.33 B C HETATM 1364 O ALA B 53 7.948 -0.906 -22.867 1.00 17.90 B O HETATM 1365 N ASP B 54 7.566 -3.131 -22.721 1.00 16.54 B N HETATM 1366 CA ASP B 54 6.113 -3.033 -22.552 1.00 15.24 B C HETATM 1367 CB ASP B 54 5.414 -4.216 -23.240 1.00 14.86 B C HETATM 1368 CG ASP B 54 5.437 -4.128 -24.760 1.00 16.13 B C HETATM 1369 OD1 ASP B 54 5.629 -3.025 -25.315 1.00 18.19 B O HETATM 1370 OD2 ASP B 54 5.234 -5.181 -25.399 1.00 15.42 B O HETATM 1371 C ASP B 54 5.606 -2.963 -21.113 1.00 15.38 B C HETATM 1372 O ASP B 54 4.426 -2.667 -20.902 1.00 16.36 B O HETATM 1373 N MET B 55 6.484 -3.201 -20.136 1.00 12.96 B N HETATM 1374 CA MET B 55 6.092 -3.207 -18.720 1.00 13.54 B C HETATM 1375 CB MET B 55 7.291 -3.498 -17.804 1.00 12.93 B C HETATM 1376 CG MET B 55 6.944 -3.437 -16.307 1.00 14.00 B C HETATM 1377 SD MET B 55 8.270 -3.866 -15.217 1.00 13.98 B S HETATM 1378 CE MET B 55 9.148 -2.302 -15.208 1.00 15.74 B C HETATM 1379 C MET B 55 5.340 -1.977 -18.222 1.00 13.73 B C HETATM 1380 O MET B 55 4.222 -2.108 -17.717 1.00 12.66 B O HETATM 1381 N GLN B 56 5.925 -0.793 -18.422 1.00 15.18 B N HETATM 1382 CA GLN B 56 5.316 0.464 -17.972 1.00 17.31 B C HETATM 1383 CB GLN B 56 6.237 1.658 -18.269 1.00 21.48 B C HETATM 1384 CG GLN B 56 5.808 2.996 -17.629 1.00 27.20 B C HETATM 1385 CD GLN B 56 5.752 2.954 -16.104 1.00 32.15 B C HETATM 1386 OE1 GLN B 56 4.671 2.866 -15.512 1.00 35.25 B O HETATM 1387 NE2 GLN B 56 6.916 3.020 -15.465 1.00 34.38 B N HETATM 1388 C GLN B 56 3.914 0.691 -18.541 1.00 15.78 B C HETATM 1389 O GLN B 56 3.017 1.113 -17.813 1.00 17.06 B O HETATM 1390 N GLY B 57 3.727 0.318 -19.808 1.00 16.34 B N HETATM 1391 CA GLY B 57 2.436 0.454 -20.474 1.00 17.51 B C HETATM 1392 C GLY B 57 1.376 -0.456 -19.870 1.00 16.46 B C HETATM 1393 O GLY B 57 0.251 -0.017 -19.630 1.00 16.59 B O HETATM 1394 N VAL B 58 1.757 -1.705 -19.583 1.00 15.15 B N HETATM 1395 CA VAL B 58 0.860 -2.701 -18.980 1.00 14.54 B C HETATM 1396 CB VAL B 58 1.504 -4.123 -18.990 1.00 12.58 B C HETATM 1397 CG1 VAL B 58 0.600 -5.153 -18.303 1.00 11.39 B C HETATM 1398 CG2 VAL B 58 1.779 -4.566 -20.415 1.00 14.01 B C HETATM 1399 C VAL B 58 0.464 -2.300 -17.548 1.00 15.04 B C HETATM 1400 O VAL B 58 -0.690 -2.464 -17.158 1.00 14.63 B O HETATM 1401 N VAL B 59 1.422 -1.764 -16.790 1.00 15.57 B N HETATM 1402 CA VAL B 59 1.185 -1.309 -15.411 1.00 15.45 B C HETATM 1403 CB VAL B 59 2.530 -0.954 -14.683 1.00 14.10 B C HETATM 1404 CG1 VAL B 59 2.286 -0.279 -13.317 1.00 13.94 B C HETATM 1405 CG2 VAL B 59 3.343 -2.213 -14.471 1.00 12.61 B C HETATM 1406 C VAL B 59 0.234 -0.103 -15.392 1.00 16.03 B C HETATM 1407 O VAL B 59 -0.739 -0.101 -14.633 1.00 16.97 B O HETATM 1408 N THR B 60 0.506 0.886 -16.250 1.00 18.67 B N HETATM 1409 CA THR B 60 -0.305 2.110 -16.347 1.00 18.03 B C HETATM 1410 CB THR B 60 0.380 3.183 -17.253 1.00 18.69 B C HETATM 1411 OG1 THR B 60 1.663 3.511 -16.700 1.00 22.63 B O HETATM 1412 CG2 THR B 60 -0.448 4.471 -17.337 1.00 21.44 B C HETATM 1413 C THR B 60 -1.737 1.822 -16.801 1.00 17.97 B C HETATM 1414 O THR B 60 -2.683 2.243 -16.136 1.00 19.26 B O HETATM 1415 N ASP B 61 -1.888 1.051 -17.882 1.00 19.41 B N HETATM 1416 CA ASP B 61 -3.215 0.685 -18.406 1.00 20.67 B C HETATM 1417 CB ASP B 61 -3.109 0.112 -19.824 1.00 20.20 B C HETATM 1418 CG ASP B 61 -2.683 1.158 -20.849 1.00 21.89 B C HETATM 1419 OD1 ASP B 61 -2.793 2.371 -20.562 1.00 22.28 B O HETATM 1420 OD2 ASP B 61 -2.237 0.763 -21.949 1.00 21.35 B O HETATM 1421 C ASP B 61 -3.901 -0.305 -17.476 1.00 20.88 B C HETATM 1422 O ASP B 61 -5.134 -0.381 -17.414 1.00 20.95 B O HETATM 1423 N GLY B 62 -3.073 -1.014 -16.710 1.00 20.53 B N HETATM 1424 CA GLY B 62 -3.558 -1.966 -15.732 1.00 21.06 B C HETATM 1425 C GLY B 62 -4.190 -1.251 -14.551 1.00 21.89 B C HETATM 1426 O GLY B 62 -5.279 -1.620 -14.123 1.00 20.44 B O HETATM 1427 N MET B 63 -3.542 -0.177 -14.092 1.00 23.93 B N HETATM 1428 CA MET B 63 -4.012 0.642 -12.965 1.00 25.71 B C HETATM 1429 CB MET B 63 -3.014 1.780 -12.702 1.00 27.31 B C HETATM 1430 CG MET B 63 -3.378 2.716 -11.544 1.00 30.68 B C HETATM 1431 SD MET B 63 -2.382 4.209 -11.490 1.00 34.94 B S HETATM 1432 CE MET B 63 -0.919 3.596 -10.647 1.00 33.32 B C HETATM 1433 C MET B 63 -5.410 1.227 -13.223 1.00 24.91 B C HETATM 1434 O MET B 63 -6.275 1.204 -12.342 1.00 25.31 B O HETATM 1435 N ALA B 64 -5.624 1.681 -14.458 1.00 24.51 B N HETATM 1436 CA ALA B 64 -6.882 2.283 -14.893 1.00 23.95 B C HETATM 1437 CB ALA B 64 -6.663 3.051 -16.191 1.00 25.28 B C HETATM 1438 C ALA B 64 -8.037 1.291 -15.051 1.00 22.98 B C HETATM 1439 O ALA B 64 -9.196 1.698 -15.123 1.00 22.39 B O HETATM 1440 N SER B 65 -7.718 -0.005 -15.083 1.00 22.46 B N HETATM 1441 CA SER B 65 -8.730 -1.054 -15.234 1.00 21.20 B C HETATM 1442 CB SER B 65 -8.126 -2.290 -15.891 1.00 21.93 B C HETATM 1443 OG SER B 65 -7.730 -2.001 -17.218 1.00 24.75 B O HETATM 1444 C SER B 65 -9.460 -1.434 -13.946 1.00 21.06 B C HETATM 1445 O SER B 65 -10.554 -2.003 -13.997 1.00 19.61 B O HETATM 1446 N GLY B 66 -8.856 -1.129 -12.797 1.00 21.02 B N HETATM 1447 CA GLY B 66 -9.493 -1.419 -11.520 1.00 20.79 B C HETATM 1448 C GLY B 66 -9.310 -2.813 -10.948 1.00 20.89 B C HETATM 1449 O GLY B 66 -8.909 -3.742 -11.651 1.00 18.36 B O HETATM 1450 N LEU B 67 -9.616 -2.932 -9.654 1.00 22.31 B N HETATM 1451 CA LEU B 67 -9.518 -4.168 -8.861 1.00 23.31 B C HETATM 1452 CB LEU B 67 -9.916 -3.856 -7.409 1.00 24.22 B C HETATM 1453 CG LEU B 67 -9.967 -4.915 -6.301 1.00 24.80 B C HETATM 1454 CD1 LEU B 67 -8.581 -5.361 -5.890 1.00 25.16 B C HETATM 1455 CD2 LEU B 67 -10.670 -4.318 -5.116 1.00 26.39 B C HETATM 1456 C LEU B 67 -10.353 -5.326 -9.370 1.00 24.40 B C HETATM 1457 O LEU B 67 -9.900 -6.474 -9.410 1.00 24.86 B O HETATM 1458 N ASP B 68 -11.565 -4.987 -9.793 1.00 24.89 B N HETATM 1459 CA ASP B 68 -12.549 -5.934 -10.295 1.00 23.03 B C HETATM 1460 CB ASP B 68 -13.906 -5.222 -10.359 1.00 23.63 B C HETATM 1461 CG ASP B 68 -14.212 -4.435 -9.068 1.00 24.54 B C HETATM 1462 OD1 ASP B 68 -13.836 -4.904 -7.968 1.00 23.41 B O HETATM 1463 OD2 ASP B 68 -14.785 -3.330 -9.146 1.00 24.73 B O HETATM 1464 C ASP B 68 -12.139 -6.591 -11.624 1.00 22.89 B C HETATM 1465 O ASP B 68 -12.700 -7.613 -12.024 1.00 23.13 B O HETATM 1466 N LYS B 69 -11.114 -6.018 -12.260 1.09 21.57 B N HETATM 1467 CA LYS B 69 -10.547 -6.528 -13.509 1.06 20.04 B C HETATM 1468 CB LYS B 69 -10.616 -5.462 -14.613 1.08 19.63 B C HETATM 1469 CG LYS B 69 -12.020 -5.256 -15.166 0.75 19.42 B C HETATM 1470 CD LYS B 69 -12.053 -4.255 -16.301 0.99 19.17 B C HETATM 1471 CE LYS B 69 -13.456 -4.167 -16.893 1.20 19.37 B C HETATM 1472 NZ LYS B 69 -13.530 -3.198 -18.017 0.72 19.11 B N HETATM 1473 C LYS B 69 -9.099 -6.992 -13.270 1.07 19.91 B C HETATM 1474 O LYS B 69 -8.309 -7.139 -14.212 1.65 21.20 B O HETATM 1475 N ASP B 70 -8.774 -7.235 -11.994 1.00 18.20 B N HETATM 1476 CA ASP B 70 -7.450 -7.699 -11.533 1.00 17.96 B C HETATM 1477 CB ASP B 70 -7.163 -9.125 -12.042 1.00 19.16 B C HETATM 1478 CG ASP B 70 -8.061 -10.175 -11.407 1.00 20.69 B C HETATM 1479 OD1 ASP B 70 -8.861 -9.845 -10.499 1.00 21.46 B O HETATM 1480 OD2 ASP B 70 -7.953 -11.347 -11.818 1.00 23.44 B O HETATM 1481 C ASP B 70 -6.299 -6.761 -11.895 1.00 16.62 B C HETATM 1482 O ASP B 70 -5.138 -7.180 -12.007 1.00 16.50 B O HETATM 1483 N TYR B 71 -6.648 -5.485 -12.079 1.00 15.43 B N HETATM 1484 CA TYR B 71 -5.720 -4.425 -12.458 1.00 15.63 B C HETATM 1485 CB TYR B 71 -4.769 -4.068 -11.307 1.00 15.29 B C HETATM 1486 CG TYR B 71 -5.418 -3.274 -10.198 1.00 15.59 B C HETATM 1487 CD1 TYR B 71 -5.859 -1.949 -10.414 1.00 17.14 B C HETATM 1488 CE1 TYR B 71 -6.448 -1.180 -9.354 1.00 17.91 B C HETATM 1489 CD2 TYR B 71 -5.571 -3.827 -8.916 1.00 16.82 B C HETATM 1490 CE2 TYR B 71 -6.148 -3.075 -7.851 1.00 17.68 B C HETATM 1491 CZ TYR B 71 -6.582 -1.757 -8.078 1.00 17.57 B C HETATM 1492 OH TYR B 71 -7.104 -1.032 -7.031 1.00 21.42 B O HETATM 1493 C TYR B 71 -4.962 -4.752 -13.743 1.00 16.72 B C HETATM 1494 O TYR B 71 -3.759 -4.554 -13.841 1.00 17.25 B O HETATM 1495 N LEU B 72 -5.696 -5.276 -14.721 1.00 17.30 B N HETATM 1496 CA LEU B 72 -5.148 -5.644 -16.019 1.00 18.55 B C HETATM 1497 CB LEU B 72 -4.889 -7.151 -16.096 1.00 18.73 B C HETATM 1498 CG LEU B 72 -3.485 -7.660 -15.779 1.00 20.60 B C HETATM 1499 CD1 LEU B 72 -3.524 -9.156 -15.766 1.00 19.58 B C HETATM 1500 CD2 LEU B 72 -2.467 -7.157 -16.794 1.00 19.00 B C HETATM 1501 C LEU B 72 -6.119 -5.260 -17.109 1.00 19.14 B C HETATM 1502 O LEU B 72 -7.322 -5.517 -16.992 1.00 19.29 B O HETATM 1503 N LYS B 73 -5.591 -4.629 -18.158 1.00 19.57 B N HETATM 1504 CA LYS B 73 -6.377 -4.212 -19.319 1.00 20.46 B C HETATM 1505 CB LYS B 73 -5.505 -3.376 -20.272 1.00 21.90 B C HETATM 1506 CG LYS B 73 -6.201 -2.873 -21.539 1.00 25.22 B C HETATM 1507 CD LYS B 73 -5.210 -2.186 -22.467 1.00 27.86 B C HETATM 1508 CE LYS B 73 -5.869 -1.731 -23.756 1.00 30.95 B C HETATM 1509 NZ LYS B 73 -4.880 -1.073 -24.654 1.00 31.94 B N HETATM 1510 C LYS B 73 -6.844 -5.496 -20.009 1.00 20.49 B C HETATM 1511 O LYS B 73 -6.018 -6.366 -20.295 1.00 19.40 B O HETATM 1512 N PRO B 74 -8.176 -5.669 -20.197 1.00 21.11 B N HETATM 1513 CD PRO B 74 -9.290 -4.823 -19.719 1.00 21.09 B C HETATM 1514 CA PRO B 74 -8.707 -6.875 -20.852 1.00 21.61 B C HETATM 1515 CB PRO B 74 -10.211 -6.613 -20.881 1.00 21.03 B C HETATM 1516 CG PRO B 74 -10.430 -5.811 -19.647 1.00 21.82 B C HETATM 1517 C PRO B 74 -8.154 -7.057 -22.258 1.00 21.29 B C HETATM 1518 O PRO B 74 -8.043 -6.088 -23.020 1.00 22.43 B O HETATM 1519 N ASP B 75 -7.716 -8.287 -22.538 1.00 22.06 B N HETATM 1520 CA ASP B 75 -7.139 -8.703 -23.827 1.00 23.82 B C HETATM 1521 CB ASP B 75 -8.213 -8.710 -24.935 1.00 25.68 B C HETATM 1522 CG ASP B 75 -9.404 -9.592 -24.593 1.00 28.64 B C HETATM 1523 OD2 ASP B 75 -10.547 -9.093 -24.667 1.00 31.80 B O HETATM 1524 OD1 ASP B 75 -9.198 -10.771 -24.236 1.00 30.43 B O HETATM 1525 C ASP B 75 -5.893 -7.910 -24.264 1.00 22.28 B C HETATM 1526 O ASP B 75 -5.671 -7.686 -25.456 1.00 22.37 B O HETATM 1527 N ASP B 76 -5.084 -7.500 -23.281 1.00 20.16 B N HETATM 1528 CA ASP B 76 -3.848 -6.741 -23.513 1.00 19.28 B C HETATM 1529 CB ASP B 76 -3.236 -6.314 -22.165 1.00 18.28 B C HETATM 1530 CG ASP B 76 -2.186 -5.209 -22.295 1.00 19.04 B C HETATM 1531 OD1 ASP B 76 -1.463 -5.155 -23.314 1.00 20.37 B O HETATM 1532 OD2 ASP B 76 -2.069 -4.397 -21.351 1.00 18.55 B O HETATM 1533 C ASP B 76 -2.866 -7.621 -24.298 1.00 18.13 B C HETATM 1534 O ASP B 76 -2.377 -8.629 -23.784 1.00 18.19 B O HETATM 1535 N SER B 77 -2.602 -7.222 -25.544 1.00 19.24 B N HETATM 1536 CA SER B 77 -1.709 -7.949 -26.456 1.00 19.20 B C HETATM 1537 CB SER B 77 -1.795 -7.353 -27.869 1.00 19.87 B C HETATM 1538 OG SER B 77 -1.344 -6.010 -27.898 1.00 23.12 B O HETATM 1539 C SER B 77 -0.248 -8.017 -26.005 1.00 18.15 B C HETATM 1540 O SER B 77 0.502 -8.902 -26.428 1.00 19.05 B O HETATM 1541 N ARG B 78 0.127 -7.094 -25.121 1.00 17.33 B N HETATM 1542 CA ARG B 78 1.483 -7.010 -24.579 1.00 16.81 B C HETATM 1543 CB ARG B 78 1.751 -5.597 -24.059 1.00 17.54 B C HETATM 1544 CG ARG B 78 1.567 -4.492 -25.098 1.00 18.64 B C HETATM 1545 CD ARG B 78 1.536 -3.112 -24.455 1.00 17.61 B C HETATM 1546 NE ARG B 78 0.399 -2.963 -23.548 1.00 18.92 B N HETATM 1547 CZ ARG B 78 -0.000 -1.814 -23.008 1.00 20.25 B C HETATM 1548 NH1 ARG B 78 0.641 -0.681 -23.273 1.00 22.27 B N HETATM 1549 NH2 ARG B 78 -1.042 -1.799 -22.187 1.00 19.62 B N HETATM 1550 C ARG B 78 1.739 -8.030 -23.468 1.00 16.55 B C HETATM 1551 O ARG B 78 2.892 -8.304 -23.129 1.00 15.84 B O HETATM 1552 N VAL B 79 0.660 -8.576 -22.900 1.00 14.70 B N HETATM 1553 CA VAL B 79 0.758 -9.578 -21.833 1.00 14.77 B C HETATM 1554 CB VAL B 79 -0.440 -9.484 -20.841 1.00 13.58 B C HETATM 1555 CG1 VAL B 79 -0.340 -10.552 -19.748 1.00 13.99 B C HETATM 1556 CG2 VAL B 79 -0.462 -8.117 -20.198 1.00 12.41 B C HETATM 1557 C VAL B 79 0.871 -10.987 -22.421 1.00 14.16 B C HETATM 1558 O VAL B 79 -0.075 -11.505 -23.022 1.00 15.37 B O HETATM 1559 N ILE B 80 2.033 -11.598 -22.198 1.00 14.32 B N HETATM 1560 CA ILE B 80 2.355 -12.941 -22.680 1.00 13.90 B C HETATM 1561 CB ILE B 80 3.894 -13.169 -22.666 1.00 13.27 B C HETATM 1562 CG2 ILE B 80 4.258 -14.595 -23.142 1.00 13.43 B C HETATM 1563 CG1 ILE B 80 4.567 -12.130 -23.571 1.00 14.63 B C HETATM 1564 CD1 ILE B 80 6.055 -12.056 -23.426 1.00 16.81 B C HETATM 1565 C ILE B 80 1.637 -14.009 -21.852 1.00 14.61 B C HETATM 1566 O ILE B 80 1.133 -14.987 -22.407 1.00 14.76 B O HETATM 1567 N ALA B 81 1.587 -13.795 -20.535 1.00 13.65 B N HETATM 1568 CA ALA B 81 0.935 -14.708 -19.591 1.00 12.69 B C HETATM 1569 CB ALA B 81 1.785 -15.948 -19.371 1.00 14.36 B C HETATM 1570 C ALA B 81 0.715 -14.008 -18.264 1.00 12.32 B C HETATM 1571 O ALA B 81 1.487 -13.122 -17.882 1.00 11.39 B O HETATM 1572 N HIS B 82 -0.338 -14.413 -17.558 1.00 11.99 B N HETATM 1573 CA HIS B 82 -0.652 -13.821 -16.262 1.00 13.12 B C HETATM 1574 CB HIS B 82 -1.383 -12.466 -16.431 1.00 11.81 B C HETATM 1575 CG HIS B 82 -2.754 -12.568 -17.040 1.00 16.08 B C HETATM 1576 CD2 HIS B 82 -3.983 -12.627 -16.469 1.00 15.14 B C HETATM 1577 ND1 HIS B 82 -2.964 -12.607 -18.401 1.00 17.45 B N HETATM 1578 CE1 HIS B 82 -4.261 -12.686 -18.643 1.00 15.75 B C HETATM 1579 NE2 HIS B 82 -4.901 -12.700 -17.489 1.00 17.90 B N HETATM 1580 C HIS B 82 -1.474 -14.714 -15.353 1.00 12.57 B C HETATM 1581 O HIS B 82 -2.211 -15.586 -15.823 1.00 13.96 B O HETATM 1582 N THR B 83 -1.365 -14.453 -14.050 1.00 13.66 B N HETATM 1583 CA THR B 83 -2.161 -15.151 -13.044 1.00 13.62 B C HETATM 1584 CB THR B 83 -1.382 -15.377 -11.709 1.00 12.79 B C HETATM 1585 OG1 THR B 83 -1.015 -14.114 -11.136 1.00 13.46 B O HETATM 1586 CG2 THR B 83 -0.148 -16.222 -11.907 1.00 14.96 B C HETATM 1587 C THR B 83 -3.287 -14.153 -12.750 1.00 14.10 B C HETATM 1588 O THR B 83 -3.313 -13.054 -13.324 1.00 13.15 B O HETATM 1589 N LYS B 84 -4.202 -14.528 -11.858 1.00 13.35 B N HETATM 1590 CA LYS B 84 -5.283 -13.634 -11.426 1.00 15.63 B C HETATM 1591 CB LYS B 84 -6.513 -14.439 -10.980 1.00 16.71 B C HETATM 1592 CG LYS B 84 -7.115 -15.343 -12.045 1.00 22.21 B C HETATM 1593 CD LYS B 84 -8.313 -16.110 -11.500 1.00 25.99 B C HETATM 1594 CE LYS B 84 -8.822 -17.156 -12.491 1.00 28.82 B C HETATM 1595 NZ LYS B 84 -7.811 -18.233 -12.763 1.00 31.31 B N HETATM 1596 C LYS B 84 -4.726 -12.856 -10.222 1.00 14.40 B C HETATM 1597 O LYS B 84 -3.591 -13.102 -9.783 1.00 12.93 B O HETATM 1598 N LEU B 85 -5.499 -11.904 -9.706 1.00 15.33 B N HETATM 1599 CA LEU B 85 -5.074 -11.133 -8.538 1.00 15.24 B C HETATM 1600 CB LEU B 85 -5.680 -9.733 -8.554 1.00 15.05 B C HETATM 1601 CG LEU B 85 -5.102 -8.657 -7.634 1.00 16.47 B C HETATM 1602 CD1 LEU B 85 -3.859 -8.021 -8.240 1.00 14.64 B C HETATM 1603 CD2 LEU B 85 -6.151 -7.596 -7.431 1.00 18.29 B C HETATM 1604 C LEU B 85 -5.540 -11.895 -7.305 1.00 14.48 B C HETATM 1605 O LEU B 85 -6.692 -12.343 -7.245 1.00 13.61 B O HETATM 1606 N ILE B 86 -4.631 -12.071 -6.348 1.00 14.99 B N HETATM 1607 CA ILE B 86 -4.926 -12.812 -5.124 1.00 16.03 B C HETATM 1608 CB ILE B 86 -4.194 -14.198 -5.089 1.00 14.92 B C HETATM 1609 CG2 ILE B 86 -4.735 -15.129 -6.179 1.00 18.16 B C HETATM 1610 CG1 ILE B 86 -2.675 -14.029 -5.186 1.00 15.94 B C HETATM 1611 CD1 ILE B 86 -1.923 -15.245 -4.723 1.00 15.07 B C HETATM 1612 C ILE B 86 -4.630 -12.074 -3.817 1.00 16.07 B C HETATM 1613 O ILE B 86 -3.781 -11.180 -3.767 1.00 16.29 B O HETATM 1614 N GLY B 87 -5.369 -12.453 -2.776 1.00 15.36 B N HETATM 1615 CA GLY B 87 -5.190 -11.886 -1.450 1.00 16.04 B C HETATM 1616 C GLY B 87 -4.507 -12.926 -0.589 1.00 16.99 B C HETATM 1617 O GLY B 87 -4.180 -14.005 -1.086 1.00 16.63 B O HETATM 1618 N SER B 88 -4.273 -12.615 0.686 1.00 17.75 B N HETATM 1619 CA SER B 88 -3.614 -13.550 1.601 1.00 20.28 B C HETATM 1620 CB SER B 88 -3.372 -12.902 2.953 1.00 20.29 B C HETATM 1621 OG SER B 88 -4.587 -12.496 3.559 1.00 22.33 B O HETATM 1622 C SER B 88 -4.346 -14.872 1.776 1.00 21.44 B C HETATM 1623 O SER B 88 -5.579 -14.901 1.855 1.00 23.30 B O HETATM 1624 N GLY B 89 -3.573 -15.958 1.741 1.00 22.28 B N HETATM 1625 CA GLY B 89 -4.122 -17.297 1.882 1.00 21.71 B C HETATM 1626 C GLY B 89 -4.649 -17.897 0.586 1.00 19.92 B C HETATM 1627 O GLY B 89 -4.987 -19.079 0.551 1.00 19.01 B O HETATM 1628 N GLU B 90 -4.730 -17.080 -0.467 1.00 19.67 B N HETATM 1629 CA GLU B 90 -5.224 -17.523 -1.778 1.00 18.66 B C HETATM 1630 CB GLU B 90 -6.061 -16.424 -2.445 1.00 19.99 B C HETATM 1631 CG GLU B 90 -7.254 -15.933 -1.618 1.00 21.25 B C HETATM 1632 CD GLU B 90 -8.121 -14.910 -2.342 1.00 23.51 B C HETATM 1633 OE1 GLU B 90 -7.581 -14.055 -3.078 1.00 21.98 B O HETATM 1634 OE2 GLU B 90 -9.357 -14.951 -2.164 1.00 24.45 B O HETATM 1635 C GLU B 90 -4.085 -17.954 -2.703 1.00 17.84 B C HETATM 1636 O GLU B 90 -2.925 -17.600 -2.476 1.00 15.07 B O HETATM 1637 N LYS B 91 -4.424 -18.749 -3.721 1.00 16.42 B N HETATM 1638 CA LYS B 91 -3.455 -19.268 -4.694 1.00 16.89 B C HETATM 1639 CB LYS B 91 -3.122 -20.742 -4.395 1.00 18.36 B C HETATM 1640 CG LYS B 91 -2.168 -21.005 -3.234 1.00 23.44 B C HETATM 1641 CD LYS B 91 -1.888 -22.501 -3.059 1.00 26.08 B C HETATM 1642 CE LYS B 91 -2.851 -23.179 -2.081 1.00 29.59 B C HETATM 1643 NZ LYS B 91 -4.278 -23.189 -2.517 1.00 28.43 B N HETATM 1644 C LYS B 91 -3.969 -19.206 -6.131 1.00 14.75 B C HETATM 1645 O LYS B 91 -5.175 -19.269 -6.370 1.00 15.15 B O HETATM 1646 N ASP B 92 -3.036 -19.081 -7.074 1.00 15.37 B N HETATM 1647 CA ASP B 92 -3.332 -19.070 -8.506 1.00 15.66 B C HETATM 1648 CB ASP B 92 -3.850 -17.715 -8.997 1.00 16.42 B C HETATM 1649 CG ASP B 92 -4.666 -17.840 -10.275 1.00 19.15 B C HETATM 1650 OD1 ASP B 92 -5.751 -18.451 -10.231 1.00 22.32 B O HETATM 1651 OD2 ASP B 92 -4.223 -17.349 -11.327 1.00 18.24 B O HETATM 1652 C ASP B 92 -2.088 -19.461 -9.289 1.00 15.85 B C HETATM 1653 O ASP B 92 -0.973 -19.064 -8.944 1.00 16.19 B O HETATM 1654 N SER B 93 -2.298 -20.234 -10.351 1.00 16.01 B N HETATM 1655 CA SER B 93 -1.214 -20.697 -11.203 1.00 13.07 B C HETATM 1656 CB SER B 93 -0.969 -22.193 -10.994 1.00 13.48 B C HETATM 1657 OG SER B 93 -0.635 -22.488 -9.648 1.00 14.55 B O HETATM 1658 C SER B 93 -1.505 -20.453 -12.675 1.00 14.03 B C HETATM 1659 O SER B 93 -2.666 -20.406 -13.087 1.00 12.02 B O HETATM 1660 N VAL B 94 -0.436 -20.296 -13.453 1.00 14.24 B N HETATM 1661 CA VAL B 94 -0.532 -20.104 -14.896 1.00 14.42 B C HETATM 1662 CB VAL B 94 -0.518 -18.583 -15.309 1.00 14.51 B C HETATM 1663 CG1 VAL B 94 0.836 -17.920 -15.020 1.00 13.15 B C HETATM 1664 CG2 VAL B 94 -0.904 -18.417 -16.786 1.00 14.74 B C HETATM 1665 C VAL B 94 0.601 -20.858 -15.588 1.00 15.81 B C HETATM 1666 O VAL B 94 1.716 -20.927 -15.071 1.00 14.43 B O HETATM 1667 N THR B 95 0.276 -21.463 -16.727 1.00 16.20 B N HETATM 1668 CA THR B 95 1.240 -22.185 -17.547 1.00 18.57 B C HETATM 1669 CB THR B 95 0.932 -23.708 -17.598 1.00 17.91 B C HETATM 1670 OG1 THR B 95 0.895 -24.223 -16.267 1.00 22.42 B O HETATM 1671 CG2 THR B 95 2.011 -24.468 -18.353 1.00 19.86 B C HETATM 1672 C THR B 95 1.191 -21.589 -18.953 1.00 17.73 B C HETATM 1673 O THR B 95 0.120 -21.231 -19.441 1.00 19.05 B O HETATM 1674 N PHE B 96 2.363 -21.410 -19.557 1.00 19.33 B N HETATM 1675 CA PHE B 96 2.464 -20.881 -20.914 1.00 19.08 B C HETATM 1676 CB PHE B 96 2.768 -19.362 -20.930 1.00 16.93 B C HETATM 1677 CG PHE B 96 4.056 -18.963 -20.234 1.00 15.90 B C HETATM 1678 CD1 PHE B 96 4.078 -18.729 -18.845 1.00 15.87 B C HETATM 1679 CD2 PHE B 96 5.254 -18.809 -20.965 1.00 16.14 B C HETATM 1680 CE1 PHE B 96 5.279 -18.346 -18.184 1.00 16.07 B C HETATM 1681 CE2 PHE B 96 6.462 -18.430 -20.321 1.00 16.65 B C HETATM 1682 CZ PHE B 96 6.474 -18.198 -18.927 1.00 16.55 B C HETATM 1683 C PHE B 96 3.500 -21.657 -21.720 1.00 19.01 B C HETATM 1684 O PHE B 96 4.421 -22.251 -21.152 1.00 18.59 B O HETATM 1685 N ASP B 97 3.356 -21.610 -23.042 1.00 21.16 B N HETATM 1686 CA ASP B 97 4.266 -22.281 -23.968 1.00 22.15 B C HETATM 1687 CB ASP B 97 3.668 -22.319 -25.383 1.00 25.94 B C HETATM 1688 CG ASP B 97 2.308 -23.006 -25.444 1.00 28.72 B C HETATM 1689 OD1 ASP B 97 2.095 -24.004 -24.727 1.00 30.47 B O HETATM 1690 OD2 ASP B 97 1.450 -22.549 -26.229 1.00 31.45 B O HETATM 1691 C ASP B 97 5.583 -21.512 -24.005 1.00 22.51 B C HETATM 1692 O ASP B 97 5.581 -20.291 -24.165 1.00 21.80 B O HETATM 1693 N VAL B 98 6.692 -22.234 -23.844 1.00 22.77 B N HETATM 1694 CA VAL B 98 8.048 -21.666 -23.856 1.00 24.55 B C HETATM 1695 CB VAL B 98 9.080 -22.710 -23.305 1.00 24.56 B C HETATM 1696 CG1 VAL B 98 10.523 -22.230 -23.423 1.00 24.19 B C HETATM 1697 CG2 VAL B 98 8.785 -22.987 -21.842 1.00 25.79 B C HETATM 1698 C VAL B 98 8.419 -21.139 -25.257 1.00 25.08 B C HETATM 1699 O VAL B 98 9.282 -20.267 -25.393 1.00 25.59 B O HETATM 1700 N SER B 99 7.680 -21.605 -26.268 1.00 26.03 B N HETATM 1701 CA SER B 99 7.857 -21.189 -27.663 1.00 26.16 B C HETATM 1702 CB SER B 99 7.038 -22.091 -28.596 1.00 26.92 B C HETATM 1703 OG SER B 99 5.651 -22.033 -28.297 1.00 29.35 B O HETATM 1704 C SER B 99 7.455 -19.720 -27.865 1.00 25.29 B C HETATM 1705 O SER B 99 7.838 -19.097 -28.858 1.00 25.41 B O HETATM 1706 N LYS B 100 6.699 -19.178 -26.903 1.00 24.11 B N HETATM 1707 CA LYS B 100 6.253 -17.783 -26.922 1.00 21.67 B C HETATM 1708 CB LYS B 100 5.042 -17.577 -26.003 1.00 22.43 B C HETATM 1709 CG LYS B 100 3.759 -18.223 -26.508 1.00 25.08 B C HETATM 1710 CD LYS B 100 2.555 -17.842 -25.655 1.00 26.70 B C HETATM 1711 CE LYS B 100 1.266 -18.366 -26.274 1.00 26.82 B C HETATM 1712 NZ LYS B 100 0.055 -17.946 -25.510 1.00 30.52 B N HETATM 1713 C LYS B 100 7.383 -16.833 -26.511 1.00 20.72 B C HETATM 1714 O LYS B 100 7.291 -15.621 -26.717 1.00 21.50 B O HETATM 1715 N LEU B 101 8.435 -17.396 -25.915 1.00 19.50 B N HETATM 1716 CA LEU B 101 9.601 -16.628 -25.483 1.00 17.90 B C HETATM 1717 CB LEU B 101 10.113 -17.127 -24.132 1.00 18.74 B C HETATM 