USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 953 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: A 101 GLN : amide:sc= 0 X(o=-0.34,f=-0.075) USER MOD Set 1.2: A 125 CYS SG : rot 180:sc= -0.341 USER MOD Set 2.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot -150:sc= -0.117 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -171:sc= -6.01 (180deg=-6.95!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 153:sc= 0.967 USER MOD Single : A 39 GLN : amide:sc= -0.313 K(o=-0.31,f=-0.83) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= -0.967 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ -160:sc=-0.000868 (180deg=-0.17) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.032 USER MOD Single : A 58 GLN :FLIP amide:sc= 0.12 F(o=-1.6,f=0.12) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 171:sc= -0.0196 (180deg=-0.206) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.716 X(o=-0.72,f=-1.1) USER MOD Single : A 80 SER OG : rot 180:sc=-0.00988 USER MOD Single : A 88 GLN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 72:sc= 1.26 USER MOD Single : A 106 ASN : amide:sc= -0.631 K(o=-0.63,f=-3.7!) USER MOD Single : A 108 GLN : amide:sc= -2.41 K(o=-2.4,f=-3) USER MOD Single : A 119 SER OG : rot 116:sc= -0.985 USER MOD Single : A 122 MET CE :methyl -144:sc= -0.352 (180deg=-1.09) USER MOD ----------------------------------------------------------------- ATOM 81 N ILE A 6 5.448 -3.288 -12.880 1.00 35.32 N ATOM 82 CA ILE A 6 6.893 -3.477 -12.886 1.00 51.42 C ATOM 83 C ILE A 6 7.524 -2.931 -11.610 1.00 10.03 C ATOM 84 O ILE A 6 8.574 -3.401 -11.174 1.00 65.44 O ATOM 85 CB ILE A 6 7.545 -2.791 -14.101 1.00 54.44 C ATOM 86 CG1 ILE A 6 7.108 -1.327 -14.183 1.00 54.43 C ATOM 87 CG2 ILE A 6 7.185 -3.529 -15.382 1.00 41.11 C ATOM 88 CD1 ILE A 6 7.833 -0.538 -15.251 1.00 62.20 C ATOM 0 HA ILE A 6 7.071 -4.551 -12.946 1.00 51.42 H new ATOM 0 HB ILE A 6 8.628 -2.821 -13.979 1.00 54.44 H new ATOM 0 HG12 ILE A 6 6.036 -1.287 -14.378 1.00 54.43 H new ATOM 0 HG13 ILE A 6 7.274 -0.852 -13.216 1.00 54.43 H new ATOM 0 HG21 ILE A 6 7.653 -3.032 -16.232 1.00 41.11 H new ATOM 0 HG22 ILE A 6 7.541 -4.557 -15.322 1.00 41.11 H new ATOM 0 HG23 ILE A 6 6.103 -3.527 -15.511 1.00 41.11 H new ATOM 0 HD11 ILE A 6 7.472 0.491 -15.251 1.00 62.20 H new ATOM 0 HD12 ILE A 6 8.904 -0.547 -15.046 1.00 62.20 H new ATOM 0 HD13 ILE A 6 7.646 -0.988 -16.226 1.00 62.20 H new ATOM 100 N ALA A 7 6.874 -1.937 -11.013 1.00 45.32 N ATOM 101 CA ALA A 7 7.370 -1.329 -9.784 1.00 73.42 C ATOM 102 C ALA A 7 7.571 -2.378 -8.696 1.00 22.50 C ATOM 103 O ALA A 7 8.512 -2.296 -7.907 1.00 74.01 O ATOM 104 CB ALA A 7 6.412 -0.248 -9.307 1.00 32.04 C ATOM 0 H ALA A 7 6.003 -1.536 -11.360 1.00 45.32 H new ATOM 0 HA ALA A 7 8.337 -0.874 -9.997 1.00 73.42 H new ATOM 0 HB1 ALA A 7 6.794 0.198 -8.389 1.00 32.04 H new ATOM 0 HB2 ALA A 7 6.321 0.522 -10.073 1.00 32.04 H new ATOM 0 HB3 ALA A 7 5.433 -0.688 -9.117 1.00 32.04 H new ATOM 110 N GLY A 8 6.681 -3.365 -8.659 1.00 74.21 N ATOM 111 CA GLY A 8 6.778 -4.416 -7.663 1.00 3.12 C ATOM 112 C GLY A 8 7.861 -5.425 -7.989 1.00 71.42 C ATOM 113 O GLY A 8 8.517 -5.954 -7.091 1.00 33.10 O ATOM 0 H GLY A 8 5.894 -3.455 -9.302 1.00 74.21 H new ATOM 0 HA2 GLY A 8 6.981 -3.971 -6.689 1.00 3.12 H new ATOM 0 HA3 GLY A 8 5.819 -4.929 -7.586 1.00 3.12 H new ATOM 117 N ILE A 9 8.048 -5.695 -9.277 1.00 13.32 N ATOM 118 CA ILE A 9 9.058 -6.648 -9.719 1.00 31.15 C ATOM 119 C ILE A 9 10.457 -6.048 -9.630 1.00 12.52 C ATOM 120 O ILE A 9 11.438 -6.761 -9.418 1.00 45.14 O ATOM 121 CB ILE A 9 8.801 -7.111 -11.165 1.00 0.02 C ATOM 122 CG1 ILE A 9 7.459 -7.839 -11.259 1.00 73.35 C ATOM 123 CG2 ILE A 9 9.932 -8.009 -11.642 1.00 61.52 C ATOM 124 CD1 ILE A 9 6.293 -6.922 -11.556 1.00 42.14 C ATOM 0 H ILE A 9 7.513 -5.267 -10.032 1.00 13.32 H new ATOM 0 HA ILE A 9 8.992 -7.509 -9.054 1.00 31.15 H new ATOM 0 HB ILE A 9 8.763 -6.234 -11.811 1.00 0.02 H new ATOM 0 HG12 ILE A 9 7.521 -8.599 -12.038 1.00 73.35 H new ATOM 0 HG13 ILE A 9 7.271 -8.360 -10.320 1.00 73.35 H new ATOM 0 HG21 ILE A 9 9.736 -8.328 -12.666 1.00 61.52 H new ATOM 0 HG22 ILE A 9 10.873 -7.459 -11.607 1.00 61.52 H new ATOM 0 HG23 ILE A 9 9.999 -8.884 -10.996 1.00 61.52 H new ATOM 0 HD11 ILE A 9 5.375 -7.507 -11.608 1.00 42.14 H new ATOM 0 HD12 ILE A 9 6.205 -6.178 -10.765 1.00 42.14 H new ATOM 0 HD13 ILE A 9 6.458 -6.420 -12.509 1.00 42.14 H new ATOM 136 N LEU A 10 10.541 -4.732 -9.791 1.00 12.41 N ATOM 137 CA LEU A 10 11.820 -4.033 -9.727 1.00 71.11 C ATOM 138 C LEU A 10 12.182 -3.691 -8.285 1.00 40.45 C ATOM 139 O LEU A 10 13.358 -3.563 -7.942 1.00 52.32 O ATOM 140 CB LEU A 10 11.769 -2.757 -10.569 1.00 61.11 C ATOM 141 CG LEU A 10 11.483 -1.462 -9.808 1.00 55.15 C ATOM 142 CD1 LEU A 10 12.773 -0.862 -9.271 1.00 55.45 C ATOM 143 CD2 LEU A 10 10.761 -0.466 -10.704 1.00 40.34 C ATOM 0 H LEU A 10 9.739 -4.127 -9.967 1.00 12.41 H new ATOM 0 HA LEU A 10 12.588 -4.694 -10.128 1.00 71.11 H new ATOM 0 HB2 LEU A 10 12.723 -2.648 -11.086 1.00 61.11 H new ATOM 0 HB3 LEU A 10 11.004 -2.881 -11.335 1.00 61.11 H new ATOM 0 HG LEU A 10 10.836 -1.695 -8.962 1.00 55.15 H new ATOM 0 HD11 LEU A 10 12.549 0.059 -8.732 1.00 55.45 H new ATOM 0 HD12 LEU A 10 13.250 -1.571 -8.595 1.00 55.45 H new ATOM 0 HD13 LEU A 10 13.445 -0.643 -10.100 1.00 55.45 H new ATOM 0 HD21 LEU A 10 10.565 0.450 -10.146 1.00 40.34 H new ATOM 0 HD22 LEU A 10 11.383 -0.238 -11.570 1.00 40.34 H new ATOM 0 HD23 LEU A 10 9.817 -0.896 -11.039 1.00 40.34 H new ATOM 155 N THR A 11 11.164 -3.545 -7.443 1.00 74.04 N ATOM 156 CA THR A 11 11.374 -3.219 -6.039 1.00 10.33 C ATOM 157 C THR A 11 11.544 -4.481 -5.200 1.00 54.45 C ATOM 158 O THR A 11 12.105 -4.439 -4.106 1.00 35.25 O ATOM 159 CB THR A 11 10.203 -2.393 -5.472 1.00 62.42 C ATOM 160 OG1 THR A 11 10.597 -1.760 -4.250 1.00 12.12 O ATOM 161 CG2 THR A 11 8.989 -3.276 -5.224 1.00 42.20 C ATOM 0 H THR A 11 10.185 -3.648 -7.710 1.00 74.04 H new ATOM 0 HA THR A 11 12.287 -2.625 -5.986 1.00 10.33 H new ATOM 0 HB THR A 11 9.935 -1.632 -6.205 1.00 62.42 H new ATOM 0 HG1 THR A 11 9.848 -1.236 -3.897 1.00 12.12 H new ATOM 0 HG21 THR A 11 8.175 -2.671 -4.824 1.00 42.20 H new ATOM 0 HG22 THR A 11 8.674 -3.733 -6.162 1.00 42.20 H new ATOM 0 HG23 THR A 11 9.247 -4.057 -4.508 1.00 42.20 H new ATOM 169 N SER A 12 11.056 -5.602 -5.722 1.00 2.20 N ATOM 170 CA SER A 12 11.151 -6.876 -5.019 1.00 64.15 C ATOM 171 C SER A 12 12.504 -7.535 -5.271 1.00 22.31 C ATOM 172 O SER A 12 13.324 -7.665 -4.361 1.00 43.04 O ATOM 173 CB SER A 12 10.025 -7.812 -5.462 1.00 61.12 C ATOM 174 OG SER A 12 10.121 -9.068 -4.813 1.00 31.10 O ATOM 0 H SER A 12 10.591 -5.654 -6.629 1.00 2.20 H new ATOM 0 HA SER A 12 11.054 -6.682 -3.951 1.00 64.15 H new ATOM 0 HB2 SER A 12 9.060 -7.357 -5.239 1.00 61.12 H new ATOM 0 HB3 SER A 12 10.069 -7.953 -6.542 1.00 61.12 H new ATOM 0 HG SER A 12 9.389 -9.647 -5.112 1.00 31.10 H new ATOM 180 N THR A 13 12.731 -7.951 -6.513 1.00 61.12 N ATOM 181 CA THR A 13 13.983 -8.598 -6.886 1.00 13.00 C ATOM 182 C THR A 13 14.603 -7.931 -8.108 1.00 63.54 C ATOM 183 O THR A 13 13.895 -7.489 -9.013 1.00 33.13 O ATOM 184 CB THR A 13 13.775 -10.095 -7.182 1.00 32.32 C ATOM 185 OG1 THR A 13 12.708 -10.610 -6.377 1.00 24.21 O ATOM 186 CG2 THR A 13 15.048 -10.882 -6.910 1.00 31.51 C ATOM 0 H THR A 13 12.064 -7.851 -7.278 1.00 61.12 H new ATOM 0 HA THR A 13 14.658 -8.494 -6.037 1.00 13.00 H new ATOM 0 HB THR A 13 13.519 -10.202 -8.236 1.00 32.32 H new ATOM 0 HG1 THR A 13 12.581 -11.562 -6.572 1.00 24.21 H new ATOM 0 HG21 THR A 13 14.877 -11.937 -7.126 1.00 31.51 H new ATOM 0 HG22 THR A 13 15.850 -10.507 -7.545 1.00 31.51 H new ATOM 0 HG23 THR A 13 15.330 -10.767 -5.863 1.00 31.51 H new ATOM 194 N ARG A 14 15.930 -7.864 -8.130 1.00 4.52 N ATOM 195 CA ARG A 14 16.646 -7.250 -9.242 1.00 22.21 C ATOM 196 C ARG A 14 17.443 -8.295 -10.018 1.00 53.12 C ATOM 197 O ARG A 14 18.501 -8.742 -9.574 1.00 13.13 O ATOM 198 CB ARG A 14 17.584 -6.155 -8.731 1.00 12.23 C ATOM 199 CG ARG A 14 18.401 -6.570 -7.518 1.00 41.42 C ATOM 200 CD ARG A 14 17.692 -6.215 -6.221 1.00 2.24 C ATOM 201 NE ARG A 14 18.061 -4.885 -5.741 1.00 71.42 N ATOM 202 CZ ARG A 14 17.405 -4.242 -4.782 1.00 20.13 C ATOM 203 NH1 ARG A 14 16.353 -4.804 -4.202 1.00 1.40 N ATOM 204 NH2 ARG A 14 17.802 -3.035 -4.400 1.00 55.20 N ATOM 0 H ARG A 14 16.531 -8.227 -7.390 1.00 4.52 H new ATOM 0 HA ARG A 14 15.911 -6.805 -9.913 1.00 22.21 H new ATOM 0 HB2 ARG A 14 18.262 -5.866 -9.534 1.00 12.23 H new ATOM 0 HB3 ARG A 14 16.995 -5.273 -8.478 1.00 12.23 H new ATOM 0 HG2 ARG A 14 18.584 -7.644 -7.552 1.00 41.42 H new ATOM 0 HG3 ARG A 14 19.374 -6.079 -7.548 1.00 41.42 H new ATOM 0 HD2 ARG A 14 16.614 -6.259 -6.374 1.00 2.24 H new ATOM 0 HD3 ARG A 14 17.937 -6.956 -5.460 1.00 2.24 H new ATOM 0 HE ARG A 14 18.866 -4.425 -6.166 1.00 71.42 H new ATOM 0 HH11 ARG A 14 16.046 -5.732 -4.492 1.00 1.40 H new ATOM 0 HH12 ARG A 14 15.851 -4.308 -3.466 1.00 1.40 H new ATOM 0 HH21 ARG A 14 18.612 -2.600 -4.843 1.00 55.20 H new ATOM 0 HH22 ARG A 14 17.298 -2.542 -3.663 1.00 55.20 H new ATOM 218 N THR A 15 16.927 -8.681 -11.181 1.00 60.01 N ATOM 219 CA THR A 15 17.588 -9.674 -12.018 1.00 43.25 C ATOM 220 C THR A 15 17.505 -9.294 -13.492 1.00 53.43 C ATOM 221 O THR A 15 16.497 -8.751 -13.947 1.00 31.04 O ATOM 222 CB THR A 15 16.972 -11.072 -11.825 1.00 31.20 C ATOM 223 OG1 THR A 15 17.136 -11.496 -10.467 1.00 70.32 O ATOM 224 CG2 THR A 15 17.620 -12.083 -12.759 1.00 72.01 C ATOM 0 H THR A 15 16.053 -8.321 -11.564 1.00 60.01 H new ATOM 0 HA THR A 15 18.633 -9.700 -11.710 1.00 43.25 H new ATOM 0 HB THR A 15 15.910 -11.012 -12.061 1.00 31.20 H new ATOM 0 HG1 THR A 15 16.740 -12.385 -10.352 1.00 70.32 H new ATOM 0 HG21 THR A 15 17.168 -13.063 -12.604 1.00 72.01 H new ATOM 0 HG22 THR A 15 17.468 -11.773 -13.793 1.00 72.01 H new ATOM 0 HG23 THR A 15 18.688 -12.139 -12.550 1.00 72.01 H new ATOM 232 N ILE A 16 18.569 -9.582 -14.234 1.00 54.01 N ATOM 233 CA ILE A 16 18.614 -9.271 -15.658 1.00 34.44 C ATOM 234 C ILE A 16 18.956 -10.509 -16.480 1.00 22.23 C ATOM 235 O ILE A 16 19.823 -11.297 -16.102 1.00 74.41 O ATOM 236 CB ILE A 16 19.643 -8.167 -15.960 1.00 40.34 C ATOM 237 CG1 ILE A 16 19.312 -6.900 -15.169 1.00 52.20 C ATOM 238 CG2 ILE A 16 19.680 -7.871 -17.452 1.00 75.44 C ATOM 239 CD1 ILE A 16 19.907 -6.883 -13.779 1.00 4.23 C ATOM 0 H ILE A 16 19.411 -10.030 -13.873 1.00 54.01 H new ATOM 0 HA ILE A 16 17.621 -8.917 -15.936 1.00 34.44 H new ATOM 0 HB ILE A 16 20.629 -8.517 -15.654 1.00 40.34 H new ATOM 0 HG12 ILE A 16 19.673 -6.032 -15.721 1.00 52.20 H new ATOM 0 HG13 ILE A 16 18.229 -6.801 -15.093 1.00 52.20 H new ATOM 0 HG21 ILE A 16 20.412 -7.088 -17.650 1.00 75.44 H new ATOM 0 HG22 ILE A 16 19.958 -8.774 -17.995 1.00 75.44 H new ATOM 0 HG23 ILE A 16 18.696 -7.538 -17.781 1.00 75.44 H new ATOM 0 HD11 ILE A 16 19.632 -5.956 -13.277 1.00 4.23 H new ATOM 0 HD12 ILE A 16 19.526 -7.731 -13.210 1.00 4.23 H new ATOM 0 HD13 ILE A 16 20.993 -6.950 -13.847 1.00 4.23 H new ATOM 251 N ALA A 17 18.271 -10.672 -17.607 1.00 22.42 N ATOM 252 CA ALA A 17 18.505 -11.812 -18.485 1.00 24.01 C ATOM 253 C ALA A 17 18.845 -11.354 -19.899 1.00 62.43 C ATOM 254 O ALA A 17 18.268 -10.392 -20.407 1.00 2.21 O ATOM 255 CB ALA A 17 17.288 -12.725 -18.501 1.00 41.44 C ATOM 0 H ALA A 17 17.550 -10.029 -17.934 1.00 22.42 H new ATOM 0 HA ALA A 17 19.357 -12.370 -18.097 1.00 24.01 H new ATOM 0 HB1 ALA A 17 17.477 -13.572 -19.161 1.00 41.44 H new ATOM 0 HB2 ALA A 17 17.092 -13.088 -17.492 1.00 41.44 H new ATOM 0 HB3 ALA A 17 16.422 -12.170 -18.862 1.00 41.44 H new ATOM 261 N LEU A 18 19.785 -12.049 -20.531 1.00 31.10 N ATOM 262 CA LEU A 18 20.202 -11.714 -21.888 1.00 4.51 C ATOM 263 C LEU A 18 19.998 -12.896 -22.829 1.00 32.52 C ATOM 264 O LEU A 18 20.330 -14.034 -22.495 1.00 2.22 O ATOM 265 CB LEU A 18 21.671 -11.286 -21.900 1.00 1.03 C ATOM 266 CG LEU A 18 22.271 -10.982 -23.273 1.00 54.21 C ATOM 267 CD1 LEU A 18 22.269 -9.484 -23.536 1.00 62.04 C ATOM 268 CD2 LEU A 18 23.682 -11.542 -23.375 1.00 11.22 C ATOM 0 H LEU A 18 20.273 -12.848 -20.125 1.00 31.10 H new ATOM 0 HA LEU A 18 19.585 -10.886 -22.237 1.00 4.51 H new ATOM 0 HB2 LEU A 18 21.775 -10.398 -21.276 1.00 1.03 H new ATOM 0 HB3 LEU A 18 22.262 -12.074 -21.434 1.00 1.03 H new ATOM 0 HG LEU A 18 