USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=25 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= -0.0534 F(o=-2,f=-0.56) USER MOD Set 1.2: P 51 ASN :FLIP amide:sc= -0.511 F(o=-1.9,f=-0.56) USER MOD Set 2.1: P 23CASN :FLIP amide:sc= -0.534 F(o=-2.8!,f=0.45) USER MOD Set 2.2: P 25 TYR OH : rot 71:sc= 0.986 USER MOD Set 3.1: P 19 TYR OH : rot -5:sc= 1.11 USER MOD Set 3.2: P 23 HIS :FLIP no HE2:sc= 1.24 F(o=-3.1,f=2.3) USER MOD Set 4.1: P 7 ASN : amide:sc= -7.05! C(o=-12!,f=-17!) USER MOD Set 4.2: P 44 GLN : amide:sc= -5.24! C(o=-12!,f=-17!) USER MOD Single : P 9 ASN :FLIP amide:sc= -2.28 F(o=-4.6!,f=-2.3) USER MOD Single : P 10 LYS NZ :NH3+ -134:sc= -0.0381 (180deg=-1.19) USER MOD Single : P 11 GLN : amide:sc= -2.34 K(o=-2.3,f=-4.9!) USER MOD Single : P 13 THR OG1 : rot 180:sc= -0.225 USER MOD Single : P 17 ASN : amide:sc= -6.77! C(o=-6.8!,f=-17!) USER MOD Single : P 21 TYR OH : rot 180:sc= 0 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= -0.0776 USER MOD Single : P 31 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.14) USER MOD Single : P 36 LYS NZ :NH3+ 161:sc= -0.117 (180deg=-0.49) USER MOD Single : P 37 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0819) USER MOD Single : P 38 SER OG : rot 130:sc= -0.571 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+ 160:sc= 1.63! (180deg=-0.807) USER MOD Single : P 56 TYR OH : rot 180:sc= 0 USER MOD Single : P 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 58 LYS NZ :NH3+ -118:sc= -1.42 (180deg=-2.52!) USER MOD Single : P 59 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : P 62 LYS NZ :NH3+ 165:sc= -0.0516 (180deg=-0.294) USER MOD Single : P 64 GLN : amide:sc= -1.36 K(o=-1.4,f=-3.6!) USER MOD Single : P 68 ASN : amide:sc= -0.498 X(o=-0.5,f=0) USER MOD Single : P 70 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1011 N ARG P 6 3.628 7.979 -18.441 1.00 15.00 N ATOM 1012 CA ARG P 6 3.762 8.721 -19.694 1.00 15.00 C ATOM 1013 C ARG P 6 3.365 7.788 -20.824 1.00 15.00 C ATOM 1014 O ARG P 6 2.852 8.203 -21.863 1.00 15.00 O ATOM 1015 CB ARG P 6 5.198 9.196 -19.910 1.00 15.00 C ATOM 1016 CG ARG P 6 6.203 8.059 -19.895 1.00 15.00 C ATOM 1017 CD ARG P 6 7.613 8.575 -19.700 1.00 15.00 C ATOM 1018 NE ARG P 6 8.606 7.503 -19.752 1.00 15.00 N ATOM 1019 CZ ARG P 6 8.868 6.784 -20.842 1.00 15.00 C ATOM 1020 NH1 ARG P 6 8.249 7.046 -21.986 1.00 15.00 N ATOM 1021 NH2 ARG P 6 9.766 5.807 -20.790 1.00 15.00 N ATOM 0 HA ARG P 6 3.123 9.604 -19.663 1.00 15.00 H new ATOM 0 HB2 ARG P 6 5.263 9.719 -20.864 1.00 15.00 H new ATOM 0 HB3 ARG P 6 5.458 9.915 -19.133 1.00 15.00 H new ATOM 0 HG2 ARG P 6 5.955 7.362 -19.095 1.00 15.00 H new ATOM 0 HG3 ARG P 6 6.142 7.505 -20.832 1.00 15.00 H new ATOM 0 HD2 ARG P 6 7.837 9.313 -20.470 1.00 15.00 H new ATOM 0 HD3 ARG P 6 7.682 9.085 -18.739 1.00 15.00 H new ATOM 0 HE ARG P 6 9.130 7.293 -18.902 1.00 15.00 H new ATOM 0 HH11 ARG P 6 7.567 7.803 -22.035 1.00 15.00 H new ATOM 0 HH12 ARG P 6 8.455 6.491 -22.816 1.00 15.00 H new ATOM 0 HH21 ARG P 6 10.254 5.608 -19.916 1.00 15.00 H new ATOM 0 HH22 ARG P 6 9.968 5.255 -21.624 1.00 15.00 H new ATOM 1035 N ASN P 7 3.611 6.505 -20.575 1.00 15.00 N ATOM 1036 CA ASN P 7 3.302 5.442 -21.509 1.00 15.00 C ATOM 1037 C ASN P 7 1.799 5.387 -21.791 1.00 15.00 C ATOM 1038 O ASN P 7 1.313 6.133 -22.641 1.00 15.00 O ATOM 1039 CB ASN P 7 3.836 4.136 -20.933 1.00 15.00 C ATOM 1040 CG ASN P 7 3.517 2.931 -21.772 1.00 15.00 C ATOM 1041 OD1 ASN P 7 3.566 2.970 -23.001 1.00 15.00 O ATOM 1042 ND2 ASN P 7 3.222 1.839 -21.093 1.00 15.00 N ATOM 0 H ASN P 7 4.035 6.177 -19.707 1.00 15.00 H new ATOM 0 HA ASN P 7 3.782 5.624 -22.471 1.00 15.00 H new ATOM 0 HB2 ASN P 7 4.917 4.214 -20.821 1.00 15.00 H new ATOM 0 HB3 ASN P 7 3.422 3.993 -19.935 1.00 15.00 H new ATOM 0 HD21 ASN P 7 3.020 0.970 -21.587 1.00 15.00 H new ATOM 0 HD22 ASN P 7 3.196 1.864 -20.074 1.00 15.00 H new ATOM 1049 N PHE P 8 1.044 4.533 -21.091 1.00 15.00 N ATOM 1050 CA PHE P 8 -0.398 4.452 -21.311 1.00 15.00 C ATOM 1051 C PHE P 8 -1.056 5.765 -20.911 1.00 15.00 C ATOM 1052 O PHE P 8 -1.112 6.106 -19.730 1.00 15.00 O ATOM 1053 CB PHE P 8 -1.037 3.321 -20.484 1.00 15.00 C ATOM 1054 CG PHE P 8 -0.337 1.989 -20.543 1.00 15.00 C ATOM 1055 CD1 PHE P 8 0.774 1.731 -19.756 1.00 15.00 C ATOM 1056 CD2 PHE P 8 -0.805 0.988 -21.376 1.00 15.00 C ATOM 1057 CE1 PHE P 8 1.404 0.499 -19.802 1.00 15.00 C ATOM 1058 CE2 PHE P 8 -0.175 -0.242 -21.426 1.00 15.00 C ATOM 1059 CZ PHE P 8 0.929 -0.484 -20.639 1.00 15.00 C ATOM 0 H PHE P 8 1.404 3.898 -20.378 1.00 15.00 H new ATOM 0 HA PHE P 8 -0.554 4.247 -22.370 1.00 15.00 H new ATOM 0 HB2 PHE P 8 -1.083 3.640 -19.443 1.00 15.00 H new ATOM 0 HB3 PHE P 8 -2.064 3.185 -20.822 1.00 15.00 H new ATOM 0 HD1 PHE P 8 1.153 2.500 -19.099 1.00 15.00 H new ATOM 0 HD2 PHE P 8 -1.672 1.169 -21.994 1.00 15.00 H new ATOM 0 HE1 PHE P 8 2.267 0.310 -19.181 1.00 15.00 H new ATOM 0 HE2 PHE P 8 -0.549 -1.013 -22.083 1.00 15.00 H new ATOM 0 HZ PHE P 8 1.421 -1.444 -20.679 1.00 15.00 H new ATOM 1069 N ASN P 9 -1.546 6.499 -21.891 1.00 15.00 N ATOM 1070 CA ASN P 9 -2.193 7.775 -21.635 1.00 15.00 C ATOM 1071 C ASN P 9 -3.530 7.563 -20.918 1.00 15.00 C ATOM 1072 O ASN P 9 -3.951 6.424 -20.716 1.00 15.00 O ATOM 1073 CB ASN P 9 -2.369 8.506 -22.959 1.00 15.00 C ATOM 1074 CG ASN P 9 -2.577 9.998 -22.788 1.00 15.00 C ATOM 1075 OD1 ASN P 9 -3.598 10.532 -23.444 1.00 15.00 O flip ATOM 1076 ND2 ASN P 9 -1.814 10.666 -22.090 1.00 15.00 N flip ATOM 0 H ASN P 9 -1.509 6.234 -22.875 1.00 15.00 H new ATOM 0 HA ASN P 9 -1.574 8.386 -20.977 1.00 15.00 H new ATOM 0 HB2 ASN P 9 -1.490 8.336 -23.581 1.00 15.00 H new ATOM 0 HB3 ASN P 9 -3.222 8.084 -23.490 1.00 15.00 H new ATOM 0 HD21 ASN P 9 -1.041 10.213 -21.603 1.00 15.00 H new ATOM 0 HD22 ASN P 9 -1.955 11.672 -21.999 1.00 15.00 H new ATOM 1083 N LYS P 10 -4.188 8.651 -20.509 1.00 15.00 N ATOM 1084 CA LYS P 10 -5.460 8.538 -19.790 1.00 15.00 C ATOM 1085 C LYS P 10 -6.502 7.775 -20.609 1.00 15.00 C ATOM 1086 O LYS P 10 -7.488 7.282 -20.061 1.00 15.00 O ATOM 1087 CB LYS P 10 -6.000 9.918 -19.390 1.00 15.00 C ATOM 1088 CG LYS P 10 -6.654 10.697 -20.522 1.00 15.00 C ATOM 1089 CD LYS P 10 -5.693 10.950 -21.666 1.00 15.00 C ATOM 1090 CE LYS P 10 -6.356 11.746 -22.779 1.00 15.00 C ATOM 1091 NZ LYS P 10 -7.527 11.026 -23.356 1.00 15.00 N ATOM 0 H LYS P 10 -3.867 9.607 -20.660 1.00 15.00 H new ATOM 0 HA LYS P 10 -5.264 7.971 -18.880 1.00 15.00 H new ATOM 0 HB2 LYS P 10 -6.727 9.790 -18.588 1.00 15.00 H new ATOM 0 HB3 LYS P 10 -5.180 10.511 -18.986 1.00 15.00 H new ATOM 0 HG2 LYS P 10 -7.519 10.145 -20.890 1.00 15.00 H new ATOM 0 HG3 LYS P 10 -7.023 11.649 -20.141 1.00 15.00 H new ATOM 0 HD2 LYS P 10 -4.821 11.491 -21.298 1.00 15.00 H new ATOM 0 HD3 LYS P 10 -5.335 9.999 -22.060 1.00 15.00 H new ATOM 0 HE2 LYS P 10 -6.679 12.712 -22.391 1.00 15.00 H new ATOM 0 HE3 LYS P 10 -5.629 11.945 -23.566 1.00 15.00 H new ATOM 0 HZ1 LYS P 10 -7.482 11.066 -24.394 1.00 15.00 H new ATOM 0 HZ2 LYS P 10 -7.511 10.033 -23.047 1.00 15.00 H new ATOM 0 HZ3 LYS P 10 -8.406 11.476 -23.030 1.00 15.00 H new ATOM 1105 N GLN P 11 -6.275 7.669 -21.913 1.00 15.00 N ATOM 1106 CA GLN P 11 -7.195 6.950 -22.786 1.00 15.00 C ATOM 1107 C GLN P 11 -7.008 5.449 -22.609 1.00 15.00 C ATOM 1108 O GLN P 11 -7.970 4.702 -22.452 1.00 15.00 O ATOM 1109 CB GLN P 11 -6.955 7.331 -24.248 1.00 15.00 C ATOM 1110 CG GLN P 11 -7.988 6.760 -25.208 1.00 15.00 C ATOM 1111 CD GLN P 11 -9.390 7.262 -24.928 1.00 15.00 C ATOM 1112 OE1 GLN P 11 -9.938 7.040 -23.850 1.00 15.00 O ATOM 1113 NE2 GLN P 11 -9.980 7.944 -25.903 1.00 15.00 N ATOM 0 H GLN P 11 -5.466 8.070 -22.387 1.00 15.00 H new ATOM 0 HA GLN P 11 -8.215 7.223 -22.516 1.00 15.00 H new ATOM 0 HB2 GLN P 11 -6.953 8.418 -24.335 1.00 15.00 H new ATOM 0 HB3 GLN P 11 -5.965 6.985 -24.546 1.00 15.00 H new ATOM 0 HG2 GLN P 11 -7.711 7.020 -26.230 1.00 15.00 H new ATOM 0 HG3 GLN P 11 -7.977 5.672 -25.142 1.00 15.00 H new ATOM 0 HE21 GLN P 11 -9.489 8.105 -26.782 1.00 15.00 H new ATOM 0 HE22 GLN P 11 -10.924 8.306 -25.773 1.00 15.00 H new ATOM 1122 N ALA P 12 -5.752 5.024 -22.634 1.00 15.00 N ATOM 1123 CA ALA P 12 -5.408 3.619 -22.478 1.00 15.00 C ATOM 1124 C ALA P 12 -5.811 3.092 -21.106 1.00 15.00 C ATOM 1125 O ALA P 12 -6.374 2.005 -20.985 1.00 15.00 O ATOM 1126 CB ALA P 12 -3.915 3.432 -22.689 1.00 15.00 C ATOM 0 H ALA P 12 -4.949 5.639 -22.762 1.00 15.00 H new ATOM 0 HA ALA P 12 -5.959 3.050 -23.227 1.00 15.00 H new ATOM 0 HB1 ALA P 12 -3.660 2.379 -22.572 1.00 15.00 H new ATOM 0 HB2 ALA P 12 -3.645 3.761 -23.693 1.00 15.00 H new ATOM 0 HB3 ALA P 12 -3.367 4.022 -21.954 1.00 15.00 H new ATOM 1132 N THR P 13 -5.504 3.868 -20.076 1.00 15.00 N ATOM 1133 CA THR P 13 -5.814 3.483 -18.705 1.00 15.00 C ATOM 1134 C THR P 13 -7.289 3.128 -18.531 1.00 15.00 C ATOM 1135 O THR P 13 -7.617 2.021 -18.107 1.00 15.00 O ATOM 1136 CB THR P 13 -5.437 4.605 -17.740 1.00 15.00 C ATOM 1137 OG1 THR P 13 -6.197 5.772 -18.002 1.00 15.00 O ATOM 1138 CG2 THR P 13 -3.974 4.988 -17.806 1.00 15.00 C ATOM 0 H THR P 13 -5.039 4.771 -20.164 1.00 15.00 H new ATOM 0 HA THR P 13 -5.226 2.593 -18.479 1.00 15.00 H new ATOM 0 HB THR P 13 -5.649 4.210 -16.746 1.00 15.00 H new ATOM 0 HG1 THR P 13 -5.941 6.477 -17.372 1.00 15.00 H new ATOM 0 HG21 THR P 13 -3.775 5.790 -17.095 1.00 15.00 H new ATOM 0 HG22 THR P 13 -3.360 4.123 -17.557 1.00 15.00 H new ATOM 0 HG23 THR P 13 -3.732 5.328 -18.813 1.00 15.00 H new ATOM 1146 N GLU P 14 -8.174 4.067 -18.860 1.00 15.00 N ATOM 1147 CA GLU P 14 -9.614 3.843 -18.728 1.00 15.00 C ATOM 1148 C GLU P 14 -10.034 2.578 -19.468 1.00 15.00 C ATOM 1149 O GLU P 14 -10.880 1.817 -19.005 1.00 15.00 O ATOM 1150 CB GLU P 14 -10.395 5.050 -19.267 1.00 15.00 C ATOM 1151 CG GLU P 14 -10.638 5.029 -20.770 1.00 15.00 C ATOM 1152 CD GLU P 14 -11.480 6.200 -21.239 1.00 15.00 C ATOM 1153 OE1 GLU P 14 -11.821 7.060 -20.400 1.00 15.00 O ATOM 1154 OE2 GLU P 14 -11.799 6.256 -22.445 1.00 15.00 O ATOM 0 H GLU P 14 -7.921 4.988 -19.219 1.00 15.00 H new ATOM 0 HA GLU P 14 -9.842 3.718 -17.670 1.00 15.00 H new ATOM 0 HB2 GLU P 14 -11.357 5.100 -18.757 1.00 15.00 H new ATOM 0 HB3 GLU P 14 -9.852 5.960 -19.013 1.00 15.00 H new ATOM 0 HG2 GLU P 14 -9.680 5.043 -21.290 1.00 15.00 H new ATOM 0 HG3 GLU P 14 -11.134 4.097 -21.042 1.00 15.00 H new ATOM 1161 N ILE P 15 -9.434 2.379 -20.627 1.00 15.00 N ATOM 1162 CA ILE P 15 -9.726 1.230 -21.467 1.00 15.00 C ATOM 1163 C ILE P 15 -9.283 -0.079 -20.823 1.00 15.00 C ATOM 1164 O ILE P 15 -10.077 -1.008 -20.671 1.00 15.00 O ATOM 1165 CB ILE P 15 -9.033 1.405 -22.832 1.00 15.00 C ATOM 1166 CG1 ILE P 15 -9.688 2.561 -23.587 1.00 15.00 C ATOM 1167 CG2 ILE P 15 -9.077 0.122 -23.650 1.00 15.00 C ATOM 1168 CD1 ILE P 15 -8.874 3.060 -24.755 1.00 15.00 C ATOM 0 H ILE P 15 -8.731 3.009 -21.013 1.00 15.00 H new ATOM 0 HA ILE P 15 -10.807 1.177 -21.599 1.00 15.00 H new ATOM 0 HB ILE P 15 -7.981 1.637 -22.663 1.00 15.00 H new ATOM 0 HG12 ILE P 15 -10.666 2.241 -23.947 1.00 15.00 H new ATOM 0 HG13 ILE P 15 -9.858 3.386 -22.895 1.00 15.00 H new ATOM 0 HG21 ILE P 15 -8.579 0.283 -24.606 1.00 15.00 H new ATOM 0 HG22 ILE P 15 -8.569 -0.674 -23.106 1.00 15.00 H new ATOM 0 HG23 ILE P 15 -10.115 -0.163 -23.825 1.00 15.00 H new ATOM 0 HD11 ILE P 15 -9.402 3.880 -25.242 1.00 15.00 H new ATOM 0 HD12 ILE P 15 -7.905 3.412 -24.400 1.00 15.00 H new ATOM 0 HD13 ILE P 15 -8.726 2.249 -25.468 1.00 15.00 H new ATOM 1180 N LEU P 16 -8.008 -0.160 -20.473 1.00 15.00 N ATOM 1181 CA LEU P 16 -7.458 -1.369 -19.878 1.00 15.00 C ATOM 1182 C LEU P 16 -8.115 -1.711 -18.534 1.00 15.00 C ATOM 1183 O LEU P 16 -8.508 -2.858 -18.318 1.00 15.00 O ATOM 1184 CB LEU P 16 -5.944 -1.238 -19.722 1.00 15.00 C ATOM 1185 CG LEU P 16 -5.184 -0.903 -21.011 1.00 15.00 C ATOM 1186 CD1 LEU P 16 -3.705 -0.728 -20.728 1.00 15.00 C ATOM 1187 CD2 LEU P 16 -5.383 -1.993 -22.052 1.00 15.00 C ATOM 0 H LEU P 16 -7.335 0.597 -20.591 1.00 15.00 H new ATOM 0 HA LEU P 16 -7.678 -2.194 -20.555 1.00 15.00 H new ATOM 0 HB2 LEU P 16 -5.736 -0.463 -18.984 1.00 15.00 H new ATOM 0 HB3 LEU P 16 -5.553 -2.173 -19.321 1.00 15.00 H new ATOM 0 HG LEU P 16 -5.583 0.033 -21.402 1.00 15.00 H new ATOM 0 HD11 LEU P 16 -3.183 -0.491 -21.655 1.00 15.00 H new ATOM 0 HD12 LEU P 16 -3.565 0.084 -20.014 1.00 15.00 H new ATOM 0 HD13 LEU P 16 -3.303 -1.651 -20.311 1.00 15.00 H new ATOM 0 HD21 LEU P 16 -4.835 -1.735 -22.958 1.00 15.00 H new ATOM 0 HD22 LEU P 16 -5.013 -2.941 -21.662 1.00 15.00 H new ATOM 0 HD23 LEU P 16 -6.444 -2.086 -22.283 1.00 15.00 H new ATOM 1199 N ASN P 17 -8.242 -0.735 -17.631 1.00 15.00 N ATOM 1200 CA ASN P 17 -8.864 -1.003 -16.333 1.00 15.00 C ATOM 1201 C ASN P 17 -10.304 -1.475 -16.511 1.00 15.00 C ATOM 1202 O ASN P 17 -10.689 -2.516 -15.978 1.00 15.00 O ATOM 1203 CB ASN P 17 -8.798 0.212 -15.395 1.00 15.00 C ATOM 1204 CG ASN P 17 -9.294 1.504 -16.015 1.00 15.00 C ATOM 1205 OD1 ASN P 17 -10.385 1.565 -16.581 1.00 15.00 O ATOM 1206 ND2 ASN P 17 -8.493 2.557 -15.882 1.00 15.00 N ATOM 0 H ASN P 17 -7.930 0.226 -17.770 1.00 15.00 H new ATOM 0 HA ASN P 17 -8.292 -1.802 -15.861 1.00 15.00 H new ATOM 0 HB2 ASN P 17 -9.388 0.001 -14.503 1.00 15.00 H new ATOM 0 HB3 ASN P 17 -7.767 0.350 -15.070 1.00 15.00 H new ATOM 0 HD21 ASN P 17 -8.775 3.463 -16.257 1.00 15.00 H new ATOM 0 HD22 ASN P 17 -7.597 2.459 -15.405 1.00 15.00 H new ATOM 1213 N GLU P 18 -11.096 -0.713 -17.264 1.00 15.00 N ATOM 1214 CA GLU P 18 -12.491 -1.070 -17.514 1.00 15.00 C ATOM 1215 C GLU P 18 -12.618 -2.548 -17.870 1.00 15.00 C ATOM 1216 O GLU P 18 -13.594 -3.204 -17.505 1.00 15.00 O ATOM 1217 CB GLU P 18 -13.078 -0.207 -18.632 1.00 15.00 C ATOM 1218 CG GLU P 18 -13.415 1.209 -18.194 1.00 15.00 C ATOM 1219 CD GLU P 18 -14.582 1.261 -17.228 1.00 15.00 C ATOM 1220 OE1 GLU P 18 -15.138 0.188 -16.908 1.00 15.00 O ATOM 1221 OE2 GLU P 18 -14.943 2.374 -16.791 1.00 15.00 O ATOM 0 H GLU P 18 -10.796 0.154 -17.711 1.00 15.00 H new ATOM 0 HA GLU P 18 -13.053 -0.885 -16.599 1.00 15.00 H new ATOM 0 HB2 GLU P 18 -12.367 -0.164 -19.457 1.00 15.00 H new ATOM 0 HB3 GLU P 18 -13.980 -0.685 -19.013 1.00 15.00 H new ATOM 0 HG2 GLU P 18 -12.540 1.658 -17.724 1.00 15.00 H new ATOM 0 HG3 GLU P 18 -13.649 1.811 -19.072 1.00 15.00 H new ATOM 1228 N TYR P 19 -11.615 -3.071 -18.571 1.00 15.00 N ATOM 1229 CA TYR P 19 -11.611 -4.475 -18.955 1.00 15.00 C ATOM 1230 C TYR P 19 -11.093 -5.339 -17.811 1.00 15.00 C ATOM 1231 O TYR P 19 -11.629 -6.413 -17.540 1.00 15.00 O ATOM 1232 CB TYR P 19 -10.744 -4.695 -20.193 1.00 15.00 C ATOM 1233 CG TYR P 19 -10.693 -6.138 -20.652 1.00 15.00 C ATOM 1234 CD1 TYR P 19 -11.639 -7.066 -20.231 1.00 15.00 C ATOM 1235 CD2 TYR P 19 -9.695 -6.567 -21.511 1.00 15.00 C ATOM 1236 CE1 TYR P 19 -11.586 -8.381 -20.654 1.00 15.00 C ATOM 1237 CE2 TYR P 19 -9.634 -7.878 -21.939 1.00 15.00 C ATOM 1238 CZ TYR P 19 -10.581 -8.782 -21.509 1.00 15.00 C ATOM 1239 OH TYR P 19 -10.522 -10.089 -21.932 1.00 15.00 O ATOM 0 H TYR P 19 -10.799 -2.544 -18.882 1.00 15.00 H new ATOM 0 HA TYR P 19 -12.637 -4.763 -19.186 1.00 15.00 H new ATOM 0 HB2 TYR P 19 -11.124 -4.077 -21.007 1.00 15.00 H new ATOM 0 HB3 TYR P 19 -9.731 -4.354 -19.981 1.00 15.00 H new ATOM 0 HD1 TYR P 19 -12.428 -6.754 -19.563 1.00 15.00 H new ATOM 0 HD2 TYR P 19 -8.951 -5.863 -21.852 1.00 15.00 H new ATOM 0 HE1 TYR P 19 -12.327 -9.090 -20.317 1.00 15.00 H new ATOM 0 HE2 TYR P 19 -8.847 -8.194 -22.608 1.00 15.00 H new ATOM 0 HH TYR P 19 -11.212 -10.613 -21.474 1.00 15.00 H new ATOM 1249 N PHE P 20 -10.051 -4.859 -17.133 1.00 15.00 N ATOM 1250 CA PHE P 20 -9.468 -5.586 -16.008 1.00 15.00 C ATOM 1251 C PHE P 20 -10.559 -6.046 -15.047 1.00 15.00 C ATOM 1252 O PHE P 20 -10.634 -7.219 -14.680 1.00 15.00 O ATOM 1253 CB PHE P 20 -8.486 -4.687 -15.249 1.00 15.00 C ATOM 1254 CG PHE P 20 -7.991 -5.271 -13.949 1.00 15.00 C ATOM 1255 CD1 PHE P 20 -7.869 -6.643 -13.781 1.00 15.00 C ATOM 1256 CD2 PHE P 20 -7.635 -4.440 -12.897 1.00 15.00 C ATOM 1257 CE1 PHE P 20 -7.403 -7.172 -12.590 1.00 15.00 C ATOM 1258 CE2 PHE P 20 -7.172 -4.963 -11.705 1.00 15.00 C ATOM 1259 CZ PHE P 20 -7.056 -6.329 -11.552 1.00 15.00 C ATOM 0 H PHE P 20 -9.595 -3.971 -17.343 1.00 15.00 H new ATOM 0 HA PHE P 20 -8.942 -6.455 -16.403 1.00 15.00 H new ATOM 0 HB2 PHE P 20 -7.630 -4.480 -15.891 1.00 15.00 H new ATOM 0 HB3 PHE P 20 -8.969 -3.732 -15.045 1.00 15.00 H new ATOM 0 HD1 PHE P 20 -8.141 -7.306 -14.589 1.00 15.00 H new ATOM 0 HD2 PHE P 20 -7.721 -3.370 -13.011 1.00 15.00 H new ATOM 0 HE1 PHE P 20 -7.311 -8.242 -12.472 1.00 15.00 H new ATOM 0 HE2 PHE P 20 -6.901 -4.303 -10.894 1.00 15.00 H new ATOM 0 HZ PHE P 20 -6.694 -6.739 -10.621 1.00 15.00 H new ATOM 1269 N TYR P 21 -11.395 -5.094 -14.637 1.00 15.00 N ATOM 1270 CA TYR P 21 -12.493 -5.351 -13.707 1.00 15.00 C ATOM 1271 