USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 554 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: P 23CASN : amide:sc= -2.74! C(o=-2.7!,f=-3.4!) USER MOD Set 1.2: P 25 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: P 21 TYR OH : rot -62:sc= 0.0205 USER MOD Set 2.2: P 52 LYS NZ :NH3+ 168:sc= -0.0832 (180deg=-0.368) USER MOD Set 3.1: P 19 TYR OH : rot -12:sc= 1.25 USER MOD Set 3.2: P 23 HIS :FLIP no HE2:sc= 1.22 F(o=-4,f=2.5) USER MOD Set 4.1: P 7 ASN :FLIP amide:sc= -3.28 F(o=-6!,f=-3.5) USER MOD Set 4.2: P 44 GLN :FLIP amide:sc= -0.235 F(o=-4.2,f=-3.5) USER MOD Single : P 9 ASN : amide:sc=-0.00518 X(o=-0.0052,f=-0.051) USER MOD Single : P 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 11 GLN : amide:sc= -2.35 K(o=-2.4,f=-5.3!) USER MOD Single : P 13 THR OG1 : rot 180:sc= -0.238 USER MOD Single : P 17 ASN : amide:sc= -8.52! C(o=-8.5!,f=-17!) USER MOD Single : P 22 SER OG : rot 180:sc= 0 USER MOD Single : P 23BSER OG : rot 180:sc= 0 USER MOD Single : P 27 SER OG : rot 180:sc= 0 USER MOD Single : P 31 LYS NZ :NH3+ -118:sc= -2.49 (180deg=-7.66!) USER MOD Single : P 36 LYS NZ :NH3+ 135:sc= -0.0545 (180deg=-0.367) USER MOD Single : P 37 LYS NZ :NH3+ 171:sc=-0.00626 (180deg=-0.0793) USER MOD Single : P 38 SER OG : rot 120:sc= -0.697 USER MOD Single : P 41 THR OG1 : rot 180:sc= 0 USER MOD Single : P 43 SER OG : rot 180:sc= 0 USER MOD Single : P 46 SER OG : rot 180:sc= 0 USER MOD Single : P 47 ASN :FLIP amide:sc= -0.107 F(o=-1.3,f=-0.11) USER MOD Single : P 51 ASN : amide:sc= -0.0169 X(o=-0.017,f=-0.017) USER MOD Single : P 56 TYR OH : rot 180:sc=-0.00815 USER MOD Single : P 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 58 LYS NZ :NH3+ 174:sc=-0.00287 (180deg=-0.0874) USER MOD Single : P 59 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : P 62 LYS NZ :NH3+ -177:sc= 0.3 (180deg=0.29) USER MOD Single : P 64 GLN : amide:sc= -1.13 K(o=-1.1,f=-4.3!) USER MOD Single : P 68 ASN : amide:sc= -0.422 X(o=-0.42,f=0) USER MOD Single : P 70 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1011 N ARG P 6 3.709 7.694 -18.317 1.00 15.00 N ATOM 1012 CA ARG P 6 3.820 8.421 -19.577 1.00 15.00 C ATOM 1013 C ARG P 6 3.259 7.581 -20.708 1.00 15.00 C ATOM 1014 O ARG P 6 2.585 8.079 -21.610 1.00 15.00 O ATOM 1015 CB ARG P 6 5.283 8.723 -19.881 1.00 15.00 C ATOM 1016 CG ARG P 6 6.022 9.463 -18.789 1.00 15.00 C ATOM 1017 CD ARG P 6 7.508 9.493 -19.095 1.00 15.00 C ATOM 1018 NE ARG P 6 7.800 10.171 -20.358 1.00 15.00 N ATOM 1019 CZ ARG P 6 7.577 11.466 -20.584 1.00 15.00 C ATOM 1020 NH1 ARG P 6 7.103 12.245 -19.622 1.00 15.00 N ATOM 1021 NH2 ARG P 6 7.845 11.986 -21.775 1.00 15.00 N ATOM 0 HA ARG P 6 3.260 9.352 -19.488 1.00 15.00 H new ATOM 0 HB2 ARG P 6 5.800 7.783 -20.076 1.00 15.00 H new ATOM 0 HB3 ARG P 6 5.334 9.311 -20.797 1.00 15.00 H new ATOM 0 HG2 ARG P 6 5.639 10.480 -18.705 1.00 15.00 H new ATOM 0 HG3 ARG P 6 5.850 8.977 -17.829 1.00 15.00 H new ATOM 0 HD2 ARG P 6 8.034 9.997 -18.284 1.00 15.00 H new ATOM 0 HD3 ARG P 6 7.889 8.473 -19.136 1.00 15.00 H new ATOM 0 HE ARG P 6 8.200 9.617 -21.115 1.00 15.00 H new ATOM 0 HH11 ARG P 6 6.906 11.855 -18.700 1.00 15.00 H new ATOM 0 HH12 ARG P 6 6.935 13.235 -19.803 1.00 15.00 H new ATOM 0 HH21 ARG P 6 8.221 11.395 -22.516 1.00 15.00 H new ATOM 0 HH22 ARG P 6 7.675 12.977 -21.949 1.00 15.00 H new ATOM 1035 N ASN P 7 3.577 6.298 -20.648 1.00 15.00 N ATOM 1036 CA ASN P 7 3.157 5.337 -21.651 1.00 15.00 C ATOM 1037 C ASN P 7 1.640 5.346 -21.863 1.00 15.00 C ATOM 1038 O ASN P 7 1.151 6.079 -22.722 1.00 15.00 O ATOM 1039 CB ASN P 7 3.665 3.959 -21.239 1.00 15.00 C ATOM 1040 CG ASN P 7 3.034 2.828 -22.008 1.00 15.00 C ATOM 1041 OD1 ASN P 7 2.485 1.884 -21.269 1.00 15.00 O flip ATOM 1042 ND2 ASN P 7 3.049 2.797 -23.238 1.00 15.00 N flip ATOM 0 H ASN P 7 4.137 5.893 -19.897 1.00 15.00 H new ATOM 0 HA ASN P 7 3.587 5.612 -22.614 1.00 15.00 H new ATOM 0 HB2 ASN P 7 4.746 3.923 -21.378 1.00 15.00 H new ATOM 0 HB3 ASN P 7 3.475 3.814 -20.175 1.00 15.00 H new ATOM 0 HD21 ASN P 7 3.488 3.554 -23.762 1.00 15.00 H new ATOM 0 HD22 ASN P 7 2.623 2.014 -23.734 1.00 15.00 H new ATOM 1049 N PHE P 8 0.879 4.543 -21.116 1.00 15.00 N ATOM 1050 CA PHE P 8 -0.569 4.492 -21.279 1.00 15.00 C ATOM 1051 C PHE P 8 -1.208 5.830 -20.960 1.00 15.00 C ATOM 1052 O PHE P 8 -1.304 6.226 -19.798 1.00 15.00 O ATOM 1053 CB PHE P 8 -1.184 3.447 -20.340 1.00 15.00 C ATOM 1054 CG PHE P 8 -0.464 2.133 -20.285 1.00 15.00 C ATOM 1055 CD1 PHE P 8 -0.661 1.176 -21.259 1.00 15.00 C ATOM 1056 CD2 PHE P 8 0.412 1.860 -19.249 1.00 15.00 C ATOM 1057 CE1 PHE P 8 0.004 -0.034 -21.207 1.00 15.00 C ATOM 1058 CE2 PHE P 8 1.081 0.652 -19.188 1.00 15.00 C ATOM 1059 CZ PHE P 8 0.879 -0.295 -20.168 1.00 15.00 C ATOM 0 H PHE P 8 1.244 3.921 -20.394 1.00 15.00 H new ATOM 0 HA PHE P 8 -0.759 4.229 -22.320 1.00 15.00 H new ATOM 0 HB2 PHE P 8 -1.222 3.864 -19.334 1.00 15.00 H new ATOM 0 HB3 PHE P 8 -2.213 3.266 -20.649 1.00 15.00 H new ATOM 0 HD1 PHE P 8 -1.343 1.375 -22.072 1.00 15.00 H new ATOM 0 HD2 PHE P 8 0.575 2.600 -18.479 1.00 15.00 H new ATOM 0 HE1 PHE P 8 -0.159 -0.775 -21.976 1.00 15.00 H new ATOM 0 HE2 PHE P 8 1.761 0.451 -18.373 1.00 15.00 H new ATOM 0 HZ PHE P 8 1.402 -1.239 -20.125 1.00 15.00 H new ATOM 1069 N ASN P 9 -1.661 6.505 -21.989 1.00 15.00 N ATOM 1070 CA ASN P 9 -2.320 7.785 -21.831 1.00 15.00 C ATOM 1071 C ASN P 9 -3.679 7.610 -21.155 1.00 15.00 C ATOM 1072 O ASN P 9 -4.096 6.486 -20.872 1.00 15.00 O ATOM 1073 CB ASN P 9 -2.470 8.409 -23.205 1.00 15.00 C ATOM 1074 CG ASN P 9 -1.401 9.442 -23.497 1.00 15.00 C ATOM 1075 OD1 ASN P 9 -1.263 10.432 -22.778 1.00 15.00 O ATOM 1076 ND2 ASN P 9 -0.638 9.214 -24.558 1.00 15.00 N ATOM 0 H ASN P 9 -1.585 6.187 -22.955 1.00 15.00 H new ATOM 0 HA ASN P 9 -1.726 8.439 -21.193 1.00 15.00 H new ATOM 0 HB2 ASN P 9 -2.429 7.626 -23.962 1.00 15.00 H new ATOM 0 HB3 ASN P 9 -3.452 8.876 -23.282 1.00 15.00 H new ATOM 0 HD21 ASN P 9 0.100 9.873 -24.807 1.00 15.00 H new ATOM 0 HD22 ASN P 9 -0.789 8.380 -25.125 1.00 15.00 H new ATOM 1083 N LYS P 10 -4.366 8.717 -20.885 1.00 15.00 N ATOM 1084 CA LYS P 10 -5.673 8.664 -20.231 1.00 15.00 C ATOM 1085 C LYS P 10 -6.668 7.825 -21.031 1.00 15.00 C ATOM 1086 O LYS P 10 -7.673 7.361 -20.492 1.00 15.00 O ATOM 1087 CB LYS P 10 -6.229 10.073 -20.022 1.00 15.00 C ATOM 1088 CG LYS P 10 -5.370 10.936 -19.112 1.00 15.00 C ATOM 1089 CD LYS P 10 -6.019 12.286 -18.845 1.00 15.00 C ATOM 1090 CE LYS P 10 -7.358 12.131 -18.140 1.00 15.00 C ATOM 1091 NZ LYS P 10 -7.983 13.449 -17.839 1.00 15.00 N ATOM 0 H LYS P 10 -4.042 9.658 -21.107 1.00 15.00 H new ATOM 0 HA LYS P 10 -5.532 8.189 -19.260 1.00 15.00 H new ATOM 0 HB2 LYS P 10 -6.325 10.564 -20.990 1.00 15.00 H new ATOM 0 HB3 LYS P 10 -7.231 10.000 -19.600 1.00 15.00 H new ATOM 0 HG2 LYS P 10 -5.205 10.418 -18.167 1.00 15.00 H new ATOM 0 HG3 LYS P 10 -4.392 11.086 -19.569 1.00 15.00 H new ATOM 0 HD2 LYS P 10 -5.354 12.896 -18.234 1.00 15.00 H new ATOM 0 HD3 LYS P 10 -6.162 12.815 -19.787 1.00 15.00 H new ATOM 0 HE2 LYS P 10 -8.031 11.544 -18.765 1.00 15.00 H new ATOM 0 HE3 LYS P 10 -7.218 11.575 -17.213 1.00 15.00 H new ATOM 0 HZ1 LYS P 10 -8.893 13.300 -17.359 1.00 15.00 H new ATOM 0 HZ2 LYS P 10 -7.352 14.000 -17.222 1.00 15.00 H new ATOM 0 HZ3 LYS P 10 -8.140 13.969 -18.726 1.00 15.00 H new ATOM 1105 N GLN P 11 -6.383 7.627 -22.315 1.00 15.00 N ATOM 1106 CA GLN P 11 -7.258 6.837 -23.174 1.00 15.00 C ATOM 1107 C GLN P 11 -7.089 5.353 -22.876 1.00 15.00 C ATOM 1108 O GLN P 11 -8.062 4.623 -22.702 1.00 15.00 O ATOM 1109 CB GLN P 11 -6.947 7.103 -24.648 1.00 15.00 C ATOM 1110 CG GLN P 11 -7.948 6.479 -25.608 1.00 15.00 C ATOM 1111 CD GLN P 11 -9.345 7.044 -25.445 1.00 15.00 C ATOM 1112 OE1 GLN P 11 -9.949 6.945 -24.379 1.00 15.00 O ATOM 1113 NE2 GLN P 11 -9.868 7.645 -26.509 1.00 15.00 N ATOM 0 H GLN P 11 -5.557 8.001 -22.781 1.00 15.00 H new ATOM 0 HA GLN P 11 -8.289 7.129 -22.972 1.00 15.00 H new ATOM 0 HB2 GLN P 11 -6.919 8.180 -24.815 1.00 15.00 H new ATOM 0 HB3 GLN P 11 -5.952 6.720 -24.875 1.00 15.00 H new ATOM 0 HG2 GLN P 11 -7.612 6.641 -26.632 1.00 15.00 H new ATOM 0 HG3 GLN P 11 -7.975 5.401 -25.448 1.00 15.00 H new ATOM 0 HE21 GLN P 11 -9.333 7.706 -27.375 1.00 15.00 H new ATOM 0 HE22 GLN P 11 -10.805 8.046 -26.459 1.00 15.00 H new ATOM 1122 N ALA P 12 -5.839 4.915 -22.830 1.00 15.00 N ATOM 1123 CA ALA P 12 -5.520 3.520 -22.565 1.00 15.00 