1718 CG LEU B 101 9.188 -17.101 -22.914 1.00 17.48 B C HETATM 1719 CD1 LEU B 101 9.919 -17.736 -21.745 1.00 20.75 B C HETATM 1720 CD2 LEU B 101 8.753 -15.679 -22.575 1.00 18.69 B C HETATM 1721 C LEU B 101 10.731 -16.726 -26.501 1.00 18.64 B C HETATM 1722 O LEU B 101 10.868 -17.739 -27.191 1.00 19.27 B O HETATM 1723 N LYS B 102 11.537 -15.668 -26.571 1.00 17.74 B N HETATM 1724 CA LYS B 102 12.681 -15.588 -27.479 1.00 19.59 B C HETATM 1725 CB LYS B 102 12.556 -14.385 -28.417 1.00 19.13 B C HETATM 1726 CG LYS B 102 11.403 -14.429 -29.394 1.00 20.91 B C HETATM 1727 CD LYS B 102 11.384 -13.218 -30.324 1.00 23.60 B C HETATM 1728 CE LYS B 102 10.993 -11.930 -29.611 1.00 23.56 B C HETATM 1729 NZ LYS B 102 10.846 -10.809 -30.579 1.00 26.58 B N HETATM 1730 C LYS B 102 13.976 -15.421 -26.699 1.00 19.92 B C HETATM 1731 O LYS B 102 14.023 -14.673 -25.722 1.00 19.77 B O HETATM 1732 N GLU B 103 15.030 -16.100 -27.151 1.00 23.18 B N HETATM 1733 CA GLU B 103 16.350 -15.996 -26.526 1.00 25.74 B C HETATM 1734 CB GLU B 103 17.235 -17.182 -26.932 1.00 29.46 B C HETATM 1735 CG GLU B 103 18.516 -17.329 -26.107 1.00 35.57 B C HETATM 1736 CD GLU B 103 19.238 -18.635 -26.366 1.00 38.77 B C HETATM 1737 OE1 GLU B 103 18.896 -19.645 -25.711 1.00 40.94 B O HETATM 1738 OE2 GLU B 103 20.152 -18.651 -27.218 1.00 41.10 B O HETATM 1739 C GLU B 103 16.961 -14.675 -27.001 1.00 26.11 B C HETATM 1740 O GLU B 103 16.808 -14.302 -28.169 1.00 26.76 B O HETATM 1741 N GLY B 104 17.580 -13.945 -26.077 1.00 25.84 B N HETATM 1742 CA GLY B 104 18.184 -12.663 -26.410 1.00 25.94 B C HETATM 1743 C GLY B 104 17.300 -11.480 -26.051 1.00 26.63 B C HETATM 1744 O GLY B 104 17.804 -10.372 -25.833 1.00 27.31 B O HETATM 1745 N GLU B 105 15.986 -11.712 -25.997 1.00 24.27 B N HETATM 1746 CA GLU B 105 15.015 -10.673 -25.650 1.00 22.84 B C HETATM 1747 CB GLU B 105 13.643 -10.983 -26.284 1.00 23.67 B C HETATM 1748 CG GLU B 105 12.470 -10.015 -25.963 1.00 24.34 B C HETATM 1749 CD GLU B 105 12.617 -8.615 -26.541 1.00 24.66 B C HETATM 1750 OE1 GLU B 105 13.470 -7.844 -26.052 1.00 28.41 B O HETATM 1751 OE2 GLU B 105 11.847 -8.272 -27.464 1.00 25.86 B O HETATM 1752 C GLU B 105 14.920 -10.523 -24.128 1.00 21.50 B C HETATM 1753 O GLU B 105 15.115 -11.490 -23.386 1.00 22.17 B O HETATM 1754 N GLN B 106 14.672 -9.292 -23.684 1.00 20.49 B N HETATM 1755 CA GLN B 106 14.565 -8.960 -22.263 1.00 19.93 B C HETATM 1756 CB GLN B 106 15.180 -7.576 -21.995 1.00 22.37 B C HETATM 1757 CG GLN B 106 16.606 -7.368 -22.515 1.00 26.09 B C HETATM 1758 CD GLN B 106 17.650 -8.154 -21.744 1.00 28.52 B C HETATM 1759 OE1 GLN B 106 18.094 -7.736 -20.671 1.00 27.96 B O HETATM 1760 NE2 GLN B 106 18.065 -9.291 -22.300 1.00 29.80 B N HETATM 1761 C GLN B 106 13.109 -8.964 -21.810 1.00 17.48 B C HETATM 1762 O GLN B 106 12.285 -8.221 -22.351 1.00 17.22 B O HETATM 1763 N TYR B 107 12.799 -9.818 -20.833 1.00 16.21 B N HETATM 1764 CA TYR B 107 11.442 -9.926 -20.289 1.00 14.72 B C HETATM 1765 CB TYR B 107 10.906 -11.358 -20.397 1.00 14.77 B C HETATM 1766 CG TYR B 107 10.774 -11.869 -21.807 1.00 14.70 B C HETATM 1767 CD1 TYR B 107 9.705 -11.458 -22.625 1.00 15.02 B C HETATM 1768 CE1 TYR B 107 9.598 -11.905 -23.969 1.00 16.16 B C HETATM 1769 CD2 TYR B 107 11.734 -12.744 -22.347 1.00 14.42 B C HETATM 1770 CE2 TYR B 107 11.634 -13.200 -23.687 1.00 16.07 B C HETATM 1771 CZ TYR B 107 10.565 -12.771 -24.485 1.00 16.13 B C HETATM 1772 OH TYR B 107 10.473 -13.178 -25.795 1.00 15.06 B O HETATM 1773 C TYR B 107 11.383 -9.502 -18.833 1.00 13.83 B C HETATM 1774 O TYR B 107 12.386 -9.541 -18.121 1.00 12.86 B O HETATM 1775 N MET B 108 10.197 -9.075 -18.406 1.00 12.93 B N HETATM 1776 CA MET B 108 9.971 -8.661 -17.027 1.00 11.89 B C HETATM 1777 CB MET B 108 9.852 -7.137 -16.910 1.00 12.87 B C HETATM 1778 CG MET B 108 11.144 -6.350 -17.060 1.00 15.05 B C HETATM 1779 SD MET B 108 12.401 -6.643 -15.821 1.00 14.29 B S HETATM 1780 CE MET B 108 11.526 -5.991 -14.358 1.00 16.13 B C HETATM 1781 C MET B 108 8.695 -9.255 -16.465 1.00 11.29 B C HETATM 1782 O MET B 108 7.691 -9.345 -17.172 1.00 10.74 B O HETATM 1783 N PHE B 109 8.771 -9.752 -15.233 1.00 11.92 B N HETATM 1784 CA PHE B 109 7.582 -10.239 -14.545 1.00 10.27 B C HETATM 1785 CB PHE B 109 7.735 -11.656 -13.964 1.00 12.31 B C HETATM 1786 CG PHE B 109 8.690 -11.788 -12.798 1.00 10.36 B C HETATM 1787 CD1 PHE B 109 8.238 -11.627 -11.466 1.00 11.95 B C HETATM 1788 CD2 PHE B 109 10.024 -12.153 -13.016 1.00 12.75 B C HETATM 1789 CE1 PHE B 109 9.105 -11.831 -10.370 1.00 12.57 B C HETATM 1790 CE2 PHE B 109 10.905 -12.363 -11.927 1.00 12.65 B C HETATM 1791 CZ PHE B 109 10.446 -12.203 -10.604 1.00 12.82 B C HETATM 1792 C PHE B 109 7.284 -9.165 -13.505 1.00 9.83 B C HETATM 1793 O PHE B 109 8.210 -8.543 -13.001 1.00 9.59 B O HETATM 1794 N PHE B 110 6.003 -8.911 -13.236 1.00 9.00 B N HETATM 1795 CA PHE B 110 5.602 -7.853 -12.305 1.00 9.91 B C HETATM 1796 CB PHE B 110 5.755 -6.460 -12.980 1.00 9.00 B C HETATM 1797 CG PHE B 110 5.184 -6.381 -14.386 1.00 10.63 B C HETATM 1798 CD1 PHE B 110 5.911 -6.877 -15.488 1.00 12.17 B C HETATM 1799 CD2 PHE B 110 3.903 -5.859 -14.610 1.00 12.58 B C HETATM 1800 CE1 PHE B 110 5.369 -6.869 -16.794 1.00 13.39 B C HETATM 1801 CE2 PHE B 110 3.345 -5.838 -15.912 1.00 14.70 B C HETATM 1802 CZ PHE B 110 4.081 -6.349 -17.006 1.00 13.48 B C HETATM 1803 C PHE B 110 4.183 -7.979 -11.780 1.00 11.00 B C HETATM 1804 O PHE B 110 3.393 -8.785 -12.275 1.00 10.06 B O HETATM 1805 N CYS B 111 3.879 -7.144 -10.788 1.00 10.99 B N HETATM 1806 CA CYS B 111 2.554 -7.060 -10.203 1.00 10.92 B C HETATM 1807 CB CYS B 111 2.614 -7.116 -8.679 1.00 11.88 B C HETATM 1808 SG CYS B 111 0.994 -6.953 -7.912 1.00 11.84 B S HETATM 1809 C CYS B 111 1.972 -5.727 -10.666 1.00 11.90 B C HETATM 1810 O CYS B 111 2.653 -4.702 -10.613 1.00 12.22 B O HETATM 1811 N THR B 112 0.709 -5.740 -11.089 1.00 10.85 B N HETATM 1812 CA THR B 112 0.061 -4.528 -11.594 1.00 10.67 B C HETATM 1813 CB THR B 112 -0.733 -4.802 -12.885 1.00 11.89 B C HETATM 1814 OG1 THR B 112 -1.767 -5.753 -12.621 1.00 11.85 B O HETATM 1815 CG2 THR B 112 0.169 -5.318 -13.992 1.00 11.58 B C HETATM 1816 C THR B 112 -0.822 -3.745 -10.623 1.00 12.04 B C HETATM 1817 O THR B 112 -1.437 -2.750 -11.014 1.00 12.35 B O HETATM 1818 N PHE B 113 -0.892 -4.190 -9.367 1.00 13.01 B N HETATM 1819 CA PHE B 113 -1.671 -3.493 -8.325 1.00 13.39 B C HETATM 1820 CB PHE B 113 -1.665 -4.349 -7.042 1.00 14.01 B C HETATM 1821 CG PHE B 113 -2.611 -3.879 -5.952 1.00 14.66 B C HETATM 1822 CD1 PHE B 113 -2.298 -2.764 -5.140 1.00 15.67 B C HETATM 1823 CD2 PHE B 113 -3.797 -4.586 -5.695 1.00 16.83 B C HETATM 1824 CE1 PHE B 113 -3.143 -2.356 -4.091 1.00 16.57 B C HETATM 1825 CE2 PHE B 113 -4.664 -4.191 -4.639 1.00 16.06 B C HETATM 1826 CZ PHE B 113 -4.331 -3.075 -3.841 1.00 16.64 B C HETATM 1827 C PHE B 113 -0.935 -2.142 -8.119 1.00 14.35 B C HETATM 1828 O PHE B 113 0.294 -2.120 -8.139 1.00 13.97 B O HETATM 1829 N PRO B 114 -1.671 -1.003 -8.003 1.00 16.19 B N HETATM 1830 CD PRO B 114 -3.133 -0.885 -8.103 1.00 15.97 B C HETATM 1831 CA PRO B 114 -1.111 0.338 -7.809 1.00 16.34 B C HETATM 1832 CB PRO B 114 -2.313 1.130 -7.315 1.00 17.33 B C HETATM 1833 CG PRO B 114 -3.363 0.611 -8.159 1.00 17.98 B C HETATM 1834 C PRO B 114 0.052 0.450 -6.854 1.00 15.25 B C HETATM 1835 O PRO B 114 -0.051 0.096 -5.674 1.00 17.74 B O HETATM 1836 N GLY B 115 1.178 0.862 -7.425 1.00 15.72 B N HETATM 1837 CA GLY B 115 2.401 1.042 -6.675 1.00 14.07 B C HETATM 1838 C GLY B 115 3.254 -0.193 -6.464 1.00 15.57 B C HETATM 1839 O GLY B 115 4.454 -0.065 -6.240 1.00 14.76 B O HETATM 1840 N HIS B 116 2.667 -1.382 -6.603 1.00 14.41 B N HETATM 1841 CA HIS B 116 3.400 -2.628 -6.380 1.00 13.17 B C HETATM 1842 CB HIS B 116 2.465 -3.843 -6.406 1.00 13.02 B C HETATM 1843 CG HIS B 116 1.548 -3.930 -5.222 1.00 13.08 B C HETATM 1844 CD2 HIS B 116 1.124 -2.986 -4.347 1.00 13.29 B C HETATM 1845 ND1 HIS B 116 0.953 -5.109 -4.829 1.00 12.76 B N HETATM 1846 CE1 HIS B 116 0.204 -4.887 -3.764 1.00 13.92 B C HETATM 1847 NE2 HIS B 116 0.292 -3.608 -3.450 1.00 15.17 B N HETATM 1848 C HIS B 116 4.622 -2.873 -7.244 1.00 13.00 B C HETATM 1849 O HIS B 116 5.648 -3.285 -6.714 1.00 12.24 B O HETATM 1850 N SER B 117 4.563 -2.472 -8.516 1.00 12.35 B N HETATM 1851 CA SER B 117 5.678 -2.670 -9.452 1.00 14.32 B C HETATM 1852 CB SER B 117 5.258 -2.366 -10.900 1.00 13.66 B C HETATM 1853 OG SER B 117 5.106 -0.978 -11.138 1.00 14.48 B O HETATM 1854 C SER B 117 6.977 -1.932 -9.115 1.00 15.04 B C HETATM 1855 O SER B 117 8.001 -2.196 -9.730 1.00 15.53 B O HETATM 1856 N ALA B 118 6.941 -1.028 -8.131 1.00 14.20 B N HETATM 1857 CA ALA B 118 8.143 -0.295 -7.711 1.00 14.06 B C HETATM 1858 CB ALA B 118 7.792 0.753 -6.674 1.00 12.23 B C HETATM 1859 C ALA B 118 9.175 -1.276 -7.140 1.00 13.67 B C HETATM 1860 O ALA B 118 10.377 -1.141 -7.377 1.00 14.83 B O HETATM 1861 N LEU B 119 8.669 -2.290 -6.435 1.00 13.63 B N HETATM 1862 CA LEU B 119 9.483 -3.335 -5.819 1.00 12.52 B C HETATM 1863 CB LEU B 119 9.276 -3.356 -4.296 1.00 13.13 B C HETATM 1864 CG LEU B 119 9.657 -2.129 -3.462 1.00 13.14 B C HETATM 1865 CD1 LEU B 119 9.348 -2.389 -1.995 1.00 12.66 B C HETATM 1866 CD2 LEU B 119 11.130 -1.803 -3.659 1.00 9.84 B C HETATM 1867 C LEU B 119 9.148 -4.717 -6.369 1.00 12.26 B C HETATM 1868 O LEU B 119 10.021 -5.585 -6.460 1.00 11.38 B O HETATM 1869 N MET B 120 7.875 -4.913 -6.717 1.00 11.47 B N HETATM 1870 CA MET B 120 7.391 -6.192 -7.229 1.00 11.65 B C HETATM 1871 CB MET B 120 5.939 -6.436 -6.823 1.00 11.39 B C HETATM 1872 CG MET B 120 5.751 -6.416 -5.350 1.00 11.84 B C HETATM 1873 SD MET B 120 4.155 -6.930 -4.753 1.00 11.44 B S HETATM 1874 CE MET B 120 4.300 -8.631 -4.978 1.00 13.04 B C HETATM 1875 C MET B 120 7.560 -6.362 -8.721 1.00 12.16 B C HETATM 1876 O MET B 120 6.607 -6.286 -9.496 1.00 12.96 B O HETATM 1877 N LYS B 121 8.811 -6.575 -9.103 1.00 11.88 B N HETATM 1878 CA LYS B 121 9.186 -6.794 -10.484 1.00 12.98 B C HETATM 1879 CB LYS B 121 9.296 -5.472 -11.269 1.00 13.91 B C HETATM 1880 CG LYS B 121 10.301 -4.466 -10.739 1.00 15.32 B C HETATM 1881 CD LYS B 121 10.302 -3.212 -11.590 1.00 17.72 B C HETATM 1882 CE LYS B 121 11.237 -2.168 -11.027 1.00 16.22 B C HETATM 1883 NZ LYS B 121 12.656 -2.534 -11.268 1.00 17.04 B N HETATM 1884 C LYS B 121 10.490 -7.561 -10.509 1.00 13.45 B C HETATM 1885 O LYS B 121 11.188 -7.639 -9.493 1.00 14.02 B O HETATM 1886 N GLY B 122 10.779 -8.161 -11.659 1.00 12.74 B N HETATM 1887 CA GLY B 122 12.006 -8.914 -11.826 1.00 11.53 B C HETATM 1888 C GLY B 122 12.209 -9.357 -13.256 1.00 10.95 B C HETATM 1889 O GLY B 122 11.278 -9.293 -14.049 1.00 10.43 B O HETATM 1890 N THR B 123 13.399 -9.857 -13.577 1.00 11.64 B N HETATM 1891 CA THR B 123 13.695 -10.309 -14.938 1.00 11.42 B C HETATM 1892 CB THR B 123 15.194 -10.151 -15.273 1.00 10.77 B C HETATM 1893 OG1 THR B 123 15.981 -10.890 -14.327 1.00 12.62 B O HETATM 1894 CG2 THR B 123 15.606 -8.679 -15.248 1.00 12.82 B C HETATM 1895 C THR B 123 13.329 -11.770 -15.176 1.00 13.77 B C HETATM 1896 O THR B 123 13.296 -12.567 -14.243 1.00 12.79 B O HETATM 1897 N LEU B 124 12.998 -12.088 -16.426 1.00 13.63 B N HETATM 1898 CA LEU B 124 12.700 -13.457 -16.844 1.00 13.45 B C HETATM 1899 CB LEU B 124 11.211 -13.670 -17.154 1.00 14.54 B C HETATM 1900 CG LEU B 124 10.824 -15.117 -17.516 1.00 16.68 B C HETATM 1901 CD1 LEU B 124 9.618 -15.584 -16.721 1.00 17.17 B C HETATM 1902 CD2 LEU B 124 10.557 -15.241 -19.013 1.00 14.95 B C HETATM 1903 C LEU B 124 13.566 -13.667 -18.080 1.00 15.64 B C HETATM 1904 O LEU B 124 13.486 -12.898 -19.041 1.00 15.73 B O HETATM 1905 N THR B 125 14.388 -14.710 -18.047 1.00 16.75 B N HETATM 1906 CA THR B 125 15.292 -14.998 -19.155 1.00 20.61 B C HETATM 1907 CB THR B 125 16.761 -14.699 -18.753 1.00 20.73 B C HETATM 1908 OG1 THR B 125 16.825 -13.426 -18.095 1.00 22.03 B O HETATM 1909 CG2 THR B 125 17.670 -14.656 -19.983 1.00 21.82 B C HETATM 1910 C THR B 125 15.183 -16.439 -19.628 1.00 21.48 B C HETATM 1911 O THR B 125 15.131 -17.366 -18.818 1.00 21.84 B O HETATM 1912 N LEU B 126 15.136 -16.607 -20.948 1.00 23.44 B N HETATM 1913 CA LEU B 126 15.067 -17.923 -21.574 1.00 25.60 B C HETATM 1914 CB LEU B 126 14.170 -17.878 -22.826 1.00 26.07 B C HETATM 1915 CG LEU B 126 13.693 -19.116 -23.616 1.00 27.44 B C HETATM 1916 CD1 LEU B 126 14.552 -19.359 -24.840 1.00 28.72 B C HETATM 1917 CD2 LEU B 126 13.601 -20.363 -22.745 1.00 27.35 B C HETATM 1918 C LEU B 126 16.498 -18.346 -21.924 1.00 27.23 B C HETATM 1919 O LEU B 126 17.201 -17.549 -22.582 1.00 28.94 B O HETATM 1920 OXT LEU B 126 16.897 -19.456 -21.510 1.00 28.87 B O HETATM 1921 FE+2 FE2 B 127 0.924 -6.587 -5.561 0.23 11.73 B FE2+ TER HETATM 1922 CB ALA C 1 6.751 -27.785 12.790 1.00 41.14 C C HETATM 1923 C ALA C 1 8.961 -28.796 12.110 1.00 39.91 C C HETATM 1924 O ALA C 1 9.936 -29.384 12.594 1.00 40.64 C O HETATM 1925 N ALA C 1 7.589 -29.814 13.932 1.00 41.42 C N HETATM 1926 CA ALA C 1 7.547 -29.083 12.632 1.00 40.86 C C HETATM 1927 N GLU C 2 9.060 -27.904 11.119 1.00 38.64 C N HETATM 1928 CA GLU C 2 10.336 -27.523 10.506 1.00 35.42 C C HETATM 1929 CB GLU C 2 10.100 -26.948 9.102 1.00 38.80 C C HETATM 1930 CG GLU C 2 11.300 -27.073 8.160 1.00 40.64 C C HETATM 1931 CD GLU C 2 11.048 -26.469 6.788 1.00 43.00 C C HETATM 1932 OE1 GLU C 2 10.067 -26.869 6.120 1.00 43.45 C O HETATM 1933 OE2 GLU C 2 11.839 -25.594 6.373 1.00 44.24 C O HETATM 1934 C GLU C 2 11.090 -26.511 11.374 1.00 32.47 C C HETATM 1935 O GLU C 2 10.504 -25.545 11.878 1.00 32.13 C O HETATM 1936 N CYS C 3 12.389 -26.752 11.542 1.00 26.87 C N HETATM 1937 CA CYS C 3 13.242 -25.892 12.357 1.00 22.84 C C HETATM 1938 C CYS C 3 14.376 -25.240 11.574 1.00 20.78 C C HETATM 1939 O CYS C 3 15.477 -25.028 12.094 1.00 18.59 C O HETATM 1940 CB CYS C 3 13.777 -26.683 13.548 1.00 24.42 C C HETATM 1941 SG CYS C 3 12.439 -27.392 14.551 1.00 24.26 C S HETATM 1942 N SER C 4 14.075 -24.880 10.330 1.00 18.67 C N HETATM 1943 CA SER C 4 15.033 -24.233 9.445 1.00 17.86 C C HETATM 1944 CB SER C 4 15.979 -25.262 8.803 1.00 19.86 C C HETATM 1945 OG SER C 4 15.290 -26.125 7.914 1.00 19.55 C O HETATM 1946 C SER C 4 14.324 -23.443 8.351 1.00 17.33 C C HETATM 1947 O SER C 4 13.142 -23.672 8.071 1.00 16.54 C O HETATM 1948 N VAL C 5 15.052 -22.498 7.762 1.00 16.79 C N HETATM 1949 CA VAL C 5 14.544 -21.678 6.663 1.00 14.93 C C HETATM 1950 CB VAL C 5 13.776 -20.401 7.176 1.00 15.31 C C HETATM 1951 CG1 VAL C 5 14.708 -19.423 7.885 1.00 14.55 C C HETATM 1952 CG2 VAL C 5 13.010 -19.733 6.032 1.00 15.36 C C HETATM 1953 C VAL C 5 15.700 -21.322 5.720 1.00 15.28 C C HETATM 1954 O VAL C 5 16.833 -21.108 6.166 1.00 15.87 C O HETATM 1955 N ASP C 6 15.417 -21.338 4.417 1.00 14.01 C N HETATM 1956 CA ASP C 6 16.404 -20.999 3.392 1.00 14.78 C C HETATM 1957 CB ASP C 6 16.303 -21.952 2.194 1.00 17.41 C C HETATM 1958 CG ASP C 6 16.815 -23.361 2.503 1.00 18.81 C C HETATM 1959 OD1 ASP C 6 17.153 -23.659 3.672 1.00 15.29 C O HETATM 1960 OD2 ASP C 6 16.877 -24.176 1.559 1.00 20.34 C O HETATM 1961 C ASP C 6 16.168 -19.557 2.956 1.00 15.28 C C HETATM 1962 O ASP C 6 15.113 -19.231 2.396 1.00 15.73 C O HETATM 1963 N ILE C 7 17.119 -18.690 3.298 1.00 13.89 C N HETATM 1964 CA ILE C 7 17.047 -17.264 2.981 1.00 14.81 C C HETATM 1965 CB ILE C 7 17.408 -16.374 4.222 1.00 15.61 C C HETATM 1966 CG2 ILE C 7 17.198 -14.887 3.917 1.00 15.95 C C HETATM 1967 CG1 ILE C 7 16.578 -16.764 5.453 1.00 18.00 C C HETATM 1968 CD1 ILE C 7 15.098 -16.661 5.298 1.00 18.94 C C HETATM 1969 C ILE C 7 17.956 -16.886 1.808 1.00 15.17 C C HETATM 1970 O ILE C 7 19.102 -17.313 1.737 1.00 14.27 C O HETATM 1971 N GLN C 8 17.417 -16.090 0.887 1.00 13.98 C N HETATM 1972 CA GLN C 8 18.160 -15.626 -0.283 1.00 15.50 C C HETATM 1973 CB GLN C 8 17.492 -16.103 -1.583 1.00 17.64 C C HETATM 1974 CG GLN C 8 17.460 -17.618 -1.805 1.00 20.00 C C HETATM 1975 CD GLN C 8 16.766 -18.044 -3.102 1.00 24.91 C C HETATM 1976 OE1 GLN C 8 16.705 -19.237 -3.414 1.00 26.03 C O HETATM 1977 NE2 GLN C 8 16.246 -17.079 -3.859 1.00 25.07 C N HETATM 1978 C GLN C 8 18.207 -14.101 -0.298 1.00 13.78 C C HETATM 1979 O GLN C 8 17.208 -13.446 -0.010 1.00 14.47 C O HETATM 1980 N GLY C 9 19.382 -13.559 -0.605 1.00 13.19 C N HETATM 1981 CA GLY C 9 19.581 -12.124 -0.718 1.00 12.90 C C HETATM 1982 C GLY C 9 20.112 -11.961 -2.132 1.00 13.35 C C HETATM 1983 O GLY C 9 21.151 -12.541 -2.453 1.00 13.58 C O HETATM 1984 N ASN C 10 19.442 -11.167 -2.965 1.00 13.11 C N HETATM 1985 CA ASN C 10 19.850 -11.012 -4.367 1.00 13.83 C C HETATM 1986 CB ASN C 10 18.654 -11.300 -5.300 1.00 14.13 C C HETATM 1987 CG ASN C 10 17.477 -10.333 -5.106 1.00 15.60 C C HETATM 1988 OD1 ASN C 10 17.620 -9.235 -4.562 1.00 16.62 C O HETATM 1989 ND2 ASN C 10 16.306 -10.748 -5.572 1.00 16.49 C N HETATM 1990 C ASN C 10 20.572 -9.732 -4.796 1.00 14.20 C C HETATM 1991 O ASN C 10 20.987 -8.926 -3.963 1.00 15.09 C O HETATM 1992 N ASP C 11 20.701 -9.564 -6.115 1.00 14.93 C N HETATM 1993 CA ASP C 11 21.350 -8.406 -6.729 1.00 15.57 C C HETATM 1994 CB ASP C 11 21.752 -8.732 -8.171 1.00 16.92 C C HETATM 1995 CG ASP C 11 23.043 -9.535 -8.260 1.00 18.74 C C HETATM 1996 OD1 ASP C 11 23.694 -9.797 -7.222 1.00 17.46 C O HETATM 1997 OD2 ASP C 11 23.432 -9.882 -9.393 1.00 18.56 C O HETATM 1998 C ASP C 11 20.499 -7.140 -6.705 1.00 16.36 C C HETATM 1999 O ASP C 11 21.004 -6.037 -6.940 1.00 15.06 C O HETATM 2000 N GLN C 12 19.214 -7.308 -6.398 1.00 15.76 C N HETATM 2001 CA GLN C 12 18.271 -6.198 -6.340 1.00 16.24 C C HETATM 2002 CB GLN C 12 16.956 -6.589 -7.020 1.00 20.42 C C HETATM 2003 CG GLN C 12 17.063 -6.826 -8.527 1.00 24.91 C C HETATM 2004 CD GLN C 12 17.210 -5.551 -9.359 1.00 29.80 C C HETATM 2005 OE1 GLN C 12 17.627 -5.612 -10.516 1.00 32.62 C O HETATM 2006 NE2 GLN C 12 16.821 -4.404 -8.798 1.00 30.90 C N HETATM 2007 C GLN C 12 18.018 -5.685 -4.920 1.00 16.07 C C HETATM 2008 O GLN C 12 17.026 -4.987 -4.666 1.00 15.35 C O HETATM 2009 N MET C 13 18.930 -6.027 -4.005 1.00 13.75 C N HETATM 2010 CA MET C 13 18.889 -5.607 -2.598 1.00 13.34 C C HETATM 2011 CB MET C 13 19.144 -4.084 -2.511 1.00 13.41 C C HETATM 2012 CG MET C 13 19.517 -3.555 -1.148 1.00 13.34 C C HETATM 2013 SD MET C 13 19.864 -1.789 -1.108 1.00 14.73 C S HETATM 2014 CE MET C 13 18.217 -1.138 -0.946 1.00 15.40 C C HETATM 2015 C MET C 13 17.590 -6.026 -1.872 1.00 12.29 C C HETATM 2016 O MET C 13 16.954 -5.224 -1.187 1.00 13.04 C O HETATM 2017 N GLN C 14 17.204 -7.292 -2.029 1.00 12.34 C N HETATM 2018 CA GLN C 14 15.987 -7.826 -1.399 1.00 11.95 C C HETATM 2019 CB GLN C 14 14.805 -7.837 -2.390 1.00 12.64 C C HETATM 2020 CG GLN C 14 14.163 -6.485 -2.689 1.00 15.48 C C HETATM 2021 CD GLN C 14 12.951 -6.590 -3.592 1.00 17.72 C C HETATM 2022 OE1 GLN C 14 12.061 -7.417 -3.370 1.00 20.55 C O HETATM 2023 NE2 GLN C 14 12.895 -5.733 -4.603 1.00 18.06 C N HETATM 2024 C GLN C 14 16.165 -9.243 -0.870 1.00 12.92 C C HETATM 2025 O GLN C 14 16.967 -10.013 -1.404 1.00 12.05 C O HETATM 2026 N PHE C 15 15.452 -9.553 0.218 1.00 11.17 C N HETATM 2027 CA PHE C 15 15.444 -10.891 0.810 1.00 11.29 C C HETATM 2028 CB PHE C 15 15.217 -10.855 2.333 1.00 10.41 C C HETATM 2029 CG PHE C 15 16.479 -10.720 3.167 1.00 10.89 C C HETATM 2030 CD1 PHE C 15 17.641 -11.469 2.884 1.00 11.57 C C HETATM 2031 CD2 PHE C 15 16.485 -9.869 4.287 1.00 11.02 C C HETATM 2032 CE1 PHE C 15 18.801 -11.370 3.714 1.00 10.14 C C HETATM 2033 CE2 PHE C 15 17.630 -9.755 5.127 1.00 9.76 C C HETATM 2034 CZ PHE C 15 18.791 -10.507 4.840 1.00 12.24 C C HETATM 2035 C PHE C 15 14.265 -11.626 0.164 1.00 13.10 C C HETATM 2036 O PHE C 15 13.348 -10.985 -0.375 1.00 14.09 C O HETATM 2037 N ASN C 16 14.272 -12.955 0.249 1.00 12.36 C N HETATM 2038 CA ASN C 16 13.198 -13.773 -0.318 1.00 13.11 C C HETATM 2039 CB ASN C 16 13.718 -15.164 -0.709 1.00 11.88 C C HETATM 2040 CG ASN C 16 14.131 -15.998 0.489 1.00 12.92 C C HETATM 2041 OD1 ASN C 16 14.730 -15.491 1.428 1.00 16.31 C O HETATM 2042 ND2 ASN C 16 13.805 -17.285 0.457 1.00 18.36 C N HETATM 2043 C ASN C 16 11.959 -13.883 0.584 1.00 11.88 C C HETATM 2044 O ASN C 16 10.927 -14.416 0.174 1.00 13.25 C O HETATM 2045 N THR C 17 12.089 -13.411 1.820 1.00 12.79 C N HETATM 2046 CA THR C 17 10.994 -13.417 2.787 1.00 13.34 C C HETATM 2047 CB THR C 17 10.941 -14.744 3.620 1.00 14.07 C C HETATM 2048 OG1 THR C 17 9.839 -14.706 4.538 1.00 12.90 C O HETATM 2049 CG2 THR C 17 12.218 -14.960 4.402 1.00 15.09 C C HETATM 2050 C THR C 17 11.128 -12.208 3.711 1.00 16.02 C C HETATM 2051 O THR C 17 12.231 -11.683 3.907 1.00 16.07 C O HETATM 2052 N ASN C 18 9.994 -11.743 4.232 1.00 14.69 C N HETATM 2053 CA ASN C 18 9.969 -10.607 5.145 1.00 15.41 C C HETATM 2054 CB ASN C 18 9.283 -9.394 4.495 1.00 17.65 C C HETATM 2055 CG ASN C 18 10.061 -8.848 3.306 1.00 18.03 C C HETATM 2056 OD1 ASN C 18 11.136 -8.259 3.459 1.00 20.67 C O HETATM 2057 ND2 ASN C 18 9.541 -9.084 2.112 1.00 17.37 C N HETATM 2058 C ASN C 18 9.301 -10.980 6.474 1.00 13.96 C C HETATM 2059 O ASN C 18 8.989 -10.110 7.293 1.00 13.90 C O HETATM 2060 N ALA C 19 9.105 -12.281 6.685 1.00 14.29 C N HETATM 2061 CA ALA C 19 8.489 -12.801 7.910 1.00 14.82 C C HETATM 2062 CB ALA C 19 6.957 -12.620 7.876 1.00 16.03 C C HETATM 2063 C ALA C 19 8.847 -14.267 8.120 1.00 15.74 C C HETATM 2064 O ALA C 19 8.517 -15.121 7.292 1.00 15.56 C O HETATM 2065 N ILE C 20 9.571 -14.532 9.209 1.00 16.85 C N HETATM 2066 CA ILE C 20 10.000 -15.882 9.582 1.00 17.48 C C HETATM 2067 CB ILE C 20 11.558 -15.954 9.839 1.00 18.85 C C HETATM 2068 CG2 ILE C 20 11.963 -17.309 10.446 1.00 17.90 C C HETATM 2069 CG1 ILE C 20 12.336 -15.765 8.534 1.00 19.32 C C HETATM 2070 CD1 ILE C 20 13.850 -15.594 8.726 1.00 20.94 C C HETATM 2071 C ILE C 20 9.268 -16.296 10.858 1.00 19.31 C C HETATM 2072 O ILE C 20 9.127 -15.498 11.791 1.00 18.59 C O HETATM 2073 N THR C 21 8.806 -17.546 10.876 1.00 19.23 C N HETATM 2074 CA THR C 21 8.122 -18.119 12.029 1.00 20.61 C C HETATM 2075 CB THR C 21 6.695 -18.634 11.676 1.00 22.09 C C HETATM 2076 OG1 THR C 21 6.771 -19.616 10.632 1.00 26.62 C O HETATM 2077 CG2 THR C 21 5.800 -17.487 11.223 1.00 22.15 C C HETATM 2078 C THR C 21 8.960 -19.271 12.577 1.00 19.11 C C HETATM 2079 O THR C 21 9.372 -20.163 11.828 1.00 17.19 C O HETATM 2080 N VAL C 22 9.283 -19.192 13.866 1.00 19.00 C N HETATM 2081 CA VAL C 22 10.055 -20.232 14.552 1.00 20.95 C C HETATM 2082 CB VAL C 22 11.178 -19.624 15.457 1.00 21.02 C C HETATM 2083 CG1 VAL C 22 11.963 -20.721 16.173 1.00 19.43 C C HETATM 2084 CG2 VAL C 22 12.133 -18.783 14.625 1.00 19.10 C C HETATM 2085 C VAL C 22 9.040 -20.987 15.414 1.00 23.14 C C HETATM 2086 O VAL C 22 8.355 -20.378 16.239 1.00 23.46 C O HETATM 2087 N ASP C 23 8.940 -22.300 15.209 1.00 25.69 C N HETATM 2088 CA ASP C 23 8.005 -23.136 15.966 1.00 29.52 C C HETATM 2089 CB ASP C 23 7.776 -24.476 15.251 1.00 30.93 C C HETATM 2090 CG ASP C 23 6.463 -25.145 15.652 1.00 34.90 C C HETATM 2091 OD1 ASP C 23 6.331 -25.569 16.822 1.00 36.29 C O HETATM 2092 OD2 ASP C 23 5.560 -25.248 14.794 1.00 36.74 C O HETATM 2093 C ASP C 23 8.497 -23.369 17.399 1.00 30.25 C C HETATM 2094 O ASP C 23 9.693 -23.562 17.630 1.00 28.76 C O HETATM 2095 N LYS C 24 7.547 -23.369 18.339 1.00 32.75 C N HETATM 2096 CA LYS C 24 7.788 -23.567 19.776 1.00 34.54 C C HETATM 2097 CB LYS C 24 6.460 -23.414 20.539 1.00 37.62 C C HETATM 2098 CG LYS C 24 6.590 -23.178 22.049 1.00 41.38 C C HETATM 2099 CD LYS C 24 5.260 -23.345 22.800 1.00 43.92 C C HETATM 2100 CE LYS C 24 4.389 -22.083 22.804 1.00 44.90 C C HETATM 2101 NZ LYS C 24 3.758 -21.769 21.493 1.00 46.77 C N HETATM 2102 C LYS C 24 8.429 -24.923 20.107 1.00 33.67 C C HETATM 2103 O LYS C 24 9.234 -25.021 21.039 1.00 33.74 C O HETATM 2104 N SER C 25 8.101 -25.938 19.304 1.00 32.92 C N HETATM 2105 CA SER C 25 8.608 -27.304 19.474 1.00 32.30 C C HETATM 2106 CB SER C 25 7.737 -28.298 18.693 1.00 33.51 C C HETATM 2107 OG SER C 25 7.760 -28.033 17.300 1.00 37.00 C O HETATM 2108 C SER C 25 10.081 -27.480 19.093 1.00 29.88 C C HETATM 2109 O SER C 25 10.703 -28.483 19.452 1.00 30.18 C O HETATM 2110 N CYS C 26 10.625 -26.504 18.364 1.00 27.94 C N HETATM 2111 CA CYS C 26 12.024 -26.517 17.936 1.00 25.76 C C HETATM 2112 C CYS C 26 12.950 -26.212 19.106 1.00 24.81 C C HETATM 2113 O CYS C 26 12.662 -25.329 19.916 1.00 24.87 C O HETATM 2114 CB CYS C 26 12.272 -25.467 16.847 1.00 25.53 C C HETATM 2115 SG CYS C 26 11.444 -25.772 15.256 1.00 25.52 C S HETATM 2116 N LYS C 27 14.031 -26.982 19.213 1.00 24.24 C N HETATM 2117 CA LYS C 27 15.031 -26.777 20.258 1.00 23.81 C C HETATM 2118 CB LYS C 27 15.736 -28.087 20.622 1.00 26.88 C C HETATM 2119 CG LYS C 27 14.894 -29.062 21.433 1.00 30.90 C C HETATM 2120 CD LYS C 27 15.705 -30.296 21.796 1.00 33.41 C C HETATM 2121 CE LYS C 27 14.887 -31.291 22.604 1.00 35.49 C C HETATM 2122 NZ LYS C 27 15.672 -32.524 22.912 1.00 36.88 C N HETATM 2123 C LYS C 27 16.044 -25.794 19.697 1.00 21.89 C C HETATM 2124 O LYS C 27 16.566 -24.945 20.414 1.00 21.47 C O HETATM 2125 N GLN C 28 16.305 -25.927 18.395 1.00 20.33 C N HETATM 2126 CA GLN C 28 17.244 -25.078 17.664 1.00 19.63 C C HETATM 2127 CB GLN C 28 18.540 -25.838 17.355 1.00 19.64 C C HETATM 2128 CG GLN C 28 19.261 -26.381 18.585 1.00 21.73 C C HETATM 2129 CD GLN C 28 20.709 -26.706 18.341 1.00 21.15 C C HETATM 2130 OE1 GLN C 28 21.065 -27.348 17.352 1.00 23.32 C O HETATM 2131 NE2 GLN C 28 21.561 -26.274 19.260 1.00 24.54 C N HETATM 2132 C GLN C 28 16.616 -24.598 16.355 1.00 18.59 C C HETATM 2133 O GLN C 28 15.659 -25.199 15.869 1.00 18.47 C O HETATM 2134 N PHE C 29 17.119 -23.483 15.828 1.00 17.52 C N HETATM 2135 CA PHE C 29 16.627 -22.926 14.564 1.00 15.64 C C HETATM 2136 CB PHE C 29 15.758 -21.682 14.792 1.00 15.92 C C HETATM 2137 CG PHE C 29 14.964 -21.267 13.575 1.00 15.97 C C HETATM 2138 CD1 PHE C 29 13.852 -22.021 13.163 1.00 16.24 C C HETATM 2139 CD2 PHE C 29 15.350 -20.149 12.810 1.00 15.71 C C HETATM 2140 CE1 PHE C 29 13.123 -21.679 11.990 1.00 17.52 C C HETATM 2141 CE2 PHE C 29 14.636 -19.789 11.634 1.00 15.65 C C HETATM 2142 CZ PHE C 29 13.516 -20.565 11.226 1.00 15.27 C C HETATM 2143 C PHE C 29 17.817 -22.575 13.682 1.00 14.22 C C HETATM 2144 O PHE C 29 18.766 -21.951 14.144 1.00 13.29 C O HETATM 2145 N THR C 30 17.707 -22.910 12.399 1.00 13.39 C N HETATM 2146 CA THR C 30 18.774 -22.665 11.433 1.00 13.40 C C HETATM 2147 CB THR C 30 19.342 -24.005 10.897 1.00 15.42 C C HETATM 2148 OG1 THR C 30 19.779 -24.801 12.003 1.00 13.57 C O HETATM 2149 CG2 THR C 30 20.541 -23.785 9.948 1.00 15.04 C C HETATM 2150 C THR C 30 18.350 -21.798 10.255 1.00 13.14 C C HETATM 2151 O THR C 30 17.268 -21.960 9.701 1.00 13.16 C O HETATM 2152 N VAL C 31 19.228 -20.873 9.889 1.00 12.14 C N HETATM 2153 CA VAL C 31 19.011 -19.989 8.752 1.00 12.85 C C HETATM 2154 CB VAL C 31 19.038 -18.500 9.189 1.00 12.81 C C HETATM 2155 CG1 VAL C 31 19.190 -17.568 7.985 1.00 12.20 C C HETATM 2156 CG2 VAL C 31 17.761 -18.172 9.923 1.00 12.65 C C HETATM 2157 C VAL C 31 20.135 -20.293 7.766 1.00 11.46 C C HETATM 2158 O VAL C 31 21.306 -20.192 8.123 1.00 13.03 C O HETATM 2159 N ASN C 32 19.763 -20.708 6.555 1.00 10.79 C N HETATM 2160 CA ASN C 32 20.722 -21.025 5.494 1.00 10.95 C C HETATM 2161 CB ASN C 32 20.400 -22.370 4.833 1.00 11.07 C C HETATM 2162 CG ASN C 32 20.311 -23.509 5.828 1.00 14.70 C C HETATM 2163 OD1 ASN C 32 21.282 -23.829 6.518 1.00 13.91 C O HETATM 2164 ND2 ASN C 32 19.136 -24.127 5.910 1.00 14.77 C N HETATM 2165 C ASN C 32 20.643 -19.905 4.463 1.00 13.21 C C HETATM 2166 O ASN C 32 19.681 -19.827 3.688 1.00 13.76 C O HETATM 2167 N LEU C 33 21.631 -19.014 4.506 1.00 12.53 C N HETATM 2168 CA LEU C 33 21.707 -17.866 3.609 1.00 12.35 C C HETATM 2169 CB LEU C 33 22.315 -16.659 4.341 1.00 11.96 C C HETATM 2170 CG LEU C 33 22.373 -15.301 3.622 1.00 11.89 C C HETATM 2171 CD1 LEU C 33 20.995 -14.723 3.411 1.00 12.24 C C HETATM 2172 CD2 LEU C 33 23.234 -14.356 4.409 1.00 11.86 C C HETATM 2173 C LEU C 33 22.492 -18.141 2.328 1.00 13.39 C C HETATM 2174 O LEU C 33 23.576 -18.722 2.365 1.00 11.95 C O HETATM 2175 N SER C 34 21.908 -17.746 1.199 1.00 12.19 C N HETATM 2176 CA SER C 34 22.547 -17.885 -0.104 1.00 14.08 C C HETATM 2177 CB SER C 34 21.913 -19.006 -0.939 1.00 14.69 C C HETATM 2178 OG SER C 34 20.566 -18.725 -1.255 1.00 13.83 C O HETATM 2179 C SER C 34 22.434 -16.536 -0.806 1.00 14.17 C C HETATM 2180 O SER C 34 21.716 -15.639 -0.337 1.00 12.20 C O HETATM 2181 N HIS C 35 23.143 -16.391 -1.922 1.00 12.92 C N HETATM 2182 CA HIS C 35 23.140 -15.137 -2.657 1.00 15.50 C C HETATM 2183 CB HIS C 35 24.379 -14.303 -2.257 1.00 13.59 C C HETATM 2184 CG HIS C 35 24.394 -12.889 -2.779 1.00 15.79 C C HETATM 2185 CD2 HIS C 35 24.990 -11.776 -2.292 1.00 14.64 C C HETATM 2186 ND1 HIS C 35 23.801 -12.511 -3.966 1.00 15.12 C N HETATM 2187 CE1 HIS C 35 24.031 -11.229 -4.187 1.00 14.19 C C HETATM 2188 NE2 HIS C 35 24.751 -10.759 -3.184 1.00 16.74 C N HETATM 2189 C HIS C 35 23.049 -15.317 -4.172 1.00 15.51 C C HETATM 2190 O HIS C 35 24.080 -15.406 -4.851 1.00 16.13 C O HETATM 2191 N PRO C 36 21.813 -15.386 -4.726 1.00 16.67 C N HETATM 2192 CD PRO C 36 20.513 -15.600 -4.063 1.00 17.02 C C HETATM 2193 CA PRO C 36 21.678 -15.535 -6.182 1.00 18.45 C C HETATM 2194 CB PRO C 36 20.186 -15.834 -6.371 1.00 19.57 C C HETATM 2195 CG PRO C 36 19.535 -15.263 -5.152 1.00 20.36 C C HETATM 2196 C PRO C 36 22.106 -14.232 -6.874 1.00 19.55 C C HETATM 2197 O PRO C 36 22.145 -13.169 -6.242 1.00 18.54 C O HETATM 2198 N GLY C 37 22.490 -14.340 -8.141 1.00 19.61 C N HETATM 2199 CA GLY C 37 22.933 -13.175 -8.883 1.00 20.42 C C HETATM 2200 C GLY C 37 24.407 -13.268 -9.223 1.00 21.22 C C HETATM 2201 O GLY C 37 25.022 -14.316 -9.013 1.00 21.08 C O HETATM 2202 N ASN C 38 24.983 -12.162 -9.697 1.00 22.51 C N HETATM 2203 CA ASN C 38 26.391 -12.129 -10.105 1.00 22.93 C C HETATM 2204 CB ASN C 38 26.499 -12.206 -11.639 1.00 27.12 C C HETATM 2205 CG ASN C 38 25.629 -11.180 -12.345 1.00 30.28 C C HETATM 2206 OD1 ASN C 38 26.056 -10.054 -12.601 1.00 33.68 C O HETATM 2207 ND2 ASN C 38 24.395 -11.567 -12.654 1.00 33.11 C N HETATM 2208 C ASN C 38 27.259 -10.984 -9.568 1.00 22.00 C C HETATM 2209 O ASN C 38 28.446 -10.907 -9.900 1.00 22.03 C O HETATM 2210 N LEU C 39 26.698 -10.137 -8.704 1.00 20.74 C N HETATM 2211 CA LEU C 39 27.444 -9.002 -8.145 1.00 21.72 C C HETATM 2212 CB LEU C 39 26.495 -7.857 -7.784 1.00 20.87 C C HETATM 2213 CG LEU C 39 25.843 -7.050 -8.909 1.00 20.07 C C HETATM 2214 CD1 LEU C 39 24.777 -6.200 -8.282 1.00 18.79 C C HETATM 2215 CD2 LEU C 39 26.840 -6.176 -9.676 1.00 21.06 C C HETATM 2216 C LEU C 39 28.334 -9.355 -6.946 1.00 22.24 C C HETATM 2217 O LEU C 39 27.926 -10.132 -6.081 1.00 24.23 C O HETATM 2218 N PRO C 40 29.569 -8.796 -6.885 1.00 22.89 C N HETATM 2219 CD PRO C 40 30.260 -8.035 -7.946 1.00 23.87 C C HETATM 2220 CA PRO C 40 30.501 -9.069 -5.779 1.00 22.92 C C HETATM 2221 CB PRO C 40 31.814 -8.451 -6.273 1.00 24.32 C C HETATM 2222 CG PRO C 40 31.371 -7.375 -7.189 1.00 24.18 C C HETATM 2223 C PRO C 40 30.106 -8.552 -4.389 1.00 23.18 C C HETATM 2224 O PRO C 40 29.212 -7.714 -4.250 1.00 22.18 C O HETATM 2225 N LYS C 41 30.821 -9.048 -3.379 1.00 23.18 C N HETATM 2226 CA LYS C 41 30.603 -8.722 -1.970 1.00 22.92 C C HETATM 2227 CB LYS C 41 31.574 -9.524 -1.091 1.00 24.41 C C HETATM 2228 CG LYS C 41 31.117 -9.723 0.358 1.00 27.99 C C HETATM 2229 CD LYS C 41 32.285 -9.914 1.338 1.00 30.64 C C HETATM 2230 CE LYS C 41 33.027 -11.226 1.148 1.00 33.24 C C HETATM 2231 NZ LYS C 41 34.088 -11.391 2.178 1.00 32.57 C N HETATM 2232 C LYS C 41 30.698 -7.242 -1.611 1.00 21.55 C C HETATM 2233 O LYS C 41 29.898 -6.753 -0.819 1.00 21.05 C O HETATM 2234 N ASN C 42 31.633 -6.527 -2.235 1.00 21.33 C N HETATM 2235 CA ASN C 42 31.837 -5.107 -1.951 1.00 19.59 C C HETATM 2236 CB ASN C 42 33.193 -4.630 -2.504 1.00 20.21 C C HETATM 2237 CG ASN C 42 33.173 -4.393 -4.007 1.00 20.55 C C HETATM 2238 OD1 ASN C 42 33.209 -5.332 -4.802 1.00 21.84 C O HETATM 2239 ND2 ASN C 42 33.108 -3.125 -4.398 1.00 20.35 C N HETATM 2240 C ASN C 42 30.709 -4.180 -2.416 1.00 18.68 C C HETATM 2241 O ASN C 42 30.558 -3.082 -1.886 1.00 18.43 C O HETATM 2242 N VAL C 43 29.951 -4.612 -3.424 1.00 18.80 C N HETATM 2243 CA VAL C 43 28.855 -3.797 -3.943 1.00 19.57 C C HETATM 2244 CB VAL C 43 28.873 -3.682 -5.512 1.00 22.30 C C HETATM 2245 CG1 VAL C 43 30.221 -3.201 -6.002 1.00 23.91 C C HETATM 2246 CG2 VAL C 43 28.531 -4.993 -6.181 1.00 24.75 C C HETATM 2247 C VAL C 43 27.471 -4.249 -3.480 1.00 18.37 C C HETATM 2248 O VAL C 43 26.601 -3.411 -3.238 1.00 17.09 C O HETATM 2249 N MET C 44 27.298 -5.564 -3.308 1.00 17.65 C N HETATM 2250 CA MET C 44 26.006 -6.137 -2.929 1.00 15.44 C C HETATM 2251 CB MET C 44 25.264 -6.547 -4.218 1.00 14.98 C C HETATM 2252 CG MET C 44 23.758 -6.793 -4.103 1.00 14.87 C C HETATM 2253 SD MET C 44 22.822 -5.487 -3.303 1.00 15.50 C S HETATM 2254 CE MET C 44 22.787 -4.265 -4.575 1.00 15.31 C C HETATM 2255 C MET C 44 26.111 -7.311 -1.939 1.00 15.12 C C HETATM 2256 O MET C 44 25.398 -8.310 -2.056 1.00 13.98 C O HETATM 2257 N GLY C 45 26.983 -7.168 -0.943 1.00 15.47 C N HETATM 2258 CA GLY C 45 27.152 -8.212 0.061 1.00 15.58 C C HETATM 2259 C GLY C 45 25.986 -8.233 1.029 1.00 15.19 C C HETATM 2260 O GLY C 45 25.410 -7.184 1.321 1.00 15.18 C O HETATM 2261 N HIS C 46 25.591 -9.427 1.468 1.00 13.35 C N HETATM 2262 CA HIS C 46 24.478 -9.563 2.407 1.00 11.83 C C HETATM 2263 CB HIS C 46 23.245 -10.187 1.752 1.00 10.21 C C HETATM 2264 CG HIS C 46 22.796 -9.509 0.502 1.00 10.32 C C HETATM 2265 CD2 HIS C 46 22.569 -10.005 -0.732 1.00 11.48 C C HETATM 2266 ND1 HIS C 46 22.475 -8.171 0.443 1.00 10.96 C N HETATM 2267 CE1 HIS C 46 22.061 -7.879 -0.778 1.00 9.27 C C HETATM 2268 NE2 HIS C 46 22.108 -8.974 -1.509 1.00 11.19 C N HETATM 2269 C HIS C 46 24.795 -10.442 3.591 1.00 11.17 C C HETATM 2270 O HIS C 46 25.610 -11.358 3.498 1.00 13.09 C O HETATM 2271 N ASN C 47 24.136 -10.139 4.706 1.00 12.40 C N HETATM 2272 CA ASN C 47 24.239 -10.931 5.925 1.00 11.17 C C HETATM 2273 CB ASN C 47 25.278 -10.386 6.941 1.00 12.35 C C HETATM 2274 CG ASN C 47 25.051 -8.929 7.357 1.00 13.55 C C HETATM 2275 OD1 ASN C 47 24.039 -8.314 7.045 1.00 13.30 C O HETATM 2276 ND2 ASN C 47 26.012 -8.384 8.098 1.00 12.86 C N HETATM 2277 C ASN C 47 22.838 -11.046 6.517 1.00 10.85 C C HETATM 2278 O ASN C 47 21.916 -10.372 6.056 1.00 11.85 C O HETATM 2279 N TRP C 48 22.660 -11.986 7.441 1.00 11.78 C N HETATM 2280 CA TRP C 48 21.381 -12.179 8.114 1.00 11.16 C C HETATM 2281 CB TRP C 48 20.844 -13.601 7.875 1.00 11.77 C C HETATM 2282 CG TRP C 48 19.469 -13.858 8.458 1.00 13.07 C C HETATM 2283 CD2 TRP C 48 19.164 -14.344 9.778 1.00 11.80 C C HETATM 2284 CE2 TRP C 48 17.751 -14.414 9.879 1.00 10.40 C C HETATM 2285 CE3 TRP C 48 19.950 -14.729 10.891 1.00 12.40 C C HETATM 2286 CD1 TRP C 48 18.270 -13.668 7.833 1.00 12.87 C C HETATM 2287 NE1 TRP C 48 17.235 -13.999 8.680 1.00 11.77 C N HETATM 2288 CZ2 TRP C 48 17.091 -14.851 11.056 1.00 9.74 C C HETATM 2289 CZ3 TRP C 48 19.297 -15.170 12.071 1.00 12.35 C C HETATM 2290 CH2 TRP C 48 17.875 -15.223 12.136 1.00 9.79 C C HETATM 2291 C TRP C 48 21.721 -11.942 9.582 1.00 10.90 C C HETATM 2292 O TRP C 48 22.513 -12.673 10.160 1.00 10.61 C O HETATM 2293 N VAL C 49 21.165 -10.878 10.153 1.00 11.99 C N HETATM 2294 CA VAL C 49 21.424 -10.505 11.547 1.00 11.70 C C HETATM 2295 CB VAL C 49 22.137 -9.120 11.624 1.00 11.31 C C HETATM 2296 CG1 VAL C 49 22.541 -8.783 13.059 1.00 10.04 C C HETATM 2297 CG2 VAL C 49 23.376 -9.096 10.729 1.00 11.24 C C HETATM 2298 C VAL C 49 20.100 -10.449 12.298 1.00 12.47 C C HETATM 2299 O VAL C 49 19.137 -9.883 11.793 1.00 10.75 C O HETATM 2300 N LEU C 50 20.084 -11.001 13.513 1.00 11.28 C N HETATM 2301 CA LEU C 50 18.885 -11.036 14.356 1.00 10.23 C C HETATM 2302 CB LEU C 50 18.522 -12.489 14.699 1.00 11.82 C C HETATM 2303 CG LEU C 50 17.259 -12.787 15.523 1.00 11.77 C C HETATM 2304 CD1 LEU C 50 16.020 -12.390 14.736 1.00 13.48 C C HETATM 2305 CD2 LEU C 50 17.220 -14.256 15.902 1.00 11.67 C C HETATM 2306 C LEU C 50 19.039 -10.251 15.654 1.00 12.20 C C HETATM 2307 O LEU C 50 20.042 -10.382 16.353 1.00 11.87 C O HETATM 2308 N SER C 51 18.014 -9.462 15.974 1.00 13.17 C N HETATM 2309 CA SER C 51 17.968 -8.671 17.201 1.00 12.36 C C HETATM 2310 CB SER C 51 18.785 -7.366 17.060 1.00 14.54 C C HETATM 2311 OG SER C 51 18.089 -6.347 16.355 1.00 12.80 C O HETATM 2312 C SER C 51 16.513 -8.351 17.502 1.00 13.06 C C HETATM 2313 O SER C 51 15.614 -8.713 16.728 1.00 11.15 C O HETATM 2314 N THR C 52 16.281 -7.662 18.623 1.00 13.34 C N HETATM 2315 CA THR C 52 14.932 -7.238 18.990 1.00 14.33 C C HETATM 2316 CB THR C 52 14.841 -6.749 20.459 1.00 13.17 C C HETATM 2317 OG1 THR C 52 15.694 -5.615 20.645 1.00 15.65 C O HETATM 2318 CG2 THR C 52 15.249 -7.852 21.433 1.00 15.69 C C HETATM 2319 C THR C 52 14.600 -6.070 18.051 1.00 14.90 C C HETATM 2320 O THR C 52 15.516 -5.426 17.520 1.00 14.14 C O HETATM 2321 N ALA C 53 13.311 -5.804 17.851 1.00 14.53 C N HETATM 2322 CA ALA C 53 12.855 -4.714 16.981 1.00 16.95 C C HETATM 2323 CB ALA C 53 11.332 -4.676 16.935 1.00 16.84 C C HETATM 2324 C ALA C 53 13.410 -3.351 17.380 1.00 18.17 C C HETATM 2325 O ALA C 53 13.841 -2.577 16.523 1.00 17.50 C O HETATM 2326 N ALA C 54 13.496 -3.134 18.693 1.00 18.79 C N HETATM 2327 CA ALA C 54 13.998 -1.898 19.290 1.00 18.23 C C HETATM 2328 CB ALA C 54 13.618 -1.854 20.770 1.00 20.95 C C HETATM 2329 C ALA C 54 15.505 -1.686 19.133 1.00 17.75 C C HETATM 2330 O ALA C 54 15.975 -0.546 19.134 1.00 17.42 C O HETATM 2331 N ASP C 55 16.249 -2.788 19.007 1.00 17.09 C N HETATM 2332 CA ASP C 55 17.703 -2.744 18.855 1.00 16.10 C C HETATM 2333 CB ASP C 55 18.354 -3.965 19.531 1.00 14.65 C C HETATM 2334 CG ASP C 55 18.402 -3.859 21.053 1.00 16.71 C C HETATM 2335 OD1 ASP C 55 18.289 -2.741 21.604 1.00 17.88 C O HETATM 2336 OD2 ASP C 55 18.587 -4.912 21.703 1.00 16.40 C O HETATM 2337 C ASP C 55 18.195 -2.671 17.409 1.00 15.01 C C HETATM 2338 O ASP C 55 19.367 -2.360 17.181 1.00 15.40 C O HETATM 2339 N MET C 56 17.308 -2.925 16.444 1.00 14.33 C N HETATM 2340 CA MET C 56 17.673 -2.929 15.020 1.00 15.24 C C HETATM 2341 CB MET C 56 16.447 -3.196 14.131 1.00 16.15 C C HETATM 2342 CG MET C 56 16.775 -3.193 12.631 1.00 16.34 C C HETATM 2343 SD MET C 56 15.432 -3.650 11.568 1.00 16.21 C S HETATM 2344 CE MET C 56 14.695 -2.043 11.305 1.00 20.13 C C HETATM 2345 C MET C 56 18.443 -1.711 14.499 1.00 14.55 C C HETATM 2346 O MET C 56 19.537 -1.865 13.954 1.00 14.89 C O HETATM 2347 N GLN C 57 17.890 -0.516 14.711 1.00 16.61 C N HETATM 2348 CA GLN C 57 18.505 0.734 14.252 1.00 18.63 C C HETATM 2349 CB GLN C 57 17.621 1.934 14.630 1.00 21.99 C C HETATM 2350 CG GLN C 57 18.073 3.299 14.088 1.00 28.14 C C HETATM 2351 CD GLN C 57 18.113 3.371 12.567 1.00 31.06 C C HETATM 2352 OE1 GLN C 57 17.104 3.160 11.893 1.00 34.34 C O HETATM 2353 NE2 GLN C 57 19.288 3.675 12.022 1.00 34.09 C N HETATM 2354 C GLN C 57 19.934 0.928 14.762 1.00 17.18 C C HETATM 2355 O GLN C 57 20.818 1.291 13.986 1.00 17.50 C O HETATM 2356 N GLY C 58 20.153 0.586 16.032 1.00 17.00 C N HETATM 2357 CA GLY C 58 21.464 0.711 16.658 1.00 17.33 C C HETATM 2358 C GLY C 58 22.498 -0.254 16.106 1.00 16.40 C C HETATM 2359 O GLY C 58 23.656 0.121 15.903 1.00 17.80 C O HETATM 2360 N VAL C 59 22.068 -1.487 15.837 1.00 16.34 C N HETATM 2361 CA VAL C 59 22.936 -2.530 15.284 1.00 14.48 C C HETATM 2362 CB VAL C 59 22.236 -3.921 15.295 1.00 13.85 C C HETATM 2363 CG1 VAL C 59 23.134 -5.001 14.689 1.00 11.36 C C HETATM 2364 CG2 VAL C 59 21.859 -4.312 16.706 1.00 14.47 C C HETATM 2365 C VAL C 59 23.347 -2.153 13.855 1.00 15.12 C C HETATM 2366 O VAL C 59 24.510 -2.284 13.499 1.00 14.75 C O HETATM 2367 N VAL C 60 22.391 -1.638 13.078 1.00 15.58 C N HETATM 2368 CA VAL C 60 22.615 -1.213 11.690 1.00 16.01 C C HETATM 2369 CB VAL C 60 21.251 -0.895 10.976 1.00 15.65 C C HETATM 2370 CG1 VAL C 60 21.453 -0.272 9.589 1.00 15.35 C C HETATM 2371 CG2 VAL C 60 20.456 -2.166 10.811 1.00 16.70 C C HETATM 2372 C VAL C 60 23.571 -0.012 11.607 1.00 17.20 C C HETATM 2373 O VAL C 60 24.496 -0.021 10.797 1.00 16.80 C O HETATM 2374 N THR C 61 23.369 0.982 12.477 1.00 20.24 C N HETATM 2375 CA THR C 61 24.198 2.195 12.507 1.00 21.76 C C HETATM 2376 CB THR C 61 23.588 3.274 13.448 1.00 22.61 C C HETATM 2377 OG1 THR C 61 22.259 3.577 13.008 1.00 24.67 C O HETATM 2378 CG2 THR C 61 24.412 4.571 13.432 1.00 25.40 C C HETATM 2379 C THR C 61 25.645 1.881 12.891 1.00 21.29 C C HETATM 2380 O THR C 61 26.566 2.224 12.148 1.00 21.57 C O HETATM 2381 N ASP C 62 25.821 1.166 14.006 1.00 23.42 C N HETATM 2382 CA ASP C 62 27.148 0.764 14.501 1.00 24.33 C C HETATM 2383 CB ASP C 62 27.048 0.199 15.923 1.00 24.06 C C HETATM 2384 CG ASP C 62 26.613 1.241 16.948 1.00 24.57 C C HETATM 2385 OD1 ASP C 62 26.712 2.457 16.669 1.00 25.38 C O HETATM 2386 OD2 ASP C 62 26.174 0.836 18.045 1.00 24.15 C O HETATM 2387 C ASP C 62 27.760 -0.278 13.574 1.00 25.23 C C HETATM 2388 O ASP C 62 28.985 -0.417 13.486 1.00 25.69 C O HETATM 2389 N GLY C 63 26.877 -0.979 12.861 1.00 25.96 C N HETATM 2390 CA GLY C 63 27.284 -1.988 11.905 1.00 25.74 C C HETATM 2391 C GLY C 63 27.913 -1.361 10.677 1.00 27.02 C C HETATM 2392 O GLY C 63 29.019 -1.740 10.297 1.00 26.57 C O HETATM 2393 N MET C 64 27.242 -0.358 10.105 1.00 28.44 C N HETATM 2394 CA MET C 64 27.729 0.362 8.919 1.00 30.28 C C HETATM 2395 CB MET C 64 26.748 1.464 8.515 1.00 33.39 C C HETATM 2396 CG MET C 64 25.513 0.989 7.783 1.00 37.87 C C HETATM 2397 SD MET C 64 24.715 2.386 6.968 1.00 44.25 C S HETATM 2398 CE MET C 64 23.028 1.910 7.043 1.00 42.73 C C HETATM 2399 C MET C 64 29.110 0.990 9.132 1.00 28.78 C C HETATM 2400 O MET C 64 29.954 0.967 8.232 1.00 29.17 C O HETATM 2401 N ALA C 65 29.341 1.473 10.353 1.00 26.96 C N HETATM 2402 CA ALA C 65 30.595 2.116 10.750 1.00 27.46 C C HETATM 2403 CB ALA C 65 30.365 2.981 11.988 1.00 28.23 C C HETATM 2404 C ALA C 65 31.765 1.154 10.988 1.00 25.93 C C HETATM 2405 O ALA C 65 32.916 1.588 11.068 1.00 26.35 C O HETATM 2406 N SER C 66 31.469 -0.143 11.083 1.00 24.57 C N HETATM 2407 CA SER C 66 32.492 -1.166 11.317 1.00 22.91 C C HETATM 2408 CB SER C 66 31.897 -2.376 12.028 1.00 23.84 C C HETATM 2409 OG SER C 66 31.635 -2.075 13.385 1.00 24.98 C O HETATM 2410 C SER C 66 33.262 -1.599 10.070 1.00 22.32 C C HETATM 2411 O SER C 66 34.352 -2.162 10.180 1.00 20.78 C O HETATM 2412 N GLY C 67 32.702 -1.325 8.892 1.00 22.25 C N HETATM 2413 CA GLY C 67 33.378 -1.660 7.645 1.00 23.08 C C HETATM 2414 C GLY C 67 33.191 -3.061 7.097 1.00 23.04 C C HETATM 2415 O GLY C 67 32.717 -3.955 7.798 1.00 23.39 C O HETATM 2416 N LEU C 68 33.584 -3.232 5.833 1.00 23.31 C N HETATM 2417 CA LEU C 68 33.489 -4.492 5.086 1.00 24.32 C C HETATM 2418 CB LEU C 68 33.908 -4.250 3.628 1.00 24.91 C C HETATM 2419 CG LEU C 68 33.859 -5.344 2.553 1.00 26.04 C C HETATM 2420 CD1 LEU C 68 32.454 -5.811 2.302 1.00 26.87 C C HETATM 2421 CD2 LEU C 68 34.421 -4.790 1.276 1.00 27.54 C C HETATM 2422 C LEU C 68 34.264 -5.670 5.673 1.00 25.12 C C HETATM 2423 O LEU C 68 33.754 -6.794 5.709 1.00 22.96 C O HETATM 2424 N ASP C 69 35.473 -5.389 6.160 1.00 26.09 C N HETATM 2425 CA ASP C 69 36.365 -6.393 6.755 1.00 28.12 C C HETATM 2426 CB ASP C 69 37.779 -5.820 6.986 1.00 31.51 C C HETATM 2427 CG ASP C 69 37.890 -4.332 6.651 1.00 34.81 C C HETATM 2428 OD1 ASP C 69 37.874 -3.980 5.447 1.00 34.76 C O HETATM 2429 OD2 ASP C 69 37.998 -3.521 7.599 1.00 36.97 C O HETATM 2430 C ASP C 69 35.825 -7.010 8.052 1.00 27.00 C C HETATM 2431 O ASP C 69 