USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=27 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 47 ASN :FLIP amide:sc= -0.0565 F(o=-2.1,f=-0.6) USER MOD Set 1.2: P 51 ASN :FLIP amide:sc= -0.539 F(o=-1.6,f=-0.6) USER MOD Set 2.1: P 7 ASN :FLIP amide:sc= -3.47 F(o=-5.5!,f=-3.8) USER MOD Set 2.2: P 44 GLN :FLIP amide:sc= -0.379 F(o=-5.7,f=-3.8) USER MOD Set 3.1: P 19 TYR OH : rot 120:sc= 0 USER MOD Set 3.2: P 23 HIS :FLIP no HE2:sc= 0.262 F(o=-0.99,f=0.26) USER MOD Single : P 9 ASN : amide:sc= -0.953 X(o=-0.95,f=-0.95) USER MOD Single : P 10 LYS NZ :NH3+ -99:sc= -2.66! (180deg=-5.65!) USER MOD Single : P 11 GLN : amide:sc= 0.986 K(o=0.99,f=-0.31) USER MOD Single : P 13 THR OG1 : rot 180:sc= -0.214 USER MOD Single : P 17 ASN : amide:sc= -8.77! C(o=-8.8!,f=-19!) USER MOD Single : P 21 TYR OH : rot 180:sc= 0 USER MOD Single : P 22 SER OG : rot -44:sc= 0.86 USER MOD Single : P 23BSER OG : rot 180:sc= 0 USER MOD Single : P 23CASN : amide:sc= -4.06! C(o=-4.1!,f=-3.8!) USER MOD Single : P 25 TYR OH : rot 180:sc= 0 USER MOD Single : P 27 SER OG : rot 180:sc= -0.314 USER MOD Single : P 31 LYS NZ :NH3+ -117:sc= -2.85! (180deg=-8.31!) USER MOD Single : P 36 LYS NZ :NH3+ 161:sc= -0.0727 (180deg=-0.464) USER MOD Single : P 37 LYS NZ :NH3+ 172:sc=-0.00825 (180deg=-0.0873) USER MOD Single : P 38 SER OG : rot 82:sc= -0.849 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 52 LYS NZ :NH3+ -122:sc= 1.13 (180deg=-0.255) USER MOD Single : P 56 TYR OH : rot 180:sc= -0.0698 USER MOD Single : P 57 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0416) USER MOD Single : P 58 LYS NZ :NH3+ -161:sc= -0.413 (180deg=-1.27) USER MOD Single : P 59 ASN : amide:sc= -9.7! C(o=-9.7!,f=-10!) USER MOD Single : P 62 LYS NZ :NH3+ 162:sc= -0.0802 (180deg=-0.441) USER MOD Single : P 64 GLN :FLIP amide:sc= -0.78 F(o=-4.2!,f=-0.78) USER MOD Single : P 68 ASN : amide:sc= -0.456 X(o=-0.46,f=0) USER MOD Single : P 70 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1011 N ARG P 6 4.007 8.020 -17.889 1.00 15.00 N ATOM 1012 CA ARG P 6 4.089 8.491 -19.278 1.00 15.00 C ATOM 1013 C ARG P 6 3.723 7.399 -20.280 1.00 15.00 C ATOM 1014 O ARG P 6 3.187 7.680 -21.351 1.00 15.00 O ATOM 1015 CB ARG P 6 5.497 9.011 -19.572 1.00 15.00 C ATOM 1016 CG ARG P 6 6.581 7.959 -19.416 1.00 15.00 C ATOM 1017 CD ARG P 6 7.955 8.530 -19.731 1.00 15.00 C ATOM 1018 NE ARG P 6 8.036 9.032 -21.100 1.00 15.00 N ATOM 1019 CZ ARG P 6 9.123 9.594 -21.622 1.00 15.00 C ATOM 1020 NH1 ARG P 6 10.228 9.720 -20.895 1.00 15.00 N ATOM 1021 NH2 ARG P 6 9.109 10.028 -22.875 1.00 15.00 N ATOM 0 HA ARG P 6 3.365 9.298 -19.390 1.00 15.00 H new ATOM 0 HB2 ARG P 6 5.526 9.401 -20.589 1.00 15.00 H new ATOM 0 HB3 ARG P 6 5.714 9.845 -18.904 1.00 15.00 H new ATOM 0 HG2 ARG P 6 6.571 7.572 -18.397 1.00 15.00 H new ATOM 0 HG3 ARG P 6 6.373 7.119 -20.079 1.00 15.00 H new ATOM 0 HD2 ARG P 6 8.181 9.337 -19.034 1.00 15.00 H new ATOM 0 HD3 ARG P 6 8.711 7.759 -19.582 1.00 15.00 H new ATOM 0 HE ARG P 6 7.209 8.947 -21.692 1.00 15.00 H new ATOM 0 HH11 ARG P 6 10.246 9.385 -19.932 1.00 15.00 H new ATOM 0 HH12 ARG P 6 11.059 10.152 -21.300 1.00 15.00 H new ATOM 0 HH21 ARG P 6 8.265 9.931 -23.439 1.00 15.00 H new ATOM 0 HH22 ARG P 6 9.943 10.459 -23.275 1.00 15.00 H new ATOM 1035 N ASN P 7 4.013 6.156 -19.921 1.00 15.00 N ATOM 1036 CA ASN P 7 3.715 5.021 -20.776 1.00 15.00 C ATOM 1037 C ASN P 7 2.223 5.001 -21.138 1.00 15.00 C ATOM 1038 O ASN P 7 1.821 5.659 -22.097 1.00 15.00 O ATOM 1039 CB ASN P 7 4.159 3.738 -20.075 1.00 15.00 C ATOM 1040 CG ASN P 7 4.182 2.543 -20.996 1.00 15.00 C ATOM 1041 OD1 ASN P 7 3.772 1.401 -20.473 1.00 15.00 O flip ATOM 1042 ND2 ASN P 7 4.600 2.637 -22.151 1.00 15.00 N flip ATOM 0 H ASN P 7 4.457 5.910 -19.037 1.00 15.00 H new ATOM 0 HA ASN P 7 4.265 5.103 -21.714 1.00 15.00 H new ATOM 0 HB2 ASN P 7 5.154 3.885 -19.655 1.00 15.00 H new ATOM 0 HB3 ASN P 7 3.487 3.535 -19.241 1.00 15.00 H new ATOM 0 HD21 ASN P 7 4.906 3.541 -22.511 1.00 15.00 H new ATOM 0 HD22 ASN P 7 4.640 1.811 -22.748 1.00 15.00 H new ATOM 1049 N PHE P 8 1.392 4.269 -20.391 1.00 15.00 N ATOM 1050 CA PHE P 8 -0.043 4.206 -20.668 1.00 15.00 C ATOM 1051 C PHE P 8 -0.718 5.534 -20.365 1.00 15.00 C ATOM 1052 O PHE P 8 -0.873 5.910 -19.203 1.00 15.00 O ATOM 1053 CB PHE P 8 -0.713 3.139 -19.799 1.00 15.00 C ATOM 1054 CG PHE P 8 -0.274 1.733 -20.065 1.00 15.00 C ATOM 1055 CD1 PHE P 8 1.035 1.342 -19.860 1.00 15.00 C ATOM 1056 CD2 PHE P 8 -1.187 0.795 -20.501 1.00 15.00 C ATOM 1057 CE1 PHE P 8 1.425 0.038 -20.089 1.00 15.00 C ATOM 1058 CE2 PHE P 8 -0.803 -0.508 -20.732 1.00 15.00 C ATOM 1059 CZ PHE P 8 0.505 -0.885 -20.526 1.00 15.00 C ATOM 0 H PHE P 8 1.690 3.712 -19.590 1.00 15.00 H new ATOM 0 HA PHE P 8 -0.153 3.963 -21.725 1.00 15.00 H new ATOM 0 HB2 PHE P 8 -0.519 3.371 -18.752 1.00 15.00 H new ATOM 0 HB3 PHE P 8 -1.792 3.200 -19.944 1.00 15.00 H new ATOM 0 HD1 PHE P 8 1.761 2.064 -19.517 1.00 15.00 H new ATOM 0 HD2 PHE P 8 -2.215 1.085 -20.663 1.00 15.00 H new ATOM 0 HE1 PHE P 8 2.451 -0.257 -19.925 1.00 15.00 H new ATOM 0 HE2 PHE P 8 -1.527 -1.233 -21.074 1.00 15.00 H new ATOM 0 HZ PHE P 8 0.808 -1.906 -20.708 1.00 15.00 H new ATOM 1069 N ASN P 9 -1.120 6.238 -21.403 1.00 15.00 N ATOM 1070 CA ASN P 9 -1.783 7.518 -21.238 1.00 15.00 C ATOM 1071 C ASN P 9 -3.163 7.331 -20.599 1.00 15.00 C ATOM 1072 O ASN P 9 -3.605 6.201 -20.390 1.00 15.00 O ATOM 1073 CB ASN P 9 -1.889 8.190 -22.599 1.00 15.00 C ATOM 1074 CG ASN P 9 -2.263 9.656 -22.507 1.00 15.00 C ATOM 1075 OD1 ASN P 9 -1.547 10.456 -21.904 1.00 15.00 O ATOM 1076 ND2 ASN P 9 -3.394 10.017 -23.104 1.00 15.00 N ATOM 0 H ASN P 9 -0.999 5.946 -22.373 1.00 15.00 H new ATOM 0 HA ASN P 9 -1.203 8.154 -20.570 1.00 15.00 H new ATOM 0 HB2 ASN P 9 -0.936 8.096 -23.120 1.00 15.00 H new ATOM 0 HB3 ASN P 9 -2.634 7.667 -23.199 1.00 15.00 H new ATOM 0 HD21 ASN P 9 -3.699 10.990 -23.073 1.00 15.00 H new ATOM 0 HD22 ASN P 9 -3.957 9.321 -23.593 1.00 15.00 H new ATOM 1083 N LYS P 10 -3.835 8.436 -20.281 1.00 15.00 N ATOM 1084 CA LYS P 10 -5.158 8.375 -19.656 1.00 15.00 C ATOM 1085 C LYS P 10 -6.157 7.602 -20.518 1.00 15.00 C ATOM 1086 O LYS P 10 -7.199 7.165 -20.029 1.00 15.00 O ATOM 1087 CB LYS P 10 -5.688 9.786 -19.383 1.00 15.00 C ATOM 1088 CG LYS P 10 -4.814 10.589 -18.434 1.00 15.00 C ATOM 1089 CD LYS P 10 -5.487 11.884 -17.994 1.00 15.00 C ATOM 1090 CE LYS P 10 -5.823 12.788 -19.172 1.00 15.00 C ATOM 1091 NZ LYS P 10 -6.961 12.265 -19.981 1.00 15.00 N ATOM 0 H LYS P 10 -3.488 9.381 -20.444 1.00 15.00 H new ATOM 0 HA LYS P 10 -5.046 7.843 -18.711 1.00 15.00 H new ATOM 0 HB2 LYS P 10 -5.773 10.323 -20.328 1.00 15.00 H new ATOM 0 HB3 LYS P 10 -6.692 9.714 -18.966 1.00 15.00 H new ATOM 0 HG2 LYS P 10 -4.582 9.985 -17.557 1.00 15.00 H new ATOM 0 HG3 LYS P 10 -3.867 10.820 -18.922 1.00 15.00 H new ATOM 0 HD2 LYS P 10 -6.400 11.649 -17.447 1.00 15.00 H new ATOM 0 HD3 LYS P 10 -4.831 12.416 -17.305 1.00 15.00 H new ATOM 0 HE2 LYS P 10 -6.069 13.784 -18.804 1.00 15.00 H new ATOM 0 HE3 LYS P 10 -4.945 12.892 -19.809 1.00 15.00 H new ATOM 0 HZ1 LYS P 10 -6.593 11.771 -20.819 1.00 15.00 H new ATOM 0 HZ2 LYS P 10 -7.520 11.603 -19.406 1.00 15.00 H new ATOM 0 HZ3 LYS P 10 -7.565 13.056 -20.283 1.00 15.00 H new ATOM 1105 N GLN P 11 -5.835 7.429 -21.795 1.00 15.00 N ATOM 1106 CA GLN P 11 -6.711 6.700 -22.707 1.00 15.00 C ATOM 1107 C GLN P 11 -6.641 5.203 -22.425 1.00 15.00 C ATOM 1108 O GLN P 11 -7.663 4.527 -22.323 1.00 15.00 O ATOM 1109 CB GLN P 11 -6.319 6.968 -24.160 1.00 15.00 C ATOM 1110 CG GLN P 11 -7.296 6.392 -25.171 1.00 15.00 C ATOM 1111 CD GLN P 11 -6.914 6.717 -26.602 1.00 15.00 C ATOM 1112 OE1 GLN P 11 -6.819 7.885 -26.980 1.00 15.00 O ATOM 1113 NE2 GLN P 11 -6.693 5.685 -27.409 1.00 15.00 N ATOM 0 H GLN P 11 -4.978 7.781 -22.222 1.00 15.00 H new ATOM 0 HA GLN P 11 -7.732 7.047 -22.548 1.00 15.00 H new ATOM 0 HB2 GLN P 11 -6.242 8.044 -24.314 1.00 15.00 H new ATOM 0 HB3 GLN P 11 -5.330 6.549 -24.344 1.00 15.00 H new ATOM 0 HG2 GLN P 11 -7.344 5.310 -25.049 1.00 15.00 H new ATOM 0 HG3 GLN P 11 -8.294 6.780 -24.968 1.00 15.00 H new ATOM 0 HE21 GLN P 11 -6.783 4.733 -27.055 1.00 15.00 H new ATOM 0 HE22 GLN P 11 -6.434 5.845 -28.382 1.00 15.00 H new ATOM 1122 N ALA P 12 -5.424 4.692 -22.312 1.00 15.00 N ATOM 1123 CA ALA P 12 -5.207 3.276 -22.052 1.00 15.00 C ATOM 1124 C ALA P 12 -5.742 2.863 -20.687 1.00 15.00 C ATOM 1125 