C TYR P 21 -13.440 -6.450 -14.206 1.00 15.00 C ATOM 1272 O TYR P 21 -14.430 -6.767 -13.545 1.00 15.00 O ATOM 1273 CB TYR P 21 -13.273 -4.056 -13.475 1.00 15.00 C ATOM 1274 CG TYR P 21 -12.422 -2.920 -12.942 1.00 15.00 C ATOM 1275 CD1 TYR P 21 -11.872 -2.973 -11.665 1.00 15.00 C ATOM 1276 CD2 TYR P 21 -12.166 -1.792 -13.717 1.00 15.00 C ATOM 1277 CE1 TYR P 21 -11.098 -1.938 -11.177 1.00 15.00 C ATOM 1278 CE2 TYR P 21 -11.391 -0.755 -13.233 1.00 15.00 C ATOM 1279 CZ TYR P 21 -10.862 -0.832 -11.964 1.00 15.00 C ATOM 1280 OH TYR P 21 -10.092 0.200 -11.480 1.00 15.00 O ATOM 0 H TYR P 21 -11.330 -4.122 -14.940 1.00 15.00 H new ATOM 0 HA TYR P 21 -12.059 -5.705 -12.772 1.00 15.00 H new ATOM 0 HB2 TYR P 21 -13.732 -3.745 -14.414 1.00 15.00 H new ATOM 0 HB3 TYR P 21 -14.084 -4.251 -12.773 1.00 15.00 H new ATOM 0 HD1 TYR P 21 -12.053 -3.838 -11.045 1.00 15.00 H new ATOM 0 HD2 TYR P 21 -12.580 -1.726 -14.712 1.00 15.00 H new ATOM 0 HE1 TYR P 21 -10.680 -1.996 -10.183 1.00 15.00 H new ATOM 0 HE2 TYR P 21 -11.201 0.112 -13.848 1.00 15.00 H new ATOM 0 HH TYR P 21 -10.022 0.902 -12.160 1.00 15.00 H new ATOM 1290 N SER P 22 -13.126 -7.044 -15.354 1.00 15.00 N ATOM 1291 CA SER P 22 -13.941 -8.116 -15.909 1.00 15.00 C ATOM 1292 C SER P 22 -13.228 -9.458 -15.756 1.00 15.00 C ATOM 1293 O SER P 22 -13.866 -10.509 -15.745 1.00 15.00 O ATOM 1294 CB SER P 22 -14.245 -7.849 -17.385 1.00 15.00 C ATOM 1295 OG SER P 22 -14.942 -6.626 -17.549 1.00 15.00 O ATOM 0 H SER P 22 -12.312 -6.799 -15.917 1.00 15.00 H new ATOM 0 HA SER P 22 -14.882 -8.152 -15.360 1.00 15.00 H new ATOM 0 HB2 SER P 22 -13.314 -7.820 -17.952 1.00 15.00 H new ATOM 0 HB3 SER P 22 -14.840 -8.667 -17.791 1.00 15.00 H new ATOM 0 HG SER P 22 -15.123 -6.478 -18.501 1.00 15.00 H new ATOM 1301 N HIS P 23 -11.901 -9.408 -15.625 1.00 15.00 N ATOM 1302 CA HIS P 23 -11.092 -10.613 -15.461 1.00 15.00 C ATOM 1303 C HIS P 23 -10.137 -10.473 -14.275 1.00 15.00 C ATOM 1304 O HIS P 23 -8.974 -10.867 -14.360 1.00 15.00 O ATOM 1305 CB HIS P 23 -10.287 -10.889 -16.736 1.00 15.00 C ATOM 1306 CG HIS P 23 -11.115 -11.330 -17.905 1.00 15.00 C ATOM 1307 ND1 HIS P 23 -12.409 -11.722 -17.986 1.00 15.00 N flip ATOM 1308 CD2 HIS P 23 -10.611 -11.425 -19.185 1.00 15.00 C flip ATOM 1309 CE1 HIS P 23 -12.658 -12.040 -19.299 1.00 15.00 C flip ATOM 1310 NE2 HIS P 23 -11.557 -11.852 -20.002 1.00 15.00 N flip ATOM 0 H HIS P 23 -11.364 -8.541 -15.630 1.00 15.00 H new ATOM 0 HA HIS P 23 -11.767 -11.447 -15.270 1.00 15.00 H new ATOM 0 HB2 HIS P 23 -9.743 -9.985 -17.011 1.00 15.00 H new ATOM 0 HB3 HIS P 23 -9.543 -11.656 -16.523 1.00 15.00 H new ATOM 0 HD1 HIS P 23 -13.075 -11.772 -17.215 1.00 15.00 H new ATOM 0 HD2 HIS P 23 -9.598 -11.187 -19.475 1.00 15.00 H new ATOM 0 HE1 HIS P 23 -13.602 -12.388 -19.692 1.00 15.00 H new ATOM 1318 N LEU P 23A -10.629 -9.913 -13.169 1.00 15.00 N ATOM 1319 CA LEU P 23A -9.798 -9.734 -11.974 1.00 15.00 C ATOM 1320 C LEU P 23A -8.996 -10.989 -11.660 1.00 15.00 C ATOM 1321 O LEU P 23A -7.768 -10.955 -11.632 1.00 15.00 O ATOM 1322 CB LEU P 23A -10.630 -9.339 -10.748 1.00 15.00 C ATOM 1323 CG LEU P 23A -11.015 -7.858 -10.643 1.00 15.00 C ATOM 1324 CD1 LEU P 23A -11.180 -7.471 -9.190 1.00 15.00 C ATOM 1325 CD2 LEU P 23A -9.965 -6.968 -11.273 1.00 15.00 C ATOM 0 H LEU P 23A -11.588 -9.578 -13.074 1.00 15.00 H new ATOM 0 HA LEU P 23A -9.110 -8.920 -12.200 1.00 15.00 H new ATOM 0 HB2 LEU P 23A -11.545 -9.932 -10.748 1.00 15.00 H new ATOM 0 HB3 LEU P 23A -10.073 -9.613 -9.852 1.00 15.00 H new ATOM 0 HG LEU P 23A -11.955 -7.721 -11.178 1.00 15.00 H new ATOM 0 HD11 LEU P 23A -11.453 -6.418 -9.123 1.00 15.00 H new ATOM 0 HD12 LEU P 23A -11.964 -8.079 -8.738 1.00 15.00 H new ATOM 0 HD13 LEU P 23A -10.242 -7.637 -8.661 1.00 15.00 H new ATOM 0 HD21 LEU P 23A -10.269 -5.925 -11.181 1.00 15.00 H new ATOM 0 HD22 LEU P 23A -9.012 -7.114 -10.765 1.00 15.00 H new ATOM 0 HD23 LEU P 23A -9.857 -7.223 -12.327 1.00 15.00 H new ATOM 1337 N SER P 23B -9.692 -12.090 -11.398 1.00 15.00 N ATOM 1338 CA SER P 23B -9.027 -13.346 -11.058 1.00 15.00 C ATOM 1339 C SER P 23B -8.067 -13.805 -12.162 1.00 15.00 C ATOM 1340 O SER P 23B -7.352 -14.791 -11.994 1.00 15.00 O ATOM 1341 CB SER P 23B -10.065 -14.437 -10.789 1.00 15.00 C ATOM 1342 OG SER P 23B -10.915 -14.079 -9.713 1.00 15.00 O ATOM 0 H SER P 23B -10.711 -12.140 -11.414 1.00 15.00 H new ATOM 0 HA SER P 23B -8.439 -13.169 -10.158 1.00 15.00 H new ATOM 0 HB2 SER P 23B -10.661 -14.606 -11.686 1.00 15.00 H new ATOM 0 HB3 SER P 23B -9.560 -15.375 -10.561 1.00 15.00 H new ATOM 0 HG SER P 23B -11.570 -14.792 -9.563 1.00 15.00 H new ATOM 1348 N ASN P 23C -8.038 -13.070 -13.273 1.00 15.00 N ATOM 1349 CA ASN P 23C -7.156 -13.377 -14.395 1.00 15.00 C ATOM 1350 C ASN P 23C -6.624 -12.072 -14.983 1.00 15.00 C ATOM 1351 O ASN P 23C -7.048 -11.643 -16.056 1.00 15.00 O ATOM 1352 CB ASN P 23C -7.906 -14.161 -15.485 1.00 15.00 C ATOM 1353 CG ASN P 23C -8.304 -15.576 -15.079 1.00 15.00 C ATOM 1354 OD1 ASN P 23C -7.707 -16.104 -14.015 1.00 15.00 O flip ATOM 1355 ND2 ASN P 23C -9.127 -16.205 -15.745 1.00 15.00 N flip ATOM 0 H ASN P 23C -8.624 -12.248 -13.419 1.00 15.00 H new ATOM 0 HA ASN P 23C -6.332 -13.992 -14.034 1.00 15.00 H new ATOM 0 HB2 ASN P 23C -8.804 -13.608 -15.761 1.00 15.00 H new ATOM 0 HB3 ASN P 23C -7.279 -14.214 -16.375 1.00 15.00 H new ATOM 0 HD21 ASN P 23C -9.567 -15.770 -16.556 1.00 15.00 H new ATOM 0 HD22 ASN P 23C -9.369 -17.161 -15.486 1.00 15.00 H new ATOM 1362 N PRO P 24 -5.695 -11.410 -14.267 1.00 15.00 N ATOM 1363 CA PRO P 24 -5.110 -10.133 -14.700 1.00 15.00 C ATOM 1364 C PRO P 24 -4.236 -10.262 -15.942 1.00 15.00 C ATOM 1365 O PRO P 24 -3.072 -9.863 -15.939 1.00 15.00 O ATOM 1366 CB PRO P 24 -4.267 -9.700 -13.496 1.00 15.00 C ATOM 1367 CG PRO P 24 -3.949 -10.967 -12.786 1.00 15.00 C ATOM 1368 CD PRO P 24 -5.152 -11.846 -12.966 1.00 15.00 C ATOM 0 HA PRO P 24 -5.883 -9.418 -14.983 1.00 15.00 H new ATOM 0 HB2 PRO P 24 -3.360 -9.184 -13.812 1.00 15.00 H new ATOM 0 HB3 PRO P 24 -4.817 -9.013 -12.853 1.00 15.00 H new ATOM 0 HG2 PRO P 24 -3.056 -11.435 -13.201 1.00 15.00 H new ATOM 0 HG3 PRO P 24 -3.752 -10.785 -11.730 1.00 15.00 H new ATOM 0 HD2 PRO P 24 -4.882 -12.902 -12.976 1.00 15.00 H new ATOM 0 HD3 PRO P 24 -5.875 -11.709 -12.162 1.00 15.00 H new ATOM 1376 N TYR P 25 -4.810 -10.801 -17.009 1.00 15.00 N ATOM 1377 CA TYR P 25 -4.100 -10.959 -18.269 1.00 15.00 C ATOM 1378 C TYR P 25 -5.091 -10.989 -19.430 1.00 15.00 C ATOM 1379 O TYR P 25 -6.014 -11.802 -19.447 1.00 15.00 O ATOM 1380 CB TYR P 25 -3.232 -12.224 -18.274 1.00 15.00 C ATOM 1381 CG TYR P 25 -3.749 -13.345 -17.400 1.00 15.00 C ATOM 1382 CD1 TYR P 25 -3.613 -13.287 -16.019 1.00 15.00 C ATOM 1383 CD2 TYR P 25 -4.367 -14.459 -17.953 1.00 15.00 C ATOM 1384 CE1 TYR P 25 -4.077 -14.308 -15.213 1.00 15.00 C ATOM 1385 CE2 TYR P 25 -4.836 -15.484 -17.153 1.00 15.00 C ATOM 1386 CZ TYR P 25 -4.688 -15.404 -15.784 1.00 15.00 C ATOM 1387 OH TYR P 25 -5.153 -16.424 -14.985 1.00 15.00 O ATOM 0 H TYR P 25 -5.773 -11.138 -17.025 1.00 15.00 H new ATOM 0 HA TYR P 25 -3.435 -10.103 -18.388 1.00 15.00 H new ATOM 0 HB2 TYR P 25 -3.149 -12.588 -19.298 1.00 15.00 H new ATOM 0 HB3 TYR P 25 -2.226 -11.960 -17.947 1.00 15.00 H new ATOM 0 HD1 TYR P 25 -3.136 -12.429 -15.568 1.00 15.00 H new ATOM 0 HD2 TYR P 25 -4.483 -14.525 -19.025 1.00 15.00 H new ATOM 0 HE1 TYR P 25 -3.962 -14.248 -14.141 1.00 15.00 H new ATOM 0 HE2 TYR P 25 -5.316 -16.343 -17.598 1.00 15.00 H new ATOM 0 HH TYR P 25 -5.941 -16.118 -14.489 1.00 15.00 H new ATOM 1397 N PRO P 26 -4.915 -10.096 -20.418 1.00 15.00 N ATOM 1398 CA PRO P 26 -5.802 -10.019 -21.588 1.00 15.00 C ATOM 1399 C PRO P 26 -5.811 -11.328 -22.382 1.00 15.00 C ATOM 1400 O PRO P 26 -5.567 -12.400 -21.827 1.00 15.00 O ATOM 1401 CB PRO P 26 -5.193 -8.854 -22.401 1.00 15.00 C ATOM 1402 CG PRO P 26 -3.785 -8.775 -21.941 1.00 15.00 C ATOM 1403 CD PRO P 26 -3.840 -9.091 -20.484 1.00 15.00 C ATOM 0 HA PRO P 26 -6.847 -9.857 -21.326 1.00 15.00 H new ATOM 0 HB2 PRO P 26 -5.250 -9.046 -23.473 1.00 15.00 H new ATOM 0 HB3 PRO P 26 -5.724 -7.920 -22.215 1.00 15.00 H new ATOM 0 HG2 PRO P 26 -3.154 -9.485 -22.476 1.00 15.00 H new ATOM 0 HG3 PRO P 26 -3.367 -7.783 -22.115 1.00 15.00 H new ATOM 0 HD2 PRO P 26 -2.892 -9.486 -20.118 1.00 15.00 H new ATOM 0 HD3 PRO P 26 -4.071 -8.210 -19.886 1.00 15.00 H new ATOM 1411 N SER P 27 -6.051 -11.233 -23.683 1.00 15.00 N ATOM 1412 CA SER P 27 -6.052 -12.372 -24.578 1.00 15.00 C ATOM 1413 C SER P 27 -5.472 -11.881 -25.893 1.00 15.00 C ATOM 1414 O SER P 27 -5.265 -10.678 -26.047 1.00 15.00 O ATOM 1415 CB SER P 27 -7.469 -12.916 -24.781 1.00 15.00 C ATOM 1416 OG SER P 27 -7.466 -14.041 -25.642 1.00 15.00 O ATOM 0 H SER P 27 -6.253 -10.348 -24.148 1.00 15.00 H new ATOM 0 HA SER P 27 -5.463 -13.191 -24.165 1.00 15.00 H new ATOM 0 HB2 SER P 27 -7.897 -13.193 -23.817 1.00 15.00 H new ATOM 0 HB3 SER P 27 -8.105 -12.136 -25.200 1.00 15.00 H new ATOM 0 HG SER P 27 -8.382 -14.370 -25.754 1.00 15.00 H new ATOM 1422 N GLU P 28 -5.216 -12.758 -26.847 1.00 15.00 N ATOM 1423 CA GLU P 28 -4.658 -12.308 -28.117 1.00 15.00 C ATOM 1424 C GLU P 28 -5.496 -11.184 -28.711 1.00 15.00 C ATOM 1425 O GLU P 28 -4.980 -10.109 -29.010 1.00 15.00 O ATOM 1426 CB GLU P 28 -4.548 -13.470 -29.104 1.00 15.00 C ATOM 1427 CG GLU P 28 -3.651 -14.597 -28.619 1.00 15.00 C ATOM 1428 CD GLU P 28 -3.557 -15.737 -29.615 1.00 15.00 C ATOM 1429 OE1 GLU P 28 -3.106 -15.494 -30.755 1.00 15.00 O ATOM 1430 OE2 GLU P 28 -3.933 -16.873 -29.256 1.00 15.00 O ATOM 0 H GLU P 28 -5.379 -13.762 -26.775 1.00 15.00 H new ATOM 0 HA GLU P 28 -3.656 -11.923 -27.925 1.00 15.00 H new ATOM 0 HB2 GLU P 28 -5.544 -13.867 -29.297 1.00 15.00 H new ATOM 0 HB3 GLU P 28 -4.165 -13.095 -30.053 1.00 15.00 H new ATOM 0 HG2 GLU P 28 -2.653 -14.204 -28.426 1.00 15.00 H new ATOM 0 HG3 GLU P 28 -4.032 -14.978 -27.671 1.00 15.00 H new ATOM 1437 N GLU P 29 -6.786 -11.433 -28.878 1.00 15.00 N ATOM 1438 CA GLU P 29 -7.679 -10.428 -29.436 1.00 15.00 C ATOM 1439 C GLU P 29 -7.906 -9.286 -28.449 1.00 15.00 C ATOM 1440 O GLU P 29 -8.236 -8.170 -28.852 1.00 15.00 O ATOM 1441 CB GLU P 29 -9.015 -11.060 -29.827 1.00 15.00 C ATOM 1442 CG GLU P 29 -9.755 -11.692 -28.658 1.00 15.00 C ATOM 1443 CD GLU P 29 -11.076 -12.313 -29.068 1.00 15.00 C ATOM 1444 OE1 GLU P 29 -11.417 -12.252 -30.268 1.00 15.00 O ATOM 1445 OE2 GLU P 29 -11.772 -12.863 -28.187 1.00 15.00 O ATOM 0 H GLU P 29 -7.236 -12.316 -28.637 1.00 15.00 H new ATOM 0 HA GLU P 29 -7.207 -10.018 -30.329 1.00 15.00 H new ATOM 0 HB2 GLU P 29 -9.650 -10.298 -30.278 1.00 15.00 H new ATOM 0 HB3 GLU P 29 -8.839 -11.820 -30.588 1.00 15.00 H new ATOM 0 HG2 GLU P 29 -9.124 -12.457 -28.205 1.00 15.00 H new ATOM 0 HG3 GLU P 29 -9.936 -10.934 -27.895 1.00 15.00 H new ATOM 1452 N ALA P 30 -7.721 -9.559 -27.159 1.00 15.00 N ATOM 1453 CA ALA P 30 -7.905 -8.532 -26.140 1.00 15.00 C ATOM 1454 C ALA P 30 -6.766 -7.528 -26.186 1.00 15.00 C ATOM 1455 O ALA P 30 -6.992 -6.327 -26.310 1.00 15.00 O ATOM 1456 CB ALA P 30 -8.011 -9.145 -24.754 1.00 15.00 C ATOM 0 H ALA P 30 -7.447 -10.473 -26.799 1.00 15.00 H new ATOM 0 HA ALA P 30 -8.840 -8.014 -26.353 1.00 15.00 H new ATOM 0 HB1 ALA P 30 -8.148 -8.355 -24.016 1.00 15.00 H new ATOM 0 HB2 ALA P 30 -8.863 -9.824 -24.721 1.00 15.00 H new ATOM 0 HB3 ALA P 30 -7.098 -9.697 -24.530 1.00 15.00 H new ATOM 1462 N LYS P 31 -5.536 -8.025 -26.110 1.00 15.00 N ATOM 1463 CA LYS P 31 -4.378 -7.146 -26.166 1.00 15.00 C ATOM 1464 C LYS P 31 -4.338 -6.404 -27.497 1.00 15.00 C ATOM 1465 O LYS P 31 -3.755 -5.326 -27.605 1.00 15.00 O ATOM 1466 CB LYS P 31 -3.085 -7.914 -25.903 1.00 15.00 C ATOM 1467 CG LYS P 31 -2.971 -9.240 -26.638 1.00 15.00 C ATOM 1468 CD LYS P 31 -2.659 -10.389 -25.681 1.00 15.00 C ATOM 1469 CE LYS P 31 -1.467 -10.084 -24.783 1.00 15.00 C ATOM 1470 NZ LYS P 31 -1.092 -11.254 -23.943 1.00 15.00 N ATOM 0 H LYS P 31 -5.319 -9.017 -26.011 1.00 15.00 H new ATOM 0 HA LYS P 31 -4.470 -6.404 -25.373 1.00 15.00 H new ATOM 0 HB2 LYS P 31 -2.241 -7.284 -26.185 1.00 15.00 H new ATOM 0 HB3 LYS P 31 -3.000 -8.100 -24.832 1.00 15.00 H new ATOM 0 HG2 LYS P 31 -3.903 -9.447 -27.164 1.00 15.00 H new ATOM 0 HG3 LYS P 31 -2.188 -9.172 -27.393 1.00 15.00 H new ATOM 0 HD2 LYS P 31 -3.534 -10.593 -25.064 1.00 15.00 H new ATOM 0 HD3 LYS P 31 -2.457 -11.293 -26.255 1.00 15.00 H new ATOM 0 HE2 LYS P 31 -0.616 -9.790 -25.397 1.00 15.00 H new ATOM 0 HE3 LYS P 31 -1.704 -9.236 -24.140 1.00 15.00 H new ATOM 0 HZ1 LYS P 31 -0.182 -11.068 -23.475 1.00 15.00 H new ATOM 0 HZ2 LYS P 31 -1.826 -11.414 -23.223 1.00 15.00 H new ATOM 0 HZ3 LYS P 31 -1.006 -12.099 -24.543 1.00 15.00 H new ATOM 1484 N GLU P 32 -5.012 -6.969 -28.496 1.00 15.00 N ATOM 1485 CA GLU P 32 -5.104 -6.337 -29.802 1.00 15.00 C ATOM 1486 C GLU P 32 -6.099 -5.185 -29.729 1.00 15.00 C ATOM 1487 O GLU P 32 -5.752 -4.033 -29.976 1.00 15.00 O ATOM 1488 CB GLU P 32 -5.524 -7.344 -30.874 1.00 15.00 C ATOM 1489 CG GLU P 32 -4.411 -8.295 -31.284 1.00 15.00 C ATOM 1490 CD GLU P 32 -4.859 -9.307 -32.320 1.00 15.00 C ATOM 1491 OE1 GLU P 32 -5.793 -10.082 -32.030 1.00 15.00 O ATOM 1492 OE2 GLU P 32 -4.274 -9.323 -33.425 1.00 15.00 O ATOM 0 H GLU P 32 -5.500 -7.862 -28.423 1.00 15.00 H new ATOM 0 HA GLU P 32 -4.122 -5.954 -30.081 1.00 15.00 H new ATOM 0 HB2 GLU P 32 -6.369 -7.925 -30.504 1.00 15.00 H new ATOM 0 HB3 GLU P 32 -5.870 -6.802 -31.754 1.00 15.00 H new ATOM 0 HG2 GLU P 32 -3.575 -7.720 -31.682 1.00 15.00 H new ATOM 0 HG3 GLU P 32 -4.045 -8.821 -30.402 1.00 15.00 H new ATOM 1499 N GLU P 33 -7.340 -5.503 -29.372 1.00 15.00 N ATOM 1500 CA GLU P 33 -8.381 -4.492 -29.249 1.00 15.00 C ATOM 1501 C GLU P 33 -7.966 -3.446 -28.225 1.00 15.00 C ATOM 1502 O GLU P 33 -8.040 -2.246 -28.486 1.00 15.00 O ATOM 1503 CB GLU P 33 -9.713 -5.130 -28.846 1.00 15.00 C ATOM 1504 CG GLU P 33 -9.679 -5.809 -27.488 1.00 15.00 C ATOM 1505 CD GLU P 33 -10.985 -6.505 -27.153 1.00 15.00 C ATOM 1506 OE1 GLU P 33 -12.026 -5.815 -27.092 1.00 15.00 O ATOM 1507 OE2 GLU P 33 -10.968 -7.737 -26.952 1.00 15.00 O ATOM 0 H GLU P 33 -7.647 -6.453 -29.163 1.00 15.00 H new ATOM 0 HA GLU P 33 -8.515 -4.010 -30.218 1.00 15.00 H new ATOM 0 HB2 GLU P 33 -10.486 -4.362 -28.839 1.00 15.00 H new ATOM 0 HB3 GLU P 33 -9.998 -5.862 -29.601 1.00 15.00 H new ATOM 0 HG2 GLU P 33 -8.868 -6.537 -27.470 1.00 15.00 H new ATOM 0 HG3 GLU P 33 -9.459 -5.067 -26.720 1.00 15.00 H new ATOM 1514 N LEU P 34 -7.504 -3.909 -27.064 1.00 15.00 N ATOM 1515 CA LEU P 34 -7.051 -3.009 -26.013 1.00 15.00 C ATOM 1516 C LEU P 34 -5.989 -2.066 -26.567 1.00 15.00 C ATOM 1517 O LEU P 34 -6.143 -0.848 -26.531 1.00 15.00 O ATOM 1518 CB LEU P 34 -6.475 -3.806 -24.831 1.00 15.00 C ATOM 1519 CG LEU P 34 -7.478 -4.677 -24.060 1.00 15.00 C ATOM 1520 CD1 LEU P 34 -6.775 -5.461 -22.956 1.00 15.00 C ATOM 1521 CD2 LEU P 34 -8.587 -3.820 -23.478 1.00 15.00 C ATOM 0 H LEU P 34 -7.435 -4.900 -26.831 1.00 15.00 H new ATOM 0 HA LEU P 34 -7.903 -2.429 -25.658 1.00 15.00 H new ATOM 0 HB2 LEU P 34 -5.677 -4.448 -25.204 1.00 15.00 H new ATOM 0 HB3 LEU P 34 -6.019 -3.105 -24.132 1.00 15.00 H new ATOM 0 HG LEU P 34 -7.919 -5.389 -24.757 1.00 15.00 H new ATOM 0 HD11 LEU P 34 -7.504 -6.071 -22.422 1.00 15.00 H new ATOM 0 HD12 LEU P 34 -6.014 -6.106 -23.396 1.00 15.00 H new ATOM 0 HD13 LEU P 34 -6.304 -4.767 -22.260 1.00 15.00 H new ATOM 0 HD21 LEU P 34 -9.289 -4.453 -22.935 1.00 15.00 H new ATOM 0 HD22 LEU P 34 -8.159 -3.085 -22.796 1.00 15.00 H new ATOM 0 HD23 LEU P 34 -9.111 -3.306 -24.284 1.00 15.00 H new ATOM 1533 N ALA P 35 -4.905 -2.646 -27.070 1.00 15.00 N ATOM 1534 CA ALA P 35 -3.802 -1.873 -27.626 1.00 15.00 C ATOM 1535 C ALA P 35 -4.255 -0.927 -28.735 1.00 15.00 C ATOM 1536 O ALA P 35 -3.688 0.153 -28.904 1.00 15.00 O ATOM 1537 CB ALA P 35 -2.715 -2.803 -28.140 1.00 15.00 C ATOM 0 H ALA P 35 -4.767 -3.656 -27.104 1.00 15.00 H new ATOM 0 HA ALA P 35 -3.403 -1.257 -26.820 1.00 15.00 H new ATOM 0 HB1 ALA P 35 -1.897 -2.213 -28.553 1.00 15.00 H new ATOM 0 HB2 ALA P 35 -2.342 -3.416 -27.319 1.00 15.00 H new ATOM 0 HB3 ALA P 35 -3.125 -3.448 -28.917 1.00 15.00 H new ATOM 1543 N LYS P 36 -5.277 -1.324 -29.487 1.00 15.00 N ATOM 1544 CA LYS P 36 -5.791 -0.492 -30.570 1.00 15.00 C ATOM 1545 C LYS P 36 -6.610 0.642 -29.986 1.00 15.00 C ATOM 1546 O LYS P 36 -6.468 1.807 -30.359 1.00 15.00 O ATOM 1547 CB LYS P 36 -6.660 -1.324 -31.523 1.00 15.00 C ATOM 1548 CG LYS P 36 -5.931 -2.453 -32.256 1.00 15.00 C ATOM 1549 CD LYS P 36 -4.455 -2.552 -31.889 1.00 15.00 C ATOM 1550 CE LYS P 36 -3.748 -3.609 -32.723 1.00 15.00 C ATOM 1551 NZ LYS P 36 -3.817 -3.304 -34.179 1.00 15.00 N ATOM 0 H LYS P 36 -5.764 -2.212 -29.367 1.00 15.00 H new ATOM 0 HA LYS P 36 -4.951 -0.086 -31.134 1.00 15.00 H new ATOM 0 HB2 LYS P 36 -7.484 -1.755 -30.954 1.00 15.00 