36.248 -8.098 8.454 1.00 28.28 C O HETATM 2432 N LYS C 70 34.889 -6.303 8.688 1.17 24.36 C N HETATM 2433 CA LYS C 70 34.243 -6.747 9.923 1.25 22.21 C C HETATM 2434 CB LYS C 70 34.294 -5.634 10.982 1.21 22.84 C C HETATM 2435 CG LYS C 70 35.682 -5.407 11.579 0.84 24.58 C C HETATM 2436 CD LYS C 70 35.692 -4.260 12.579 1.05 26.09 C C HETATM 2437 CE LYS C 70 37.033 -4.153 13.315 1.58 28.69 C C HETATM 2438 NZ LYS C 70 38.167 -3.816 12.410 0.54 28.30 C N HETATM 2439 C LYS C 70 32.792 -7.178 9.643 1.02 21.12 C C HETATM 2440 O LYS C 70 31.965 -7.266 10.561 1.40 20.18 C O HETATM 2441 N ASP C 71 32.505 -7.449 8.362 1.00 20.44 C N HETATM 2442 CA ASP C 71 31.188 -7.888 7.861 1.00 19.59 C C HETATM 2443 CB ASP C 71 30.881 -9.319 8.333 1.00 21.63 C C HETATM 2444 CG ASP C 71 31.776 -10.357 7.686 1.00 22.44 C C HETATM 2445 OD1 ASP C 71 32.645 -10.008 6.853 1.00 25.77 C O HETATM 2446 OD2 ASP C 71 31.597 -11.541 8.010 1.00 24.54 C O HETATM 2447 C ASP C 71 30.036 -6.947 8.203 1.00 19.18 C C HETATM 2448 O ASP C 71 28.876 -7.361 8.335 1.00 19.29 C O HETATM 2449 N TYR C 72 30.387 -5.665 8.325 1.00 18.12 C N HETATM 2450 CA TYR C 72 29.476 -4.586 8.686 1.00 16.81 C C HETATM 2451 CB TYR C 72 28.533 -4.217 7.530 1.00 15.00 C C HETATM 2452 CG TYR C 72 29.223 -3.523 6.377 1.00 16.16 C C HETATM 2453 CD1 TYR C 72 29.711 -2.204 6.507 1.00 19.25 C C HETATM 2454 CE1 TYR C 72 30.338 -1.533 5.405 1.00 19.48 C C HETATM 2455 CD2 TYR C 72 29.371 -4.169 5.135 1.00 17.07 C C HETATM 2456 CE2 TYR C 72 29.987 -3.514 4.034 1.00 17.87 C C HETATM 2457 CZ TYR C 72 30.464 -2.201 4.175 1.00 19.69 C C HETATM 2458 OH TYR C 72 31.022 -1.568 3.090 1.00 22.09 C O HETATM 2459 C TYR C 72 28.718 -4.854 9.983 1.00 16.66 C C HETATM 2460 O TYR C 72 27.525 -4.602 10.086 1.00 15.41 C O HETATM 2461 N LEU C 73 29.434 -5.397 10.966 1.00 17.34 C N HETATM 2462 CA LEU C 73 28.875 -5.701 12.276 1.00 17.42 C C HETATM 2463 CB LEU C 73 28.540 -7.191 12.405 1.00 18.38 C C HETATM 2464 CG LEU C 73 27.166 -7.667 11.934 1.00 20.31 C C HETATM 2465 CD1 LEU C 73 27.148 -9.169 11.914 1.00 21.49 C C HETATM 2466 CD2 LEU C 73 26.069 -7.115 12.833 1.00 17.24 C C HETATM 2467 C LEU C 73 29.854 -5.316 13.359 1.00 18.05 C C HETATM 2468 O LEU C 73 31.052 -5.604 13.251 1.00 18.47 C O HETATM 2469 N LYS C 74 29.340 -4.636 14.386 1.00 18.90 C N HETATM 2470 CA LYS C 74 30.138 -4.211 15.539 1.00 20.53 C C HETATM 2471 CB LYS C 74 29.291 -3.342 16.485 1.00 22.21 C C HETATM 2472 CG LYS C 74 30.060 -2.682 17.632 1.00 27.53 C C HETATM 2473 CD LYS C 74 29.116 -1.994 18.615 1.00 29.91 C C HETATM 2474 CE LYS C 74 29.875 -1.172 19.652 1.00 34.15 C C HETATM 2475 NZ LYS C 74 30.783 -1.992 20.504 1.00 35.40 C N HETATM 2476 C LYS C 74 30.581 -5.493 16.251 1.00 19.33 C C HETATM 2477 O LYS C 74 29.738 -6.352 16.541 1.00 16.94 C O HETATM 2478 N PRO C 75 31.912 -5.686 16.439 1.00 19.89 C N HETATM 2479 CD PRO C 75 33.028 -4.840 15.968 1.00 21.12 C C HETATM 2480 CA PRO C 75 32.436 -6.884 17.112 1.00 20.86 C C HETATM 2481 CB PRO C 75 33.947 -6.637 17.122 1.00 21.01 C C HETATM 2482 CG PRO C 75 34.165 -5.823 15.895 1.00 21.49 C C HETATM 2483 C PRO C 75 31.898 -7.004 18.534 1.00 20.21 C C HETATM 2484 O PRO C 75 31.828 -6.007 19.260 1.00 21.91 C O HETATM 2485 N ASP C 76 31.455 -8.215 18.883 1.00 22.51 C N HETATM 2486 CA ASP C 76 30.891 -8.559 20.201 1.00 23.45 C C HETATM 2487 CB ASP C 76 31.966 -8.484 21.309 1.00 25.48 C C HETATM 2488 CG ASP C 76 33.175 -9.362 21.021 1.00 27.93 C C HETATM 2489 OD2 ASP C 76 34.295 -8.813 20.932 1.00 29.48 C O HETATM 2490 OD1 ASP C 76 33.005 -10.591 20.875 1.00 28.93 C O HETATM 2491 C ASP C 76 29.650 -7.733 20.587 1.00 22.37 C C HETATM 2492 O ASP C 76 29.431 -7.434 21.767 1.00 23.39 C O HETATM 2493 N ASP C 77 28.844 -7.374 19.583 1.00 19.92 C N HETATM 2494 CA ASP C 77 27.621 -6.585 19.785 1.00 20.82 C C HETATM 2495 CB ASP C 77 27.017 -6.173 18.426 1.00 19.04 C C HETATM 2496 CG ASP C 77 26.008 -5.021 18.530 1.00 20.06 C C HETATM 2497 OD1 ASP C 77 25.331 -4.879 19.573 1.00 19.21 C O HETATM 2498 OD2 ASP C 77 25.883 -4.257 17.545 1.00 18.23 C O HETATM 2499 C ASP C 77 26.623 -7.414 20.599 1.00 20.67 C C HETATM 2500 O ASP C 77 26.078 -8.402 20.107 1.00 20.78 C O HETATM 2501 N SER C 78 26.408 -6.996 21.850 1.00 21.27 C N HETATM 2502 CA SER C 78 25.503 -7.673 22.791 1.00 21.65 C C HETATM 2503 CB SER C 78 25.616 -7.038 24.184 1.00 22.52 C C HETATM 2504 OG SER C 78 25.266 -5.663 24.153 1.00 24.38 C O HETATM 2505 C SER C 78 24.032 -7.713 22.362 1.00 20.81 C C HETATM 2506 O SER C 78 23.259 -8.551 22.841 1.00 20.27 C O HETATM 2507 N ARG C 79 23.672 -6.816 21.445 1.00 17.89 C N HETATM 2508 CA ARG C 79 22.312 -6.706 20.918 1.00 18.17 C C HETATM 2509 CB ARG C 79 22.073 -5.295 20.375 1.00 19.46 C C HETATM 2510 CG ARG C 79 22.206 -4.175 21.402 1.00 19.64 C C HETATM 2511 CD ARG C 79 22.254 -2.805 20.728 1.00 18.31 C C HETATM 2512 NE ARG C 79 23.401 -2.693 19.828 1.00 19.23 C N HETATM 2513 CZ ARG C 79 23.826 -1.567 19.259 1.00 19.68 C C HETATM 2514 NH1 ARG C 79 23.210 -0.408 19.477 1.00 16.98 C N HETATM 2515 NH2 ARG C 79 24.874 -1.607 18.449 1.00 18.13 C N HETATM 2516 C ARG C 79 22.016 -7.737 19.821 1.00 16.61 C C HETATM 2517 O ARG C 79 20.852 -7.977 19.492 1.00 15.22 C O HETATM 2518 N VAL C 80 23.069 -8.334 19.263 1.00 15.57 C N HETATM 2519 CA VAL C 80 22.933 -9.343 18.205 1.00 14.77 C C HETATM 2520 CB VAL C 80 24.139 -9.293 17.209 1.00 13.69 C C HETATM 2521 CG1 VAL C 80 24.022 -10.381 16.130 1.00 14.05 C C HETATM 2522 CG2 VAL C 80 24.195 -7.947 16.545 1.00 12.30 C C HETATM 2523 C VAL C 80 22.788 -10.744 18.803 1.00 15.20 C C HETATM 2524 O VAL C 80 23.736 -11.285 19.383 1.00 16.29 C O HETATM 2525 N ILE C 81 21.601 -11.327 18.622 1.00 13.84 C N HETATM 2526 CA ILE C 81 21.278 -12.669 19.123 1.00 14.43 C C HETATM 2527 CB ILE C 81 19.737 -12.904 19.128 1.00 14.43 C C HETATM 2528 CG2 ILE C 81 19.385 -14.323 19.649 1.00 15.26 C C HETATM 2529 CG1 ILE C 81 19.066 -11.856 20.023 1.00 16.95 C C HETATM 2530 CD1 ILE C 81 17.580 -11.762 19.841 1.00 19.95 C C HETATM 2531 C ILE C 81 21.974 -13.754 18.293 1.00 15.26 C C HETATM 2532 O ILE C 81 22.477 -14.744 18.842 1.00 14.93 C O HETATM 2533 N ALA C 82 22.001 -13.551 16.977 1.00 13.16 C N HETATM 2534 CA ALA C 82 22.623 -14.491 16.045 1.00 12.75 C C HETATM 2535 CB ALA C 82 21.729 -15.705 15.833 1.00 12.55 C C HETATM 2536 C ALA C 82 22.867 -13.808 14.720 1.00 13.56 C C HETATM 2537 O ALA C 82 22.124 -12.894 14.340 1.00 13.34 C O HETATM 2538 N HIS C 83 23.912 -14.248 14.021 1.00 13.36 C N HETATM 2539 CA HIS C 83 24.254 -13.691 12.715 1.00 13.82 C C HETATM 2540 CB HIS C 83 25.042 -12.364 12.862 1.00 12.64 C C HETATM 2541 CG HIS C 83 26.425 -12.521 13.432 1.00 13.37 C C HETATM 2542 CD2 HIS C 83 27.629 -12.676 12.827 1.00 12.32 C C HETATM 2543 ND1 HIS C 83 26.675 -12.525 14.787 1.00 13.80 C N HETATM 2544 CE1 HIS C 83 27.972 -12.676 14.991 1.00 15.40 C C HETATM 2545 NE2 HIS C 83 28.572 -12.771 13.819 1.00 14.90 C N HETATM 2546 C HIS C 83 25.054 -14.640 11.838 1.00 13.55 C C HETATM 2547 O HIS C 83 25.748 -15.529 12.338 1.00 13.34 C O HETATM 2548 N THR C 84 24.990 -14.392 10.531 1.00 15.07 C N HETATM 2549 CA THR C 84 25.772 -15.133 9.542 1.00 13.52 C C HETATM 2550 CB THR C 84 24.995 -15.369 8.206 1.00 11.16 C C HETATM 2551 OG1 THR C 84 24.712 -14.115 7.578 1.00 12.99 C O HETATM 2552 CG2 THR C 84 23.715 -16.133 8.424 1.00 11.31 C C HETATM 2553 C THR C 84 26.911 -14.157 9.211 1.00 13.45 C C HETATM 2554 O THR C 84 26.928 -13.030 9.717 1.00 12.98 C O HETATM 2555 N LYS C 85 27.832 -14.571 8.343 1.00 13.85 C N HETATM 2556 CA LYS C 85 28.913 -13.690 7.888 1.00 15.71 C C HETATM 2557 CB LYS C 85 30.170 -14.502 7.510 1.00 15.86 C C HETATM 2558 CG LYS C 85 30.076 -15.337 6.227 1.00 20.76 C C HETATM 2559 CD LYS C 85 31.342 -16.129 5.945 1.00 21.56 C C HETATM 2560 CE LYS C 85 31.175 -16.974 4.688 1.00 23.14 C C HETATM 2561 NZ LYS C 85 32.387 -17.771 4.340 1.00 25.26 C N HETATM 2562 C LYS C 85 28.356 -12.943 6.658 1.00 15.17 C C HETATM 2563 O LYS C 85 27.232 -13.224 6.223 1.00 14.99 C O HETATM 2564 N LEU C 86 29.123 -12.001 6.112 1.00 15.00 C N HETATM 2565 CA LEU C 86 28.696 -11.263 4.919 1.00 16.06 C C HETATM 2566 CB LEU C 86 29.323 -9.868 4.870 1.00 18.07 C C HETATM 2567 CG LEU C 86 28.732 -8.830 3.911 1.00 18.73 C C HETATM 2568 CD1 LEU C 86 27.568 -8.099 4.555 1.00 17.96 C C HETATM 2569 CD2 LEU C 86 29.791 -7.833 3.556 1.00 19.07 C C HETATM 2570 C LEU C 86 29.134 -12.073 3.707 1.00 15.87 C C HETATM 2571 O LEU C 86 30.291 -12.507 3.631 1.00 16.99 C O HETATM 2572 N ILE C 87 28.196 -12.326 2.795 1.00 14.39 C N HETATM 2573 CA ILE C 87 28.487 -13.115 1.602 1.00 16.28 C C HETATM 2574 CB ILE C 87 27.709 -14.471 1.582 1.00 14.03 C C HETATM 2575 CG2 ILE C 87 28.238 -15.413 2.655 1.00 17.44 C C HETATM 2576 CG1 ILE C 87 26.195 -14.256 1.701 1.00 13.73 C C HETATM 2577 CD1 ILE C 87 25.400 -15.483 1.326 1.00 14.58 C C HETATM 2578 C ILE C 87 28.241 -12.414 0.273 1.00 15.46 C C HETATM 2579 O ILE C 87 27.372 -11.549 0.163 1.00 15.03 C O HETATM 2580 N GLY C 88 29.019 -12.820 -0.729 1.00 16.74 C N HETATM 2581 CA GLY C 88 28.883 -12.293 -2.075 1.00 18.71 C C HETATM 2582 C GLY C 88 28.144 -13.313 -2.915 1.00 20.55 C C HETATM 2583 O GLY C 88 27.697 -14.335 -2.387 1.00 20.16 C O HETATM 2584 N SER C 89 28.000 -13.042 -4.212 1.00 22.29 C N HETATM 2585 CA SER C 89 27.301 -13.949 -5.126 1.00 25.72 C C HETATM 2586 CB SER C 89 27.140 -13.302 -6.496 1.00 26.55 C C HETATM 2587 OG SER C 89 28.394 -12.945 -7.058 1.00 29.87 C O HETATM 2588 C SER C 89 27.951 -15.324 -5.267 1.00 26.46 C C HETATM 2589 O SER C 89 29.177 -15.433 -5.398 1.00 28.19 C O HETATM 2590 N GLY C 90 27.122 -16.362 -5.168 1.00 25.94 C N HETATM 2591 CA GLY C 90 27.596 -17.733 -5.278 1.00 26.38 C C HETATM 2592 C GLY C 90 28.122 -18.331 -3.984 1.00 25.27 C C HETATM 2593 O GLY C 90 28.506 -19.502 -3.963 1.00 27.78 C O HETATM 2594 N GLU C 91 28.162 -17.526 -2.919 1.00 24.16 C N HETATM 2595 CA GLU C 91 28.640 -17.975 -1.605 1.00 23.09 C C HETATM 2596 CB GLU C 91 29.526 -16.916 -0.939 1.00 24.55 C C HETATM 2597 CG GLU C 91 30.740 -16.459 -1.751 1.00 27.35 C C HETATM 2598 CD GLU C 91 31.677 -15.545 -0.965 1.00 28.77 C C HETATM 2599 OE1 GLU C 91 31.193 -14.630 -0.262 1.00 26.99 C O HETATM 2600 OE2 GLU C 91 32.910 -15.740 -1.057 1.00 28.71 C O HETATM 2601 C GLU C 91 27.461 -18.288 -0.690 1.00 22.77 C C HETATM 2602 O GLU C 91 26.337 -17.835 -0.934 1.00 21.17 C O HETATM 2603 N LYS C 92 27.723 -19.088 0.346 1.00 20.98 C N HETATM 2604 CA LYS C 92 26.712 -19.503 1.322 1.00 21.23 C C HETATM 2605 CB LYS C 92 26.266 -20.956 1.059 1.00 23.41 C C HETATM 2606 CG LYS C 92 25.501 -21.229 -0.234 1.00 28.32 C C HETATM 2607 CD LYS C 92 25.312 -22.728 -0.440 1.00 30.49 C C HETATM 2608 CE LYS C 92 24.678 -23.042 -1.790 1.00 34.34 C C HETATM 2609 NZ LYS C 92 23.273 -22.549 -1.899 1.00 36.16 C N HETATM 2610 C LYS C 92 27.256 -19.444 2.752 1.00 20.05 C C HETATM 2611 O LYS C 92 28.474 -19.438 2.968 1.00 18.50 C O HETATM 2612 N ASP C 93 26.333 -19.384 3.713 1.00 18.78 C N HETATM 2613 CA ASP C 93 26.642 -19.395 5.146 1.00 16.43 C C HETATM 2614 CB ASP C 93 27.192 -18.055 5.658 1.00 15.05 C C HETATM 2615 CG ASP C 93 27.918 -18.196 7.000 1.00 15.60 C C HETATM 2616 OD1 ASP C 93 28.678 -19.167 7.183 1.00 17.58 C O HETATM 2617 OD2 ASP C 93 27.736 -17.336 7.878 1.00 15.81 C O HETATM 2618 C ASP C 93 25.384 -19.755 5.917 1.00 17.10 C C HETATM 2619 O ASP C 93 24.275 -19.396 5.511 1.00 18.83 C O HETATM 2620 N SER C 94 25.570 -20.469 7.024 1.00 16.45 C N HETATM 2621 CA SER C 94 24.466 -20.886 7.878 1.00 16.04 C C HETATM 2622 CB SER C 94 24.226 -22.395 7.756 1.00 16.77 C C HETATM 2623 OG SER C 94 23.926 -22.765 6.421 1.00 22.10 C O HETATM 2624 C SER C 94 24.729 -20.539 9.336 1.00 15.60 C C HETATM 2625 O SER C 94 25.882 -20.460 9.762 1.00 14.53 C O HETATM 2626 N VAL C 95 23.650 -20.282 10.074 1.00 15.38 C N HETATM 2627 CA VAL C 95 23.733 -19.982 11.504 1.00 15.40 C C HETATM 2628 CB VAL C 95 23.701 -18.437 11.819 1.00 13.80 C C HETATM 2629 CG1 VAL C 95 22.365 -17.798 11.433 1.00 14.57 C C HETATM 2630 CG2 VAL C 95 24.027 -18.179 13.292 1.00 14.46 C C HETATM 2631 C VAL C 95 22.624 -20.731 12.240 1.00 14.74 C C HETATM 2632 O VAL C 95 21.485 -20.798 11.775 1.00 14.13 C O HETATM 2633 N THR C 96 22.998 -21.352 13.352 1.00 15.76 C N HETATM 2634 CA THR C 96 22.063 -22.090 14.186 1.00 17.53 C C HETATM 2635 CB THR C 96 22.344 -23.617 14.145 1.00 17.29 C C HETATM 2636 OG1 THR C 96 22.281 -24.073 12.792 1.00 17.21 C O HETATM 2637 CG2 THR C 96 21.327 -24.404 14.972 1.00 19.88 C C HETATM 2638 C THR C 96 22.178 -21.548 15.604 1.00 17.47 C C HETATM 2639 O THR C 96 23.273 -21.241 16.076 1.00 20.56 C O HETATM 2640 N PHE C 97 21.025 -21.369 16.244 1.00 19.10 C N HETATM 2641 CA PHE C 97 20.956 -20.870 17.613 1.00 18.82 C C HETATM 2642 CB PHE C 97 20.710 -19.339 17.648 1.00 18.01 C C HETATM 2643 CG PHE C 97 19.513 -18.869 16.840 1.00 17.45 C C HETATM 2644 CD1 PHE C 97 19.632 -18.621 15.460 1.00 15.35 C C HETATM 2645 CD2 PHE C 97 18.262 -18.669 17.457 1.00 16.79 C C HETATM 2646 CE1 PHE C 97 18.521 -18.179 14.691 1.00 17.51 C C HETATM 2647 CE2 PHE C 97 17.138 -18.230 16.705 1.00 18.52 C C HETATM 2648 CZ PHE C 97 17.267 -17.985 15.318 1.00 16.92 C C HETATM 2649 C PHE C 97 19.867 -21.614 18.370 1.00 18.42 C C HETATM 2650 O PHE C 97 18.949 -22.161 17.759 1.00 16.83 C O HETATM 2651 N ASP C 98 19.969 -21.613 19.697 1.00 20.28 C N HETATM 2652 CA ASP C 98 18.983 -22.263 20.558 1.00 20.99 C C HETATM 2653 CB ASP C 98 19.566 -22.513 21.952 1.00 24.35 C C HETATM 2654 CG ASP C 98 20.611 -23.621 21.963 1.00 27.92 C C HETATM 2655 OD1 ASP C 98 20.318 -24.729 21.461 1.00 26.51 C O HETATM 2656 OD2 ASP C 98 21.722 -23.387 22.491 1.00 29.88 C O HETATM 2657 C ASP C 98 17.732 -21.393 20.658 1.00 19.55 C C HETATM 2658 O ASP C 98 17.833 -20.178 20.797 1.00 20.04 C O HETATM 2659 N VAL C 99 16.563 -22.027 20.562 1.00 20.96 C N HETATM 2660 CA VAL C 99 15.259 -21.351 20.630 1.00 19.00 C C HETATM 2661 CB VAL C 99 14.138 -22.292 20.082 1.00 18.42 C C HETATM 2662 CG1 VAL C 99 12.740 -21.722 20.269 1.00 17.29 C C HETATM 2663 CG2 VAL C 99 14.361 -22.518 18.600 1.00 19.47 C C HETATM 2664 C VAL C 99 14.967 -20.810 22.040 1.00 21.64 C C HETATM 2665 O VAL C 99 14.146 -19.904 22.209 1.00 23.28 C O HETATM 2666 N SER C 100 15.722 -21.304 23.026 1.00 22.63 C N HETATM 2667 CA SER C 100 15.610 -20.864 24.419 1.00 23.66 C C HETATM 2668 CB SER C 100 16.408 -21.795 25.344 1.00 23.15 C C HETATM 2669 OG SER C 100 17.756 -21.923 24.924 1.00 25.50 C O HETATM 2670 C SER C 100 16.092 -19.410 24.569 1.00 23.60 C C HETATM 2671 O SER C 100 15.775 -18.743 25.554 1.00 25.25 C O HETATM 2672 N LYS C 101 16.827 -18.928 23.560 1.00 24.25 C N HETATM 2673 CA LYS C 101 17.338 -17.557 23.512 1.00 23.33 C C HETATM 2674 CB LYS C 101 18.516 -17.438 22.535 1.00 25.19 C C HETATM 2675 CG LYS C 101 19.784 -18.154 22.953 1.00 27.50 C C HETATM 2676 CD LYS C 101 20.945 -17.762 22.040 1.00 29.55 C C HETATM 2677 CE LYS C 101 22.254 -18.404 22.490 1.00 32.62 C C HETATM 2678 NZ LYS C 101 22.653 -17.993 23.869 1.00 33.77 C N HETATM 2679 C LYS C 101 16.242 -16.579 23.071 1.00 22.17 C C HETATM 2680 O LYS C 101 16.403 -15.359 23.194 1.00 22.20 C O HETATM 2681 N LEU C 102 15.157 -17.121 22.513 1.00 21.03 C N HETATM 2682 CA LEU C 102 14.028 -16.321 22.041 1.00 20.63 C C HETATM 2683 CB LEU C 102 13.585 -16.774 20.648 1.00 19.33 C C HETATM 2684 CG LEU C 102 14.600 -16.778 19.503 1.00 20.54 C C HETATM 2685 CD1 LEU C 102 13.934 -17.361 18.278 1.00 20.47 C C HETATM 2686 CD2 LEU C 102 15.131 -15.373 19.230 1.00 19.75 C C HETATM 2687 C LEU C 102 12.835 -16.388 22.985 1.00 21.18 C C HETATM 2688 O LEU C 102 12.616 -17.398 23.660 1.00 22.57 C O HETATM 2689 N LYS C 103 12.060 -15.307 23.000 1.00 21.29 C N HETATM 2690 CA LYS C 103 10.875 -15.187 23.845 1.00 22.72 C C HETATM 2691 CB LYS C 103 10.987 -13.962 24.761 1.00 22.76 C C HETATM 2692 CG LYS C 103 12.101 -14.014 25.785 1.00 25.03 C C HETATM 2693 CD LYS C 103 12.159 -12.760 26.646 1.00 26.20 C C HETATM 2694 CE LYS C 103 12.871 -11.606 25.963 1.00 27.37 C C HETATM 2695 NZ LYS C 103 13.049 -10.463 26.909 1.00 28.76 C N HETATM 2696 C LYS C 103 9.611 -15.029 23.018 1.00 23.24 C C HETATM 2697 O LYS C 103 9.579 -14.243 22.065 1.00 22.28 C O HETATM 2698 N GLU C 104 8.565 -15.763 23.401 1.00 24.16 C N HETATM 2699 CA GLU C 104 7.262 -15.672 22.741 1.00 25.37 C C HETATM 2700 CB GLU C 104 6.382 -16.877 23.106 1.00 26.61 C C HETATM 2701 CG GLU C 104 4.972 -16.850 22.490 1.00 29.92 C C HETATM 2702 CD GLU C 104 4.141 -18.078 22.813 1.00 32.13 C C HETATM 2703 OE1 GLU C 104 4.204 -18.573 23.957 1.00 35.15 C O HETATM 2704 OE2 GLU C 104 3.404 -18.541 21.919 1.00 34.53 C O HETATM 2705 C GLU C 104 6.634 -14.373 23.252 1.00 25.89 C C HETATM 2706 O GLU C 104 6.698 -14.079 24.450 1.00 27.41 C O HETATM 2707 N GLY C 105 6.104 -13.570 22.332 1.00 26.74 C N HETATM 2708 CA GLY C 105 5.494 -12.304 22.704 1.00 27.60 C C HETATM 2709 C GLY C 105 6.379 -11.106 22.409 1.00 27.95 C C HETATM 2710 O GLY C 105 5.881 -9.981 22.292 1.00 29.93 C O HETATM 2711 N GLU C 106 7.692 -11.339 22.318 1.00 26.57 C N HETATM 2712 CA GLU C 106 8.657 -10.280 22.014 1.00 24.39 C C HETATM 2713 CB GLU C 106 10.030 -10.584 22.646 1.00 25.65 C C HETATM 2714 CG GLU C 106 11.197 -9.603 22.314 1.00 24.38 C C HETATM 2715 CD GLU C 106 11.082 -8.227 22.952 1.00 26.44 C C HETATM 2716 OE1 GLU C 106 11.838 -7.955 23.914 1.00 24.17 C O HETATM 2717 OE2 GLU C 106 10.277 -7.403 22.466 1.00 27.93 C O HETATM 2718 C GLU C 106 8.766 -10.104 20.498 1.00 24.15 C C HETATM 2719 O GLU C 106 8.609 -11.063 19.735 1.00 22.78 C O HETATM 2720 N GLN C 107 8.988 -8.859 20.079 1.00 23.46 C N HETATM 2721 CA GLN C 107 9.106 -8.513 18.667 1.00 23.03 C C HETATM 2722 CB GLN C 107 8.433 -7.161 18.394 1.00 25.64 C C HETATM 2723 CG GLN C 107 6.994 -7.029 18.930 1.00 28.08 C C HETATM 2724 CD GLN C 107 6.009 -7.990 18.279 1.00 30.20 C C HETATM 2725 OE1 GLN C 107 5.674 -9.036 18.845 1.00 31.13 C O HETATM 2726 NE2 GLN C 107 5.530 -7.633 17.091 1.00 29.75 C N HETATM 2727 C GLN C 107 10.565 -8.497 18.210 1.00 20.75 C C HETATM 2728 O GLN C 107 11.381 -7.721 18.727 1.00 18.55 C O HETATM 2729 N TYR C 108 10.886 -9.402 17.282 1.00 18.07 C N HETATM 2730 CA TYR C 108 12.234 -9.527 16.730 1.00 15.44 C C HETATM 2731 CB TYR C 108 12.757 -10.964 16.850 1.00 16.38 C C HETATM 2732 CG TYR C 108 12.881 -11.477 18.259 1.00 16.43 C C HETATM 2733 CD1 TYR C 108 13.929 -11.047 19.092 1.00 16.56 C C HETATM 2734 CE1 TYR C 108 14.039 -11.515 20.430 1.00 16.91 C C HETATM 2735 CD2 TYR C 108 11.941 -12.392 18.777 1.00 16.23 C C HETATM 2736 CE2 TYR C 108 12.043 -12.872 20.109 1.00 16.00 C C HETATM 2737 CZ TYR C 108 13.095 -12.423 20.923 1.00 17.00 C C HETATM 2738 OH TYR C 108 13.201 -12.858 22.217 1.00 17.70 C O HETATM 2739 C TYR C 108 12.275 -9.147 15.262 1.00 14.14 C C HETATM 2740 O TYR C 108 11.277 -9.257 14.554 1.00 13.32 C O HETATM 2741 N MET C 109 13.448 -8.705 14.819 1.00 12.52 C N HETATM 2742 CA MET C 109 13.673 -8.333 13.429 1.00 11.70 C C HETATM 2743 CB MET C 109 13.838 -6.820 13.275 1.00 12.21 C C HETATM 2744 CG MET C 109 12.573 -6.003 13.433 1.00 13.42 C C HETATM 2745 SD MET C 109 11.273 -6.353 12.256 1.00 15.11 C S HETATM 2746 CE MET C 109 12.056 -5.746 10.716 1.00 13.30 C C HETATM 2747 C MET C 109 14.933 -8.985 12.885 1.00 11.98 C C HETATM 2748 O MET C 109 15.914 -9.139 13.614 1.00 10.65 C O HETATM 2749 N PHE C 110 14.863 -9.450 11.639 1.00 12.28 C N HETATM 2750 CA PHE C 110 16.034 -10.006 10.961 1.00 11.04 C C HETATM 2751 CB PHE C 110 15.826 -11.433 10.415 1.00 12.99 C C HETATM 2752 CG PHE C 110 14.882 -11.557 9.242 1.00 10.53 C C HETATM 2753 CD1 PHE C 110 15.338 -11.378 7.916 1.00 11.66 C C HETATM 2754 CD2 PHE C 110 13.545 -11.922 9.450 1.00 11.61 C C HETATM 2755 CE1 PHE C 110 14.472 -11.560 6.816 1.00 9.54 C C HETATM 2756 CE2 PHE C 110 12.664 -12.110 8.356 1.00 11.74 C C HETATM 2757 CZ PHE C 110 13.131 -11.928 7.037 1.00 12.39 C C HETATM 2758 C PHE C 110 16.364 -8.974 9.896 1.00 11.87 C C HETATM 2759 O PHE C 110 15.455 -8.350 9.363 1.00 13.14 C O HETATM 2760 N PHE C 111 17.652 -8.743 9.640 1.00 11.04 C N HETATM 2761 CA PHE C 111 18.064 -7.709 8.685 1.00 11.81 C C HETATM 2762 CB PHE C 111 17.932 -6.306 9.340 1.00 10.84 C C HETATM 2763 CG PHE C 111 18.514 -6.219 10.738 1.00 11.96 C C HETATM 2764 CD1 PHE C 111 17.772 -6.653 11.854 1.00 14.03 C C HETATM 2765 CD2 PHE C 111 19.823 -5.753 10.942 1.00 12.73 C C HETATM 2766 CE1 PHE C 111 18.324 -6.638 13.159 1.00 14.46 C C HETATM 2767 CE2 PHE C 111 20.389 -5.728 12.242 1.00 13.45 C C HETATM 2768 CZ PHE C 111 19.637 -6.174 13.350 1.00 13.29 C C HETATM 2769 C PHE C 111 19.479 -7.866 8.165 1.00 11.36 C C HETATM 2770 O PHE C 111 20.248 -8.689 8.668 1.00 10.89 C O HETATM 2771 N CYS C 112 19.795 -7.064 7.151 1.00 11.89 C N HETATM 2772 CA CYS C 112 21.123 -7.015 6.560 1.00 11.52 C C HETATM 2773 CB CYS C 112 21.068 -7.132 5.036 1.00 12.57 C C HETATM 2774 SG CYS C 112 22.699 -7.020 4.249 1.00 13.31 C S HETATM 2775 C CYS C 112 21.728 -5.675 6.976 1.00 12.63 C C HETATM 2776 O CYS C 112 21.075 -4.638 6.868 1.00 13.13 C O HETATM 2777 N THR C 113 22.987 -5.703 7.415 1.00 12.21 C N HETATM 2778 CA THR C 113 23.675 -4.503 7.888 1.00 12.36 C C HETATM 2779 CB THR C 113 24.469 -4.784 9.177 1.00 13.00 C C HETATM 2780 OG1 THR C 113 25.423 -5.824 8.939 1.00 13.35 C O HETATM 2781 CG2 THR C 113 23.550 -5.181 10.311 1.00 12.85 C C HETATM 2782 C THR C 113 24.583 -3.766 6.902 1.00 12.84 C C HETATM 2783 O THR C 113 25.234 -2.792 7.287 1.00 14.74 C O HETATM 2784 N PHE C 114 24.650 -4.246 5.654 1.00 12.94 C N HETATM 2785 CA PHE C 114 25.444 -3.612 4.579 1.00 14.11 C C HETATM 2786 CB PHE C 114 25.396 -4.507 3.319 1.00 13.75 C C HETATM 2787 