O ALA P 12 -6.362 1.811 -20.542 1.00 15.00 O ATOM 1126 CB ALA P 12 -3.724 2.953 -22.144 1.00 15.00 C ATOM 0 H ALA P 12 -4.568 5.240 -22.397 1.00 15.00 H new ATOM 0 HA ALA P 12 -5.754 2.713 -22.808 1.00 15.00 H new ATOM 0 HB1 ALA P 12 -3.570 1.892 -21.948 1.00 15.00 H new ATOM 0 HB2 ALA P 12 -3.360 3.194 -23.143 1.00 15.00 H new ATOM 0 HB3 ALA P 12 -3.177 3.541 -21.407 1.00 15.00 H new ATOM 1132 N THR P 13 -5.488 3.693 -19.689 1.00 15.00 N ATOM 1133 CA THR P 13 -5.928 3.406 -18.331 1.00 15.00 C ATOM 1134 C THR P 13 -7.437 3.168 -18.263 1.00 15.00 C ATOM 1135 O THR P 13 -7.881 2.120 -17.800 1.00 15.00 O ATOM 1136 CB THR P 13 -5.532 4.538 -17.390 1.00 15.00 C ATOM 1137 OG1 THR P 13 -6.216 5.734 -17.721 1.00 15.00 O ATOM 1138 CG2 THR P 13 -4.049 4.838 -17.406 1.00 15.00 C ATOM 0 H THR P 13 -4.980 4.571 -19.792 1.00 15.00 H new ATOM 0 HA THR P 13 -5.431 2.489 -18.014 1.00 15.00 H new ATOM 0 HB THR P 13 -5.807 4.191 -16.394 1.00 15.00 H new ATOM 0 HG1 THR P 13 -5.948 6.446 -17.103 1.00 15.00 H new ATOM 0 HG21 THR P 13 -3.835 5.653 -16.715 1.00 15.00 H new ATOM 0 HG22 THR P 13 -3.495 3.950 -17.102 1.00 15.00 H new ATOM 0 HG23 THR P 13 -3.747 5.127 -18.413 1.00 15.00 H new ATOM 1146 N GLU P 14 -8.220 4.139 -18.731 1.00 15.00 N ATOM 1147 CA GLU P 14 -9.678 4.021 -18.715 1.00 15.00 C ATOM 1148 C GLU P 14 -10.131 2.740 -19.408 1.00 15.00 C ATOM 1149 O GLU P 14 -11.085 2.091 -18.986 1.00 15.00 O ATOM 1150 CB GLU P 14 -10.322 5.232 -19.399 1.00 15.00 C ATOM 1151 CG GLU P 14 -10.111 5.277 -20.902 1.00 15.00 C ATOM 1152 CD GLU P 14 -10.840 6.434 -21.557 1.00 15.00 C ATOM 1153 OE1 GLU P 14 -12.082 6.492 -21.446 1.00 15.00 O ATOM 1154 OE2 GLU P 14 -10.167 7.283 -22.179 1.00 15.00 O ATOM 0 H GLU P 14 -7.871 5.013 -19.125 1.00 15.00 H new ATOM 0 HA GLU P 14 -9.997 3.986 -17.673 1.00 15.00 H new ATOM 0 HB2 GLU P 14 -11.392 5.226 -19.193 1.00 15.00 H new ATOM 0 HB3 GLU P 14 -9.917 6.143 -18.958 1.00 15.00 H new ATOM 0 HG2 GLU P 14 -9.045 5.357 -21.114 1.00 15.00 H new ATOM 0 HG3 GLU P 14 -10.454 4.340 -21.342 1.00 15.00 H new ATOM 1161 N ILE P 15 -9.446 2.406 -20.488 1.00 15.00 N ATOM 1162 CA ILE P 15 -9.762 1.227 -21.282 1.00 15.00 C ATOM 1163 C ILE P 15 -9.359 -0.074 -20.596 1.00 15.00 C ATOM 1164 O ILE P 15 -10.172 -0.987 -20.450 1.00 15.00 O ATOM 1165 CB ILE P 15 -9.052 1.328 -22.648 1.00 15.00 C ATOM 1166 CG1 ILE P 15 -9.712 2.419 -23.490 1.00 15.00 C ATOM 1167 CG2 ILE P 15 -9.055 -0.007 -23.381 1.00 15.00 C ATOM 1168 CD1 ILE P 15 -8.825 2.951 -24.587 1.00 15.00 C ATOM 0 H ILE P 15 -8.654 2.944 -20.841 1.00 15.00 H new ATOM 0 HA ILE P 15 -10.844 1.202 -21.408 1.00 15.00 H new ATOM 0 HB ILE P 15 -8.009 1.594 -22.477 1.00 15.00 H new ATOM 0 HG12 ILE P 15 -10.626 2.022 -23.933 1.00 15.00 H new ATOM 0 HG13 ILE P 15 -10.005 3.243 -22.839 1.00 15.00 H new ATOM 0 HG21 ILE P 15 -8.546 0.103 -24.339 1.00 15.00 H new ATOM 0 HG22 ILE P 15 -8.538 -0.754 -22.779 1.00 15.00 H new ATOM 0 HG23 ILE P 15 -10.083 -0.327 -23.551 1.00 15.00 H new ATOM 0 HD11 ILE P 15 -9.358 3.722 -25.144 1.00 15.00 H new ATOM 0 HD12 ILE P 15 -7.922 3.378 -24.150 1.00 15.00 H new ATOM 0 HD13 ILE P 15 -8.553 2.139 -25.261 1.00 15.00 H new ATOM 1180 N LEU P 16 -8.095 -0.171 -20.212 1.00 15.00 N ATOM 1181 CA LEU P 16 -7.584 -1.381 -19.586 1.00 15.00 C ATOM 1182 C LEU P 16 -8.277 -1.699 -18.257 1.00 15.00 C ATOM 1183 O LEU P 16 -8.619 -2.855 -18.006 1.00 15.00 O ATOM 1184 CB LEU P 16 -6.071 -1.280 -19.398 1.00 15.00 C ATOM 1185 CG LEU P 16 -5.275 -1.004 -20.679 1.00 15.00 C ATOM 1186 CD1 LEU P 16 -3.805 -0.822 -20.365 1.00 15.00 C ATOM 1187 CD2 LEU P 16 -5.446 -2.132 -21.685 1.00 15.00 C ATOM 0 H LEU P 16 -7.405 0.572 -20.323 1.00 15.00 H new ATOM 0 HA LEU P 16 -7.808 -2.209 -20.258 1.00 15.00 H new ATOM 0 HB2 LEU P 16 -5.862 -0.487 -18.680 1.00 15.00 H new ATOM 0 HB3 LEU P 16 -5.712 -2.211 -18.959 1.00 15.00 H new ATOM 0 HG LEU P 16 -5.664 -0.085 -21.117 1.00 15.00 H new ATOM 0 HD11 LEU P 16 -3.257 -0.627 -21.287 1.00 15.00 H new ATOM 0 HD12 LEU P 16 -3.680 0.020 -19.684 1.00 15.00 H new ATOM 0 HD13 LEU P 16 -3.418 -1.727 -19.898 1.00 15.00 H new ATOM 0 HD21 LEU P 16 -4.870 -1.909 -22.583 1.00 15.00 H new ATOM 0 HD22 LEU P 16 -5.091 -3.066 -21.249 1.00 15.00 H new ATOM 0 HD23 LEU P 16 -6.500 -2.231 -21.945 1.00 15.00 H new ATOM 1199 N ASN P 17 -8.487 -0.696 -17.398 1.00 15.00 N ATOM 1200 CA ASN P 17 -9.142 -0.950 -16.114 1.00 15.00 C ATOM 1201 C ASN P 17 -10.547 -1.512 -16.316 1.00 15.00 C ATOM 1202 O ASN P 17 -10.886 -2.561 -15.767 1.00 15.00 O ATOM 1203 CB ASN P 17 -9.176 0.300 -15.219 1.00 15.00 C ATOM 1204 CG ASN P 17 -9.749 1.532 -15.890 1.00 15.00 C ATOM 1205 OD1 ASN P 17 -10.800 1.486 -16.527 1.00 15.00 O ATOM 1206 ND2 ASN P 17 -9.067 2.659 -15.715 1.00 15.00 N ATOM 0 H ASN P 17 -8.220 0.275 -17.563 1.00 15.00 H new ATOM 0 HA ASN P 17 -8.543 -1.699 -15.596 1.00 15.00 H new ATOM 0 HB2 ASN P 17 -9.764 0.079 -14.328 1.00 15.00 H new ATOM 0 HB3 ASN P 17 -8.162 0.521 -14.885 1.00 15.00 H new ATOM 0 HD21 ASN P 17 -9.411 3.531 -16.116 1.00 15.00 H new ATOM 0 HD22 ASN P 17 -8.199 2.652 -15.179 1.00 15.00 H new ATOM 1213 N GLU P 18 -11.361 -0.820 -17.109 1.00 15.00 N ATOM 1214 CA GLU P 18 -12.727 -1.265 -17.384 1.00 15.00 C ATOM 1215 C GLU P 18 -12.762 -2.755 -17.719 1.00 15.00 C ATOM 1216 O GLU P 18 -13.598 -3.496 -17.203 1.00 15.00 O ATOM 1217 CB GLU P 18 -13.338 -0.451 -18.525 1.00 15.00 C ATOM 1218 CG GLU P 18 -13.638 0.991 -18.146 1.00 15.00 C ATOM 1219 CD GLU P 18 -14.157 1.810 -19.313 1.00 15.00 C ATOM 1220 OE1 GLU P 18 -14.279 1.251 -20.424 1.00 15.00 O ATOM 1221 OE2 GLU P 18 -14.440 3.010 -19.117 1.00 15.00 O ATOM 0 H GLU P 18 -11.100 0.050 -17.573 1.00 15.00 H new ATOM 0 HA GLU P 18 -13.319 -1.104 -16.483 1.00 15.00 H new ATOM 0 HB2 GLU P 18 -12.655 -0.461 -19.375 1.00 15.00 H new ATOM 0 HB3 GLU P 18 -14.260 -0.932 -18.851 1.00 15.00 H new ATOM 0 HG2 GLU P 18 -14.374 1.005 -17.342 1.00 15.00 H new ATOM 0 HG3 GLU P 18 -12.732 1.455 -17.756 1.00 15.00 H new ATOM 1228 N TYR P 19 -11.839 -3.190 -18.571 1.00 15.00 N ATOM 1229 CA TYR P 19 -11.757 -4.595 -18.953 1.00 15.00 C ATOM 1230 C TYR P 19 -11.239 -5.424 -17.785 1.00 15.00 C ATOM 1231 O TYR P 19 -11.727 -6.519 -17.515 1.00 15.00 O ATOM 1232 CB TYR P 19 -10.825 -4.770 -20.152 1.00 15.00 C ATOM 1233 CG TYR P 19 -10.650 -6.209 -20.591 1.00 15.00 C ATOM 1234 CD1 TYR P 19 -11.561 -7.194 -20.224 1.00 15.00 C ATOM 1235 CD2 TYR P 19 -9.573 -6.579 -21.384 1.00 15.00 C ATOM 1236 CE1 TYR P 19 -11.400 -8.505 -20.633 1.00 15.00 C ATOM 1237 CE2 TYR P 19 -9.405 -7.886 -21.798 1.00 15.00 C ATOM 1238 CZ TYR P 19 -10.320 -8.845 -21.420 1.00 15.00 C ATOM 1239 OH TYR P 19 -10.156 -10.148 -21.831 1.00 15.00 O ATOM 0 H TYR P 19 -11.139 -2.591 -19.009 1.00 15.00 H new ATOM 0 HA TYR P 19 -12.756 -4.936 -19.226 1.00 15.00 H new ATOM 0 HB2 TYR P 19 -11.214 -4.190 -20.989 1.00 15.00 H new ATOM 0 HB3 TYR P 19 -9.848 -4.355 -19.903 1.00 15.00 H new ATOM 0 HD1 TYR P 19 -12.409 -6.930 -19.609 1.00 15.00 H new ATOM 0 HD2 TYR P 19 -8.853 -5.831 -21.683 1.00 15.00 H new ATOM 0 HE1 TYR P 19 -12.116 -9.258 -20.338 1.00 15.00 H new ATOM 0 HE2 TYR P 19 -8.561 -8.155 -22.415 1.00 15.00 H new ATOM 0 HH TYR P 19 -10.163 -10.185 -22.810 1.00 15.00 H new ATOM 1249 N PHE P 20 -10.249 -4.879 -17.091 1.00 15.00 N ATOM 1250 CA PHE P 20 -9.648 -5.537 -15.939 1.00 15.00 C ATOM 1251 C PHE P 20 -10.717 -5.955 -14.927 1.00 15.00 C ATOM 1252 O PHE P 20 -10.735 -7.098 -14.473 1.00 15.00 O ATOM 1253 CB PHE P 20 -8.600 -4.588 -15.334 1.00 15.00 C ATOM 1254 CG PHE P 20 -8.290 -4.775 -13.874 1.00 15.00 C ATOM 1255 CD1 PHE P 20 -9.172 -4.330 -12.901 1.00 15.00 C ATOM 1256 CD2 PHE P 20 -7.102 -5.366 -13.477 1.00 15.00 C ATOM 1257 CE1 PHE P 20 -8.873 -4.471 -11.562 1.00 15.00 C ATOM 1258 CE2 PHE P 20 -6.800 -5.516 -12.137 1.00 15.00 C ATOM 1259 CZ PHE P 20 -7.686 -5.065 -11.178 1.00 15.00 C ATOM 0 H PHE P 20 -9.841 -3.970 -17.310 1.00 15.00 H new ATOM 0 HA PHE P 20 -9.151 -6.458 -16.244 1.00 15.00 H new ATOM 0 HB2 PHE P 20 -7.673 -4.700 -15.897 1.00 15.00 H new ATOM 0 HB3 PHE P 20 -8.941 -3.563 -15.482 1.00 15.00 H new ATOM 0 HD1 PHE P 20 -10.103 -3.868 -13.195 1.00 15.00 H new ATOM 0 HD2 PHE P 20 -6.403 -5.714 -14.224 1.00 15.00 H new ATOM 0 HE1 PHE P 20 -9.567 -4.117 -10.814 1.00 15.00 H new ATOM 0 HE2 PHE P 20 -5.873 -5.985 -11.840 1.00 15.00 H new ATOM 0 HZ PHE P 20 -7.451 -5.176 -10.130 1.00 15.00 H new ATOM 1269 N TYR