C ATOM 1124 C ALA P 12 -5.962 3.093 -21.171 1.00 15.00 C ATOM 1125 O ALA P 12 -6.468 1.989 -20.977 1.00 15.00 O ATOM 1126 CB ALA P 12 -4.024 3.299 -22.723 1.00 15.00 C ATOM 0 H ALA P 12 -5.024 5.511 -22.974 1.00 15.00 H new ATOM 0 HA ALA P 12 -6.064 2.909 -23.286 1.00 15.00 H new ATOM 0 HB1 ALA P 12 -3.788 2.254 -22.524 1.00 15.00 H new ATOM 0 HB2 ALA P 12 -3.724 3.552 -23.740 1.00 15.00 H new ATOM 0 HB3 ALA P 12 -3.486 3.933 -22.018 1.00 15.00 H new ATOM 1132 N THR P 13 -5.753 3.970 -20.204 1.00 15.00 N ATOM 1133 CA THR P 13 -6.110 3.681 -18.823 1.00 15.00 C ATOM 1134 C THR P 13 -7.586 3.316 -18.677 1.00 15.00 C ATOM 1135 O THR P 13 -7.916 2.256 -18.148 1.00 15.00 O ATOM 1136 CB THR P 13 -5.775 4.868 -17.925 1.00 15.00 C ATOM 1137 OG1 THR P 13 -6.571 5.992 -18.258 1.00 15.00 O ATOM 1138 CG2 THR P 13 -4.325 5.289 -18.009 1.00 15.00 C ATOM 0 H THR P 13 -5.337 4.890 -20.349 1.00 15.00 H new ATOM 0 HA THR P 13 -5.523 2.817 -18.513 1.00 15.00 H new ATOM 0 HB THR P 13 -5.980 4.529 -16.910 1.00 15.00 H new ATOM 0 HG1 THR P 13 -6.341 6.741 -17.670 1.00 15.00 H new ATOM 0 HG21 THR P 13 -4.154 6.137 -17.347 1.00 15.00 H new ATOM 0 HG22 THR P 13 -3.687 4.458 -17.707 1.00 15.00 H new ATOM 0 HG23 THR P 13 -4.088 5.575 -19.034 1.00 15.00 H new ATOM 1146 N GLU P 14 -8.473 4.193 -19.145 1.00 15.00 N ATOM 1147 CA GLU P 14 -9.913 3.946 -19.047 1.00 15.00 C ATOM 1148 C GLU P 14 -10.282 2.622 -19.706 1.00 15.00 C ATOM 1149 O GLU P 14 -11.121 1.873 -19.210 1.00 15.00 O ATOM 1150 CB GLU P 14 -10.702 5.088 -19.699 1.00 15.00 C ATOM 1151 CG GLU P 14 -10.767 5.022 -21.219 1.00 15.00 C ATOM 1152 CD GLU P 14 -11.660 6.096 -21.810 1.00 15.00 C ATOM 1153 OE1 GLU P 14 -12.183 6.926 -21.037 1.00 15.00 O ATOM 1154 OE2 GLU P 14 -11.836 6.107 -23.046 1.00 15.00 O ATOM 0 H GLU P 14 -8.224 5.075 -19.593 1.00 15.00 H new ATOM 0 HA GLU P 14 -10.172 3.895 -17.990 1.00 15.00 H new ATOM 0 HB2 GLU P 14 -11.718 5.083 -19.304 1.00 15.00 H new ATOM 0 HB3 GLU P 14 -10.251 6.037 -19.408 1.00 15.00 H new ATOM 0 HG2 GLU P 14 -9.762 5.125 -21.627 1.00 15.00 H new ATOM 0 HG3 GLU P 14 -11.135 4.041 -21.521 1.00 15.00 H new ATOM 1161 N ILE P 15 -9.652 2.360 -20.835 1.00 15.00 N ATOM 1162 CA ILE P 15 -9.895 1.151 -21.605 1.00 15.00 C ATOM 1163 C ILE P 15 -9.410 -0.105 -20.882 1.00 15.00 C ATOM 1164 O ILE P 15 -10.176 -1.046 -20.673 1.00 15.00 O ATOM 1165 CB ILE P 15 -9.203 1.275 -22.974 1.00 15.00 C ATOM 1166 CG1 ILE P 15 -9.898 2.358 -23.798 1.00 15.00 C ATOM 1167 CG2 ILE P 15 -9.194 -0.052 -23.720 1.00 15.00 C ATOM 1168 CD1 ILE P 15 -9.077 2.850 -24.962 1.00 15.00 C ATOM 0 H ILE P 15 -8.955 2.980 -21.247 1.00 15.00 H new ATOM 0 HA ILE P 15 -10.972 1.047 -21.735 1.00 15.00 H new ATOM 0 HB ILE P 15 -8.163 1.557 -22.812 1.00 15.00 H new ATOM 0 HG12 ILE P 15 -10.845 1.967 -24.171 1.00 15.00 H new ATOM 0 HG13 ILE P 15 -10.135 3.201 -23.149 1.00 15.00 H new ATOM 0 HG21 ILE P 15 -8.697 0.075 -24.682 1.00 15.00 H new ATOM 0 HG22 ILE P 15 -8.659 -0.797 -23.131 1.00 15.00 H new ATOM 0 HG23 ILE P 15 -10.219 -0.385 -23.882 1.00 15.00 H new ATOM 0 HD11 ILE P 15 -9.633 3.617 -25.501 1.00 15.00 H new ATOM 0 HD12 ILE P 15 -8.141 3.271 -24.595 1.00 15.00 H new ATOM 0 HD13 ILE P 15 -8.862 2.018 -25.633 1.00 15.00 H new ATOM 1180 N LEU P 16 -8.132 -0.128 -20.532 1.00 15.00 N ATOM 1181 CA LEU P 16 -7.543 -1.284 -19.866 1.00 15.00 C ATOM 1182 C LEU P 16 -8.195 -1.580 -18.513 1.00 15.00 C ATOM 1183 O LEU P 16 -8.512 -2.733 -18.219 1.00 15.00 O ATOM 1184 CB LEU P 16 -6.042 -1.077 -19.680 1.00 15.00 C ATOM 1185 CG LEU P 16 -5.256 -0.783 -20.960 1.00 15.00 C ATOM 1186 CD1 LEU P 16 -3.795 -0.569 -20.633 1.00 15.00 C ATOM 1187 CD2 LEU P 16 -5.400 -1.911 -21.970 1.00 15.00 C ATOM 0 H LEU P 16 -7.482 0.640 -20.698 1.00 15.00 H new ATOM 0 HA LEU P 16 -7.723 -2.145 -20.509 1.00 15.00 H new ATOM 0 HB2 LEU P 16 -5.890 -0.253 -18.983 1.00 15.00 H new ATOM 0 HB3 LEU P 16 -5.624 -1.970 -19.214 1.00 15.00 H new ATOM 0 HG LEU P 16 -5.666 0.124 -21.405 1.00 15.00 H new ATOM 0 HD11 LEU P 16 -3.244 -0.360 -21.550 1.00 15.00 H new ATOM 0 HD12 LEU P 16 -3.695 0.274 -19.950 1.00 15.00 H new ATOM 0 HD13 LEU P 16 -3.392 -1.466 -20.163 1.00 15.00 H new ATOM 0 HD21 LEU P 16 -4.830 -1.671 -22.867 1.00 15.00 H new ATOM 0 HD22 LEU P 16 -5.022 -2.837 -21.537 1.00 15.00 H new ATOM 0 HD23 LEU P 16 -6.451 -2.034 -22.230 1.00 15.00 H new ATOM 1199 N ASN P 17 -8.388 -0.554 -17.682 1.00 15.00 N ATOM 1200 CA ASN P 17 -8.993 -0.773 -16.370 1.00 15.00 C ATOM 1201 C ASN P 17 -10.400 -1.349 -16.497 1.00 15.00 C ATOM 1202 O ASN P 17 -10.707 -2.377 -15.897 1.00 15.00 O ATOM 1203 CB ASN P 17 -8.983 0.498 -15.499 1.00 15.00 C ATOM 1204 CG ASN P 17 -9.732 1.677 -16.093 1.00 15.00 C ATOM 1205 OD1 ASN P 17 -10.870 1.553 -16.542 1.00 15.00 O ATOM 1206 ND2 ASN P 17 -9.100 2.846 -16.058 1.00 15.00 N ATOM 0 H ASN P 17 -8.141 0.414 -17.888 1.00 15.00 H new ATOM 0 HA ASN P 17 -8.374 -1.509 -15.857 1.00 15.00 H new ATOM 0 HB2 ASN P 17 -9.417 0.260 -14.528 1.00 15.00 H new ATOM 0 HB3 ASN P 17 -7.949 0.793 -15.322 1.00 15.00 H new ATOM 0 HD21 ASN P 17 -9.559 3.685 -16.412 1.00 15.00 H new ATOM 0 HD22 ASN P 17 -8.156 2.904 -15.677 1.00 15.00 H new ATOM 1213 N GLU P 18 -11.246 -0.698 -17.289 1.00 15.00 N ATOM 1214 CA GLU P 18 -12.615 -1.165 -17.498 1.00 15.00 C ATOM 1215 C GLU P 18 -12.646 -2.666 -17.774 1.00 15.00 C ATOM 1216 O GLU P 18 -13.526 -3.378 -17.290 1.00 15.00 O ATOM 1217 CB GLU P 18 -13.265 -0.404 -18.653 1.00 15.00 C ATOM 1218 CG GLU P 18 -13.591 1.043 -18.317 1.00 15.00 C ATOM 1219 CD GLU P 18 -14.017 1.842 -19.533 1.00 15.00 C ATOM 1220 OE1 GLU P 18 -15.001 1.444 -20.188 1.00 15.00 O ATOM 1221 OE2 GLU P 18 -13.366 2.866 -19.828 1.00 15.00 O ATOM 0 H GLU P 18 -11.009 0.154 -17.797 1.00 15.00 H new ATOM 0 HA GLU P 18 -13.180 -0.974 -16.585 1.00 15.00 H new ATOM 0 HB2 GLU P 18 -12.598 -0.427 -19.515 1.00 15.00 H new ATOM 0 HB3 GLU P 18 -14.181 -0.916 -18.946 1.00 15.00 H new ATOM 0 HG2 GLU P 18 -14.387 1.069 -17.573 1.00 15.00 H new ATOM 0 HG3 GLU P 18 -12.717 1.513 -17.866 1.00 15.00 H new ATOM 1228 N TYR P 19 -11.669 -3.143 -18.539 1.00 15.00 N ATOM 1229 CA TYR P 19 -11.577 -4.561 -18.857 1.00 15.00 C ATOM 1230 C TYR P 19 -11.017 -5.331 -17.668 1.00 15.00 C ATOM 1231 O TYR P 19 -11.476 -6.426 -17.345 1.00 15.00 O ATOM 1232 CB TYR P 19 -10.677 -4.778 -20.076 1.00 15.00 C ATOM 1233 CG TYR P 19 -10.532 -6.230 -20.485 1.00 15.00 C ATOM 1234 CD1 TYR P 19 -11.421 -7.201 -20.033 1.00 15.00 C ATOM 1235 CD2 TYR P 19 -9.508 -6.628 -21.332 1.00 15.00 C ATOM 1236 CE1 TYR P 19 -11.289 -8.523 -20.414 1.00 15.00 C ATOM 1237 CE2 TYR P 19 -9.370 -7.946 -21.718 1.00 15.00 C ATOM 1238 CZ TYR P 19 -10.262 -8.890 -21.256 1.00 15.00 C ATOM 1239 OH TYR P 19 -10.126 -10.205 -21.638 1.00 15.00 O ATOM 0 H TYR P 19 -10.932 -2.569 -18.949 1.00 15.00 H new ATOM 0 HA TYR P 19 -12.578 -4.927 -19.084 1.00 15.00 H new ATOM 0 HB2 TYR P 19 -11.079 -4.213 -20.917 1.00 15.00 H new ATOM 0 HB3 TYR P 19 -9.689 -4.371 -19.862 1.00 15.00 H new ATOM 0 HD1 TYR P 19 -12.228 -6.917 -19.373 1.00 15.00 H new ATOM 0 HD2 TYR P 19 -8.806 -5.893 -21.696 1.00 15.00 H new ATOM 0 HE1 TYR P 19 -11.987 -9.264 -20.054 1.00 15.00 H new ATOM 0 HE2 TYR P 19 -8.567 -8.236 -22.379 1.00 15.00 H new ATOM 0 HH TYR P 19 -10.706 -10.768 -21.084 1.00 15.00 H new ATOM 1249 N PHE P 20 -10.012 -4.746 -17.023 1.00 15.00 N ATOM 1250 CA PHE P 20 -9.370 -5.364 -15.869 1.00 15.00 C ATOM 1251 C PHE P 20 -10.393 -5.801 -14.818 1.00 15.00 C ATOM 1252 O PHE P 20 -10.314 -6.916 -14.304 1.00 15.00 O ATOM 1253 CB PHE P 20 -8.331 -4.402 -15.271 1.00 15.00 C ATOM 1254 CG PHE P 20 -7.999 -4.654 -13.824 1.00 15.00 C ATOM 1255 CD1 PHE P 20 -6.996 -5.541 -13.468 1.00 15.00 C ATOM 1256 CD2 PHE P 20 -8.703 -4.006 -12.822 1.00 15.00 C ATOM 1257 CE1 PHE P 20 -6.699 -5.774 -12.136 1.00 15.00 C ATOM 1258 CE2 PHE P 20 -8.411 -4.234 -11.492 1.00 15.00 C ATOM 1259 CZ PHE P 20 -7.410 -5.119 -11.147 1.00 15.00 C ATOM 0 H PHE P 20 -9.623 -3.839 -17.283 1.00 15.00 H new ATOM 0 HA PHE P 20 -8.859 -6.266 -16.205 1.00 15.00 H new ATOM 0 HB2 PHE P 20 -7.414 -4.469 -15.857 1.00 15.00 H new ATOM 0 HB3 PHE P 20 -8.700 -3.381 -15.372 1.00 15.00 H new ATOM 0 HD1 PHE P 20 -6.440 -6.056 -14.238 1.00 15.00 H new ATOM 0 HD2 PHE P 20 -9.490 -3.314 -13.084 1.00 15.00 H new ATOM 0 HE1 PHE P 20 -5.914 -6.466 -11.870 1.00 15.00 H new ATOM 0 HE2 PHE P 20 -8.966 -3.720 -10.721 1.00 15.00 H new ATOM 0 HZ PHE P 