CG PHE C 114 26.352 -4.104 2.203 1.00 15.68 C C HETATM 2788 CD1 PHE C 114 26.070 -3.012 1.346 1.00 18.18 C C HETATM 2789 CD2 PHE C 114 27.519 -4.849 1.972 1.00 17.03 C C HETATM 2790 CE1 PHE C 114 26.930 -2.669 0.282 1.00 17.86 C C HETATM 2791 CE2 PHE C 114 28.400 -4.518 0.906 1.00 17.87 C C HETATM 2792 CZ PHE C 114 28.100 -3.427 0.063 1.00 16.20 C C HETATM 2793 C PHE C 114 24.760 -2.247 4.321 1.00 15.27 C C HETATM 2794 O PHE C 114 23.534 -2.167 4.403 1.00 14.71 C O HETATM 2795 N PRO C 115 25.542 -1.152 4.094 1.00 15.95 C N HETATM 2796 CD PRO C 115 27.007 -1.077 4.228 1.00 17.32 C C HETATM 2797 CA PRO C 115 25.027 0.198 3.838 1.00 17.12 C C HETATM 2798 CB PRO C 115 26.245 0.911 3.273 1.00 16.57 C C HETATM 2799 CG PRO C 115 27.295 0.416 4.159 1.00 17.99 C C HETATM 2800 C PRO C 115 23.823 0.335 2.932 1.00 16.06 C C HETATM 2801 O PRO C 115 23.857 -0.047 1.758 1.00 18.74 C O HETATM 2802 N GLY C 116 22.732 0.767 3.557 1.00 15.36 C N HETATM 2803 CA GLY C 116 21.474 0.989 2.873 1.00 15.03 C C HETATM 2804 C GLY C 116 20.584 -0.216 2.648 1.00 15.54 C C HETATM 2805 O GLY C 116 19.411 -0.054 2.323 1.00 15.53 C O HETATM 2806 N HIS C 117 21.119 -1.415 2.863 1.00 14.57 C N HETATM 2807 CA HIS C 117 20.367 -2.647 2.649 1.00 13.87 C C HETATM 2808 CB HIS C 117 21.290 -3.866 2.698 1.00 13.78 C C HETATM 2809 CG HIS C 117 22.198 -3.981 1.512 1.00 12.81 C C HETATM 2810 CD2 HIS C 117 22.614 -3.059 0.609 1.00 13.75 C C HETATM 2811 ND1 HIS C 117 22.763 -5.176 1.123 1.00 12.59 C N HETATM 2812 CE1 HIS C 117 23.483 -4.986 0.033 1.00 13.43 C C HETATM 2813 NE2 HIS C 117 23.409 -3.710 -0.300 1.00 13.50 C N HETATM 2814 C HIS C 117 19.148 -2.864 3.517 1.00 13.99 C C HETATM 2815 O HIS C 117 18.120 -3.293 3.002 1.00 13.52 C O HETATM 2816 N SER C 118 19.223 -2.446 4.783 1.00 14.00 C N HETATM 2817 CA SER C 118 18.116 -2.602 5.734 1.00 15.43 C C HETATM 2818 CB SER C 118 18.552 -2.238 7.159 1.00 15.87 C C HETATM 2819 OG SER C 118 18.758 -0.847 7.305 1.00 17.09 C O HETATM 2820 C SER C 118 16.837 -1.844 5.370 1.00 15.78 C C HETATM 2821 O SER C 118 15.792 -2.108 5.953 1.00 15.26 C O HETATM 2822 N ALA C 119 16.909 -0.934 4.394 1.00 14.33 C N HETATM 2823 CA ALA C 119 15.725 -0.181 3.952 1.00 14.74 C C HETATM 2824 CB ALA C 119 16.105 0.835 2.895 1.00 12.87 C C HETATM 2825 C ALA C 119 14.664 -1.147 3.402 1.00 14.28 C C HETATM 2826 O ALA C 119 13.470 -1.000 3.682 1.00 14.31 C O HETATM 2827 N LEU C 120 15.141 -2.184 2.708 1.00 14.10 C N HETATM 2828 CA LEU C 120 14.294 -3.221 2.111 1.00 12.66 C C HETATM 2829 CB LEU C 120 14.490 -3.268 0.588 1.00 12.09 C C HETATM 2830 CG LEU C 120 14.143 -2.047 -0.271 1.00 12.67 C C HETATM 2831 CD1 LEU C 120 14.462 -2.336 -1.734 1.00 11.12 C C HETATM 2832 CD2 LEU C 120 12.666 -1.693 -0.093 1.00 13.57 C C HETATM 2833 C LEU C 120 14.595 -4.610 2.668 1.00 13.72 C C HETATM 2834 O LEU C 120 13.707 -5.469 2.724 1.00 11.59 C O HETATM 2835 N MET C 121 15.852 -4.828 3.059 1.00 11.84 C N HETATM 2836 CA MET C 121 16.295 -6.122 3.569 1.00 11.67 C C HETATM 2837 CB MET C 121 17.736 -6.404 3.155 1.00 12.96 C C HETATM 2838 CG MET C 121 17.929 -6.358 1.681 1.00 12.68 C C HETATM 2839 SD MET C 121 19.522 -6.911 1.116 1.00 10.54 C S HETATM 2840 CE MET C 121 19.296 -8.637 1.310 1.00 13.02 C C HETATM 2841 C MET C 121 16.132 -6.280 5.062 1.00 13.36 C C HETATM 2842 O MET C 121 17.097 -6.226 5.822 1.00 11.64 C O HETATM 2843 N LYS C 122 14.879 -6.469 5.460 1.00 12.33 C N HETATM 2844 CA LYS C 122 14.499 -6.657 6.851 1.00 14.17 C C HETATM 2845 CB LYS C 122 14.427 -5.312 7.598 1.00 15.11 C C HETATM 2846 CG LYS C 122 13.390 -4.328 7.074 1.00 14.94 C C HETATM 2847 CD LYS C 122 13.444 -3.033 7.851 1.00 19.11 C C HETATM 2848 CE LYS C 122 12.506 -2.008 7.265 1.00 17.22 C C HETATM 2849 NZ LYS C 122 11.079 -2.429 7.403 1.00 21.44 C N HETATM 2850 C LYS C 122 13.160 -7.373 6.927 1.00 12.89 C C HETATM 2851 O LYS C 122 12.425 -7.430 5.941 1.00 13.48 C O HETATM 2852 N GLY C 123 12.863 -7.924 8.100 1.00 12.48 C N HETATM 2853 CA GLY C 123 11.600 -8.612 8.294 1.00 13.48 C C HETATM 2854 C GLY C 123 11.424 -9.085 9.716 1.00 11.67 C C HETATM 2855 O GLY C 123 12.373 -9.066 10.487 1.00 10.77 C O HETATM 2856 N THR C 124 10.222 -9.537 10.061 1.00 11.47 C N HETATM 2857 CA THR C 124 9.944 -10.012 11.413 1.00 10.25 C C HETATM 2858 CB THR C 124 8.447 -9.872 11.757 1.00 8.89 C C HETATM 2859 OG1 THR C 124 7.668 -10.556 10.768 1.00 10.77 C O HETATM 2860 CG2 THR C 124 8.033 -8.409 11.805 1.00 12.20 C C HETATM 2861 C THR C 124 10.320 -11.474 11.642 1.00 12.91 C C HETATM 2862 O THR C 124 10.387 -12.265 10.701 1.00 12.33 C O HETATM 2863 N LEU C 125 10.606 -11.803 12.899 1.00 13.73 C N HETATM 2864 CA LEU C 125 10.897 -13.171 13.316 1.00 15.08 C C HETATM 2865 CB LEU C 125 12.389 -13.403 13.612 1.00 15.34 C C HETATM 2866 CG LEU C 125 12.774 -14.843 14.000 1.00 15.51 C C HETATM 2867 CD1 LEU C 125 14.020 -15.298 13.269 1.00 16.58 C C HETATM 2868 CD2 LEU C 125 12.963 -14.977 15.512 1.00 16.47 C C HETATM 2869 C LEU C 125 10.029 -13.340 14.558 1.00 16.43 C C HETATM 2870 O LEU C 125 10.141 -12.564 15.512 1.00 16.41 C O HETATM 2871 N THR C 126 9.173 -14.358 14.540 1.00 17.79 C N HETATM 2872 CA THR C 126 8.248 -14.609 15.641 1.00 20.57 C C HETATM 2873 CB THR C 126 6.792 -14.294 15.193 1.00 20.53 C C HETATM 2874 OG1 THR C 126 6.766 -13.019 14.543 1.00 20.54 C O HETATM 2875 CG2 THR C 126 5.828 -14.258 16.386 1.00 21.57 C C HETATM 2876 C THR C 126 8.312 -16.045 16.150 1.00 20.62 C C HETATM 2877 O THR C 126 8.312 -16.991 15.365 1.00 20.98 C O HETATM 2878 N LEU C 127 8.378 -16.182 17.473 1.00 22.18 C N HETATM 2879 CA LEU C 127 8.403 -17.483 18.132 1.00 24.64 C C HETATM 2880 CB LEU C 127 9.377 -17.473 19.321 1.00 25.79 C C HETATM 2881 CG LEU C 127 10.059 -18.732 19.888 1.00 26.52 C C HETATM 2882 CD1 LEU C 127 10.032 -18.653 21.400 1.00 27.86 C C HETATM 2883 CD2 LEU C 127 9.458 -20.052 19.428 1.00 26.44 C C HETATM 2884 C LEU C 127 6.977 -17.729 18.630 1.00 26.42 C C HETATM 2885 O LEU C 127 6.483 -17.001 19.495 1.00 26.78 C O HETATM 2886 N LYS C 128 6.316 -18.729 18.047 1.00 27.57 C N HETATM 2887 CA LYS C 128 4.946 -19.089 18.420 1.00 30.31 C C HETATM 2888 CB LYS C 128 3.919 -18.251 17.628 1.00 31.53 C C HETATM 2889 CG LYS C 128 3.989 -18.358 16.106 1.00 33.75 C C HETATM 2890 CD LYS C 128 2.986 -17.413 15.461 1.00 36.21 C C HETATM 2891 CE LYS C 128 2.974 -17.556 13.949 1.00 36.88 C C HETATM 2892 NZ LYS C 128 2.079 -16.553 13.303 1.00 38.34 C N HETATM 2893 C LYS C 128 4.668 -20.588 18.265 1.00 30.81 C C HETATM 2894 O LYS C 128 3.568 -21.031 18.664 1.00 30.83 C O HETATM 2895 OXT LYS C 128 5.559 -21.306 17.762 1.00 31.00 C O HETATM 2896 FE+2 FE2 C 129 22.598 -6.709 1.886 0.20 12.22 C FE2+ TER HETATM 2897 CB ALA D 1 9.741 30.764 15.450 1.00 25.46 D C HETATM 2898 C ALA D 1 8.278 30.880 13.413 1.00 24.03 D C HETATM 2899 O ALA D 1 7.049 30.749 13.473 1.00 22.94 D O HETATM 2900 N ALA D 1 8.085 32.587 15.212 1.00 24.53 D N HETATM 2901 CA ALA D 1 9.023 31.696 14.469 1.00 24.85 D C HETATM 2902 N GLU D 2 9.028 30.359 12.439 1.00 23.75 D N HETATM 2903 CA GLU D 2 8.481 29.520 11.363 1.00 23.66 D C HETATM 2904 CB GLU D 2 9.445 29.493 10.170 1.00 26.45 D C HETATM 2905 CG GLU D 2 8.906 28.769 8.935 1.00 31.74 D C HETATM 2906 CD GLU D 2 9.856 28.808 7.748 1.00 33.94 D C HETATM 2907 OE1 GLU D 2 10.459 29.873 7.485 1.00 36.49 D O HETATM 2908 OE2 GLU D 2 9.985 27.769 7.067 1.00 36.44 D O HETATM 2909 C GLU D 2 8.328 28.125 11.973 1.00 21.86 D C HETATM 2910 O GLU D 2 9.324 27.441 12.226 1.00 22.44 D O HETATM 2911 N CYS D 3 7.080 27.733 12.233 1.00 18.76 D N HETATM 2912 CA CYS D 3 6.787 26.459 12.878 1.00 17.45 D C HETATM 2913 C CYS D 3 5.785 25.553 12.169 1.00 16.72 D C HETATM 2914 O CYS D 3 4.931 24.930 12.814 1.00 16.16 D O HETATM 2915 CB CYS D 3 6.333 26.721 14.314 1.00 16.88 D C HETATM 2916 SG CYS D 3 7.412 27.866 15.222 1.00 18.83 D S HETATM 2917 N SER D 4 5.914 25.457 10.847 1.00 16.63 D N HETATM 2918 CA SER D 4 5.045 24.608 10.038 1.00 18.47 D C HETATM 2919 CB SER D 4 3.727 25.317 9.689 1.00 19.19 D C HETATM 2920 OG SER D 4 3.945 26.472 8.901 1.00 21.55 D O HETATM 2921 C SER D 4 5.721 24.156 8.754 1.00 17.68 D C HETATM 2922 O SER D 4 6.621 24.830 8.247 1.00 19.52 D O HETATM 2923 N VAL D 5 5.286 23.003 8.250 1.00 17.10 D N HETATM 2924 CA VAL D 5 5.796 22.452 6.997 1.00 17.31 D C HETATM 2925 CB VAL D 5 7.010 21.455 7.213 1.00 17.85 D C HETATM 2926 CG1 VAL D 5 6.584 20.171 7.934 1.00 16.93 D C HETATM 2927 CG2 VAL D 5 7.697 21.130 5.877 1.00 19.56 D C HETATM 2928 C VAL D 5 4.634 21.800 6.244 1.00 17.91 D C HETATM 2929 O VAL D 5 3.777 21.140 6.851 1.00 16.98 D O HETATM 2930 N ASP D 6 4.558 22.089 4.945 1.00 16.12 D N HETATM 2931 CA ASP D 6 3.531 21.523 4.074 1.00 17.74 D C HETATM 2932 CB ASP D 6 3.020 22.561 3.062 1.00 18.77 D C HETATM 2933 CG ASP D 6 2.273 23.727 3.719 1.00 20.85 D C HETATM 2934 OD1 ASP D 6 1.950 23.667 4.925 1.00 18.00 D O HETATM 2935 OD2 ASP D 6 2.001 24.717 3.011 1.00 23.96 D O HETATM 2936 C ASP D 6 4.180 20.345 3.349 1.00 17.27 D C HETATM 2937 O ASP D 6 5.212 20.509 2.686 1.00 17.02 D O HETATM 2938 N ILE D 7 3.621 19.151 3.557 1.00 15.83 D N HETATM 2939 CA ILE D 7 4.136 17.921 2.947 1.00 15.48 D C HETATM 2940 CB ILE D 7 4.615 16.895 4.034 1.00 16.35 D C HETATM 2941 CG2 ILE D 7 5.249 15.654 3.378 1.00 16.28 D C HETATM 2942 CG1 ILE D 7 5.641 17.548 4.965 1.00 16.28 D C HETATM 2943 CD1 ILE D 7 6.023 16.715 6.150 1.00 16.62 D C HETATM 2944 C ILE D 7 3.096 17.256 2.039 1.00 15.72 D C HETATM 2945 O ILE D 7 1.921 17.150 2.390 1.00 14.03 D O HETATM 2946 N GLN D 8 3.551 16.834 0.861 1.00 14.64 D N HETATM 2947 CA GLN D 8 2.706 16.153 -0.116 1.00 14.67 D C HETATM 2948 CB GLN D 8 2.815 16.818 -1.491 1.00 15.69 D C HETATM 2949 CG GLN D 8 2.249 18.230 -1.607 1.00 17.05 D C HETATM 2950 CD GLN D 8 2.579 18.911 -2.933 1.00 19.37 D C HETATM 2951 OE1 GLN D 8 2.458 20.134 -3.056 1.00 22.98 D O HETATM 2952 NE2 GLN D 8 2.981 18.129 -3.928 1.00 15.71 D N HETATM 2953 C GLN D 8 3.164 14.712 -0.268 1.00 13.64 D C HETATM 2954 O GLN D 8 4.355 14.430 -0.219 1.00 11.81 D O HETATM 2955 N GLY D 9 2.203 13.815 -0.460 1.00 14.52 D N HETATM 2956 CA GLY D 9 2.501 12.414 -0.691 1.00 15.00 D C HETATM 2957 C GLY D 9 1.806 12.081 -1.999 1.00 15.45 D C HETATM 2958 O GLY D 9 0.580 12.158 -2.051 1.00 15.76 D O HETATM 2959 N ASN D 10 2.562 11.688 -3.028 1.00 13.36 D N HETATM 2960 CA ASN D 10 1.993 11.384 -4.350 1.00 14.56 D C HETATM 2961 CB ASN D 10 2.963 11.829 -5.471 1.00 13.53 D C HETATM 2962 CG ASN D 10 4.304 11.066 -5.468 1.00 13.36 D C HETATM 2963 OD1 ASN D 10 4.394 9.928 -5.018 1.00 16.80 D O HETATM 2964 ND2 ASN D 10 5.343 11.700 -5.998 1.00 12.83 D N HETATM 2965 C ASN D 10 1.497 9.946 -4.583 1.00 12.52 D C HETATM 2966 O ASN D 10 1.541 9.107 -3.682 1.00 12.00 D O HETATM 2967 N ASP D 11 1.035 9.680 -5.807 1.00 12.64 D N HETATM 2968 CA ASP D 11 0.534 8.364 -6.208 1.00 13.34 D C HETATM 2969 CB ASP D 11 -0.274 8.481 -7.506 1.00 13.89 D C HETATM 2970 CG ASP D 11 -1.741 8.799 -7.270 1.00 16.42 D C HETATM 2971 OD1 ASP D 11 -2.203 8.811 -6.110 1.00 15.18 D O HETATM 2972 OD2 ASP D 11 -2.458 8.998 -8.274 1.00 17.09 D O HETATM 2973 C ASP D 11 1.627 7.307 -6.388 1.00 13.23 D C HETATM 2974 O ASP D 11 1.331 6.122 -6.564 1.00 13.81 D O HETATM 2975 N GLN D 12 2.884 7.752 -6.368 1.00 13.20 D N HETATM 2976 CA GLN D 12 4.038 6.874 -6.536 1.00 13.50 D C HETATM 2977 CB GLN D 12 5.004 7.463 -7.572 1.00 14.94 D C HETATM 2978 CG GLN D 12 4.444 7.545 -8.992 1.00 17.61 D C HETATM 2979 CD GLN D 12 3.521 8.729 -9.206 1.00 19.19 D C HETATM 2980 OE1 GLN D 12 3.904 9.881 -8.999 1.00 22.20 D O HETATM 2981 NE2 GLN D 12 2.291 8.447 -9.618 1.00 16.74 D N HETATM 2982 C GLN D 12 4.765 6.604 -5.212 1.00 13.36 D C HETATM 2983 O GLN D 12 5.964 6.294 -5.198 1.00 13.60 D O HETATM 2984 N MET D 13 4.016 6.701 -4.106 1.00 12.54 D N HETATM 2985 CA MET D 13 4.511 6.457 -2.734 1.00 12.24 D C HETATM 2986 CB MET D 13 4.804 4.954 -2.517 1.00 12.87 D C HETATM 2987 CG MET D 13 3.670 4.024 -2.911 1.00 13.19 D C HETATM 2988 SD MET D 13 4.156 2.346 -3.361 1.00 14.64 D S HETATM 2989 CE MET D 13 5.141 2.711 -4.811 1.00 14.56 D C HETATM 2990 C MET D 13 5.745 7.292 -2.347 1.00 12.79 D C HETATM 2991 O MET D 13 6.760 6.749 -1.887 1.00 11.00 D O HETATM 2992 N GLN D 14 5.675 8.603 -2.569 1.00 12.59 D N HETATM 2993 CA GLN D 14 6.790 9.502 -2.253 1.00 12.31 D C HETATM 2994 CB GLN D 14 7.522 9.936 -3.535 1.00 13.00 D C HETATM 2995 CG GLN D 14 8.182 8.825 -4.334 1.00 14.00 D C HETATM 2996 CD GLN D 14 8.499 9.216 -5.760 1.00 16.30 D C HETATM 2997 OE1 GLN D 14 7.807 10.036 -6.379 1.00 14.45 D O HETATM 2998 NE2 GLN D 14 9.538 8.601 -6.309 1.00 15.34 D N HETATM 2999 C GLN D 14 6.356 10.775 -1.546 1.00 12.09 D C HETATM 3000 O GLN D 14 5.382 11.415 -1.954 1.00 11.92 D O HETATM 3001 N PHE D 15 7.085 11.133 -0.485 1.00 12.08 D N HETATM 3002 CA PHE D 15 6.861 12.393 0.243 1.00 11.10 D C HETATM 3003 CB PHE D 15 7.390 12.321 1.683 1.00 12.35 D C HETATM 3004 CG PHE D 15 6.466 11.645 2.669 1.00 13.16 D C HETATM 3005 CD1 PHE D 15 5.103 11.994 2.758 1.00 11.52 D C HETATM 3006 CD2 PHE D 15 6.987 10.708 3.581 1.00 10.78 D C HETATM 3007 CE1 PHE D 15 4.261 11.419 3.754 1.00 12.50 D C HETATM 3008 CE2 PHE D 15 6.163 10.122 4.588 1.00 14.16 D C HETATM 3009 CZ PHE D 15 4.795 10.481 4.672 1.00 13.35 D C HETATM 3010 C PHE D 15 7.731 13.408 -0.506 1.00 11.85 D C HETATM 3011 O PHE D 15 8.739 13.014 -1.106 1.00 11.94 D O HETATM 3012 N ASN D 16 7.369 14.695 -0.471 1.00 10.80 D N HETATM 3013 CA ASN D 16 8.174 15.717 -1.146 1.00 11.40 D C HETATM 3014 CB ASN D 16 7.293 16.774 -1.852 1.00 12.21 D C HETATM 3015 CG ASN D 16 6.471 17.623 -0.890 1.00 13.22 D C HETATM 3016 OD1 ASN D 16 6.368 17.330 0.301 1.00 12.23 D O HETATM 3017 ND2 ASN D 16 5.877 18.691 -1.419 1.00 14.78 D N HETATM 3018 C ASN D 16 9.287 16.342 -0.273 1.00 11.92 D C HETATM 3019 O ASN D 16 9.761 17.453 -0.539 1.00 11.93 D O HETATM 3020 N THR D 17 9.657 15.615 0.785 1.00 11.96 D N HETATM 3021 CA THR D 17 10.741 15.982 1.704 1.00 11.88 D C HETATM 3022 CB THR D 17 10.366 17.108 2.743 1.00 12.28 D C HETATM 3023 OG1 THR D 17 11.538 17.458 3.500 1.00 13.74 D O HETATM 3024 CG2 THR D 17 9.262 16.665 3.713 1.00 10.81 D C HETATM 3025 C THR D 17 11.221 14.740 2.452 1.00 11.83 D C HETATM 3026 O THR D 17 10.449 13.801 2.663 1.00 12.05 D O HETATM 3027 N ASN D 18 12.504 14.733 2.805 1.00 11.68 D N HETATM 3028 CA ASN D 18 13.088 13.638 3.565 1.00 13.11 D C HETATM 3029 CB ASN D 18 13.968 12.724 2.683 1.00 12.86 D C HETATM 3030 CG ASN D 18 15.202 13.421 2.120 1.00 15.32 D C HETATM 3031 OD1 ASN D 18 16.074 13.871 2.865 1.00 16.77 D O HETATM 3032 ND2 ASN D 18 15.299 13.469 0.795 1.00 14.98 D N HETATM 3033 C ASN D 18 13.838 14.162 4.794 1.00 12.91 D C HETATM 3034 O ASN D 18 14.451 13.386 5.528 1.00 12.98 D O HETATM 3035 N ALA D 19 13.771 15.482 5.001 1.00 13.08 D N HETATM 3036 CA ALA D 19 14.432 16.157 6.121 1.00 13.50 D C HETATM 3037 CB ALA D 19 15.858 16.564 5.734 1.00 14.70 D C HETATM 3038 C ALA D 19 13.647 17.378 6.593 1.00 14.01 D C HETATM 3039 O ALA D 19 13.427 18.326 5.832 1.00 13.74 D O HETATM 3040 N ILE D 20 13.198 17.322 7.847 1.00 14.08 D N HETATM 3041 CA ILE D 20 12.432 18.404 8.471 1.00 15.35 D C HETATM 3042 CB ILE D 20 11.046 17.906 9.016 1.00 17.17 D C HETATM 3043 CG2 ILE D 20 10.308 19.031 9.767 1.00 17.39 D C HETATM 3044 CG1 ILE D 20 10.146 17.420 7.876 1.00 16.13 D C HETATM 3045 CD1 ILE D 20 8.923 16.656 8.360 1.00 16.85 D C HETATM 3046 C ILE D 20 13.245 18.960 9.635 1.00 17.02 D C HETATM 3047 O ILE D 20 13.797 18.205 10.435 1.00 17.90 D O HETATM 3048 N THR D 21 13.334 20.286 9.689 1.00 17.54 D N HETATM 3049 CA THR D 21 14.037 20.990 10.752 1.00 19.75 D C HETATM 3050 CB THR D 21 15.094 21.974 10.200 1.00 21.57 D C HETATM 3051 OG1 THR D 21 14.586 22.631 9.031 1.00 28.11 D O HETATM 3052 CG2 THR D 21 16.383 21.255 9.867 1.00 21.68 D C HETATM 3053 C THR D 21 13.011 21.768 11.566 1.00 19.83 D C HETATM 3054 O THR D 21 12.249 22.569 11.014 1.00 19.29 D O HETATM 3055 N VAL D 22 12.931 21.457 12.859 1.00 18.20 D N HETATM 3056 CA VAL D 22 12.013 22.144 13.767 1.00 18.82 D C HETATM 3057 CB VAL D 22 11.326 21.167 14.767 1.00 17.51 D C HETATM 3058 CG1 VAL D 22 10.380 21.930 15.707 1.00 17.77 D C HETATM 3059 CG2 VAL D 22 10.544 20.097 14.015 1.00 17.68 D C HETATM 3060 C VAL D 22 12.859 23.156 14.534 1.00 20.79 D C HETATM 3061 O VAL D 22 13.841 22.784 15.174 1.00 20.31 D O HETATM 3062 N ASP D 23 12.477 24.430 14.443 1.00 23.32 D N HETATM 3063 CA ASP D 23 13.178 25.524 15.118 1.00 26.50 D C HETATM 3064 CB ASP D 23 12.675 26.871 14.575 1.00 28.08 D C HETATM 3065 CG ASP D 23 13.635 28.018 14.850 1.00 32.01 D C HETATM 3066 OD1 ASP D 23 13.756 28.434 16.025 1.00 32.14 D O HETATM 3067 OD2 ASP D 23 14.265 28.506 13.885 1.00 34.49 D O HETATM 3068 C ASP D 23 12.957 25.434 16.636 1.00 26.99 D C HETATM 3069 O ASP D 23 11.870 25.061 17.085 1.00 26.20 D O HETATM 3070 N LYS D 24 14.003 25.767 17.397 1.00 28.91 D N HETATM 3071 CA LYS D 24 14.015 25.745 18.868 1.00 30.70 D C HETATM 3072 CB LYS D 24 15.403 26.132 19.389 1.00 32.81 D C HETATM 3073 CG LYS D 24 16.363 24.976 19.580 1.00 34.89 D C HETATM 3074 CD LYS D 24 17.749 25.453 20.020 1.00 36.67 D C HETATM 3075 CE LYS D 24 17.765 25.945 21.466 1.00 38.63 D C HETATM 3076 NZ LYS D 24 19.142 26.285 21.911 1.00 40.37 D N HETATM 3077 C LYS D 24 12.988 26.632 19.564 1.00 30.17 D C HETATM 3078 O LYS D 24 12.369 26.218 20.550 1.00 30.61 D O HETATM 3079 N SER D 25 12.818 27.845 19.037 1.00 29.80 D N HETATM 3080 CA SER D 25 11.897 28.839 19.586 1.00 28.60 D C HETATM 3081 CB SER D 25 12.227 30.231 19.033 1.00 30.82 D C HETATM 3082 OG SER D 25 12.300 30.226 17.619 1.00 33.11 D O HETATM 3083 C SER D 25 10.410 28.526 19.410 1.00 27.34 D C HETATM 3084 O SER D 25 9.560 29.216 19.978 1.00 27.19 D O HETATM 3085 N CYS D 26 10.108 27.466 18.655 1.00 25.22 D N HETATM 3086 CA CYS D 26 8.732 27.034 18.409 1.00 22.63 D C HETATM 3087 C CYS D 26 8.137 26.358 19.642 1.00 21.81 D C HETATM 3088 O CYS D 26 8.803 25.540 20.276 1.00 21.20 D O HETATM 3089 CB CYS D 26 8.682 26.043 17.240 1.00 21.54 D C HETATM 3090 SG CYS D 26 9.061 26.747 15.606 1.00 18.92 D S HETATM 3091 N LYS D 27 6.909 26.737 19.998 1.00 21.63 D N HETATM 3092 CA LYS D 27 6.210 26.133 21.137 1.00 22.92 D C HETATM 3093 CB LYS D 27 5.203 27.107 21.763 1.00 26.65 D C HETATM 3094 CG LYS D 27 5.836 28.277 22.519 1.00 30.87 D C HETATM 3095 CD LYS D 27 4.796 29.089 23.310 1.00 34.68 D C HETATM 3096 CE LYS D 27 3.894 29.956 22.421 1.00 36.37 D C HETATM 3097 NZ LYS D 27 4.629 31.092 21.785 1.00 38.98 D N HETATM 3098 C LYS D 27 5.488 24.895 20.616 1.00 21.48 D C HETATM 3099 O LYS D 27 5.422 23.866 21.293 1.00 20.48 D O HETATM 3100 N GLN D 28 4.943 25.021 19.406 1.00 19.70 D N HETATM 3101 CA GLN D 28 4.236 23.943 18.722 1.00 18.82 D C HETATM 3102 CB GLN D 28 2.713 24.127 18.800 1.00 20.46 D C HETATM 3103 CG GLN D 28 2.090 23.729 20.143 1.00 25.70 D C HETATM 3104 CD GLN D 28 0.735 23.065 19.998 1.00 29.24 D C HETATM 3105 OE1 GLN D 28 -0.263 23.720 19.699 1.00 33.89 D O HETATM 3106 NE2 GLN D 28 0.698 21.752 20.183 1.00 31.47 D N HETATM 3107 C GLN D 28 4.692 23.859 17.262 1.00 16.78 D C HETATM 3108 O GLN D 28 5.193 24.836 16.711 1.00 18.13 D O HETATM 3109 N PHE D 29 4.587 22.668 16.673 1.00 16.23 D N HETATM 3110 CA PHE D 29 4.973 22.442 15.278 1.00 13.37 D C HETATM 3111 CB PHE D 29 6.237 21.574 15.187 1.00 14.62 D C HETATM 3112 CG PHE D 29 6.852 21.529 13.806 1.00 14.28 D C HETATM 3113 CD1 PHE D 29 7.613 22.611 13.329 1.00 15.87 D C HETATM 3114 CD2 PHE D 29 6.655 20.413 12.967 1.00 13.11 D C HETATM 3115 CE1 PHE D 29 8.181 22.596 12.024 1.00 17.61 D C HETATM 3116 CE2 PHE D 29 7.211 20.377 11.661 1.00 13.49 D C HETATM 3117 CZ PHE D 29 7.977 21.475 11.190 1.00 14.63 D C HETATM 3118 C PHE D 29 3.815 21.791 14.533 1.00 14.12 D C HETATM 3119 O PHE D 29 3.211 20.839 15.024 1.00 12.68 D O HETATM 3120 N THR D 30 3.551 22.281 13.324 1.00 13.70 D N HETATM 3121 CA THR D 30 2.452 21.775 12.507 1.00 13.88 D C HETATM 3122 CB THR D 30 1.441 22.919 12.170 1.00 13.50 D C HETATM 3123 OG1 THR D 30 1.041 23.571 13.379 1.00 15.57 D O HETATM 3124 CG2 THR D 30 0.186 22.386 11.466 1.00 15.90 D C HETATM 3125 C THR D 30 2.898 21.129 11.203 1.00 12.11 D C HETATM 3126 O THR D 30 3.776 21.639 10.511 1.00 14.28 D O HETATM 3127 N VAL D 31 2.297 19.982 10.898 1.00 12.68 D N HETATM 3128 CA VAL D 31 2.553 19.277 9.648 1.00 12.77 D C HETATM 3129 CB VAL D 31 3.060 17.821 9.870 1.00 13.94 D C HETATM 3130 CG1 VAL D 31 3.102 17.049 8.545 1.00 12.39 D C HETATM 3131 CG2 VAL D 31 4.447 17.850 10.458 1.00 13.13 D C HETATM 3132 C VAL D 31 1.213 19.276 8.922 1.00 13.44 D C HETATM 3133 O VAL D 31 0.198 18.880 9.496 1.00 14.30 D O HETATM 3134 N ASN D 32 1.212 19.813 7.704 1.00 13.86 D N HETATM 3135 CA ASN D 32 0.017 19.873 6.863 1.00 14.18 D C HETATM 3136 CB ASN D 32 -0.222 21.301 6.347 1.00 15.00 D C HETATM 3137 CG ASN D 32 -0.452 22.305 7.471 1.00 16.33 D C HETATM 3138 OD1 ASN D 32 -1.408 22.193 8.235 1.00 18.28 D O HETATM 3139 ND2 ASN D 32 0.428 23.292 7.571 1.00 17.65 D N HETATM 3140 C ASN D 32 0.241 18.912 5.701 1.00 13.83 D C HETATM 3141 O ASN D 32 0.991 19.208 4.762 1.00 14.58 D O HETATM 3142 N LEU D 33 -0.372 17.736 5.807 1.00 15.15 D N HETATM 3143 CA LEU D 33 -0.243 16.697 4.792 1.00 14.50 D C HETATM 3144 CB LEU D 33 -0.209 15.316 5.457 1.00 13.28 D C HETATM 3145 CG LEU D 33 0.147 14.079 4.626 1.00 13.68 D C HETATM 3146 CD1 LEU D 33 1.619 14.073 4.237 1.00 12.60 D C HETATM 3147 CD2 LEU D 33 -0.184 12.850 5.437 1.00 12.05 D C HETATM 3148 C LEU D 33 -1.348 16.744 3.738 1.00 14.80 D C HETATM 3149 O LEU D 33 -2.524 16.914 4.068 1.00 14.87 D O HETATM 3150 N SER D 34 -0.946 16.644 2.472 1.00 14.26 D N HETATM 3151 CA SER D 34 -1.877 16.625 