P 21 -11.604 -5.029 -14.574 1.00 15.00 N ATOM 1270 CA TYR P 21 -12.675 -5.301 -13.611 1.00 15.00 C ATOM 1271 C TYR P 21 -13.632 -6.413 -14.071 1.00 15.00 C ATOM 1272 O TYR P 21 -14.707 -6.575 -13.494 1.00 15.00 O ATOM 1273 CB TYR P 21 -13.482 -4.026 -13.368 1.00 15.00 C ATOM 1274 CG TYR P 21 -12.665 -2.877 -12.824 1.00 15.00 C ATOM 1275 CD1 TYR P 21 -12.104 -2.939 -11.556 1.00 15.00 C ATOM 1276 CD2 TYR P 21 -12.459 -1.729 -13.580 1.00 15.00 C ATOM 1277 CE1 TYR P 21 -11.359 -1.891 -11.055 1.00 15.00 C ATOM 1278 CE2 TYR P 21 -11.715 -0.676 -13.086 1.00 15.00 C ATOM 1279 CZ TYR P 21 -11.168 -0.761 -11.822 1.00 15.00 C ATOM 1280 OH TYR P 21 -10.426 0.287 -11.326 1.00 15.00 O ATOM 0 H TYR P 21 -11.605 -4.077 -14.941 1.00 15.00 H new ATOM 0 HA TYR P 21 -12.193 -5.642 -12.695 1.00 15.00 H new ATOM 0 HB2 TYR P 21 -13.946 -3.717 -14.305 1.00 15.00 H new ATOM 0 HB3 TYR P 21 -14.290 -4.247 -12.670 1.00 15.00 H new ATOM 0 HD1 TYR P 21 -12.253 -3.822 -10.952 1.00 15.00 H new ATOM 0 HD2 TYR P 21 -12.887 -1.660 -14.569 1.00 15.00 H new ATOM 0 HE1 TYR P 21 -10.928 -1.955 -10.067 1.00 15.00 H new ATOM 0 HE2 TYR P 21 -11.562 0.209 -13.686 1.00 15.00 H new ATOM 0 HH TYR P 21 -10.387 1.005 -11.992 1.00 15.00 H new ATOM 1290 N SER P 22 -13.250 -7.182 -15.088 1.00 15.00 N ATOM 1291 CA SER P 22 -14.099 -8.268 -15.575 1.00 15.00 C ATOM 1292 C SER P 22 -13.425 -9.622 -15.366 1.00 15.00 C ATOM 1293 O SER P 22 -14.092 -10.656 -15.332 1.00 15.00 O ATOM 1294 CB SER P 22 -14.429 -8.077 -17.057 1.00 15.00 C ATOM 1295 OG SER P 22 -13.285 -8.278 -17.868 1.00 15.00 O ATOM 0 H SER P 22 -12.367 -7.076 -15.587 1.00 15.00 H new ATOM 0 HA SER P 22 -15.026 -8.246 -15.002 1.00 15.00 H new ATOM 0 HB2 SER P 22 -15.213 -8.775 -17.350 1.00 15.00 H new ATOM 0 HB3 SER P 22 -14.820 -7.072 -17.218 1.00 15.00 H new ATOM 0 HG SER P 22 -12.514 -7.828 -17.464 1.00 15.00 H new ATOM 1301 N HIS P 23 -12.103 -9.606 -15.213 1.00 15.00 N ATOM 1302 CA HIS P 23 -11.334 -10.825 -14.997 1.00 15.00 C ATOM 1303 C HIS P 23 -10.413 -10.673 -13.788 1.00 15.00 C ATOM 1304 O HIS P 23 -9.318 -11.213 -13.767 1.00 15.00 O ATOM 1305 CB HIS P 23 -10.503 -11.153 -16.240 1.00 15.00 C ATOM 1306 CG HIS P 23 -11.307 -11.648 -17.404 1.00 15.00 C ATOM 1307 ND1 HIS P 23 -12.604 -12.027 -17.495 1.00 15.00 N flip ATOM 1308 CD2 HIS P 23 -10.773 -11.819 -18.663 1.00 15.00 C flip ATOM 1309 CE1 HIS P 23 -12.825 -12.412 -18.795 1.00 15.00 C flip ATOM 1310 NE2 HIS P 23 -11.705 -12.277 -19.480 1.00 15.00 N flip ATOM 0 H HIS P 23 -11.541 -8.755 -15.235 1.00 15.00 H new ATOM 0 HA HIS P 23 -12.032 -11.640 -14.806 1.00 15.00 H new ATOM 0 HB2 HIS P 23 -9.957 -10.260 -16.544 1.00 15.00 H new ATOM 0 HB3 HIS P 23 -9.761 -11.907 -15.978 1.00 15.00 H new ATOM 0 HD1 HIS P 23 -13.289 -12.027 -16.739 1.00 15.00 H new ATOM 0 HD2 HIS P 23 -9.750 -11.611 -18.939 1.00 15.00 H new ATOM 0 HE1 HIS P 23 -13.764 -12.768 -19.192 1.00 15.00 H new ATOM 1318 N LEU P 23A -10.878 -9.939 -12.786 1.00 15.00 N ATOM 1319 CA LEU P 23A -10.089 -9.718 -11.563 1.00 15.00 C ATOM 1320 C LEU P 23A -9.343 -10.985 -11.127 1.00 15.00 C ATOM 1321 O LEU P 23A -8.123 -10.974 -10.982 1.00 15.00 O ATOM 1322 CB LEU P 23A -10.953 -9.220 -10.395 1.00 15.00 C ATOM 1323 CG LEU P 23A -10.934 -7.706 -10.134 1.00 15.00 C ATOM 1324 CD1 LEU P 23A -11.170 -7.419 -8.665 1.00 15.00 C ATOM 1325 CD2 LEU P 23A -9.619 -7.082 -10.548 1.00 15.00 C ATOM 0 H LEU P 23A -11.791 -9.485 -12.787 1.00 15.00 H new ATOM 0 HA LEU P 23A -9.363 -8.945 -11.817 1.00 15.00 H new ATOM 0 HB2 LEU P 23A -11.984 -9.523 -10.578 1.00 15.00 H new ATOM 0 HB3 LEU P 23A -10.628 -9.728 -9.487 1.00 15.00 H new ATOM 0 HG LEU P 23A -11.733 -7.269 -10.733 1.00 15.00 H new ATOM 0 HD11 LEU P 23A -11.153 -6.342 -8.497 1.00 15.00 H new ATOM 0 HD12 LEU P 23A -12.140 -7.818 -8.368 1.00 15.00 H new ATOM 0 HD13 LEU P 23A -10.387 -7.891 -8.072 1.00 15.00 H new ATOM 0 HD21 LEU P 23A -9.645 -6.011 -10.347 1.00 15.00 H new ATOM 0 HD22 LEU P 23A -8.806 -7.537 -9.982 1.00 15.00 H new ATOM 0 HD23 LEU P 23A -9.457 -7.248 -11.613 1.00 15.00 H new ATOM 1337 N SER P 23B -10.088 -12.060 -10.888 1.00 15.00 N ATOM 1338 CA SER P 23B -9.501 -13.325 -10.436 1.00 15.00 C ATOM 1339 C SER P 23B -8.571 -13.950 -11.483 1.00 15.00 C ATOM 1340 O SER P 23B -7.834 -14.889 -11.179 1.00 15.00 O ATOM 1341 CB SER P 23B -10.608 -14.316 -10.076 1.00 15.00 C ATOM 1342 OG SER P 23B -11.430 -13.809 -9.040 1.00 15.00 O ATOM 0 H SER P 23B -11.102 -12.084 -10.999 1.00 15.00 H new ATOM 0 HA SER P 23B -8.898 -13.100 -9.556 1.00 15.00 H new ATOM 0 HB2 SER P 23B -11.215 -14.524 -10.957 1.00 15.00 H new ATOM 0 HB3 SER P 23B -10.166 -15.262 -9.763 1.00 15.00 H new ATOM 0 HG SER P 23B -12.131 -14.461 -8.830 1.00 15.00 H new ATOM 1348 N ASN P 23C -8.607 -13.439 -12.710 1.00 15.00 N ATOM 1349 CA ASN P 23C -7.768 -13.966 -13.781 1.00 15.00 C ATOM 1350 C ASN P 23C -7.725 -12.993 -14.960 1.00 15.00 C ATOM 1351 O ASN P 23C -8.144 -13.329 -16.068 1.00 15.00 O ATOM 1352 CB ASN P 23C -8.305 -15.325 -14.239 1.00 15.00 C ATOM 1353 CG ASN P 23C -7.464 -15.947 -15.335 1.00 15.00 C ATOM 1354 OD1 ASN P 23C -6.290 -16.250 -15.135 1.00 15.00 O ATOM 1355 ND2 ASN P 23C -8.064 -16.139 -16.505 1.00 15.00 N ATOM 0 H ASN P 23C -9.207 -12.662 -12.987 1.00 15.00 H new ATOM 0 HA ASN P 23C -6.754 -14.090 -13.401 1.00 15.00 H new ATOM 0 HB2 ASN P 23C -8.342 -16.003 -13.386 1.00 15.00 H new ATOM 0 HB3 ASN P 23C -9.328 -15.205 -14.595 1.00 15.00 H new ATOM 0 HD21 ASN P 23C -7.548 -16.553 -17.281 1.00 15.00 H new ATOM 0 HD22 ASN P 23C -9.041 -15.872 -16.627 1.00 15.00 H new ATOM 1362 N PRO P 24 -7.226 -11.764 -14.731 1.00 15.00 N ATOM 1363 CA PRO P 24 -7.144 -10.734 -15.763 1.00 15.00 C ATOM 1364 C PRO P 24 -6.047 -11.024 -16.767 1.00 15.00 C ATOM 1365 O PRO P 24 -4.935 -10.506 -16.659 1.00 15.00 O ATOM 1366 CB PRO P 24 -6.839 -9.443 -14.988 1.00 15.00 C ATOM 1367 CG PRO P 24 -6.979 -9.796 -13.545 1.00 15.00 C ATOM 1368 CD PRO P 24 -6.714 -11.273 -13.451 1.00 15.00 C ATOM 0 HA PRO P 24 -8.064 -10.674 -16.345 1.00 15.00 H new ATOM 0 HB2 PRO P 24 -5.834 -9.083 -15.207 1.00 15.00 H new ATOM 0 HB3 PRO P 24 -7.530 -8.647 -15.265 1.00 15.00 H new ATOM 0 HG2 PRO P 24 -6.272 -9.233 -12.936 1.00 15.00 H new ATOM 0 HG3 PRO P 24 -7.977 -9.555 -13.180 1.00 15.00 H new ATOM 0 HD2 PRO P 24 -5.653 -11.489 -13.328 1.00 15.00 H new ATOM 0 HD3 PRO P 24 -7.231 -11.726 -12.605 1.00 15.00 H new ATOM 1376 N TYR P 25 -6.373 -11.850 -17.749 1.00 15.00 N ATOM 1377 CA TYR P 25 -5.421 -12.215 -18.783 1.00 15.00 C ATOM 1378 C TYR P 25 -5.993 -11.818 -20.135 1.00 15.00 C ATOM 1379 O TYR P 25 -6.718 -12.590 -20.762 1.00 15.00 O ATOM 1380 CB TYR P 25 -5.145 -13.730 -18.787 1.00 15.00 C ATOM 1381 CG TYR P 25 -4.630 -14.326 -17.482 1.00 15.00 C ATOM 1382 CD1 TYR P 25 -4.501 -13.569 -16.323 1.00 15.00 C ATOM 1383 CD2 TYR P 25 -4.279 -15.670 -17.420 1.00 15.00 C ATOM 1384 CE1 TYR P 25 -4.042 -14.130 -15.147 1.00 15.00 C ATOM 1385 CE2 TYR P 25 -3.819 -16.239 -16.247 1.00 15.00 C ATOM 1386 CZ TYR P 25 -3.704 -15.464 -15.114 1.00 15.00 C ATOM 1387 OH TYR P 25 -3.247 -16.027 -13.944 1.00 15.00 O ATOM 0 H TYR P 25 -7.292 -12.280 -17.851 1.00 15.00 H new ATOM 0 HA TYR P 25 -4.483 -11.696 -18.585 1.00 15.00 H new ATOM 0 HB2 TYR P 25 -6.067 -14.245 -19.058 1.00 15.00 H new ATOM 0 HB3 TYR P 25 -4.418 -13.943 -19.571 1.00 15.00 H new ATOM 0 HD1 TYR P 25 -4.765 -12.522 -16.342 1.00 15.00 H new ATOM 0 HD2 TYR P 25 -4.367 -16.282 -18.306 1.00 15.00 H new ATOM 0 HE1 TYR P 25 -3.949 -13.525 -14.257 1.00 15.00 H new ATOM 0 HE2 TYR P 25 -3.551 -17.285 -16.219 1.00 15.00 H new ATOM 0 HH TYR P 25 -3.054 -16.976 -14.091 1.00 15.00 H new ATOM 1397 N PRO P 26 -5.669 -10.604 -20.609 1.00 15.00 N ATOM 1398 CA PRO P 26 -6.146 -10.102 -21.900 1.00 15.00 C ATOM 1399 C PRO P 26 -5.619 -10.939 -23.040 1.00 15.00 C ATOM 1400 O PRO P 26 -4.537 -10.686 -23.555 1.00 15.00 O ATOM 1401 CB PRO P 26 -5.549 -8.698 -21.965 1.00 15.00 C ATOM 1402 CG PRO P 26 -4.329 -8.844 -21.150 1.00 15.00 C ATOM 1403 CD PRO P 26 -4.796 -9.615 -19.961 1.00 15.00 C ATOM 0 HA PRO P 26 -7.232 -10.125 -21.985 1.00 15.00 H new ATOM 0 HB2 PRO P 26 -5.322 -8.398 -22.988 1.00 15.00 H new ATOM 0 HB3 PRO P 26 -6.226 -7.948 -21.556 1.00 15.00 H new ATOM 0 HG2 PRO P 26 -3.546 -9.375 -21.691 1.00 15.00 H new ATOM 0 HG3 PRO P 26 -3.918 -7.875 -20.865 1.00 15.00 H new ATOM 0 HD2 PRO P 26 -3.973 -10.081 -19.419 1.00 15.00 H new ATOM 0 HD3 