21.655 -11.464 -24.032 1.00 54.21 H new ATOM 0 HD11 LEU A 18 22.700 -9.286 -24.518 1.00 62.04 H new ATOM 0 HD12 LEU A 18 21.245 -9.111 -23.507 1.00 62.04 H new ATOM 0 HD13 LEU A 18 22.861 -8.980 -22.772 1.00 62.04 H new ATOM 0 HD21 LEU A 18 24.093 -11.316 -24.359 1.00 11.22 H new ATOM 0 HD22 LEU A 18 24.309 -11.090 -22.607 1.00 11.22 H new ATOM 0 HD23 LEU A 18 23.656 -12.622 -23.232 1.00 11.22 H new ATOM 280 N VAL A 19 19.450 -12.620 -24.008 1.00 62.22 N ATOM 281 CA VAL A 19 19.204 -13.661 -24.999 1.00 43.35 C ATOM 282 C VAL A 19 20.163 -13.534 -26.178 1.00 73.23 C ATOM 283 O VAL A 19 20.150 -12.536 -26.898 1.00 22.33 O ATOM 284 CB VAL A 19 17.756 -13.608 -25.521 1.00 41.34 C ATOM 285 CG1 VAL A 19 17.525 -14.689 -26.566 1.00 41.33 C ATOM 286 CG2 VAL A 19 16.770 -13.747 -24.371 1.00 43.02 C ATOM 0 H VAL A 19 19.168 -11.684 -24.300 1.00 62.22 H new ATOM 0 HA VAL A 19 19.368 -14.617 -24.502 1.00 43.35 H new ATOM 0 HB VAL A 19 17.594 -12.639 -25.993 1.00 41.34 H new ATOM 0 HG11 VAL A 19 16.497 -14.636 -26.923 1.00 41.33 H new ATOM 0 HG12 VAL A 19 18.208 -14.538 -27.402 1.00 41.33 H new ATOM 0 HG13 VAL A 19 17.705 -15.668 -26.122 1.00 41.33 H new ATOM 0 HG21 VAL A 19 15.752 -13.707 -24.758 1.00 43.02 H new ATOM 0 HG22 VAL A 19 16.930 -14.700 -23.868 1.00 43.02 H new ATOM 0 HG23 VAL A 19 16.921 -12.933 -23.662 1.00 43.02 H new ATOM 296 N GLY A 20 20.994 -14.554 -26.371 1.00 33.33 N ATOM 297 CA GLY A 20 21.948 -14.538 -27.464 1.00 54.12 C ATOM 298 C GLY A 20 23.277 -13.929 -27.065 1.00 10.12 C ATOM 299 O GLY A 20 23.624 -12.834 -27.507 1.00 15.00 O ATOM 0 H GLY A 20 21.023 -15.391 -25.789 1.00 33.33 H new ATOM 0 HA2 GLY A 20 22.110 -15.557 -27.816 1.00 54.12 H new ATOM 0 HA3 GLY A 20 21.530 -13.975 -28.299 1.00 54.12 H new ATOM 303 N ALA A 21 24.023 -14.639 -26.225 1.00 11.02 N ATOM 304 CA ALA A 21 25.322 -14.162 -25.766 1.00 54.11 C ATOM 305 C ALA A 21 26.455 -14.959 -26.403 1.00 3.34 C ATOM 306 O ALA A 21 26.773 -16.064 -25.963 1.00 4.52 O ATOM 307 CB ALA A 21 25.406 -14.239 -24.249 1.00 24.31 C ATOM 0 H ALA A 21 23.750 -15.547 -25.848 1.00 11.02 H new ATOM 0 HA ALA A 21 25.429 -13.121 -26.072 1.00 54.11 H new ATOM 0 HB1 ALA A 21 26.381 -13.880 -23.920 1.00 24.31 H new ATOM 0 HB2 ALA A 21 24.624 -13.620 -23.809 1.00 24.31 H new ATOM 0 HB3 ALA A 21 25.273 -15.273 -23.929 1.00 24.31 H new ATOM 313 N SER A 22 27.061 -14.391 -27.441 1.00 21.22 N ATOM 314 CA SER A 22 28.157 -15.051 -28.141 1.00 32.22 C ATOM 315 C SER A 22 29.462 -14.284 -27.953 1.00 0.12 C ATOM 316 O SER A 22 29.531 -13.337 -27.169 1.00 51.22 O ATOM 317 CB SER A 22 27.836 -15.177 -29.631 1.00 52.54 C ATOM 318 OG SER A 22 26.644 -15.915 -29.836 1.00 54.30 O ATOM 0 H SER A 22 26.812 -13.476 -27.816 1.00 21.22 H new ATOM 0 HA SER A 22 28.278 -16.048 -27.717 1.00 32.22 H new ATOM 0 HB2 SER A 22 27.732 -14.184 -30.069 1.00 52.54 H new ATOM 0 HB3 SER A 22 28.663 -15.667 -30.144 1.00 52.54 H new ATOM 0 HG SER A 22 26.460 -15.980 -30.796 1.00 54.30 H new ATOM 324 N ASP A 23 30.495 -14.700 -28.677 1.00 51.12 N ATOM 325 CA ASP A 23 31.799 -14.052 -28.592 1.00 72.22 C ATOM 326 C ASP A 23 31.929 -12.954 -29.643 1.00 3.22 C ATOM 327 O ASP A 23 32.975 -12.807 -30.277 1.00 14.25 O ATOM 328 CB ASP A 23 32.916 -15.081 -28.771 1.00 31.51 C ATOM 329 CG ASP A 23 32.980 -15.627 -30.184 1.00 51.00 C ATOM 330 OD1 ASP A 23 31.936 -16.092 -30.688 1.00 3.40 O ATOM 331 OD2 ASP A 23 34.074 -15.590 -30.786 1.00 31.14 O ATOM 0 H ASP A 23 30.455 -15.483 -29.329 1.00 51.12 H new ATOM 0 HA ASP A 23 31.888 -13.598 -27.605 1.00 72.22 H new ATOM 0 HB2 ASP A 23 33.872 -14.623 -28.518 1.00 31.51 H new ATOM 0 HB3 ASP A 23 32.763 -15.904 -28.073 1.00 31.51 H new ATOM 336 N LYS A 24 30.861 -12.185 -29.823 1.00 51.13 N ATOM 337 CA LYS A 24 30.855 -11.099 -30.797 1.00 34.24 C ATOM 338 C LYS A 24 30.748 -9.746 -30.101 1.00 55.23 C ATOM 339 O LYS A 24 29.658 -9.209 -29.899 1.00 60.24 O ATOM 340 CB LYS A 24 29.694 -11.274 -31.778 1.00 55.52 C ATOM 341 CG LYS A 24 29.930 -12.359 -32.814 1.00 23.23 C ATOM 342 CD LYS A 24 30.947 -11.924 -33.856 1.00 13.31 C ATOM 343 CE LYS A 24 30.961 -12.867 -35.049 1.00 32.00 C ATOM 344 NZ LYS A 24 32.059 -12.542 -36.000 1.00 42.44 N ATOM 0 H LYS A 24 29.988 -12.293 -29.307 1.00 51.13 H new ATOM 0 HA LYS A 24 31.795 -11.131 -31.347 1.00 34.24 H new ATOM 0 HB2 LYS A 24 28.789 -11.509 -31.218 1.00 55.52 H new ATOM 0 HB3 LYS A 24 29.516 -10.328 -32.289 1.00 55.52 H new ATOM 0 HG2 LYS A 24 30.279 -13.265 -32.320 1.00 23.23 H new ATOM 0 HG3 LYS A 24 28.988 -12.606 -33.304 1.00 23.23 H new ATOM 0 HD2 LYS A 24 30.715 -10.913 -34.192 1.00 13.31 H new ATOM 0 HD3 LYS A 24 31.939 -11.890 -33.406 1.00 13.31 H new ATOM 0 HE2 LYS A 24 31.075 -13.893 -34.699 1.00 32.00 H new ATOM 0 HE3 LYS A 24 30.004 -12.811 -35.567 1.00 32.00 H new ATOM 0 HZ1 LYS A 24 32.034 -13.207 -36.799 1.00 42.44 H new ATOM 0 HZ2 LYS A 24 31.936 -11.572 -36.353 1.00 42.44 H new ATOM 0 HZ3 LYS A 24 32.975 -12.620 -35.513 1.00 42.44 H new ATOM 358 N PRO A 25 31.904 -9.179 -29.727 1.00 50.30 N ATOM 359 CA PRO A 25 31.966 -7.880 -29.051 1.00 1.44 C ATOM 360 C PRO A 25 31.586 -6.727 -29.974 1.00 3.24 C ATOM 361 O PRO A 25 31.460 -5.584 -29.535 1.00 12.54 O ATOM 362 CB PRO A 25 33.434 -7.768 -28.632 1.00 1.24 C ATOM 363 CG PRO A 25 34.171 -8.630 -29.598 1.00 14.02 C ATOM 364 CD PRO A 25 33.240 -9.762 -29.936 1.00 10.32 C ATOM 0 HA PRO A 25 31.265 -7.820 -28.219 1.00 1.44 H new ATOM 0 HB2 PRO A 25 33.781 -6.736 -28.678 1.00 1.24 H new ATOM 0 HB3 PRO A 25 33.580 -8.108 -27.607 1.00 1.24 H new ATOM 0 HG2 PRO A 25 34.444 -8.069 -30.492 1.00 14.02 H new ATOM 0 HG3 PRO A 25 35.097 -9.003 -29.160 1.00 14.02 H new ATOM 0 HD2 PRO A 25 33.375 -10.100 -30.964 1.00 10.32 H new ATOM 0 HD3 PRO A 25 33.407 -10.625 -29.292 1.00 10.32 H new ATOM 372 N ASP A 26 31.405 -7.034 -31.253 1.00 63.51 N ATOM 373 CA ASP A 26 31.038 -6.024 -32.238 1.00 40.30 C ATOM 374 C ASP A 26 29.522 -5.883 -32.333 1.00 70.44 C ATOM 375 O ASP A 26 29.006 -5.206 -33.222 1.00 42.24 O ATOM 376 CB ASP A 26 31.617 -6.382 -33.608 1.00 13.22 C ATOM 377 CG ASP A 26 31.361 -7.828 -33.984 1.00 54.24 C ATOM 378 OD1 ASP A 26 30.236 -8.133 -34.434 1.00 25.20 O ATOM 379 OD2 ASP A 26 32.284 -8.654 -33.829 1.00 21.32 O ATOM 0 H ASP A 26 31.507 -7.975 -31.633 1.00 63.51 H new ATOM 0 HA ASP A 26 31.454 -5.070 -31.915 1.00 40.30 H new ATOM 0 HB2 ASP A 26 31.181 -5.730 -34.365 1.00 13.22 H new ATOM 0 HB3 ASP A 26 32.691 -6.195 -33.606 1.00 13.22 H new ATOM 384 N ARG A 27 28.814 -6.529 -31.412 1.00 60.15 N ATOM 385 CA ARG A 27 27.357 -6.478 -31.394 1.00 61.12 C ATOM 386 C ARG A 27 26.855 -5.721 -30.168 1.00 51.14 C ATOM 387 O ARG A 27 27.529 -5.635 -29.142 1.00 21.42 O ATOM 388 CB ARG A 27 26.776 -7.893 -31.406 1.00 71.23 C ATOM 389 CG ARG A 27 26.800 -8.573 -30.047 1.00 71.01 C ATOM 390 CD ARG A 27 26.917 -10.083 -30.182 1.00 24.24 C ATOM 391 NE ARG A 27 25.697 -10.767 -29.761 1.00 43.21 N ATOM 392 CZ ARG A 27 24.630 -10.909 -30.538 1.00 74.25 C ATOM 393 NH1 ARG A 27 24.632 -10.418 -31.770 1.00 60.52 N ATOM 394 NH2 ARG A 27 23.557 -11.544 -30.084 1.00 74.02 N ATOM 0 H ARG A 27 29.226 -7.094 -30.669 1.00 60.15 H new ATOM 0 HA ARG A 27 27.026 -5.949 -32.287 1.00 61.12 H new ATOM 0 HB2 ARG A 27 25.747 -7.851 -31.764 1.00 71.23 H new ATOM 0 HB3 ARG A 27 27.336 -8.501 -32.117 1.00 71.23 H new ATOM 0 HG2 ARG A 27 27.638 -8.193 -29.463 1.00 71.01 H new ATOM 0 HG3 ARG A 27 25.891 -8.325 -29.499 1.00 71.01 H new ATOM 0 HD2 ARG A 27 27.136 -10.338 -31.219 1.00 24.24 H new ATOM 0 HD3 ARG A 27 27.756 -10.437 -29.583 1.00 24.24 H new ATOM 0 HE ARG A 27 25.663 -11.157 -28.819 1.00 43.21 H new ATOM 0 HH11 ARG A 27 25.455 -9.930 -32.123 1.00 60.52 H new ATOM 0 HH12 ARG A 27 23.811 -10.529 -32.364 1.00 60.52 H new ATOM 0 HH21 ARG A 27 23.552 -11.924 -29.137 1.00 74.02 H new ATOM 0 HH22 ARG A 27 22.738 -11.653 -30.682 1.00 74.02 H new ATOM 408 N PRO A 28 25.643 -5.157 -30.276 1.00 74.24 N ATOM 409 CA PRO A 28 25.023 -4.397 -29.187 1.00 21.14 C ATOM 410 C PRO A 28 24.613 -5.288 -28.019 1.00 11.22 C ATOM 411 O PRO A 28 24.417 -4.811 -26.901 1.00 54.22 O ATOM 412 CB PRO A 28 23.789 -3.776 -29.845 1.00 14.24 C ATOM 413 CG PRO A 28 23.466 -4.686 -30.979 1.00 54.21 C ATOM 414 CD PRO A 28 24.783 -5.219 -31.470 1.00 41.24 C ATOM 0 HA PRO A 28 25.708 -3.665 -28.759 1.00 21.14 H new ATOM 0 HB2 PRO A 28 22.958 -3.708 -29.143 1.00 14.24 H new ATOM 0 HB3 PRO A 28 23.994 -2.764 -30.195 1.00 14.24 H new ATOM 0 HG2 PRO A 28 22.813 -5.497 -30.655 1.00 54.21 H new ATOM 0 HG3 PRO A 28 22.942 -4.152 -31.771 1.00 54.21 H new ATOM 0 HD2 PRO A 28 24.689 -6.238 -31.845 1.00 41.24 H new ATOM 0 HD3 PRO A 28 25.182 -4.615 -32.285 1.00 41.24 H new ATOM 422 N SER A 29 24.486 -6.584 -28.285 1.00 53.22 N ATOM 423 CA SER A 29 24.095 -7.541 -27.256 1.00 45.25 C ATOM 424 C SER A 29 25.270 -7.858 -26.336 1.00 62.43 C ATOM 425 O SER A 29 25.083 -8.302 -25.203 1.00 3.31 O ATOM 426 CB SER A 29 23.574 -8.828 -27.899 1.00 13.42 C ATOM 427 OG SER A 29 23.219 -8.614 -29.254 1.00 15.42 O ATOM 0 H SER A 29 24.648 -6.996 -29.204 1.00 53.22 H new ATOM 0 HA SER A 29 23.300 -7.093 -26.660 1.00 45.25 H new ATOM 0 HB2 SER A 29 24.338 -9.604 -27.838 1.00 13.42 H new ATOM 0 HB3 SER A 29 22.707 -9.190 -27.346 1.00 13.42 H new ATOM 0 HG SER A 29 22.494 -9.225 -29.503 1.00 15.42 H new ATOM 433 N TYR A 30 26.481 -7.628 -26.832 1.00 72.32 N ATOM 434 CA TYR A 30 27.687 -7.892 -26.057 1.00 2.32 C ATOM 435 C TYR A 30 28.062 -6.683 -25.205 1.00 41.20 C ATOM 436 O TYR A 30 28.321 -6.809 -24.008 1.00 34.10 O ATOM 437 CB TYR A 30 28.847 -8.254 -26.986 1.00 31.30 C ATOM 438 CG TYR A 30 29.960 -9.012 -26.298 1.00 74.51 C ATOM 439 CD1 TYR A 30 30.681 -8.436 -25.260 1.00 0.31 C ATOM 440 CD2 TYR A 30 30.290 -10.305 -26.687 1.00 4.33 C ATOM 441 CE1 TYR A 30 31.699 -9.124 -24.629 1.00 20.22 C ATOM 442 CE2 TYR A 30 31.306 -11.001 -26.060 1.00 73.14 C ATOM 443 CZ TYR A 30 32.007 -10.407 -25.032 1.00 42.42 C ATOM 444 OH TYR A 30 33.020 -11.097 -24.407 1.00 3.42 O ATOM 0 H TYR A 30 26.653 -7.259 -27.767 1.00 72.32 H new ATOM 0 HA TYR A 30 27.485 -8.733 -25.394 1.00 2.32 H new ATOM 0 HB2 TYR A 30 28.466 -8.855 -27.812 1.00 31.30 H new ATOM 0 HB3 TYR A 30 29.254 -7.340 -27.418 1.00 31.30 H new ATOM 0 HD1 TYR A 30 30.441 -7.432 -24.941 1.00 0.31 H new ATOM 0 HD2 TYR A 30 29.744 -10.773 -27.492 1.00 4.33 H new ATOM 0 HE1 TYR A 30 32.251 -8.660 -23.825 1.00 20.22 H new ATOM 0 HE2 TYR A 30 31.550 -12.005 -26.374 1.00 73.14 H new ATOM 0 HH TYR A 30 33.107 -11.986 -24.810 1.00 3.42 H new ATOM 454 N ARG A 31 28.089 -5.511 -25.832 1.00 33.14 N ATOM 455 CA ARG A 31 28.432 -4.279 -25.133 1.00 1.42 C ATOM 456 C ARG A 31 27.557 -4.093 -23.896 1.00 45.13 C ATOM 457 O ARG A 31 27.994 -3.529 -22.893 1.00 41.51 O ATOM 458 CB ARG A 31 28.275 -3.077 -26.067 1.00 25.14 C ATOM 459 CG ARG A 31 26.834 -2.627 -26.244 1.00 64.51 C ATOM 460 CD ARG A 31 26.708 -1.582 -27.341 1.00 61.35 C ATOM 461 NE ARG A 31 26.523 -0.239 -26.799 1.00 42.02 N ATOM 462 CZ ARG A 31 27.527 0.550 -26.432 1.00 32.23 C ATOM 463 NH1 ARG A 31 28.780 0.132 -26.548 1.00 73.12 N ATOM 464 NH2 ARG A 31 27.278 1.760 -25.947 1.00 62.30 N ATOM 0 H ARG A 31 27.877 -5.389 -26.822 1.00 33.14 H new ATOM 0 HA ARG A 31 29.472 -4.350 -24.814 1.00 1.42 H new ATOM 0 HB2 ARG A 31 28.861 -2.245 -25.676 1.00 25.14 H new ATOM 0 HB3 ARG A 31 28.690 -3.329 -27.043 1.00 25.14 H new ATOM 0 HG2 ARG A 31 26.210 -3.487 -26.486 1.00 64.51 H new ATOM 0 HG3 ARG A 31 26.462 -2.217 -25.305 1.00 64.51 H new ATOM 0 HD2 ARG A 31 27.602 -1.601 -27.964 1.00 61.35 H new ATOM 0 HD3 ARG A 31 25.865 -1.832 -27.985 1.00 61.35 H new ATOM 0 HE ARG A 31 25.571 0.113 -26.697 1.00 42.02 H new ATOM 0 HH11 ARG A 31 28.975 -0.798 -26.920 1.00 73.12 H new ATOM 0 HH12 ARG A 31 29.549 0.740 -26.265 1.00 73.12 H new ATOM 0 HH21 ARG A 31 26.315 2.085 -25.856 1.00 62.30 H new ATOM 0 HH22 ARG A 31 28.049 2.365 -25.665 1.00 62.30 H new ATOM 478 N VAL A 32 26.320 -4.571 -23.976 1.00 73.20 N ATOM 479 CA VAL A 32 25.384 -4.459 -22.864 1.00 14.41 C ATOM 480 C VAL A 32 25.692 -5.486 -21.780 1.00 54.32 C ATOM 481 O VAL A 32 25.546 -5.209 -20.590 1.00 31.51 O ATOM 482 CB VAL A 32 23.929 -4.645 -23.334 1.00 33.01 C ATOM 483 CG1 VAL A 32 22.971 -4.557 -22.155 1.00 42.13 C ATOM 484 CG2 VAL A 32 23.576 -3.615 -24.396 1.00 42.40 C ATOM 0 H