1.341 1.00 15.58 D C HETATM 3152 CB SER D 34 -1.895 17.957 0.577 1.00 15.79 D C HETATM 3153 OG SER D 34 -0.633 18.287 0.047 1.00 15.92 D O HETATM 3154 C SER D 34 -1.503 15.453 0.435 1.00 16.59 D C HETATM 3155 O SER D 34 -0.438 14.845 0.607 1.00 17.27 D O HETATM 3156 N HIS D 35 -2.359 15.150 -0.537 1.00 16.93 D N HETATM 3157 CA HIS D 35 -2.136 14.006 -1.414 1.00 17.46 D C HETATM 3158 CB HIS D 35 -2.893 12.793 -0.815 1.00 17.07 D C HETATM 3159 CG HIS D 35 -2.611 11.465 -1.466 1.00 17.63 D C HETATM 3160 CD2 HIS D 35 -2.741 10.206 -0.986 1.00 19.56 D C HETATM 3161 ND1 HIS D 35 -2.220 11.329 -2.781 1.00 18.31 D N HETATM 3162 CE1 HIS D 35 -2.123 10.047 -3.083 1.00 16.95 D C HETATM 3163 NE2 HIS D 35 -2.435 9.344 -2.012 1.00 17.74 D N HETATM 3164 C HIS D 35 -2.541 14.255 -2.873 1.00 17.22 D C HETATM 3165 O HIS D 35 -3.695 14.036 -3.243 1.00 18.51 D O HETATM 3166 N PRO D 36 -1.605 14.753 -3.714 1.00 18.97 D N HETATM 3167 CD PRO D 36 -0.300 15.359 -3.388 1.00 18.19 D C HETATM 3168 CA PRO D 36 -1.943 14.984 -5.126 1.00 19.16 D C HETATM 3169 CB PRO D 36 -0.747 15.792 -5.642 1.00 20.45 D C HETATM 3170 CG PRO D 36 0.373 15.414 -4.725 1.00 20.64 D C HETATM 3171 C PRO D 36 -2.091 13.624 -5.835 1.00 21.09 D C HETATM 3172 O PRO D 36 -1.619 12.598 -5.322 1.00 20.02 D O HETATM 3173 N GLY D 37 -2.813 13.608 -6.952 1.00 20.84 D N HETATM 3174 CA GLY D 37 -3.027 12.371 -7.685 1.00 20.85 D C HETATM 3175 C GLY D 37 -4.483 11.950 -7.754 1.00 22.38 D C HETATM 3176 O GLY D 37 -5.376 12.765 -7.495 1.00 24.22 D O HETATM 3177 N ASN D 38 -4.720 10.669 -8.053 1.00 23.09 D N HETATM 3178 CA ASN D 38 -6.076 10.122 -8.182 1.00 23.38 D C HETATM 3179 CB ASN D 38 -6.495 10.061 -9.666 1.00 27.55 D C HETATM 3180 CG ASN D 38 -5.449 9.401 -10.557 1.00 30.79 D C HETATM 3181 OD1 ASN D 38 -4.795 10.070 -11.362 1.00 33.85 D O HETATM 3182 ND2 ASN D 38 -5.295 8.086 -10.425 1.00 33.41 D N HETATM 3183 C ASN D 38 -6.381 8.783 -7.482 1.00 22.16 D C HETATM 3184 O ASN D 38 -7.527 8.330 -7.498 1.00 21.84 D O HETATM 3185 N LEU D 39 -5.393 8.192 -6.806 1.00 21.05 D N HETATM 3186 CA LEU D 39 -5.589 6.904 -6.125 1.00 19.46 D C HETATM 3187 CB LEU D 39 -4.279 6.111 -6.096 1.00 19.08 D C HETATM 3188 CG LEU D 39 -3.725 5.543 -7.406 1.00 19.04 D C HETATM 3189 CD1 LEU D 39 -2.304 5.049 -7.162 1.00 18.03 D C HETATM 3190 CD2 LEU D 39 -4.607 4.424 -7.941 1.00 19.04 D C HETATM 3191 C LEU D 39 -6.230 6.954 -4.721 1.00 19.20 D C HETATM 3192 O LEU D 39 -5.834 7.773 -3.883 1.00 18.89 D O HETATM 3193 N PRO D 40 -7.217 6.063 -4.443 1.00 18.49 D N HETATM 3194 CD PRO D 40 -7.836 5.109 -5.387 1.00 20.08 D C HETATM 3195 CA PRO D 40 -7.917 6.003 -3.147 1.00 18.76 D C HETATM 3196 CB PRO D 40 -9.076 5.045 -3.430 1.00 18.91 D C HETATM 3197 CG PRO D 40 -8.529 4.145 -4.463 1.00 19.68 D C HETATM 3198 C PRO D 40 -7.108 5.568 -1.919 1.00 18.11 D C HETATM 3199 O PRO D 40 -6.009 5.026 -2.047 1.00 15.95 D O HETATM 3200 N LYS D 41 -7.707 5.774 -0.744 1.00 18.02 D N HETATM 3201 CA LYS D 41 -7.122 5.465 0.567 1.00 18.59 D C HETATM 3202 CB LYS D 41 -8.083 5.918 1.682 1.00 19.62 D C HETATM 3203 CG LYS D 41 -7.433 6.105 3.060 1.00 20.91 D C HETATM 3204 CD LYS D 41 -8.408 6.631 4.113 1.00 24.09 D C HETATM 3205 CE LYS D 41 -9.282 5.536 4.711 1.00 25.65 D C HETATM 3206 NZ LYS D 41 -10.192 6.073 5.770 1.00 29.07 D N HETATM 3207 C LYS D 41 -6.705 4.011 0.809 1.00 18.55 D C HETATM 3208 O LYS D 41 -5.652 3.749 1.410 1.00 15.99 D O HETATM 3209 N ASN D 42 -7.518 3.076 0.318 1.00 18.47 D N HETATM 3210 CA ASN D 42 -7.259 1.650 0.495 1.00 18.14 D C HETATM 3211 CB ASN D 42 -8.518 0.823 0.167 1.00 19.86 D C HETATM 3212 CG ASN D 42 -8.845 0.796 -1.316 1.00 21.58 D C HETATM 3213 OD1 ASN D 42 -9.037 1.836 -1.945 1.00 22.03 D O HETATM 3214 ND2 ASN D 42 -8.893 -0.404 -1.883 1.00 22.90 D N HETATM 3215 C ASN D 42 -6.031 1.115 -0.250 1.00 17.10 D C HETATM 3216 O ASN D 42 -5.492 0.079 0.131 1.00 17.68 D O HETATM 3217 N VAL D 43 -5.595 1.828 -1.292 1.00 16.03 D N HETATM 3218 CA VAL D 43 -4.426 1.420 -2.082 1.00 16.92 D C HETATM 3219 CB VAL D 43 -4.764 1.207 -3.612 1.00 16.20 D C HETATM 3220 CG1 VAL D 43 -5.953 0.264 -3.784 1.00 18.50 D C HETATM 3221 CG2 VAL D 43 -5.027 2.517 -4.330 1.00 17.19 D C HETATM 3222 C VAL D 43 -3.238 2.382 -1.957 1.00 17.12 D C HETATM 3223 O VAL D 43 -2.081 1.965 -2.072 1.00 16.56 D O HETATM 3224 N MET D 44 -3.530 3.661 -1.711 1.00 15.33 D N HETATM 3225 CA MET D 44 -2.494 4.688 -1.618 1.00 15.01 D C HETATM 3226 CB MET D 44 -2.381 5.382 -2.985 1.00 16.35 D C HETATM 3227 CG MET D 44 -1.077 6.118 -3.288 1.00 16.40 D C HETATM 3228 SD MET D 44 0.398 5.122 -3.055 1.00 15.05 D S HETATM 3229 CE MET D 44 0.189 3.839 -4.402 1.00 11.44 D C HETATM 3230 C MET D 44 -2.750 5.696 -0.488 1.00 13.76 D C HETATM 3231 O MET D 44 -2.565 6.907 -0.650 1.00 13.25 D O HETATM 3232 N GLY D 45 -3.152 5.178 0.667 1.00 12.56 D N HETATM 3233 CA GLY D 45 -3.410 6.027 1.820 1.00 14.78 D C HETATM 3234 C GLY D 45 -2.124 6.419 2.514 1.00 15.30 D C HETATM 3235 O GLY D 45 -1.326 5.552 2.879 1.00 14.71 D O HETATM 3236 N HIS D 46 -1.933 7.723 2.706 1.00 14.91 D N HETATM 3237 CA HIS D 46 -0.733 8.237 3.357 1.00 15.25 D C HETATM 3238 CB HIS D 46 -0.042 9.297 2.491 1.00 15.11 D C HETATM 3239 CG HIS D 46 0.349 8.831 1.125 1.00 14.82 D C HETATM 3240 CD2 HIS D 46 0.480 9.514 -0.033 1.00 15.69 D C HETATM 3241 ND1 HIS D 46 0.702 7.531 0.842 1.00 13.22 D N HETATM 3242 CE1 HIS D 46 1.035 7.436 -0.433 1.00 16.14 D C HETATM 3243 NE2 HIS D 46 0.911 8.627 -0.986 1.00 13.76 D N HETATM 3244 C HIS D 46 -1.001 8.891 4.700 1.00 15.13 D C HETATM 3245 O HIS D 46 -2.032 9.528 4.897 1.00 14.80 D O HETATM 3246 N ASN D 47 -0.067 8.697 5.627 1.00 15.60 D N HETATM 3247 CA ASN D 47 -0.119 9.341 6.933 1.00 11.59 D C HETATM 3248 CB ASN D 47 -0.708 8.450 8.056 1.00 11.48 D C HETATM 3249 CG ASN D 47 0.038 7.131 8.260 1.00 12.27 D C HETATM 3250 OD1 ASN D 47 1.074 6.881 7.658 1.00 8.72 D O HETATM 3251 ND2 ASN D 47 -0.502 6.284 9.131 1.00 12.48 D N HETATM 3252 C ASN D 47 1.289 9.830 7.243 1.00 12.79 D C HETATM 3253 O ASN D 47 2.239 9.484 6.531 1.00 11.61 D O HETATM 3254 N TRP D 48 1.394 10.744 8.198 1.00 11.73 D N HETATM 3255 CA TRP D 48 2.684 11.261 8.625 1.00 12.15 D C HETATM 3256 CB TRP D 48 2.757 12.784 8.451 1.00 12.70 D C HETATM 3257 CG TRP D 48 4.094 13.371 8.792 1.00 12.74 D C HETATM 3258 CD2 TRP D 48 4.511 13.885 10.068 1.00 13.17 D C HETATM 3259 CE2 TRP D 48 5.847 14.339 9.916 1.00 13.11 D C HETATM 3260 CE3 TRP D 48 3.885 14.003 11.331 1.00 13.05 D C HETATM 3261 CD1 TRP D 48 5.151 13.528 7.952 1.00 12.62 D C HETATM 3262 NE1 TRP D 48 6.208 14.110 8.614 1.00 14.54 D N HETATM 3263 CZ2 TRP D 48 6.584 14.905 10.983 1.00 12.86 D C HETATM 3264 CZ3 TRP D 48 4.618 14.571 12.404 1.00 14.56 D C HETATM 3265 CH2 TRP D 48 5.958 15.013 12.214 1.00 13.59 D C HETATM 3266 C TRP D 48 2.729 10.864 10.088 1.00 12.78 D C HETATM 3267 O TRP D 48 1.883 11.288 10.875 1.00 12.84 D O HETATM 3268 N VAL D 49 3.697 10.019 10.434 1.00 11.13 D N HETATM 3269 CA VAL D 49 3.854 9.508 11.795 1.00 11.77 D C HETATM 3270 CB VAL D 49 3.622 7.959 11.840 1.00 12.13 D C HETATM 3271 CG1 VAL D 49 3.660 7.429 13.262 1.00 14.19 D C HETATM 3272 CG2 VAL D 49 2.292 7.594 11.197 1.00 14.23 D C HETATM 3273 C VAL D 49 5.267 9.830 12.261 1.00 11.11 D C HETATM 3274 O VAL D 49 6.214 9.689 11.496 1.00 9.03 D O HETATM 3275 N LEU D 50 5.394 10.245 13.517 1.00 11.75 D N HETATM 3276 CA LEU D 50 6.693 10.585 14.096 1.00 13.30 D C HETATM 3277 CB LEU D 50 6.732 12.070 14.480 1.00 10.28 D C HETATM 3278 CG LEU D 50 8.024 12.668 15.056 1.00 11.82 D C HETATM 3279 CD1 LEU D 50 9.100 12.751 13.977 1.00 10.05 D C HETATM 3280 CD2 LEU D 50 7.745 14.043 15.650 1.00 14.01 D C HETATM 3281 C LEU D 50 7.023 9.735 15.321 1.00 12.49 D C HETATM 3282 O LEU D 50 6.182 9.534 16.195 1.00 13.71 D O HETATM 3283 N SER D 51 8.267 9.259 15.369 1.00 13.92 D N HETATM 3284 CA SER D 51 8.781 8.464 16.480 1.00 13.37 D C HETATM 3285 CB SER D 51 8.402 6.978 16.329 1.00 15.37 D C HETATM 3286 OG SER D 51 9.158 6.335 15.316 1.00 14.71 D O HETATM 3287 C SER D 51 10.294 8.609 16.497 1.00 14.54 D C HETATM 3288 O SER D 51 10.874 9.236 15.607 1.00 13.69 D O HETATM 3289 N THR D 52 10.935 8.030 17.513 1.00 14.47 D N HETATM 3290 CA THR D 52 12.396 8.048 17.604 1.00 16.04 D C HETATM 3291 CB THR D 52 12.900 7.644 19.008 1.00 16.09 D C HETATM 3292 OG1 THR D 52 12.471 6.311 19.302 1.00 17.55 D O HETATM 3293 CG2 THR D 52 12.365 8.604 20.076 1.00 17.59 D C HETATM 3294 C THR D 52 12.889 7.018 16.580 1.00 16.27 D C HETATM 3295 O THR D 52 12.126 6.127 16.186 1.00 15.87 D O HETATM 3296 N ALA D 53 14.139 7.149 16.141 1.00 16.91 D N HETATM 3297 CA ALA D 53 14.724 6.232 15.158 1.00 17.32 D C HETATM 3298 CB ALA D 53 16.164 6.623 14.862 1.00 18.04 D C HETATM 3299 C ALA D 53 14.640 4.761 15.542 1.00 17.80 D C HETATM 3300 O ALA D 53 14.305 3.917 14.709 1.00 17.13 D O HETATM 3301 N ALA D 54 14.854 4.492 16.830 1.00 17.42 D N HETATM 3302 CA ALA D 54 14.819 3.143 17.392 1.00 17.63 D C HETATM 3303 CB ALA D 54 15.483 3.140 18.755 1.00 17.36 D C HETATM 3304 C ALA D 54 13.414 2.547 17.494 1.00 17.20 D C HETATM 3305 O ALA D 54 13.259 1.323 17.473 1.00 17.31 D O HETATM 3306 N ASP D 55 12.405 3.418 17.580 1.00 16.66 D N HETATM 3307 CA ASP D 55 11.002 3.007 17.699 1.00 16.19 D C HETATM 3308 CB ASP D 55 10.228 3.994 18.579 1.00 16.55 D C HETATM 3309 CG ASP D 55 10.554 3.864 20.059 1.00 15.28 D C HETATM 3310 OD1 ASP D 55 11.199 2.876 20.471 1.00 15.46 D O HETATM 3311 OD2 ASP D 55 10.132 4.761 20.821 1.00 14.55 D O HETATM 3312 C ASP D 55 10.230 2.833 16.396 1.00 14.56 D C HETATM 3313 O ASP D 55 9.150 2.237 16.403 1.00 14.13 D O HETATM 3314 N MET D 56 10.778 3.340 15.290 1.00 12.77 D N HETATM 3315 CA MET D 56 10.118 3.267 13.980 1.00 12.68 D C HETATM 3316 CB MET D 56 11.014 3.840 12.875 1.00 13.70 D C HETATM 3317 CG MET D 56 10.366 3.767 11.489 1.00 13.83 D C HETATM 3318 SD MET D 56 11.259 4.490 10.137 1.00 16.59 D S HETATM 3319 CE MET D 56 10.472 3.628 8.780 1.00 14.20 D C HETATM 3320 C MET D 56 9.601 1.892 13.555 1.00 13.56 D C HETATM 3321 O MET D 56 8.416 1.739 13.254 1.00 12.27 D O HETATM 3322 N GLN D 57 10.477 0.895 13.585 1.00 14.86 D N HETATM 3323 CA GLN D 57 10.103 -0.450 13.175 1.00 15.53 D C HETATM 3324 CB GLN D 57 11.318 -1.373 13.182 1.00 16.67 D C HETATM 3325 CG GLN D 57 11.037 -2.733 12.567 1.00 17.81 D C HETATM 3326 CD GLN D 57 10.537 -2.658 11.129 1.00 18.51 D C HETATM 3327 OE1 GLN D 57 11.248 -2.199 10.245 1.00 18.76 D O HETATM 3328 NE2 GLN D 57 9.313 -3.132 10.894 1.00 17.89 D N HETATM 3329 C GLN D 57 8.942 -1.064 13.955 1.00 13.73 D C HETATM 3330 O GLN D 57 8.040 -1.651 13.350 1.00 13.48 D O HETATM 3331 N GLY D 58 8.958 -0.881 15.276 1.00 14.60 D N HETATM 3332 CA GLY D 58 7.904 -1.389 16.141 1.00 15.19 D C HETATM 3333 C GLY D 58 6.564 -0.741 15.827 1.00 15.13 D C HETATM 3334 O GLY D 58 5.535 -1.420 15.813 1.00 14.95 D O HETATM 3335 N VAL D 59 6.593 0.561 15.528 1.00 14.67 D N HETATM 3336 CA VAL D 59 5.392 1.329 15.173 1.00 13.26 D C HETATM 3337 CB VAL D 59 5.676 2.871 15.151 1.00 14.47 D C HETATM 3338 CG1 VAL D 59 4.475 3.665 14.618 1.00 11.71 D C HETATM 3339 CG2 VAL D 59 6.002 3.366 16.549 1.00 11.77 D C HETATM 3340 C VAL D 59 4.844 0.854 13.814 1.00 13.78 D C HETATM 3341 O VAL D 59 3.637 0.670 13.680 1.00 12.75 D O HETATM 3342 N VAL D 60 5.743 0.610 12.849 1.00 14.17 D N HETATM 3343 CA VAL D 60 5.381 0.148 11.493 1.00 14.44 D C HETATM 3344 CB VAL D 60 6.623 0.168 10.520 1.00 14.83 D C HETATM 3345 CG1 VAL D 60 6.274 -0.408 9.130 1.00 15.44 D C HETATM 3346 CG2 VAL D 60 7.120 1.583 10.345 1.00 15.16 D C HETATM 3347 C VAL D 60 4.747 -1.251 11.502 1.00 14.80 D C HETATM 3348 O VAL D 60 3.706 -1.470 10.867 1.00 13.19 D O HETATM 3349 N THR D 61 5.365 -2.174 12.240 1.00 15.45 D N HETATM 3350 CA THR D 61 4.879 -3.553 12.355 1.00 14.86 D C HETATM 3351 CB THR D 61 5.902 -4.452 13.099 1.00 14.16 D C HETATM 3352 OG1 THR D 61 7.141 -4.459 12.377 1.00 14.17 D O HETATM 3353 CG2 THR D 61 5.397 -5.899 13.215 1.00 15.32 D C HETATM 3354 C THR D 61 3.512 -3.606 13.053 1.00 14.99 D C HETATM 3355 O THR D 61 2.574 -4.205 12.524 1.00 14.77 D O HETATM 3356 N ASP D 62 3.399 -2.935 14.201 1.00 14.75 D N HETATM 3357 CA ASP D 62 2.143 -2.895 14.965 1.00 16.07 D C HETATM 3358 CB ASP D 62 2.364 -2.294 16.352 1.00 15.97 D C HETATM 3359 CG ASP D 62 3.174 -3.202 17.268 1.00 17.91 D C HETATM 3360 OD1 ASP D 62 3.382 -4.390 16.932 1.00 19.17 D O HETATM 3361 OD2 ASP D 62 3.605 -2.722 18.338 1.00 16.21 D O HETATM 3362 C ASP D 62 1.078 -2.109 14.218 1.00 15.34 D C HETATM 3363 O ASP D 62 -0.117 -2.401 14.322 1.00 14.74 D O HETATM 3364 N GLY D 63 1.552 -1.168 13.403 1.00 15.18 D N HETATM 3365 CA GLY D 63 0.686 -0.343 12.590 1.00 16.43 D C HETATM 3366 C GLY D 63 -0.014 -1.120 11.491 1.00 17.99 D C HETATM 3367 O GLY D 63 -1.240 -1.027 11.358 1.00 16.78 D O HETATM 3368 N MET D 64 0.748 -1.929 10.751 1.00 18.08 D N HETATM 3369 CA MET D 64 0.218 -2.765 9.660 1.00 19.91 D C HETATM 3370 CB MET D 64 1.354 -3.593 9.029 1.00 20.97 D C HETATM 3371 CG MET D 64 0.915 -4.569 7.929 1.00 28.98 D C HETATM 3372 SD MET D 64 2.159 -5.770 7.429 1.00 34.85 D S HETATM 3373 CE MET D 64 3.253 -4.751 6.466 1.00 33.42 D C HETATM 3374 C MET D 64 -0.871 -3.714 10.177 1.00 19.60 D C HETATM 3375 O MET D 64 -1.931 -3.862 9.559 1.00 19.76 D O HETATM 3376 N ALA D 65 -0.604 -4.286 11.349 1.00 18.75 D N HETATM 3377 CA ALA D 65 -1.486 -5.234 12.020 1.00 17.62 D C HETATM 3378 CB ALA D 65 -0.713 -5.951 13.120 1.00 17.41 D C HETATM 3379 C ALA D 65 -2.779 -4.640 12.586 1.00 17.05 D C HETATM 3380 O ALA D 65 -3.697 -5.387 12.927 1.00 18.62 D O HETATM 3381 N SER D 66 -2.853 -3.308 12.663 1.00 15.68 D N HETATM 3382 CA SER D 66 -4.025 -2.608 13.200 1.00 16.10 D C HETATM 3383 CB SER D 66 -3.608 -1.313 13.882 1.00 14.75 D C HETATM 3384 OG SER D 66 -2.707 -1.577 14.940 1.00 16.05 D O HETATM 3385 C SER D 66 -5.155 -2.330 12.210 1.00 15.62 D C HETATM 3386 O SER D 66 -6.265 -1.992 12.623 1.00 16.13 D O HETATM 3387 N GLY D 67 -4.862 -2.432 10.913 1.00 16.90 D N HETATM 3388 CA GLY D 67 -5.883 -2.231 9.890 1.00 17.29 D C HETATM 3389 C GLY D 67 -6.170 -0.816 9.422 1.00 18.08 D C HETATM 3390 O GLY D 67 -5.791 0.156 10.074 1.00 16.12 D O HETATM 3391 N LEU D 68 -6.849 -0.730 8.274 1.00 18.85 D N HETATM 3392 CA LEU D 68 -7.246 0.517 7.608 1.00 20.70 D C HETATM 3393 CB LEU D 68 -7.959 0.174 6.286 1.00 23.02 D C HETATM 3394 CG LEU D 68 -8.409 1.244 5.278 1.00 24.46 D C HETATM 3395 CD1 LEU D 68 -7.220 1.894 4.619 1.00 24.23 D C HETATM 3396 CD2 LEU D 68 -9.287 0.606 4.217 1.00 25.54 D C HETATM 3397 C LEU D 68 -8.122 1.439 8.459 1.00 21.08 D C HETATM 3398 O LEU D 68 -7.984 2.663 8.395 1.00 20.50 D O HETATM 3399 N ASP D 69 -8.992 0.836 9.273 1.00 20.50 D N HETATM 3400 CA ASP D 69 -9.907 1.562 10.162 1.00 21.68 D C HETATM 3401 CB ASP D 69 -10.982 0.613 10.714 1.00 23.46 D C HETATM 3402 CG ASP D 69 -10.397 -0.574 11.474 1.00 24.68 D C HETATM 3403 OD1 ASP D 69 -9.690 -1.400 10.854 1.00 28.06 D O HETATM 3404 OD2 ASP D 69 -10.654 -0.680 12.691 1.00 26.38 D O HETATM 3405 C ASP D 69 -9.218 2.303 11.312 1.00 21.81 D C HETATM 3406 O ASP D 69 -9.788 3.233 11.888 1.00 24.24 D O HETATM 3407 N LYS D 70 -8.007 1.860 11.652 1.25 20.80 D N HETATM 3408 CA LYS D 70 -7.217 2.474 12.716 0.87 18.79 D C HETATM 3409 CB LYS D 70 -6.670 1.405 13.679 0.80 19.34 D C HETATM 3410 CG LYS D 70 -7.714 0.515 14.372 1.23 18.75 D C HETATM 3411 CD LYS D 70 -8.712 1.309 15.213 0.94 19.23 D C HETATM 3412 CE LYS D 70 -9.603 0.388 16.031 0.91 19.69 D C HETATM 3413 NZ LYS D 70 -10.670 1.153 16.728 0.76 20.30 D N HETATM 3414 C LYS D 70 -6.064 3.298 12.127 1.06 17.66 D C HETATM 3415 O LYS D 70 -5.080 3.573 12.817 1.09 16.69 D O HETATM 3416 N ASP D 71 -6.210 3.691 10.853 1.00 15.94 D N HETATM 3417 CA ASP D 71 -5.227 4.490 10.086 1.00 17.09 D C HETATM 3418 CB ASP D 71 -5.152 5.938 10.610 1.00 18.22 D C HETATM 3419 CG ASP D 71 -6.453 6.698 10.433 1.00 20.66 D C HETATM 3420 OD1 ASP D 71 -7.075 6.592 9.357 1.00 20.55 D O HETATM 3421 OD2 ASP D 71 -6.845 7.413 11.380 1.00 25.18 D O HETATM 3422 C ASP D 71 -3.831 3.871 10.058 1.00 16.23 D C HETATM 3423 O ASP D 71 -2.812 4.580 10.002 1.00 17.32 D O HETATM 3424 N TYR D 72 -3.812 2.536 10.108 1.00 16.11 D N HETATM 3425 CA TYR D 72 -2.601 1.718 10.145 1.00 14.82 D C HETATM 3426 CB TYR D 72 -1.897 1.657 8.783 1.00 13.74 D C HETATM 3427 CG TYR D 72 -2.616 0.773 7.794 1.00 14.06 D C HETATM 3428 CD1 TYR D 72 -2.771 -0.611 8.035 1.00 14.84 D C HETATM 3429 CE1 TYR D 72 -3.472 -1.446 7.119 1.00 14.55 D C HETATM 3430 CD2 TYR D 72 -3.167 1.311 6.618 1.00 13.74 D C HETATM 3431 CE2 TYR D 72 -3.866 0.489 5.692 1.00 15.98 D C HETATM 3432 CZ TYR D 72 -4.013 -0.884 5.954 1.00 15.09 D C HETATM 3433 OH TYR D 72 -4.681 -1.674 5.060 1.00 14.98 D O HETATM 3434 C TYR D 72 -1.655 2.115 11.269 1.00 15.79 D C HETATM 3435 O TYR D 72 -0.438 2.198 11.094 1.00 13.84 D O HETATM 3436 N LEU D 73 -2.250 2.382 12.430 1.00 15.32 D N HETATM 3437 CA LEU D 73 -1.537 2.770 13.644 1.00 15.63 D C HETATM 3438 CB LEU D 73 -1.615 4.282 13.864 1.00 15.47 D C HETATM 3439 CG LEU D 73 -0.679 5.159 13.042 1.00 17.43 D C HETATM 3440 CD1 LEU D 73 -1.169 6.574 13.073 1.00 18.32 D C HETATM 3441 CD2 LEU D 73 0.751 5.017 13.554 1.00 15.08 D C HETATM 3442 C LEU D 73 -2.168 2.075 14.833 1.00 15.50 D C HETATM 3443 O LEU D 73 -3.396 1.991 14.919 1.00 17.55 D O HETATM 3444 N LYS D 74 -1.333 1.570 15.741 1.00 15.67 D N HETATM 3445 CA LYS D 74 -1.820 0.892 16.944 1.00 17.55 D C HETATM 3446 CB LYS D 74 -0.691 0.116 17.634 1.00 17.66 D C HETATM 3447 CG LYS D 74 -1.142 -0.733 18.847 1.00 18.77 D C HETATM 3448 CD LYS D 74 -0.018 -1.570 19.440 1.00 20.52 D C HETATM 3449 CE LYS D 74 1.049 -0.722 20.121 1.00 22.21 D C HETATM 3450 NZ LYS D 74 2.183 -1.560 20.601 1.00 24.28 D N HETATM 3451 C LYS D 74 -2.398 1.943 17.886 1.00 17.58 D C HETATM 3452 O LYS D 74 -1.719 2.926 18.186 1.00 18.29 D O HETATM 3453 N PRO D 75 -3.681 1.790 18.301 1.00 19.19 D N HETATM 3454 CD PRO D 75 -4.670 0.771 17.891 1.00 19.96 D C HETATM 3455 CA PRO D 75 -4.312 2.758 19.209 1.00 20.74 D C HETATM 3456 CB PRO D 75 -5.675 2.127 19.483 1.00 20.38 D C HETATM 3457 CG PRO D 75 -5.980 1.449 18.200 1.00 21.00 D C HETATM 3458 C PRO D 75 -3.519 2.941 20.499 1.00 20.90 D C HETATM 3459 O PRO D 75 -3.004 1.970 21.061 1.00 21.52 D O HETATM 3460 N ASP D 76 -3.334 4.209 20.874 1.00 22.30 D N HETATM 3461 CA ASP D 76 -2.608 4.632 22.078 1.00 22.70 D C HETATM 3462 CB ASP D 76 -3.359 4.204 23.363 1.00 26.27 D C HETATM 3463 CG ASP D 76 -4.792 4.721 23.413 1.00 28.63 D C HETATM 3464 OD2 ASP D 76 -5.723 3.889 23.347 1.00 30.99 D O HETATM 3465 OD1 ASP D 76 -4.988 5.950 23.513 1.00 33.31 D O HETATM 3466 C ASP D 76 -1.136 4.192 22.131 1.00 22.79 D C HETATM 3467 O ASP D 76 -0.577 3.987 23.216 1.00 23.46 D O HETATM 3468 N ASP D 77 -0.513 4.060 20.954 1.00 21.52 D N HETATM 3469 CA ASP D 77 0.900 3.663 20.837 1.00 20.69 D C HETATM 3470 CB ASP D 77 1.282 3.475 19.356 1.00 20.05 D C HETATM 3471 CG ASP D 77 2.629 2.761 19.157 1.00 19.03 D C HETATM 3472 OD1 ASP D 77 3.541 2.878 20.008 1.00 16.98 D O HETATM 3473 OD2 ASP D 77 2.776 2.081 18.122 1.00 17.76 D O HETATM 3474 C ASP D 77 1.756 4.761 21.477 1.00 19.47 D C HETATM 3475 O ASP D 77 1.842 5.875 20.958 1.00 20.34 D O HETATM 3476 N SER D 78 2.382 4.414 22.602 1.00 19.26 D N HETATM 3477 CA SER D 78 3.223 5.327 23.385 1.00 20.95 D C HETATM 3478 CB SER D 78 3.577 4.687 24.735 1.00 22.12 D C HETATM 3479 OG SER D 78 4.425 3.557 24.572 1.00 24.75 D O HETATM 3480 C SER D 78 4.502 5.793 22.688 1.00 19.79 D C HETATM 3481 O SER D 78 5.150 6.743 23.142 1.00 20.86 D O HETATM 3482 N ARG D 79 4.848 5.123 21.589 1.00 18.26 D N HETATM 3483 CA ARG D 79 6.050 5.440 20.818 1.00 18.05 D C HETATM 3484 CB ARG D 79 6.614 4.169 20.185 1.00 17.35 D C HETATM 3485 CG ARG D 79 6.978 3.068 21.183 1.00 18.39 D C HETATM 3486 CD ARG D 79 7.218 1.743 20.471 1.00 19.52 D C HETATM 3487 NE ARG D 79 5.993 1.273 19.824 1.00 18.45 D N HETATM 3488 CZ ARG D 79 5.814 0.059 19.316 1.00 18.16 D C HETATM 3489 NH1 ARG D 79 6.780 -0.848 19.364 1.00 18.29 D N HETATM 3490 NH2 ARG D 79 4.659 -0.244 18.744 1.00 16.69 D N HETATM 3491 C ARG D 79 5.802 6.504 19.746 1.00 16.71 D C HETATM 3492 O ARG D 79 6.750 7.109 19.235 1.00 16.46 D O HETATM 3493 N VAL D 80 4.529 6.716 19.410 1.00 15.45 D N HETATM 3494 CA VAL D 80 4.122 7.713 18.419 1.00 14.81 D C HETATM 3495 CB VAL D 80 2.759 7.346 17.739 1.00 15.21 D C HETATM 3496 CG1 VAL D 80 2.341 8.419 16.740 1.00 16.52 D C HETATM 3497 CG2 VAL D 80 2.874 6.019 17.005 1.00 16.71 D C HETATM 3498 C VAL D 80 4.020 9.082 19.096 1.00 14.41 D C HETATM 3499 O VAL D 80 3.112 9.331 19.898 1.00 14.00 D O HETATM 3500 N ILE D 81 4.952 9.963 18.741 1.00 14.38 D N HETATM 3501 CA ILE D 81 5.020 11.326 19.284 1.00 15.39 D C HETATM 3502 CB ILE D 81 6.407 11.975 18.977 1.00 15.72 D C HETATM 3503 CG2 ILE D 81 6.500 13.397 19.567 1.00 14.89 D C HETATM 3504 CG1 ILE D 81 7.524 11.097 19.559 1.00 14.83 D C HETATM 3505 CD1 ILE D 81 8.910 11.501 19.138 1.00 13.83 D C HETATM 3506 C ILE D 81 3.887 12.180 18.710 1.00 16.64 D C HETATM 3507 O ILE D 81 3.246 12.948 19.437 1.00 16.49 D O HETATM 3508 N ALA D 82 3.639 12.010 17.411 1.00 15.13 D N HETATM 3509 CA ALA D 82 2.598 12.740 16.695 1.00 15.50 D C HETATM 3510 CB ALA D 82 3.069 14.140 16.369 1.00 14.32 D C HETATM 3511 C ALA D 82 2.254 12.020 15.410 1.00 15.21 D C HETATM 3512 O ALA D 82 3.112 11.351 14.824 1.00 15.64 D O HETATM 3513 N HIS D 83 1.012 12.194 14.956 1.00 14.61 D N HETATM 3514 CA HIS D 83 0.539 11.570 13.721 1.00 15.21 D C HETATM 3515 CB HIS D 83 0.236 10.069 13.936 1.00 16.82 D C HETATM 3516 CG HIS D 83 -0.970 9.798 14.788 1.00 17.01 D C HETATM 3517 CD2 HIS D 83 -1.106 9.643 16.126 1.00 18.57 D C HETATM 3518 ND1 HIS