PRO P 26 -5.334 -8.991 -19.248 1.00 15.00 H new ATOM 1411 N SER P 27 -6.388 -11.946 -23.404 1.00 15.00 N ATOM 1412 CA SER P 27 -6.030 -12.862 -24.475 1.00 15.00 C ATOM 1413 C SER P 27 -5.417 -12.119 -25.654 1.00 15.00 C ATOM 1414 O SER P 27 -5.465 -10.891 -25.728 1.00 15.00 O ATOM 1415 CB SER P 27 -7.262 -13.641 -24.934 1.00 15.00 C ATOM 1416 OG SER P 27 -6.935 -14.548 -25.972 1.00 15.00 O ATOM 0 H SER P 27 -7.284 -12.155 -22.964 1.00 15.00 H new ATOM 0 HA SER P 27 -5.286 -13.558 -24.088 1.00 15.00 H new ATOM 0 HB2 SER P 27 -7.686 -14.186 -24.091 1.00 15.00 H new ATOM 0 HB3 SER P 27 -8.027 -12.946 -25.282 1.00 15.00 H new ATOM 0 HG SER P 27 -7.740 -15.035 -26.246 1.00 15.00 H new ATOM 1422 N GLU P 28 -4.849 -12.877 -26.576 1.00 15.00 N ATOM 1423 CA GLU P 28 -4.223 -12.308 -27.761 1.00 15.00 C ATOM 1424 C GLU P 28 -5.091 -11.216 -28.359 1.00 15.00 C ATOM 1425 O GLU P 28 -4.608 -10.137 -28.690 1.00 15.00 O ATOM 1426 CB GLU P 28 -3.962 -13.399 -28.803 1.00 15.00 C ATOM 1427 CG GLU P 28 -3.035 -14.499 -28.312 1.00 15.00 C ATOM 1428 CD GLU P 28 -2.787 -15.563 -29.363 1.00 15.00 C ATOM 1429 OE1 GLU P 28 -3.767 -16.200 -29.805 1.00 15.00 O ATOM 1430 OE2 GLU P 28 -1.615 -15.760 -29.745 1.00 15.00 O ATOM 0 H GLU P 28 -4.808 -13.895 -26.527 1.00 15.00 H new ATOM 0 HA GLU P 28 -3.271 -11.869 -27.463 1.00 15.00 H new ATOM 0 HB2 GLU P 28 -4.913 -13.842 -29.099 1.00 15.00 H new ATOM 0 HB3 GLU P 28 -3.531 -12.943 -29.694 1.00 15.00 H new ATOM 0 HG2 GLU P 28 -2.083 -14.060 -28.012 1.00 15.00 H new ATOM 0 HG3 GLU P 28 -3.466 -14.963 -27.425 1.00 15.00 H new ATOM 1437 N GLU P 29 -6.378 -11.501 -28.494 1.00 15.00 N ATOM 1438 CA GLU P 29 -7.305 -10.532 -29.057 1.00 15.00 C ATOM 1439 C GLU P 29 -7.506 -9.374 -28.098 1.00 15.00 C ATOM 1440 O GLU P 29 -7.655 -8.227 -28.518 1.00 15.00 O ATOM 1441 CB GLU P 29 -8.647 -11.194 -29.376 1.00 15.00 C ATOM 1442 CG GLU P 29 -9.330 -11.802 -28.161 1.00 15.00 C ATOM 1443 CD GLU P 29 -10.656 -12.456 -28.498 1.00 15.00 C ATOM 1444 OE1 GLU P 29 -11.043 -12.439 -29.686 1.00 15.00 O ATOM 1445 OE2 GLU P 29 -11.307 -12.987 -27.574 1.00 15.00 O ATOM 0 H GLU P 29 -6.801 -12.389 -28.223 1.00 15.00 H new ATOM 0 HA GLU P 29 -6.879 -10.148 -29.984 1.00 15.00 H new ATOM 0 HB2 GLU P 29 -9.311 -10.454 -29.823 1.00 15.00 H new ATOM 0 HB3 GLU P 29 -8.490 -11.973 -30.122 1.00 15.00 H new ATOM 0 HG2 GLU P 29 -8.669 -12.543 -27.711 1.00 15.00 H new ATOM 0 HG3 GLU P 29 -9.493 -11.025 -27.415 1.00 15.00 H new ATOM 1452 N ALA P 30 -7.502 -9.676 -26.806 1.00 15.00 N ATOM 1453 CA ALA P 30 -7.677 -8.658 -25.784 1.00 15.00 C ATOM 1454 C ALA P 30 -6.540 -7.648 -25.826 1.00 15.00 C ATOM 1455 O ALA P 30 -6.764 -6.457 -26.019 1.00 15.00 O ATOM 1456 CB ALA P 30 -7.753 -9.312 -24.419 1.00 15.00 C ATOM 0 H ALA P 30 -7.379 -10.621 -26.443 1.00 15.00 H new ATOM 0 HA ALA P 30 -8.608 -8.125 -25.977 1.00 15.00 H new ATOM 0 HB1 ALA P 30 -7.884 -8.546 -23.655 1.00 15.00 H new ATOM 0 HB2 ALA P 30 -8.598 -10.000 -24.392 1.00 15.00 H new ATOM 0 HB3 ALA P 30 -6.831 -9.862 -24.227 1.00 15.00 H new ATOM 1462 N LYS P 31 -5.312 -8.132 -25.666 1.00 15.00 N ATOM 1463 CA LYS P 31 -4.151 -7.255 -25.707 1.00 15.00 C ATOM 1464 C LYS P 31 -4.060 -6.558 -27.060 1.00 15.00 C ATOM 1465 O LYS P 31 -3.484 -5.476 -27.178 1.00 15.00 O ATOM 1466 CB LYS P 31 -2.875 -8.035 -25.387 1.00 15.00 C ATOM 1467 CG LYS P 31 -2.680 -9.290 -26.227 1.00 15.00 C ATOM 1468 CD LYS P 31 -2.497 -10.535 -25.362 1.00 15.00 C ATOM 1469 CE LYS P 31 -1.414 -10.372 -24.292 1.00 15.00 C ATOM 1470 NZ LYS P 31 -0.042 -10.532 -24.848 1.00 15.00 N ATOM 0 H LYS P 31 -5.098 -9.117 -25.508 1.00 15.00 H new ATOM 0 HA LYS P 31 -4.264 -6.485 -24.944 1.00 15.00 H new ATOM 0 HB2 LYS P 31 -2.017 -7.379 -25.531 1.00 15.00 H new ATOM 0 HB3 LYS P 31 -2.889 -8.316 -24.334 1.00 15.00 H new ATOM 0 HG2 LYS P 31 -3.542 -9.426 -26.881 1.00 15.00 H new ATOM 0 HG3 LYS P 31 -1.809 -9.164 -26.870 1.00 15.00 H new ATOM 0 HD2 LYS P 31 -3.444 -10.776 -24.878 1.00 15.00 H new ATOM 0 HD3 LYS P 31 -2.242 -11.380 -26.002 1.00 15.00 H new ATOM 0 HE2 LYS P 31 -1.505 -9.388 -23.833 1.00 15.00 H new ATOM 0 HE3 LYS P 31 -1.572 -11.107 -23.503 1.00 15.00 H new ATOM 0 HZ1 LYS P 31 0.417 -11.356 -24.409 1.00 15.00 H new ATOM 0 HZ2 LYS P 31 -0.099 -10.675 -25.877 1.00 15.00 H new ATOM 0 HZ3 LYS P 31 0.516 -9.678 -24.647 1.00 15.00 H new ATOM 1484 N GLU P 32 -4.681 -7.165 -28.066 1.00 15.00 N ATOM 1485 CA GLU P 32 -4.719 -6.579 -29.397 1.00 15.00 C ATOM 1486 C GLU P 32 -5.727 -5.435 -29.411 1.00 15.00 C ATOM 1487 O GLU P 32 -5.376 -4.289 -29.672 1.00 15.00 O ATOM 1488 CB GLU P 32 -5.078 -7.628 -30.451 1.00 15.00 C ATOM 1489 CG GLU P 32 -3.908 -8.519 -30.843 1.00 15.00 C ATOM 1490 CD GLU P 32 -4.314 -9.635 -31.785 1.00 15.00 C ATOM 1491 OE1 GLU P 32 -5.175 -10.453 -31.400 1.00 15.00 O ATOM 1492 OE2 GLU P 32 -3.771 -9.690 -32.909 1.00 15.00 O ATOM 0 H GLU P 32 -5.163 -8.060 -27.983 1.00 15.00 H new ATOM 0 HA GLU P 32 -3.729 -6.194 -29.644 1.00 15.00 H new ATOM 0 HB2 GLU P 32 -5.888 -8.251 -30.071 1.00 15.00 H new ATOM 0 HB3 GLU P 32 -5.455 -7.124 -31.341 1.00 15.00 H new ATOM 0 HG2 GLU P 32 -3.137 -7.912 -31.317 1.00 15.00 H new ATOM 0 HG3 GLU P 32 -3.467 -8.950 -29.944 1.00 15.00 H new ATOM 1499 N GLU P 33 -6.980 -5.753 -29.102 1.00 15.00 N ATOM 1500 CA GLU P 33 -8.029 -4.744 -29.055 1.00 15.00 C ATOM 1501 C GLU P 33 -7.662 -3.666 -28.043 1.00 15.00 C ATOM 1502 O GLU P 33 -7.707 -2.475 -28.349 1.00 15.00 O ATOM 1503 CB GLU P 33 -9.378 -5.375 -28.695 1.00 15.00 C ATOM 1504 CG GLU P 33 -9.415 -5.997 -27.311 1.00 15.00 C ATOM 1505 CD GLU P 33 -10.730 -6.691 -27.020 1.00 15.00 C ATOM 1506 OE1 GLU P 33 -11.779 -6.013 -27.052 1.00 15.00 O ATOM 1507 OE2 GLU P 33 -10.712 -7.913 -26.762 1.00 15.00 O ATOM 0 H GLU P 33 -7.292 -6.699 -28.881 1.00 15.00 H new ATOM 0 HA GLU P 33 -8.121 -4.292 -30.042 1.00 15.00 H new ATOM 0 HB2 GLU P 33 -10.154 -4.612 -28.761 1.00 15.00 H new ATOM 0 HB3 GLU P 33 -9.619 -6.140 -29.433 1.00 15.00 H new ATOM 0 HG2 GLU P 33 -8.601 -6.715 -27.218 1.00 15.00 H new ATOM 0 HG3 GLU P 33 -9.244 -5.222 -26.564 1.00 15.00 H new ATOM 1514 N LEU P 34 -7.276 -4.092 -26.838 1.00 15.00 N ATOM 1515 CA LEU P 34 -6.877 -3.162 -25.790 1.00 15.00 C ATOM 1516 C LEU P 34 -5.799 -2.220 -26.314 1.00 15.00 C ATOM 1517 O LEU P 34 -5.975 -1.005 -26.338 1.00 15.00 O ATOM 1518 CB LEU P 34 -6.337 -3.928 -24.569 1.00 15.00 C ATOM 1519 CG LEU P 34 -7.344 -4.826 -23.836 1.00 15.00 C ATOM 1520 CD1 LEU P 34 -6.661 -5.588 -22.700 1.00 15.00 C ATOM 1521 CD2 LEU P 34 -8.499 -3.999 -23.300 1.00 15.00 C ATOM 0 H LEU P 34 -7.233 -5.075 -26.568 1.00 15.00 H new ATOM 0 HA LEU P 34 -7.751 -2.584 -25.489 1.00 15.00 H new ATOM 0 HB2 LEU P 34 -5.500 -4.546 -24.894 1.00 15.00 H new ATOM 0 HB3 LEU P 34 -5.941 -3.204 -23.857 1.00 15.00 H new ATOM 0 HG LEU P 34 -7.737 -5.552 -24.548 1.00 15.00 H new ATOM 0 HD11 LEU P 34 -7.392 -6.218 -22.194 1.00 15.00 H new ATOM 0 HD12 LEU P 34 -5.865 -6.211 -23.107 1.00 15.00 H new ATOM 0 HD13 LEU P 34 -6.239 -4.879 -21.988 1.00 15.00 H new ATOM 0 HD21 LEU P 34 -9.204 -4.650 -22.783 1.00 15.00 H new ATOM 0 HD22 LEU P 34 -8.119 -3.251 -22.604 1.00 15.00 H new ATOM 0 HD23 LEU P 34 -9.005 -3.501 -24.127 1.00 15.00 H new ATOM 1533 N ALA P 35 -4.675 -2.801 -26.715 1.00 15.00 N ATOM 1534 CA ALA P 35 -3.544 -2.038 -27.226 1.00 15.00 C ATOM 1535 C ALA P 35 -3.932 -1.129 -28.391 1.00 15.00 C ATOM 1536 O ALA P 35 -3.350 -0.059 -28.566 1.00 15.00 O ATOM 1537 CB ALA P 35 -2.427 -2.983 -27.638 1.00 15.00 C ATOM 0 H ALA P 35 -4.522 -3.809 -26.695 1.00 15.00 H new ATOM 0 HA ALA P 35 -3.196 -1.390 -26.422 1.00 15.00 H new ATOM 0 HB1 ALA P 35 -1.584 -2.406 -28.019 1.00 15.00 H new ATOM 0 HB2 ALA P 35 -2.107 -3.566 -26.775 1.00 15.00 H new ATOM 0 HB3 ALA P 35 -2.788 -3.656 -28.416 1.00 15.00 H new ATOM 1543 N LYS P 36 -4.919 -1.544 -29.177 1.00 15.00 N ATOM 1544 CA LYS P 36 -5.376 -0.743 -30.308 1.00 15.00 C ATOM 1545 C LYS P 36 -6.216 0.410 -29.798 1.00 15.00 C ATOM 1546 O LYS P 36 -6.072 1.559 -30.216 1.00 15.00 O ATOM 1547 CB LYS P 36 -6.196 -1.596 -31.283 1.00 15.00 C ATOM 1548 CG LYS P 36 -5.436 -2.747 -31.946 1.00 15.00 C ATOM 1549 CD LYS P 36 -3.979 -2.834 -31.509 1.00 15.00 C ATOM 1550 CE LYS P 36 -3.230 -3.907 -32.285 1.00 15.00 C ATOM 1551 NZ LYS P 36 -3.228 -3.633 -33.749 1.00 15.00 N ATOM 0 H LYS P 36 -5.416 -2.426 -29.053 1.00 15.00 H new ATOM 0 HA LYS P 36 -4.507 -0.358 -30.841 1.00 