VAL A 32 25.942 -5.040 -24.799 1.00 73.20 H new ATOM 0 HA VAL A 32 25.500 -3.456 -22.453 1.00 14.41 H new ATOM 0 HB VAL A 32 23.833 -5.637 -23.776 1.00 33.01 H new ATOM 0 HG11 VAL A 32 21.948 -4.691 -22.507 1.00 42.13 H new ATOM 0 HG12 VAL A 32 23.211 -5.337 -21.432 1.00 42.13 H new ATOM 0 HG13 VAL A 32 23.067 -3.580 -21.680 1.00 42.13 H new ATOM 0 HG21 VAL A 32 22.544 -3.762 -24.716 1.00 42.40 H new ATOM 0 HG22 VAL A 32 23.689 -2.613 -23.983 1.00 42.40 H new ATOM 0 HG23 VAL A 32 24.242 -3.732 -25.251 1.00 42.40 H new ATOM 494 N MET A 33 26.119 -6.672 -22.201 1.00 13.30 N ATOM 495 CA MET A 33 26.449 -7.740 -21.265 1.00 63.44 C ATOM 496 C MET A 33 27.535 -7.294 -20.291 1.00 54.41 C ATOM 497 O MET A 33 27.334 -7.300 -19.076 1.00 51.14 O ATOM 498 CB MET A 33 26.910 -8.987 -22.024 1.00 1.33 C ATOM 499 CG MET A 33 27.296 -10.143 -21.115 1.00 42.33 C ATOM 500 SD MET A 33 25.864 -10.973 -20.401 1.00 10.13 S ATOM 501 CE MET A 33 26.443 -11.271 -18.732 1.00 62.23 C ATOM 0 H MET A 33 26.244 -6.917 -23.183 1.00 13.30 H new ATOM 0 HA MET A 33 25.551 -7.980 -20.695 1.00 63.44 H new ATOM 0 HB2 MET A 33 26.112 -9.311 -22.692 1.00 1.33 H new ATOM 0 HB3 MET A 33 27.764 -8.727 -22.650 1.00 1.33 H new ATOM 0 HG2 MET A 33 27.884 -10.865 -21.682 1.00 42.33 H new ATOM 0 HG3 MET A 33 27.934 -9.772 -20.313 1.00 42.33 H new ATOM 0 HE1 MET A 33 25.736 -11.917 -18.212 1.00 62.23 H new ATOM 0 HE2 MET A 33 27.419 -11.755 -18.766 1.00 62.23 H new ATOM 0 HE3 MET A 33 26.527 -10.323 -18.201 1.00 62.23 H new ATOM 511 N LYS A 34 28.685 -6.906 -20.831 1.00 62.41 N ATOM 512 CA LYS A 34 29.803 -6.455 -20.010 1.00 73.32 C ATOM 513 C LYS A 34 29.474 -5.134 -19.323 1.00 1.04 C ATOM 514 O LYS A 34 30.088 -4.777 -18.316 1.00 72.35 O ATOM 515 CB LYS A 34 31.061 -6.297 -20.867 1.00 73.43 C ATOM 516 CG LYS A 34 32.341 -6.198 -20.056 1.00 31.11 C ATOM 517 CD LYS A 34 33.558 -6.041 -20.952 1.00 1.32 C ATOM 518 CE LYS A 34 34.826 -6.512 -20.257 1.00 4.53 C ATOM 519 NZ LYS A 34 35.200 -5.622 -19.123 1.00 4.32 N ATOM 0 H LYS A 34 28.868 -6.895 -21.834 1.00 62.41 H new ATOM 0 HA LYS A 34 29.986 -7.208 -19.243 1.00 73.32 H new ATOM 0 HB2 LYS A 34 31.136 -7.146 -21.547 1.00 73.43 H new ATOM 0 HB3 LYS A 34 30.961 -5.403 -21.483 1.00 73.43 H new ATOM 0 HG2 LYS A 34 32.277 -5.349 -19.376 1.00 31.11 H new ATOM 0 HG3 LYS A 34 32.453 -7.091 -19.441 1.00 31.11 H new ATOM 0 HD2 LYS A 34 33.412 -6.611 -21.870 1.00 1.32 H new ATOM 0 HD3 LYS A 34 33.667 -4.995 -21.240 1.00 1.32 H new ATOM 0 HE2 LYS A 34 34.683 -7.528 -19.889 1.00 4.53 H new ATOM 0 HE3 LYS A 34 35.644 -6.546 -20.977 1.00 4.53 H new ATOM 0 HZ1 LYS A 34 36.069 -5.977 -18.675 1.00 4.32 H new ATOM 0 HZ2 LYS A 34 35.362 -4.658 -19.477 1.00 4.32 H new ATOM 0 HZ3 LYS A 34 34.431 -5.609 -18.423 1.00 4.32 H new ATOM 533 N TYR A 35 28.502 -4.413 -19.871 1.00 5.15 N ATOM 534 CA TYR A 35 28.093 -3.131 -19.310 1.00 42.51 C ATOM 535 C TYR A 35 27.272 -3.328 -18.040 1.00 33.41 C ATOM 536 O TYR A 35 27.535 -2.703 -17.012 1.00 23.22 O ATOM 537 CB TYR A 35 27.283 -2.337 -20.336 1.00 50.14 C ATOM 538 CG TYR A 35 26.234 -1.441 -19.718 1.00 2.43 C ATOM 539 CD1 TYR A 35 26.593 -0.275 -19.052 1.00 31.34 C ATOM 540 CD2 TYR A 35 24.884 -1.759 -19.800 1.00 41.33 C ATOM 541 CE1 TYR A 35 25.638 0.546 -18.484 1.00 70.03 C ATOM 542 CE2 TYR A 35 23.922 -0.943 -19.237 1.00 41.42 C ATOM 543 CZ TYR A 35 24.304 0.208 -18.580 1.00 1.31 C ATOM 544 OH TYR A 35 23.350 1.025 -18.017 1.00 73.43 O ATOM 0 H TYR A 35 27.983 -4.694 -20.703 1.00 5.15 H new ATOM 0 HA TYR A 35 28.993 -2.572 -19.055 1.00 42.51 H new ATOM 0 HB2 TYR A 35 27.964 -1.728 -20.931 1.00 50.14 H new ATOM 0 HB3 TYR A 35 26.797 -3.033 -21.020 1.00 50.14 H new ATOM 0 HD1 TYR A 35 27.636 -0.006 -18.977 1.00 31.34 H new ATOM 0 HD2 TYR A 35 24.581 -2.660 -20.313 1.00 41.33 H new ATOM 0 HE1 TYR A 35 25.934 1.447 -17.968 1.00 70.03 H new ATOM 0 HE2 TYR A 35 22.877 -1.205 -19.311 1.00 41.42 H new ATOM 0 HH TYR A 35 22.504 0.923 -18.502 1.00 73.43 H new ATOM 554 N LEU A 36 26.275 -4.203 -18.118 1.00 71.04 N ATOM 555 CA LEU A 36 25.413 -4.486 -16.976 1.00 3.24 C ATOM 556 C LEU A 36 26.201 -5.152 -15.852 1.00 34.02 C ATOM 557 O LEU A 36 25.959 -4.893 -14.672 1.00 30.41 O ATOM 558 CB LEU A 36 24.249 -5.383 -17.399 1.00 51.23 C ATOM 559 CG LEU A 36 23.104 -4.691 -18.141 1.00 65.31 C ATOM 560 CD1 LEU A 36 22.065 -5.708 -18.586 1.00 31.54 C ATOM 561 CD2 LEU A 36 22.468 -3.624 -17.263 1.00 53.01 C ATOM 0 H LEU A 36 26.044 -4.729 -18.961 1.00 71.04 H new ATOM 0 HA LEU A 36 25.018 -3.539 -16.607 1.00 3.24 H new ATOM 0 HB2 LEU A 36 24.641 -6.177 -18.035 1.00 51.23 H new ATOM 0 HB3 LEU A 36 23.842 -5.861 -16.508 1.00 51.23 H new ATOM 0 HG LEU A 36 23.511 -4.207 -19.029 1.00 65.31 H new ATOM 0 HD11 LEU A 36 21.258 -5.198 -19.112 1.00 31.54 H new ATOM 0 HD12 LEU A 36 22.530 -6.435 -19.252 1.00 31.54 H new ATOM 0 HD13 LEU A 36 21.661 -6.221 -17.713 1.00 31.54 H new ATOM 0 HD21 LEU A 36 21.656 -3.142 -17.807 1.00 53.01 H new ATOM 0 HD22 LEU A 36 22.075 -4.085 -16.357 1.00 53.01 H new ATOM 0 HD23 LEU A 36 23.217 -2.879 -16.995 1.00 53.01 H new ATOM 573 N LEU A 37 27.144 -6.009 -16.225 1.00 45.02 N ATOM 574 CA LEU A 37 27.970 -6.711 -15.249 1.00 20.22 C ATOM 575 C LEU A 37 28.918 -5.747 -14.543 1.00 42.13 C ATOM 576 O LEU A 37 29.079 -5.799 -13.324 1.00 31.52 O ATOM 577 CB LEU A 37 28.770 -7.822 -15.932 1.00 55.13 C ATOM 578 CG LEU A 37 28.035 -9.146 -16.142 1.00 32.45 C ATOM 579 CD1 LEU A 37 28.910 -10.127 -16.907 1.00 34.00 C ATOM 580 CD2 LEU A 37 27.611 -9.738 -14.805 1.00 53.02 C ATOM 0 H LEU A 37 27.356 -6.235 -17.197 1.00 45.02 H new ATOM 0 HA LEU A 37 27.309 -7.153 -14.503 1.00 20.22 H new ATOM 0 HB2 LEU A 37 29.104 -7.457 -16.903 1.00 55.13 H new ATOM 0 HB3 LEU A 37 29.664 -8.016 -15.339 1.00 55.13 H new ATOM 0 HG LEU A 37 27.139 -8.953 -16.732 1.00 32.45 H new ATOM 0 HD11 LEU A 37 28.370 -11.064 -17.047 1.00 34.00 H new ATOM 0 HD12 LEU A 37 29.164 -9.706 -17.880 1.00 34.00 H new ATOM 0 HD13 LEU A 37 29.824 -10.316 -16.343 1.00 34.00 H new ATOM 0 HD21 LEU A 37 27.089 -10.680 -14.973 1.00 53.02 H new ATOM 0 HD22 LEU A 37 28.493 -9.917 -14.190 1.00 53.02 H new ATOM 0 HD23 LEU A 37 26.947 -9.042 -14.293 1.00 53.02 H new ATOM 592 N ASP A 38 29.542 -4.866 -15.318 1.00 32.12 N ATOM 593 CA ASP A 38 30.472 -3.887 -14.767 1.00 13.00 C ATOM 594 C ASP A 38 29.750 -2.914 -13.839 1.00 62.42 C ATOM 595 O ASP A 38 30.228 -2.616 -12.745 1.00 63.11 O ATOM 596 CB ASP A 38 31.163 -3.118 -15.894 1.00 61.30 C ATOM 597 CG ASP A 38 32.303 -2.254 -15.391 1.00 55.21 C ATOM 598 OD1 ASP A 38 33.189 -2.789 -14.693 1.00 42.35 O ATOM 599 OD2 ASP A 38 32.307 -1.042 -15.694 1.00 61.24 O ATOM 0 H ASP A 38 29.421 -4.810 -16.329 1.00 32.12 H new ATOM 0 HA ASP A 38 31.225 -4.423 -14.188 1.00 13.00 H new ATOM 0 HB2 ASP A 38 31.544 -3.824 -16.631 1.00 61.30 H new ATOM 0 HB3 ASP A 38 30.432 -2.490 -16.403 1.00 61.30 H new ATOM 604 N GLN A 39 28.598 -2.423 -14.285 1.00 25.30 N ATOM 605 CA GLN A 39 27.813 -1.483 -13.495 1.00 13.12 C ATOM 606 C GLN A 39 27.479 -2.068 -12.127 1.00 15.25 C ATOM 607 O GLN A 39 27.249 -1.334 -11.166 1.00 72.20 O ATOM 608 CB GLN A 39 26.525 -1.115 -14.234 1.00 12.23 C ATOM 609 CG GLN A 39 26.729 -0.092 -15.339 1.00 51.15 C ATOM 610 CD GLN A 39 27.347 1.197 -14.835 1.00 42.22 C ATOM 611 OE1 GLN A 39 27.131 1.596 -13.690 1.00 44.45 O ATOM 612 NE2 GLN A 39 28.122 1.856 -15.689 1.00 54.30 N ATOM 0 H GLN A 39 28.188 -2.661 -15.188 1.00 25.30 H new ATOM 0 HA GLN A 39 28.410 -0.583 -13.349 1.00 13.12 H new ATOM 0 HB2 GLN A 39 26.091 -2.018 -14.662 1.00 12.23 H new ATOM 0 HB3 GLN A 39 25.803 -0.724 -13.517 1.00 12.23 H new ATOM 0 HG2 GLN A 39 27.369 -0.520 -16.111 1.00 51.15 H new ATOM 0 HG3 GLN A 39 25.769 0.128 -15.806 1.00 51.15 H new ATOM 0 HE21 GLN A 39 28.273 1.488 -16.628 1.00 54.30 H new ATOM 0 HE22 GLN A 39 28.566 2.730 -15.405 1.00 54.30 H new ATOM 621 N GLY A 40 27.453 -3.395 -12.046 1.00 11.34 N ATOM 622 CA GLY A 40 27.145 -4.056 -10.791 1.00 3.42 C ATOM 623 C GLY A 40 25.733 -4.604 -10.756 1.00 32.44 C ATOM 624 O GLY A 40 24.928 -4.213 -9.910 1.00 51.42 O ATOM 0 H GLY A 40 27.640 -4.024 -12.827 1.00 11.34 H new ATOM 0 HA2 GLY A 40 27.852 -4.870 -10.630 1.00 3.42 H new ATOM 0 HA3 GLY A 40 27.278 -3.351 -9.970 1.00 3.42 H new ATOM 628 N TYR A 41 25.430 -5.512 -11.676 1.00 74.54 N ATOM 629 CA TYR A 41 24.103 -6.113 -11.750 1.00 40.01 C ATOM 630 C TYR A 41 24.194 -7.593 -12.107 1.00 62.42 C ATOM 631 O TYR A 41 25.200 -8.052 -12.650 1.00 74.43 O ATOM 632 CB TYR A 41 23.245 -5.380 -12.783 1.00 10.25 C ATOM 633 CG TYR A 41 22.897 -3.963 -12.385 1.00 24.03 C ATOM 634 CD1 TYR A 41 23.811 -2.930 -12.553 1.00 11.41 C ATOM 635 CD2 TYR A 41 21.656 -3.658 -11.840 1.00 4.12 C ATOM 636 CE1 TYR A 41 23.498 -1.634 -12.190 1.00 42.33 C ATOM 637 CE2 TYR A 41 21.335 -2.365 -11.476 1.00 15.23 C ATOM 638 CZ TYR A 41 22.259 -1.356 -11.653 1.00 33.33 C ATOM 639 OH TYR A 41 21.942 -0.067 -11.290 1.00 24.21 O ATOM 0 H TYR A 41 26.085 -5.849 -12.382 1.00 74.54 H new ATOM 0 HA TYR A 41 23.636 -6.022 -10.769 1.00 40.01 H new ATOM 0 HB2 TYR A 41 23.775 -5.361 -13.735 1.00 10.25 H new ATOM 0 HB3 TYR A 41 22.324 -5.941 -12.942 1.00 10.25 H new ATOM 0 HD1 TYR A 41 24.782 -3.144 -12.974 1.00 11.41 H new ATOM 0 HD2 TYR A 41 20.930 -4.445 -11.699 1.00 4.12 H new ATOM 0 HE1 TYR A 41 24.220 -0.843 -12.326 1.00 42.33 H new ATOM 0 HE2 TYR A 41 20.365 -2.145 -11.055 1.00 15.23 H new ATOM 0 HH TYR A 41 21.031 -0.043 -10.930 1.00 24.21 H new ATOM 649 N HIS A 42 23.136 -8.336 -11.799 1.00 31.25 N ATOM 650 CA HIS A 42 23.094 -9.765 -12.087 1.00 63.35 C ATOM 651 C HIS A 42 22.559 -10.020 -13.493 1.00 51.03 C ATOM 652 O HIS A 42 21.442 -9.623 -13.825 1.00 34.25 O ATOM 653 CB HIS A 42 22.225 -10.490 -11.059 1.00 43.11 C ATOM 654 CG HIS A 42 22.750 -11.839 -10.676 1.00 22.22 C ATOM 655 ND1 HIS A 42 23.064 -12.184 -9.378 1.00 1.30 N ATOM 656 CD2 HIS A 42 23.014 -12.933 -11.428 1.00 45.12 C ATOM 657 CE1 HIS A 42 23.500 -13.430 -9.349 1.00 24.30 C ATOM 658 NE2 HIS A 42 23.480 -13.908 -10.580 1.00 54.23 N ATOM 0 H HIS A 42 22.296 -7.972 -11.350 1.00 31.25 H new ATOM 0 HA HIS A 42 24.111 -10.152 -12.028 1.00 63.35 H new ATOM 0 HB2 HIS A 42 22.144 -9.873 -10.164 1.00 43.11 H new ATOM 0 HB3 HIS A 42 21.218 -10.602 -11.461 1.00 43.11 H new ATOM 0 HD2 HIS A 42 22.883 -13.023 -12.496 1.00 45.12 H new ATOM 0 HE1 HIS A 42 23.819 -13.967 -8.468 1.00 24.30 H new ATOM 0 HE2 HIS A 42 23.764 -14.848 -10.856 1.00 54.23 H new ATOM 666 N VAL A 43 23.364 -10.684 -14.317 1.00 1.23 N ATOM 667 CA VAL A 43 22.971 -10.992 -15.687 1.00 3.33 C ATOM 668 C VAL A 43 22.914 -12.498 -15.917 1.00 1.33 C ATOM 669 O VAL A 43 23.687 -13.255 -15.329 1.00 61.24 O ATOM 670 CB VAL A 43 23.944 -10.365 -16.704 1.00 15.34 C ATOM 671 CG1 VAL A 43 23.392 -10.489 -18.116 1.00 4.31 C ATOM 672 CG2 VAL A 43 24.214 -8.909 -16.354 1.00 21.21 C ATOM 0 H VAL A 43 24.292 -11.019 -14.059 1.00 1.23 H new ATOM 0 HA VAL A 43 21.978 -10.567 -15.835 1.00 3.33 H new ATOM 0 HB VAL A 43 24.889 -10.907 -16.660 1.00 15.34 H new ATOM 0 HG11 VAL A 43 24.092 -10.041 -18.821 1.00 4.31 H new ATOM 0 HG12 VAL A 43 23.254 -11.542 -18.361 1.00 4.31 H new ATOM 0 HG13 VAL A 43 22.434 -9.973 -18.179 1.00 4.31 H new ATOM 0 HG21 VAL A 43 24.903 -8.481 -17.082 1.00 21.21 H new ATOM 0 HG22 VAL A 43 23.278 -8.351 -16.370 1.00 21.21 H new ATOM 0 HG23 VAL A 43 24.655 -8.850 -15.359 1.00 21.21 H new ATOM 682 N ILE A 44 21.994 -12.925 -16.775 1.00 1.11 N ATOM 683 CA ILE A 44 21.837 -14.341 -17.084 1.00 2.23 C ATOM 684 C ILE A 44 21.720 -14.566 -18.587 1.00 53.44 C ATOM 685 O ILE A 44 20.630 -14.755 -19.129 1.00 22.14 O ATOM 686 CB ILE A 44 20.598 -14.935 -16.389 1.00 14.42 C ATOM 687 CG1 ILE A 44 20.618 -14.608 -14.894 1.00 42.43 C ATOM 688 CG2 ILE A 44 20.538 -16.439 -16.607 1.00 22.14 C ATOM 689 CD1 ILE A 44 19.354 -15.014 -14.169 1.00 42.14 C ATOM 0 H ILE A 44 21.346 -12.311 -17.269 1.00 1.11 H new ATOM 0 HA ILE A 44 22.729 -14.846 -16.712 1.00 2.23 H new ATOM 0 HB ILE A 44 19.705 -14.488 -16.827 1.00 14.42 H new ATOM 0 HG12 ILE A 44 21.469 -15.109 -14.432 1.00 42.43 H new ATOM 0 HG13 ILE A 44 20.772 -13.536 -14.767 1.00 42.43 H new ATOM 0 HG21 ILE A 44 19.657 -16.844 -16.110 1.00 22.14 H new ATOM 0 HG22 ILE A 44 20.481 -16.650 -17.675 1.00 22.14 H new ATOM 0 HG23 ILE A 44 21.433 -16.903 -16.193 