D 83 -2.240 9.689 14.259 1.00 18.18 D N HETATM 3519 CE1 HIS D 83 -3.105 9.483 15.236 1.00 18.85 D C HETATM 3520 NE2 HIS D 83 -2.442 9.450 16.379 1.00 16.40 D N HETATM 3521 C HIS D 83 -0.690 12.227 13.107 1.00 16.03 D C HETATM 3522 O HIS D 83 -1.512 12.806 13.816 1.00 15.30 D O HETATM 3523 N THR D 84 -0.813 12.101 11.787 1.00 16.84 D N HETATM 3524 CA THR D 84 -1.985 12.589 11.054 1.00 17.14 D C HETATM 3525 CB THR D 84 -1.646 13.094 9.612 1.00 16.60 D C HETATM 3526 OG1 THR D 84 -1.144 12.013 8.817 1.00 15.67 D O HETATM 3527 CG2 THR D 84 -0.656 14.226 9.623 1.00 18.46 D C HETATM 3528 C THR D 84 -2.846 11.334 10.882 1.00 17.28 D C HETATM 3529 O THR D 84 -2.457 10.244 11.322 1.00 15.80 D O HETATM 3530 N LYS D 85 -4.009 11.480 10.251 1.00 18.58 D N HETATM 3531 CA LYS D 85 -4.847 10.320 9.968 1.00 19.69 D C HETATM 3532 CB LYS D 85 -6.350 10.653 10.069 1.00 23.57 D C HETATM 3533 CG LYS D 85 -6.943 11.553 8.990 1.00 26.86 D C HETATM 3534 CD LYS D 85 -8.417 11.816 9.269 1.00 31.04 D C HETATM 3535 CE LYS D 85 -9.023 12.792 8.270 1.00 31.64 D C HETATM 3536 NZ LYS D 85 -10.447 13.103 8.604 1.00 34.07 D N HETATM 3537 C LYS D 85 -4.440 9.872 8.556 1.00 18.74 D C HETATM 3538 O LYS D 85 -3.628 10.539 7.899 1.00 18.04 D O HETATM 3539 N LEU D 86 -4.970 8.739 8.109 1.00 18.72 D N HETATM 3540 CA LEU D 86 -4.662 8.216 6.779 1.00 18.07 D C HETATM 3541 CB LEU D 86 -4.957 6.718 6.732 1.00 20.83 D C HETATM 3542 CG LEU D 86 -4.202 5.832 5.748 1.00 21.94 D C HETATM 3543 CD1 LEU D 86 -2.759 5.628 6.183 1.00 21.77 D C HETATM 3544 CD2 LEU D 86 -4.899 4.505 5.664 1.00 20.43 D C HETATM 3545 C LEU D 86 -5.517 8.959 5.753 1.00 17.72 D C HETATM 3546 O LEU D 86 -6.729 9.094 5.940 1.00 18.21 D O HETATM 3547 N ILE D 87 -4.871 9.520 4.731 1.00 16.35 D N HETATM 3548 CA ILE D 87 -5.582 10.264 3.694 1.00 16.54 D C HETATM 3549 CB ILE D 87 -5.219 11.783 3.678 1.00 16.60 D C HETATM 3550 CG2 ILE D 87 -5.759 12.467 4.927 1.00 18.54 D C HETATM 3551 CG1 ILE D 87 -3.710 11.998 3.499 1.00 17.17 D C HETATM 3552 CD1 ILE D 87 -3.340 13.373 3.028 1.00 15.84 D C HETATM 3553 C ILE D 87 -5.413 9.721 2.284 1.00 17.22 D C HETATM 3554 O ILE D 87 -4.330 9.263 1.900 1.00 15.04 D O HETATM 3555 N GLY D 88 -6.503 9.787 1.523 1.00 16.81 D N HETATM 3556 CA GLY D 88 -6.494 9.355 0.136 1.00 18.67 D C HETATM 3557 C GLY D 88 -6.252 10.567 -0.742 1.00 18.26 D C HETATM 3558 O GLY D 88 -6.052 11.670 -0.227 1.00 20.08 D O HETATM 3559 N SER D 89 -6.248 10.373 -2.059 1.00 18.67 D N HETATM 3560 CA SER D 89 -6.032 11.476 -2.994 1.00 18.41 D C HETATM 3561 CB SER D 89 -5.889 10.958 -4.413 1.00 20.35 D C HETATM 3562 OG SER D 89 -7.050 10.251 -4.819 1.00 20.35 D O HETATM 3563 C SER D 89 -7.119 12.544 -2.929 1.00 18.90 D C HETATM 3564 O SER D 89 -8.301 12.226 -2.768 1.00 20.21 D O HETATM 3565 N GLY D 90 -6.689 13.805 -2.983 1.00 18.88 D N HETATM 3566 CA GLY D 90 -7.611 14.932 -2.923 1.00 19.43 D C HETATM 3567 C GLY D 90 -7.997 15.331 -1.508 1.00 19.73 D C HETATM 3568 O GLY D 90 -8.648 16.359 -1.313 1.00 19.61 D O HETATM 3569 N GLU D 91 -7.612 14.510 -0.527 1.00 19.00 D N HETATM 3570 CA GLU D 91 -7.905 14.769 0.883 1.00 18.46 D C HETATM 3571 CB GLU D 91 -8.272 13.475 1.614 1.00 19.51 D C HETATM 3572 CG GLU D 91 -9.406 12.674 0.993 1.00 21.40 D C HETATM 3573 CD GLU D 91 -9.738 11.408 1.767 1.00 24.38 D C HETATM 3574 OE1 GLU D 91 -8.869 10.883 2.501 1.00 23.76 D O HETATM 3575 OE2 GLU D 91 -10.884 10.932 1.638 1.00 26.98 D O HETATM 3576 C GLU D 91 -6.700 15.405 1.569 1.00 18.71 D C HETATM 3577 O GLU D 91 -5.604 15.435 1.010 1.00 16.53 D O HETATM 3578 N LYS D 92 -6.919 15.931 2.774 1.00 19.00 D N HETATM 3579 CA LYS D 92 -5.862 16.571 3.551 1.00 19.97 D C HETATM 3580 CB LYS D 92 -5.667 18.042 3.124 1.00 23.00 D C HETATM 3581 CG LYS D 92 -6.932 18.908 3.092 1.00 26.97 D C HETATM 3582 CD LYS D 92 -6.657 20.301 2.523 1.00 30.28 D C HETATM 3583 CE LYS D 92 -5.957 21.208 3.526 1.00 32.86 D C HETATM 3584 NZ LYS D 92 -6.829 21.512 4.698 1.00 36.05 D N HETATM 3585 C LYS D 92 -6.089 16.477 5.052 1.00 19.53 D C HETATM 3586 O LYS D 92 -7.220 16.284 5.507 1.00 20.29 D O HETATM 3587 N ASP D 93 -4.990 16.532 5.806 1.00 19.50 D N HETATM 3588 CA ASP D 93 -5.039 16.494 7.265 1.00 18.90 D C HETATM 3589 CB ASP D 93 -5.115 15.057 7.801 1.00 18.86 D C HETATM 3590 CG ASP D 93 -5.511 14.997 9.274 1.00 18.98 D C HETATM 3591 OD1 ASP D 93 -6.449 15.716 9.689 1.00 17.42 D O HETATM 3592 OD2 ASP D 93 -4.876 14.229 10.021 1.00 21.63 D O HETATM 3593 C ASP D 93 -3.836 17.206 7.856 1.00 18.66 D C HETATM 3594 O ASP D 93 -2.766 17.268 7.247 1.00 19.75 D O HETATM 3595 N SER D 94 -4.041 17.750 9.051 1.00 18.33 D N HETATM 3596 CA SER D 94 -3.009 18.468 9.774 1.00 17.27 D C HETATM 3597 CB SER D 94 -3.352 19.960 9.850 1.00 20.05 D C HETATM 3598 OG SER D 94 -3.532 20.526 8.565 1.00 22.68 D O HETATM 3599 C SER D 94 -2.883 17.932 11.188 1.00 16.70 D C HETATM 3600 O SER D 94 -3.849 17.411 11.753 1.00 15.48 D O HETATM 3601 N VAL D 95 -1.668 18.013 11.725 1.00 16.13 D N HETATM 3602 CA VAL D 95 -1.393 17.621 13.101 1.00 13.49 D C HETATM 3603 CB VAL D 95 -0.830 16.164 13.252 1.00 14.32 D C HETATM 3604 CG1 VAL D 95 0.531 15.997 12.567 1.00 13.41 D C HETATM 3605 CG2 VAL D 95 -0.730 15.783 14.728 1.00 15.32 D C HETATM 3606 C VAL D 95 -0.432 18.646 13.682 1.00 13.02 D C HETATM 3607 O VAL D 95 0.499 19.100 13.011 1.00 12.56 D O HETATM 3608 N THR D 96 -0.731 19.060 14.906 1.00 12.42 D N HETATM 3609 CA THR D 96 0.097 20.005 15.627 1.00 11.81 D C HETATM 3610 CB THR D 96 -0.662 21.329 15.889 1.00 12.10 D C HETATM 3611 OG1 THR D 96 -1.099 21.871 14.639 1.00 14.85 D O HETATM 3612 CG2 THR D 96 0.236 22.350 16.543 1.00 11.37 D C HETATM 3613 C THR D 96 0.504 19.328 16.933 1.00 12.98 D C HETATM 3614 O THR D 96 -0.312 18.664 17.576 1.00 12.90 D O HETATM 3615 N PHE D 97 1.776 19.473 17.299 1.00 13.75 D N HETATM 3616 CA PHE D 97 2.286 18.883 18.531 1.00 14.66 D C HETATM 3617 CB PHE D 97 2.960 17.519 18.268 1.00 14.31 D C HETATM 3618 CG PHE D 97 4.172 17.575 17.363 1.00 11.96 D C HETATM 3619 CD1 PHE D 97 4.021 17.587 15.963 1.00 12.43 D C HETATM 3620 CD2 PHE D 97 5.472 17.585 17.907 1.00 13.16 D C HETATM 3621 CE1 PHE D 97 5.154 17.610 15.105 1.00 14.37 D C HETATM 3622 CE2 PHE D 97 6.615 17.611 17.065 1.00 14.53 D C HETATM 3623 CZ PHE D 97 6.453 17.623 15.660 1.00 13.54 D C HETATM 3624 C PHE D 97 3.217 19.814 19.290 1.00 15.33 D C HETATM 3625 O PHE D 97 3.807 20.716 18.696 1.00 14.61 D O HETATM 3626 N ASP D 98 3.375 19.555 20.589 1.00 16.29 D N HETATM 3627 CA ASP D 98 4.248 20.353 21.455 1.00 17.65 D C HETATM 3628 CB ASP D 98 3.949 20.082 22.944 1.00 21.15 D C HETATM 3629 CG ASP D 98 2.551 20.530 23.374 1.00 25.59 D C HETATM 3630 OD1 ASP D 98 1.907 21.337 22.664 1.00 27.12 D O HETATM 3631 OD2 ASP D 98 2.093 20.070 24.445 1.00 26.03 D O HETATM 3632 C ASP D 98 5.710 20.020 21.163 1.00 18.04 D C HETATM 3633 O ASP D 98 6.093 18.849 21.150 1.00 17.17 D O HETATM 3634 N VAL D 99 6.514 21.058 20.934 1.00 16.63 D N HETATM 3635 CA VAL D 99 7.944 20.917 20.641 1.00 17.99 D C HETATM 3636 CB VAL D 99 8.507 22.250 20.064 1.00 16.62 D C HETATM 3637 CG1 VAL D 99 10.027 22.248 19.922 1.00 18.63 D C HETATM 3638 CG2 VAL D 99 7.898 22.490 18.702 1.00 16.39 D C HETATM 3639 C VAL D 99 8.715 20.422 21.875 1.00 18.41 D C HETATM 3640 O VAL D 99 9.804 19.852 21.749 1.00 18.89 D O HETATM 3641 N SER D 100 8.080 20.549 23.043 1.00 18.46 D N HETATM 3642 CA SER D 100 8.638 20.105 24.322 1.00 19.33 D C HETATM 3643 CB SER D 100 7.761 20.589 25.483 1.00 19.07 D C HETATM 3644 OG SER D 100 6.453 20.039 25.428 1.00 20.69 D O HETATM 3645 C SER D 100 8.797 18.577 24.375 1.00 18.07 D C HETATM 3646 O SER D 100 9.546 18.056 25.199 1.00 16.79 D O HETATM 3647 N LYS D 101 8.112 17.879 23.464 1.00 17.56 D N HETATM 3648 CA LYS D 101 8.176 16.416 23.355 1.00 16.91 D C HETATM 3649 CB LYS D 101 6.906 15.869 22.694 1.00 16.70 D C HETATM 3650 CG LYS D 101 5.669 15.969 23.564 1.00 17.26 D C HETATM 3651 CD LYS D 101 4.456 15.339 22.903 1.00 19.98 D C HETATM 3652 CE LYS D 101 3.354 15.127 23.929 1.00 20.32 D C HETATM 3653 NZ LYS D 101 2.087 14.659 23.307 1.00 21.28 D N HETATM 3654 C LYS D 101 9.416 15.966 22.572 1.00 16.87 D C HETATM 3655 O LYS D 101 9.665 14.767 22.422 1.00 17.29 D O HETATM 3656 N LEU D 102 10.166 16.940 22.051 1.00 16.63 D N HETATM 3657 CA LEU D 102 11.394 16.690 21.296 1.00 16.19 D C HETATM 3658 CB LEU D 102 11.350 17.387 19.932 1.00 15.30 D C HETATM 3659 CG LEU D 102 10.186 17.126 18.967 1.00 14.73 D C HETATM 3660 CD1 LEU D 102 10.321 18.052 17.770 1.00 16.80 D C HETATM 3661 CD2 LEU D 102 10.149 15.663 18.526 1.00 16.62 D C HETATM 3662 C LEU D 102 12.621 17.167 22.083 1.00 18.55 D C HETATM 3663 O LEU D 102 12.533 18.104 22.882 1.00 18.49 D O HETATM 3664 N LYS D 103 13.757 16.524 21.816 1.00 21.37 D N HETATM 3665 CA LYS D 103 15.046 16.795 22.459 1.00 24.72 D C HETATM 3666 CB LYS D 103 15.426 15.559 23.296 1.00 27.29 D C HETATM 3667 CG LYS D 103 16.795 15.522 23.969 1.00 31.93 D C HETATM 3668 CD LYS D 103 17.085 14.107 24.457 1.00 33.93 D C HETATM 3669 CE LYS D 103 18.512 13.946 24.963 1.00 37.52 D C HETATM 3670 NZ LYS D 103 18.747 14.621 26.269 1.00 38.56 D N HETATM 3671 C LYS D 103 16.111 17.040 21.386 1.00 26.13 D C HETATM 3672 O LYS D 103 16.075 16.417 20.323 1.00 25.03 D O HETATM 3673 N GLU D 104 17.062 17.932 21.681 1.00 28.17 D N HETATM 3674 CA GLU D 104 18.176 18.237 20.770 1.00 29.68 D C HETATM 3675 CB GLU D 104 18.904 19.518 21.195 1.00 31.41 D C HETATM 3676 CG GLU D 104 18.218 20.817 20.827 1.00 32.38 D C HETATM 3677 CD GLU D 104 19.028 22.028 21.242 1.00 34.19 D C HETATM 3678 OE1 GLU D 104 18.673 22.657 22.260 1.00 35.33 D O HETATM 3679 OE2 GLU D 104 20.021 22.351 20.552 1.00 35.67 D O HETATM 3680 C GLU D 104 19.184 17.087 20.796 1.00 30.21 D C HETATM 3681 O GLU D 104 19.452 16.517 21.858 1.00 30.90 D O HETATM 3682 N GLY D 105 19.710 16.737 19.624 1.00 30.26 D N HETATM 3683 CA GLY D 105 20.689 15.666 19.526 1.00 30.60 D C HETATM 3684 C GLY D 105 20.132 14.256 19.425 1.00 30.91 D C HETATM 3685 O GLY D 105 20.902 13.290 19.390 1.00 31.57 D O HETATM 3686 N GLU D 106 18.803 14.132 19.428 1.00 28.95 D N HETATM 3687 CA GLU D 106 18.152 12.831 19.308 1.00 28.18 D C HETATM 3688 CB GLU D 106 17.005 12.682 20.318 1.00 27.26 D C HETATM 3689 CG GLU D 106 16.375 11.274 20.363 1.00 27.23 D C HETATM 3690 CD GLU D 106 15.470 11.046 21.562 1.00 27.15 D C HETATM 3691 OE1 GLU D 106 15.489 9.924 22.114 1.00 28.17 D O HETATM 3692 OE2 GLU D 106 14.740 11.975 21.957 1.00 25.01 D O HETATM 3693 C GLU D 106 17.648 12.678 17.877 1.00 26.88 D C HETATM 3694 O GLU D 106 17.159 13.637 17.273 1.00 25.55 D O HETATM 3695 N GLN D 107 17.813 11.470 17.341 1.00 27.26 D N HETATM 3696 CA GLN D 107 17.397 11.144 15.981 1.00 25.99 D C HETATM 3697 CB GLN D 107 18.288 10.034 15.402 1.00 29.78 D C HETATM 3698 CG GLN D 107 19.731 10.452 15.087 1.00 35.04 D C HETATM 3699 CD GLN D 107 19.834 11.438 13.926 1.00 38.62 D C HETATM 3700 OE1 GLN D 107 20.288 12.572 14.098 1.00 40.93 D O HETATM 3701 NE2 GLN D 107 19.414 11.007 12.737 1.00 40.37 D N HETATM 3702 C GLN D 107 15.930 10.735 15.903 1.00 21.95 D C HETATM 3703 O GLN D 107 15.512 9.759 16.538 1.00 22.42 D O HETATM 3704 N TYR D 108 15.139 11.537 15.192 1.00 19.06 D N HETATM 3705 CA TYR D 108 13.719 11.242 15.008 1.00 15.23 D C HETATM 3706 CB TYR D 108 12.826 12.428 15.379 1.00 13.75 D C HETATM 3707 CG TYR D 108 12.945 12.861 16.817 1.00 14.86 D C HETATM 3708 CD1 TYR D 108 12.378 12.089 17.852 1.00 14.19 D C HETATM 3709 CE1 TYR D 108 12.539 12.461 19.211 1.00 14.68 D C HETATM 3710 CD2 TYR D 108 13.669 14.021 17.160 1.00 15.11 D C HETATM 3711 CE2 TYR D 108 13.834 14.400 18.512 1.00 16.82 D C HETATM 3712 CZ TYR D 108 13.269 13.612 19.524 1.00 15.07 D C HETATM 3713 OH TYR D 108 13.442 13.966 20.838 1.00 17.64 D O HETATM 3714 C TYR D 108 13.472 10.876 13.561 1.00 14.84 D C HETATM 3715 O TYR D 108 14.172 11.353 12.659 1.00 14.09 D O HETATM 3716 N MET D 109 12.487 10.007 13.359 1.00 14.23 D N HETATM 3717 CA MET D 109 12.109 9.547 12.031 1.00 13.77 D C HETATM 3718 CB MET D 109 12.328 8.035 11.895 1.00 15.74 D C HETATM 3719 CG MET D 109 13.775 7.593 11.770 1.00 17.76 D C HETATM 3720 SD MET D 109 14.548 8.179 10.289 1.00 19.44 D S HETATM 3721 CE MET D 109 13.617 7.188 9.079 1.00 22.03 D C HETATM 3722 C MET D 109 10.651 9.821 11.748 1.00 11.62 D C HETATM 3723 O MET D 109 9.813 9.664 12.635 1.00 14.52 D O HETATM 3724 N PHE D 110 10.364 10.314 10.545 1.00 10.00 D N HETATM 3725 CA PHE D 110 8.982 10.511 10.131 1.00 9.87 D C HETATM 3726 CB PHE D 110 8.632 11.962 9.763 1.00 10.03 D C HETATM 3727 CG PHE D 110 9.190 12.451 8.453 1.00 11.03 D C HETATM 3728 CD1 PHE D 110 8.485 12.251 7.239 1.00 10.88 D C HETATM 3729 CD2 PHE D 110 10.371 13.200 8.431 1.00 11.22 D C HETATM 3730 CE1 PHE D 110 8.952 12.797 6.028 1.00 10.90 D C HETATM 3731 CE2 PHE D 110 10.854 13.758 7.219 1.00 11.46 D C HETATM 3732 CZ PHE D 110 10.141 13.556 6.019 1.00 13.15 D C HETATM 3733 C PHE D 110 8.740 9.502 9.014 1.00 9.76 D C HETATM 3734 O PHE D 110 9.650 9.205 8.241 1.00 9.02 D O HETATM 3735 N PHE D 111 7.531 8.944 8.968 1.00 9.23 D N HETATM 3736 CA PHE D 111 7.199 7.903 7.994 1.00 11.10 D C HETATM 3737 CB PHE D 111 7.855 6.557 8.425 1.00 12.34 D C HETATM 3738 CG PHE D 111 7.634 6.201 9.890 1.00 12.41 D C HETATM 3739 CD1 PHE D 111 8.416 6.801 10.902 1.00 12.17 D C HETATM 3740 CD2 PHE D 111 6.595 5.338 10.272 1.00 14.13 D C HETATM 3741 CE1 PHE D 111 8.163 6.562 12.270 1.00 11.71 D C HETATM 3742 CE2 PHE D 111 6.329 5.082 11.642 1.00 14.03 D C HETATM 3743 CZ PHE D 111 7.114 5.699 12.642 1.00 13.85 D C HETATM 3744 C PHE D 111 5.706 7.662 7.810 1.00 11.33 D C HETATM 3745 O PHE D 111 4.893 8.093 8.630 1.00 13.02 D O HETATM 3746 N CYS D 112 5.377 6.943 6.735 1.00 12.82 D N HETATM 3747 CA CYS D 112 4.007 6.528 6.433 1.00 11.43 D C HETATM 3748 CB CYS D 112 3.685 6.658 4.946 1.00 12.01 D C HETATM 3749 SG CYS D 112 2.035 6.056 4.516 1.00 12.15 D S HETATM 3750 C CYS D 112 3.926 5.060 6.851 1.00 12.40 D C HETATM 3751 O CYS D 112 4.864 4.303 6.605 1.00 11.58 D O HETATM 3752 N THR D 113 2.825 4.666 7.492 1.00 11.25 D N HETATM 3753 CA THR D 113 2.670 3.287 7.960 1.00 12.36 D C HETATM 3754 CB THR D 113 2.147 3.205 9.403 1.00 12.96 D C HETATM 3755 OG1 THR D 113 0.905 3.910 9.507 1.00 12.50 D O HETATM 3756 CG2 THR D 113 3.150 3.749 10.383 1.00 12.87 D C HETATM 3757 C THR D 113 1.827 2.361 7.105 1.00 12.42 D C HETATM 3758 O THR D 113 1.532 1.239 7.532 1.00 14.90 D O HETATM 3759 N PHE D 114 1.449 2.810 5.904 1.00 12.23 D N HETATM 3760 CA PHE D 114 0.671 1.977 4.980 1.00 12.59 D C HETATM 3761 CB PHE D 114 0.316 2.754 3.692 1.00 14.90 D C HETATM 3762 CG PHE D 114 -0.712 2.059 2.818 1.00 14.02 D C HETATM 3763 CD1 PHE D 114 -0.329 1.033 1.924 1.00 16.11 D C HETATM 3764 CD2 PHE D 114 -2.077 2.371 2.937 1.00 15.72 D C HETATM 3765 CE1 PHE D 114 -1.281 0.318 1.169 1.00 16.78 D C HETATM 3766 CE2 PHE D 114 -3.051 1.666 2.187 1.00 16.87 D C HETATM 3767 CZ PHE D 114 -2.645 0.633 1.303 1.00 16.15 D C HETATM 3768 C PHE D 114 1.553 0.754 4.643 1.00 13.27 D C HETATM 3769 O PHE D 114 2.756 0.912 4.413 1.00 13.90 D O HETATM 3770 N PRO D 115 0.972 -0.472 4.638 1.00 13.02 D N HETATM 3771 CD PRO D 115 -0.403 -0.798 5.054 1.00 13.20 D C HETATM 3772 CA PRO D 115 1.694 -1.712 4.337 1.00 13.08 D C HETATM 3773 CB PRO D 115 0.566 -2.712 4.162 1.00 13.40 D C HETATM 3774 CG PRO D 115 -0.381 -2.292 5.180 1.00 15.82 D C HETATM 3775 C PRO D 115 2.591 -1.672 3.108 1.00 12.53 D C HETATM 3776 O PRO D 115 2.157 -1.281 2.018 1.00 12.40 D O HETATM 3777 N GLY D 116 3.870 -1.957 3.347 1.00 13.31 D N HETATM 3778 CA GLY D 116 4.876 -1.980 2.298 1.00 14.21 D C HETATM 3779 C GLY D 116 5.311 -0.656 1.702 1.00 15.05 D C HETATM 3780 O GLY D 116 6.084 -0.642 0.742 1.00 14.28 D O HETATM 3781 N HIS D 117 4.817 0.449 2.262 1.00 15.49 D N HETATM 3782 CA HIS D 117 5.142 1.790 1.771 1.00 13.30 D C HETATM 3783 CB HIS D 117 3.868 2.643 1.633 1.00 14.15 D C HETATM 3784 CG HIS D 117 2.937 2.204 0.538 1.00 15.37 D C HETATM 3785 CD2 HIS D 117 2.905 1.085 -0.227 1.00 14.05 D C HETATM 3786 ND1 HIS D 117 1.865 2.971 0.131 1.00 14.38 D N HETATM 3787 CE1 HIS D 117 1.216 2.344 -0.834 1.00 14.64 D C HETATM 3788 NE2 HIS D 117 1.826 1.197 -1.069 1.00 13.88 D N HETATM 3789 C HIS D 117 6.145 2.551 2.628 1.00 14.10 D C HETATM 3790 O HIS D 117 6.720 3.533 2.155 1.00 14.00 D O HETATM 3791 N SER D 118 6.378 2.084 3.860 1.00 14.27 D N HETATM 3792 CA SER D 118 7.299 2.746 4.799 1.00 14.51 D C HETATM 3793 CB SER D 118 7.270 2.072 6.183 1.00 16.60 D C HETATM 3794 OG SER D 118 7.914 0.808 6.203 1.00 19.47 D O HETATM 3795 C SER D 118 8.741 2.929 4.334 1.00 13.49 D C HETATM 3796 O SER D 118 9.363 3.946 4.647 1.00 12.37 D O HETATM 3797 N ALA D 119 9.238 1.977 3.543 1.00 12.90 D N HETATM 3798 CA ALA D 119 10.606 2.025 3.020 1.00 13.89 D C HETATM 3799 CB ALA D 119 10.975 0.688 2.408 1.00 14.84 D C HETATM 3800 C ALA D 119 10.804 3.142 1.991 1.00 13.20 D C HETATM 3801 O ALA D 119 11.882 3.730 1.899 1.00 12.70 D O HETATM 3802 N LEU D 120 9.746 3.432 1.236 1.00 12.68 D N HETATM 3803 CA LEU D 120 9.778 4.461 0.202 1.00 13.41 D C HETATM 3804 CB LEU D 120 8.896 4.033 -0.976 1.00 16.17 D C HETATM 3805 CG LEU D 120 9.177 2.671 -1.627 1.00 17.29 D C HETATM 3806 CD1 LEU D 120 7.997 2.242 -2.469 1.00 19.38 D C HETATM 3807 CD2 LEU D 120 10.437 2.716 -2.468 1.00 20.48 D C HETATM 3808 C LEU D 120 9.311 5.816 0.724 1.00 14.00 D C HETATM 3809 O LEU D 120 9.559 6.848 0.096 1.00 14.91 D O HETATM 3810 N MET D 121 8.630 5.796 1.874 1.00 13.53 D N HETATM 3811 CA MET D 121 8.075 7.002 2.492 1.00 12.02 D C HETATM 3812 CB MET D 121 6.542 6.914 2.508 1.00 13.33 D C HETATM 3813 CG MET D 121 5.923 6.666 1.163 1.00 12.97 D C HETATM 3814 SD MET D 121 4.166 6.875 1.062 1.00 11.84 D S HETATM 3815 CE MET D 121 4.068 8.648 1.193 1.00 11.96 D C HETATM 3816 C MET D 121 8.589 7.243 3.910 1.00 13.47 D C HETATM 3817 O MET D 121 7.876 7.008 4.894 1.00 11.43 D O HETATM 3818 N LYS D 122 9.825 7.725 4.006 1.00 13.79 D N HETATM 3819 CA LYS D 122 10.452 8.001 5.297 1.00 14.00 D C HETATM 3820 CB LYS D 122 11.094 6.728 5.889 1.00 15.59 D C HETATM 3821 CG LYS D 122 12.147 6.031 5.016 1.00 16.85 D C HETATM 3822 CD LYS D 122 12.740 4.835 5.742 1.00 17.80 D C HETATM 3823 CE LYS D 122 13.738 4.076 4.874 1.00 22.18 D C HETATM 3824 NZ LYS D 122 14.962 4.864 4.565 1.00 24.27 D N HETATM 3825 C LYS D 122 11.472 9.123 5.241 1.00 12.82 D C HETATM 3826 O LYS D 122 11.924 9.506 4.162 1.00 12.45 D O HETATM 3827 N GLY D 123 11.825 9.637 6.417 1.00 12.44 D N HETATM 3828 CA GLY D 123 12.808 10.701 6.510 1.00 11.81 D C HETATM 3829 C GLY D 123 13.168 11.058 7.937 1.00 12.81 D C HETATM 3830 O GLY D 123 12.643 10.469 8.880 1.00 11.22 D O HETATM 3831 N THR D 124 14.011 12.079 8.082 1.00 13.41 D N HETATM 3832 CA THR D 124 14.483 12.558 9.382 1.00 13.66 D C HETATM 3833 CB THR D 124 16.006 12.849 9.348 1.00 14.42 D C HETATM 3834 OG1 THR D 124 16.303 13.753 8.275 1.00 13.82 D O HETATM 3835 CG2 THR D 124 16.812 11.578 9.173 1.00 16.75 D C HETATM 3836 C THR D 124 13.814 13.846 9.862 1.00 13.78 D C HETATM 3837 O THR D 124 13.334 14.650 9.056 1.00 12.18 D O HETATM 3838 N LEU D 125 13.764 14.011 11.182 1.00 13.55 D N HETATM 3839 CA LEU D 125 13.236 15.219 11.819 1.00 15.28 D C HETATM 3840 CB LEU D 125 11.817 15.021 12.376 1.00 14.85 D C HETATM 3841 CG LEU D 125 11.138 16.238 13.033 1.00 17.06 D C HETATM 3842 CD1 LEU D 125 9.692 16.360 12.590 1.00 14.86 D C HETATM 3843 CD2 LEU D 125 11.208 16.139 14.553 1.00 14.72 D C HETATM 3844 C LEU D 125 14.228 15.559 12.923 1.00 16.75 D C HETATM 3845 O LEU D 125 14.545 14.713 13.768 1.00 18.19 D O HETATM 3846 N THR D 126 14.719 16.794 12.904 1.00 17.64 D N HETATM 3847 CA THR D 126 15.698 17.249 13.885 1.00 20.81 D C HETATM 3848 CB THR D 126 17.096 17.424 13.228 1.00 22.56 D C HETATM 3849 OG1 THR D 126 17.358 16.322 12.347 1.00 26.85 D O HETATM 3850 CG2 THR D 126 18.193 17.472 14.288 1.00 24.21 D C HETATM 3851 C THR D 126 15.281 18.575 14.518 1.00 21.26 D C HETATM 3852 O THR D 126 14.784 19.473 13.836 1.00 19.59 D O HETATM 3853 N LEU D 127 15.487 18.676 15.829 1.00 22.25 D N HETATM 3854 CA LEU D 127 15.182 19.884 16.589 1.00 25.56 D C HETATM 3855 CB LEU D 127 14.555 19.514 17.943 1.00 26.39 D C HETATM 3856 CG LEU D 127 13.712 20.441 18.844 1.00 28.19 D C HETATM 3857 CD1 LEU D 127 14.316 20.457 20.233 1.00 27.84 D C HETATM 3858 CD2 LEU D 127 13.531 21.852 18.322 1.00 27.83 D C HETATM 3859 C LEU D 127 16.530 20.588 16.783 1.00 26.91 D C HETATM 3860 O LEU D 127 17.429 20.046 17.435 1.00 28.00 D O HETATM 3861 N LYS D 128 16.677 21.760 16.163 1.00 28.43 D N HETATM 3862 CA LYS D 128 17.912 22.550 16.238 1.00 30.74 D C HETATM 3863 CB LYS D 128 18.894 22.151 15.116 1.00 32.40 D C HETATM 3864 CG LYS D 128 18.334 22.225 13.686 1.00 34.89 D C HETATM 3865 CD LYS D 128 19.427 22.112 12.623 1.00 36.64 D C HETATM 3866 CE LYS D 128 20.228 23.407 12.479 1.00 38.16 D C HETATM 3867 NZ LYS D 128 21.248 23.324 11.391 1.00 40.18 D N HETATM 3868 C LYS D 128 17.670 24.059 16.203 1.00 31.58 D C HETATM 3869 O LYS D 128 16.584 24.484 15.754 1.00 31.48 D O HETATM 3870 OXT LYS D 128 18.573 24.801 16.642 1.00 31.22 D O TER HETATM 3871 O HOH S 1 18.461 -7.320 20.599 1.00 15.72 S O HETATM 3872 O HOH S 2 9.423 9.631 0.236 1.00 13.74 S O HETATM 3873 O HOH S 3 5.317 -7.706 -24.311 1.00 14.69 S O HETATM 3874 O HOH S 4 10.140 -7.835 -5.012 1.00 8.47 S O HETATM 3875 O HOH S 5 2.152 -1.984 -9.951 1.00 14.75 S O HETATM 3876 O HOH S 6 3.930 -20.040 -4.132 1.00 14.48 S O HETATM 3877 O HOH S 7 14.323 6.938 -23.518 1.00 14.64 S O HETATM 3878 O HOH S 8 24.111 -23.332 11.112 1.00 21.41 S O HETATM 3879 O HOH S 9 10.359 0.965 -17.748 1.00 13.29 S O HETATM 3880 O HOH S 10 19.307 -20.105 