20 -7.182 -5.300 -10.107 1.00 15.00 H new ATOM 1269 N TYR P 21 -11.351 -4.931 -14.492 1.00 15.00 N ATOM 1270 CA TYR P 21 -12.369 -5.263 -13.492 1.00 15.00 C ATOM 1271 C TYR P 21 -13.281 -6.402 -13.960 1.00 15.00 C ATOM 1272 O TYR P 21 -14.303 -6.681 -13.332 1.00 15.00 O ATOM 1273 CB TYR P 21 -13.224 -4.041 -13.151 1.00 15.00 C ATOM 1274 CG TYR P 21 -12.431 -2.838 -12.696 1.00 15.00 C ATOM 1275 CD1 TYR P 21 -12.029 -2.706 -11.372 1.00 15.00 C ATOM 1276 CD2 TYR P 21 -12.080 -1.836 -13.591 1.00 15.00 C ATOM 1277 CE1 TYR P 21 -11.304 -1.609 -10.954 1.00 15.00 C ATOM 1278 CE2 TYR P 21 -11.355 -0.735 -13.181 1.00 15.00 C ATOM 1279 CZ TYR P 21 -10.969 -0.625 -11.860 1.00 15.00 C ATOM 1280 OH TYR P 21 -10.247 0.471 -11.447 1.00 15.00 O ATOM 0 H TYR P 21 -11.444 -4.001 -14.900 1.00 15.00 H new ATOM 0 HA TYR P 21 -11.834 -5.592 -12.601 1.00 15.00 H new ATOM 0 HB2 TYR P 21 -13.810 -3.765 -14.028 1.00 15.00 H new ATOM 0 HB3 TYR P 21 -13.931 -4.313 -12.368 1.00 15.00 H new ATOM 0 HD1 TYR P 21 -12.288 -3.475 -10.659 1.00 15.00 H new ATOM 0 HD2 TYR P 21 -12.379 -1.919 -14.625 1.00 15.00 H new ATOM 0 HE1 TYR P 21 -11.000 -1.521 -9.921 1.00 15.00 H new ATOM 0 HE2 TYR P 21 -11.091 0.036 -13.890 1.00 15.00 H new ATOM 0 HH TYR P 21 -10.761 0.968 -10.777 1.00 15.00 H new ATOM 1290 N SER P 22 -12.902 -7.070 -15.045 1.00 15.00 N ATOM 1291 CA SER P 22 -13.681 -8.184 -15.568 1.00 15.00 C ATOM 1292 C SER P 22 -12.937 -9.498 -15.352 1.00 15.00 C ATOM 1293 O SER P 22 -13.548 -10.562 -15.263 1.00 15.00 O ATOM 1294 CB SER P 22 -13.972 -7.985 -17.055 1.00 15.00 C ATOM 1295 OG SER P 22 -14.676 -6.776 -17.281 1.00 15.00 O ATOM 0 H SER P 22 -12.059 -6.858 -15.579 1.00 15.00 H new ATOM 0 HA SER P 22 -14.628 -8.222 -15.030 1.00 15.00 H new ATOM 0 HB2 SER P 22 -13.036 -7.974 -17.613 1.00 15.00 H new ATOM 0 HB3 SER P 22 -14.557 -8.825 -17.430 1.00 15.00 H new ATOM 0 HG SER P 22 -14.848 -6.672 -18.240 1.00 15.00 H new ATOM 1301 N HIS P 23 -11.610 -9.408 -15.257 1.00 15.00 N ATOM 1302 CA HIS P 23 -10.771 -10.581 -15.044 1.00 15.00 C ATOM 1303 C HIS P 23 -9.888 -10.404 -13.807 1.00 15.00 C ATOM 1304 O HIS P 23 -8.741 -10.835 -13.789 1.00 15.00 O ATOM 1305 CB HIS P 23 -9.892 -10.833 -16.271 1.00 15.00 C ATOM 1306 CG HIS P 23 -10.648 -11.265 -17.492 1.00 15.00 C ATOM 1307 ND1 HIS P 23 -11.960 -11.551 -17.674 1.00 15.00 N flip ATOM 1308 CD2 HIS P 23 -10.044 -11.465 -18.715 1.00 15.00 C flip ATOM 1309 CE1 HIS P 23 -12.119 -11.914 -18.990 1.00 15.00 C flip ATOM 1310 NE2 HIS P 23 -10.949 -11.853 -19.597 1.00 15.00 N flip ATOM 0 H HIS P 23 -11.094 -8.530 -15.325 1.00 15.00 H new ATOM 0 HA HIS P 23 -11.425 -11.439 -14.886 1.00 15.00 H new ATOM 0 HB2 HIS P 23 -9.341 -9.921 -16.502 1.00 15.00 H new ATOM 0 HB3 HIS P 23 -9.155 -11.597 -16.025 1.00 15.00 H new ATOM 0 HD1 HIS P 23 -12.693 -11.505 -16.966 1.00 15.00 H new ATOM 0 HD2 HIS P 23 -8.993 -11.326 -18.921 1.00 15.00 H new ATOM 0 HE1 HIS P 23 -13.051 -12.203 -19.453 1.00 15.00 H new ATOM 1318 N LEU P 23A -10.434 -9.771 -12.775 1.00 15.00 N ATOM 1319 CA LEU P 23A -9.682 -9.548 -11.533 1.00 15.00 C ATOM 1320 C LEU P 23A -8.943 -10.806 -11.085 1.00 15.00 C ATOM 1321 O LEU P 23A -7.720 -10.806 -10.964 1.00 15.00 O ATOM 1322 CB LEU P 23A -10.588 -9.062 -10.398 1.00 15.00 C ATOM 1323 CG LEU P 23A -11.002 -7.591 -10.468 1.00 15.00 C ATOM 1324 CD1 LEU P 23A -11.436 -7.101 -9.099 1.00 15.00 C ATOM 1325 CD2 LEU P 23A -9.862 -6.735 -10.981 1.00 15.00 C ATOM 0 H LEU P 23A -11.386 -9.404 -12.767 1.00 15.00 H new ATOM 0 HA LEU P 23A -8.951 -8.771 -11.756 1.00 15.00 H new ATOM 0 HB2 LEU P 23A -11.489 -9.675 -10.389 1.00 15.00 H new ATOM 0 HB3 LEU P 23A -10.077 -9.233 -9.451 1.00 15.00 H new ATOM 0 HG LEU P 23A -11.840 -7.507 -11.160 1.00 15.00 H new ATOM 0 HD11 LEU P 23A -11.728 -6.053 -9.163 1.00 15.00 H new ATOM 0 HD12 LEU P 23A -12.283 -7.693 -8.752 1.00 15.00 H new ATOM 0 HD13 LEU P 23A -10.609 -7.205 -8.396 1.00 15.00 H new ATOM 0 HD21 LEU P 23A -10.179 -5.693 -11.022 1.00 15.00 H new ATOM 0 HD22 LEU P 23A -9.007 -6.828 -10.311 1.00 15.00 H new ATOM 0 HD23 LEU P 23A -9.578 -7.068 -11.979 1.00 15.00 H new ATOM 1337 N SER P 23B -9.690 -11.863 -10.798 1.00 15.00 N ATOM 1338 CA SER P 23B -9.098 -13.110 -10.327 1.00 15.00 C ATOM 1339 C SER P 23B -8.103 -13.702 -11.333 1.00 15.00 C ATOM 1340 O SER P 23B -7.326 -14.591 -10.985 1.00 15.00 O ATOM 1341 CB SER P 23B -10.195 -14.132 -10.023 1.00 15.00 C ATOM 1342 OG SER P 23B -10.968 -14.412 -11.177 1.00 15.00 O ATOM 0 H SER P 23B -10.706 -11.883 -10.883 1.00 15.00 H new ATOM 0 HA SER P 23B -8.545 -12.878 -9.417 1.00 15.00 H new ATOM 0 HB2 SER P 23B -9.745 -15.053 -9.651 1.00 15.00 H new ATOM 0 HB3 SER P 23B -10.842 -13.751 -9.232 1.00 15.00 H new ATOM 0 HG SER P 23B -11.660 -15.069 -10.955 1.00 15.00 H new ATOM 1348 N ASN P 23C -8.121 -13.208 -12.570 1.00 15.00 N ATOM 1349 CA ASN P 23C -7.213 -13.694 -13.611 1.00 15.00 C ATOM 1350 C ASN P 23C -7.115 -12.678 -14.748 1.00 15.00 C ATOM 1351 O ASN P 23C -7.612 -12.918 -15.848 1.00 15.00 O ATOM 1352 CB ASN P 23C -7.704 -15.037 -14.161 1.00 15.00 C ATOM 1353 CG ASN P 23C -7.683 -16.140 -13.120 1.00 15.00 C ATOM 1354 OD1 ASN P 23C -6.631 -16.473 -12.573 1.00 15.00 O ATOM 1355 ND2 ASN P 23C -8.848 -16.711 -12.841 1.00 15.00 N ATOM 0 H ASN P 23C -8.755 -12.470 -12.877 1.00 15.00 H new ATOM 0 HA ASN P 23C -6.226 -13.829 -13.169 1.00 15.00 H new ATOM 0 HB2 ASN P 23C -8.719 -14.920 -14.540 1.00 15.00 H new ATOM 0 HB3 ASN P 23C -7.080 -15.329 -15.006 1.00 15.00 H new ATOM 0 HD21 ASN P 23C -8.897 -17.458 -12.148 1.00 15.00 H new ATOM 0 HD22 ASN P 23C -9.695 -16.403 -13.319 1.00 15.00 H new ATOM 1362 N PRO P 24 -6.481 -11.515 -14.495 1.00 15.00 N ATOM 1363 CA PRO P 24 -6.345 -10.457 -15.498 1.00 15.00 C ATOM 1364 C PRO P 24 -5.318 -10.792 -16.563 1.00 15.00 C ATOM 1365 O PRO P 24 -4.177 -10.333 -16.512 1.00 15.00 O ATOM 1366 CB PRO P 24 -5.896 -9.248 -14.680 1.00 15.00 C ATOM 1367 CG PRO P 24 -5.175 -9.833 -13.519 1.00 15.00 C ATOM 1368 CD PRO P 24 -5.862 -11.138 -13.212 1.00 15.00 C ATOM 0 HA PRO P 24 -7.273 -10.297 -16.046 1.00 15.00 H new ATOM 0 HB2 PRO P 24 -5.247 -8.594 -15.262 1.00 15.00 H new ATOM 0 HB3 PRO P 24 -6.747 -8.648 -14.358 1.00 15.00 H new ATOM 0 HG2 PRO P 24 -4.123 -9.993 -13.755 1.00 15.00 H new ATOM 0 HG3 PRO P 24 -5.211 -9.163 -12.660 1.00 15.00 H new ATOM 0 HD2 PRO P 24 -5.154 -11.893 -12.871 1.00 15.00 H new ATOM 0 HD3 PRO P 24 -6.608 -11.023 -12.426 1.00 15.00 H new ATOM 1376 N TYR P 25 -5.736 -11.590 -17.530 1.00 15.00 N ATOM 1377 CA TYR P 25 -4.865 -11.987 -18.619 1.00 15.00 C ATOM 1378 C TYR P 25 -5.512 -11.643 -19.952 1.00 15.00 C ATOM 1379 O TYR P 25 -6.233 -12.459 -20.527 1.00 15.00 O ATOM 1380 CB TYR P 25 -4.576 -13.489 -18.547 1.00 15.00 C ATOM 1381 CG TYR P 25 -4.254 -13.975 -17.151 1.00 15.00 C ATOM 1382 CD1 TYR P 25 -3.255 -13.374 -16.397 1.00 15.00 C ATOM 1383 CD2 TYR P 25 -4.955 -15.032 -16.585 1.00 15.00 C ATOM 1384 CE1 TYR P 25 -2.965 -13.811 -15.120 1.00 15.00 C ATOM 1385 CE2 TYR P 25 -4.669 -15.476 -15.308 1.00 15.00 C ATOM 1386 CZ TYR P 25 -3.673 -14.861 -14.581 1.00 15.00 C ATOM 1387 OH TYR P 25 -3.387 -15.300 -13.308 1.00 15.00 O ATOM 0 H TYR P 25 -6.678 -11.977 -17.582 1.00 15.00 H new ATOM 0 HA TYR P 25 -3.923 -11.446 -18.531 1.00 15.00 H new ATOM 0 HB2 TYR P 25 -5.441 -14.036 -18.923 1.00 15.00 H new ATOM 0 HB3 TYR P 25 -3.740 -13.722 -19.206 1.00 15.00 H new ATOM 0 HD1 TYR P 25 -2.695 -12.551 -16.816 1.00 15.00 H new ATOM 0 HD2 TYR P 25 -5.737 -15.515 -17.152 1.00 15.00 H new ATOM 0 HE1 TYR P 25 -2.186 -13.331 -14.546 1.00 15.00 H new ATOM 0 HE2 TYR P 25 -5.223 -16.300 -14.882 1.00 15.00 H new ATOM 0 HH TYR P 25 -3.978 -16.047 -13.079 1.00 15.00 H new ATOM 1397 N PRO P 26 -5.254 -10.432 -20.480 1.00 15.00 N ATOM 1398 CA PRO P 26 -5.809 -10.000 -21.764 1.00 15.00 C ATOM 1399 C PRO P 26 -5.284 -10.861 -22.888 1.00 15.00 C ATOM 1400 O PRO P 26 -4.225 -10.591 -23.440 1.00 15.00 O ATOM 1401 CB PRO P 26 -5.277 -8.577 -21.910 1.00 15.00 C ATOM 1402 CG PRO P 26 -4.015 -8.639 -21.150 1.00 15.00 C ATOM 1403 CD PRO P 26 -4.389 -9.388 -19.912 1.00 15.00 C ATOM 0 HA PRO P 26 -6.896 -10.068 -21.801 1.00 15.00 H new ATOM 0 HB2 PRO P 26 -5.112 -8.309 -22.953 1.00 15.00 H new ATOM 0 HB3 PRO P 26 -5.966 -7.840 -21.497 1.00 15.00 H new ATOM 0 HG2 PRO P 26 -3.234 -9.154 -21.710 1.00 15.00 H new ATOM 0 HG3 PRO P 26 -3.637 -7.643 -20.918 1.00 15.00 H new ATOM 0 HD2 PRO P 26 -3.520 -9.803 -19.400 1.00 15.00 H new ATOM 0 HD3 PRO P 26 -4.914 -8.761 -19.191 1.00 15.00 H new ATOM 1411 N SER P 27 -6.027 -11.907 -23.192 1.00 15.00 N ATOM 1412 CA SER P 27 -5.666 -12.851 -24.237 1.00 15.00 C ATOM 1413 C SER P 27 -5.069 -12.139 -25.442 1.00 15.00 C ATOM 1414 O SER P 27 -5.170 -10.919 -25.576 1.00 15.00 O ATOM 1415 CB SER P 27 -6.892 -13.659 -24.665 1.00 15.00 C ATOM 1416 OG SER P 27 -7.431 -14.384 -23.573 1.00 15.00 O ATOM 0 H SER P 27 -6.903 -12.129 -22.720 1.00 15.00 H new ATOM 0 HA SER P 27 -4.912 -13.526 -23.832 1.00 15.00 H new ATOM 0 HB2 SER P 27 -7.650 -12.989 -25.070 1.00 15.00 H new ATOM 0 HB3 SER P 27 -6.617 -14.348 -25.463 1.00 15.00 H new ATOM 0 HG SER P 27 -8.215 -14.891 -23.872 1.00 15.00 H new ATOM 1422 N GLU P 28 -4.454 -12.914 -26.317 1.00 15.00 N ATOM 1423 CA GLU P 28 -3.837 -12.372 -27.520 1.00 15.00 C ATOM 1424 C GLU P 28 -4.754 -11.354 -28.173 1.00 15.00 C ATOM 1425 O GLU P 28 -4.316 -10.276 -28.570 1.00 15.00 O ATOM 1426 CB GLU P 28 -3.511 -13.495 -28.506 1.00 15.00 C ATOM 1427 CG GLU P 28 -2.538 -14.525 -27.955 1.00 15.00 C ATOM 1428 CD GLU P 28 -2.224 -15.623 -28.953 1.00 15.00 C ATOM 1429 OE1 GLU P 28 -1.703 -15.305 -30.042 1.00 15.00 O ATOM 1430 OE2 GLU P 28 -2.500 -16.802 -28.645 1.00 15.00 O ATOM 0 H GLU P 28 -4.367 -13.926 -26.219 1.00 15.00 H new ATOM 0 HA GLU P 28 -2.909 -11.876 -27.236 1.00 15.00 H new ATOM 0 HB2 GLU P 28 -4.436 -13.997 -28.791 1.00 15.00 H new ATOM 0 HB3 GLU P 28 -3.092 -13.060 -29.413 1.00 15.00 H new ATOM 0 HG2 GLU P 28 -1.613 -14.027 -27.665 1.00 15.00 H new ATOM 0 HG3 GLU P 28 -2.957 -14.969 -27.052 1.00 15.00 H new ATOM 1437 N GLU P 29 -6.029 -11.699 -28.281 1.00 15.00 N ATOM 1438 CA GLU P 29 -6.997 -10.804 -28.889 1.00 15.00 C ATOM 1439 C GLU P 29 -7.263 -9.616 -27.982 1.00 15.00 C ATOM 1440 O GLU P 29 -7.473 -8.500 -28.455 1.00 15.00 O ATOM 1441 CB GLU P 29 -8.303 -11.545 -29.189 1.00 15.00 C ATOM 1442 CG GLU P 29 -8.963 -12.139 -27.954 1.00 15.00 C ATOM 1443 CD GLU P 29 -10.252 -12.870 -28.277 1.00 15.00 C ATOM 1444 OE1 GLU P 29 -11.181 -12.229 -28.809 1.00 15.00 O ATOM 1445 OE2 GLU P 29 -10.330 -14.085 -27.997 1.00 15.00 O ATOM 0 H GLU P 29 -6.413 -12.587 -27.957 1.00 15.00 H new ATOM 0 HA GLU P 29 -6.583 -10.440 -29.829 1.00 15.00 H new ATOM 0 HB2 GLU P 29 -9.000 -10.857 -29.668 1.00 15.00 H new ATOM 0 HB3 GLU P 29 -8.102 -12.344 -29.903 1.00 15.00 H new ATOM 0 HG2 GLU P 29 -8.270 -12.828 -27.472 1.00 15.00 H new ATOM 0 HG3 GLU P 29 -9.170 -11.343 -27.239 1.00 15.00 H new ATOM 1452 N ALA P 30 -7.248 -9.856 -26.675 1.00 15.00 N ATOM 1453 CA ALA P 30 -7.481 -8.800 -25.705 1.00 15.00 C ATOM 1454 C ALA P 30 -6.393 -7.738 -25.791 1.00 15.00 C ATOM 1455 O ALA P 30 -6.675 -6.571 -26.040 1.00 15.00 O ATOM 1456 CB ALA P 30 -7.540 -9.391 -24.309 1.00 15.00 C ATOM 0 H ALA P 30 -7.076 -10.774 -26.266 1.00 15.00 H new ATOM 0 HA ALA P 30 -8.435 -8.322 -25.929 1.00 15.00 H new ATOM 0 HB1 ALA P 30 -7.715 -8.596 -23.584 1.00 15.00 H new ATOM 0 HB2 ALA P 30 -8.352 -10.116 -24.255 1.00 15.00 H new ATOM 0 HB3 ALA P 30 -6.596 -9.886 -24.083 1.00 15.00 H new ATOM 1462 N LYS P 31 -5.143 -8.152 -25.611 1.00 15.00 N ATOM 1463 CA LYS P 31 -4.026 -7.222 -25.695 1.00 15.00 C ATOM 1464 C LYS P 31 -3.985 -6.574 -27.076 1.00 15.00 C ATOM 1465 O LYS P 31 -3.468 -5.469 -27.244 1.00 15.00 O ATOM 1466 CB LYS P 31 -2.713 -7.929 -25.365 1.00 15.00 C ATOM 1467 CG LYS P 31 -2.471 -9.204 -26.160 1.00 15.00 C ATOM 1468 CD LYS P 31 -2.187 -10.400 -25.254 1.00 15.00 C ATOM 1469 CE LYS P 31 -1.095 -10.121 -24.219 1.00 15.00 C ATOM 1470 NZ LYS P 31 0.262 -10.074 -24.830 1.00 15.00 N ATOM 0 H LYS P 31 -4.881 -9.117 -25.408 1.00 15.00 H new ATOM 0 HA LYS P 31 -4.165 -6.431 -24.958 1.00 15.00 H new ATOM 0 HB2 LYS P 31 -1.888 -7.240 -25.545 1.00 15.00 H new ATOM 0 HB3 LYS P 31 -2.701 -8.170 -24.302 1.00 15.00 H new ATOM 0 HG2 LYS P 31 -3.343 -9.417 -26.778 1.00 15.00 H new ATOM 0 HG3 LYS P 31 -1.630 -9.055 -26.837 1.00 15.00 H new ATOM 0 HD2 LYS P 31 -3.104 -10.684 -24.738 1.00 15.00 H new ATOM 0 HD3 LYS P 31 -1.890 -11.251 -25.867 1.00 15.00 H new ATOM 0 HE2 LYS P 31 -1.301 -9.173 -23.723 1.00 15.00 H new ATOM 0 HE3 LYS P 31 -1.119 -10.894 -23.451 1.00 15.00 H new ATOM 0 HZ1 LYS P 31 0.852 -10.829 -24.425 1.00 15.00 H new ATOM 0 HZ2 LYS P 31 0.185 -10.210 -25.858 1.00 15.00 H new ATOM 0 HZ3 LYS P 31 0.699 -9.151 -24.635 1.00 15.00 H new ATOM 1484 N GLU P 32 -4.585 -7.254 -28.048 1.00 15.00 N ATOM 1485 CA GLU P 32 -4.671 -6.730 -29.402 1.00 15.00 C ATOM 1486 C GLU P 32 -5.737 -5.644 -29.450 1.00 15.00 C ATOM 1487 O GLU P 32 -5.451 -4.496 -29.771 1.00 15.00 O ATOM 1488 CB GLU P 32 -4.988 -7.841 -30.404 1.00 15.00 C ATOM 1489 CG GLU P 32 -3.775 -8.674 -30.790 1.00 15.00 C ATOM 1490 CD GLU P 32 -4.135 -9.853 -31.671 1.00 15.00 C ATOM 1491 OE1 GLU P 32 -4.679 -9.627 -32.772 1.00 15.00 O ATOM 1492 OE2 GLU P 32 -3.873 -11.004 -31.260 1.00 15.00 O ATOM 0 H GLU P 32 -5.018 -8.169 -27.921 1.00 15.00 H new ATOM 0 HA GLU P 32 -3.706 -6.305 -29.680 1.00 15.00 H new ATOM 0 HB2 GLU P 32 -5.749 -8.496 -29.979 1.00 15.00 H new ATOM 0 HB3 GLU P 32 -5.415 -7.397 -31.303 1.00 15.00 H new ATOM 0 HG2 GLU P 32 -3.056 -8.042 -31.311 1.00 15.00 H new ATOM 0 HG3 GLU P 32 -3.285 -9.037 -29.886 1.00 15.00 H new ATOM 1499 N GLU P 33 -6.966 -6.008 -29.099 1.00 15.00 N ATOM 1500 CA GLU P 33 -8.061 -5.052 -29.080 1.00 15.00 C ATOM 1501 C GLU P 33 -7.728 -3.917 -28.122 1.00 15.00 C ATOM 1502 O GLU P 33 -7.830 -2.744 -28.480 1.00 15.00 O ATOM 1503 CB GLU P 33 -9.371 -5.730 -28.670 1.00 15.00 C ATOM 1504 CG GLU P 33 -9.345 -6.322 -27.273 1.00 15.00 C ATOM 1505 CD GLU P 33 -10.624 -7.060 -26.931 1.00 15.00 C ATOM 1506 OE1 GLU P 33 -11.699 -6.422 -26.945 1.00 15.00 O ATOM 1507 OE2 GLU P 33 -10.553 -8.275 -26.650 1.00 15.00 O ATOM 0 H GLU P 33 -7.226 -6.956 -28.825 1.00 15.00 H new ATOM 0 HA GLU P 33 -8.193 -4.649 -30.084 1.00 15.00 H new ATOM 0 HB2 GLU P 33 -10.180 -5.002 -28.731 1.00 15.00 H new ATOM 0 HB3 GLU P 33 -9.599 -6.520 -29.385 1.00 15.00 H new ATOM 0 HG2 GLU P 33 -8.501 -7.006 -27.188 1.00 15.00 H new ATOM 0 HG3 GLU P 33 -9.184 -5.525 -26.547 1.00 15.00 H new ATOM 1514 N LEU P 34 -7.306 -4.272 -26.907 1.00 15.00 N ATOM 1515 CA LEU P 34 -6.932 -3.283 -25.907 1.00 15.00 C ATOM 1516 C LEU P 34 -5.916 -2.306 -26.489 1.00 15.00 C ATOM 1517 O LEU P 34 -6.167 -1.108 -26.568 1.00 15.00 O ATOM 1518 CB LEU P 34 -6.341 -3.980 -24.667 1.00 15.00 C ATOM 1519 CG LEU P 34 -7.310 -4.882 -23.886 1.00 15.00 C ATOM 1520 CD1 LEU P 34 -6.589 -5.608 -22.750 1.00 15.00 C ATOM 1521 CD2 LEU P 34 -8.460 -4.060 -23.338 1.00 15.00 C ATOM 0 H LEU P 34 -7.216 -5.239 -26.596 1.00 15.00 H new ATOM 0 HA LEU P 34 -7.824 -2.730 -25.610 1.00 15.00 H new ATOM 0 HB2 LEU P 34 -5.488 -4.581 -24.982 1.00 15.00 H new ATOM 0 HB3 LEU P 34 -5.959 -3.216 -23.990 1.00 15.00 H new ATOM 0 HG LEU P 34 -7.704 -5.633 -24.571 1.00 15.00 H new ATOM 0 HD11 LEU P 34 -7.298 -6.239 -22.214 1.00 15.00 H new ATOM 0 HD12 LEU P 34 -5.792 -6.227 -23.162 1.00 15.00 H new ATOM 0 HD13 LEU P 34 -6.163 -4.877 -22.063 1.00 15.00 H new ATOM 0 HD21 LEU P 34 -9.141 -4.709 -22.786 1.00 15.00 H new ATOM 0 HD22 LEU P 34 -8.072 -3.290 -22.671 1.00 15.00 H new ATOM 0 HD23 LEU P 34 -8.996 -3.589 -24.162 1.00 15.00 H new ATOM 1533 N ALA P 35 -4.764 -2.834 -26.889 1.00 15.00 N ATOM 1534 CA ALA P 35 -3.698 -2.018 -27.458 1.00 15.00 C ATOM 1535 C ALA P 35 -4.185 -1.183 -28.640 1.00 15.00 C ATOM 1536 O ALA P 35 -3.683 -0.084 -28.878 1.00 15.00 O ATOM 1537 CB ALA P 35 -2.532 -2.898 -27.880 1.00 15.00 C ATOM 0 H ALA P 35 -4.544 -3.828 -26.829 1.00 15.00 H new ATOM 0 HA ALA P 35 -3.367 -1.326 -26.684 1.00 15.00 H new ATOM 0 HB1 ALA P 35 -1.742 -2.277 -28.303 1.00 15.00 H new ATOM 0 HB2 ALA P 35 -2.147 -3.433 -27.012 1.00 15.00 H new ATOM 0 HB3 ALA P 35 -2.870 -3.616 -28.628 1.00 15.00 H new ATOM 1543 N LYS P 36 -5.166 -1.699 -29.375 1.00 15.00 N ATOM 1544 CA LYS P 36 -5.715 -0.984 -30.520 1.00 15.00 C ATOM 1545 C LYS P 36 -6.618 0.131 -30.029 1.00 15.00 C ATOM 1546 O LYS P 36 -6.578 1.263 -30.512 1.00 15.00 O ATOM 1547 CB LYS P 36 -6.506 -1.937 -31.425 1.00 15.00 C ATOM 1548 CG LYS P 36 -5.682 -3.045 -32.085 1.00 15.00 C ATOM 1549 CD LYS P 36 -4.212 -3.017 -31.686 1.00 15.00 C ATOM 1550 CE LYS P 36 -3.412 -4.068 -32.441 1.00 15.00 C ATOM 1551 NZ LYS P 36 -3.469 -3.859 -33.914 1.00 15.00 N ATOM 0 H LYS P 36 -5.595 -2.607 -29.198 1.00 15.00 H new ATOM 0 HA