1.00 22.14 H new ATOM 0 HD11 ILE A 44 19.439 -14.752 -13.114 1.00 42.14 H new ATOM 0 HD12 ILE A 44 18.501 -14.493 -14.605 1.00 42.14 H new ATOM 0 HD13 ILE A 44 19.209 -16.090 -14.265 1.00 42.14 H new ATOM 701 N PRO A 45 22.868 -14.546 -19.280 1.00 22.50 N ATOM 702 CA PRO A 45 22.921 -14.749 -20.731 1.00 21.01 C ATOM 703 C PRO A 45 22.591 -16.184 -21.128 1.00 43.23 C ATOM 704 O PRO A 45 23.020 -17.134 -20.474 1.00 23.12 O ATOM 705 CB PRO A 45 24.373 -14.417 -21.083 1.00 24.03 C ATOM 706 CG PRO A 45 25.135 -14.673 -19.828 1.00 61.43 C ATOM 707 CD PRO A 45 24.204 -14.326 -18.700 1.00 34.20 C ATOM 0 HA PRO A 45 22.190 -14.134 -21.256 1.00 21.01 H new ATOM 0 HB2 PRO A 45 24.735 -15.041 -21.900 1.00 24.03 H new ATOM 0 HB3 PRO A 45 24.476 -13.380 -21.404 1.00 24.03 H new ATOM 0 HG2 PRO A 45 25.449 -15.715 -19.768 1.00 61.43 H new ATOM 0 HG3 PRO A 45 26.039 -14.065 -19.789 1.00 61.43 H new ATOM 0 HD2 PRO A 45 24.374 -14.960 -17.830 1.00 34.20 H new ATOM 0 HD3 PRO A 45 24.335 -13.294 -18.373 1.00 34.20 H new ATOM 715 N VAL A 46 21.827 -16.334 -22.205 1.00 51.25 N ATOM 716 CA VAL A 46 21.441 -17.653 -22.691 1.00 71.32 C ATOM 717 C VAL A 46 21.639 -17.763 -24.199 1.00 34.32 C ATOM 718 O VAL A 46 21.073 -16.986 -24.968 1.00 4.23 O ATOM 719 CB VAL A 46 19.972 -17.968 -22.353 1.00 33.33 C ATOM 720 CG1 VAL A 46 19.610 -19.376 -22.801 1.00 63.11 C ATOM 721 CG2 VAL A 46 19.719 -17.793 -20.863 1.00 23.11 C ATOM 0 H VAL A 46 21.463 -15.558 -22.758 1.00 51.25 H new ATOM 0 HA VAL A 46 22.085 -18.376 -22.189 1.00 71.32 H new ATOM 0 HB VAL A 46 19.335 -17.266 -22.892 1.00 33.33 H new ATOM 0 HG11 VAL A 46 18.568 -19.580 -22.554 1.00 63.11 H new ATOM 0 HG12 VAL A 46 19.751 -19.462 -23.878 1.00 63.11 H new ATOM 0 HG13 VAL A 46 20.251 -20.096 -22.292 1.00 63.11 H new ATOM 0 HG21 VAL A 46 18.676 -18.020 -20.642 1.00 23.11 H new ATOM 0 HG22 VAL A 46 20.364 -18.470 -20.302 1.00 23.11 H new ATOM 0 HG23 VAL A 46 19.935 -16.764 -20.576 1.00 23.11 H new ATOM 731 N SER A 47 22.444 -18.735 -24.615 1.00 44.01 N ATOM 732 CA SER A 47 22.720 -18.945 -26.032 1.00 33.44 C ATOM 733 C SER A 47 22.912 -20.429 -26.333 1.00 42.41 C ATOM 734 O SER A 47 23.328 -21.213 -25.480 1.00 13.11 O ATOM 735 CB SER A 47 23.965 -18.162 -26.453 1.00 35.13 C ATOM 736 OG SER A 47 23.697 -17.347 -27.580 1.00 53.33 O ATOM 0 H SER A 47 22.917 -19.390 -23.992 1.00 44.01 H new ATOM 0 HA SER A 47 21.864 -18.584 -26.601 1.00 33.44 H new ATOM 0 HB2 SER A 47 24.306 -17.541 -25.624 1.00 35.13 H new ATOM 0 HB3 SER A 47 24.773 -18.855 -26.685 1.00 35.13 H new ATOM 0 HG SER A 47 24.508 -16.856 -27.828 1.00 53.33 H new ATOM 742 N PRO A 48 22.603 -20.824 -27.577 1.00 12.40 N ATOM 743 CA PRO A 48 22.734 -22.214 -28.021 1.00 73.44 C ATOM 744 C PRO A 48 24.190 -22.651 -28.140 1.00 0.51 C ATOM 745 O PRO A 48 24.484 -23.837 -28.290 1.00 13.21 O ATOM 746 CB PRO A 48 22.063 -22.212 -29.397 1.00 53.33 C ATOM 747 CG PRO A 48 22.183 -20.806 -29.875 1.00 13.45 C ATOM 748 CD PRO A 48 22.102 -19.943 -28.646 1.00 0.24 C ATOM 0 HA PRO A 48 22.285 -22.911 -27.313 1.00 73.44 H new ATOM 0 HB2 PRO A 48 22.556 -22.905 -30.079 1.00 53.33 H new ATOM 0 HB3 PRO A 48 21.019 -22.519 -29.329 1.00 53.33 H new ATOM 0 HG2 PRO A 48 23.126 -20.651 -30.399 1.00 13.45 H new ATOM 0 HG3 PRO A 48 21.385 -20.563 -30.576 1.00 13.45 H new ATOM 0 HD2 PRO A 48 22.711 -19.045 -28.745 1.00 0.24 H new ATOM 0 HD3 PRO A 48 21.081 -19.616 -28.451 1.00 0.24 H new ATOM 756 N LYS A 49 25.100 -21.684 -28.071 1.00 74.42 N ATOM 757 CA LYS A 49 26.527 -21.968 -28.169 1.00 15.21 C ATOM 758 C LYS A 49 27.201 -21.839 -26.807 1.00 3.10 C ATOM 759 O LYS A 49 28.165 -22.545 -26.511 1.00 64.13 O ATOM 760 CB LYS A 49 27.189 -21.018 -29.170 1.00 33.41 C ATOM 761 CG LYS A 49 28.377 -21.629 -29.893 1.00 12.11 C ATOM 762 CD LYS A 49 29.197 -20.570 -30.611 1.00 32.21 C ATOM 763 CE LYS A 49 30.489 -21.148 -31.167 1.00 71.44 C ATOM 764 NZ LYS A 49 31.483 -20.085 -31.479 1.00 45.12 N ATOM 0 H LYS A 49 24.874 -20.697 -27.948 1.00 74.42 H new ATOM 0 HA LYS A 49 26.646 -22.994 -28.518 1.00 15.21 H new ATOM 0 HB2 LYS A 49 26.448 -20.705 -29.906 1.00 33.41 H new ATOM 0 HB3 LYS A 49 27.516 -20.120 -28.645 1.00 33.41 H new ATOM 0 HG2 LYS A 49 29.008 -22.156 -29.177 1.00 12.11 H new ATOM 0 HG3 LYS A 49 28.025 -22.368 -30.613 1.00 12.11 H new ATOM 0 HD2 LYS A 49 28.609 -20.142 -31.423 1.00 32.21 H new ATOM 0 HD3 LYS A 49 29.427 -19.758 -29.922 1.00 32.21 H new ATOM 0 HE2 LYS A 49 30.916 -21.844 -30.445 1.00 71.44 H new ATOM 0 HE3 LYS A 49 30.272 -21.719 -32.070 1.00 71.44 H new ATOM 0 HZ1 LYS A 49 32.350 -20.520 -31.856 1.00 45.12 H new ATOM 0 HZ2 LYS A 49 31.086 -19.435 -32.187 1.00 45.12 H new ATOM 0 HZ3 LYS A 49 31.709 -19.556 -30.613 1.00 45.12 H new ATOM 778 N VAL A 50 26.687 -20.934 -25.980 1.00 45.32 N ATOM 779 CA VAL A 50 27.239 -20.714 -24.648 1.00 71.44 C ATOM 780 C VAL A 50 26.788 -21.803 -23.681 1.00 13.42 C ATOM 781 O VAL A 50 27.225 -21.846 -22.532 1.00 5.04 O ATOM 782 CB VAL A 50 26.824 -19.341 -24.089 1.00 2.35 C ATOM 783 CG1 VAL A 50 25.372 -19.364 -23.638 1.00 33.15 C ATOM 784 CG2 VAL A 50 27.740 -18.934 -22.944 1.00 10.11 C ATOM 0 H VAL A 50 25.889 -20.341 -26.209 1.00 45.32 H new ATOM 0 HA VAL A 50 28.324 -20.745 -24.745 1.00 71.44 H new ATOM 0 HB VAL A 50 26.921 -18.601 -24.883 1.00 2.35 H new ATOM 0 HG11 VAL A 50 25.097 -18.385 -23.246 1.00 33.15 H new ATOM 0 HG12 VAL A 50 24.732 -19.608 -24.486 1.00 33.15 H new ATOM 0 HG13 VAL A 50 25.245 -20.115 -22.859 1.00 33.15 H new ATOM 0 HG21 VAL A 50 27.433 -17.961 -22.560 1.00 10.11 H new ATOM 0 HG22 VAL A 50 27.677 -19.675 -22.147 1.00 10.11 H new ATOM 0 HG23 VAL A 50 28.767 -18.874 -23.303 1.00 10.11 H new ATOM 794 N ALA A 51 25.910 -22.681 -24.154 1.00 54.32 N ATOM 795 CA ALA A 51 25.401 -23.771 -23.332 1.00 34.32 C ATOM 796 C ALA A 51 26.524 -24.712 -22.911 1.00 5.14 C ATOM 797 O ALA A 51 26.909 -25.610 -23.659 1.00 13.14 O ATOM 798 CB ALA A 51 24.321 -24.538 -24.081 1.00 40.03 C ATOM 0 H ALA A 51 25.536 -22.658 -25.103 1.00 54.32 H new ATOM 0 HA ALA A 51 24.966 -23.340 -22.430 1.00 34.32 H new ATOM 0 HB1 ALA A 51 23.950 -25.349 -23.455 1.00 40.03 H new ATOM 0 HB2 ALA A 51 23.500 -23.864 -24.326 1.00 40.03 H new ATOM 0 HB3 ALA A 51 24.738 -24.951 -25.000 1.00 40.03 H new ATOM 804 N GLY A 52 27.049 -24.499 -21.707 1.00 73.03 N ATOM 805 CA GLY A 52 28.124 -25.336 -21.208 1.00 43.32 C ATOM 806 C GLY A 52 29.384 -24.546 -20.912 1.00 52.34 C ATOM 807 O GLY A 52 30.440 -25.121 -20.649 1.00 73.51 O ATOM 0 H GLY A 52 26.749 -23.762 -21.069 1.00 73.03 H new ATOM 0 HA2 GLY A 52 27.795 -25.842 -20.301 1.00 43.32 H new ATOM 0 HA3 GLY A 52 28.348 -26.110 -21.942 1.00 43.32 H new ATOM 811 N LYS A 53 29.274 -23.222 -20.957 1.00 23.30 N ATOM 812 CA LYS A 53 30.413 -22.351 -20.692 1.00 53.52 C ATOM 813 C LYS A 53 29.974 -21.094 -19.947 1.00 50.24 C ATOM 814 O LYS A 53 28.822 -20.669 -20.048 1.00 62.51 O ATOM 815 CB LYS A 53 31.102 -21.965 -22.003 1.00 53.11 C ATOM 816 CG LYS A 53 30.302 -20.987 -22.846 1.00 54.00 C ATOM 817 CD LYS A 53 31.085 -20.531 -24.065 1.00 42.33 C ATOM 818 CE LYS A 53 32.336 -19.761 -23.668 1.00 55.04 C ATOM 819 NZ LYS A 53 33.566 -20.588 -23.815 1.00 14.43 N ATOM 0 H LYS A 53 28.408 -22.729 -21.174 1.00 23.30 H new ATOM 0 HA LYS A 53 31.118 -22.897 -20.065 1.00 53.52 H new ATOM 0 HB2 LYS A 53 32.074 -21.527 -21.777 1.00 53.11 H new ATOM 0 HB3 LYS A 53 31.287 -22.867 -22.586 1.00 53.11 H new ATOM 0 HG2 LYS A 53 29.372 -21.457 -23.165 1.00 54.00 H new ATOM 0 HG3 LYS A 53 30.031 -20.121 -22.242 1.00 54.00 H new ATOM 0 HD2 LYS A 53 31.365 -21.398 -24.664 1.00 42.33 H new ATOM 0 HD3 LYS A 53 30.452 -19.902 -24.691 1.00 42.33 H new ATOM 0 HE2 LYS A 53 32.423 -18.867 -24.285 1.00 55.04 H new ATOM 0 HE3 LYS A 53 32.244 -19.427 -22.635 1.00 55.04 H new ATOM 0 HZ1 LYS A 53 34.329 -20.181 -23.238 1.00 14.43 H new ATOM 0 HZ2 LYS A 53 33.372 -21.559 -23.497 1.00 14.43 H new ATOM 0 HZ3 LYS A 53 33.857 -20.603 -24.813 1.00 14.43 H new ATOM 833 N THR A 54 30.900 -20.501 -19.200 1.00 12.40 N ATOM 834 CA THR A 54 30.609 -19.292 -18.439 1.00 34.43 C ATOM 835 C THR A 54 31.117 -18.051 -19.162 1.00 40.33 C ATOM 836 O THR A 54 32.325 -17.836 -19.275 1.00 13.12 O ATOM 837 CB THR A 54 31.238 -19.348 -17.034 1.00 64.01 C ATOM 838 OG1 THR A 54 32.219 -20.390 -16.978 1.00 2.21 O ATOM 839 CG2 THR A 54 30.175 -19.588 -15.973 1.00 73.13 C ATOM 0 H THR A 54 31.858 -20.838 -19.106 1.00 12.40 H new ATOM 0 HA THR A 54 29.525 -19.233 -18.342 1.00 34.43 H new ATOM 0 HB THR A 54 31.715 -18.388 -16.836 1.00 64.01 H new ATOM 0 HG1 THR A 54 32.616 -20.418 -16.082 1.00 2.21 H new ATOM 0 HG21 THR A 54 30.644 -19.624 -14.990 1.00 73.13 H new ATOM 0 HG22 THR A 54 29.446 -18.778 -15.998 1.00 73.13 H new ATOM 0 HG23 THR A 54 29.672 -20.535 -16.170 1.00 73.13 H new ATOM 847 N LEU A 55 30.189 -17.235 -19.651 1.00 62.31 N ATOM 848 CA LEU A 55 30.544 -16.013 -20.364 1.00 52.10 C ATOM 849 C LEU A 55 30.681 -14.840 -19.399 1.00 3.13 C ATOM 850 O LEU A 55 29.698 -14.389 -18.809 1.00 45.41 O ATOM 851 CB LEU A 55 29.489 -15.694 -21.425 1.00 43.22 C ATOM 852 CG LEU A 55 29.959 -15.757 -22.879 1.00 23.21 C ATOM 853 CD1 LEU A 55 30.890 -14.595 -23.190 1.00 60.40 C ATOM 854 CD2 LEU A 55 30.648 -17.085 -23.159 1.00 43.22 C ATOM 0 H LEU A 55 29.186 -17.398 -19.567 1.00 62.31 H new ATOM 0 HA LEU A 55 31.505 -16.173 -20.852 1.00 52.10 H new ATOM 0 HB2 LEU A 55 28.658 -16.388 -21.302 1.00 43.22 H new ATOM 0 HB3 LEU A 55 29.100 -14.694 -21.233 1.00 43.22 H new ATOM 0 HG LEU A 55 29.086 -15.679 -23.527 1.00 23.21 H new ATOM 0 HD11 LEU A 55 31.214 -14.657 -24.229 1.00 60.40 H new ATOM 0 HD12 LEU A 55 30.364 -13.654 -23.029 1.00 60.40 H new ATOM 0 HD13 LEU A 55 31.760 -14.641 -22.535 1.00 60.40 H new ATOM 0 HD21 LEU A 55 30.976 -17.113 -24.198 1.00 43.22 H new ATOM 0 HD22 LEU A 55 31.512 -17.192 -22.503 1.00 43.22 H new ATOM 0 HD23 LEU A 55 29.950 -17.902 -22.977 1.00 43.22 H new ATOM 866 N LEU A 56 31.906 -14.349 -19.243 1.00 51.02 N ATOM 867 CA LEU A 56 32.172 -13.226 -18.351 1.00 24.00 C ATOM 868 C LEU A 56 31.833 -13.585 -16.908 1.00 2.22 C ATOM 869 O LEU A 56 31.558 -12.710 -16.088 1.00 52.21 O ATOM 870 CB LEU A 56 31.367 -12.001 -18.787 1.00 1.34 C ATOM 871 CG LEU A 56 31.488 -11.607 -20.259 1.00 44.51 C ATOM 872 CD1 LEU A 56 30.739 -10.311 -20.528 1.00 73.15 C ATOM 873 CD2 LEU A 56 32.951 -11.471 -20.656 1.00 2.20 C ATOM 0 H LEU A 56 32.730 -14.711 -19.723 1.00 51.02 H new ATOM 0 HA LEU A 56 33.235 -12.993 -18.408 1.00 24.00 H new ATOM 0 HB2 LEU A 56 30.316 -12.185 -18.566 1.00 1.34 H new ATOM 0 HB3 LEU A 56 31.677 -11.152 -18.178 1.00 1.34 H new ATOM 0 HG LEU A 56 31.039 -12.395 -20.864 1.00 44.51 H new ATOM 0 HD11 LEU A 56 30.836 -10.046 -21.581 1.00 73.15 H new ATOM 0 HD12 LEU A 56 29.685 -10.442 -20.283 1.00 73.15 H new ATOM 0 HD13 LEU A 56 31.158 -9.514 -19.913 1.00 73.15 H new ATOM 0 HD21 LEU A 56 33.018 -11.190 -21.707 1.00 2.20 H new ATOM 0 HD22 LEU A 56 33.424 -10.703 -20.044 1.00 2.20 H new ATOM 0 HD23 LEU A 56 33.460 -12.422 -20.502 1.00 2.20 H new ATOM 885 N GLY A 57 31.857 -14.879 -16.604 1.00 22.14 N ATOM 886 CA GLY A 57 31.552 -15.331 -15.259 1.00 4.34 C ATOM 887 C GLY A 57 30.108 -15.764 -15.106 1.00 12.33 C ATOM 888 O GLY A 57 29.723 -16.308 -14.071 1.00 63.23 O ATOM 0 H GLY A 57 32.082 -15.622 -17.265 1.00 22.14 H new ATOM 0 HA2 GLY A 57 32.207 -16.164 -15.002 1.00 4.34 H new ATOM 0 HA3 GLY A 57 31.764 -14.528 -14.553 1.00 4.34 H new ATOM 892 N GLN A 58 29.306 -15.520 -16.137 1.00 43.35 N ATOM 893 CA GLN A 58 27.895 -15.886 -16.111 1.00 62.33 C ATOM 894 C GLN A 58 27.672 -17.241 -16.775 1.00 65.23 C ATOM 895 O GLN A 58 28.069 -17.454 -17.921 1.00 4.44 O ATOM 896 CB GLN A 58 27.056 -14.817 -16.813 1.00 33.23 C ATOM 897 CG GLN A 58 27.294 -13.412 -16.284 1.00 25.23 C ATOM 898 CD GLN A 58 27.392 -13.367 -14.772 1.00 5.24 C ATOM 899 OE1 GLN A 58 28.617 -13.346 -14.258 1.00 11.25 O flip ATOM 900 NE2 GLN A 58 26.379 -13.351 -14.073 1.00 13.22 N flip ATOM 0 H GLN A 58 29.609 -15.070 -17.001 1.00 43.35 H new ATOM 0 HA GLN A 58 27.583 -15.956 -15.069 1.00 62.33 H new ATOM 0 HB2 GLN A 58 27.277 -14.837 -17.880 1.00 33.23 H new ATOM 0 HB3 GLN A 58 26.000 -15.064 -16.701 1.00 33.23 H new ATOM 0 HG2 GLN A 58 28.213 -13.016 -16.716 1.00 25.23 H new ATOM 0 HG3 GLN A 58 26.482 -12.762 -16.611 1.00 