15.00 H new ATOM 0 HB2 LYS P 36 -7.051 -2.008 -30.748 1.00 15.00 H new ATOM 0 HB3 LYS P 36 -6.591 -0.946 -32.064 1.00 15.00 H new ATOM 0 HG2 LYS P 36 -5.936 -3.687 -31.711 1.00 15.00 H new ATOM 0 HG3 LYS P 36 -5.477 -2.626 -33.028 1.00 15.00 H new ATOM 0 HD2 LYS P 36 -3.494 -1.869 -31.659 1.00 15.00 H new ATOM 0 HD3 LYS P 36 -3.930 -3.053 -30.442 1.00 15.00 H new ATOM 0 HE2 LYS P 36 -2.203 -3.965 -31.925 1.00 15.00 H new ATOM 0 HE3 LYS P 36 -3.689 -4.878 -32.098 1.00 15.00 H new ATOM 0 HZ1 LYS P 36 -2.466 -4.176 -34.203 1.00 15.00 H new ATOM 0 HZ2 LYS P 36 -4.143 -3.914 -34.156 1.00 15.00 H new ATOM 0 HZ3 LYS P 36 -3.074 -2.617 -33.912 1.00 15.00 H new ATOM 1565 N LYS P 37 -7.100 0.060 -28.882 1.00 15.00 N ATOM 1566 CA LYS P 37 -8.010 0.997 -28.255 1.00 15.00 C ATOM 1567 C LYS P 37 -7.271 1.992 -27.365 1.00 15.00 C ATOM 1568 O LYS P 37 -7.526 3.195 -27.408 1.00 15.00 O ATOM 1569 CB LYS P 37 -9.005 0.198 -27.421 1.00 15.00 C ATOM 1570 CG LYS P 37 -10.115 -0.449 -28.234 1.00 15.00 C ATOM 1571 CD LYS P 37 -10.939 -1.405 -27.386 1.00 15.00 C ATOM 1572 CE LYS P 37 -11.547 -0.703 -26.183 1.00 15.00 C ATOM 1573 NZ LYS P 37 -12.485 0.380 -26.587 1.00 15.00 N ATOM 0 H LYS P 37 -7.207 -0.898 -28.549 1.00 15.00 H new ATOM 0 HA LYS P 37 -8.520 1.572 -29.028 1.00 15.00 H new ATOM 0 HB2 LYS P 37 -8.467 -0.579 -26.878 1.00 15.00 H new ATOM 0 HB3 LYS P 37 -9.451 0.857 -26.676 1.00 15.00 H new ATOM 0 HG2 LYS P 37 -10.763 0.324 -28.647 1.00 15.00 H new ATOM 0 HG3 LYS P 37 -9.683 -0.988 -29.077 1.00 15.00 H new ATOM 0 HD2 LYS P 37 -11.733 -1.840 -27.994 1.00 15.00 H new ATOM 0 HD3 LYS P 37 -10.309 -2.228 -27.048 1.00 15.00 H new ATOM 0 HE2 LYS P 37 -12.076 -1.430 -25.567 1.00 15.00 H new ATOM 0 HE3 LYS P 37 -10.751 -0.283 -25.567 1.00 15.00 H new ATOM 0 HZ1 LYS P 37 -12.979 0.742 -25.747 1.00 15.00 H new ATOM 0 HZ2 LYS P 37 -11.951 1.152 -27.035 1.00 15.00 H new ATOM 0 HZ3 LYS P 37 -13.180 0.003 -27.262 1.00 15.00 H new ATOM 1587 N SER P 38 -6.376 1.466 -26.543 1.00 15.00 N ATOM 1588 CA SER P 38 -5.605 2.261 -25.608 1.00 15.00 C ATOM 1589 C SER P 38 -4.508 3.072 -26.292 1.00 15.00 C ATOM 1590 O SER P 38 -4.395 4.281 -26.089 1.00 15.00 O ATOM 1591 CB SER P 38 -4.977 1.319 -24.587 1.00 15.00 C ATOM 1592 OG SER P 38 -5.963 0.733 -23.754 1.00 15.00 O ATOM 0 H SER P 38 -6.165 0.469 -26.508 1.00 15.00 H new ATOM 0 HA SER P 38 -6.278 2.974 -25.132 1.00 15.00 H new ATOM 0 HB2 SER P 38 -4.422 0.536 -25.104 1.00 15.00 H new ATOM 0 HB3 SER P 38 -4.260 1.867 -23.976 1.00 15.00 H new ATOM 0 HG SER P 38 -6.364 -0.035 -24.212 1.00 15.00 H new ATOM 1598 N GLY P 39 -3.684 2.390 -27.070 1.00 15.00 N ATOM 1599 CA GLY P 39 -2.577 3.046 -27.743 1.00 15.00 C ATOM 1600 C GLY P 39 -1.242 2.513 -27.252 1.00 15.00 C ATOM 1601 O GLY P 39 -0.203 3.155 -27.405 1.00 15.00 O ATOM 0 H GLY P 39 -3.760 1.389 -27.250 1.00 15.00 H new ATOM 0 HA2 GLY P 39 -2.659 2.892 -28.819 1.00 15.00 H new ATOM 0 HA3 GLY P 39 -2.628 4.121 -27.570 1.00 15.00 H new ATOM 1605 N ILE P 40 -1.289 1.318 -26.671 1.00 15.00 N ATOM 1606 CA ILE P 40 -0.109 0.640 -26.153 1.00 15.00 C ATOM 1607 C ILE P 40 0.250 -0.518 -27.072 1.00 15.00 C ATOM 1608 O ILE P 40 -0.273 -0.620 -28.182 1.00 15.00 O ATOM 1609 CB ILE P 40 -0.370 0.091 -24.726 1.00 15.00 C ATOM 1610 CG1 ILE P 40 -1.682 -0.697 -24.710 1.00 15.00 C ATOM 1611 CG2 ILE P 40 -0.403 1.221 -23.705 1.00 15.00 C ATOM 1612 CD1 ILE P 40 -2.068 -1.216 -23.347 1.00 15.00 C ATOM 0 H ILE P 40 -2.153 0.791 -26.546 1.00 15.00 H new ATOM 0 HA ILE P 40 0.711 1.357 -26.109 1.00 15.00 H new ATOM 0 HB ILE P 40 0.447 -0.577 -24.451 1.00 15.00 H new ATOM 0 HG12 ILE P 40 -2.482 -0.059 -25.085 1.00 15.00 H new ATOM 0 HG13 ILE P 40 -1.597 -1.539 -25.398 1.00 15.00 H new ATOM 0 HG21 ILE P 40 -0.588 0.809 -22.713 1.00 15.00 H new ATOM 0 HG22 ILE P 40 0.554 1.743 -23.709 1.00 15.00 H new ATOM 0 HG23 ILE P 40 -1.199 1.920 -23.962 1.00 15.00 H new ATOM 0 HD11 ILE P 40 -3.008 -1.763 -23.419 1.00 15.00 H new ATOM 0 HD12 ILE P 40 -1.288 -1.882 -22.977 1.00 15.00 H new ATOM 0 HD13 ILE P 40 -2.187 -0.379 -22.659 1.00 15.00 H new ATOM 1624 N THR P 41 1.101 -1.411 -26.596 1.00 15.00 N ATOM 1625 CA THR P 41 1.473 -2.579 -27.366 1.00 15.00 C ATOM 1626 C THR P 41 1.075 -3.820 -26.583 1.00 15.00 C ATOM 1627 O THR P 41 1.219 -3.858 -25.366 1.00 15.00 O ATOM 1628 CB THR P 41 2.971 -2.584 -27.675 1.00 15.00 C ATOM 1629 OG1 THR P 41 3.318 -3.714 -28.457 1.00 15.00 O ATOM 1630 CG2 THR P 41 3.841 -2.599 -26.439 1.00 15.00 C ATOM 0 H THR P 41 1.546 -1.347 -25.680 1.00 15.00 H new ATOM 0 HA THR P 41 0.951 -2.565 -28.323 1.00 15.00 H new ATOM 0 HB THR P 41 3.155 -1.655 -28.216 1.00 15.00 H new ATOM 0 HG1 THR P 41 4.280 -3.698 -28.646 1.00 15.00 H new ATOM 0 HG21 THR P 41 4.891 -2.602 -26.733 1.00 15.00 H new ATOM 0 HG22 THR P 41 3.635 -1.713 -25.838 1.00 15.00 H new ATOM 0 HG23 THR P 41 3.626 -3.493 -25.853 1.00 15.00 H new ATOM 1638 N VAL P 42 0.564 -4.819 -27.287 1.00 15.00 N ATOM 1639 CA VAL P 42 0.129 -6.072 -26.665 1.00 15.00 C ATOM 1640 C VAL P 42 0.843 -6.336 -25.329 1.00 15.00 C ATOM 1641 O VAL P 42 0.258 -6.188 -24.253 1.00 15.00 O ATOM 1642 CB VAL P 42 0.361 -7.263 -27.619 1.00 15.00 C ATOM 1643 CG1 VAL P 42 0.383 -8.579 -26.860 1.00 15.00 C ATOM 1644 CG2 VAL P 42 -0.708 -7.290 -28.705 1.00 15.00 C ATOM 0 H VAL P 42 0.438 -4.790 -28.299 1.00 15.00 H new ATOM 0 HA VAL P 42 -0.937 -5.969 -26.462 1.00 15.00 H new ATOM 0 HB VAL P 42 1.335 -7.132 -28.090 1.00 15.00 H new ATOM 0 HG11 VAL P 42 0.548 -9.399 -27.559 1.00 15.00 H new ATOM 0 HG12 VAL P 42 1.187 -8.561 -26.124 1.00 15.00 H new ATOM 0 HG13 VAL P 42 -0.571 -8.722 -26.352 1.00 15.00 H new ATOM 0 HG21 VAL P 42 -0.530 -8.136 -29.369 1.00 15.00 H new ATOM 0 HG22 VAL P 42 -1.691 -7.390 -28.245 1.00 15.00 H new ATOM 0 HG23 VAL P 42 -0.668 -6.364 -29.278 1.00 15.00 H new ATOM 1654 N SER P 43 2.101 -6.753 -25.417 1.00 15.00 N ATOM 1655 CA SER P 43 2.906 -7.071 -24.237 1.00 15.00 C ATOM 1656 C SER P 43 2.750 -6.053 -23.105 1.00 15.00 C ATOM 1657 O SER P 43 2.858 -6.415 -21.933 1.00 15.00 O ATOM 1658 CB SER P 43 4.381 -7.188 -24.624 1.00 15.00 C ATOM 1659 OG SER P 43 4.572 -8.201 -25.596 1.00 15.00 O ATOM 0 H SER P 43 2.592 -6.881 -26.302 1.00 15.00 H new ATOM 0 HA SER P 43 2.537 -8.024 -23.859 1.00 15.00 H new ATOM 0 HB2 SER P 43 4.735 -6.234 -25.014 1.00 15.00 H new ATOM 0 HB3 SER P 43 4.976 -7.412 -23.739 1.00 15.00 H new ATOM 0 HG SER P 43 5.522 -8.256 -25.829 1.00 15.00 H new ATOM 1665 N GLN P 44 2.483 -4.789 -23.435 1.00 15.00 N ATOM 1666 CA GLN P 44 2.311 -3.780 -22.403 1.00 15.00 C ATOM 1667 C GLN P 44 1.055 -4.068 -21.593 1.00 15.00 C ATOM 1668 O GLN P 44 1.052 -3.946 -20.368 1.00 15.00 O ATOM 1669 CB GLN P 44 2.260 -2.379 -23.018 1.00 15.00 C ATOM 1670 CG GLN P 44 3.622 -1.867 -23.462 1.00 15.00 C ATOM 1671 CD GLN P 44 4.573 -1.562 -22.308 1.00 15.00 C ATOM 1672 OE1 GLN P 44 4.109 -1.715 -21.068 1.00 15.00 O flip ATOM 1673 NE2 GLN P 44 5.723 -1.185 -22.535 1.00 15.00 N flip ATOM 0 H GLN P 44 2.384 -4.449 -24.391 1.00 15.00 H new ATOM 0 HA GLN P 44 3.169 -3.817 -21.731 1.00 15.00 H new ATOM 0 HB2 GLN P 44 1.587 -2.390 -23.875 1.00 15.00 H new ATOM 0 HB3 GLN P 44 1.838 -1.685 -22.290 1.00 15.00 H new ATOM 0 HG2 GLN P 44 4.083 -2.609 -24.114 1.00 15.00 H new ATOM 0 HG3 GLN P 44 3.484 -0.963 -24.055 1.00 15.00 H new ATOM 0 HE21 GLN P 44 6.044 -1.079 -23.497 1.00 15.00 H new ATOM 0 HE22 GLN P 44 6.354 -0.979 -21.761 1.00 15.00 H new ATOM 1682 N VAL P 45 -0.009 -4.471 -22.278 1.00 15.00 N ATOM 1683 CA VAL P 45 -1.263 -4.793 -21.612 1.00 15.00 C ATOM 1684 C VAL P 45 -1.036 -5.821 -20.504 1.00 15.00 C ATOM 1685 O VAL P 45 -1.396 -5.590 -19.350 1.00 15.00 O ATOM 1686 CB VAL P 45 -2.309 -5.323 -22.615 1.00 15.00 C ATOM 1687 CG1 VAL P 45 -3.606 -5.675 -21.904 1.00 15.00 C ATOM 1688 CG2 VAL P 45 -2.562 -4.295 -23.705 1.00 15.00 C ATOM 0 H VAL P 45 -0.027 -4.582 -23.292 1.00 15.00 H new ATOM 0 HA VAL P 45 -1.647 -3.874 -21.170 1.00 15.00 H new ATOM 0 HB VAL P 45 -1.916 -6.230 -23.075 1.00 15.00 H new ATOM 0 HG11 VAL P 45 -4.329 -6.047 -22.630 1.00 15.00 H new ATOM 0 HG12 VAL P 45 -3.414 -6.445 -21.156 1.00 15.00 H new ATOM 0 HG13 VAL P 45 -4.006 -4.786 -21.415 1.00 15.00 H new ATOM 0 HG21 VAL P 45 -3.302 -4.682 -24.406 1.00 15.00 H new ATOM 0 HG22 VAL P 45 -2.934 -3.374 -23.257 1.00 15.00 H new ATOM 0 HG23 VAL P 45 -1.632 -4.091 -24.236 1.00 15.00 H new ATOM 1698 N SER P 46 -0.424 -6.948 -20.858 