LYS P 36 -4.894 -0.563 -31.101 1.00 15.00 H new ATOM 0 HB2 LYS P 36 -7.298 -2.398 -30.835 1.00 15.00 H new ATOM 0 HB3 LYS P 36 -6.990 -1.352 -32.207 1.00 15.00 H new ATOM 0 HG2 LYS P 36 -6.106 -4.013 -31.818 1.00 15.00 H new ATOM 0 HG3 LYS P 36 -5.760 -2.951 -33.168 1.00 15.00 H new ATOM 0 HD2 LYS P 36 -3.798 -2.029 -31.886 1.00 15.00 H new ATOM 0 HD3 LYS P 36 -4.121 -3.189 -30.614 1.00 15.00 H new ATOM 0 HE2 LYS P 36 -2.374 -4.040 -32.111 1.00 15.00 H new ATOM 0 HE3 LYS P 36 -3.797 -5.059 -32.200 1.00 15.00 H new ATOM 0 HZ1 LYS P 36 -2.516 -3.963 -34.317 1.00 15.00 H new ATOM 0 HZ2 LYS P 36 -4.104 -4.564 -34.340 1.00 15.00 H new ATOM 0 HZ3 LYS P 36 -3.828 -2.904 -34.115 1.00 15.00 H new ATOM 1565 N LYS P 37 -7.431 -0.230 -29.053 1.00 15.00 N ATOM 1566 CA LYS P 37 -8.377 0.675 -28.432 1.00 15.00 C ATOM 1567 C LYS P 37 -7.671 1.748 -27.609 1.00 15.00 C ATOM 1568 O LYS P 37 -8.012 2.930 -27.676 1.00 15.00 O ATOM 1569 CB LYS P 37 -9.291 -0.143 -27.527 1.00 15.00 C ATOM 1570 CG LYS P 37 -10.420 -0.850 -28.259 1.00 15.00 C ATOM 1571 CD LYS P 37 -11.195 -1.767 -27.326 1.00 15.00 C ATOM 1572 CE LYS P 37 -11.777 -1.000 -26.149 1.00 15.00 C ATOM 1573 NZ LYS P 37 -12.760 0.028 -26.586 1.00 15.00 N ATOM 0 H LYS P 37 -7.452 -1.173 -28.665 1.00 15.00 H new ATOM 0 HA LYS P 37 -8.947 1.181 -29.211 1.00 15.00 H new ATOM 0 HB2 LYS P 37 -8.692 -0.886 -27.001 1.00 15.00 H new ATOM 0 HB3 LYS P 37 -9.719 0.515 -26.771 1.00 15.00 H new ATOM 0 HG2 LYS P 37 -11.096 -0.111 -28.690 1.00 15.00 H new ATOM 0 HG3 LYS P 37 -10.012 -1.430 -29.087 1.00 15.00 H new ATOM 0 HD2 LYS P 37 -11.999 -2.254 -27.878 1.00 15.00 H new ATOM 0 HD3 LYS P 37 -10.537 -2.555 -26.959 1.00 15.00 H new ATOM 0 HE2 LYS P 37 -12.261 -1.697 -25.465 1.00 15.00 H new ATOM 0 HE3 LYS P 37 -10.971 -0.519 -25.595 1.00 15.00 H new ATOM 0 HZ1 LYS P 37 -13.244 0.422 -25.754 1.00 15.00 H new ATOM 0 HZ2 LYS P 37 -12.264 0.790 -27.091 1.00 15.00 H new ATOM 0 HZ3 LYS P 37 -13.460 -0.408 -27.219 1.00 15.00 H new ATOM 1587 N SER P 38 -6.705 1.312 -26.816 1.00 15.00 N ATOM 1588 CA SER P 38 -5.945 2.186 -25.942 1.00 15.00 C ATOM 1589 C SER P 38 -4.950 3.050 -26.707 1.00 15.00 C ATOM 1590 O SER P 38 -4.900 4.268 -26.530 1.00 15.00 O ATOM 1591 CB SER P 38 -5.197 1.321 -24.931 1.00 15.00 C ATOM 1592 OG SER P 38 -6.082 0.778 -23.967 1.00 15.00 O ATOM 0 H SER P 38 -6.425 0.333 -26.762 1.00 15.00 H new ATOM 0 HA SER P 38 -6.641 2.862 -25.445 1.00 15.00 H new ATOM 0 HB2 SER P 38 -4.681 0.513 -25.451 1.00 15.00 H new ATOM 0 HB3 SER P 38 -4.434 1.918 -24.432 1.00 15.00 H new ATOM 0 HG SER P 38 -6.046 -0.201 -24.004 1.00 15.00 H new ATOM 1598 N GLY P 39 -4.137 2.407 -27.528 1.00 15.00 N ATOM 1599 CA GLY P 39 -3.120 3.117 -28.280 1.00 15.00 C ATOM 1600 C GLY P 39 -1.729 2.713 -27.830 1.00 15.00 C ATOM 1601 O GLY P 39 -0.753 3.427 -28.056 1.00 15.00 O ATOM 0 H GLY P 39 -4.162 1.400 -27.689 1.00 15.00 H new ATOM 0 HA2 GLY P 39 -3.237 2.908 -29.343 1.00 15.00 H new ATOM 0 HA3 GLY P 39 -3.250 4.191 -28.150 1.00 15.00 H new ATOM 1605 N ILE P 40 -1.657 1.545 -27.200 1.00 15.00 N ATOM 1606 CA ILE P 40 -0.408 0.987 -26.711 1.00 15.00 C ATOM 1607 C ILE P 40 -0.013 -0.195 -27.586 1.00 15.00 C ATOM 1608 O ILE P 40 -0.552 -0.372 -28.678 1.00 15.00 O ATOM 1609 CB ILE P 40 -0.553 0.520 -25.240 1.00 15.00 C ATOM 1610 CG1 ILE P 40 -1.756 -0.416 -25.101 1.00 15.00 C ATOM 1611 CG2 ILE P 40 -0.693 1.719 -24.307 1.00 15.00 C ATOM 1612 CD1 ILE P 40 -1.949 -0.951 -23.698 1.00 15.00 C ATOM 0 H ILE P 40 -2.470 0.958 -27.015 1.00 15.00 H new ATOM 0 HA ILE P 40 0.362 1.757 -26.753 1.00 15.00 H new ATOM 0 HB ILE P 40 0.347 -0.026 -24.957 1.00 15.00 H new ATOM 0 HG12 ILE P 40 -2.657 0.117 -25.405 1.00 15.00 H new ATOM 0 HG13 ILE P 40 -1.635 -1.254 -25.787 1.00 15.00 H new ATOM 0 HG21 ILE P 40 -0.794 1.370 -23.279 1.00 15.00 H new ATOM 0 HG22 ILE P 40 0.191 2.351 -24.391 1.00 15.00 H new ATOM 0 HG23 ILE P 40 -1.577 2.294 -24.583 1.00 15.00 H new ATOM 0 HD11 ILE P 40 -2.819 -1.607 -23.675 1.00 15.00 H new ATOM 0 HD12 ILE P 40 -1.064 -1.512 -23.398 1.00 15.00 H new ATOM 0 HD13 ILE P 40 -2.103 -0.120 -23.010 1.00 15.00 H new ATOM 1624 N THR P 41 0.889 -1.027 -27.095 1.00 15.00 N ATOM 1625 CA THR P 41 1.299 -2.210 -27.825 1.00 15.00 C ATOM 1626 C THR P 41 0.967 -3.429 -26.988 1.00 15.00 C ATOM 1627 O THR P 41 1.109 -3.397 -25.771 1.00 15.00 O ATOM 1628 CB THR P 41 2.792 -2.166 -28.156 1.00 15.00 C ATOM 1629 OG1 THR P 41 3.182 -3.327 -28.867 1.00 15.00 O ATOM 1630 CG2 THR P 41 3.679 -2.058 -26.937 1.00 15.00 C ATOM 0 H THR P 41 1.350 -0.904 -26.194 1.00 15.00 H new ATOM 0 HA THR P 41 0.764 -2.256 -28.773 1.00 15.00 H new ATOM 0 HB THR P 41 2.923 -1.267 -28.758 1.00 15.00 H new ATOM 0 HG1 THR P 41 4.139 -3.280 -29.071 1.00 15.00 H new ATOM 0 HG21 THR P 41 4.723 -2.032 -27.248 1.00 15.00 H new ATOM 0 HG22 THR P 41 3.440 -1.145 -26.393 1.00 15.00 H new ATOM 0 HG23 THR P 41 3.515 -2.920 -26.290 1.00 15.00 H new ATOM 1638 N VAL P 42 0.514 -4.490 -27.642 1.00 15.00 N ATOM 1639 CA VAL P 42 0.148 -5.728 -26.951 1.00 15.00 C ATOM 1640 C VAL P 42 0.874 -5.860 -25.606 1.00 15.00 C ATOM 1641 O VAL P 42 0.280 -5.670 -24.545 1.00 15.00 O ATOM 1642 CB VAL P 42 0.452 -6.958 -27.836 1.00 15.00 C ATOM 1643 CG1 VAL P 42 0.508 -8.230 -27.008 1.00 15.00 C ATOM 1644 CG2 VAL P 42 -0.595 -7.086 -28.937 1.00 15.00 C ATOM 0 H VAL P 42 0.389 -4.522 -28.654 1.00 15.00 H new ATOM 0 HA VAL P 42 -0.923 -5.686 -26.756 1.00 15.00 H new ATOM 0 HB VAL P 42 1.431 -6.813 -28.293 1.00 15.00 H new ATOM 0 HG11 VAL P 42 0.723 -9.078 -27.658 1.00 15.00 H new ATOM 0 HG12 VAL P 42 1.292 -8.141 -26.256 1.00 15.00 H new ATOM 0 HG13 VAL P 42 -0.451 -8.386 -26.515 1.00 15.00 H new ATOM 0 HG21 VAL P 42 -0.370 -7.956 -29.554 1.00 15.00 H new ATOM 0 HG22 VAL P 42 -1.582 -7.204 -28.489 1.00 15.00 H new ATOM 0 HG23 VAL P 42 -0.583 -6.189 -29.557 1.00 15.00 H new ATOM 1654 N SER P 43 2.147 -6.224 -25.668 1.00 15.00 N ATOM 1655 CA SER P 43 2.965 -6.426 -24.472 1.00 15.00 C ATOM 1656 C SER P 43 2.744 -5.355 -23.396 1.00 15.00 C ATOM 1657 O SER P 43 2.864 -5.649 -22.206 1.00 15.00 O ATOM 1658 CB SER P 43 4.445 -6.473 -24.852 1.00 15.00 C ATOM 1659 OG SER P 43 4.707 -7.533 -25.757 1.00 15.00 O ATOM 0 H SER P 43 2.644 -6.388 -26.543 1.00 15.00 H new ATOM 0 HA SER P 43 2.652 -7.377 -24.041 1.00 15.00 H new ATOM 0 HB2 SER P 43 4.738 -5.525 -25.303 1.00 15.00 H new ATOM 0 HB3 SER P 43 5.050 -6.599 -23.954 1.00 15.00 H new ATOM 0 HG SER P 43 5.660 -7.540 -25.985 1.00 15.00 H new ATOM 1665 N GLN P 44 2.406 -4.128 -23.789 1.00 15.00 N ATOM 1666 CA GLN P 44 2.164 -3.080 -22.807 1.00 15.00 C ATOM 1667 C GLN P 44 0.916 -3.397 -21.994 1.00 15.00 C ATOM 1668 O GLN P 44 0.842 -3.097 -20.805 1.00 15.00 O ATOM 1669 CB GLN P 44 2.042 -1.712 -23.479 1.00 15.00 C ATOM 1670 CG GLN P 44 3.375 -1.155 -23.948 1.00 15.00 C ATOM 1671 CD GLN P 44 4.320 -0.866 -22.799 1.00 15.00 C ATOM 1672 OE1 GLN P 44 5.455 -1.553 -22.779 1.00 15.00 O flip ATOM 1673 NE2 GLN P 44 4.033 -0.035 -21.938 1.00 15.00 N flip ATOM 0 H GLN P 44 2.296 -3.841 -24.762 1.00 15.00 H new ATOM 0 HA GLN P 44 3.018 -3.041 -22.131 1.00 15.00 H new ATOM 0 HB2 GLN P 44 1.369 -1.792 -24.332 1.00 15.00 H new ATOM 0 HB3 GLN P 44 1.588 -1.010 -22.780 1.00 15.00 H new ATOM 0 HG2 GLN P 44 3.843 -1.866 -24.629 1.00 15.00 H new ATOM 0 HG3 GLN P 44 3.204 -0.238 -24.513 1.00 15.00 H new ATOM 0 HE21 GLN P 44 3.149 0.471 -21.992 1.00 15.00 H new ATOM 0 HE22 GLN P 44 4.679 0.148 -21.170 1.00 15.00 H new ATOM 1682 N VAL P 45 -0.058 -4.026 -22.640 1.00 15.00 N ATOM 1683 CA VAL P 45 -1.291 -4.399 -21.967 1.00 15.00 C ATOM 1684 C VAL P 45 -1.015 -5.425 -20.874 1.00 15.00 C ATOM 1685 O VAL P 45 -1.270 -5.172 -19.696 1.00 15.00 O ATOM 1686 CB VAL P 45 -2.328 -4.965 -22.954 1.00 15.00 C ATOM 1687 CG1 VAL P 45 -3.612 -5.319 -22.224 1.00 15.00 C ATOM 1688 CG2 VAL P 45 -2.603 -3.968 -24.067 1.00 15.00 C ATOM 0 H VAL P 45 -0.016 -4.287 -23.625 1.00 15.00 H new ATOM 0 HA VAL P 45 -1.702 -3.494 -21.520 1.00 15.00 H new ATOM 0 HB VAL P 45 -1.923 -5.873 -23.401 1.00 15.00 H new ATOM 0 HG11 VAL P 45 -4.336 -5.718 -22.934 1.00 15.00 H new ATOM 0 HG12 VAL P 45 -3.402 -6.068 -21.461 1.00 15.00 H new ATOM 0 HG13 VAL P 45 -4.021 -4.425 -21.753 1.00 15.00 H new ATOM 0 HG21 VAL P 45 -3.338 -4.385 -24.755 1.00 15.00 H new ATOM 0 HG22 VAL P 45 -2.990 -3.043 -23.639 1.00 15.00 H new ATOM 0 HG23 VAL P 45 -1.679 -3.760 -24.606 1.00 15.00 H new ATOM 1698 