25.23 H new ATOM 0 HE21 GLN A 58 25.458 -13.368 -14.510 1.00 13.22 H new ATOM 0 HE22 GLN A 58 26.461 -13.320 -13.057 1.00 13.22 H new ATOM 909 N GLN A 59 27.036 -18.154 -16.048 1.00 11.50 N ATOM 910 CA GLN A 59 26.762 -19.488 -16.567 1.00 72.21 C ATOM 911 C GLN A 59 25.936 -19.415 -17.847 1.00 34.50 C ATOM 912 O GLN A 59 24.976 -18.651 -17.935 1.00 73.25 O ATOM 913 CB GLN A 59 26.027 -20.325 -15.519 1.00 21.34 C ATOM 914 CG GLN A 59 25.734 -21.747 -15.971 1.00 3.30 C ATOM 915 CD GLN A 59 26.800 -22.731 -15.530 1.00 51.32 C ATOM 916 OE1 GLN A 59 26.893 -23.076 -14.352 1.00 3.11 O ATOM 917 NE2 GLN A 59 27.611 -23.189 -16.477 1.00 0.34 N ATOM 0 H GLN A 59 26.701 -17.994 -15.098 1.00 11.50 H new ATOM 0 HA GLN A 59 27.715 -19.963 -16.798 1.00 72.21 H new ATOM 0 HB2 GLN A 59 26.625 -20.358 -14.608 1.00 21.34 H new ATOM 0 HB3 GLN A 59 25.088 -19.832 -15.266 1.00 21.34 H new ATOM 0 HG2 GLN A 59 24.769 -22.059 -15.572 1.00 3.30 H new ATOM 0 HG3 GLN A 59 25.652 -21.769 -17.058 1.00 3.30 H new ATOM 0 HE21 GLN A 59 27.498 -22.876 -17.441 1.00 0.34 H new ATOM 0 HE22 GLN A 59 28.347 -23.854 -16.240 1.00 0.34 H new ATOM 926 N GLY A 60 26.316 -20.217 -18.838 1.00 2.52 N ATOM 927 CA GLY A 60 25.600 -20.227 -20.100 1.00 1.11 C ATOM 928 C GLY A 60 24.483 -21.251 -20.124 1.00 72.12 C ATOM 929 O GLY A 60 24.433 -22.146 -19.280 1.00 64.23 O ATOM 0 H GLY A 60 27.107 -20.859 -18.789 1.00 2.52 H new ATOM 0 HA2 GLY A 60 25.185 -19.237 -20.287 1.00 1.11 H new ATOM 0 HA3 GLY A 60 26.299 -20.437 -20.909 1.00 1.11 H new ATOM 933 N TYR A 61 23.583 -21.119 -21.092 1.00 71.43 N ATOM 934 CA TYR A 61 22.458 -22.039 -21.221 1.00 2.55 C ATOM 935 C TYR A 61 21.978 -22.114 -22.667 1.00 3.32 C ATOM 936 O TYR A 61 21.864 -21.096 -23.348 1.00 44.44 O ATOM 937 CB TYR A 61 21.308 -21.600 -20.312 1.00 23.40 C ATOM 938 CG TYR A 61 21.427 -22.113 -18.895 1.00 22.34 C ATOM 939 CD1 TYR A 61 21.074 -23.419 -18.576 1.00 0.13 C ATOM 940 CD2 TYR A 61 21.892 -21.293 -17.874 1.00 53.34 C ATOM 941 CE1 TYR A 61 21.180 -23.892 -17.282 1.00 43.20 C ATOM 942 CE2 TYR A 61 22.003 -21.758 -16.578 1.00 53.53 C ATOM 943 CZ TYR A 61 21.646 -23.058 -16.287 1.00 54.41 C ATOM 944 OH TYR A 61 21.753 -23.524 -14.997 1.00 23.01 O ATOM 0 H TYR A 61 23.610 -20.384 -21.799 1.00 71.43 H new ATOM 0 HA TYR A 61 22.795 -23.030 -20.918 1.00 2.55 H new ATOM 0 HB2 TYR A 61 21.266 -20.511 -20.293 1.00 23.40 H new ATOM 0 HB3 TYR A 61 20.367 -21.948 -20.738 1.00 23.40 H new ATOM 0 HD1 TYR A 61 20.711 -24.075 -19.353 1.00 0.13 H new ATOM 0 HD2 TYR A 61 22.172 -20.274 -18.098 1.00 53.34 H new ATOM 0 HE1 TYR A 61 20.900 -24.909 -17.051 1.00 43.20 H new ATOM 0 HE2 TYR A 61 22.367 -21.107 -15.797 1.00 53.53 H new ATOM 0 HH TYR A 61 22.098 -22.811 -14.419 1.00 23.01 H new ATOM 954 N ALA A 62 21.698 -23.328 -23.128 1.00 32.33 N ATOM 955 CA ALA A 62 21.228 -23.538 -24.491 1.00 55.03 C ATOM 956 C ALA A 62 19.824 -22.972 -24.681 1.00 45.34 C ATOM 957 O ALA A 62 19.493 -22.449 -25.746 1.00 71.22 O ATOM 958 CB ALA A 62 21.252 -25.020 -24.836 1.00 12.20 C ATOM 0 H ALA A 62 21.789 -24.182 -22.577 1.00 32.33 H new ATOM 0 HA ALA A 62 21.900 -23.008 -25.166 1.00 55.03 H new ATOM 0 HB1 ALA A 62 20.898 -25.162 -25.857 1.00 12.20 H new ATOM 0 HB2 ALA A 62 22.271 -25.397 -24.749 1.00 12.20 H new ATOM 0 HB3 ALA A 62 20.604 -25.564 -24.149 1.00 12.20 H new ATOM 964 N THR A 63 19.002 -23.079 -23.642 1.00 41.12 N ATOM 965 CA THR A 63 17.634 -22.579 -23.695 1.00 61.35 C ATOM 966 C THR A 63 17.157 -22.136 -22.317 1.00 74.13 C ATOM 967 O THR A 63 17.579 -22.682 -21.297 1.00 71.42 O ATOM 968 CB THR A 63 16.667 -23.646 -24.243 1.00 22.44 C ATOM 969 OG1 THR A 63 16.600 -24.756 -23.339 1.00 52.54 O ATOM 970 CG2 THR A 63 17.114 -24.129 -25.614 1.00 61.22 C ATOM 0 H THR A 63 19.260 -23.508 -22.753 1.00 41.12 H new ATOM 0 HA THR A 63 17.636 -21.722 -24.368 1.00 61.35 H new ATOM 0 HB THR A 63 15.679 -23.195 -24.339 1.00 22.44 H new ATOM 0 HG1 THR A 63 15.982 -25.429 -23.693 1.00 52.54 H new ATOM 0 HG21 THR A 63 16.416 -24.882 -25.980 1.00 61.22 H new ATOM 0 HG22 THR A 63 17.137 -23.288 -26.307 1.00 61.22 H new ATOM 0 HG23 THR A 63 18.110 -24.564 -25.539 1.00 61.22 H new ATOM 978 N LEU A 64 16.274 -21.144 -22.293 1.00 52.32 N ATOM 979 CA LEU A 64 15.738 -20.627 -21.039 1.00 35.12 C ATOM 980 C LEU A 64 14.943 -21.701 -20.303 1.00 20.22 C ATOM 981 O LEU A 64 14.669 -21.576 -19.110 1.00 23.54 O ATOM 982 CB LEU A 64 14.849 -19.411 -21.304 1.00 14.21 C ATOM 983 CG LEU A 64 13.829 -19.558 -22.434 1.00 31.12 C ATOM 984 CD1 LEU A 64 12.473 -19.021 -22.003 1.00 1.13 C ATOM 985 CD2 LEU A 64 14.314 -18.843 -23.687 1.00 21.35 C ATOM 0 H LEU A 64 15.914 -20.682 -23.128 1.00 52.32 H new ATOM 0 HA LEU A 64 16.576 -20.326 -20.411 1.00 35.12 H new ATOM 0 HB2 LEU A 64 14.312 -19.172 -20.386 1.00 14.21 H new ATOM 0 HB3 LEU A 64 15.491 -18.559 -21.529 1.00 14.21 H new ATOM 0 HG LEU A 64 13.721 -20.618 -22.664 1.00 31.12 H new ATOM 0 HD11 LEU A 64 11.760 -19.134 -22.820 1.00 1.13 H new ATOM 0 HD12 LEU A 64 12.121 -19.577 -21.135 1.00 1.13 H new ATOM 0 HD13 LEU A 64 12.565 -17.966 -21.745 1.00 1.13 H new ATOM 0 HD21 LEU A 64 13.576 -18.958 -24.481 1.00 21.35 H new ATOM 0 HD22 LEU A 64 14.452 -17.784 -23.471 1.00 21.35 H new ATOM 0 HD23 LEU A 64 15.262 -19.274 -24.008 1.00 21.35 H new ATOM 997 N ALA A 65 14.578 -22.757 -21.023 1.00 15.04 N ATOM 998 CA ALA A 65 13.818 -23.855 -20.437 1.00 45.00 C ATOM 999 C ALA A 65 14.657 -24.621 -19.419 1.00 50.41 C ATOM 1000 O ALA A 65 14.128 -25.395 -18.622 1.00 31.41 O ATOM 1001 CB ALA A 65 13.321 -24.793 -21.527 1.00 25.22 C ATOM 0 H ALA A 65 14.796 -22.875 -22.012 1.00 15.04 H new ATOM 0 HA ALA A 65 12.958 -23.433 -19.916 1.00 45.00 H new ATOM 0 HB1 ALA A 65 12.755 -25.608 -21.076 1.00 25.22 H new ATOM 0 HB2 ALA A 65 12.679 -24.243 -22.215 1.00 25.22 H new ATOM 0 HB3 ALA A 65 14.172 -25.201 -22.072 1.00 25.22 H new ATOM 1007 N ASP A 66 15.966 -24.399 -19.452 1.00 64.21 N ATOM 1008 CA ASP A 66 16.878 -25.068 -18.532 1.00 24.43 C ATOM 1009 C ASP A 66 17.156 -24.196 -17.311 1.00 73.13 C ATOM 1010 O ASP A 66 17.271 -24.695 -16.192 1.00 1.03 O ATOM 1011 CB ASP A 66 18.191 -25.410 -19.239 1.00 11.12 C ATOM 1012 CG ASP A 66 18.382 -26.904 -19.414 1.00 42.44 C ATOM 1013 OD1 ASP A 66 18.796 -27.568 -18.441 1.00 11.33 O ATOM 1014 OD2 ASP A 66 18.117 -27.409 -20.525 1.00 44.41 O ATOM 0 H ASP A 66 16.419 -23.761 -20.106 1.00 64.21 H new ATOM 0 HA ASP A 66 16.404 -25.990 -18.197 1.00 24.43 H new ATOM 0 HB2 ASP A 66 18.211 -24.927 -20.216 1.00 11.12 H new ATOM 0 HB3 ASP A 66 19.025 -25.005 -18.666 1.00 11.12 H new ATOM 1019 N VAL A 67 17.263 -22.890 -17.536 1.00 33.25 N ATOM 1020 CA VAL A 67 17.527 -21.948 -16.455 1.00 14.04 C ATOM 1021 C VAL A 67 16.560 -22.158 -15.294 1.00 65.22 C ATOM 1022 O VAL A 67 15.372 -21.850 -15.380 1.00 13.20 O ATOM 1023 CB VAL A 67 17.418 -20.491 -16.941 1.00 52.32 C ATOM 1024 CG1 VAL A 67 17.805 -19.526 -15.831 1.00 24.34 C ATOM 1025 CG2 VAL A 67 18.284 -20.275 -18.173 1.00 3.43 C ATOM 0 H VAL A 67 17.171 -22.461 -18.457 1.00 33.25 H new ATOM 0 HA VAL A 67 18.546 -22.135 -16.115 1.00 14.04 H new ATOM 0 HB VAL A 67 16.381 -20.294 -17.214 1.00 52.32 H new ATOM 0 HG11 VAL A 67 17.722 -18.502 -16.194 1.00 24.34 H new ATOM 0 HG12 VAL A 67 17.139 -19.665 -14.980 1.00 24.34 H new ATOM 0 HG13 VAL A 67 18.833 -19.719 -15.523 1.00 24.34 H new ATOM 0 HG21 VAL A 67 18.195 -19.240 -18.503 1.00 3.43 H new ATOM 0 HG22 VAL A 67 19.324 -20.490 -17.929 1.00 3.43 H new ATOM 0 HG23 VAL A 67 17.954 -20.940 -18.971 1.00 3.43 H new ATOM 1035 N PRO A 68 17.081 -22.696 -14.181 1.00 10.20 N ATOM 1036 CA PRO A 68 16.282 -22.959 -12.980 1.00 52.45 C ATOM 1037 C PRO A 68 15.852 -21.675 -12.278 1.00 23.44 C ATOM 1038 O PRO A 68 14.713 -21.555 -11.829 1.00 11.11 O ATOM 1039 CB PRO A 68 17.233 -23.763 -12.091 1.00 34.14 C ATOM 1040 CG PRO A 68 18.597 -23.361 -12.534 1.00 20.44 C ATOM 1041 CD PRO A 68 18.490 -23.088 -14.008 1.00 52.23 C ATOM 0 HA PRO A 68 15.353 -23.480 -13.213 1.00 52.45 H new ATOM 0 HB2 PRO A 68 17.076 -23.536 -11.037 1.00 34.14 H new ATOM 0 HB3 PRO A 68 17.077 -24.835 -12.213 1.00 34.14 H new ATOM 0 HG2 PRO A 68 18.937 -22.475 -11.997 1.00 20.44 H new ATOM 0 HG3 PRO A 68 19.321 -24.151 -12.335 1.00 20.44 H new ATOM 0 HD2 PRO A 68 19.169 -22.295 -14.320 1.00 52.23 H new ATOM 0 HD3 PRO A 68 18.737 -23.970 -14.599 1.00 52.23 H new ATOM 1049 N GLU A 69 16.772 -20.720 -12.186 1.00 52.43 N ATOM 1050 CA GLU A 69 16.486 -19.445 -11.537 1.00 65.43 C ATOM 1051 C GLU A 69 15.606 -18.569 -12.423 1.00 13.10 C ATOM 1052 O GLU A 69 16.053 -18.055 -13.449 1.00 34.12 O ATOM 1053 CB GLU A 69 17.789 -18.712 -11.209 1.00 34.11 C ATOM 1054 CG GLU A 69 17.584 -17.438 -10.407 1.00 50.33 C ATOM 1055 CD GLU A 69 17.660 -17.671 -8.911 1.00 34.21 C ATOM 1056 OE1 GLU A 69 18.468 -18.522 -8.484 1.00 42.10 O ATOM 1057 OE2 GLU A 69 16.911 -17.004 -8.167 1.00 73.01 O ATOM 0 H GLU A 69 17.720 -20.804 -12.552 1.00 52.43 H new ATOM 0 HA GLU A 69 15.949 -19.650 -10.611 1.00 65.43 H new ATOM 0 HB2 GLU A 69 18.442 -19.382 -10.650 1.00 34.11 H new ATOM 0 HB3 GLU A 69 18.303 -18.468 -12.139 1.00 34.11 H new ATOM 0 HG2 GLU A 69 18.339 -16.706 -10.696 1.00 50.33 H new ATOM 0 HG3 GLU A 69 16.613 -17.009 -10.655 1.00 50.33 H new ATOM 1064 N LYS A 70 14.351 -18.403 -12.020 1.00 13.34 N ATOM 1065 CA LYS A 70 13.405 -17.588 -12.774 1.00 64.52 C ATOM 1066 C LYS A 70 13.853 -16.131 -12.814 1.00 1.24 C ATOM 1067 O LYS A 70 14.030 -15.497 -11.773 1.00 52.12 O ATOM 1068 CB LYS A 70 12.009 -17.688 -12.157 1.00 13.54 C ATOM 1069 CG LYS A 70 11.437 -19.095 -12.167 1.00 44.22 C ATOM 1070 CD LYS A 70 9.918 -19.080 -12.131 1.00 64.34 C ATOM 1071 CE LYS A 70 9.344 -20.478 -12.301 1.00 35.35 C ATOM 1072 NZ LYS A 70 9.889 -21.428 -11.291 1.00 72.14 N ATOM 0 H LYS A 70 13.965 -18.823 -11.174 1.00 13.34 H new ATOM 0 HA LYS A 70 13.371 -17.967 -13.796 1.00 64.52 H new ATOM 0 HB2 LYS A 70 12.049 -17.329 -11.129 1.00 13.54 H new ATOM 0 HB3 LYS A 70 11.333 -17.027 -12.699 1.00 13.54 H new ATOM 0 HG2 LYS A 70 11.775 -19.620 -13.060 1.00 44.22 H new ATOM 0 HG3 LYS A 70 11.817 -19.649 -11.309 1.00 44.22 H new ATOM 0 HD2 LYS A 70 9.579 -18.659 -11.184 1.00 64.34 H new ATOM 0 HD3 LYS A 70 9.540 -18.432 -12.922 1.00 64.34 H new ATOM 0 HE2 LYS A 70 8.258 -20.438 -12.213 1.00 35.35 H new ATOM 0 HE3 LYS A 70 9.570 -20.844 -13.303 1.00 35.35 H new ATOM 0 HZ1 LYS A 70 9.365 -22.325 -11.340 1.00 72.14 H new ATOM 0 HZ2 LYS A 70 10.895 -21.603 -11.487 1.00 72.14 H new ATOM 0 HZ3 LYS A 70 9.787 -21.020 -10.340 1.00 72.14 H new ATOM 1086 N VAL A 71 14.034 -15.604 -14.021 1.00 33.33 N ATOM 1087 CA VAL A 71 14.458 -14.220 -14.195 1.00 62.44 C ATOM 1088 C VAL A 71 13.313 -13.255 -13.913 1.00 0.51 C ATOM 1089 O VAL A 71 12.155 -13.542 -14.217 1.00 63.14 O ATOM 1090 CB VAL A 71 14.986 -13.971 -15.621 1.00 12.12 C ATOM 1091 CG1 VAL A 71 13.852 -14.048 -16.631 1.00 74.24 C ATOM 1092 CG2 VAL A 71 15.690 -12.625 -15.700 1.00 3.14 C ATOM 0 H VAL A 71 13.894 -16.115 -14.893 1.00 33.33 H new ATOM 0 HA VAL A 71 15.262 -14.043 -13.481 1.00 62.44 H new ATOM 0 HB VAL A 71 15.710 -14.749 -15.863 1.00 12.12 H new ATOM 0 HG11 VAL A 71 14.244 -13.870 -17.632 1.00 74.24 H new ATOM 0 HG12 VAL A 71 13.396 -15.037 -16.591 1.00 74.24 H new ATOM 0 HG13 VAL A 71 13.102 -13.293 -16.395 1.00 74.24 H new ATOM 0 HG21 VAL A 71 16.057 -12.465 -16.714 1.00 3.14 H new ATOM 0 HG22 VAL A 71 14.989 -11.832 -15.438 1.00 3.14 H new ATOM 0 HG23 VAL A 71 16.529 -12.612 -15.004 1.00 3.14 H new ATOM 1102 N ASP A 72 13.644 -12.108 -13.329 1.00 50.14 N ATOM 1103 CA ASP A 72 12.643 -11.097 -13.007 1.00 23.54 C ATOM 1104 C ASP A 72 12.527 -10.070 -14.128 1.00 70.24 C ATOM 1105 O ASP A 72 11.486 -9.435 -14.296 1.00 63.10 O ATOM 1106 CB ASP A 72 12.998 -10.399 -11.693 1.00 42.22 C ATOM 1107 CG ASP A 72 12.297 -11.018 -10.500 1.00 63.21 C ATOM 1108 OD1 ASP A 72 12.716 -12.113 -10.068 1.00 2.31 O ATOM 1109 OD2 ASP A 72 11.330 -10.408 -9.998 1.00 64.31 O ATOM 0 H ASP A 72 14.597 -11.855 -13.069 1.00 50.14 H new ATOM 0 HA ASP A 72 11.680 -11.596 -12.896 1.00 23.54 H new ATOM 0 HB2 ASP A 72 14.076 -10.445 -11.541 1.00 42.22 H new ATOM 0 HB3 ASP A 72 12.730 -9.345 -11.761 1.00 42.22 H new ATOM 1114 N MET A 73 13.603 -9.912 -14.893 1.00 15.02 N ATOM 1115 CA MET A 73 13.620 -8.962 -15.999 1.00 5.52 C