1.00 15.00 N ATOM 1699 CA SER P 46 -0.139 -8.000 -19.879 1.00 15.00 C ATOM 1700 C SER P 46 0.667 -7.435 -18.709 1.00 15.00 C ATOM 1701 O SER P 46 0.567 -7.909 -17.577 1.00 15.00 O ATOM 1702 CB SER P 46 0.630 -9.146 -20.538 1.00 15.00 C ATOM 1703 OG SER P 46 0.907 -10.178 -19.606 1.00 15.00 O ATOM 0 H SER P 46 -0.117 -7.158 -21.808 1.00 15.00 H new ATOM 0 HA SER P 46 -1.086 -8.384 -19.500 1.00 15.00 H new ATOM 0 HB2 SER P 46 0.049 -9.548 -21.368 1.00 15.00 H new ATOM 0 HB3 SER P 46 1.564 -8.769 -20.956 1.00 15.00 H new ATOM 0 HG SER P 46 1.398 -10.899 -20.053 1.00 15.00 H new ATOM 1709 N ASN P 47 1.445 -6.400 -19.002 1.00 15.00 N ATOM 1710 CA ASN P 47 2.255 -5.737 -17.988 1.00 15.00 C ATOM 1711 C ASN P 47 1.357 -4.897 -17.083 1.00 15.00 C ATOM 1712 O ASN P 47 1.396 -5.012 -15.858 1.00 15.00 O ATOM 1713 CB ASN P 47 3.326 -4.857 -18.643 1.00 15.00 C ATOM 1714 CG ASN P 47 4.318 -4.256 -17.652 1.00 15.00 C ATOM 1715 OD1 ASN P 47 4.239 -4.651 -16.381 1.00 15.00 O flip ATOM 1716 ND2 ASN P 47 5.163 -3.446 -18.031 1.00 15.00 N flip ATOM 0 H ASN P 47 1.532 -6.001 -19.937 1.00 15.00 H new ATOM 0 HA ASN P 47 2.759 -6.494 -17.388 1.00 15.00 H new ATOM 0 HB2 ASN P 47 3.873 -5.451 -19.376 1.00 15.00 H new ATOM 0 HB3 ASN P 47 2.837 -4.050 -19.188 1.00 15.00 H new ATOM 0 HD21 ASN P 47 5.196 -3.165 -19.011 1.00 15.00 H new ATOM 0 HD22 ASN P 47 5.830 -3.056 -17.365 1.00 15.00 H new ATOM 1723 N TRP P 48 0.546 -4.057 -17.715 1.00 15.00 N ATOM 1724 CA TRP P 48 -0.388 -3.177 -17.015 1.00 15.00 C ATOM 1725 C TRP P 48 -1.338 -3.973 -16.120 1.00 15.00 C ATOM 1726 O TRP P 48 -1.412 -3.752 -14.912 1.00 15.00 O ATOM 1727 CB TRP P 48 -1.201 -2.404 -18.048 1.00 15.00 C ATOM 1728 CG TRP P 48 -1.963 -1.248 -17.487 1.00 15.00 C ATOM 1729 CD1 TRP P 48 -1.496 0.013 -17.266 1.00 15.00 C ATOM 1730 CD2 TRP P 48 -3.327 -1.254 -17.061 1.00 15.00 C ATOM 1731 NE1 TRP P 48 -2.496 0.801 -16.755 1.00 15.00 N ATOM 1732 CE2 TRP P 48 -3.627 0.044 -16.612 1.00 15.00 C ATOM 1733 CE3 TRP P 48 -4.323 -2.231 -17.022 1.00 15.00 C ATOM 1734 CZ2 TRP P 48 -4.885 0.389 -16.129 1.00 15.00 C ATOM 1735 CZ3 TRP P 48 -5.570 -1.887 -16.542 1.00 15.00 C ATOM 1736 CH2 TRP P 48 -5.841 -0.587 -16.102 1.00 15.00 C ATOM 0 H TRP P 48 0.516 -3.965 -18.730 1.00 15.00 H new ATOM 0 HA TRP P 48 0.182 -2.496 -16.384 1.00 15.00 H new ATOM 0 HB2 TRP P 48 -0.528 -2.039 -18.824 1.00 15.00 H new ATOM 0 HB3 TRP P 48 -1.901 -3.087 -18.528 1.00 15.00 H new ATOM 0 HD1 TRP P 48 -0.487 0.343 -17.464 1.00 15.00 H new ATOM 0 HE1 TRP P 48 -2.410 1.790 -16.520 1.00 15.00 H new ATOM 0 HE3 TRP P 48 -4.122 -3.236 -17.361 1.00 15.00 H new ATOM 0 HZ2 TRP P 48 -5.098 1.391 -15.788 1.00 15.00 H new ATOM 0 HZ3 TRP P 48 -6.350 -2.634 -16.505 1.00 15.00 H new ATOM 0 HH2 TRP P 48 -6.828 -0.349 -15.733 1.00 15.00 H new ATOM 1747 N PHE P 49 -2.068 -4.894 -16.743 1.00 15.00 N ATOM 1748 CA PHE P 49 -3.033 -5.734 -16.032 1.00 15.00 C ATOM 1749 C PHE P 49 -2.418 -6.332 -14.769 1.00 15.00 C ATOM 1750 O PHE P 49 -2.959 -6.173 -13.674 1.00 15.00 O ATOM 1751 CB PHE P 49 -3.546 -6.853 -16.946 1.00 15.00 C ATOM 1752 CG PHE P 49 -4.651 -6.436 -17.885 1.00 15.00 C ATOM 1753 CD1 PHE P 49 -4.481 -5.392 -18.789 1.00 15.00 C ATOM 1754 CD2 PHE P 49 -5.869 -7.101 -17.863 1.00 15.00 C ATOM 1755 CE1 PHE P 49 -5.507 -5.027 -19.646 1.00 15.00 C ATOM 1756 CE2 PHE P 49 -6.891 -6.739 -18.721 1.00 15.00 C ATOM 1757 CZ PHE P 49 -6.709 -5.702 -19.610 1.00 15.00 C ATOM 0 H PHE P 49 -2.010 -5.080 -17.744 1.00 15.00 H new ATOM 0 HA PHE P 49 -3.872 -5.103 -15.738 1.00 15.00 H new ATOM 0 HB2 PHE P 49 -2.712 -7.236 -17.534 1.00 15.00 H new ATOM 0 HB3 PHE P 49 -3.904 -7.676 -16.327 1.00 15.00 H new ATOM 0 HD1 PHE P 49 -3.541 -4.861 -18.823 1.00 15.00 H new ATOM 0 HD2 PHE P 49 -6.021 -7.912 -17.166 1.00 15.00 H new ATOM 0 HE1 PHE P 49 -5.365 -4.214 -20.342 1.00 15.00 H new ATOM 0 HE2 PHE P 49 -7.832 -7.269 -18.694 1.00 15.00 H new ATOM 0 HZ PHE P 49 -7.508 -5.418 -20.279 1.00 15.00 H new ATOM 1767 N GLY P 50 -1.292 -7.016 -14.922 1.00 15.00 N ATOM 1768 CA GLY P 50 -0.633 -7.620 -13.776 1.00 15.00 C ATOM 1769 C GLY P 50 -0.434 -6.646 -12.627 1.00 15.00 C ATOM 1770 O GLY P 50 -0.576 -7.016 -11.463 1.00 15.00 O ATOM 0 H GLY P 50 -0.823 -7.164 -15.815 1.00 15.00 H new ATOM 0 HA2 GLY P 50 -1.224 -8.468 -13.429 1.00 15.00 H new ATOM 0 HA3 GLY P 50 0.336 -8.012 -14.085 1.00 15.00 H new ATOM 1774 N ASN P 51 -0.100 -5.401 -12.952 1.00 15.00 N ATOM 1775 CA ASN P 51 0.126 -4.379 -11.933 1.00 15.00 C ATOM 1776 C ASN P 51 -1.170 -3.986 -11.226 1.00 15.00 C ATOM 1777 O ASN P 51 -1.185 -3.776 -10.013 1.00 15.00 O ATOM 1778 CB ASN P 51 0.772 -3.138 -12.552 1.00 15.00 C ATOM 1779 CG ASN P 51 2.150 -3.421 -13.117 1.00 15.00 C ATOM 1780 OD1 ASN P 51 2.338 -3.121 -14.396 1.00 15.00 O flip ATOM 1781 ND2 ASN P 51 3.038 -3.895 -12.409 1.00 15.00 N flip ATOM 0 H ASN P 51 0.020 -5.075 -13.911 1.00 15.00 H new ATOM 0 HA ASN P 51 0.800 -4.807 -11.191 1.00 15.00 H new ATOM 0 HB2 ASN P 51 0.129 -2.755 -13.345 1.00 15.00 H new ATOM 0 HB3 ASN P 51 0.846 -2.356 -11.796 1.00 15.00 H new ATOM 0 HD21 ASN P 51 2.849 -4.111 -11.430 1.00 15.00 H new ATOM 0 HD22 ASN P 51 3.963 -4.072 -12.801 1.00 15.00 H new ATOM 1788 N LYS P 52 -2.253 -3.870 -11.990 1.00 15.00 N ATOM 1789 CA LYS P 52 -3.546 -3.482 -11.431 1.00 15.00 C ATOM 1790 C LYS P 52 -3.946 -4.367 -10.254 1.00 15.00 C ATOM 1791 O LYS P 52 -4.472 -3.876 -9.255 1.00 15.00 O ATOM 1792 CB LYS P 52 -4.628 -3.523 -12.508 1.00 15.00 C ATOM 1793 CG LYS P 52 -4.390 -2.542 -13.643 1.00 15.00 C ATOM 1794 CD LYS P 52 -4.183 -1.124 -13.126 1.00 15.00 C ATOM 1795 CE LYS P 52 -5.373 -0.643 -12.312 1.00 15.00 C ATOM 1796 NZ LYS P 52 -6.619 -0.585 -13.125 1.00 15.00 N ATOM 0 H LYS P 52 -2.262 -4.039 -12.996 1.00 15.00 H new ATOM 0 HA LYS P 52 -3.446 -2.462 -11.061 1.00 15.00 H new ATOM 0 HB2 LYS P 52 -4.685 -4.532 -12.916 1.00 15.00 H new ATOM 0 HB3 LYS P 52 -5.594 -3.309 -12.050 1.00 15.00 H new ATOM 0 HG2 LYS P 52 -3.516 -2.852 -14.215 1.00 15.00 H new ATOM 0 HG3 LYS P 52 -5.240 -2.561 -14.325 1.00 15.00 H new ATOM 0 HD2 LYS P 52 -3.283 -1.088 -12.511 1.00 15.00 H new ATOM 0 HD3 LYS P 52 -4.021 -0.450 -13.967 1.00 15.00 H new ATOM 0 HE2 LYS P 52 -5.525 -1.310 -11.463 1.00 15.00 H new ATOM 0 HE3 LYS P 52 -5.159 0.346 -11.906 1.00 15.00 H new ATOM 0 HZ1 LYS P 52 -6.999 0.383 -13.110 1.00 15.00 H new ATOM 0 HZ2 LYS P 52 -6.407 -0.858 -14.106 1.00 15.00 H new ATOM 0 HZ3 LYS P 52 -7.323 -1.239 -12.728 1.00 15.00 H new ATOM 1810 N ARG P 53 -3.685 -5.665 -10.362 1.00 15.00 N ATOM 1811 CA ARG P 53 -4.020 -6.583 -9.274 1.00 15.00 C ATOM 1812 C ARG P 53 -3.151 -6.263 -8.064 1.00 15.00 C ATOM 1813 O ARG P 53 -3.592 -6.330 -6.921 1.00 15.00 O ATOM 1814 CB ARG P 53 -3.810 -8.040 -9.689 1.00 15.00 C ATOM 1815 CG ARG P 53 -2.383 -8.530 -9.452 1.00 15.00 C ATOM 1816 CD ARG P 53 -2.129 -9.917 -10.022 1.00 15.00 C ATOM 1817 NE ARG P 53 -2.347 -9.963 -11.462 1.00 15.00 N ATOM 1818 CZ ARG P 53 -3.543 -10.067 -12.024 1.00 15.00 C ATOM 1819 NH1 ARG P 53 -4.620 -10.251 -11.266 1.00 15.00 N ATOM 1820 NH2 ARG P 53 -3.660 -10.011 -13.344 1.00 15.00 N ATOM 0 H ARG P 53 -3.251 -6.102 -11.175 1.00 15.00 H new ATOM 0 HA ARG P 53 -5.073 -6.454 -9.025 1.00 15.00 H new ATOM 0 HB2 ARG P 53 -4.502 -8.673 -9.134 1.00 15.00 H new ATOM 0 HB3 ARG P 53 -4.055 -8.150 -10.745 1.00 15.00 H new ATOM 0 HG2 ARG P 53 -1.683 -7.825 -9.901 1.00 15.00 H new ATOM 0 HG3 ARG P 53 -2.182 -8.541 -8.381 1.00 15.00 H new ATOM 0 HD2 ARG P 53 -1.105 -10.218 -9.800 1.00 15.00 H new ATOM 0 HD3 ARG P 53 -2.786 -10.636 -9.533 1.00 15.00 H new ATOM 0 HE ARG P 53 -1.532 -9.912 -12.073 1.00 15.00 H new ATOM 0 HH11 ARG P 53 -4.526 -10.312 -10.252 1.00 15.00 H new ATOM 0 HH12 ARG P 53 -5.540 -10.331 -11.698 1.00 15.00 H new ATOM 0 HH21 ARG P 53 -2.831 -9.888 -13.925 1.00 15.00 H new ATOM 0 HH22 ARG P 53 -4.579 -10.091 -13.778 1.00 15.00 H new ATOM 1834 N ILE P 54 -1.895 -5.940 -8.334 1.00 15.00 N ATOM 1835 CA ILE P 54 -0.957 -5.632 -7.273 1.00 15.00 C ATOM 1836 C ILE P 54 -1.527 -4.510 -6.416 1.00 15.00 C ATOM 1837 O ILE P 54 -1.822 -4.717 -5.244 1.00 15.00 O ATOM 1838 CB ILE P 54 0.423 -5.213 -7.825 1.00 15.00 C ATOM 1839 CG1 ILE P 54 0.858 -6.145 -8.961 1.00 15.00 C ATOM 1840 CG2 ILE P 54 1.461 -5.210 -6.713 1.00 15.00 C ATOM 1841 CD1 ILE P 54 0.801 -7.619 -8.611 1.00 15.00 C ATOM 0 H ILE P 54 -1.506 -5.885 -9.275 1.00 15.00 H new ATOM 0 HA ILE P 54 -0.812 -6.533 -6.677 1.00 15.00 H new ATOM 0 HB ILE P 54 0.339 -4.202 -8.225 1.00 15.00 H new ATOM 0 HG12 ILE P 54 0.223 -5.964 -9.828 1.00 15.00 H new ATOM 0 HG13 ILE P 54 1.877 -5.892 -9.254 1.00 15.00 H new ATOM 0 HG21 ILE P 54 2.428 -4.913 -7.119 1.00 15.00 H new ATOM 0 HG22 ILE P 54 1.161 -4.506 -5.937 1.00 15.00 H new ATOM 0 HG23 ILE P 54 1.539 -6.210 -6.285 1.00 15.00 H new ATOM 0 HD11 ILE P 54 1.124 -8.209 -9.468 1.00 15.00 H new ATOM 0 HD12 ILE P 54 1.459 -7.818 -7.765 1.00 15.00 H new ATOM 0 HD13 ILE P 54 -0.221 -7.891 -8.348 1.00 15.00 H new ATOM 1853 N ARG P 55 -1.724 -3.338 -7.017 1.00 15.00 N ATOM 1854 CA ARG P 55 -2.299 -2.197 -6.304 1.00 15.00 C ATOM 1855 C ARG P 55 -3.575 -2.610 -5.567 1.00 15.00 C ATOM 1856 O ARG P 55 -3.884 -2.094 -4.494 1.00 15.00 O ATOM 1857 CB ARG P 55 -2.603 -1.060 -7.280 1.00 15.00 C ATOM 1858 CG ARG P 55 -1.388 -0.590 -8.065 1.00 15.00 C ATOM 1859 CD ARG P 55 -0.275 -0.116 -7.144 1.00 15.00 C ATOM 1860 NE ARG P 55 -0.693 1.008 -6.310 1.00 15.00 N ATOM 1861 CZ ARG P 55 0.095 1.602 -5.415 1.00 15.00 C ATOM 1862 NH1 ARG P 55 1.341 1.182 -5.237 1.00 15.00 N ATOM 1863 NH2 ARG P 55 -0.365 2.618 -4.698 1.00 15.00 N ATOM 0 H ARG P 55 -1.495 -3.153 -7.994 1.00 15.00 H new ATOM 0 HA ARG P 55 -1.571 -1.849 -5.571 1.00 15.00 H new ATOM 0 HB2 ARG P 55 -3.372 -1.388 -7.979 1.00 15.00 H new ATOM 0 HB3 ARG P 55 -3.015 -0.217 -6.726 1.00 15.00 H new ATOM 0 HG2 ARG P 55 -1.021 -1.404 -8.691 1.00 15.00 H new ATOM 0 HG3 ARG P 55 -1.678 0.221 -8.734 1.00 15.00 H new ATOM 0 HD2 ARG P 55 0.044 -0.941 -6.507 1.00 15.00 H new ATOM 0 HD3 ARG P 55 0.589 0.177 -7.741 1.00 15.00 H new ATOM 0 HE ARG P 55 -1.644 1.359 -6.419 1.00 15.00 H new ATOM 0 HH11 ARG P 55 1.699 0.401 -5.787 1.00 15.00 H new ATOM 0 HH12 ARG P 55 1.940 1.640 -4.551 1.00 15.00 H new ATOM 0 HH21 ARG P 55 -1.322 2.945 -4.832 1.00 15.00 H new ATOM 0 HH22 ARG P 55 0.238 3.073 -4.013 1.00 15.00 H new ATOM 1877 N TYR P 56 -4.299 -3.563 -6.153 1.00 15.00 N ATOM 1878 CA TYR P 56 -5.533 -4.087 -5.568 1.00 15.00 C ATOM 1879 C TYR P 56 -5.284 -4.559 -4.135 1.00 15.00 C ATOM 1880 O TYR P 56 -5.844 -4.021 -3.184 1.00 15.00 O ATOM 1881 CB TYR P 56 -6.045 -5.230 -6.456 1.00 15.00 C ATOM 1882 CG TYR P 56 -7.175 -6.047 -5.884 1.00 15.00 C ATOM 1883 CD1 TYR P 56 -8.482 -5.579 -5.882 1.00 15.00 C ATOM 1884 CD2 TYR P 56 -6.925 -7.301 -5.351 1.00 15.00 C ATOM 1885 CE1 TYR P 56 -9.509 -6.345 -5.362 1.00 15.00 C ATOM 1886 CE2 TYR P 56 -7.938 -8.072 -4.831 1.00 15.00 C ATOM 1887 CZ TYR P 56 -9.232 -7.591 -4.836 1.00 15.00 C ATOM 1888 OH TYR P 56 -10.250 -8.358 -4.318 1.00 15.00 O ATOM 0 H TYR P 56 -4.048 -3.992 -7.044 1.00 15.00 H new ATOM 0 HA TYR P 56 -6.291 -3.305 -5.522 1.00 15.00 H new ATOM 0 HB2 TYR P 56 -6.371 -4.808 -7.407 1.00 15.00 H new ATOM 0 HB3 TYR P 56 -5.212 -5.898 -6.673 1.00 15.00 H new ATOM 0 HD1 TYR P 56 -8.699 -4.604 -6.292 1.00 15.00 H new ATOM 0 HD2 TYR P 56 -5.914 -7.681 -5.344 1.00 15.00 H new ATOM 0 HE1 TYR P 56 -10.522 -5.971 -5.367 1.00 15.00 H new ATOM 0 HE2 TYR P 56 -7.723 -9.048 -4.421 1.00 15.00 H new ATOM 0 HH TYR P 56 -9.886 -9.207 -3.990 1.00 15.00 H new ATOM 1898 N LYS P 57 -4.425 -5.558 -4.004 1.00 15.00 N ATOM 1899 CA LYS P 57 -4.051 -6.140 -2.709 1.00 15.00 C ATOM 1900 C LYS P 57 -3.740 -5.092 -1.639 1.00 15.00 C ATOM 1901 O LYS P 57 -3.796 -5.381 -0.444 1.00 15.00 O ATOM 1902 CB LYS P 57 -2.805 -6.974 -2.912 1.00 15.00 C ATOM 1903 CG LYS P 57 -2.981 -8.086 -3.933 1.00 15.00 C ATOM 1904 CD LYS P 57 -4.125 -9.010 -3.551 1.00 15.00 C ATOM 1905 CE LYS P 57 -4.449 -9.990 -4.665 1.00 15.00 C ATOM 1906 NZ LYS P 57 -5.538 -10.931 -4.281 1.00 15.00 N ATOM 0 H LYS P 57 -3.959 -5.997 -4.798 1.00 15.00 H new ATOM 0 HA LYS P 57 -4.902 -6.725 -2.360 1.00 15.00 H new ATOM 0 HB2 LYS P 57 -1.990 -6.324 -3.231 1.00 15.00 H new ATOM 0 HB3 LYS P 57 -2.510 -7.411 -1.958 1.00 15.00 H new ATOM 0 HG2 LYS P 57 -3.172 -7.654 -4.915 1.00 15.00 H new ATOM 0 HG3 LYS P 57 -2.058 -8.660 -4.012 1.00 15.00 H new ATOM 0 HD2 LYS P 57 -3.863 -9.560 -2.647 1.00 15.00 H new ATOM 0 HD3 LYS P 57 -5.010 -8.417 -3.318 1.00 15.00 H new ATOM 0 HE2 LYS P 57 -4.744 -9.439 -5.558 1.00 15.00 H new ATOM 0 HE3 LYS P 57 -3.554 -10.557 -4.921 1.00 15.00 H new ATOM 0 HZ1 LYS P 57 -5.856 -11.455 -5.121 1.00 15.00 H new ATOM 0 HZ2 LYS P 57 -5.183 -11.601 -3.569 1.00 15.00 H new ATOM 0 HZ3 LYS P 57 -6.336 -10.395 -3.885 1.00 15.00 H new ATOM 1920 N LYS P 58 -3.410 -3.886 -2.068 1.00 15.00 N ATOM 1921 CA LYS P 58 -3.091 -2.818 -1.135 1.00 15.00 C ATOM 1922 C LYS P 58 -4.347 -2.079 -0.709 1.00 15.00 C ATOM 1923 O LYS P 58 -4.441 -1.594 0.419 1.00 15.00 O ATOM 1924 CB LYS P 58 -2.096 -1.825 -1.746 1.00 15.00 C ATOM 1925 CG LYS P 58 -0.755 -2.435 -2.127 1.00 15.00 C ATOM 1926 CD LYS P 58 -0.903 -3.418 -3.272 1.00 15.00 C ATOM 1927 CE LYS P 58 0.440 -3.796 -3.878 1.00 15.00 C ATOM 1928 NZ LYS P 58 1.224 -2.595 -4.275 1.00 15.00 N ATOM 0 H LYS P 58 -3.356 -3.622 -3.052 1.00 15.00 H new ATOM 0 HA LYS P 58 -2.633 -3.279 -0.260 1.00 15.00 H new ATOM 0 HB2 LYS P 58 -2.544 -1.379 -2.634 1.00 15.00 H new ATOM 0 HB3 LYS P 58 -1.925 -1.016 -1.035 1.00 15.00 H new ATOM 0 HG2 LYS P 58 -0.061 -1.644 -2.411 1.00 15.00 H new ATOM 0 HG3 LYS P 58 -0.325 -2.942 -1.263 1.00 15.00 H new ATOM 0 HD2 LYS P 58 -1.405 -4.317 -2.915 1.00 15.00 H new ATOM 0 HD3 LYS P 58 -1.539 -2.983 -4.043 1.00 15.00 H new ATOM 0 HE2 LYS P 58 1.012 -4.382 -3.158 1.00 15.00 H new ATOM 0 HE3 LYS P 58 0.280 -4.430 -4.750 1.00 15.00 H new ATOM 0 HZ1 LYS P 58 1.960 -2.870 -4.956 1.00 15.00 H new ATOM 0 HZ2 LYS P 58 0.591 -1.896 -4.713 1.00 15.00 H new ATOM 0 HZ3 LYS P 58 1.670 -2.178 -3.433 1.00 15.00 H new ATOM 1942 N ASN P 59 -5.278 -1.929 -1.641 1.00 15.00 N ATOM 1943 CA ASN P 59 -6.486 -1.168 -1.371 1.00 15.00 C ATOM 1944 C ASN P 59 -7.770 -1.849 -1.860 1.00 15.00 C ATOM 1945 O ASN P 59 -8.725 -1.170 -2.216 1.00 15.00 O ATOM 1946 CB ASN P 59 -6.315 0.178 -2.049 1.00 15.00 C ATOM 1947 CG ASN P 59 -6.361 0.075 -3.559 1.00 15.00 C ATOM 1948 OD1 ASN P 59 -7.306 -0.467 -4.124 1.00 15.00 O ATOM 1949 ND2 ASN P 59 -5.335 0.597 -4.220 1.00 15.00 N ATOM 0 H ASN P 59 -5.220 -2.320 -2.581 1.00 15.00 H new ATOM 0 HA ASN P 59 -6.607 -1.077 -0.292 1.00 15.00 H new ATOM 0 HB2 ASN P 59 -7.099 0.855 -1.710 1.00 15.00 H new ATOM 0 HB3 ASN P 59 -5.364 0.616 -1.746 1.00 15.00 H new ATOM 0 HD21 ASN P 59 -5.311 0.557 -5.239 1.00 15.00 H new ATOM 0 HD22 ASN P 59 -4.570 1.038 -3.709 1.00 15.00 H new ATOM 1956 N ILE P 60 -7.777 -3.178 -1.878 1.00 15.00 N ATOM 1957 CA ILE P 60 -8.935 -3.976 -2.324 1.00 15.00 C ATOM 1958 C ILE P 60 -10.248 -3.186 -2.465 1.00 15.00 C ATOM 1959 O ILE P 60 -10.761 -3.007 -3.570 1.00 15.00 O ATOM 1960 CB ILE P 60 -9.200 -5.163 -1.377 1.00 15.00 C ATOM 1961 CG1 ILE P 60 -7.926 -5.978 -1.173 1.00 15.00 C ATOM 1962 CG2 ILE P 60 -10.307 -6.042 -1.945 1.00 15.00 C ATOM 1963 CD1 ILE P 60 -7.319 -6.460 -2.467 1.00 15.00 C ATOM 0 H ILE P 60 -6.980 -3.743 -1.584 1.00 15.00 H new ATOM 0 HA ILE P 60 -8.646 -4.318 -3.318 1.00 15.00 H new ATOM 0 HB ILE P 60 -9.518 -4.776 -0.409 1.00 15.00 H new ATOM 0 HG12 ILE P 60 -7.195 -5.371 -0.639 1.00 15.00 H new ATOM 0 HG13 ILE P 60 -8.149 -6.837 -0.541 1.00 15.00 H new ATOM 0 HG21 ILE P 60 -10.489 -6.879 -1.271 1.00 15.00 H new ATOM 0 HG22 ILE P 60 -11.220 -5.455 -2.050 1.00 15.00 H new ATOM 0 HG23 ILE P 60 -10.005 -6.422 -2.921 1.00 15.00 H new ATOM 0 HD11 ILE P 60 -6.416 -7.033 -2.254 1.00 15.00 H new ATOM 0 HD12 ILE P 60 -8.035 -7.093 -2.991 1.00 15.00 H new ATOM 0 HD13 ILE P 60 -7.066 -5.603 -3.092 1.00 15.00 H new ATOM 1975 N GLY P 61 -10.799 -2.756 -1.330 1.00 15.00 N ATOM 1976 CA GLY P 61 -12.069 -2.034 -1.323 1.00 15.00 C ATOM 1977 C GLY P 61 -12.116 -0.840 -2.260 1.00 15.00 C ATOM 1978 O GLY P 61 -13.197 -0.395 -2.652 1.00 15.00 O ATOM 0 H GLY P 61 -10.387 -2.895 -0.407 1.00 15.00 H new ATOM 0 HA2 GLY P 61 -12.867 -2.725 -1.594 1.00 15.00 H new ATOM 0 HA3 GLY P 61 -12.274 -1.693 -0.308 1.00 15.00 H new ATOM 1982 N LYS P 62 -10.954 -0.318 -2.616 1.00 15.00 N ATOM 1983 CA LYS P 62 -10.875 0.832 -3.505 1.00 15.00 C ATOM 1984 C LYS P 62 -11.298 0.450 -4.921 1.00 15.00 C ATOM 1985 O LYS P 62 -11.974 1.217 -5.602 1.00 15.00 O ATOM 1986 CB LYS P 62 -9.453 1.401 -3.504 1.00 15.00 C ATOM 1987 CG LYS P 62 -9.329 2.798 -4.099 1.00 15.00 C ATOM 1988 CD LYS P 62 -9.411 2.784 -5.618 1.00 15.00 C ATOM 1989 CE LYS P 62 -9.152 4.164 -6.201 1.00 15.00 C ATOM 1990 