H new ATOM 0 HB3 LYS P 36 -7.099 -0.656 -32.264 1.00 15.00 H new ATOM 0 HG2 LYS P 36 -6.420 -3.400 -32.028 1.00 15.00 H new ATOM 0 HG3 LYS P 36 -6.022 -2.298 -33.331 1.00 15.00 H new ATOM 0 HD2 LYS P 36 -3.975 -1.585 -32.040 1.00 15.00 H new ATOM 0 HD3 LYS P 36 -4.357 -2.795 -30.831 1.00 15.00 H new ATOM 0 HE2 LYS P 36 -2.705 -3.677 -32.415 1.00 15.00 H new ATOM 0 HE3 LYS P 36 -4.200 -4.583 -32.534 1.00 15.00 H new ATOM 0 HZ1 LYS P 36 -3.079 -3.838 -34.681 1.00 15.00 H new ATOM 0 HZ2 LYS P 36 -4.751 -3.575 -34.547 1.00 15.00 H new ATOM 0 HZ3 LYS P 36 -3.669 -2.285 -34.328 1.00 15.00 H new ATOM 1565 N LYS P 37 -7.468 0.259 -29.061 1.00 15.00 N ATOM 1566 CA LYS P 37 -8.354 1.176 -28.370 1.00 15.00 C ATOM 1567 C LYS P 37 -7.576 2.151 -27.492 1.00 15.00 C ATOM 1568 O LYS P 37 -7.848 3.352 -27.475 1.00 15.00 O ATOM 1569 CB LYS P 37 -9.308 0.356 -27.509 1.00 15.00 C ATOM 1570 CG LYS P 37 -10.502 -0.203 -28.266 1.00 15.00 C ATOM 1571 CD LYS P 37 -11.314 -1.152 -27.398 1.00 15.00 C ATOM 1572 CE LYS P 37 -11.801 -0.468 -26.131 1.00 15.00 C ATOM 1573 NZ LYS P 37 -12.713 0.671 -26.428 1.00 15.00 N ATOM 0 H LYS P 37 -7.571 -0.711 -28.764 1.00 15.00 H new ATOM 0 HA LYS P 37 -8.903 1.764 -29.106 1.00 15.00 H new ATOM 0 HB2 LYS P 37 -8.757 -0.470 -27.060 1.00 15.00 H new ATOM 0 HB3 LYS P 37 -9.669 0.979 -26.691 1.00 15.00 H new ATOM 0 HG2 LYS P 37 -11.136 0.616 -28.604 1.00 15.00 H new ATOM 0 HG3 LYS P 37 -10.157 -0.728 -29.157 1.00 15.00 H new ATOM 0 HD2 LYS P 37 -12.168 -1.523 -27.964 1.00 15.00 H new ATOM 0 HD3 LYS P 37 -10.705 -2.017 -27.135 1.00 15.00 H new ATOM 0 HE2 LYS P 37 -12.319 -1.193 -25.504 1.00 15.00 H new ATOM 0 HE3 LYS P 37 -10.944 -0.108 -25.561 1.00 15.00 H new ATOM 0 HZ1 LYS P 37 -13.128 1.023 -25.542 1.00 15.00 H new ATOM 0 HZ2 LYS P 37 -12.177 1.435 -26.887 1.00 15.00 H new ATOM 0 HZ3 LYS P 37 -13.472 0.351 -27.063 1.00 15.00 H new ATOM 1587 N SER P 38 -6.623 1.610 -26.751 1.00 15.00 N ATOM 1588 CA SER P 38 -5.798 2.385 -25.841 1.00 15.00 C ATOM 1589 C SER P 38 -4.763 3.227 -26.579 1.00 15.00 C ATOM 1590 O SER P 38 -4.622 4.423 -26.325 1.00 15.00 O ATOM 1591 CB SER P 38 -5.095 1.424 -24.883 1.00 15.00 C ATOM 1592 OG SER P 38 -6.005 0.876 -23.945 1.00 15.00 O ATOM 0 H SER P 38 -6.399 0.615 -26.765 1.00 15.00 H new ATOM 0 HA SER P 38 -6.442 3.074 -25.295 1.00 15.00 H new ATOM 0 HB2 SER P 38 -4.626 0.620 -25.450 1.00 15.00 H new ATOM 0 HB3 SER P 38 -4.299 1.950 -24.356 1.00 15.00 H new ATOM 0 HG SER P 38 -5.907 -0.099 -23.925 1.00 15.00 H new ATOM 1598 N GLY P 39 -4.019 2.582 -27.464 1.00 15.00 N ATOM 1599 CA GLY P 39 -2.971 3.267 -28.201 1.00 15.00 C ATOM 1600 C GLY P 39 -1.602 2.749 -27.806 1.00 15.00 C ATOM 1601 O GLY P 39 -0.584 3.409 -28.017 1.00 15.00 O ATOM 0 H GLY P 39 -4.121 1.592 -27.688 1.00 15.00 H new ATOM 0 HA2 GLY P 39 -3.122 3.126 -29.271 1.00 15.00 H new ATOM 0 HA3 GLY P 39 -3.028 4.339 -28.010 1.00 15.00 H new ATOM 1605 N ILE P 40 -1.596 1.549 -27.234 1.00 15.00 N ATOM 1606 CA ILE P 40 -0.380 0.885 -26.793 1.00 15.00 C ATOM 1607 C ILE P 40 -0.080 -0.288 -27.717 1.00 15.00 C ATOM 1608 O ILE P 40 -0.636 -0.382 -28.812 1.00 15.00 O ATOM 1609 CB ILE P 40 -0.544 0.361 -25.345 1.00 15.00 C ATOM 1610 CG1 ILE P 40 -1.797 -0.515 -25.255 1.00 15.00 C ATOM 1611 CG2 ILE P 40 -0.620 1.519 -24.360 1.00 15.00 C ATOM 1612 CD1 ILE P 40 -2.081 -1.047 -23.869 1.00 15.00 C ATOM 0 H ILE P 40 -2.444 1.008 -27.063 1.00 15.00 H new ATOM 0 HA ILE P 40 0.440 1.602 -26.821 1.00 15.00 H new ATOM 0 HB ILE P 40 0.326 -0.241 -25.083 1.00 15.00 H new ATOM 0 HG12 ILE P 40 -2.657 0.064 -25.593 1.00 15.00 H new ATOM 0 HG13 ILE P 40 -1.689 -1.356 -25.940 1.00 15.00 H new ATOM 0 HG21 ILE P 40 -0.735 1.129 -23.349 1.00 15.00 H new ATOM 0 HG22 ILE P 40 0.295 2.108 -24.420 1.00 15.00 H new ATOM 0 HG23 ILE P 40 -1.474 2.150 -24.605 1.00 15.00 H new ATOM 0 HD11 ILE P 40 -2.984 -1.657 -23.891 1.00 15.00 H new ATOM 0 HD12 ILE P 40 -1.241 -1.655 -23.533 1.00 15.00 H new ATOM 0 HD13 ILE P 40 -2.223 -0.213 -23.181 1.00 15.00 H new ATOM 1624 N THR P 41 0.761 -1.205 -27.263 1.00 15.00 N ATOM 1625 CA THR P 41 1.079 -2.386 -28.036 1.00 15.00 C ATOM 1626 C THR P 41 0.709 -3.610 -27.219 1.00 15.00 C ATOM 1627 O THR P 41 0.836 -3.603 -25.996 1.00 15.00 O ATOM 1628 CB THR P 41 2.561 -2.418 -28.414 1.00 15.00 C ATOM 1629 OG1 THR P 41 2.841 -3.536 -29.238 1.00 15.00 O ATOM 1630 CG2 THR P 41 3.485 -2.492 -27.221 1.00 15.00 C ATOM 0 H THR P 41 1.234 -1.150 -26.361 1.00 15.00 H new ATOM 0 HA THR P 41 0.510 -2.373 -28.966 1.00 15.00 H new ATOM 0 HB THR P 41 2.744 -1.479 -28.937 1.00 15.00 H new ATOM 0 HG1 THR P 41 3.793 -3.540 -29.472 1.00 15.00 H new ATOM 0 HG21 THR P 41 4.520 -2.511 -27.563 1.00 15.00 H new ATOM 0 HG22 THR P 41 3.329 -1.620 -26.585 1.00 15.00 H new ATOM 0 HG23 THR P 41 3.274 -3.398 -26.653 1.00 15.00 H new ATOM 1638 N VAL P 42 0.245 -4.651 -27.896 1.00 15.00 N ATOM 1639 CA VAL P 42 -0.155 -5.894 -27.234 1.00 15.00 C ATOM 1640 C VAL P 42 0.604 -6.107 -25.915 1.00 15.00 C ATOM 1641 O VAL P 42 0.038 -5.964 -24.832 1.00 15.00 O ATOM 1642 CB VAL P 42 0.059 -7.110 -28.168 1.00 15.00 C ATOM 1643 CG1 VAL P 42 0.049 -8.414 -27.384 1.00 15.00 C ATOM 1644 CG2 VAL P 42 -1.010 -7.134 -29.253 1.00 15.00 C ATOM 0 H VAL P 42 0.134 -4.663 -28.910 1.00 15.00 H new ATOM 0 HA VAL P 42 -1.217 -5.806 -27.003 1.00 15.00 H new ATOM 0 HB VAL P 42 1.037 -7.009 -28.638 1.00 15.00 H new ATOM 0 HG11 VAL P 42 0.202 -9.250 -28.067 1.00 15.00 H new ATOM 0 HG12 VAL P 42 0.849 -8.399 -26.644 1.00 15.00 H new ATOM 0 HG13 VAL P 42 -0.910 -8.528 -26.880 1.00 15.00 H new ATOM 0 HG21 VAL P 42 -0.849 -7.994 -29.904 1.00 15.00 H new ATOM 0 HG22 VAL P 42 -1.995 -7.207 -28.792 1.00 15.00 H new ATOM 0 HG23 VAL P 42 -0.952 -6.218 -29.841 1.00 15.00 H new ATOM 1654 N SER P 43 1.874 -6.473 -26.026 1.00 15.00 N ATOM 1655 CA SER P 43 2.719 -6.739 -24.859 1.00 15.00 C ATOM 1656 C SER P 43 2.552 -5.708 -23.735 1.00 15.00 C ATOM 1657 O SER P 43 2.678 -6.058 -22.561 1.00 15.00 O ATOM 1658 CB SER P 43 4.187 -6.806 -25.281 1.00 15.00 C ATOM 1659 OG SER P 43 4.396 -7.835 -26.233 1.00 15.00 O ATOM 0 H SER P 43 2.350 -6.595 -26.920 1.00 15.00 H new ATOM 0 HA SER P 43 2.394 -7.698 -24.456 1.00 15.00 H new ATOM 0 HB2 SER P 43 4.492 -5.848 -25.703 1.00 15.00 H new ATOM 0 HB3 SER P 43 4.813 -6.983 -24.406 1.00 15.00 H new ATOM 0 HG SER P 43 5.342 -7.857 -26.489 1.00 15.00 H new ATOM 1665 N GLN P 44 2.260 -4.453 -24.071 1.00 15.00 N ATOM 1666 CA GLN P 44 2.077 -3.436 -23.039 1.00 15.00 C ATOM 1667 C GLN P 44 0.834 -3.741 -22.216 1.00 15.00 C ATOM 1668 O GLN P 44 0.803 -3.512 -21.007 1.00 15.00 O ATOM 1669 CB GLN P 44 1.987 -2.038 -23.652 1.00 15.00 C ATOM 1670 CG GLN P 44 3.324 -1.513 -24.151 1.00 15.00 C ATOM 1671 CD GLN P 44 3.210 -0.152 -24.808 1.00 15.00 C ATOM 1672 OE1 GLN P 44 2.456 0.029 -25.763 1.00 15.00 O ATOM 1673 NE2 GLN P 44 3.969 0.814 -24.303 1.00 15.00 N ATOM 0 H GLN P 44 2.147 -4.121 -25.029 1.00 15.00 H new ATOM 0 HA GLN P 44 2.947 -3.456 -22.382 1.00 15.00 H new ATOM 0 HB2 GLN P 44 1.280 -2.057 -24.481 1.00 15.00 H new ATOM 0 HB3 GLN P 44 1.588 -1.348 -22.909 1.00 15.00 H new ATOM 0 HG2 GLN P 44 4.020 -1.451 -23.315 1.00 15.00 H new ATOM 0 HG3 GLN P 44 3.745 -2.222 -24.864 1.00 15.00 H new ATOM 0 HE21 GLN P 44 4.580 0.620 -23.510 1.00 15.00 H new ATOM 0 HE22 GLN P 44 3.940 1.750 -24.708 1.00 15.00 H new ATOM 1682 N VAL P 45 -0.187 -4.264 -22.882 1.00 15.00 N ATOM 1683 CA VAL P 45 -1.432 -4.607 -22.215 1.00 15.00 C ATOM 1684 C VAL P 45 -1.203 -5.665 -21.143 1.00 15.00 C ATOM 1685 O VAL P 45 -1.507 -5.443 -19.972 1.00 15.00 O ATOM 1686 CB VAL P 45 -2.487 -5.107 -23.216 1.00 15.00 C ATOM 1687 CG1 VAL P 45 -3.794 -5.412 -22.510 1.00 15.00 C ATOM 1688 CG2 VAL P 45 -2.699 -4.074 -24.307 1.00 15.00 C ATOM 0 H VAL P 45 -0.176 -4.459 -23.883 1.00 15.00 H new ATOM 0 HA VAL P 45 -1.804 -3.698 -21.744 1.00 15.00 H new ATOM 0 HB VAL P 45 -2.125 -6.029 -23.671 1.00 15.00 H new ATOM 0 HG11 VAL P 45 -4.526 -5.764 -23.236 1.00 15.00 H new ATOM 0 HG12 VAL P 45 -3.630 -6.183 -21.757 1.00 15.00 H new ATOM 0 HG13 VAL P 45 -4.167 -4.508 -22.028 1.00 15.00 H new ATOM 0 HG21 VAL P 45 -3.448 -4.437 -25.011 1.00 15.00 H new ATOM 0 HG22 VAL P 45 -3.042 -3.140 -23.862 1.00 15.00 H new ATOM 0 HG23 VAL P 45 -1.760 -3.902 -24.833 1.00 15.00 H new ATOM 1698 N SER P 46 -0.654 -6.814 -21.537 1.00 15.00 N ATOM 1699 CA SER P 46 -0.383 -7.881 -20.579 1.00 15.00 C ATOM 1700 C SER P 46 0.412 -7.322 -19.406 1.00 15.00 C ATOM 1701 O SER P 46 0.017 -7.448 -18.246 1.00 15.00 O ATOM 1702 CB SER P 46 0.391 -9.020 -21.245 1.00 15.00 C ATOM 1703 OG SER P 46 0.658 -10.064 -20.324 1.00 15.00 O ATOM 0 H SER P 46 -0.392 -7.027 -22.500 1.00 15.00 H new ATOM 0 HA SER P 46 -1.331 -8.279 -20.217 1.00 15.00 H new ATOM 0 HB2 SER P 46 -0.183 -9.411 -22.086 1.00 15.00 H new ATOM 0 HB3 SER P 46 1.329 -8.639 -21.649 1.00 15.00 H new ATOM 0 HG SER P 46 1.152 -10.780 -20.775 1.00 15.00 H new ATOM 1709 N ASN P 47 1.531 -6.689 -19.734 1.00 15.00 N ATOM 1710 CA ASN P 47 2.393 -6.083 -18.727 1.00 15.00 C ATOM 1711 C ASN P 47 1.566 -5.187 -17.804 1.00 15.00 C ATOM 1712 O ASN P 47 1.623 -5.310 -16.580 1.00 15.00 O ATOM 1713 CB ASN P 47 3.503 -5.267 -19.401 1.00 15.00 C ATOM 1714 CG ASN P 47 4.557 -4.742 -18.431 1.00 15.00 C ATOM 1715 OD1 ASN P 47 4.492 -5.155 -17.166 1.00 15.00 O flip ATOM 1716 ND2 ASN P 47 5.437 -3.976 -18.824 1.00 15.00 N flip ATOM 0 H ASN P 47 1.864 -6.582 -20.692 1.00 15.00 H new ATOM 0 HA ASN P 47 2.853 -6.874 -18.134 1.00 15.00 H new ATOM 0 HB2 ASN P 47 3.991 -5.887 -20.153 1.00 15.00 H new ATOM 0 HB3 ASN P 47 3.054 -4.424 -19.926 1.00 15.00 H new ATOM 0 HD21 ASN P 47 5.457 -3.680 -19.800 1.00 15.00 H new ATOM 0 HD22 ASN P 47 6.146 -3.638 -18.174 1.00 15.00 H new ATOM 1723 N TRP P 48 0.783 -4.300 -18.413 1.00 15.00 N ATOM 1724 CA TRP P 48 -0.083 -3.383 -17.674 1.00 15.00 C ATOM 1725 C TRP P 48 -1.047 -4.146 -16.771 1.00 15.00 C ATOM 1726 O TRP P 48 -1.114 -3.908 -15.566 1.00 15.00 O ATOM 1727 CB TRP P 48 -0.893 -2.535 -18.651 1.00 15.00 C ATOM 1728 CG TRP P 48 -1.633 -1.404 -18.003 1.00 15.00 C ATOM 1729 CD1 TRP P 48 -1.148 -0.159 -17.724 1.00 15.00 C ATOM 1730 CD2 TRP P 48 -2.985 -1.422 -17.528 1.00 15.00 C ATOM 1731 NE1 TRP P 48 -2.124 0.608 -17.139 1.00 15.00 N ATOM 1732 CE2 TRP P 48 -3.258 -0.146 -17.001 1.00 15.00 C ATOM 1733 CE3 TRP P 48 -3.993 -2.388 -17.508 1.00 15.00 C ATOM 1734 CZ2 TRP P 48 -4.497 0.187 -16.461 1.00 15.00 C ATOM 1735 CZ3 TRP P 48 -5.222 -2.058 -16.968 1.00 15.00 C ATOM 1736 CH2 TRP P 48 -5.465 -0.779 -16.452 1.00 15.00 C ATOM 0 H TRP P 48 0.730 -4.196 -19.426 1.00 15.00 H new ATOM 0 HA TRP P 48 0.552 -2.746 -17.058 1.00 15.00 H new ATOM 0 HB2 TRP P 48 -0.222 -2.131 -19.409 1.00 15.00 H new ATOM 0 HB3 TRP P 48 -1.608 -3.176 -19.167 1.00 15.00 H new ATOM 0 HD1 TRP P 48 -0.142 0.174 -17.933 1.00 15.00 H new ATOM 0 HE1 TRP P 48 -2.021 1.582 -16.853 1.00 15.00 H new ATOM 0 HE3 TRP P 48 -3.816 -3.376 -17.907 1.00 15.00 H new ATOM 0 HZ2 TRP P 48 -4.687 1.173 -16.063 1.00 15.00 H new ATOM 0 HZ3 TRP P 48 -6.008 -2.799 -16.944 1.00 15.00 H new ATOM 0 HH2 TRP P 48 -6.436 -0.551 -16.039 1.00 15.00 H new ATOM 1747 N PHE P 49 -1.807 -5.052 -17.384 1.00 15.00 N ATOM 1748 CA PHE P 49 -2.797 -5.848 -16.663 1.00 15.00 C ATOM 1749 C PHE P 49 -2.216 -6.445 -15.382 1.00 15.00 C ATOM 1750 O PHE P 49 -2.789 -6.286 -14.306 1.00 15.00 O ATOM 1751 CB PHE P 49 -3.370 -6.940 -17.567 1.00 15.00 C ATOM 1752 CG PHE P 49 -4.533 -6.471 -18.404 1.00 15.00 C ATOM 1753 CD1 PHE P 49 -4.422 -5.356 -19.224 1.00 15.00 C ATOM 1754 CD2 PHE P 49 -5.742 -7.151 -18.369 1.00 15.00 C ATOM 1755 CE1 PHE P 49 -5.493 -4.931 -19.992 1.00 15.00 C ATOM 1756 CE2 PHE P 49 -6.815 -6.729 -19.135 1.00 15.00 C ATOM 1757 CZ PHE P 49 -6.689 -5.620 -19.946 1.00 15.00 C ATOM 0 H PHE P 49 -1.755 -5.253 -18.383 1.00 15.00 H new ATOM 0 HA PHE P 49 -3.609 -5.183 -16.370 1.00 15.00 H new ATOM 0 HB2 PHE P 49 -2.583 -7.308 -18.225 1.00 15.00 H new ATOM 0 HB3 PHE P 49 -3.690 -7.781 -16.952 1.00 15.00 H new ATOM 0 HD1 PHE P 49 -3.489 -4.814 -19.263 1.00 15.00 H new ATOM 0 HD2 PHE P 49 -5.847 -8.020 -17.736 1.00 15.00 H new ATOM 0 HE1 PHE P 49 -5.393 -4.062 -20.626 1.00 15.00 H new ATOM 0 HE2 PHE P 49 -7.750 -7.268 -19.098 1.00 15.00 H new ATOM 0 HZ PHE P 49 -7.525 -5.291 -20.545 1.00 15.00 H new ATOM 1767 N GLY P 50 -1.089 -7.130 -15.489 1.00 15.00 N ATOM 1768 CA GLY P 50 -0.482 -7.724 -14.310 1.00 15.00 C ATOM 1769 C GLY P 50 -0.163 -6.700 -13.228 1.00 15.00 C ATOM 1770 O GLY P 50 -0.292 -6.987 -12.037 1.00 15.00 O ATOM 0 H GLY P 50 -0.585 -7.287 -16.362 1.00 15.00 H new ATOM 0 HA2 GLY P 50 -1.155 -8.479 -13.902 1.00 15.00 H new ATOM 0 HA3 GLY P 50 0.435 -8.237 -14.599 1.00 15.00 H new ATOM 1774 N ASN P 51 0.269 -5.509 -13.639 1.00 15.00 N ATOM 1775 CA ASN P 51 0.629 -4.451 -12.693 1.00 15.00 C ATOM 1776 C ASN P 51 -0.562 -3.944 -11.877 1.00 15.00 C ATOM 1777 O ASN P 51 -0.702 -4.273 -10.699 1.00 15.00 O ATOM 1778 CB ASN P 51 1.278 -3.274 -13.426 1.00 15.00 C ATOM 1779 CG ASN P 51 2.623 -3.630 -14.026 1.00 15.00 C ATOM 1780 OD1 ASN P 51 2.776 -3.385 -15.321 1.00 15.00 O flip ATOM 1781 ND2 ASN P 51 3.519 -4.106 -13.331 1.00 15.00 N flip ATOM 0 H ASN P 51 0.379 -5.251 -14.620 1.00 15.00 H new ATOM 0 HA ASN P 51 1.338 -4.897 -11.995 1.00 15.00 H new ATOM 0 HB2 ASN P 51 0.611 -2.931 -14.217 1.00 15.00 H new ATOM 0 HB3 ASN P 51 1.403 -2.443 -12.732 1.00 15.00 H new ATOM 0 HD21 ASN P 51 3.358 -4.278 -12.339 1.00 15.00 H new ATOM 0 HD22 ASN P 51 4.423 -4.329 -13.747 1.00 15.00 H new ATOM 1788 N LYS P 52 -1.393 -3.103 -12.492 1.00 15.00 N ATOM 1789 CA LYS P 52 -2.542 -2.516 -11.794 1.00 15.00 C ATOM 1790 C LYS P 52 -3.267 -3.520 -10.894 1.00 15.00 C ATOM 1791 O LYS P 52 -3.678 -3.160 -9.791 1.00 15.00 O ATOM 1792 CB LYS P 52 -3.531 -1.835 -12.756 1.00 15.00 C ATOM 1793 CG LYS P 52 -3.330 -2.158 -14.222 1.00 15.00 C ATOM 1794 CD LYS P 52 -3.561 -3.621 -14.507 1.00 15.00 C ATOM 1795 CE LYS P 52 -4.985 -4.033 -14.174 1.00 15.00 C ATOM 1796 NZ LYS P 52 -5.223 -5.480 -14.426 1.00 15.00 N ATOM 0 H LYS P 52 -1.296 -2.813 -13.465 1.00 15.00 H new ATOM 0 HA LYS P 52 -2.123 -1.744 -11.148 1.00 15.00 H new ATOM 0 HB2 LYS P 52 -4.544 -2.121 -12.473 1.00 15.00 H new ATOM 0 HB3 LYS P 52 -3.456 -0.756 -12.625 1.00 15.00 H new ATOM 0 HG2 LYS P 52 -4.012 -1.558 -14.824 1.00 15.00 H new ATOM 0 HG3 LYS P 52 -2.318 -1.885 -14.520 1.00 15.00 H new ATOM 0 HD2 LYS P 52 -3.358 -3.825 -15.558 1.00 15.00 H new ATOM 0 HD3 LYS P 52 -2.862 -4.221 -13.925 1.00 15.00 H new ATOM 0 HE2 LYS P 52 -5.191 -3.809 -13.127 1.00 15.00 H new ATOM 0 HE3 LYS P 52 -5.681 -3.443 -14.769 1.00 15.00 H new ATOM 0 HZ1 LYS P 52 -6.057 -5.793 -13.889 1.00 15.00 H new ATOM 0 HZ2 LYS P 52 -5.387 -5.633 -15.441 1.00 15.00 H new ATOM 0 HZ3 LYS P 52 -4.391 -6.026 -14.124 1.00 15.00 H new ATOM 1810 N ARG P 53 -3.420 -4.777 -11.326 1.00 15.00 N ATOM 1811 CA ARG P 53 -4.089 -5.766 -10.479 1.00 15.00 C ATOM 1812 C ARG P 53 -3.401 -5.778 -9.117 1.00 15.00 C ATOM 1813 O ARG P 53 -4.053 -5.804 -8.078 1.00 15.00 O ATOM 1814 CB ARG P 53 -4.089 -7.160 -11.137 1.00 15.00 C ATOM 1815 CG ARG P 53 -2.850 -8.006 -10.866 1.00 15.00 C ATOM 1816 CD ARG P 53 -2.925 -8.754 -9.535 1.00 15.00 C ATOM 1817 NE ARG P 53 -3.853 -9.885 -9.581 1.00 15.00 N ATOM 1818 CZ ARG P 53 -5.170 -9.788 -9.403 1.00 15.00 C ATOM 1819 NH1 ARG P 53 -5.722 -8.634 -9.052 1.00 15.00 N ATOM 1820 NH2 ARG P 53 -5.934 -10.862 -9.543 1.00 15.00 N ATOM 0 H ARG P 53 -3.100 -5.125 -12.230 1.00 15.00 H new ATOM 0 HA ARG P 53 -5.136 -5.493 -10.349 1.00 15.00 H new ATOM 0 HB2 ARG P 53 -4.966 -7.707 -10.791 1.00 15.00 H new ATOM 0 HB3 ARG P 53 -4.196 -7.035 -12.215 1.00 15.00 H new ATOM 0 HG2 ARG P 53 -2.722 -8.725 -11.675 1.00 15.00 H new ATOM 0 HG3 ARG P 53 -1.969 -7.364 -10.868 1.00 15.00 H new ATOM 0 HD2 ARG P 53 -1.931 -9.114 -9.267 1.00 15.00 H new ATOM 0 HD3 ARG P 53 -3.236 -8.064 -8.751 1.00 15.00 H new ATOM 0 HE ARG P 53 -3.465 -10.811 -9.762 1.00 15.00 H new ATOM 0 HH11 ARG P 53 -5.137 -7.809 -8.916 1.00 15.00 H new ATOM 0 HH12 ARG P 53 -6.731 -8.571 -8.918 1.00 15.00 H new ATOM 0 HH21 ARG P 53 -5.513 -11.759 -9.786 1.00 15.00 H new ATOM 0 HH22 ARG P 53 -6.943 -10.792 -9.408 1.00 15.00 H new ATOM 1834 N ILE P 54 -2.070 -5.800 -9.130 1.00 15.00 N ATOM 1835 CA ILE P 54 -1.316 -5.852 -7.892 1.00 15.00 C ATOM 1836 C ILE P 54 -1.757 -4.727 -6.962 1.00 15.00 C ATOM 1837 O ILE P 54 -2.114 -4.990 -5.819 1.00 15.00 O ATOM 1838 CB ILE P 54 0.208 -5.704 -8.132 1.00 15.00 C ATOM 1839 CG1 ILE P 54 0.671 -6.517 -9.343 1.00 15.00 C ATOM 1840 CG2 ILE P 54 0.984 -6.128 -6.893 1.00 15.00 C ATOM 1841 CD1 ILE P 54 0.319 -7.983 -9.272 1.00 15.00 C ATOM 0 H ILE P 54 -1.502 -5.783 -9.977 1.00 15.00 H new ATOM 0 HA ILE P 54 -1.511 -6.827 -7.445 1.00 15.00 H new ATOM 0 HB ILE P 