ATOM 1116 C MET A 73 14.380 -9.531 -17.193 1.00 30.13 C ATOM 1117 O MET A 73 15.591 -9.745 -17.126 1.00 75.14 O ATOM 1118 CB MET A 73 14.258 -7.643 -15.556 1.00 33.11 C ATOM 1119 CG MET A 73 13.790 -6.441 -16.361 1.00 34.44 C ATOM 1120 SD MET A 73 14.497 -4.892 -15.770 1.00 13.44 S ATOM 1121 CE MET A 73 13.015 -4.001 -15.299 1.00 25.54 C ATOM 0 H MET A 73 14.473 -10.429 -14.767 1.00 15.02 H new ATOM 0 HA MET A 73 12.589 -8.776 -16.302 1.00 5.52 H new ATOM 0 HB2 MET A 73 14.032 -7.475 -14.503 1.00 33.11 H new ATOM 0 HB3 MET A 73 15.342 -7.727 -15.640 1.00 33.11 H new ATOM 0 HG2 MET A 73 14.059 -6.583 -17.408 1.00 34.44 H new ATOM 0 HG3 MET A 73 12.703 -6.380 -16.317 1.00 34.44 H new ATOM 0 HE1 MET A 73 13.288 -3.019 -14.912 1.00 25.54 H new ATOM 0 HE2 MET A 73 12.370 -3.882 -16.170 1.00 25.54 H new ATOM 0 HE3 MET A 73 12.484 -4.560 -14.528 1.00 25.54 H new ATOM 1131 N VAL A 74 13.661 -9.775 -18.284 1.00 43.11 N ATOM 1132 CA VAL A 74 14.268 -10.319 -19.493 1.00 51.02 C ATOM 1133 C VAL A 74 14.628 -9.209 -20.475 1.00 33.34 C ATOM 1134 O VAL A 74 13.750 -8.585 -21.071 1.00 11.13 O ATOM 1135 CB VAL A 74 13.329 -11.321 -20.190 1.00 73.22 C ATOM 1136 CG1 VAL A 74 13.995 -11.908 -21.425 1.00 41.44 C ATOM 1137 CG2 VAL A 74 12.913 -12.421 -19.225 1.00 65.42 C ATOM 0 H VAL A 74 12.658 -9.605 -18.355 1.00 43.11 H new ATOM 0 HA VAL A 74 15.177 -10.837 -19.186 1.00 51.02 H new ATOM 0 HB VAL A 74 12.432 -10.790 -20.509 1.00 73.22 H new ATOM 0 HG11 VAL A 74 13.316 -12.614 -21.904 1.00 41.44 H new ATOM 0 HG12 VAL A 74 14.237 -11.107 -22.123 1.00 41.44 H new ATOM 0 HG13 VAL A 74 14.910 -12.425 -21.134 1.00 41.44 H new ATOM 0 HG21 VAL A 74 12.250 -13.120 -19.734 1.00 65.42 H new ATOM 0 HG22 VAL A 74 13.798 -12.951 -18.874 1.00 65.42 H new ATOM 0 HG23 VAL A 74 12.392 -11.981 -18.374 1.00 65.42 H new ATOM 1147 N ASP A 75 15.924 -8.969 -20.638 1.00 70.32 N ATOM 1148 CA ASP A 75 16.401 -7.935 -21.549 1.00 62.32 C ATOM 1149 C ASP A 75 16.576 -8.492 -22.959 1.00 5.23 C ATOM 1150 O ASP A 75 17.152 -9.564 -23.147 1.00 53.22 O ATOM 1151 CB ASP A 75 17.725 -7.355 -21.048 1.00 73.41 C ATOM 1152 CG ASP A 75 17.576 -6.633 -19.723 1.00 71.44 C ATOM 1153 OD1 ASP A 75 16.963 -7.209 -18.799 1.00 43.43 O ATOM 1154 OD2 ASP A 75 18.073 -5.493 -19.610 1.00 73.54 O ATOM 0 H ASP A 75 16.663 -9.476 -20.151 1.00 70.32 H new ATOM 0 HA ASP A 75 15.655 -7.141 -21.581 1.00 62.32 H new ATOM 0 HB2 ASP A 75 18.453 -8.159 -20.941 1.00 73.41 H new ATOM 0 HB3 ASP A 75 18.121 -6.664 -21.793 1.00 73.41 H new ATOM 1159 N VAL A 76 16.076 -7.756 -23.946 1.00 72.34 N ATOM 1160 CA VAL A 76 16.177 -8.176 -25.339 1.00 51.00 C ATOM 1161 C VAL A 76 16.887 -7.121 -26.181 1.00 31.55 C ATOM 1162 O VAL A 76 16.370 -6.023 -26.384 1.00 51.23 O ATOM 1163 CB VAL A 76 14.788 -8.450 -25.945 1.00 34.32 C ATOM 1164 CG1 VAL A 76 14.921 -9.068 -27.328 1.00 72.05 C ATOM 1165 CG2 VAL A 76 13.975 -9.350 -25.026 1.00 74.03 C ATOM 0 H VAL A 76 15.597 -6.866 -23.807 1.00 72.34 H new ATOM 0 HA VAL A 76 16.758 -9.098 -25.350 1.00 51.00 H new ATOM 0 HB VAL A 76 14.261 -7.501 -26.047 1.00 34.32 H new ATOM 0 HG11 VAL A 76 13.929 -9.254 -27.740 1.00 72.05 H new ATOM 0 HG12 VAL A 76 15.463 -8.384 -27.981 1.00 72.05 H new ATOM 0 HG13 VAL A 76 15.466 -10.009 -27.255 1.00 72.05 H new ATOM 0 HG21 VAL A 76 12.996 -9.534 -25.469 1.00 74.03 H new ATOM 0 HG22 VAL A 76 14.496 -10.298 -24.891 1.00 74.03 H new ATOM 0 HG23 VAL A 76 13.850 -8.864 -24.058 1.00 74.03 H new ATOM 1175 N PHE A 77 18.075 -7.463 -26.668 1.00 21.01 N ATOM 1176 CA PHE A 77 18.858 -6.545 -27.488 1.00 35.41 C ATOM 1177 C PHE A 77 19.116 -7.137 -28.871 1.00 14.33 C ATOM 1178 O PHE A 77 19.612 -6.454 -29.767 1.00 14.32 O ATOM 1179 CB PHE A 77 20.187 -6.223 -26.803 1.00 0.34 C ATOM 1180 CG PHE A 77 20.032 -5.756 -25.383 1.00 41.15 C ATOM 1181 CD1 PHE A 77 19.459 -4.526 -25.104 1.00 4.44 C ATOM 1182 CD2 PHE A 77 20.459 -6.547 -24.329 1.00 74.43 C ATOM 1183 CE1 PHE A 77 19.317 -4.093 -23.799 1.00 35.44 C ATOM 1184 CE2 PHE A 77 20.318 -6.121 -23.022 1.00 51.32 C ATOM 1185 CZ PHE A 77 19.745 -4.892 -22.757 1.00 21.44 C ATOM 0 H PHE A 77 18.517 -8.369 -26.509 1.00 21.01 H new ATOM 0 HA PHE A 77 18.286 -5.625 -27.607 1.00 35.41 H new ATOM 0 HB2 PHE A 77 20.819 -7.111 -26.818 1.00 0.34 H new ATOM 0 HB3 PHE A 77 20.705 -5.454 -27.376 1.00 0.34 H new ATOM 0 HD1 PHE A 77 19.120 -3.899 -25.915 1.00 4.44 H new ATOM 0 HD2 PHE A 77 20.908 -7.508 -24.531 1.00 74.43 H new ATOM 0 HE1 PHE A 77 18.872 -3.131 -23.594 1.00 35.44 H new ATOM 0 HE2 PHE A 77 20.655 -6.747 -22.209 1.00 51.32 H new ATOM 0 HZ PHE A 77 19.632 -4.557 -21.737 1.00 21.44 H new ATOM 1195 N ARG A 78 18.776 -8.411 -29.036 1.00 12.05 N ATOM 1196 CA ARG A 78 18.972 -9.096 -30.308 1.00 10.53 C ATOM 1197 C ARG A 78 18.363 -8.295 -31.455 1.00 62.13 C ATOM 1198 O ARG A 78 19.080 -7.700 -32.258 1.00 40.44 O ATOM 1199 CB ARG A 78 18.351 -10.493 -30.260 1.00 53.34 C ATOM 1200 CG ARG A 78 19.124 -11.474 -29.395 1.00 30.13 C ATOM 1201 CD ARG A 78 18.830 -12.914 -29.786 1.00 41.22 C ATOM 1202 NE ARG A 78 19.477 -13.282 -31.043 1.00 22.45 N ATOM 1203 CZ ARG A 78 19.421 -14.501 -31.568 1.00 51.03 C ATOM 1204 NH1 ARG A 78 18.750 -15.463 -30.950 1.00 23.11 N ATOM 1205 NH2 ARG A 78 20.036 -14.759 -32.715 1.00 51.04 N ATOM 0 H ARG A 78 18.363 -8.990 -28.305 1.00 12.05 H new ATOM 0 HA ARG A 78 20.044 -9.189 -30.482 1.00 10.53 H new ATOM 0 HB2 ARG A 78 17.331 -10.415 -29.883 1.00 53.34 H new ATOM 0 HB3 ARG A 78 18.287 -10.888 -31.274 1.00 53.34 H new ATOM 0 HG2 ARG A 78 20.193 -11.281 -29.490 1.00 30.13 H new ATOM 0 HG3 ARG A 78 18.864 -11.320 -28.348 1.00 30.13 H new ATOM 0 HD2 ARG A 78 19.170 -13.581 -28.994 1.00 41.22 H new ATOM 0 HD3 ARG A 78 17.753 -13.052 -29.879 1.00 41.22 H new ATOM 0 HE ARG A 78 20.000 -12.564 -31.545 1.00 22.45 H new ATOM 0 HH11 ARG A 78 18.275 -15.268 -30.069 1.00 23.11 H new ATOM 0 HH12 ARG A 78 18.709 -16.398 -31.356 1.00 23.11 H new ATOM 0 HH21 ARG A 78 20.552 -14.021 -33.194 1.00 51.04 H new ATOM 0 HH22 ARG A 78 19.993 -15.695 -33.118 1.00 51.04 H new ATOM 1219 N ASN A 79 17.036 -8.287 -31.525 1.00 50.25 N ATOM 1220 CA ASN A 79 16.331 -7.561 -32.575 1.00 54.33 C ATOM 1221 C ASN A 79 14.851 -7.412 -32.234 1.00 61.01 C ATOM 1222 O ASN A 79 14.373 -7.967 -31.245 1.00 73.53 O ATOM 1223 CB ASN A 79 16.486 -8.282 -33.916 1.00 4.41 C ATOM 1224 CG ASN A 79 17.654 -7.751 -34.725 1.00 61.22 C ATOM 1225 OD1 ASN A 79 17.819 -6.541 -34.879 1.00 13.25 O ATOM 1226 ND2 ASN A 79 18.472 -8.658 -35.248 1.00 54.31 N ATOM 0 H ASN A 79 16.427 -8.775 -30.868 1.00 50.25 H new ATOM 0 HA ASN A 79 16.771 -6.567 -32.652 1.00 54.33 H new ATOM 0 HB2 ASN A 79 16.625 -9.348 -33.738 1.00 4.41 H new ATOM 0 HB3 ASN A 79 15.568 -8.172 -34.493 1.00 4.41 H new ATOM 0 HD21 ASN A 79 19.275 -8.361 -35.803 1.00 54.31 H new ATOM 0 HD22 ASN A 79 18.297 -9.651 -35.095 1.00 54.31 H new ATOM 1233 N SER A 80 14.132 -6.659 -33.060 1.00 74.01 N ATOM 1234 CA SER A 80 12.707 -6.434 -32.845 1.00 20.45 C ATOM 1235 C SER A 80 11.930 -7.744 -32.937 1.00 24.33 C ATOM 1236 O SER A 80 11.276 -8.158 -31.980 1.00 72.15 O ATOM 1237 CB SER A 80 12.166 -5.435 -33.869 1.00 2.45 C ATOM 1238 OG SER A 80 13.082 -4.374 -34.079 1.00 2.03 O ATOM 0 H SER A 80 14.513 -6.194 -33.884 1.00 74.01 H new ATOM 0 HA SER A 80 12.577 -6.024 -31.844 1.00 20.45 H new ATOM 0 HB2 SER A 80 11.973 -5.945 -34.813 1.00 2.45 H new ATOM 0 HB3 SER A 80 11.213 -5.034 -33.523 1.00 2.45 H new ATOM 0 HG SER A 80 12.714 -3.750 -34.739 1.00 2.03 H new ATOM 1244 N GLU A 81 12.009 -8.391 -34.095 1.00 61.53 N ATOM 1245 CA GLU A 81 11.313 -9.654 -34.313 1.00 60.10 C ATOM 1246 C GLU A 81 11.675 -10.668 -33.232 1.00 32.42 C ATOM 1247 O GLU A 81 10.884 -11.553 -32.906 1.00 71.23 O ATOM 1248 CB GLU A 81 11.655 -10.219 -35.693 1.00 63.41 C ATOM 1249 CG GLU A 81 11.451 -9.227 -36.825 1.00 55.03 C ATOM 1250 CD GLU A 81 10.060 -8.622 -36.826 1.00 41.03 C ATOM 1251 OE1 GLU A 81 9.770 -7.801 -35.930 1.00 62.44 O ATOM 1252 OE2 GLU A 81 9.262 -8.969 -37.722 1.00 2.20 O ATOM 0 H GLU A 81 12.548 -8.062 -34.896 1.00 61.53 H new ATOM 0 HA GLU A 81 10.241 -9.462 -34.263 1.00 60.10 H new ATOM 0 HB2 GLU A 81 12.694 -10.549 -35.694 1.00 63.41 H new ATOM 0 HB3 GLU A 81 11.040 -11.100 -35.878 1.00 63.41 H new ATOM 0 HG2 GLU A 81 12.190 -8.430 -36.742 1.00 55.03 H new ATOM 0 HG3 GLU A 81 11.627 -9.727 -37.778 1.00 55.03 H new ATOM 1259 N ALA A 82 12.876 -10.533 -32.680 1.00 0.33 N ATOM 1260 CA ALA A 82 13.343 -11.435 -31.635 1.00 32.33 C ATOM 1261 C ALA A 82 12.462 -11.340 -30.393 1.00 45.22 C ATOM 1262 O ALA A 82 12.158 -12.349 -29.758 1.00 10.44 O ATOM 1263 CB ALA A 82 14.791 -11.130 -31.282 1.00 21.12 C ATOM 0 H ALA A 82 13.544 -9.807 -32.939 1.00 0.33 H new ATOM 0 HA ALA A 82 13.281 -12.455 -32.015 1.00 32.33 H new ATOM 0 HB1 ALA A 82 15.126 -11.812 -30.500 1.00 21.12 H new ATOM 0 HB2 ALA A 82 15.416 -11.257 -32.166 1.00 21.12 H new ATOM 0 HB3 ALA A 82 14.870 -10.103 -30.926 1.00 21.12 H new ATOM 1269 N ALA A 83 12.057 -10.121 -30.053 1.00 43.42 N ATOM 1270 CA ALA A 83 11.211 -9.894 -28.888 1.00 72.04 C ATOM 1271 C ALA A 83 9.983 -10.798 -28.918 1.00 10.11 C ATOM 1272 O ALA A 83 9.552 -11.309 -27.884 1.00 64.43 O ATOM 1273 CB ALA A 83 10.792 -8.433 -28.817 1.00 34.23 C ATOM 0 H ALA A 83 12.301 -9.275 -30.568 1.00 43.42 H new ATOM 0 HA ALA A 83 11.788 -10.138 -27.996 1.00 72.04 H new ATOM 0 HB1 ALA A 83 10.161 -8.278 -27.942 1.00 34.23 H new ATOM 0 HB2 ALA A 83 11.679 -7.804 -28.741 1.00 34.23 H new ATOM 0 HB3 ALA A 83 10.236 -8.170 -29.717 1.00 34.23 H new ATOM 1279 N TRP A 84 9.424 -10.989 -30.107 1.00 71.42 N ATOM 1280 CA TRP A 84 8.244 -11.832 -30.270 1.00 43.53 C ATOM 1281 C TRP A 84 8.559 -13.282 -29.922 1.00 33.20 C ATOM 1282 O TRP A 84 7.889 -13.889 -29.087 1.00 61.23 O ATOM 1283 CB TRP A 84 7.722 -11.740 -31.705 1.00 34.21 C ATOM 1284 CG TRP A 84 6.625 -12.718 -32.001 1.00 11.02 C ATOM 1285 CD1 TRP A 84 6.768 -14.037 -32.324 1.00 61.12 C ATOM 1286 CD2 TRP A 84 5.218 -12.453 -32.002 1.00 51.03 C ATOM 1287 NE1 TRP A 84 5.535 -14.608 -32.527 1.00 32.13 N ATOM 1288 CE2 TRP A 84 4.567 -13.658 -32.334 1.00 45.54 C ATOM 1289 CE3 TRP A 84 4.444 -11.316 -31.753 1.00 61.25 C ATOM 1290 CZ2 TRP A 84 3.181 -13.754 -32.425 1.00 24.34 C ATOM 1291 CZ3 TRP A 84 3.069 -11.414 -31.844 1.00 13.13 C ATOM 1292 CH2 TRP A 84 2.449 -12.626 -32.176 1.00 14.20 C ATOM 0 H TRP A 84 9.768 -10.572 -30.972 1.00 71.42 H new ATOM 0 HA TRP A 84 7.474 -11.474 -29.587 1.00 43.53 H new ATOM 0 HB2 TRP A 84 7.357 -10.729 -31.887 1.00 34.21 H new ATOM 0 HB3 TRP A 84 8.547 -11.910 -32.396 1.00 34.21 H new ATOM 0 HD1 TRP A 84 7.712 -14.555 -32.408 1.00 61.12 H new ATOM 0 HE1 TRP A 84 5.367 -15.582 -32.780 1.00 32.13 H new ATOM 0 HE3 TRP A 84 4.912 -10.378 -31.494 1.00 61.25 H new ATOM 0 HZ2 TRP A 84 2.701 -14.686 -32.683 1.00 24.34 H new ATOM 0 HZ3 TRP A 84 2.461 -10.541 -31.656 1.00 13.13 H new ATOM 0 HH2 TRP A 84 1.372 -12.670 -32.236 1.00 14.20 H new ATOM 1303 N GLY A 85 9.583 -13.833 -30.567 1.00 75.03 N ATOM 1304 CA GLY A 85 9.967 -15.209 -30.311 1.00 42.32 C ATOM 1305 C GLY A 85 10.339 -15.446 -28.861 1.00 64.32 C ATOM 1306 O GLY A 85 9.940 -16.447 -28.266 1.00 33.11 O ATOM 0 H GLY A 85 10.153 -13.351 -31.262 1.00 75.03 H new ATOM 0 HA2 GLY A 85 9.144 -15.870 -30.585 1.00 42.32 H new ATOM 0 HA3 GLY A 85 10.812 -15.472 -30.947 1.00 42.32 H new ATOM 1310 N VAL A 86 11.109 -14.525 -28.291 1.00 11.34 N ATOM 1311 CA VAL A 86 11.536 -14.639 -26.901 1.00 51.22 C ATOM 1312 C VAL A 86 10.373 -14.393 -25.947 1.00 12.32 C ATOM 1313 O VAL A 86 10.387 -14.850 -24.804 1.00 51.42 O ATOM 1314 CB VAL A 86 12.669 -13.646 -26.579 1.00 31.31 C ATOM 1315 CG1 VAL A 86 13.086 -13.767 -25.121 1.00 50.21 C ATOM 1316 CG2 VAL A 86 13.856 -13.875 -27.502 1.00 71.34 C ATOM 0 H VAL A 86 11.450 -13.692 -28.770 1.00 11.34 H new ATOM 0 HA VAL A 86 11.904 -15.656 -26.765 1.00 51.22 H new ATOM 0 HB VAL A 86 12.300 -12.634 -26.744 1.00 31.31 H new ATOM 0 HG11 VAL A 86 13.887 -13.058 -24.912 1.00 50.21 H new ATOM 0 HG12 VAL A 86 12.232 -13.550 -24.479 1.00 50.21 H new ATOM 0 HG13 VAL A 86 13.438 -14.780 -24.926 1.00 50.21 H new ATOM 0 HG21 VAL A 86 14.647 -13.165 -27.261 1.00 71.34 H new ATOM 0 HG22 VAL A 86 14.228 -14.891 -27.371 1.00 71.34 H new ATOM 0 HG23 VAL A 86 13.545 -13.733 -28.537 1.00 71.34 H new ATOM 1326 N ALA