N SER P 46 -0.473 -6.578 -21.264 1.00 15.00 N ATOM 1699 CA SER P 46 -0.143 -7.629 -20.301 1.00 15.00 C ATOM 1700 C SER P 46 0.704 -7.054 -19.168 1.00 15.00 C ATOM 1701 O SER P 46 0.675 -7.539 -18.038 1.00 15.00 O ATOM 1702 CB SER P 46 0.607 -8.769 -20.993 1.00 15.00 C ATOM 1703 OG SER P 46 0.936 -9.795 -20.072 1.00 15.00 O ATOM 0 H SER P 46 -0.254 -6.808 -22.233 1.00 15.00 H new ATOM 0 HA SER P 46 -1.069 -8.024 -19.884 1.00 15.00 H new ATOM 0 HB2 SER P 46 -0.007 -9.179 -21.795 1.00 15.00 H new ATOM 0 HB3 SER P 46 1.517 -8.384 -21.453 1.00 15.00 H new ATOM 0 HG SER P 46 1.413 -10.513 -20.538 1.00 15.00 H new ATOM 1709 N ASN P 47 1.430 -5.990 -19.490 1.00 15.00 N ATOM 1710 CA ASN P 47 2.260 -5.301 -18.515 1.00 15.00 C ATOM 1711 C ASN P 47 1.370 -4.498 -17.570 1.00 15.00 C ATOM 1712 O ASN P 47 1.483 -4.598 -16.349 1.00 15.00 O ATOM 1713 CB ASN P 47 3.261 -4.378 -19.218 1.00 15.00 C ATOM 1714 CG ASN P 47 4.229 -3.685 -18.266 1.00 15.00 C ATOM 1715 OD1 ASN P 47 4.221 -4.070 -16.990 1.00 15.00 O flip ATOM 1716 ND2 ASN P 47 4.994 -2.815 -18.682 1.00 15.00 N flip ATOM 0 H ASN P 47 1.459 -5.585 -20.426 1.00 15.00 H new ATOM 0 HA ASN P 47 2.823 -6.037 -17.941 1.00 15.00 H new ATOM 0 HB2 ASN P 47 3.831 -4.960 -19.942 1.00 15.00 H new ATOM 0 HB3 ASN P 47 2.712 -3.621 -19.778 1.00 15.00 H new ATOM 0 HD21 ASN P 47 4.973 -2.545 -19.665 1.00 15.00 H new ATOM 0 HD22 ASN P 47 5.649 -2.364 -18.043 1.00 15.00 H new ATOM 1723 N TRP P 48 0.478 -3.708 -18.162 1.00 15.00 N ATOM 1724 CA TRP P 48 -0.456 -2.880 -17.406 1.00 15.00 C ATOM 1725 C TRP P 48 -1.315 -3.722 -16.465 1.00 15.00 C ATOM 1726 O TRP P 48 -1.317 -3.519 -15.252 1.00 15.00 O ATOM 1727 CB TRP P 48 -1.373 -2.121 -18.360 1.00 15.00 C ATOM 1728 CG TRP P 48 -2.190 -1.073 -17.678 1.00 15.00 C ATOM 1729 CD1 TRP P 48 -1.836 0.225 -17.456 1.00 15.00 C ATOM 1730 CD2 TRP P 48 -3.481 -1.243 -17.088 1.00 15.00 C ATOM 1731 NE1 TRP P 48 -2.843 0.882 -16.799 1.00 15.00 N ATOM 1732 CE2 TRP P 48 -3.860 0.002 -16.553 1.00 15.00 C ATOM 1733 CE3 TRP P 48 -4.358 -2.322 -16.971 1.00 15.00 C ATOM 1734 CZ2 TRP P 48 -5.073 0.195 -15.908 1.00 15.00 C ATOM 1735 CZ3 TRP P 48 -5.562 -2.130 -16.326 1.00 15.00 C ATOM 1736 CH2 TRP P 48 -5.908 -0.878 -15.803 1.00 15.00 C ATOM 0 H TRP P 48 0.383 -3.624 -19.174 1.00 15.00 H new ATOM 0 HA TRP P 48 0.133 -2.181 -16.813 1.00 15.00 H new ATOM 0 HB2 TRP P 48 -0.770 -1.654 -19.139 1.00 15.00 H new ATOM 0 HB3 TRP P 48 -2.039 -2.828 -18.854 1.00 15.00 H new ATOM 0 HD1 TRP P 48 -0.898 0.670 -17.755 1.00 15.00 H new ATOM 0 HE1 TRP P 48 -2.835 1.868 -16.536 1.00 15.00 H new ATOM 0 HE3 TRP P 48 -4.099 -3.289 -17.378 1.00 15.00 H new ATOM 0 HZ2 TRP P 48 -5.346 1.159 -15.504 1.00 15.00 H new ATOM 0 HZ3 TRP P 48 -6.248 -2.958 -16.223 1.00 15.00 H new ATOM 0 HH2 TRP P 48 -6.859 -0.759 -15.305 1.00 15.00 H new ATOM 1747 N PHE P 49 -2.061 -4.656 -17.053 1.00 15.00 N ATOM 1748 CA PHE P 49 -2.957 -5.531 -16.297 1.00 15.00 C ATOM 1749 C PHE P 49 -2.264 -6.141 -15.086 1.00 15.00 C ATOM 1750 O PHE P 49 -2.712 -5.965 -13.952 1.00 15.00 O ATOM 1751 CB PHE P 49 -3.497 -6.644 -17.198 1.00 15.00 C ATOM 1752 CG PHE P 49 -4.638 -6.219 -18.080 1.00 15.00 C ATOM 1753 CD1 PHE P 49 -4.498 -5.168 -18.975 1.00 15.00 C ATOM 1754 CD2 PHE P 49 -5.857 -6.875 -18.011 1.00 15.00 C ATOM 1755 CE1 PHE P 49 -5.552 -4.784 -19.781 1.00 15.00 C ATOM 1756 CE2 PHE P 49 -6.913 -6.495 -18.817 1.00 15.00 C ATOM 1757 CZ PHE P 49 -6.760 -5.450 -19.702 1.00 15.00 C ATOM 0 H PHE P 49 -2.062 -4.827 -18.059 1.00 15.00 H new ATOM 0 HA PHE P 49 -3.784 -4.918 -15.938 1.00 15.00 H new ATOM 0 HB2 PHE P 49 -2.686 -7.015 -17.825 1.00 15.00 H new ATOM 0 HB3 PHE P 49 -3.824 -7.476 -16.574 1.00 15.00 H new ATOM 0 HD1 PHE P 49 -3.556 -4.645 -19.042 1.00 15.00 H new ATOM 0 HD2 PHE P 49 -5.983 -7.694 -17.318 1.00 15.00 H new ATOM 0 HE1 PHE P 49 -5.432 -3.963 -20.473 1.00 15.00 H new ATOM 0 HE2 PHE P 49 -7.857 -7.016 -18.753 1.00 15.00 H new ATOM 0 HZ PHE P 49 -7.584 -5.152 -20.334 1.00 15.00 H new ATOM 1767 N GLY P 50 -1.181 -6.872 -15.333 1.00 15.00 N ATOM 1768 CA GLY P 50 -0.448 -7.515 -14.254 1.00 15.00 C ATOM 1769 C GLY P 50 -0.346 -6.659 -13.003 1.00 15.00 C ATOM 1770 O GLY P 50 -0.697 -7.103 -11.911 1.00 15.00 O ATOM 0 H GLY P 50 -0.796 -7.032 -16.264 1.00 15.00 H new ATOM 0 HA2 GLY P 50 -0.937 -8.456 -14.003 1.00 15.00 H new ATOM 0 HA3 GLY P 50 0.556 -7.760 -14.601 1.00 15.00 H new ATOM 1774 N ASN P 51 0.138 -5.433 -13.164 1.00 15.00 N ATOM 1775 CA ASN P 51 0.293 -4.516 -12.039 1.00 15.00 C ATOM 1776 C ASN P 51 -1.054 -3.959 -11.576 1.00 15.00 C ATOM 1777 O ASN P 51 -1.191 -3.526 -10.431 1.00 15.00 O ATOM 1778 CB ASN P 51 1.226 -3.366 -12.425 1.00 15.00 C ATOM 1779 CG ASN P 51 1.460 -2.398 -11.282 1.00 15.00 C ATOM 1780 OD1 ASN P 51 1.964 -2.776 -10.225 1.00 15.00 O ATOM 1781 ND2 ASN P 51 1.091 -1.140 -11.489 1.00 15.00 N ATOM 0 H ASN P 51 0.430 -5.050 -14.063 1.00 15.00 H new ATOM 0 HA ASN P 51 0.727 -5.076 -11.211 1.00 15.00 H new ATOM 0 HB2 ASN P 51 2.182 -3.773 -12.753 1.00 15.00 H new ATOM 0 HB3 ASN P 51 0.801 -2.827 -13.272 1.00 15.00 H new ATOM 0 HD21 ASN P 51 1.222 -0.443 -10.756 1.00 15.00 H new ATOM 0 HD22 ASN P 51 0.677 -0.870 -12.381 1.00 15.00 H new ATOM 1788 N LYS P 52 -2.044 -3.963 -12.465 1.00 15.00 N ATOM 1789 CA LYS P 52 -3.368 -3.446 -12.130 1.00 15.00 C ATOM 1790 C LYS P 52 -3.968 -4.204 -10.947 1.00 15.00 C ATOM 1791 O LYS P 52 -4.534 -3.600 -10.034 1.00 15.00 O ATOM 1792 CB LYS P 52 -4.299 -3.528 -13.339 1.00 15.00 C ATOM 1793 CG LYS P 52 -5.646 -2.861 -13.112 1.00 15.00 C ATOM 1794 CD LYS P 52 -5.487 -1.399 -12.729 1.00 15.00 C ATOM 1795 CE LYS P 52 -6.834 -0.731 -12.504 1.00 15.00 C ATOM 1796 NZ LYS P 52 -6.686 0.701 -12.128 1.00 15.00 N ATOM 0 H LYS P 52 -1.956 -4.316 -13.418 1.00 15.00 H new ATOM 0 HA LYS P 52 -3.258 -2.400 -11.845 1.00 15.00 H new ATOM 0 HB2 LYS P 52 -3.811 -3.062 -14.196 1.00 15.00 H new ATOM 0 HB3 LYS P 52 -4.459 -4.576 -13.594 1.00 15.00 H new ATOM 0 HG2 LYS P 52 -6.248 -2.937 -14.017 1.00 15.00 H new ATOM 0 HG3 LYS P 52 -6.186 -3.388 -12.325 1.00 15.00 H new ATOM 0 HD2 LYS P 52 -4.886 -1.323 -11.823 1.00 15.00 H new ATOM 0 HD3 LYS P 52 -4.946 -0.873 -13.515 1.00 15.00 H new ATOM 0 HE2 LYS P 52 -7.434 -0.808 -13.411 1.00 15.00 H new ATOM 0 HE3 LYS P 52 -7.375 -1.259 -11.718 1.00 15.00 H new ATOM 0 HZ1 LYS P 52 -7.612 1.171 -12.181 1.00 15.00 H new ATOM 0 HZ2 LYS P 52 -6.319 0.769 -11.157 1.00 15.00 H new ATOM 0 HZ3 LYS P 52 -6.024 1.165 -12.782 1.00 15.00 H new ATOM 1810 N ARG P 53 -3.821 -5.526 -10.955 1.00 15.00 N ATOM 1811 CA ARG P 53 -4.328 -6.354 -9.862 1.00 15.00 C ATOM 1812 C ARG P 53 -3.478 -6.135 -8.619 1.00 15.00 C ATOM 1813 O ARG P 53 -3.994 -6.024 -7.510 1.00 15.00 O ATOM 1814 CB ARG P 53 -4.336 -7.831 -10.254 1.00 15.00 C ATOM 1815 CG ARG P 53 -3.058 -8.275 -10.945 1.00 15.00 C ATOM 1816 CD ARG P 53 -3.026 -9.776 -11.166 1.00 15.00 C ATOM 1817 NE ARG P 53 -2.070 -10.147 -12.207 1.00 15.00 N ATOM 1818 CZ ARG P 53 -0.754 -9.972 -12.108 1.00 15.00 C ATOM 1819 NH1 ARG P 53 -0.225 -9.479 -11.001 1.00 15.00 N ATOM 1820 NH2 ARG P 53 0.039 -10.311 -13.117 1.00 15.00 N ATOM 0 H ARG P 53 -3.358 -6.045 -11.701 1.00 15.00 H new ATOM 0 HA ARG P 53 -5.356 -6.061 -9.648 1.00 15.00 H new ATOM 0 HB2 ARG P 53 -4.487 -8.436 -9.360 1.00 15.00 H new ATOM 0 HB3 ARG P 53 -5.183 -8.020 -10.914 1.00 15.00 H new ATOM 0 HG2 ARG P 53 -2.968 -7.765 -11.904 1.00 15.00 H new ATOM 0 HG3 ARG P 53 -2.198 -7.978 -10.344 1.00 15.00 H new ATOM 0 HD2 ARG P 53 -2.762 -10.276 -10.234 1.00 15.00 H new ATOM 0 HD3 ARG P 53 -4.021 -10.125 -11.444 1.00 15.00 H new ATOM 0 HE ARG P 53 -2.434 -10.566 -13.063 1.00 15.00 H new ATOM 0 HH11 ARG P 53 -0.826 -9.230 -10.215 1.00 15.00 H new ATOM 0 HH12 ARG P 53 0.784 -9.348 -10.933 1.00 15.00 H new ATOM 0 HH21 ARG P 53 -0.360 -10.706 -13.969 1.00 15.00 H new ATOM 0 HH22 ARG P 53 1.047 -10.177 -13.041 1.00 15.00 H new ATOM 1834 N ILE P 54 -2.163 -6.072 -8.809 1.00 15.00 N ATOM 1835 CA ILE P 54 -1.264 -5.860 -7.687 1.00 15.00 C ATOM 1836 C ILE P 54 -1.710 -4.602 -6.969 1.00 15.00 C ATOM 1837 O ILE P 54 -1.990 -4.633 -5.777 1.00 15.00 O ATOM 1838 CB ILE P 54 0.203 -5.700 -8.141 1.00 15.00 C ATOM 1839 CG1 ILE P 54 0.607 -6.849 -9.064 1.00 15.00 C ATOM 1840 CG2 ILE P 54 1.131 -5.640 -6.935 1.00 15.00 C ATOM 1841 CD1 ILE P 54 0.424 -8.217 -8.448 1.00 15.00 C ATOM 0 H ILE P 54 -1.705 -6.163 -9.716 1.00 15.00 H new ATOM 0 HA ILE P 54 -1.305 -6.731 -7.032 1.00 15.00 H new ATOM 0 HB ILE P 54 0.291 -4.764 -8.693 1.00 15.00 H new ATOM 0 HG12 ILE P 54 0.019 -6.791 -9.980 1.00 15.00 H new ATOM 0 HG13 ILE P 54 1.652 -6.725 -9.348 1.00 15.00 H new ATOM 0 HG21 ILE P 54 2.161 -5.527 -7.274 1.00 15.00 H new ATOM 0 HG22 ILE P 54 0.860 -4.790 -6.309 1.00 15.00 H new ATOM 0 HG23 ILE P 54 1.038 -6.560 -6.358 1.00 15.00 H new ATOM 0 HD11 ILE P 54 0.731 -8.981 -9.162 1.00 15.00 H new ATOM 0 HD12 ILE P 54 1.033 -8.295 -7.548 1.00 15.00 H new ATOM 0 HD13 ILE P 54 -0.625 -8.362 -8.190 1.00 15.00 H new ATOM 1853 N ARG P 55 -1.847 -3.519 -7.727 1.00 15.00 N ATOM 1854 CA ARG P 55 -2.327 -2.255 -7.191 1.00 15.00 C ATOM 1855 C ARG P 55 -3.634 -2.468 -6.421 1.00 15.00 C ATOM 1856 O ARG P 55 -3.839 -1.906 -5.347 1.00 15.00 O ATOM 1857 CB ARG P 55 -2.546 -1.286 -8.351 1.00 15.00 C ATOM 1858 CG ARG P 55 -3.066 0.075 -7.945 1.00 15.00 C ATOM 1859 CD ARG P 55 -3.548 0.842 -9.160 1.00 15.00 C ATOM 1860 NE ARG P 55 -2.474 1.087 -10.121 1.00 15.00 N ATOM 1861 CZ ARG P 55 -2.666 1.613 -11.328 1.00 15.00 C ATOM 1862 NH1 ARG P 55 -3.888 1.940 -11.731 1.00 15.00 N ATOM 1863 NH2 ARG P 55 -1.634 1.807 -12.138 1.00 15.00 N ATOM 0 H ARG P 55 -1.629 -3.494 -8.723 1.00 15.00 H new ATOM 0 HA ARG P 55 -1.591 -1.843 -6.501 1.00 15.00 H new ATOM 0 HB2 ARG P 55 -1.603 -1.156 -8.882 1.00 15.00 H new ATOM 0 HB3 ARG P 55 -3.249 -1.734 -9.054 1.00 15.00 H new ATOM 0 HG2 ARG P 55 -3.882 -0.039 -7.232 1.00 15.00 H new ATOM 0 HG3 ARG P 55 -2.279 0.636 -7.442 1.00 15.00 H new ATOM 0 HD2 ARG P 55 -4.348 0.283 -9.646 1.00 15.00 H new ATOM 0 HD3 ARG P 55 -3.972 1.794 -8.842 1.00 15.00 H new ATOM 0 HE ARG P 55 -1.522 0.840 -9.850 1.00 15.00 H new ATOM 0 HH11 ARG P 55 -4.686 1.788 -11.114 1.00 15.00 H new ATOM 0 HH12 ARG P 55 -4.029 2.343 -12.657 1.00 15.00 H new ATOM 0 HH21 ARG P 55 -0.694 1.553 -11.836 1.00 15.00 H new ATOM 0 HH22 ARG P 55 -1.781 2.210 -13.063 1.00 15.00 H new ATOM 1877 N TYR P 56 -4.509 -3.299 -6.986 1.00 15.00 N ATOM 1878 CA TYR P 56 -5.797 -3.617 -6.368 1.00 15.00 C ATOM 1879 C TYR P 56 -5.613 -4.062 -4.908 1.00 15.00 C ATOM 1880 O TYR P 56 -6.135 -3.440 -3.983 1.00 15.00 O ATOM 1881 CB TYR P 56 -6.518 -4.681 -7.210 1.00 15.00 C ATOM 1882 CG TYR P 56 -7.479 -5.564 -6.447 1.00 15.00 C ATOM 1883 CD1 TYR P 56 -8.472 -5.025 -5.645 1.00 15.00 C ATOM 1884 CD2 TYR P 56 -7.391 -6.945 -6.545 1.00 15.00 C ATOM 1885 CE1 TYR P 56 -9.351 -5.840 -4.956 1.00 15.00 C ATOM 1886 CE2 TYR P 56 -8.262 -7.766 -5.862 1.00 15.00 C ATOM 1887 CZ TYR P 56 -9.241 -7.210 -5.068 1.00 15.00 C ATOM 1888 OH TYR P 56 -10.115 -8.026 -4.385 1.00 15.00 O ATOM 0 H TYR P 56 -4.348 -3.768 -7.878 1.00 15.00 H new ATOM 0 HA TYR P 56 -6.418 -2.722 -6.344 1.00 15.00 H new ATOM 0 HB2 TYR P 56 -7.066 -4.180 -8.008 1.00 15.00 H new ATOM 0 HB3 TYR P 56 -5.769 -5.313 -7.686 1.00 15.00 H new ATOM 0 HD1 TYR P 56 -8.561 -3.952 -5.557 1.00 15.00 H new ATOM 0 HD2 TYR P 56 -6.626 -7.385 -7.168 1.00 15.00 H new ATOM 0 HE1 TYR P 56 -10.120 -5.406 -4.334 1.00 15.00 H new ATOM 0 HE2 TYR P 56 -8.178 -8.839 -5.949 1.00 15.00 H new ATOM 0 HH TYR P 56 -9.902 -8.964 -4.573 1.00 15.00 H new ATOM 1898 N LYS P 57 -4.859 -5.137 -4.727 1.00 15.00 N ATOM 1899 CA LYS P 57 -4.557 -5.710 -3.406 1.00 15.00 C ATOM 1900 C LYS P 57 -4.123 -4.674 -2.363 1.00 15.00 C ATOM 1901 O LYS P 57 -4.150 -4.941 -1.161 1.00 15.00 O ATOM 1902 CB LYS P 57 -3.412 -6.680 -3.570 1.00 15.00 C ATOM 1903 CG LYS P 57 -3.733 -7.870 -4.458 1.00 15.00 C ATOM 1904 CD LYS P 57 -4.857 -8.710 -3.873 1.00 15.00 C ATOM 1905 CE LYS P 57 -5.225 -9.867 -4.785 1.00 15.00 C ATOM 1906 NZ LYS P 57 -6.309 -10.709 -4.207 1.00 15.00 N ATOM 0 H LYS P 57 -4.430 -5.649 -5.498 1.00 15.00 H new ATOM 0 HA LYS P 57 -5.476 -6.174 -3.048 1.00 15.00 H new ATOM 0 HB2 LYS P 57 -2.556 -6.149 -3.987 1.00 15.00 H new ATOM 0 HB3 LYS P 57 -3.113 -7.043 -2.587 1.00 15.00 H new ATOM 0 HG2 LYS P 57 -4.017 -7.520 -5.450 1.00 15.00 H new ATOM 0 HG3 LYS P 57 -2.842 -8.486 -4.580 1.00 15.00 H new ATOM 0 HD2 LYS P 57 -4.555 -9.096 -2.899 1.00 15.00 H new ATOM 0 HD3 LYS P 57 -5.733 -8.083 -3.709 1.00 15.00 H new ATOM 0 HE2 LYS P 57 -5.544 -9.479 -5.752 1.00 15.00 H new ATOM 0 HE3 LYS P 57 -4.343 -10.483 -4.963 1.00 15.00 H new ATOM 0 HZ1 LYS P 57 -6.530 -11.487 -4.861 1.00 15.00 H new ATOM 0 HZ2 LYS P 57 -5.996 -11.101 -3.296 1.00 15.00 H new ATOM 0 HZ3 LYS P 57 -7.159 -10.128 -4.060 1.00 15.00 H new ATOM 1920 N LYS P 58 -3.717 -3.510 -2.827 1.00 15.00 N ATOM 1921 CA LYS P 58 -3.269 -2.453 -1.927 1.00 15.00 C ATOM 1922 C LYS P 58 -4.458 -1.800 -1.246 1.00 15.00 C ATOM 1923 O LYS P 58 -4.386 -1.416 -0.078 1.00 15.00 O ATOM 1924 CB LYS P 58 -2.438 -1.397 -2.665 1.00 15.00 C ATOM 1925 CG LYS P 58 -1.064 -1.887 -3.097 1.00 15.00 C ATOM 1926 CD LYS P 58 -1.175 -3.093 -4.005 1.00 15.00 C ATOM 1927 CE LYS P 58 0.171 -3.514 -4.576 1.00 15.00 C ATOM 1928 NZ LYS P 58 1.149 -3.845 -3.505 1.00 15.00 N ATOM 0 H LYS P 58 -3.686 -3.267 -3.817 1.00 15.00 H new ATOM 0 HA LYS P 58 -2.631 -2.912 -1.171 1.00 15.00 H new ATOM 0 HB2 LYS P 58 -2.988 -1.066 -3.546 1.00 15.00 H new ATOM 0 HB3 LYS P 58 -2.317 -0.527 -2.019 1.00 15.00 H new ATOM 0 HG2 LYS P 58 -0.535 -1.086 -3.614 1.00 15.00 H new ATOM 0 HG3 LYS P 58 -0.473 -2.143 -2.218 1.00 15.00 H new ATOM 0 HD2 LYS P 58 -1.607 -3.925 -3.449 1.00 15.00 H new ATOM 0 HD3 LYS P 58 -1.859 -2.867 -4.823 1.00 15.00 H new ATOM 0 HE2 LYS P 58 0.036 -4.380 -5.224 1.00 15.00 H new ATOM 0 HE3 LYS P 58 0.570 -2.711 -5.196 1.00 15.00 H new ATOM 0 HZ1 LYS P 58 2.018 -4.223 -3.933 1.00 15.00 H new ATOM 0 HZ2 LYS P 58 1.375 -2.986 -2.964 1.00 15.00 H new ATOM 0 HZ3 LYS P 58 0.738 -4.557 -2.868 1.00 15.00 H new ATOM 1942 N ASN P 59 -5.539 -1.650 -1.992 1.00 15.00 N ATOM 1943 CA ASN P 59 -6.731 -1.008 -1.464 1.00 15.00 C ATOM 1944 C ASN P 59 -8.024 -1.715 -1.874 1.00 15.00 C ATOM 1945 O ASN P 59 -9.000 -1.062 -2.230 1.00 15.00 O ATOM 1946 CB ASN P 59 -6.747 0.442 -1.927 1.00 15.00 C ATOM 1947 CG ASN P 59 -5.828 1.326 -1.107 1.00 15.00 C ATOM 1948 OD1 ASN P 59 -5.993 1.455 0.107 1.00 15.00 O ATOM 1949 ND2 ASN P 59 -4.854 1.941 -1.766 1.00 15.00 N ATOM 0 H ASN P 59 -5.616 -1.962 -2.960 1.00 15.00 H new ATOM 0 HA ASN P 59 -6.690 -1.064 -0.376 1.00 15.00 H new ATOM 0 HB2 ASN P 59 -6.450 0.488 -2.975 1.00 15.00 H new ATOM 0 HB3 ASN P 59 -7.765 0.828 -1.867 1.00 15.00 H new ATOM 0 HD21 ASN P 59 -4.205 2.549 -1.266 1.00 15.00 H new ATOM 0 HD22 ASN P 59 -4.754 1.805 -2.772 1.00 15.00 H new ATOM 1956 N ILE P 60 -8.019 -3.044 -1.811 1.00 15.00 N ATOM 1957 CA ILE P 60 -9.180 -3.886 -2.151 1.00 15.00 C ATOM 1958 C ILE P 60 -10.517 -3.133 -2.277 1.00 15.00 C ATOM 1959 O ILE P 60 -11.060 -2.986 -3.372 1.00 15.00 O ATOM 1960 CB ILE P 60 -9.361 -5.014 -1.110 1.00 15.00 C ATOM 1961 CG1 ILE P 60 -8.089 -5.856 -1.002 1.00 15.00 C ATOM 1962 CG2 ILE P 60 -10.550 -5.894 -1.477 1.00 15.00 C ATOM 1963 CD1 ILE P 60 -7.696 -6.520 -2.302 1.00 15.00 C ATOM 0 H ILE P 60 -7.202 -3.580 -1.520 1.00 15.00 H new ATOM 0 HA ILE P 60 -8.943 -4.283 -3.138 1.00 15.00 H new ATOM 0 HB ILE P 60 -9.555 -4.556 -0.140 1.00 15.00 H new ATOM 0 HG12 ILE P 60 -7.270 -5.221 -0.665 1.00 15.00 H new ATOM 0 HG13 ILE P 60 -8.233 -6.622 -0.240 1.00 15.00 H new ATOM 0 HG21 ILE P 60 -10.662 -6.683 -0.733 1.00 15.00 H new ATOM 0 HG22 ILE P 60 -11.456 -5.289 -1.504 1.00 15.00 H new ATOM 0 HG23 ILE P 60 -10.383 -6.341 -2.457 1.00 15.00 H new ATOM 0 HD11 ILE P 60 -6.786 -7.101 -2.153 1.00 15.00 H new ATOM 0 HD12 ILE P 60 -8.498 -7.181 -2.630 1.00 15.00 H new ATOM 0 HD13 ILE P 60 -7.520 -5.758 -3.061 1.00 15.00 H new ATOM 1975 N GLY P 61 -11.054 -2.698 -1.136 1.00 15.00 N ATOM 1976 CA GLY P 61 -12.343 -2.011 -1.107 1.00 15.00 C ATOM 1977 C GLY P 61 -12.423 -0.794 -2.011 1.00 15.00 C ATOM 1978 O GLY P 61 -13.513 -0.382 -2.414 1.00 15.00 O ATOM 0 H GLY P 61 -10.616 -2.810 -0.222 1.00 15.00 H new ATOM 0 HA2 GLY P 61 -13.123 -2.715 -1.395 1.00 15.00 H new ATOM 0 HA3 GLY P 61 -12.554 -1.703 -0.083 1.00 15.00 H new ATOM 1982 N LYS P 62 -11.276 -0.228 -2.338 1.00 15.00 N ATOM 1983 CA LYS P 62 -11.224 0.940 -3.205 1.00 15.00 C ATOM 1984 C LYS P 62 -11.506 0.541 -4.648 1.00 15.00 C ATOM 1985 O LYS P 62 -12.156 1.272 -5.392 1.00 15.00 O ATOM 1986 CB LYS P 62 -9.854 1.616 -3.104 1.00 15.00 C ATOM 1987 CG LYS P 62 -9.719 2.856 -3.973 1.00 15.00 C ATOM 1988 CD LYS P 62 -8.341 3.484 -3.836 1.00 15.00 C ATOM 1989 CE LYS P 62 -8.203 4.721 -4.711 1.00 