54 0.407 -4.652 -8.338 1.00 15.00 H new ATOM 0 HG12 ILE P 54 0.229 -6.091 -10.244 1.00 15.00 H new ATOM 0 HG13 ILE P 54 1.752 -6.418 -9.442 1.00 15.00 H new ATOM 0 HG21 ILE P 54 2.053 -6.018 -7.078 1.00 15.00 H new ATOM 0 HG22 ILE P 54 0.695 -5.500 -6.050 1.00 15.00 H new ATOM 0 HG23 ILE P 54 0.761 -7.170 -6.663 1.00 15.00 H new ATOM 0 HD11 ILE P 54 0.682 -8.488 -10.167 1.00 15.00 H new ATOM 0 HD12 ILE P 54 0.784 -8.427 -8.391 1.00 15.00 H new ATOM 0 HD13 ILE P 54 -0.763 -8.095 -9.206 1.00 15.00 H new ATOM 1853 N ARG P 55 -1.755 -3.483 -7.447 1.00 15.00 N ATOM 1854 CA ARG P 55 -2.171 -2.356 -6.607 1.00 15.00 C ATOM 1855 C ARG P 55 -3.558 -2.590 -6.001 1.00 15.00 C ATOM 1856 O ARG P 55 -3.876 -2.045 -4.946 1.00 15.00 O ATOM 1857 CB ARG P 55 -2.136 -1.021 -7.360 1.00 15.00 C ATOM 1858 CG ARG P 55 -3.206 -0.855 -8.424 1.00 15.00 C ATOM 1859 CD ARG P 55 -3.615 0.606 -8.549 1.00 15.00 C ATOM 1860 NE ARG P 55 -4.408 0.867 -9.745 1.00 15.00 N ATOM 1861 CZ ARG P 55 -3.901 0.892 -10.973 1.00 15.00 C ATOM 1862 NH1 ARG P 55 -2.599 0.710 -11.163 1.00 15.00 N ATOM 1863 NH2 ARG P 55 -4.692 1.111 -12.015 1.00 15.00 N ATOM 0 H ARG P 55 -1.477 -3.233 -8.396 1.00 15.00 H new ATOM 0 HA ARG P 55 -1.445 -2.294 -5.796 1.00 15.00 H new ATOM 0 HB2 ARG P 55 -2.235 -0.211 -6.637 1.00 15.00 H new ATOM 0 HB3 ARG P 55 -1.158 -0.912 -7.829 1.00 15.00 H new ATOM 0 HG2 ARG P 55 -2.833 -1.217 -9.382 1.00 15.00 H new ATOM 0 HG3 ARG P 55 -4.076 -1.461 -8.171 1.00 15.00 H new ATOM 0 HD2 ARG P 55 -4.187 0.896 -7.668 1.00 15.00 H new ATOM 0 HD3 ARG P 55 -2.721 1.229 -8.567 1.00 15.00 H new ATOM 0 HE ARG P 55 -5.407 1.040 -9.633 1.00 15.00 H new ATOM 0 HH11 ARG P 55 -1.985 0.550 -10.365 1.00 15.00 H new ATOM 0 HH12 ARG P 55 -2.214 0.730 -12.107 1.00 15.00 H new ATOM 0 HH21 ARG P 55 -5.691 1.261 -11.874 1.00 15.00 H new ATOM 0 HH22 ARG P 55 -4.301 1.130 -12.957 1.00 15.00 H new ATOM 1877 N TYR P 56 -4.371 -3.419 -6.652 1.00 15.00 N ATOM 1878 CA TYR P 56 -5.702 -3.731 -6.135 1.00 15.00 C ATOM 1879 C TYR P 56 -5.574 -4.356 -4.740 1.00 15.00 C ATOM 1880 O TYR P 56 -6.068 -3.810 -3.753 1.00 15.00 O ATOM 1881 CB TYR P 56 -6.440 -4.637 -7.133 1.00 15.00 C ATOM 1882 CG TYR P 56 -7.497 -5.530 -6.539 1.00 15.00 C ATOM 1883 CD1 TYR P 56 -8.488 -5.033 -5.707 1.00 15.00 C ATOM 1884 CD2 TYR P 56 -7.499 -6.883 -6.830 1.00 15.00 C ATOM 1885 CE1 TYR P 56 -9.452 -5.867 -5.177 1.00 15.00 C ATOM 1886 CE2 TYR P 56 -8.453 -7.722 -6.308 1.00 15.00 C ATOM 1887 CZ TYR P 56 -9.430 -7.214 -5.480 1.00 15.00 C ATOM 1888 OH TYR P 56 -10.388 -8.050 -4.955 1.00 15.00 O ATOM 0 H TYR P 56 -4.135 -3.883 -7.529 1.00 15.00 H new ATOM 0 HA TYR P 56 -6.297 -2.824 -6.026 1.00 15.00 H new ATOM 0 HB2 TYR P 56 -6.905 -4.008 -7.892 1.00 15.00 H new ATOM 0 HB3 TYR P 56 -5.706 -5.261 -7.642 1.00 15.00 H new ATOM 0 HD1 TYR P 56 -8.506 -3.979 -5.470 1.00 15.00 H new ATOM 0 HD2 TYR P 56 -6.736 -7.287 -7.480 1.00 15.00 H new ATOM 0 HE1 TYR P 56 -10.219 -5.468 -4.529 1.00 15.00 H new ATOM 0 HE2 TYR P 56 -8.437 -8.775 -6.546 1.00 15.00 H new ATOM 0 HH TYR P 56 -10.230 -8.965 -5.267 1.00 15.00 H new ATOM 1898 N LYS P 57 -4.877 -5.482 -4.676 1.00 15.00 N ATOM 1899 CA LYS P 57 -4.612 -6.209 -3.422 1.00 15.00 C ATOM 1900 C LYS P 57 -4.142 -5.299 -2.278 1.00 15.00 C ATOM 1901 O LYS P 57 -4.155 -5.692 -1.111 1.00 15.00 O ATOM 1902 CB LYS P 57 -3.496 -7.191 -3.690 1.00 15.00 C ATOM 1903 CG LYS P 57 -3.811 -8.191 -4.789 1.00 15.00 C ATOM 1904 CD LYS P 57 -5.033 -9.025 -4.439 1.00 15.00 C ATOM 1905 CE LYS P 57 -5.437 -9.936 -5.586 1.00 15.00 C ATOM 1906 NZ LYS P 57 -6.595 -10.800 -5.226 1.00 15.00 N ATOM 0 H LYS P 57 -4.471 -5.929 -5.498 1.00 15.00 H new ATOM 0 HA LYS P 57 -5.546 -6.680 -3.116 1.00 15.00 H new ATOM 0 HB2 LYS P 57 -2.596 -6.639 -3.961 1.00 15.00 H new ATOM 0 HB3 LYS P 57 -3.273 -7.733 -2.771 1.00 15.00 H new ATOM 0 HG2 LYS P 57 -3.984 -7.663 -5.726 1.00 15.00 H new ATOM 0 HG3 LYS P 57 -2.953 -8.845 -4.946 1.00 15.00 H new ATOM 0 HD2 LYS P 57 -4.823 -9.625 -3.554 1.00 15.00 H new ATOM 0 HD3 LYS P 57 -5.864 -8.366 -4.187 1.00 15.00 H new ATOM 0 HE2 LYS P 57 -5.691 -9.332 -6.457 1.00 15.00 H new ATOM 0 HE3 LYS P 57 -4.591 -10.562 -5.868 1.00 15.00 H new ATOM 0 HZ1 LYS P 57 -6.840 -11.407 -6.034 1.00 15.00 H new ATOM 0 HZ2 LYS P 57 -6.344 -11.395 -4.410 1.00 15.00 H new ATOM 0 HZ3 LYS P 57 -7.411 -10.203 -4.981 1.00 15.00 H new ATOM 1920 N LYS P 58 -3.731 -4.100 -2.631 1.00 15.00 N ATOM 1921 CA LYS P 58 -3.252 -3.132 -1.647 1.00 15.00 C ATOM 1922 C LYS P 58 -4.416 -2.417 -0.979 1.00 15.00 C ATOM 1923 O LYS P 58 -4.361 -2.095 0.208 1.00 15.00 O ATOM 1924 CB LYS P 58 -2.307 -2.111 -2.282 1.00 15.00 C ATOM 1925 CG LYS P 58 -0.978 -2.698 -2.732 1.00 15.00 C ATOM 1926 CD LYS P 58 -1.188 -3.822 -3.729 1.00 15.00 C ATOM 1927 CE LYS P 58 0.107 -4.237 -4.413 1.00 15.00 C ATOM 1928 NZ LYS P 58 0.806 -3.085 -5.052 1.00 15.00 N ATOM 0 H LYS P 58 -3.716 -3.764 -3.594 1.00 15.00 H new ATOM 0 HA LYS P 58 -2.698 -3.686 -0.890 1.00 15.00 H new ATOM 0 HB2 LYS P 58 -2.802 -1.657 -3.141 1.00 15.00 H new ATOM 0 HB3 LYS P 58 -2.116 -1.312 -1.565 1.00 15.00 H new ATOM 0 HG2 LYS P 58 -0.366 -1.917 -3.183 1.00 15.00 H new ATOM 0 HG3 LYS P 58 -0.431 -3.072 -1.867 1.00 15.00 H new ATOM 0 HD2 LYS P 58 -1.618 -4.683 -3.217 1.00 15.00 H new ATOM 0 HD3 LYS P 58 -1.909 -3.506 -4.483 1.00 15.00 H new ATOM 0 HE2 LYS P 58 0.769 -4.700 -3.681 1.00 15.00 H new ATOM 0 HE3 LYS P 58 -0.110 -4.992 -5.169 1.00 15.00 H new ATOM 0 HZ1 LYS P 58 0.869 -3.243 -6.078 1.00 15.00 H new ATOM 0 HZ2 LYS P 58 0.274 -2.211 -4.868 1.00 15.00 H new ATOM 0 HZ3 LYS P 58 1.764 -2.997 -4.656 1.00 15.00 H new ATOM 1942 N ASN P 59 -5.458 -2.148 -1.753 1.00 15.00 N ATOM 1943 CA ASN P 59 -6.620 -1.443 -1.233 1.00 15.00 C ATOM 1944 C ASN P 59 -7.941 -2.063 -1.694 1.00 15.00 C ATOM 1945 O ASN P 59 -8.899 -1.351 -1.968 1.00 15.00 O ATOM 1946 CB ASN P 59 -6.544 0.015 -1.663 1.00 15.00 C ATOM 1947 CG ASN P 59 -5.527 0.803 -0.861 1.00 15.00 C ATOM 1948 OD1 ASN P 59 -5.633 0.913 0.361 1.00 15.00 O ATOM 1949 ND2 ASN P 59 -4.533 1.357 -1.545 1.00 15.00 N ATOM 0 H ASN P 59 -5.522 -2.406 -2.738 1.00 15.00 H new ATOM 0 HA ASN P 59 -6.603 -1.522 -0.146 1.00 15.00 H new ATOM 0 HB2 ASN P 59 -6.286 0.066 -2.721 1.00 15.00 H new ATOM 0 HB3 ASN P 59 -7.526 0.475 -1.552 1.00 15.00 H new ATOM 0 HD21 ASN P 59 -3.819 1.899 -1.058 1.00 15.00 H new ATOM 0 HD22 ASN P 59 -4.483 1.241 -2.557 1.00 15.00 H new ATOM 1956 N ILE P 60 -7.970 -3.391 -1.764 1.00 15.00 N ATOM 1957 CA ILE P 60 -9.157 -4.163 -2.173 1.00 15.00 C ATOM 1958 C ILE P 60 -10.474 -3.366 -2.204 1.00 15.00 C ATOM 1959 O ILE P 60 -11.044 -3.132 -3.269 1.00 15.00 O ATOM 1960 CB ILE P 60 -9.362 -5.388 -1.258 1.00 15.00 C ATOM 1961 CG1 ILE P 60 -8.118 -6.273 -1.271 1.00 15.00 C ATOM 1962 CG2 ILE P 60 -10.582 -6.181 -1.708 1.00 15.00 C ATOM 1963 CD1 ILE P 60 -7.752 -6.755 -2.654 1.00 15.00 C ATOM 0 H ILE P 60 -7.165 -3.975 -1.537 1.00 15.00 H new ATOM 0 HA ILE P 60 -8.937 -4.461 -3.198 1.00 15.00 H new ATOM 0 HB ILE P 60 -9.529 -5.040 -0.239 1.00 15.00 H new ATOM 0 HG12 ILE P 60 -7.279 -5.717 -0.852 1.00 15.00 H new ATOM 0 HG13 ILE P 60 -8.285 -7.134 -0.624 1.00 15.00 H new ATOM 0 HG21 ILE P 60 -10.717 -7.043 -1.055 1.00 15.00 H new ATOM 0 HG22 ILE P 60 -11.467 -5.546 -1.659 1.00 15.00 H new ATOM 0 HG23 ILE P 60 -10.437 -6.522 -2.733 1.00 15.00 H new ATOM 0 HD11 ILE P 60 -6.860 -7.379 -2.598 1.00 15.00 H new ATOM 0 HD12 ILE P 60 -8.576 -7.337 -3.067 1.00 15.00 H new ATOM 0 HD13 ILE P 60 -7.555 -5.898 -3.298 1.00 15.00 H new ATOM 1975 N GLY P 61 -10.962 -2.989 -1.021 1.00 15.00 N ATOM 1976 CA GLY P 61 -12.225 -2.264 -0.913 1.00 15.00 C ATOM 1977 C GLY P 61 -12.286 -1.018 -1.775 1.00 15.00 C ATOM 1978 O GLY P 61 -13.368 -0.582 -2.180 1.00 15.00 O ATOM 0 H GLY P 61 -10.503 -3.174 -0.129 1.00 15.00 H new ATOM 0 HA2 GLY P 61 -13.041 -2.930 -1.193 1.00 15.00 H new ATOM 0 HA3 GLY P 61 -12.385 -1.984 0.128 1.00 15.00 H new ATOM 1982 N LYS P 62 -11.127 -0.459 -2.065 1.00 15.00 N ATOM 1983 CA LYS P 62 -11.039 0.734 -2.890 1.00 15.00 C ATOM 1984 C LYS P 62 -11.445 0.419 -4.323 1.00 15.00 C ATOM 1985 O LYS P 62 -12.122 1.210 -4.977 1.00 15.00 O ATOM 1986 CB LYS P 62 -9.618 1.298 -2.860 1.00 15.00 C ATOM 1987 CG LYS P 62 -9.442 2.554 -3.698 1.00 15.00 C ATOM 1988 CD LYS P 62 -8.011 3.066 -3.639 1.00 15.00 C ATOM 1989 CE LYS P 62 -7.835 4.323 -4.477 1.00 15.00 C ATOM 1990 NZ LYS