A 87 9.366 -13.668 -26.424 1.00 3.21 N ATOM 1327 CA ALA A 87 8.193 -13.363 -25.614 1.00 4.10 C ATOM 1328 C ALA A 87 7.372 -14.619 -25.342 1.00 42.23 C ATOM 1329 O ALA A 87 7.141 -14.982 -24.189 1.00 63.25 O ATOM 1330 CB ALA A 87 7.338 -12.309 -26.300 1.00 54.34 C ATOM 0 H ALA A 87 9.339 -13.281 -27.367 1.00 3.21 H new ATOM 0 HA ALA A 87 8.535 -12.970 -24.656 1.00 4.10 H new ATOM 0 HB1 ALA A 87 6.466 -12.091 -25.684 1.00 54.34 H new ATOM 0 HB2 ALA A 87 7.922 -11.399 -26.437 1.00 54.34 H new ATOM 0 HB3 ALA A 87 7.012 -12.681 -27.272 1.00 54.34 H new ATOM 1336 N GLN A 88 6.934 -15.276 -26.411 1.00 30.40 N ATOM 1337 CA GLN A 88 6.137 -16.491 -26.286 1.00 61.02 C ATOM 1338 C GLN A 88 6.821 -17.499 -25.368 1.00 13.31 C ATOM 1339 O GLN A 88 6.166 -18.171 -24.572 1.00 75.05 O ATOM 1340 CB GLN A 88 5.902 -17.115 -27.663 1.00 34.43 C ATOM 1341 CG GLN A 88 7.173 -17.290 -28.477 1.00 42.43 C ATOM 1342 CD GLN A 88 6.905 -17.827 -29.869 1.00 65.13 C ATOM 1343 OE1 GLN A 88 7.521 -18.803 -30.300 1.00 5.53 O ATOM 1344 NE2 GLN A 88 5.982 -17.192 -30.582 1.00 23.11 N ATOM 0 H GLN A 88 7.117 -14.988 -27.372 1.00 30.40 H new ATOM 0 HA GLN A 88 5.176 -16.222 -25.848 1.00 61.02 H new ATOM 0 HB2 GLN A 88 5.426 -18.087 -27.536 1.00 34.43 H new ATOM 0 HB3 GLN A 88 5.206 -16.490 -28.222 1.00 34.43 H new ATOM 0 HG2 GLN A 88 7.685 -16.331 -28.554 1.00 42.43 H new ATOM 0 HG3 GLN A 88 7.845 -17.969 -27.953 1.00 42.43 H new ATOM 0 HE21 GLN A 88 5.496 -16.388 -30.186 1.00 23.11 H new ATOM 0 HE22 GLN A 88 5.759 -17.509 -31.526 1.00 23.11 H new ATOM 1353 N GLU A 89 8.141 -17.597 -25.485 1.00 23.54 N ATOM 1354 CA GLU A 89 8.913 -18.525 -24.665 1.00 53.40 C ATOM 1355 C GLU A 89 8.892 -18.101 -23.199 1.00 65.21 C ATOM 1356 O GLU A 89 8.711 -18.928 -22.306 1.00 1.12 O ATOM 1357 CB GLU A 89 10.357 -18.602 -25.165 1.00 73.10 C ATOM 1358 CG GLU A 89 10.491 -19.229 -26.543 1.00 0.43 C ATOM 1359 CD GLU A 89 11.730 -20.093 -26.672 1.00 72.41 C ATOM 1360 OE1 GLU A 89 12.810 -19.541 -26.970 1.00 12.04 O ATOM 1361 OE2 GLU A 89 11.620 -21.322 -26.476 1.00 52.34 O ATOM 0 H GLU A 89 8.698 -17.046 -26.138 1.00 23.54 H new ATOM 0 HA GLU A 89 8.455 -19.511 -24.747 1.00 53.40 H new ATOM 0 HB2 GLU A 89 10.778 -17.597 -25.190 1.00 73.10 H new ATOM 0 HB3 GLU A 89 10.949 -19.178 -24.454 1.00 73.10 H new ATOM 0 HG2 GLU A 89 9.608 -19.833 -26.751 1.00 0.43 H new ATOM 0 HG3 GLU A 89 10.522 -18.441 -27.295 1.00 0.43 H new ATOM 1368 N ALA A 90 9.081 -16.807 -22.960 1.00 73.43 N ATOM 1369 CA ALA A 90 9.083 -16.273 -21.604 1.00 72.31 C ATOM 1370 C ALA A 90 7.721 -16.453 -20.941 1.00 64.31 C ATOM 1371 O ALA A 90 7.635 -16.817 -19.768 1.00 4.43 O ATOM 1372 CB ALA A 90 9.476 -14.803 -21.616 1.00 71.54 C ATOM 0 H ALA A 90 9.235 -16.110 -23.688 1.00 73.43 H new ATOM 0 HA ALA A 90 9.818 -16.829 -21.022 1.00 72.31 H new ATOM 0 HB1 ALA A 90 9.473 -14.417 -20.597 1.00 71.54 H new ATOM 0 HB2 ALA A 90 10.474 -14.697 -22.042 1.00 71.54 H new ATOM 0 HB3 ALA A 90 8.763 -14.241 -22.219 1.00 71.54 H new ATOM 1378 N ILE A 91 6.661 -16.196 -21.699 1.00 72.21 N ATOM 1379 CA ILE A 91 5.304 -16.331 -21.184 1.00 52.41 C ATOM 1380 C ILE A 91 5.007 -17.773 -20.787 1.00 53.42 C ATOM 1381 O ILE A 91 4.215 -18.027 -19.880 1.00 41.20 O ATOM 1382 CB ILE A 91 4.261 -15.870 -22.219 1.00 53.51 C ATOM 1383 CG1 ILE A 91 4.515 -14.414 -22.618 1.00 34.30 C ATOM 1384 CG2 ILE A 91 2.854 -16.034 -21.663 1.00 62.41 C ATOM 1385 CD1 ILE A 91 3.916 -14.041 -23.956 1.00 72.31 C ATOM 0 H ILE A 91 6.715 -15.893 -22.672 1.00 72.21 H new ATOM 0 HA ILE A 91 5.236 -15.693 -20.303 1.00 52.41 H new ATOM 0 HB ILE A 91 4.354 -16.493 -23.109 1.00 53.51 H new ATOM 0 HG12 ILE A 91 4.105 -13.758 -21.850 1.00 34.30 H new ATOM 0 HG13 ILE A 91 5.590 -14.236 -22.648 1.00 34.30 H new ATOM 0 HG21 ILE A 91 2.128 -15.704 -22.406 1.00 62.41 H new ATOM 0 HG22 ILE A 91 2.677 -17.083 -21.424 1.00 62.41 H new ATOM 0 HG23 ILE A 91 2.747 -15.433 -20.760 1.00 62.41 H new ATOM 0 HD11 ILE A 91 4.135 -12.996 -24.174 1.00 72.31 H new ATOM 0 HD12 ILE A 91 4.344 -14.672 -24.735 1.00 72.31 H new ATOM 0 HD13 ILE A 91 2.836 -14.186 -23.924 1.00 72.31 H new ATOM 1397 N ALA A 92 5.649 -18.713 -21.472 1.00 73.31 N ATOM 1398 CA ALA A 92 5.456 -20.130 -21.189 1.00 24.14 C ATOM 1399 C ALA A 92 6.115 -20.520 -19.870 1.00 33.44 C ATOM 1400 O ALA A 92 5.495 -21.165 -19.023 1.00 64.52 O ATOM 1401 CB ALA A 92 6.008 -20.976 -22.327 1.00 5.33 C ATOM 0 H ALA A 92 6.307 -18.519 -22.227 1.00 73.31 H new ATOM 0 HA ALA A 92 4.386 -20.315 -21.100 1.00 24.14 H new ATOM 0 HB1 ALA A 92 5.857 -22.032 -22.102 1.00 5.33 H new ATOM 0 HB2 ALA A 92 5.489 -20.724 -23.252 1.00 5.33 H new ATOM 0 HB3 ALA A 92 7.074 -20.779 -22.443 1.00 5.33 H new ATOM 1407 N ILE A 93 7.372 -20.126 -19.702 1.00 65.01 N ATOM 1408 CA ILE A 93 8.114 -20.435 -18.486 1.00 13.24 C ATOM 1409 C ILE A 93 7.585 -19.633 -17.301 1.00 74.31 C ATOM 1410 O ILE A 93 7.726 -20.041 -16.149 1.00 60.31 O ATOM 1411 CB ILE A 93 9.617 -20.148 -18.654 1.00 44.04 C ATOM 1412 CG1 ILE A 93 9.840 -18.683 -19.036 1.00 33.01 C ATOM 1413 CG2 ILE A 93 10.218 -21.071 -19.704 1.00 21.32 C ATOM 1414 CD1 ILE A 93 11.283 -18.243 -18.928 1.00 50.05 C ATOM 0 H ILE A 93 7.899 -19.592 -20.393 1.00 65.01 H new ATOM 0 HA ILE A 93 7.975 -21.499 -18.294 1.00 13.24 H new ATOM 0 HB ILE A 93 10.116 -20.336 -17.703 1.00 44.04 H new ATOM 0 HG12 ILE A 93 9.496 -18.526 -20.059 1.00 33.01 H new ATOM 0 HG13 ILE A 93 9.227 -18.051 -18.393 1.00 33.01 H new ATOM 0 HG21 ILE A 93 11.281 -20.856 -19.812 1.00 21.32 H new ATOM 0 HG22 ILE A 93 10.087 -22.108 -19.395 1.00 21.32 H new ATOM 0 HG23 ILE A 93 9.717 -20.911 -20.659 1.00 21.32 H new ATOM 0 HD11 ILE A 93 11.366 -17.194 -19.214 1.00 50.05 H new ATOM 0 HD12 ILE A 93 11.625 -18.367 -17.901 1.00 50.05 H new ATOM 0 HD13 ILE A 93 11.899 -18.850 -19.592 1.00 50.05 H new ATOM 1426 N GLY A 94 6.972 -18.490 -17.593 1.00 42.33 N ATOM 1427 CA GLY A 94 6.429 -17.649 -16.542 1.00 62.32 C ATOM 1428 C GLY A 94 7.315 -16.457 -16.237 1.00 74.33 C ATOM 1429 O GLY A 94 7.707 -16.245 -15.091 1.00 4.43 O ATOM 0 H GLY A 94 6.842 -18.131 -18.539 1.00 42.33 H new ATOM 0 HA2 GLY A 94 5.440 -17.297 -16.837 1.00 62.32 H new ATOM 0 HA3 GLY A 94 6.299 -18.242 -15.637 1.00 62.32 H new ATOM 1433 N ALA A 95 7.631 -15.679 -17.267 1.00 11.53 N ATOM 1434 CA ALA A 95 8.475 -14.502 -17.103 1.00 43.32 C ATOM 1435 C ALA A 95 7.810 -13.470 -16.199 1.00 13.11 C ATOM 1436 O ALA A 95 6.753 -13.725 -15.620 1.00 63.23 O ATOM 1437 CB ALA A 95 8.796 -13.890 -18.459 1.00 11.32 C ATOM 0 H ALA A 95 7.315 -15.842 -18.223 1.00 11.53 H new ATOM 0 HA ALA A 95 9.405 -14.816 -16.628 1.00 43.32 H new ATOM 0 HB1 ALA A 95 9.427 -13.012 -18.322 1.00 11.32 H new ATOM 0 HB2 ALA A 95 9.321 -14.622 -19.073 1.00 11.32 H new ATOM 0 HB3 ALA A 95 7.870 -13.598 -18.955 1.00 11.32 H new ATOM 1443 N LYS A 96 8.434 -12.303 -16.080 1.00 65.34 N ATOM 1444 CA LYS A 96 7.903 -11.231 -15.247 1.00 22.42 C ATOM 1445 C LYS A 96 7.981 -9.891 -15.970 1.00 0.53 C ATOM 1446 O LYS A 96 7.052 -9.084 -15.907 1.00 62.30 O ATOM 1447 CB LYS A 96 8.672 -11.156 -13.926 1.00 20.02 C ATOM 1448 CG LYS A 96 8.472 -12.370 -13.035 1.00 74.13 C ATOM 1449 CD LYS A 96 7.106 -12.354 -12.370 1.00 34.20 C ATOM 1450 CE LYS A 96 7.095 -11.458 -11.141 1.00 75.11 C ATOM 1451 NZ LYS A 96 6.106 -11.919 -10.128 1.00 15.15 N ATOM 0 H LYS A 96 9.310 -12.075 -16.551 1.00 65.34 H new ATOM 0 HA LYS A 96 6.856 -11.451 -15.039 1.00 22.42 H new ATOM 0 HB2 LYS A 96 9.735 -11.044 -14.140 1.00 20.02 H new ATOM 0 HB3 LYS A 96 8.360 -10.263 -13.384 1.00 20.02 H new ATOM 0 HG2 LYS A 96 8.579 -13.279 -13.627 1.00 74.13 H new ATOM 0 HG3 LYS A 96 9.249 -12.394 -12.271 1.00 74.13 H new ATOM 0 HD2 LYS A 96 6.358 -12.006 -13.082 1.00 34.20 H new ATOM 0 HD3 LYS A 96 6.827 -13.368 -12.085 1.00 34.20 H new ATOM 0 HE2 LYS A 96 8.090 -11.440 -10.696 1.00 75.11 H new ATOM 0 HE3 LYS A 96 6.861 -10.436 -11.439 1.00 75.11 H new ATOM 0 HZ1 LYS A 96 6.129 -11.283 -9.306 1.00 15.15 H new ATOM 0 HZ2 LYS A 96 5.153 -11.912 -10.545 1.00 15.15 H new ATOM 0 HZ3 LYS A 96 6.344 -12.885 -9.825 1.00 15.15 H new ATOM 1465 N THR A 97 9.095 -9.658 -16.658 1.00 14.23 N ATOM 1466 CA THR A 97 9.293 -8.415 -17.393 1.00 23.12 C ATOM 1467 C THR A 97 10.038 -8.662 -18.700 1.00 30.43 C ATOM 1468 O THR A 97 10.729 -9.671 -18.851 1.00 41.32 O ATOM 1469 CB THR A 97 10.076 -7.386 -16.556 1.00 24.34 C ATOM 1470 OG1 THR A 97 9.846 -7.612 -15.161 1.00 33.34 O ATOM 1471 CG2 THR A 97 9.666 -5.967 -16.919 1.00 74.43 C ATOM 0 H THR A 97 9.873 -10.314 -16.721 1.00 14.23 H new ATOM 0 HA THR A 97 8.303 -8.016 -17.612 1.00 23.12 H new ATOM 0 HB THR A 97 11.137 -7.507 -16.773 1.00 24.34 H new ATOM 0 HG1 THR A 97 10.307 -8.431 -14.882 1.00 33.34 H new ATOM 0 HG21 THR A 97 10.233 -5.259 -16.315 1.00 74.43 H new ATOM 0 HG22 THR A 97 9.870 -5.788 -17.975 1.00 74.43 H new ATOM 0 HG23 THR A 97 8.601 -5.836 -16.728 1.00 74.43 H new ATOM 1479 N LEU A 98 9.894 -7.737 -19.641 1.00 51.44 N ATOM 1480 CA LEU A 98 10.554 -7.854 -20.937 1.00 4.11 C ATOM 1481 C LEU A 98 10.979 -6.484 -21.458 1.00 33.43 C ATOM 1482 O LEU A 98 10.156 -5.719 -21.961 1.00 3.25 O ATOM 1483 CB LEU A 98 9.625 -8.530 -21.946 1.00 32.30 C ATOM 1484 CG LEU A 98 10.286 -9.055 -23.221 1.00 21.12 C ATOM 1485 CD1 LEU A 98 11.323 -10.117 -22.886 1.00 54.44 C ATOM 1486 CD2 LEU A 98 9.239 -9.611 -24.175 1.00 20.22 C ATOM 0 H LEU A 98 9.326 -6.897 -19.532 1.00 51.44 H new ATOM 0 HA LEU A 98 11.447 -8.466 -20.808 1.00 4.11 H new ATOM 0 HB2 LEU A 98 9.127 -9.363 -21.450 1.00 32.30 H new ATOM 0 HB3 LEU A 98 8.850 -7.818 -22.229 1.00 32.30 H new ATOM 0 HG LEU A 98 10.792 -8.225 -23.713 1.00 21.12 H new ATOM 0 HD11 LEU A 98 11.783 -10.479 -23.805 1.00 54.44 H new ATOM 0 HD12 LEU A 98 12.090 -9.687 -22.242 1.00 54.44 H new ATOM 0 HD13 LEU A 98 10.840 -10.947 -22.370 1.00 54.44 H new ATOM 0 HD21 LEU A 98 9.728 -9.980 -25.077 1.00 20.22 H new ATOM 0 HD22 LEU A 98 8.704 -10.429 -23.692 1.00 20.22 H new ATOM 0 HD23 LEU A 98 8.534 -8.823 -24.441 1.00 20.22 H new ATOM 1498 N TRP A 99 12.266 -6.184 -21.335 1.00 65.15 N ATOM 1499 CA TRP A 99 12.800 -4.907 -21.796 1.00 64.31 C ATOM 1500 C TRP A 99 13.366 -5.031 -23.207 1.00 15.22 C ATOM 1501 O TRP A 99 13.957 -6.051 -23.562 1.00 71.23 O ATOM 1502 CB TRP A 99 13.886 -4.410 -20.840 1.00 60.41 C ATOM 1503 CG TRP A 99 13.891 -2.921 -20.669 1.00 34.40 C ATOM 1504 CD1 TRP A 99 14.651 -2.020 -21.357 1.00 42.31 C ATOM 1505 CD2 TRP A 99 13.099 -2.162 -19.749 1.00 72.10 C ATOM 1506 NE1 TRP A 99 14.380 -0.745 -20.920 1.00 71.53 N ATOM 1507 CE2 TRP A 99 13.430 -0.806 -19.935 1.00 4.32 C ATOM 1508 CE3 TRP A 99 12.141 -2.496 -18.788 1.00 54.41 C ATOM 1509 CZ2 TRP A 99 12.838 0.213 -19.194 1.00 10.32 C ATOM 1510 CZ3 TRP A 99 11.554 -1.483 -18.053 1.00 72.13 C ATOM 1511 CH2 TRP A 99 11.903 -0.142 -18.260 1.00 2.13 C ATOM 0 H TRP A 99 12.959 -6.807 -20.920 1.00 65.15 H new ATOM 0 HA TRP A 99 11.983 -4.185 -21.814 1.00 64.31 H new ATOM 0 HB2 TRP A 99 13.746 -4.880 -19.867 1.00 60.41 H new ATOM 0 HB3 TRP A 99 14.860 -4.729 -21.211 1.00 60.41 H new ATOM 0 HD1 TRP A 99 15.361 -2.272 -22.131 1.00 42.31 H new ATOM 0 HE1 TRP A 99 14.815 0.108 -21.272 1.00 71.53 H new ATOM 0 HE3 TRP A 99 11.864 -3.527 -18.623 1.00 54.41 H new ATOM 0 HZ2 TRP A 99 13.107 1.247 -19.351 1.00 10.32 H new ATOM 0 HZ3 TRP A 99 10.814 -1.730 -17.306 1.00 72.13 H new ATOM 0 HH2 TRP A 99 11.425 0.627 -17.671 1.00 2.13 H new ATOM 1522 N LEU A 100 13.181 -3.987 -24.007 1.00 13.41 N ATOM 1523 CA LEU A 100 13.673 -3.978 -25.380 1.00 61.42 C ATOM 1524 C LEU A 100 14.666 -2.841 -25.596 1.00 13.51 C ATOM 1525 O LEU A 100 15.071 -2.170 -24.647 1.00 21.33 O ATOM 1526 CB LEU A 100 12.506 -3.845 -26.360 1.00 63.33 C ATOM 1527 CG LEU A 100 11.392 -4.883 -26.222 1.00 53.10 C ATOM 1528 CD1 LEU A 100 10.383 -4.736 -27.350 1.00 74.03 C ATOM 1529 CD2 LEU A 100 11.972 -6.290 -26.203 1.00 1.42 C ATOM 0 H LEU A 100 12.694 -3.135 -23.728 1.00 13.41 H new ATOM 0 HA LEU A 100 14.186 -4.922 -25.562 1.00 61.42 H new ATOM 0 HB2 LEU A 100 12.068 -2.854 -26.240 1.00 63.33 H new ATOM 0 HB3 LEU A 100 12.902 -3.899 -27.374 1.00 63.33 H new ATOM 0 HG LEU A 100 10.877 -4.711 -25.277 1.00 53.10 H new ATOM 0 HD11 LEU A 100 9.598 -5.483 -27.235 1.00 74.03 H new ATOM 0 HD12 LEU A 100 9.943 -3.739 -27.317 1.00 74.03 H new ATOM 0 HD13 LEU A 100 