# Supplementary Information for "Direct observations of conformational
# distributions of intrinsically disordered p53 peptides using UV Raman and
# explicit solvent simulations." by Kan Xiong, Matthew C. Zwier, 
# Nataliya S. Myshakina, Virginia M. Burger, Sanford A. Asher, and
# Lillian T. Chong.
#
# Please direct inquiries to asher@pitt.edu or ltchong@pitt.edu
#
# Psi distribution from MD simulations for wild-type p53
# Psi angle (degrees)     Probability density (deg^-1)
-1.800000000000000000e+02 6.941109107535059844e-03
-1.760000000000000000e+02 4.592652098484783715e-03
-1.720000000000000000e+02 3.136403647457974668e-03
-1.680000000000000000e+02 2.127968687239879201e-03
-1.640000000000000000e+02 1.415227367899293300e-03
-1.600000000000000000e+02 1.031509319477322967e-03
-1.560000000000000000e+02 6.759932657055199275e-04
-1.520000000000000000e+02 5.067812978045174678e-04
-1.480000000000000000e+02 3.367147240050250966e-04
-1.440000000000000000e+02 2.589455872424431581e-04
-1.400000000000000000e+02 1.863040858708006880e-04
-1.360000000000000000e+02 2.042508097390888277e-04
-1.320000000000000000e+02 1.854494799723107766e-04
-1.280000000000000000e+02 1.623751207130831684e-04
-1.240000000000000000e+02 2.196337159119072331e-04
-1.200000000000000000e+02 2.239067454043567901e-04
-1.160000000000000000e+02 2.478357105620743097e-04
-1.120000000000000000e+02 2.290343807952962586e-04
-1.080000000000000000e+02 2.315981984907659929e-04
-1.040000000000000000e+02 2.093784451300282961e-04
-1.000000000000000000e+02 2.102330510285182075e-04
-9.600000000000000000e+01 2.743284934152615635e-04
-9.200000000000000000e+01 2.435626810696247526e-04
-8.800000000000000000e+01 3.426969652944544765e-04
-8.400000000000000000e+01 4.913983916316990623e-04
-8.000000000000000000e+01 6.272807294915949770e-04
-7.600000000000000000e+01 8.358045687231333617e-04
-7.200000000000000000e+01 1.176792322220607907e-03
-6.800000000000000000e+01 1.623751207130831684e-03
-6.400000000000000000e+01 2.474084076128293432e-03
-6.000000000000000000e+01 3.597036226744036811e-03
-5.600000000000000000e+01 5.412219155136608652e-03
-5.200000000000000000e+01 8.082862587917582359e-03
-4.800000000000000000e+01 1.140471571534786704e-02
-4.400000000000000000e+01 1.541367198516404094e-02
-4.000000000000000000e+01 1.997983130079563838e-02
-3.600000000000000000e+01 2.459213933494568821e-02
-3.200000000000000000e+01 2.886858725098920622e-02
-2.800000000000000000e+01 3.254595643219129752e-02
-2.400000000000000000e+01 3.453975199336825619e-02
-2.000000000000000000e+01 3.532428020818199899e-02
-1.600000000000000000e+01 3.462948561270969700e-02
-1.200000000000000000e+01 3.250493534906377657e-02
-8.000000000000000000e+00 2.933092904207224710e-02
-4.000000000000000000e+00 2.567065197883995967e-02
0.000000000000000000e+00 2.161896541409928652e-02
4.000000000000000000e+00 1.774930990573696937e-02
8.000000000000000000e+00 1.434797842974712238e-02
1.200000000000000000e+01 1.160042046610205643e-02
1.600000000000000000e+01 9.661319682428448630e-03
2.000000000000000000e+01 8.132429730029996570e-03
2.400000000000000000e+01 6.986403220155025691e-03
2.800000000000000000e+01 6.115559809593805636e-03
3.200000000000000000e+01 5.370343466110602884e-03
3.600000000000000000e+01 4.678967294232264443e-03
4.000000000000000000e+01 4.099544495056104722e-03
4.400000000000000000e+01 3.567125020296890020e-03
4.800000000000000000e+01 3.114183894097237188e-03
5.200000000000000000e+01 2.779178381889191914e-03
5.600000000000000000e+01 2.543307153905976364e-03
6.000000000000000000e+01 2.337347132369907605e-03
6.400000000000000000e+01 2.180954252946253925e-03
6.800000000000000000e+01 2.151897652397596720e-03
7.200000000000000000e+01 2.237358242246587862e-03
7.600000000000000000e+01 2.210865459393400716e-03
8.000000000000000000e+01 2.213429277088870342e-03
8.400000000000000000e+01 2.192918735525112468e-03
8.800000000000000000e+01 2.401442574756650853e-03
9.200000000000000000e+01 2.586037448830471718e-03
9.600000000000000000e+01 3.097946382025928546e-03
1.000000000000000000e+02 3.580798714672728603e-03
1.040000000000000000e+02 4.491808602462974385e-03
1.080000000000000000e+02 5.940365600403374122e-03
1.120000000000000000e+02 7.935015767478827142e-03
1.160000000000000000e+02 1.014246280327826821e-02
1.200000000000000000e+02 1.314554793057181627e-02
1.240000000000000000e+02 1.649474844675377985e-02
1.280000000000000000e+02 2.048148496320921497e-02
1.320000000000000000e+02 2.422465879859502652e-02
1.360000000000000000e+02 2.968644509584405025e-02
1.400000000000000000e+02 3.547640005811319996e-02
1.440000000000000000e+02 4.223376889747292723e-02
1.480000000000000000e+02 4.764427884081255671e-02
1.520000000000000000e+02 4.963892900788801493e-02
1.560000000000000000e+02 4.753147086221189144e-02
1.600000000000000000e+02 4.080401322929930880e-02
1.640000000000000000e+02 3.190671122012084249e-02
1.680000000000000000e+02 2.300940921094237271e-02
1.720000000000000000e+02 1.581619136335278911e-02
1.760000000000000000e+02 1.052019861041080841e-02