P 62 -8.719 5.427 -4.014 1.00 15.00 N ATOM 0 H LYS P 62 -10.227 -0.813 -1.740 1.00 15.00 H new ATOM 0 HA LYS P 62 -11.722 1.482 -2.488 1.00 15.00 H new ATOM 0 HB2 LYS P 62 -9.346 1.519 -1.828 1.00 15.00 H new ATOM 0 HB3 LYS P 62 -8.926 0.535 -3.215 1.00 15.00 H new ATOM 0 HG2 LYS P 62 -9.712 2.343 -4.733 1.00 15.00 H new ATOM 0 HG3 LYS P 62 -10.122 3.328 -3.343 1.00 15.00 H new ATOM 0 HD2 LYS P 62 -7.741 3.276 -2.604 1.00 15.00 H new ATOM 0 HD3 LYS P 62 -7.331 2.292 -3.995 1.00 15.00 H new ATOM 0 HE2 LYS P 62 -6.795 4.647 -4.431 1.00 15.00 H new ATOM 0 HE3 LYS P 62 -8.053 4.097 -5.521 1.00 15.00 H new ATOM 0 HZ1 LYS P 62 -8.399 6.325 -4.429 1.00 15.00 H new ATOM 0 HZ2 LYS P 62 -9.697 5.237 -4.312 1.00 15.00 H new ATOM 0 HZ3 LYS P 62 -8.680 5.491 -2.977 1.00 15.00 H new ATOM 2004 N PHE P 63 -11.014 -0.740 -4.809 1.00 15.00 N ATOM 2005 CA PHE P 63 -11.319 -1.155 -6.171 1.00 15.00 C ATOM 2006 C PHE P 63 -12.703 -1.773 -6.280 1.00 15.00 C ATOM 2007 O PHE P 63 -13.302 -1.766 -7.353 1.00 15.00 O ATOM 2008 CB PHE P 63 -10.257 -2.125 -6.676 1.00 15.00 C ATOM 2009 CG PHE P 63 -8.880 -1.550 -6.583 1.00 15.00 C ATOM 2010 CD1 PHE P 63 -8.219 -1.503 -5.368 1.00 15.00 C ATOM 2011 CD2 PHE P 63 -8.264 -1.022 -7.704 1.00 15.00 C ATOM 2012 CE1 PHE P 63 -6.961 -0.944 -5.271 1.00 15.00 C ATOM 2013 CE2 PHE P 63 -7.003 -0.464 -7.616 1.00 15.00 C ATOM 2014 CZ PHE P 63 -6.350 -0.425 -6.397 1.00 15.00 C ATOM 0 H PHE P 63 -10.453 -1.407 -4.280 1.00 15.00 H new ATOM 0 HA PHE P 63 -11.314 -0.263 -6.797 1.00 15.00 H new ATOM 0 HB2 PHE P 63 -10.304 -3.047 -6.097 1.00 15.00 H new ATOM 0 HB3 PHE P 63 -10.470 -2.388 -7.712 1.00 15.00 H new ATOM 0 HD1 PHE P 63 -8.693 -1.908 -4.486 1.00 15.00 H new ATOM 0 HD2 PHE P 63 -8.773 -1.046 -8.656 1.00 15.00 H new ATOM 0 HE1 PHE P 63 -6.455 -0.912 -4.317 1.00 15.00 H new ATOM 0 HE2 PHE P 63 -6.528 -0.059 -8.497 1.00 15.00 H new ATOM 0 HZ PHE P 63 -5.364 0.010 -6.325 1.00 15.00 H new ATOM 2024 N GLN P 64 -13.227 -2.290 -5.173 1.00 15.00 N ATOM 2025 CA GLN P 64 -14.559 -2.878 -5.189 1.00 15.00 C ATOM 2026 C GLN P 64 -15.557 -1.840 -5.689 1.00 15.00 C ATOM 2027 O GLN P 64 -16.142 -1.988 -6.762 1.00 15.00 O ATOM 2028 CB GLN P 64 -14.958 -3.372 -3.797 1.00 15.00 C ATOM 2029 CG GLN P 64 -14.063 -4.479 -3.262 1.00 15.00 C ATOM 2030 CD GLN P 64 -14.559 -5.045 -1.946 1.00 15.00 C ATOM 2031 OE1 GLN P 64 -14.704 -4.322 -0.961 1.00 15.00 O ATOM 2032 NE2 GLN P 64 -14.821 -6.346 -1.924 1.00 15.00 N ATOM 0 H GLN P 64 -12.757 -2.314 -4.268 1.00 15.00 H new ATOM 0 HA GLN P 64 -14.558 -3.738 -5.858 1.00 15.00 H new ATOM 0 HB2 GLN P 64 -14.936 -2.532 -3.103 1.00 15.00 H new ATOM 0 HB3 GLN P 64 -15.986 -3.732 -3.830 1.00 15.00 H new ATOM 0 HG2 GLN P 64 -14.003 -5.280 -3.998 1.00 15.00 H new ATOM 0 HG3 GLN P 64 -13.053 -4.092 -3.129 1.00 15.00 H new ATOM 0 HE21 GLN P 64 -14.686 -6.908 -2.765 1.00 15.00 H new ATOM 0 HE22 GLN P 64 -15.157 -6.784 -1.066 1.00 15.00 H new ATOM 2041 N GLU P 65 -15.731 -0.781 -4.904 1.00 15.00 N ATOM 2042 CA GLU P 65 -16.644 0.300 -5.264 1.00 15.00 C ATOM 2043 C GLU P 65 -16.332 0.828 -6.661 1.00 15.00 C ATOM 2044 O GLU P 65 -17.229 0.991 -7.486 1.00 15.00 O ATOM 2045 CB GLU P 65 -16.541 1.435 -4.251 1.00 15.00 C ATOM 2046 CG GLU P 65 -17.479 2.597 -4.536 1.00 15.00 C ATOM 2047 CD GLU P 65 -17.364 3.705 -3.508 1.00 15.00 C ATOM 2048 OE1 GLU P 65 -16.259 4.269 -3.364 1.00 15.00 O ATOM 2049 OE2 GLU P 65 -18.379 4.009 -2.847 1.00 15.00 O ATOM 0 H GLU P 65 -15.252 -0.648 -4.014 1.00 15.00 H new ATOM 0 HA GLU P 65 -17.659 -0.096 -5.259 1.00 15.00 H new ATOM 0 HB2 GLU P 65 -16.755 1.043 -3.257 1.00 15.00 H new ATOM 0 HB3 GLU P 65 -15.515 1.803 -4.235 1.00 15.00 H new ATOM 0 HG2 GLU P 65 -17.262 3.000 -5.525 1.00 15.00 H new ATOM 0 HG3 GLU P 65 -18.506 2.233 -4.559 1.00 15.00 H new ATOM 2056 N GLU P 66 -15.048 1.065 -6.929 1.00 15.00 N ATOM 2057 CA GLU P 66 -14.619 1.544 -8.239 1.00 15.00 C ATOM 2058 C GLU P 66 -15.106 0.583 -9.310 1.00 15.00 C ATOM 2059 O GLU P 66 -15.761 0.976 -10.272 1.00 15.00 O ATOM 2060 CB GLU P 66 -13.095 1.655 -8.298 1.00 15.00 C ATOM 2061 CG GLU P 66 -12.525 2.732 -7.389 1.00 15.00 C ATOM 2062 CD GLU P 66 -12.871 4.134 -7.855 1.00 15.00 C ATOM 2063 OE1 GLU P 66 -14.074 4.454 -7.935 1.00 15.00 O ATOM 2064 OE2 GLU P 66 -11.936 4.911 -8.138 1.00 15.00 O ATOM 0 H GLU P 66 -14.291 0.933 -6.258 1.00 15.00 H new ATOM 0 HA GLU P 66 -15.044 2.533 -8.411 1.00 15.00 H new ATOM 0 HB2 GLU P 66 -12.659 0.694 -8.026 1.00 15.00 H new ATOM 0 HB3 GLU P 66 -12.794 1.862 -9.325 1.00 15.00 H new ATOM 0 HG2 GLU P 66 -12.904 2.586 -6.377 1.00 15.00 H new ATOM 0 HG3 GLU P 66 -11.441 2.626 -7.342 1.00 15.00 H new ATOM 2071 N ALA P 67 -14.767 -0.686 -9.120 1.00 15.00 N ATOM 2072 CA ALA P 67 -15.153 -1.736 -10.048 1.00 15.00 C ATOM 2073 C ALA P 67 -16.607 -1.570 -10.480 1.00 15.00 C ATOM 2074 O ALA P 67 -16.941 -1.768 -11.647 1.00 15.00 O ATOM 2075 CB ALA P 67 -14.934 -3.095 -9.402 1.00 15.00 C ATOM 0 H ALA P 67 -14.220 -1.013 -8.323 1.00 15.00 H new ATOM 0 HA ALA P 67 -14.531 -1.664 -10.941 1.00 15.00 H new ATOM 0 HB1 ALA P 67 -15.224 -3.881 -10.100 1.00 15.00 H new ATOM 0 HB2 ALA P 67 -13.881 -3.210 -9.144 1.00 15.00 H new ATOM 0 HB3 ALA P 67 -15.539 -3.170 -8.499 1.00 15.00 H new ATOM 2081 N ASN P 68 -17.467 -1.189 -9.535 1.00 15.00 N ATOM 2082 CA ASN P 68 -18.878 -0.982 -9.843 1.00 15.00 C ATOM 2083 C ASN P 68 -19.062 0.317 -10.624 1.00 15.00 C ATOM 2084 O ASN P 68 -19.931 0.419 -11.489 1.00 15.00 O ATOM 2085 CB ASN P 68 -19.708 -0.944 -8.558 1.00 15.00 C ATOM 2086 CG ASN P 68 -19.638 -2.248 -7.788 1.00 15.00 C ATOM 2087 OD1 ASN P 68 -20.017 -3.304 -8.294 1.00 15.00 O ATOM 2088 ND2 ASN P 68 -19.152 -2.181 -6.554 1.00 15.00 N ATOM 0 H ASN P 68 -17.213 -1.020 -8.562 1.00 15.00 H new ATOM 0 HA ASN P 68 -19.223 -1.815 -10.455 1.00 15.00 H new ATOM 0 HB2 ASN P 68 -19.354 -0.131 -7.924 1.00 15.00 H new ATOM 0 HB3 ASN P 68 -20.747 -0.726 -8.806 1.00 15.00 H new ATOM 0 HD21 ASN P 68 -19.082 -3.026 -5.987 1.00 15.00 H new ATOM 0 HD22 ASN P 68 -18.849 -1.285 -6.173 1.00 15.00 H new ATOM 2095 N ILE P 69 -18.225 1.302 -10.313 1.00 15.00 N ATOM 2096 CA ILE P 69 -18.268 2.598 -10.980 1.00 15.00 C ATOM 2097 C ILE P 69 -17.817 2.476 -12.432 1.00 15.00 C ATOM 2098 O ILE P 69 -18.495 2.944 -13.344 1.00 15.00 O ATOM 2099 CB ILE P 69 -17.370 3.622 -10.257 1.00 15.00 C ATOM 2100 CG1 ILE P 69 -17.799 3.769 -8.797 1.00 15.00 C ATOM 2101 CG2 ILE P 69 -17.419 4.971 -10.962 1.00 15.00 C ATOM 2102 CD1 ILE P 69 -16.826 4.570 -7.961 1.00 15.00 C ATOM 0 H ILE P 69 -17.503 1.225 -9.597 1.00 15.00 H new ATOM 0 HA ILE P 69 -19.301 2.945 -10.951 1.00 15.00 H new ATOM 0 HB ILE P 69 -16.343 3.257 -10.284 1.00 15.00 H new ATOM 0 HG12 ILE P 69 -18.777 4.248 -8.760 1.00 15.00 H new ATOM 0 HG13 ILE P 69 -17.913 2.778 -8.358 1.00 15.00 H new ATOM 0 HG21 ILE P 69 -16.779 5.680 -10.436 1.00 15.00 H new ATOM 0 HG22 ILE P 69 -17.069 4.858 -11.988 1.00 15.00 H new ATOM 0 HG23 ILE P 69 -18.444 5.342 -10.967 1.00 15.00 H new ATOM 0 HD11 ILE P 69 -17.193 4.634 -6.937 1.00 15.00 H new ATOM 0 HD12 ILE P 69 -15.852 4.081 -7.967 1.00 15.00 H new ATOM 0 HD13 ILE P 69 -16.730 5.574 -8.376 1.00 15.00 H new ATOM 2114 N TYR P 70 -16.666 1.839 -12.635 1.00 15.00 N ATOM 2115 CA TYR P 70 -16.118 1.649 -13.975 1.00 15.00 C ATOM 2116 C TYR P 70 -17.012 0.722 -14.796 1.00 15.00 C ATOM 2117 O TYR P 70 -17.343 1.008 -15.946 1.00 15.00 O ATOM 2118 CB TYR P 70 -14.703 1.068 -13.893 1.00 15.00 C ATOM 2119 CG TYR P 70 -13.661 2.051 -13.400 1.00 15.00 C ATOM 2120 CD1 TYR P 70 -13.712 2.575 -12.112 1.00 15.00 C ATOM 2121 CD2 TYR P 70 -12.624 2.460 -14.230 1.00 15.00 C ATOM 2122 CE1 TYR P 70 -12.761 3.474 -11.669 1.00 15.00 C ATOM 2123 CE2 TYR P 70 -11.669 3.357 -13.793 1.00 15.00 C ATOM 2124 CZ TYR P 70 -11.743 3.862 -12.513 1.00 15.00 C ATOM 2125 OH TYR P 70 -10.794 4.756 -12.074 1.00 15.00 O ATOM 0 H TYR P 70 -16.095 1.445 -11.887 1.00 15.00 H new ATOM 0 HA TYR P 70 -16.076 2.621 -14.467 1.00 15.00 H new ATOM 0 HB2 TYR P 70 -14.714 0.203 -13.230 1.00 15.00 H new ATOM 0 HB3 TYR P 70 -14.411 0.709 -14.880 1.00 15.00 H new ATOM 0 HD1 TYR P 70 -14.508 2.274 -11.447 1.00 15.00 H new ATOM 0 HD2 TYR P 70 -12.564 2.069 -15.235 1.00 15.00 H new ATOM 0 HE1 TYR P 70 -12.815 3.871 -10.666 1.00 15.00 H new ATOM 0 HE2 TYR P 70 -10.868 3.661 -14.451 1.00 15.00 H new ATOM 0 HH TYR P 70 -10.146 4.924 -12.790 1.00 15.00 H new