0.753 1.00 12.82 S O HETATM 3881 O HOH S 11 16.064 -13.237 -6.821 1.00 17.18 S O HETATM 3882 O HOH S 12 24.901 -18.129 -3.254 1.00 15.46 S O HETATM 3883 O HOH S 13 25.564 -16.008 15.667 1.00 14.92 S O HETATM 3884 O HOH S 14 13.242 0.336 -10.767 1.00 21.37 S O HETATM 3885 O HOH S 15 6.625 12.883 -9.556 1.00 17.15 S O HETATM 3886 O HOH S 16 26.717 19.574 -8.460 1.00 13.99 S O HETATM 3887 O HOH S 17 13.166 10.904 -6.037 1.00 13.82 S O HETATM 3888 O HOH S 18 14.985 -0.328 15.841 1.00 18.90 S O HETATM 3889 O HOH S 19 -4.839 16.508 -1.347 1.00 13.71 S O HETATM 3890 O HOH S 20 23.943 0.008 -0.922 1.00 16.24 S O HETATM 3891 O HOH S 21 28.504 16.363 -2.379 1.00 12.34 S O HETATM 3892 O HOH S 22 29.904 -0.401 -6.886 1.00 21.20 S O HETATM 3893 O HOH S 23 13.352 6.034 1.107 1.00 13.64 S O HETATM 3894 O HOH S 24 29.477 15.197 2.270 1.00 22.39 S O HETATM 3895 O HOH S 25 -12.652 -1.887 -10.137 1.00 26.00 S O HETATM 3896 O HOH S 26 -0.889 13.342 17.102 1.00 16.93 S O HETATM 3897 O HOH S 27 14.929 -5.240 -18.335 1.00 18.83 S O HETATM 3898 O HOH S 28 19.357 20.864 -3.647 1.00 16.99 S O HETATM 3899 O HOH S 29 7.397 -13.068 3.290 1.00 17.33 S O HETATM 3900 O HOH S 30 7.333 6.220 -22.182 1.00 26.87 S O HETATM 3901 O HOH S 31 0.434 19.774 2.092 1.00 17.30 S O HETATM 3902 O HOH S 32 -0.114 0.327 -2.898 1.00 16.79 S O HETATM 3903 O HOH S 33 4.757 -7.189 9.834 1.00 17.76 S O HETATM 3904 O HOH S 34 -6.902 -14.651 -15.129 1.00 28.94 S O HETATM 3905 O HOH S 35 21.676 -2.050 6.164 1.00 13.77 S O HETATM 3906 O HOH S 36 -2.626 23.854 18.491 1.00 25.84 S O HETATM 3907 O HOH S 37 -0.158 -17.445 -22.449 1.00 18.82 S O HETATM 3908 O HOH S 38 24.309 -2.377 -2.308 1.00 15.89 S O HETATM 3909 O HOH S 39 1.579 1.486 15.526 1.00 13.84 S O HETATM 3910 O HOH S 40 33.207 9.547 -1.010 1.00 22.99 S O HETATM 3911 O HOH S 41 26.534 -3.926 14.885 1.00 16.47 S O HETATM 3912 O HOH S 42 -1.376 -17.977 -0.072 1.00 12.28 S O HETATM 3913 O HOH S 43 10.735 11.088 2.189 1.00 17.53 S O HETATM 3914 O HOH S 44 21.682 -26.418 7.389 1.00 14.47 S O HETATM 3915 O HOH S 45 -4.022 -10.584 -21.967 1.00 21.79 S O HETATM 3916 O HOH S 46 11.086 -2.403 4.486 1.00 23.14 S O HETATM 3917 O HOH S 47 -9.184 -11.765 -8.357 1.00 17.42 S O HETATM 3918 O HOH S 48 7.434 -13.254 11.806 1.00 17.99 S O HETATM 3919 O HOH S 49 17.209 12.934 5.675 1.00 18.41 S O HETATM 3920 O HOH S 50 1.998 -9.502 8.020 1.00 29.96 S O HETATM 3921 O HOH S 51 22.103 1.398 -19.221 1.00 14.37 S O HETATM 3922 O HOH S 52 13.486 1.303 14.065 1.00 15.15 S O HETATM 3923 O HOH S 53 10.318 -22.598 -6.966 1.00 19.37 S O HETATM 3924 O HOH S 54 0.534 -20.550 -23.804 1.00 26.73 S O HETATM 3925 O HOH S 55 8.808 -0.571 -19.599 1.00 16.61 S O HETATM 3926 O HOH S 56 18.539 -10.021 -13.939 1.00 22.49 S O HETATM 3927 O HOH S 57 12.930 -22.623 3.547 1.00 21.12 S O HETATM 3928 O HOH S 58 20.933 12.051 -25.922 1.00 21.23 S O HETATM 3929 O HOH S 59 3.880 0.614 21.755 1.00 27.50 S O HETATM 3930 O HOH S 60 31.936 -2.583 0.419 1.00 21.39 S O HETATM 3931 O HOH S 61 10.974 19.767 5.184 1.00 21.54 S O HETATM 3932 O HOH S 62 -3.001 19.703 4.819 1.00 14.55 S O HETATM 3933 O HOH S 63 10.459 -10.782 0.328 1.00 18.03 S O HETATM 3934 O HOH S 64 18.536 -9.065 22.696 1.00 28.17 S O HETATM 3935 O HOH S 65 -4.898 -21.583 -10.551 1.00 16.80 S O HETATM 3936 O HOH S 66 34.254 3.820 -3.769 1.00 19.63 S O HETATM 3937 O HOH S 67 -1.205 -18.697 -20.181 1.00 23.14 S O HETATM 3938 O HOH S 68 -16.290 -3.231 -18.599 1.00 21.23 S O HETATM 3939 O HOH S 69 16.141 -13.686 -15.278 1.00 18.93 S O HETATM 3940 O HOH S 70 -3.597 18.093 16.014 2.13 47.85 S O HETATM 3941 O HOH S 71 -9.326 9.580 -2.732 1.00 20.97 S O HETATM 3942 O HOH S 72 23.308 23.456 -4.446 1.00 22.00 S O HETATM 3943 O HOH S 73 14.193 20.632 -6.699 1.00 17.55 S O HETATM 3944 O HOH S 74 1.793 21.332 -0.115 1.00 23.27 S O HETATM 3945 O HOH S 75 -2.790 -3.879 -18.550 1.00 18.12 S O HETATM 3946 O HOH S 76 1.181 14.646 20.246 1.00 20.43 S O HETATM 3947 O HOH S 77 5.846 14.034 -3.363 1.00 18.34 S O HETATM 3948 O HOH S 78 8.470 -5.251 -26.951 1.00 20.86 S O HETATM 3949 O HOH S 79 -1.841 21.065 2.625 1.00 18.05 S O HETATM 3950 O HOH S 80 28.626 20.196 -10.278 1.00 18.22 S O HETATM 3951 O HOH S 81 6.934 19.458 -4.404 1.00 22.44 S O HETATM 3952 O HOH S 82 12.810 15.492 -0.832 1.00 17.90 S O HETATM 3953 O HOH S 83 19.232 17.800 24.203 1.00 28.04 S O HETATM 3954 O HOH S 84 12.909 19.752 -9.031 1.00 23.05 S O HETATM 3955 O HOH S 85 16.893 -5.563 -13.455 1.00 16.93 S O HETATM 3956 O HOH S 86 2.512 -6.483 11.126 1.00 20.74 S O HETATM 3957 O HOH S 87 19.687 15.665 0.757 1.00 18.36 S O HETATM 3958 O HOH S 88 10.501 5.916 -4.735 1.00 13.72 S O HETATM 3959 O HOH S 89 21.744 -9.567 -11.556 1.00 29.41 S O HETATM 3960 O HOH S 90 24.570 13.124 -20.879 1.00 20.31 S O HETATM 3961 O HOH S 91 -1.180 11.914 19.214 1.00 24.18 S O HETATM 3962 O HOH S 92 9.339 7.176 19.761 1.00 15.65 S O HETATM 3963 O HOH S 93 5.751 0.462 -21.966 1.00 19.36 S O HETATM 3964 O HOH S 94 15.338 -3.192 -11.704 1.00 19.17 S O HETATM 3965 O HOH S 95 -4.216 -2.959 19.997 1.00 27.48 S O HETATM 3966 O HOH S 96 0.084 -21.406 -5.982 1.00 17.07 S O HETATM 3967 O HOH S 97 32.240 -8.007 13.465 1.00 21.34 S O HETATM 3968 O HOH S 98 16.872 -2.726 23.933 1.00 24.37 S O HETATM 3969 O HOH S 99 21.794 -12.787 22.773 1.00 29.82 S O HETATM 3970 O HOH S 100 22.507 14.552 -24.028 1.00 19.69 S O HETATM 3971 O HOH S 101 -5.417 15.077 -5.921 1.00 23.37 S O HETATM 3972 O HOH S 102 -0.411 7.057 19.758 1.00 22.58 S O HETATM 3973 O HOH S 103 16.389 16.273 9.457 1.00 22.89 S O HETATM 3974 O HOH S 104 13.870 -1.133 -23.458 1.00 27.97 S O HETATM 3975 O HOH S 105 7.586 19.317 2.050 1.00 20.74 S O HETATM 3976 O HOH S 106 11.312 -0.481 16.794 1.00 14.79 S O HETATM 3977 O HOH S 107 9.745 20.724 2.852 1.00 14.93 S O HETATM 3978 O HOH S 108 -4.750 -8.888 -19.965 1.00 24.77 S O HETATM 3979 O HOH S 109 -3.863 -0.977 21.600 1.00 30.52 S O HETATM 3980 O HOH S 110 -4.226 -10.460 -12.908 1.00 21.00 S O HETATM 3981 O HOH S 111 8.584 16.593 -21.640 1.00 25.30 S O HETATM 3982 O HOH S 112 22.941 5.777 6.559 1.00 22.16 S O HETATM 3983 O HOH S 113 28.788 4.135 -19.532 1.00 22.70 S O HETATM 3984 O HOH S 114 17.106 16.382 2.136 1.00 16.21 S O HETATM 3985 O HOH S 115 6.768 16.411 -5.798 1.00 18.71 S O HETATM 3986 O HOH S 116 24.881 5.337 -21.302 1.00 26.76 S O HETATM 3987 O HOH S 117 7.112 18.773 -11.852 1.00 28.42 S O HETATM 3988 O HOH S 118 -7.270 -12.482 2.105 1.00 24.19 S O HETATM 3989 O HOH S 119 10.962 15.683 -2.963 1.00 26.56 S O HETATM 3990 O HOH S 120 -5.143 4.203 15.625 1.00 20.25 S O HETATM 3991 O HOH S 121 -10.560 -0.135 -8.597 1.00 21.12 S O HETATM 3992 O HOH S 122 27.586 -0.951 -25.353 1.00 28.43 S O HETATM 3993 O HOH S 123 7.208 -13.999 0.880 1.00 19.30 S O HETATM 3994 O HOH S 124 -3.809 -2.988 17.296 1.00 30.96 S O HETATM 3995 O HOH S 125 8.764 -5.109 14.623 1.00 18.87 S O HETATM 3996 O HOH S 126 16.968 10.487 5.047 1.00 23.10 S O HETATM 3997 O HOH S 127 -13.093 -10.753 -5.767 1.00 37.97 S O HETATM 3998 O HOH S 128 30.295 -3.119 -10.444 1.00 18.97 S O HETATM 3999 O HOH S 129 15.206 -4.884 23.323 1.00 21.41 S O HETATM 4000 O HOH S 130 1.246 4.116 -8.308 1.00 27.89 S O HETATM 4001 O HOH S 131 -10.574 3.918 0.064 1.00 25.79 S O HETATM 4002 O HOH S 132 10.469 25.060 12.455 1.00 19.54 S O HETATM 4003 O HOH S 133 -1.148 5.687 17.277 1.00 20.45 S O HETATM 4004 O HOH S 134 13.121 -10.799 -3.647 1.00 29.61 S O HETATM 4005 O HOH S 135 27.756 -10.337 18.268 1.00 24.92 S O HETATM 4006 O HOH S 136 14.448 8.414 -25.581 1.00 19.10 S O HETATM 4007 O HOH S 137 16.062 -14.262 -4.250 1.00 19.35 S O HETATM 4008 O HOH S 138 36.452 -10.269 1.621 1.00 37.74 S O HETATM 4009 O HOH S 139 -6.278 -20.683 -14.609 1.00 22.72 S O HETATM 4010 O HOH S 140 17.730 -26.253 13.129 1.00 23.54 S O HETATM 4011 O HOH S 141 15.434 -12.107 -2.824 1.00 21.30 S O HETATM 4012 O HOH S 142 24.782 -18.362 16.830 1.00 25.78 S O HETATM 4013 O HOH S 143 19.055 -26.560 7.731 1.00 14.81 S O HETATM 4014 O HOH S 144 -6.330 -3.282 6.341 1.00 22.97 S O HETATM 4015 O HOH S 145 -7.281 -3.167 14.757 1.00 22.80 S O HETATM 4016 O HOH S 146 4.233 15.784 -4.589 1.00 18.37 S O HETATM 4017 O HOH S 147 11.356 -5.596 -26.922 1.00 18.29 S O HETATM 4018 O HOH S 148 -3.123 -15.279 -21.334 1.00 28.03 S O HETATM 4019 O HOH S 149 15.323 -24.951 5.460 1.00 26.92 S O HETATM 4020 O HOH S 150 11.133 0.895 -9.325 1.00 25.24 S O HETATM 4021 O HOH S 151 22.151 21.035 -3.723 1.00 19.78 S O HETATM 4022 O HOH S 152 4.991 -9.863 10.415 1.00 19.43 S O HETATM 4023 O HOH S 153 8.136 -12.147 -0.712 1.00 17.56 S O HETATM 4024 O HOH S 154 8.492 -1.160 3.793 1.00 22.31 S O HETATM 4025 O HOH S 155 13.337 25.111 -15.993 1.00 27.78 S O HETATM 4026 O HOH S 156 33.519 -13.256 7.710 1.00 28.87 S O HETATM 4027 O HOH S 157 16.775 -15.407 -8.442 1.00 24.98 S O HETATM 4028 O HOH S 158 -0.132 -9.494 12.045 1.00 32.82 S O HETATM 4029 O HOH S 159 11.632 21.705 7.064 1.00 26.67 S O HETATM 4030 O HOH S 160 9.034 8.517 22.007 1.00 20.87 S O HETATM 4031 O HOH S 161 21.386 -8.371 -17.201 1.00 29.71 S O HETATM 4032 O HOH S 162 -8.098 -2.166 -4.576 1.00 25.63 S O HETATM 4033 O HOH S 163 23.417 -17.455 18.864 1.00 24.39 S O HETATM 4034 O HOH S 164 27.366 -3.283 -20.904 1.00 27.89 S O HETATM 4035 O HOH S 165 23.158 -21.215 20.319 1.00 36.97 S O HETATM 4036 O HOH S 166 6.965 -5.449 9.744 1.00 18.17 S O HETATM 4037 O HOH S 167 16.619 -1.779 -9.365 1.00 25.43 S O HETATM 4038 O HOH S 168 25.534 20.875 -6.436 1.00 21.31 S O HETATM 4039 O HOH S 169 12.435 -0.763 -20.648 1.00 17.00 S O HETATM 4040 O HOH S 170 19.231 -29.398 16.424 1.00 25.09 S O HETATM 4041 O HOH S 171 19.486 18.123 17.120 1.00 26.68 S O HETATM 4042 O HOH S 172 17.391 19.397 0.516 1.00 23.75 S O HETATM 4043 O HOH S 173 6.862 10.425 -8.852 1.00 19.23 S O HETATM 4044 O HOH S 174 16.716 18.848 8.098 1.00 22.26 S O HETATM 4045 O HOH S 175 9.921 -0.774 19.623 1.00 30.87 S O HETATM 4046 O HOH S 176 -8.648 -7.897 -17.077 1.00 24.24 S O HETATM 4047 O HOH S 177 -12.287 1.091 13.895 1.00 35.64 S O HETATM 4048 O HOH S 178 8.939 -7.633 14.948 1.00 20.46 S O HETATM 4049 O HOH S 179 27.468 -18.417 10.659 1.00 25.78 S O HETATM 4050 O HOH S 180 -2.548 -3.318 -25.459 1.00 21.52 S O HETATM 4051 O HOH S 181 23.406 -14.460 21.520 1.00 28.47 S O HETATM 4052 O HOH S 182 18.510 11.231 -26.974 1.00 25.41 S O HETATM 4053 O HOH S 183 17.437 23.639 -7.631 1.00 24.49 S O HETATM 4054 O HOH S 184 13.538 6.978 -1.295 1.00 30.32 S O HETATM 4055 O HOH S 185 18.564 17.845 4.210 1.00 21.84 S O HETATM 4056 O HOH S 186 34.327 -0.479 4.659 1.00 24.39 S O HETATM 4057 O HOH S 187 6.200 -1.225 22.926 1.00 31.40 S O HETATM 4058 O HOH S 188 17.154 13.190 13.336 1.00 33.19 S O HETATM 4059 O HOH S 189 -2.892 16.759 -8.736 1.00 34.90 S O HETATM 4060 O HOH S 190 -8.733 7.829 7.528 1.00 29.82 S O HETATM 4061 O HOH S 191 3.436 25.513 6.455 1.00 23.63 S O HETATM 4062 O HOH S 192 11.913 -0.758 24.166 1.00 27.74 S O HETATM 4063 O HOH S 193 -15.771 -5.619 -13.921 1.00 24.67 S O HETATM 4064 O HOH S 194 2.702 27.374 3.921 1.00 29.18 S O HETATM 4065 O HOH S 195 5.514 -26.876 -16.170 1.00 26.15 S O HETATM 4066 O HOH S 196 4.631 -9.726 13.192 1.00 24.99 S O HETATM 4067 O HOH S 197 24.147 6.902 -23.574 1.00 24.22 S O HETATM 4068 O HOH S 198 2.730 11.916 22.226 1.00 30.16 S O HETATM 4069 O HOH S 199 14.538 -7.895 -18.599 1.00 21.67 S O HETATM 4070 O HOH S 200 -6.477 -2.165 17.142 1.00 27.83 S O HETATM 4071 O HOH S 201 11.892 21.544 -10.900 1.00 27.03 S O HETATM 4072 O HOH S 202 32.303 12.814 2.424 1.00 32.48 S O HETATM 4073 O HOH S 203 -3.478 13.469 15.809 1.00 23.18 S O HETATM 4074 O HOH S 204 22.361 4.120 4.621 1.00 25.59 S O HETATM 4075 O HOH S 205 2.277 -6.572 15.532 1.00 23.73 S O HETATM 4076 O HOH S 206 22.281 1.311 -27.642 1.00 29.26 S O HETATM 4077 O HOH S 207 1.930 -13.319 -26.574 1.00 34.34 S O HETATM 4078 O HOH S 208 -4.334 -18.015 -14.043 1.00 31.97 S O HETATM 4079 O HOH S 209 32.773 -12.055 4.686 1.00 21.42 S O HETATM 4080 O HOH S 210 17.976 13.955 -0.442 1.00 15.83 S O HETATM 4081 O HOH S 211 9.377 -9.326 -28.336 1.00 25.04 S O HETATM 4082 O HOH S 212 30.373 -4.714 22.498 1.00 39.71 S O HETATM 4083 O HOH S 213 18.809 -7.348 -13.414 1.00 24.09 S O HETATM 4084 O HOH S 214 -11.768 2.472 2.195 1.00 33.58 S O HETATM 4085 O HOH S 215 6.362 9.101 22.460 1.00 26.72 S O HETATM 4086 O HOH S 216 30.656 -19.954 0.573 1.00 32.49 S O HETATM 4087 O HOH S 217 25.484 -22.909 4.232 1.00 27.94 S O HETATM 4088 O HOH S 218 23.071 -21.504 2.739 1.00 33.82 S O HETATM 4089 O HOH S 219 12.177 -5.599 -23.992 1.00 20.58 S O HETATM 4090 O HOH S 220 -9.828 -13.199 -11.387 1.00 30.07 S O HETATM 4091 O HOH S 221 1.671 -22.594 -4.265 1.00 35.63 S O HETATM 4092 O HOH S 222 5.029 -9.522 -26.310 1.00 24.63 S O HETATM 4093 O HOH S 223 12.470 0.071 -13.437 1.00 21.58 S O HETATM 4094 O HOH S 224 27.123 13.470 -19.550 1.00 20.51 S O HETATM 4095 O HOH S 225 4.614 20.899 -0.278 1.00 17.77 S O HETATM 4096 O HOH S 226 -4.292 -10.489 -25.958 1.00 31.41 S O HETATM 4097 O HOH S 227 8.342 -10.697 16.321 1.00 21.83 S O HETATM 4098 O HOH S 228 -7.749 1.716 -7.303 1.00 37.91 S O HETATM 4099 O HOH S 229 13.743 5.453 21.604 1.00 26.53 S O HETATM 4100 O HOH S 230 3.040 -0.118 -24.620 1.00 31.08 S O HETATM 4101 O HOH S 231 32.503 -11.532 -4.042 1.00 36.20 S O HETATM 4102 O HOH S 232 3.166 -20.111 0.143 1.00 24.82 S O HETATM 4103 O HOH S 233 12.229 -19.846 2.319 1.00 28.84 S O HETATM 4104 O HOH S 234 24.530 13.161 -25.252 1.00 30.62 S O HETATM 4105 O HOH S 235 27.723 -5.665 -13.227 1.00 21.49 S O HETATM 4106 O HOH S 236 -7.599 19.535 7.115 1.00 29.90 S O HETATM 4107 O HOH S 237 29.948 18.130 -16.957 1.00 33.86 S O HETATM 4108 O HOH S 238 19.074 -9.990 -16.785 1.00 24.51 S O HETATM 4109 O HOH S 239 8.326 -3.240 8.056 1.00 22.69 S O HETATM 4110 O HOH S 240 -1.105 19.609 -2.386 1.00 29.81 S O HETATM 4111 O HOH S 241 16.505 7.044 18.235 1.00 29.42 S O HETATM 4112 O HOH S 242 2.157 8.814 22.552 1.00 28.66 S O HETATM 4113 O HOH S 243 -1.201 -20.729 0.457 1.00 27.00 S O HETATM 4114 O HOH S 244 -9.212 -13.536 -5.343 1.00 28.91 S O HETATM 4115 O HOH S 245 26.407 -3.050 21.549 1.00 28.02 S O HETATM 4116 O HOH S 246 18.155 0.835 18.233 1.00 21.30 S O HETATM 4117 O HOH S 247 28.937 14.557 -16.436 1.00 34.58 S O HETATM 4118 O HOH S 248 23.305 9.725 -23.029 1.00 27.78 S O HETATM 4119 O HOH S 249 17.133 -9.495 -18.492 1.00 22.78 S O HETATM 4120 O HOH S 250 16.229 19.274 -5.797 1.00 17.34 S O HETATM 4121 O HOH S 251 12.216 13.522 -3.366 1.00 31.23 S O HETATM 4122 O HOH S 252 19.766 -24.682 -2.067 1.00 44.55 S O HETATM 4123 O HOH S 253 21.115 -6.647 -14.775 1.00 26.87 S O HETATM 4124 O HOH S 254 -9.376 8.821 -5.261 1.00 27.43 S O HETATM 4125 O HOH S 255 24.842 -16.766 -7.654 1.00 25.24 S O HETATM 4126 O HOH S 256 21.453 -6.724 -19.357 1.00 24.44 S O HETATM 4127 O HOH S 257 5.233 17.949 -8.125 1.00 21.86 S O HETATM 4128 O HOH S 258 19.961 0.179 -25.789 1.00 27.71 S O HETATM 4129 O HOH S 259 6.627 -9.127 15.017 1.00 20.43 S O HETATM 4130 O HOH S 260 -4.439 6.798 18.807 1.00 33.78 S O HETATM 4131 O HOH S 261 11.673 8.372 1.638 1.00 26.99 S O HETATM 4132 O HOH S 262 -1.372 10.464 -10.456 1.00 30.84 S O HETATM 4133 O HOH S 263 11.743 -5.002 20.329 1.00 27.23 S O HETATM 4134 O HOH S 264 10.534 0.484 7.102 1.00 23.32 S O HETATM 4135 O HOH S 265 12.658 20.234 0.922 1.00 31.89 S O HETATM 4136 O HOH S 266 7.434 -2.825 -27.336 1.00 30.84 S O HETATM 4137 O HOH S 267 12.154 18.518 -1.628 1.00 38.26 S O HETATM 4138 O HOH S 268 32.581 7.870 -11.498 1.00 27.98 S O HETATM 4139 O HOH S 269 -4.073 -5.454 9.413 1.00 25.32 S O HETATM 4140 O HOH S 270 27.500 -17.260 13.738 1.00 27.49 S O HETATM 4141 O HOH S 271 -11.026 -8.588 -17.703 1.00 24.95 S O HETATM 4142 O HOH S 272 11.722 -3.059 -28.826 1.00 37.84 S O HETATM 4143 O HOH S 273 15.078 -14.371 -23.144 1.00 21.54 S O HETATM 4144 O HOH S 274 2.516 -23.519 18.690 1.00 45.36 S O HETATM 4145 O HOH S 275 33.970 -7.771 -3.862 1.00 27.29 S O HETATM 4146 O HOH S 276 30.065 -14.749 11.337 1.00 27.01 S O HETATM 4147 O HOH S 277 -3.246 21.380 0.428 1.00 28.66 S O HETATM 4148 O HOH S 278 10.608 11.623 -3.069 1.00 22.29 S O HETATM 4149 O HOH S 279 13.879 -19.331 -11.291 1.00 35.61 S O HETATM 4150 O HOH S 280 13.085 11.613 -0.593 1.00 22.31 S O HETATM 4151 O HOH S 281 5.462 11.449 23.161 1.00 30.67 S O HETATM 4152 O HOH S 282 9.416 -3.668 20.209 1.00 29.39 S O HETATM 4153 O HOH S 283 16.665 16.609 17.481 1.00 26.64 S O HETATM 4154 O HOH S 284 0.499 9.813 19.256 1.00 24.11 S O HETATM 4155 O HOH S 285 20.639 -8.293 26.631 1.00 37.97 S O HETATM 4156 O HOH S 286 -0.522 15.947 18.220 1.00 27.83 S O HETATM 4157 O HOH S 287 -1.250 0.988 23.129 1.00 33.88 S O HETATM 4158 O HOH S 288 19.415 25.624 -5.397 1.00 37.07 S O HETATM 4159 O HOH S 289 15.299 -6.709 25.173 1.00 31.10 S O HETATM 4160 O HOH S 290 34.645 -8.571 14.061 1.00 28.39 S O HETATM 4161 O HOH S 291 14.681 20.318 -2.372 1.00 34.51 S O HETATM 4162 O HOH S 292 -9.629 8.211 -0.579 1.00 30.21 S O HETATM 4163 O HOH S 293 6.617 -16.572 3.560 1.00 36.41 S O HETATM 4164 O HOH S 294 28.797 7.089 -22.320 1.00 34.56 S O HETATM 4165 O HOH S 295 35.290 -0.747 -6.398 1.00 26.99 S O HETATM 4166 O HOH S 296 -6.607 -11.712 -14.319 1.00 23.37 S O HETATM 4167 O HOH S 297 32.805 5.008 -11.945 1.00 36.93 S O HETATM 4168 O HOH S 298 34.726 -10.242 10.393 1.00 35.36 S O HETATM 4169 O HOH S 299 10.059 5.007 -25.311 1.00 27.37 S O HETATM 4170 O HOH S 300 27.300 6.163 -20.603 1.00 27.24 S O HETATM 4171 O HOH S 301 5.499 -13.978 19.650 1.00 32.99 S O HETATM 4172 O HOH S 302 6.410 -4.959 16.561 1.00 23.21 S O HETATM 4173 O HOH S 303 30.093 -2.259 -20.876 1.00 25.71 S O HETATM 4174 O HOH S 304 14.963 23.843 -28.289 1.00 33.48 S O HETATM 4175 O HOH S 305 -6.678 -9.995 -18.212 1.00 33.56 S O HETATM 4176 O HOH S 306 -4.898 16.782 -4.082 1.00 23.60 S O HETATM 4177 O HOH S 307 0.897 18.060 -24.363 1.00 34.17 S O HETATM 4178 O HOH S 308 7.248 25.674 -27.845 1.00 37.64 S O HETATM 4179 O HOH S 309 35.402 2.496 -5.859 1.00 29.42 S O HETATM 4180 O HOH S 310 3.306 10.013 -12.699 1.00 31.35 S O HETATM 4181 O HOH S 311 20.301 0.820 5.924 1.00 34.70 S O HETATM 4182 O HOH S 312 31.374 1.350 3.572 1.00 40.13 S O HETATM 4183 O HOH S 313 4.155 -26.659 -10.582 1.00 22.47 S O HETATM 4184 O HOH S 314 32.257 -14.221 2.278 1.00 29.13 S O HETATM 4185 O HOH S 315 24.148 15.695 -22.077 1.00 21.75 S O HETATM 4186 O HOH S 316 -6.049 -6.036 11.601 1.00 27.93 S O HETATM 4187 O HOH S 317 14.052 -17.633 -8.388 1.00 30.82 S O HETATM 4188 O HOH S 318 27.638 -3.265 -23.627 1.00 36.14 S O HETATM 4189 O HOH S 319 -2.113 -12.767 -21.779 1.00 29.24 S O HETATM 4190 O HOH S 320 -0.807 13.445 21.395 1.00 31.10 S O HETATM 4191 O HOH S 321 -9.428 2.701 18.595 1.00 31.41 S O HETATM 4192 O HOH S 322 0.285 11.172 22.865 1.00 31.79 S O HETATM 4193 O HOH S 323 -3.062 4.823 -15.214 1.00 33.01 S O HETATM 4194 C ACT S 324 13.967 -5.872 -10.592 1.00 31.58 S C HETATM 4195 O ACT S 324 13.696 -4.766 -10.173 1.00 32.35 S O HETATM 4196 OXT ACT S 324 13.891 -6.833 -9.851 1.00 33.54 S O HETATM 4197 CH3 ACT S 324 14.409 -6.056 -12.014 1.00 30.45 S C HETATM 4198 C ACT S 325 15.983 7.392 6.490 1.00 22.58 S C HETATM 4199 O ACT S 325 15.288 7.680 5.532 1.00 23.04 S O HETATM 4200 OXT ACT S 325 16.176 6.224 6.780 1.00 26.58 S O HETATM 4201 CH3 ACT S 325 16.600 8.471 7.319 1.00 21.70 S C HETATM 4202 C ACT S 326 20.065 14.800 4.047 1.00 24.92 S C HETATM 4203 O ACT S 326 21.019 15.171 3.382 1.00 26.59 S O HETATM 4204 OXT ACT S 326 19.091 14.322 3.495 1.00 21.81 S O HETATM 4205 CH3 ACT S 326 20.090 14.938 5.545 1.00 26.06 S C HETATM 4206 C ACT S 327 22.989 12.361 4.934 1.00 34.60 S C HETATM 4207 O ACT S 327 23.103 13.238 4.095 1.00 36.10 S O HETATM 4208 OXT ACT S 327 22.739 11.221 4.590 1.00 33.88 S O HETATM 4209 CH3 ACT S 327 23.155 12.691 6.393 1.00 35.31 S C HETATM 4210 C ACT S 328 3.543 14.944 -7.876 1.00 26.25 S C HETATM 4211 O ACT S 328 2.811 15.480 -7.068 1.00 27.28 S O HETATM 4212 OXT ACT S 328 3.163 14.754 -9.017 1.00 27.40 S O HETATM 4213 CH3 ACT S 328 4.914 14.520 -7.466 1.00 23.83 S C HETATM 4214 C ACT S 329 0.780 12.377 -8.703 1.00 33.98 S C HETATM 4215 O ACT S 329 0.538 12.960 -7.662 1.00 34.81 S O HETATM 4216 OXT ACT S 329 1.231 11.248 -8.673 1.00 32.54 S O HETATM 4217 CH3 ACT S 329 0.525 13.055 -10.023 1.00 34.57 S C HETATM 4218 C ACT S 330 7.764 7.476 -10.352 1.00 20.35 S C HETATM 4219 O ACT S 330 7.269 8.387 -10.999 1.00 20.11 S O HETATM 4220 OXT ACT S 330 7.599 6.316 -10.692 1.00 22.22 S O HETATM 4221 CH3 ACT S 330 8.574 7.786 -9.142 1.00 18.15 S C HETATM 4222 C ACT S 331 14.884 -29.438 16.831 1.00 52.87 S C HETATM 4223 O ACT S 331 13.989 -29.534 17.655 1.00 52.74 S O HETATM 4224 OXT ACT S 331 15.280 -28.338 16.488 1.00 52.75 S O HETATM 4225 CH3 ACT S 331 15.500 -30.678 16.241 1.00 52.68 S C HETATM 4226 C ACT S 332 4.879 3.067 -8.961 1.00 44.78 S C HETATM 4227 O ACT S 332 3.794 3.606 -8.858 1.00 45.20 S O HETATM 4228 OXT ACT S 332 4.957 1.935 -9.406 1.00 46.19 S O HETATM 4229 CH3 ACT S 332 6.118 3.796 -8.538 1.00 44.72 S C HETATM 4230 C ACT S 333 -0.140 17.858 21.935 1.00 30.87 S C HETATM 4231 O ACT S 333 -0.497 18.829 21.289 1.00 30.86 S O HETATM 4232 OXT ACT S 333 -0.926 17.282 22.669 1.00 32.47 S O HETATM 4233 CH3 ACT S 333 1.269 17.373 21.832 1.00 28.43 S C HETATM 4234 C ACT S 334 -11.428 -7.871 -1.336 1.00 26.51 S C HETATM 4235 O ACT S 334 -11.151 -7.364 -2.408 1.00 27.11 S O HETATM 4236 OXT ACT S 334 -12.456 -8.497 -1.201 1.00 28.00 S O HETATM 4237 CH3 ACT S 334 -10.501 -7.726 -0.178 1.00 23.57 S C HETATM 4238 O HOH S 335 22.930 4.911 -5.270 1.00 30.01 S O HETATM 4239 O HOH S 336 0.940 5.066 1.486 1.00 30.01 S O TER END