NZ LYS P 62 -7.825 4.699 -5.792 1.00 15.00 N ATOM 0 H LYS P 62 -10.050 -0.672 -2.303 1.00 15.00 H new ATOM 0 HA LYS P 62 -11.560 1.599 -3.142 1.00 15.00 H new ATOM 0 HB2 LYS P 62 -9.085 1.423 -2.478 1.00 15.00 H new ATOM 0 HB3 LYS P 62 -8.804 0.724 -4.060 1.00 15.00 H new ATOM 0 HG2 LYS P 62 -10.120 3.433 -3.700 1.00 15.00 H new ATOM 0 HG3 LYS P 62 -8.381 3.239 -3.792 1.00 15.00 H new ATOM 0 HD2 LYS P 62 -8.684 2.077 -6.016 1.00 15.00 H new ATOM 0 HD3 LYS P 62 -10.397 2.436 -5.927 1.00 15.00 H new ATOM 0 HE2 LYS P 62 -9.204 4.114 -7.289 1.00 15.00 H new ATOM 0 HE3 LYS P 62 -9.935 4.848 -5.876 1.00 15.00 H new ATOM 0 HZ1 LYS P 62 -7.552 5.474 -6.429 1.00 15.00 H new ATOM 0 HZ2 LYS P 62 -7.880 5.056 -4.817 1.00 15.00 H new ATOM 0 HZ3 LYS P 62 -7.114 3.942 -5.844 1.00 15.00 H new ATOM 2004 N PHE P 63 -10.905 -0.743 -5.366 1.00 15.00 N ATOM 2005 CA PHE P 63 -11.256 -1.198 -6.707 1.00 15.00 C ATOM 2006 C PHE P 63 -12.697 -1.680 -6.790 1.00 15.00 C ATOM 2007 O PHE P 63 -13.287 -1.674 -7.864 1.00 15.00 O ATOM 2008 CB PHE P 63 -10.316 -2.303 -7.183 1.00 15.00 C ATOM 2009 CG PHE P 63 -8.910 -1.832 -7.388 1.00 15.00 C ATOM 2010 CD1 PHE P 63 -8.009 -1.832 -6.342 1.00 15.00 C ATOM 2011 CD2 PHE P 63 -8.498 -1.369 -8.626 1.00 15.00 C ATOM 2012 CE1 PHE P 63 -6.715 -1.383 -6.526 1.00 15.00 C ATOM 2013 CE2 PHE P 63 -7.205 -0.921 -8.818 1.00 15.00 C ATOM 2014 CZ PHE P 63 -6.312 -0.928 -7.766 1.00 15.00 C ATOM 0 H PHE P 63 -10.350 -1.404 -4.823 1.00 15.00 H new ATOM 0 HA PHE P 63 -11.148 -0.334 -7.363 1.00 15.00 H new ATOM 0 HB2 PHE P 63 -10.319 -3.113 -6.453 1.00 15.00 H new ATOM 0 HB3 PHE P 63 -10.694 -2.715 -8.118 1.00 15.00 H new ATOM 0 HD1 PHE P 63 -8.319 -2.187 -5.370 1.00 15.00 H new ATOM 0 HD2 PHE P 63 -9.195 -1.358 -9.451 1.00 15.00 H new ATOM 0 HE1 PHE P 63 -6.019 -1.388 -5.700 1.00 15.00 H new ATOM 0 HE2 PHE P 63 -6.894 -0.566 -9.789 1.00 15.00 H new ATOM 0 HZ PHE P 63 -5.301 -0.579 -7.912 1.00 15.00 H new ATOM 2024 N GLN P 64 -13.270 -2.094 -5.665 1.00 15.00 N ATOM 2025 CA GLN P 64 -14.651 -2.563 -5.661 1.00 15.00 C ATOM 2026 C GLN P 64 -15.591 -1.440 -6.078 1.00 15.00 C ATOM 2027 O GLN P 64 -16.228 -1.510 -7.129 1.00 15.00 O ATOM 2028 CB GLN P 64 -15.035 -3.102 -4.286 1.00 15.00 C ATOM 2029 CG GLN P 64 -14.332 -4.402 -3.942 1.00 15.00 C ATOM 2030 CD GLN P 64 -14.596 -4.853 -2.525 1.00 15.00 C ATOM 2031 OE1 GLN P 64 -13.532 -4.964 -1.746 1.00 15.00 O flip ATOM 2032 NE2 GLN P 64 -15.738 -5.098 -2.135 1.00 15.00 N flip ATOM 0 H GLN P 64 -12.808 -2.115 -4.756 1.00 15.00 H new ATOM 0 HA GLN P 64 -14.741 -3.377 -6.381 1.00 15.00 H new ATOM 0 HB2 GLN P 64 -14.796 -2.355 -3.529 1.00 15.00 H new ATOM 0 HB3 GLN P 64 -16.113 -3.258 -4.251 1.00 15.00 H new ATOM 0 HG2 GLN P 64 -14.658 -5.180 -4.633 1.00 15.00 H new ATOM 0 HG3 GLN P 64 -13.259 -4.278 -4.085 1.00 15.00 H new ATOM 0 HE21 GLN P 64 -16.527 -4.998 -2.773 1.00 15.00 H new ATOM 0 HE22 GLN P 64 -15.895 -5.401 -1.174 1.00 15.00 H new ATOM 2041 N GLU P 65 -15.669 -0.397 -5.259 1.00 15.00 N ATOM 2042 CA GLU P 65 -16.525 0.744 -5.567 1.00 15.00 C ATOM 2043 C GLU P 65 -16.246 1.247 -6.978 1.00 15.00 C ATOM 2044 O GLU P 65 -17.165 1.440 -7.773 1.00 15.00 O ATOM 2045 CB GLU P 65 -16.294 1.868 -4.567 1.00 15.00 C ATOM 2046 CG GLU P 65 -17.204 3.066 -4.774 1.00 15.00 C ATOM 2047 CD GLU P 65 -16.956 4.168 -3.762 1.00 15.00 C ATOM 2048 OE1 GLU P 65 -15.822 4.686 -3.714 1.00 15.00 O ATOM 2049 OE2 GLU P 65 -17.898 4.511 -3.017 1.00 15.00 O ATOM 0 H GLU P 65 -15.154 -0.317 -4.382 1.00 15.00 H new ATOM 0 HA GLU P 65 -17.564 0.421 -5.502 1.00 15.00 H new ATOM 0 HB2 GLU P 65 -16.441 1.481 -3.559 1.00 15.00 H new ATOM 0 HB3 GLU P 65 -15.256 2.195 -4.635 1.00 15.00 H new ATOM 0 HG2 GLU P 65 -17.056 3.461 -5.779 1.00 15.00 H new ATOM 0 HG3 GLU P 65 -18.243 2.744 -4.708 1.00 15.00 H new ATOM 2056 N GLU P 66 -14.964 1.425 -7.289 1.00 15.00 N ATOM 2057 CA GLU P 66 -14.554 1.871 -8.612 1.00 15.00 C ATOM 2058 C GLU P 66 -15.038 0.878 -9.651 1.00 15.00 C ATOM 2059 O GLU P 66 -15.688 1.243 -10.627 1.00 15.00 O ATOM 2060 CB GLU P 66 -13.034 1.989 -8.687 1.00 15.00 C ATOM 2061 CG GLU P 66 -12.460 3.033 -7.742 1.00 15.00 C ATOM 2062 CD GLU P 66 -12.902 4.441 -8.089 1.00 15.00 C ATOM 2063 OE1 GLU P 66 -12.602 4.899 -9.210 1.00 15.00 O ATOM 2064 OE2 GLU P 66 -13.550 5.086 -7.238 1.00 15.00 O ATOM 0 H GLU P 66 -14.193 1.266 -6.640 1.00 15.00 H new ATOM 0 HA GLU P 66 -14.991 2.850 -8.806 1.00 15.00 H new ATOM 0 HB2 GLU P 66 -12.590 1.020 -8.458 1.00 15.00 H new ATOM 0 HB3 GLU P 66 -12.747 2.238 -9.709 1.00 15.00 H new ATOM 0 HG2 GLU P 66 -12.766 2.801 -6.722 1.00 15.00 H new ATOM 0 HG3 GLU P 66 -11.372 2.981 -7.768 1.00 15.00 H new ATOM 2071 N ALA P 67 -14.716 -0.388 -9.414 1.00 15.00 N ATOM 2072 CA ALA P 67 -15.111 -1.463 -10.307 1.00 15.00 C ATOM 2073 C ALA P 67 -16.565 -1.285 -10.732 1.00 15.00 C ATOM 2074 O ALA P 67 -16.901 -1.450 -11.906 1.00 15.00 O ATOM 2075 CB ALA P 67 -14.892 -2.809 -9.631 1.00 15.00 C ATOM 0 H ALA P 67 -14.178 -0.694 -8.603 1.00 15.00 H new ATOM 0 HA ALA P 67 -14.493 -1.431 -11.204 1.00 15.00 H new ATOM 0 HB1 ALA P 67 -15.191 -3.609 -10.308 1.00 15.00 H new ATOM 0 HB2 ALA P 67 -13.838 -2.922 -9.379 1.00 15.00 H new ATOM 0 HB3 ALA P 67 -15.490 -2.861 -8.721 1.00 15.00 H new ATOM 2081 N ASN P 68 -17.424 -0.921 -9.779 1.00 15.00 N ATOM 2082 CA ASN P 68 -18.833 -0.698 -10.084 1.00 15.00 C ATOM 2083 C ASN P 68 -18.986 0.560 -10.934 1.00 15.00 C ATOM 2084 O ASN P 68 -19.801 0.610 -11.855 1.00 15.00 O ATOM 2085 CB ASN P 68 -19.648 -0.566 -8.796 1.00 15.00 C ATOM 2086 CG ASN P 68 -19.596 -1.822 -7.949 1.00 15.00 C ATOM 2087 OD1 ASN P 68 -19.995 -2.900 -8.390 1.00 15.00 O ATOM 2088 ND2 ASN P 68 -19.104 -1.688 -6.723 1.00 15.00 N ATOM 0 H ASN P 68 -17.171 -0.776 -8.802 1.00 15.00 H new ATOM 0 HA ASN P 68 -19.209 -1.555 -10.643 1.00 15.00 H new ATOM 0 HB2 ASN P 68 -19.272 0.276 -8.216 1.00 15.00 H new ATOM 0 HB3 ASN P 68 -20.685 -0.342 -9.047 1.00 15.00 H new ATOM 0 HD21 ASN P 68 -19.045 -2.498 -6.106 1.00 15.00 H new ATOM 0 HD22 ASN P 68 -18.785 -0.775 -6.399 1.00 15.00 H new ATOM 2095 N ILE P 69 -18.182 1.572 -10.616 1.00 15.00 N ATOM 2096 CA ILE P 69 -18.205 2.834 -11.346 1.00 15.00 C ATOM 2097 C ILE P 69 -17.790 2.626 -12.802 1.00 15.00 C ATOM 2098 O ILE P 69 -18.442 3.123 -13.719 1.00 15.00 O ATOM 2099 CB ILE P 69 -17.272 3.878 -10.694 1.00 15.00 C ATOM 2100 CG1 ILE P 69 -17.718 4.166 -9.259 1.00 15.00 C ATOM 2101 CG2 ILE P 69 -17.248 5.164 -11.509 1.00 15.00 C ATOM 2102 CD1 ILE P 69 -16.798 5.114 -8.520 1.00 15.00 C ATOM 0 H ILE P 69 -17.504 1.541 -9.854 1.00 15.00 H new ATOM 0 HA ILE P 69 -19.228 3.208 -11.312 1.00 15.00 H new ATOM 0 HB ILE P 69 -16.262 3.468 -10.672 1.00 15.00 H new ATOM 0 HG12 ILE P 69 -18.723 4.588 -9.277 1.00 15.00 H new ATOM 0 HG13 ILE P 69 -17.776 3.226 -8.709 1.00 15.00 H new ATOM 0 HG21 ILE P 69 -16.585 5.885 -11.031 1.00 15.00 H new ATOM 0 HG22 ILE P 69 -16.888 4.950 -12.515 1.00 15.00 H new ATOM 0 HG23 ILE P 69 -18.255 5.578 -11.565 1.00 15.00 H new ATOM 0 HD11 ILE P 69 -17.175 5.273 -7.510 1.00 15.00 H new ATOM 0 HD12 ILE P 69 -15.797 4.685 -8.471 1.00 15.00 H new ATOM 0 HD13 ILE P 69 -16.759 6.067 -9.047 1.00 15.00 H new ATOM 2114 N TYR P 70 -16.702 1.885 -13.004 1.00 15.00 N ATOM 2115 CA TYR P 70 -16.207 1.611 -14.350 1.00 15.00 C ATOM 2116 C TYR P 70 -17.096 0.605 -15.082 1.00 15.00 C ATOM 2117 O TYR P 70 -16.918 0.362 -16.276 1.00 15.00 O ATOM 2118 CB TYR P 70 -14.766 1.095 -14.303 1.00 15.00 C ATOM 2119 CG TYR P 70 -13.750 2.144 -13.897 1.00 15.00 C ATOM 2120 CD1 TYR P 70 -13.740 2.680 -12.615 1.00 15.00 C ATOM 2121 CD2 TYR P 70 -12.801 2.598 -14.804 1.00 15.00 C ATOM 2122 CE1 TYR P 70 -12.813 3.636 -12.249 1.00 15.00 C ATOM 2123 CE2 TYR P 70 -11.871 3.555 -14.445 1.00 15.00 C ATOM 2124 CZ TYR P 70 -11.880 4.069 -13.166 1.00 15.00 C ATOM 2125 OH TYR P 70 -10.954 5.022 -12.804 1.00 15.00 O ATOM 0 H TYR P 70 -16.149 1.466 -12.256 1.00 15.00 H new ATOM 0 HA TYR P 70 -16.231 2.551 -14.902 1.00 15.00 H new ATOM 0 HB2 TYR P 70 -14.712 0.261 -13.603 1.00 15.00 H new ATOM 0 HB3 TYR P 70 -14.498 0.705 -15.285 1.00 15.00 H new ATOM 0 HD1 TYR P 70 -14.469 2.343 -11.893 1.00 15.00 H new ATOM 0 HD2 TYR P 70 -12.790 2.196 -15.806 1.00 15.00 H new ATOM 0 HE1 TYR P 70 -12.819 4.042 -11.248 1.00 15.00 H new ATOM 0 HE2 TYR P 70 -11.141 3.898 -15.163 1.00 15.00 H new ATOM 0 HH TYR P 70 -10.369 5.215 -13.566 1.00 15.00 H new