15.00 C ATOM 1990 NZ LYS P 62 -8.398 4.405 -6.153 1.00 15.00 N ATOM 0 H LYS P 62 -10.365 -0.557 -2.017 1.00 15.00 H new ATOM 0 HA LYS P 62 -11.988 1.646 -2.881 1.00 15.00 H new ATOM 0 HB2 LYS P 62 -9.669 1.889 -2.065 1.00 15.00 H new ATOM 0 HB3 LYS P 62 -9.083 0.899 -3.387 1.00 15.00 H new ATOM 0 HG2 LYS P 62 -9.898 2.593 -5.015 1.00 15.00 H new ATOM 0 HG3 LYS P 62 -10.481 3.583 -3.693 1.00 15.00 H new ATOM 0 HD2 LYS P 62 -8.164 3.752 -2.794 1.00 15.00 H new ATOM 0 HD3 LYS P 62 -7.579 2.755 -4.111 1.00 15.00 H new ATOM 0 HE2 LYS P 62 -8.933 5.468 -4.401 1.00 15.00 H new ATOM 0 HE3 LYS P 62 -7.216 5.160 -4.566 1.00 15.00 H new ATOM 0 HZ1 LYS P 62 -8.246 5.263 -6.720 1.00 15.00 H new ATOM 0 HZ2 LYS P 62 -7.718 3.673 -6.443 1.00 15.00 H new ATOM 0 HZ3 LYS P 62 -9.366 4.057 -6.304 1.00 15.00 H new ATOM 2004 N PHE P 63 -11.000 -0.624 -5.032 1.00 15.00 N ATOM 2005 CA PHE P 63 -11.174 -1.137 -6.384 1.00 15.00 C ATOM 2006 C PHE P 63 -12.546 -1.770 -6.571 1.00 15.00 C ATOM 2007 O PHE P 63 -13.123 -1.700 -7.656 1.00 15.00 O ATOM 2008 CB PHE P 63 -10.067 -2.140 -6.678 1.00 15.00 C ATOM 2009 CG PHE P 63 -8.711 -1.517 -6.555 1.00 15.00 C ATOM 2010 CD1 PHE P 63 -8.110 -0.913 -7.646 1.00 15.00 C ATOM 2011 CD2 PHE P 63 -8.062 -1.491 -5.333 1.00 15.00 C ATOM 2012 CE1 PHE P 63 -6.879 -0.297 -7.520 1.00 15.00 C ATOM 2013 CE2 PHE P 63 -6.829 -0.884 -5.202 1.00 15.00 C ATOM 2014 CZ PHE P 63 -6.238 -0.285 -6.297 1.00 15.00 C ATOM 0 H PHE P 63 -10.461 -1.236 -4.419 1.00 15.00 H new ATOM 0 HA PHE P 63 -11.111 -0.307 -7.088 1.00 15.00 H new ATOM 0 HB2 PHE P 63 -10.145 -2.981 -5.989 1.00 15.00 H new ATOM 0 HB3 PHE P 63 -10.195 -2.539 -7.684 1.00 15.00 H new ATOM 0 HD1 PHE P 63 -8.608 -0.923 -8.605 1.00 15.00 H new ATOM 0 HD2 PHE P 63 -8.525 -1.951 -4.472 1.00 15.00 H new ATOM 0 HE1 PHE P 63 -6.419 0.174 -8.376 1.00 15.00 H new ATOM 0 HE2 PHE P 63 -6.328 -0.878 -4.245 1.00 15.00 H new ATOM 0 HZ PHE P 63 -5.275 0.193 -6.197 1.00 15.00 H new ATOM 2024 N GLN P 64 -13.079 -2.374 -5.512 1.00 15.00 N ATOM 2025 CA GLN P 64 -14.397 -2.992 -5.585 1.00 15.00 C ATOM 2026 C GLN P 64 -15.411 -1.975 -6.095 1.00 15.00 C ATOM 2027 O GLN P 64 -16.015 -2.159 -7.153 1.00 15.00 O ATOM 2028 CB GLN P 64 -14.823 -3.524 -4.214 1.00 15.00 C ATOM 2029 CG GLN P 64 -13.916 -4.620 -3.677 1.00 15.00 C ATOM 2030 CD GLN P 64 -14.390 -5.170 -2.345 1.00 15.00 C ATOM 2031 OE1 GLN P 64 -14.516 -4.433 -1.366 1.00 15.00 O ATOM 2032 NE2 GLN P 64 -14.652 -6.471 -2.300 1.00 15.00 N ATOM 0 H GLN P 64 -12.623 -2.448 -4.603 1.00 15.00 H new ATOM 0 HA GLN P 64 -14.353 -3.834 -6.276 1.00 15.00 H new ATOM 0 HB2 GLN P 64 -14.841 -2.698 -3.503 1.00 15.00 H new ATOM 0 HB3 GLN P 64 -15.841 -3.908 -4.283 1.00 15.00 H new ATOM 0 HG2 GLN P 64 -13.864 -5.431 -4.403 1.00 15.00 H new ATOM 0 HG3 GLN P 64 -12.905 -4.227 -3.565 1.00 15.00 H new ATOM 0 HE21 GLN P 64 -14.534 -7.044 -3.135 1.00 15.00 H new ATOM 0 HE22 GLN P 64 -14.971 -6.897 -1.430 1.00 15.00 H new ATOM 2041 N GLU P 65 -15.584 -0.895 -5.338 1.00 15.00 N ATOM 2042 CA GLU P 65 -16.515 0.166 -5.713 1.00 15.00 C ATOM 2043 C GLU P 65 -16.247 0.640 -7.137 1.00 15.00 C ATOM 2044 O GLU P 65 -17.172 0.782 -7.935 1.00 15.00 O ATOM 2045 CB GLU P 65 -16.396 1.340 -4.748 1.00 15.00 C ATOM 2046 CG GLU P 65 -17.368 2.471 -5.039 1.00 15.00 C ATOM 2047 CD GLU P 65 -17.232 3.622 -4.062 1.00 15.00 C ATOM 2048 OE1 GLU P 65 -16.134 4.211 -3.988 1.00 15.00 O ATOM 2049 OE2 GLU P 65 -18.224 3.935 -3.370 1.00 15.00 O ATOM 0 H GLU P 65 -15.091 -0.731 -4.460 1.00 15.00 H new ATOM 0 HA GLU P 65 -17.527 -0.237 -5.663 1.00 15.00 H new ATOM 0 HB2 GLU P 65 -16.563 0.982 -3.732 1.00 15.00 H new ATOM 0 HB3 GLU P 65 -15.378 1.729 -4.786 1.00 15.00 H new ATOM 0 HG2 GLU P 65 -17.201 2.837 -6.052 1.00 15.00 H new ATOM 0 HG3 GLU P 65 -18.388 2.087 -5.003 1.00 15.00 H new ATOM 2056 N GLU P 66 -14.971 0.846 -7.462 1.00 15.00 N ATOM 2057 CA GLU P 66 -14.590 1.266 -8.806 1.00 15.00 C ATOM 2058 C GLU P 66 -15.110 0.252 -9.807 1.00 15.00 C ATOM 2059 O GLU P 66 -15.781 0.598 -10.777 1.00 15.00 O ATOM 2060 CB GLU P 66 -13.070 1.385 -8.928 1.00 15.00 C ATOM 2061 CG GLU P 66 -12.484 2.536 -8.126 1.00 15.00 C ATOM 2062 CD GLU P 66 -10.974 2.615 -8.238 1.00 15.00 C ATOM 2063 OE1 GLU P 66 -10.471 2.791 -9.368 1.00 15.00 O ATOM 2064 OE2 GLU P 66 -10.295 2.501 -7.196 1.00 15.00 O ATOM 0 H GLU P 66 -14.190 0.729 -6.816 1.00 15.00 H new ATOM 0 HA GLU P 66 -15.024 2.245 -9.008 1.00 15.00 H new ATOM 0 HB2 GLU P 66 -12.613 0.452 -8.597 1.00 15.00 H new ATOM 0 HB3 GLU P 66 -12.807 1.514 -9.978 1.00 15.00 H new ATOM 0 HG2 GLU P 66 -12.920 3.474 -8.471 1.00 15.00 H new ATOM 0 HG3 GLU P 66 -12.762 2.422 -7.078 1.00 15.00 H new ATOM 2071 N ALA P 67 -14.794 -1.010 -9.545 1.00 15.00 N ATOM 2072 CA ALA P 67 -15.222 -2.106 -10.397 1.00 15.00 C ATOM 2073 C ALA P 67 -16.682 -1.930 -10.801 1.00 15.00 C ATOM 2074 O ALA P 67 -17.048 -2.156 -11.956 1.00 15.00 O ATOM 2075 CB ALA P 67 -15.017 -3.426 -9.674 1.00 15.00 C ATOM 0 H ALA P 67 -14.237 -1.299 -8.741 1.00 15.00 H new ATOM 0 HA ALA P 67 -14.621 -2.107 -11.306 1.00 15.00 H new ATOM 0 HB1 ALA P 67 -15.339 -4.246 -10.316 1.00 15.00 H new ATOM 0 HB2 ALA P 67 -13.961 -3.548 -9.432 1.00 15.00 H new ATOM 0 HB3 ALA P 67 -15.603 -3.432 -8.755 1.00 15.00 H new ATOM 2081 N ASN P 68 -17.513 -1.510 -9.848 1.00 15.00 N ATOM 2082 CA ASN P 68 -18.929 -1.292 -10.119 1.00 15.00 C ATOM 2083 C ASN P 68 -19.129 -0.005 -10.916 1.00 15.00 C ATOM 2084 O ASN P 68 -20.029 0.088 -11.750 1.00 15.00 O ATOM 2085 CB ASN P 68 -19.719 -1.225 -8.810 1.00 15.00 C ATOM 2086 CG ASN P 68 -19.614 -2.505 -8.006 1.00 15.00 C ATOM 2087 OD1 ASN P 68 -20.005 -3.577 -8.469 1.00 15.00 O ATOM 2088 ND2 ASN P 68 -19.084 -2.400 -6.793 1.00 15.00 N ATOM 0 H ASN P 68 -17.230 -1.315 -8.887 1.00 15.00 H new ATOM 0 HA ASN P 68 -19.298 -2.131 -10.710 1.00 15.00 H new ATOM 0 HB2 ASN P 68 -19.353 -0.391 -8.210 1.00 15.00 H new ATOM 0 HB3 ASN P 68 -20.767 -1.023 -9.031 1.00 15.00 H new ATOM 0 HD21 ASN P 68 -18.988 -3.228 -6.205 1.00 15.00 H new ATOM 0 HD22 ASN P 68 -18.773 -1.491 -6.449 1.00 15.00 H new ATOM 2095 N ILE P 69 -18.278 0.983 -10.654 1.00 15.00 N ATOM 2096 CA ILE P 69 -18.352 2.264 -11.347 1.00 15.00 C ATOM 2097 C ILE P 69 -18.057 2.101 -12.837 1.00 15.00 C ATOM 2098 O ILE P 69 -18.859 2.496 -13.680 1.00 15.00 O ATOM 2099 CB ILE P 69 -17.365 3.289 -10.743 1.00 15.00 C ATOM 2100 CG1 ILE P 69 -17.717 3.566 -9.281 1.00 15.00 C ATOM 2101 CG2 ILE P 69 -17.375 4.585 -11.543 1.00 15.00 C ATOM 2102 CD1 ILE P 69 -16.742 4.496 -8.590 1.00 15.00 C ATOM 0 H ILE P 69 -17.528 0.920 -9.965 1.00 15.00 H new ATOM 0 HA ILE P 69 -19.369 2.635 -11.221 1.00 15.00 H new ATOM 0 HB ILE P 69 -16.362 2.866 -10.789 1.00 15.00 H new ATOM 0 HG12 ILE P 69 -18.716 3.999 -9.232 1.00 15.00 H new ATOM 0 HG13 ILE P 69 -17.752 2.621 -8.739 1.00 15.00 H new ATOM 0 HG21 ILE P 69 -16.673 5.292 -11.100 1.00 15.00 H new ATOM 0 HG22 ILE P 69 -17.082 4.379 -12.572 1.00 15.00 H new ATOM 0 HG23 ILE P 69 -18.377 5.013 -11.530 1.00 15.00 H new ATOM 0 HD11 ILE P 69 -17.054 4.648 -7.557 1.00 15.00 H new ATOM 0 HD12 ILE P 69 -15.745 4.056 -8.607 1.00 15.00 H new ATOM 0 HD13 ILE P 69 -16.724 5.455 -9.108 1.00 15.00 H new ATOM 2114 N TYR P 70 -16.904 1.514 -13.151 1.00 15.00 N ATOM 2115 CA TYR P 70 -16.508 1.299 -14.541 1.00 15.00 C ATOM 2116 C TYR P 70 -17.437 0.299 -15.230 1.00 15.00 C ATOM 2117 O TYR P 70 -17.474 0.211 -16.458 1.00 15.00 O ATOM 2118 CB TYR P 70 -15.059 0.810 -14.619 1.00 15.00 C ATOM 2119 CG TYR P 70 -14.039 1.837 -14.168 1.00 15.00 C ATOM 2120 CD1 TYR P 70 -13.903 2.183 -12.827 1.00 15.00 C ATOM 2121 CD2 TYR P 70 -13.213 2.466 -15.092 1.00 15.00 C ATOM 2122 CE1 TYR P 70 -12.975 3.124 -12.423 1.00 15.00 C ATOM 2123 CE2 TYR P 70 -12.281 3.406 -14.695 1.00 15.00 C ATOM 2124 CZ TYR P 70 -12.167 3.732 -13.360 1.00 15.00 C ATOM 2125 OH TYR P 70 -11.241 4.668 -12.962 1.00 15.00 O ATOM 0 H TYR P 70 -16.229 1.179 -12.463 1.00 15.00 H new ATOM 0 HA TYR P 70 -16.586 2.254 -15.061 1.00 15.00 H new ATOM 0 HB2 TYR P 70 -14.954 -0.085 -14.006 1.00 15.00 H new ATOM 0 HB3 TYR P 70 -14.838 0.520 -15.646 1.00 15.00 H new ATOM 0 HD1 TYR P 70 -14.533 1.708 -12.090 1.00 15.00 H new ATOM 0 HD2 TYR P 70 -13.301 2.216 -16.139 1.00 15.00 H new ATOM 0 HE1 TYR P 70 -12.883 3.382 -11.378 1.00 15.00 H new ATOM 0 HE2 TYR P 70 -11.645 3.883 -15.426 1.00 15.00 H new ATOM 0 HH TYR P 70 -10.753 4.999 -13.745 1.00 15.00 H new