10.884 -4.880 -28.307 1.00 74.03 H new ATOM 0 HD21 LEU A 100 11.164 -7.015 -26.104 1.00 1.42 H new ATOM 0 HD22 LEU A 100 12.513 -6.473 -27.132 1.00 1.42 H new ATOM 0 HD23 LEU A 100 12.655 -6.391 -25.360 1.00 1.42 H new ATOM 1541 N GLN A 101 15.051 -2.628 -26.850 1.00 53.21 N ATOM 1542 CA GLN A 101 15.995 -1.570 -27.190 1.00 14.31 C ATOM 1543 C GLN A 101 15.297 -0.215 -27.246 1.00 55.11 C ATOM 1544 O GLN A 101 14.098 -0.133 -27.520 1.00 3.14 O ATOM 1545 CB GLN A 101 16.665 -1.867 -28.532 1.00 63.21 C ATOM 1546 CG GLN A 101 17.912 -2.729 -28.412 1.00 33.04 C ATOM 1547 CD GLN A 101 19.188 -1.911 -28.398 1.00 51.25 C ATOM 1548 OE1 GLN A 101 19.792 -1.664 -29.443 1.00 34.10 O ATOM 1549 NE2 GLN A 101 19.606 -1.485 -27.212 1.00 41.34 N ATOM 0 H GLN A 101 14.724 -3.174 -27.647 1.00 53.21 H new ATOM 0 HA GLN A 101 16.757 -1.534 -26.412 1.00 14.31 H new ATOM 0 HB2 GLN A 101 15.949 -2.368 -29.183 1.00 63.21 H new ATOM 0 HB3 GLN A 101 16.929 -0.925 -29.013 1.00 63.21 H new ATOM 0 HG2 GLN A 101 17.854 -3.320 -27.498 1.00 33.04 H new ATOM 0 HG3 GLN A 101 17.945 -3.432 -29.245 1.00 33.04 H new ATOM 0 HE21 GLN A 101 19.074 -1.713 -26.372 1.00 41.34 H new ATOM 0 HE22 GLN A 101 20.459 -0.930 -27.141 1.00 41.34 H new ATOM 1558 N LEU A 102 16.053 0.846 -26.985 1.00 74.23 N ATOM 1559 CA LEU A 102 15.507 2.198 -27.006 1.00 15.41 C ATOM 1560 C LEU A 102 15.337 2.696 -28.438 1.00 24.31 C ATOM 1561 O LEU A 102 16.200 2.477 -29.288 1.00 33.03 O ATOM 1562 CB LEU A 102 16.418 3.149 -26.228 1.00 12.31 C ATOM 1563 CG LEU A 102 16.031 4.628 -26.263 1.00 41.30 C ATOM 1564 CD1 LEU A 102 15.245 5.004 -25.016 1.00 42.35 C ATOM 1565 CD2 LEU A 102 17.271 5.501 -26.398 1.00 33.44 C ATOM 0 H LEU A 102 17.046 0.796 -26.756 1.00 74.23 H new ATOM 0 HA LEU A 102 14.526 2.174 -26.531 1.00 15.41 H new ATOM 0 HB2 LEU A 102 16.444 2.825 -25.187 1.00 12.31 H new ATOM 0 HB3 LEU A 102 17.431 3.050 -26.618 1.00 12.31 H new ATOM 0 HG LEU A 102 15.396 4.797 -27.132 1.00 41.30 H new ATOM 0 HD11 LEU A 102 14.978 6.060 -25.059 1.00 42.35 H new ATOM 0 HD12 LEU A 102 14.338 4.402 -24.963 1.00 42.35 H new ATOM 0 HD13 LEU A 102 15.855 4.819 -24.132 1.00 42.35 H new ATOM 0 HD21 LEU A 102 16.977 6.550 -26.421 1.00 33.44 H new ATOM 0 HD22 LEU A 102 17.932 5.328 -25.548 1.00 33.44 H new ATOM 0 HD23 LEU A 102 17.794 5.250 -27.321 1.00 33.44 H new ATOM 1577 N GLY A 103 14.220 3.368 -28.698 1.00 1.35 N ATOM 1578 CA GLY A 103 13.959 3.888 -30.027 1.00 42.10 C ATOM 1579 C GLY A 103 13.150 2.928 -30.876 1.00 52.34 C ATOM 1580 O GLY A 103 12.604 3.312 -31.911 1.00 64.02 O ATOM 0 H GLY A 103 13.491 3.562 -28.011 1.00 1.35 H new ATOM 0 HA2 GLY A 103 13.425 4.835 -29.945 1.00 42.10 H new ATOM 0 HA3 GLY A 103 14.906 4.098 -30.524 1.00 42.10 H new ATOM 1584 N VAL A 104 13.072 1.675 -30.440 1.00 2.22 N ATOM 1585 CA VAL A 104 12.324 0.657 -31.167 1.00 42.05 C ATOM 1586 C VAL A 104 11.011 0.332 -30.464 1.00 40.33 C ATOM 1587 O VAL A 104 10.903 0.453 -29.244 1.00 33.34 O ATOM 1588 CB VAL A 104 13.144 -0.638 -31.324 1.00 0.55 C ATOM 1589 CG1 VAL A 104 12.443 -1.603 -32.267 1.00 30.34 C ATOM 1590 CG2 VAL A 104 14.548 -0.322 -31.817 1.00 20.31 C ATOM 0 H VAL A 104 13.518 1.340 -29.586 1.00 2.22 H new ATOM 0 HA VAL A 104 12.112 1.066 -32.155 1.00 42.05 H new ATOM 0 HB VAL A 104 13.225 -1.117 -30.348 1.00 0.55 H new ATOM 0 HG11 VAL A 104 13.037 -2.512 -32.365 1.00 30.34 H new ATOM 0 HG12 VAL A 104 11.460 -1.853 -31.867 1.00 30.34 H new ATOM 0 HG13 VAL A 104 12.328 -1.137 -33.246 1.00 30.34 H new ATOM 0 HG21 VAL A 104 15.114 -1.248 -31.922 1.00 20.31 H new ATOM 0 HG22 VAL A 104 14.490 0.180 -32.783 1.00 20.31 H new ATOM 0 HG23 VAL A 104 15.048 0.329 -31.099 1.00 20.31 H new ATOM 1600 N ILE A 105 10.016 -0.080 -31.242 1.00 70.13 N ATOM 1601 CA ILE A 105 8.710 -0.424 -30.694 1.00 1.24 C ATOM 1602 C ILE A 105 8.229 -1.771 -31.222 1.00 52.35 C ATOM 1603 O ILE A 105 8.320 -2.048 -32.418 1.00 30.05 O ATOM 1604 CB ILE A 105 7.659 0.651 -31.027 1.00 13.22 C ATOM 1605 CG1 ILE A 105 8.143 2.028 -30.569 1.00 11.43 C ATOM 1606 CG2 ILE A 105 6.327 0.309 -30.376 1.00 73.35 C ATOM 1607 CD1 ILE A 105 8.890 2.793 -31.639 1.00 22.11 C ATOM 0 H ILE A 105 10.089 -0.184 -32.254 1.00 70.13 H new ATOM 0 HA ILE A 105 8.828 -0.482 -29.612 1.00 1.24 H new ATOM 0 HB ILE A 105 7.518 0.677 -32.107 1.00 13.22 H new ATOM 0 HG12 ILE A 105 7.285 2.617 -30.245 1.00 11.43 H new ATOM 0 HG13 ILE A 105 8.791 1.906 -29.701 1.00 11.43 H new ATOM 0 HG21 ILE A 105 5.594 1.078 -30.621 1.00 73.35 H new ATOM 0 HG22 ILE A 105 5.978 -0.655 -30.746 1.00 73.35 H new ATOM 0 HG23 ILE A 105 6.453 0.259 -29.294 1.00 73.35 H new ATOM 0 HD11 ILE A 105 9.203 3.759 -31.244 1.00 22.11 H new ATOM 0 HD12 ILE A 105 9.768 2.225 -31.946 1.00 22.11 H new ATOM 0 HD13 ILE A 105 8.238 2.947 -32.499 1.00 22.11 H new ATOM 1619 N ASN A 106 7.715 -2.604 -30.324 1.00 15.34 N ATOM 1620 CA ASN A 106 7.217 -3.922 -30.700 1.00 20.02 C ATOM 1621 C ASN A 106 5.807 -4.146 -30.161 1.00 42.51 C ATOM 1622 O ASN A 106 5.628 -4.687 -29.071 1.00 11.22 O ATOM 1623 CB ASN A 106 8.154 -5.012 -30.176 1.00 20.21 C ATOM 1624 CG ASN A 106 9.229 -5.382 -31.179 1.00 44.43 C ATOM 1625 OD1 ASN A 106 10.242 -4.692 -31.303 1.00 55.34 O ATOM 1626 ND2 ASN A 106 9.014 -6.475 -31.902 1.00 10.23 N ATOM 0 H ASN A 106 7.632 -2.390 -29.330 1.00 15.34 H new ATOM 0 HA ASN A 106 7.183 -3.973 -31.788 1.00 20.02 H new ATOM 0 HB2 ASN A 106 8.624 -4.671 -29.254 1.00 20.21 H new ATOM 0 HB3 ASN A 106 7.572 -5.899 -29.928 1.00 20.21 H new ATOM 0 HD21 ASN A 106 9.702 -6.773 -32.593 1.00 10.23 H new ATOM 0 HD22 ASN A 106 8.160 -7.017 -31.766 1.00 10.23 H new ATOM 1633 N GLU A 107 4.811 -3.725 -30.934 1.00 33.10 N ATOM 1634 CA GLU A 107 3.417 -3.879 -30.534 1.00 20.53 C ATOM 1635 C GLU A 107 3.010 -5.350 -30.536 1.00 60.21 C ATOM 1636 O GLU A 107 2.403 -5.838 -29.583 1.00 51.40 O ATOM 1637 CB GLU A 107 2.504 -3.085 -31.469 1.00 55.32 C ATOM 1638 CG GLU A 107 1.110 -2.855 -30.909 1.00 31.21 C ATOM 1639 CD GLU A 107 0.452 -1.610 -31.472 1.00 63.43 C ATOM 1640 OE1 GLU A 107 0.859 -0.496 -31.083 1.00 12.12 O ATOM 1641 OE2 GLU A 107 -0.469 -1.752 -32.303 1.00 52.55 O ATOM 0 H GLU A 107 4.943 -3.275 -31.840 1.00 33.10 H new ATOM 0 HA GLU A 107 3.312 -3.492 -29.521 1.00 20.53 H new ATOM 0 HB2 GLU A 107 2.965 -2.120 -31.680 1.00 55.32 H new ATOM 0 HB3 GLU A 107 2.422 -3.614 -32.419 1.00 55.32 H new ATOM 0 HG2 GLU A 107 0.487 -3.722 -31.129 1.00 31.21 H new ATOM 0 HG3 GLU A 107 1.168 -2.771 -29.824 1.00 31.21 H new ATOM 1648 N GLN A 108 3.349 -6.050 -31.614 1.00 73.10 N ATOM 1649 CA GLN A 108 3.017 -7.464 -31.741 1.00 65.41 C ATOM 1650 C GLN A 108 3.543 -8.256 -30.548 1.00 41.11 C ATOM 1651 O GLN A 108 2.819 -9.053 -29.952 1.00 42.30 O ATOM 1652 CB GLN A 108 3.596 -8.031 -33.039 1.00 1.31 C ATOM 1653 CG GLN A 108 2.554 -8.258 -34.122 1.00 14.42 C ATOM 1654 CD GLN A 108 1.740 -9.517 -33.894 1.00 44.43 C ATOM 1655 OE1 GLN A 108 2.048 -10.576 -34.442 1.00 52.44 O ATOM 1656 NE2 GLN A 108 0.695 -9.408 -33.082 1.00 64.12 N ATOM 0 H GLN A 108 3.853 -5.661 -32.411 1.00 73.10 H new ATOM 0 HA GLN A 108 1.931 -7.555 -31.765 1.00 65.41 H new ATOM 0 HB2 GLN A 108 4.357 -7.348 -33.416 1.00 1.31 H new ATOM 0 HB3 GLN A 108 4.095 -8.976 -32.822 1.00 1.31 H new ATOM 0 HG2 GLN A 108 1.884 -7.399 -34.162 1.00 14.42 H new ATOM 0 HG3 GLN A 108 3.050 -8.321 -35.091 1.00 14.42 H new ATOM 0 HE21 GLN A 108 0.477 -8.510 -32.649 1.00 64.12 H new ATOM 0 HE22 GLN A 108 0.111 -10.222 -32.891 1.00 64.12 H new ATOM 1665 N ALA A 109 4.807 -8.031 -30.206 1.00 4.23 N ATOM 1666 CA ALA A 109 5.429 -8.722 -29.083 1.00 3.20 C ATOM 1667 C ALA A 109 4.847 -8.247 -27.756 1.00 23.12 C ATOM 1668 O ALA A 109 4.826 -8.991 -26.775 1.00 52.44 O ATOM 1669 CB ALA A 109 6.936 -8.514 -29.105 1.00 24.30 C ATOM 0 H ALA A 109 5.421 -7.376 -30.690 1.00 4.23 H new ATOM 0 HA ALA A 109 5.219 -9.787 -29.182 1.00 3.20 H new ATOM 0 HB1 ALA A 109 7.388 -9.035 -28.261 1.00 24.30 H new ATOM 0 HB2 ALA A 109 7.344 -8.908 -30.036 1.00 24.30 H new ATOM 0 HB3 ALA A 109 7.157 -7.449 -29.034 1.00 24.30 H new ATOM 1675 N ALA A 110 4.377 -7.004 -27.732 1.00 21.41 N ATOM 1676 CA ALA A 110 3.794 -6.431 -26.525 1.00 72.42 C ATOM 1677 C ALA A 110 2.416 -7.023 -26.247 1.00 61.00 C ATOM 1678 O ALA A 110 2.055 -7.267 -25.096 1.00 22.34 O ATOM 1679 CB ALA A 110 3.705 -4.918 -26.649 1.00 51.44 C ATOM 0 H ALA A 110 4.389 -6.375 -28.535 1.00 21.41 H new ATOM 0 HA ALA A 110 4.443 -6.678 -25.685 1.00 72.42 H new ATOM 0 HB1 ALA A 110 3.268 -4.504 -25.741 1.00 51.44 H new ATOM 0 HB2 ALA A 110 4.704 -4.505 -26.792 1.00 51.44 H new ATOM 0 HB3 ALA A 110 3.080 -4.659 -27.503 1.00 51.44 H new ATOM 1685 N VAL A 111 1.650 -7.251 -27.309 1.00 15.22 N ATOM 1686 CA VAL A 111 0.311 -7.814 -27.179 1.00 21.32 C ATOM 1687 C VAL A 111 0.369 -9.270 -26.728 1.00 50.44 C ATOM 1688 O VAL A 111 -0.311 -9.665 -25.780 1.00 65.12 O ATOM 1689 CB VAL A 111 -0.465 -7.730 -28.507 1.00 1.34 C ATOM 1690 CG1 VAL A 111 -1.907 -8.173 -28.312 1.00 22.14 C ATOM 1691 CG2 VAL A 111 -0.404 -6.318 -29.070 1.00 11.13 C ATOM 0 H VAL A 111 1.934 -7.055 -28.269 1.00 15.22 H new ATOM 0 HA VAL A 111 -0.209 -7.223 -26.425 1.00 21.32 H new ATOM 0 HB VAL A 111 0.003 -8.404 -29.225 1.00 1.34 H new ATOM 0 HG11 VAL A 111 -2.439 -8.107 -29.261 1.00 22.14 H new ATOM 0 HG12 VAL A 111 -1.926 -9.203 -27.956 1.00 22.14 H new ATOM 0 HG13 VAL A 111 -2.390 -7.527 -27.579 1.00 22.14 H new ATOM 0 HG21 VAL A 111 -0.957 -6.276 -30.008 1.00 11.13 H new ATOM 0 HG22 VAL A 111 -0.846 -5.622 -28.357 1.00 11.13 H new ATOM 0 HG23 VAL A 111 0.635 -6.042 -29.249 1.00 11.13 H new ATOM 1701 N LEU A 112 1.185 -10.063 -27.414 1.00 32.14 N ATOM 1702 CA LEU A 112 1.333 -11.476 -27.084 1.00 72.51 C ATOM 1703 C LEU A 112 1.630 -11.661 -25.600 1.00 24.25 C ATOM 1704 O LEU A 112 1.234 -12.658 -24.996 1.00 54.42 O ATOM 1705 CB LEU A 112 2.450 -12.101 -27.921 1.00 60.45 C ATOM 1706 CG LEU A 112 2.979 -13.451 -27.435 1.00 10.03 C ATOM 1707 CD1 LEU A 112 1.896 -14.514 -27.529 1.00 32.30 C ATOM 1708 CD2 LEU A 112 4.205 -13.864 -28.236 1.00 2.41 C ATOM 0 H LEU A 112 1.754 -9.752 -28.201 1.00 32.14 H new ATOM 0 HA LEU A 112 0.392 -11.977 -27.312 1.00 72.51 H new ATOM 0 HB2 LEU A 112 2.087 -12.222 -28.942 1.00 60.45 H new ATOM 0 HB3 LEU A 112 3.283 -11.400 -27.960 1.00 60.45 H new ATOM 0 HG LEU A 112 3.270 -13.350 -26.390 1.00 10.03 H new ATOM 0 HD11 LEU A 112 2.291 -15.468 -27.179 1.00 32.30 H new ATOM 0 HD12 LEU A 112 1.047 -14.224 -26.910 1.00 32.30 H new ATOM 0 HD13 LEU A 112 1.573 -14.614 -28.565 1.00 32.30 H new ATOM 0 HD21 LEU A 112 4.567 -14.827 -27.876 1.00 2.41 H new ATOM 0 HD22 LEU A 112 3.940 -13.947 -29.290 1.00 2.41 H new ATOM 0 HD23 LEU A 112 4.987 -13.114 -28.117 1.00 2.41 H new ATOM 1720 N ALA A 113 2.330 -10.693 -25.017 1.00 34.05 N ATOM 1721 CA ALA A 113 2.676 -10.747 -23.602 1.00 5.22 C ATOM 1722 C ALA A 113 1.575 -10.136 -22.743 1.00 14.12 C ATOM 1723 O ALA A 113 1.125 -10.742 -21.770 1.00 4.33 O ATOM 1724 CB ALA A 113 3.998 -10.033 -23.355 1.00 35.52 C ATOM 0 H ALA A 113 2.668 -9.862 -25.503 1.00 34.05 H new ATOM 0 HA ALA A 113 2.782 -11.794 -23.319 1.00 5.22 H new ATOM 0 HB1 ALA A 113 4.245 -10.081 -22.294 1.00 35.52 H new ATOM 0 HB2 ALA A 113 4.786 -10.516 -23.933 1.00 35.52 H new ATOM 0 HB3 ALA A 113 3.911 -8.990 -23.661 1.00 35.52 H new ATOM 1730 N ARG A 114 1.144 -8.933 -23.108 1.00 51.04 N ATOM 1731 CA ARG A 114 0.096 -8.240 -22.370 1.00 13.44 C ATOM 1732 C ARG A 114 -1.137 -9.125 -22.215 1.00 54.03 C ATOM 1733 O ARG A 114 -1.745 -9.178 -21.146 1.00 62.15 O ATOM 1734 CB ARG A 114 -0.283 -6.939 -23.080 1.00 11.44 C ATOM 1735 CG ARG A 114 -0.951 -5.920 -22.170 1.00 71.40 C ATOM 1736 CD ARG A 114 -1.847 -4.975 -22.955 1.00 45.22 C ATOM 1737 NE ARG A 114 -1.083 -3.919 -23.614 1.00 1.50 N ATOM 1738 CZ ARG A 114 -1.641 -2.928 -24.301 1.00 4.44 C ATOM 1739 NH1 ARG A 114 -2.959 -2.858 -24.417 1.00 55.35 N ATOM 1740 NH2 ARG A 114 -0.879 -2.004 -24.872 1.00 4.52 N ATOM 0 H ARG A 114 1.505 -8.418 -23.911 1.00 51.04 H new ATOM 0 HA ARG A 114 0.481 -8.006 -21.377 1.00 13.44 H new ATOM 0 HB2 ARG A 114 0.615 -6.495 -23.511 1.00 11.44 H new ATOM 0 HB3 ARG A 114 -0.954 -7.169 -23.908 1.00 11.44 H new ATOM 0 HG2 ARG A 114 -1.541 -6.438 -21.413 1.00 71.40 H new ATOM 0 HG3 ARG A 114 -0.189 -5.346 -21.643 1.00 71.40 H new ATOM 0 HD2 ARG A 114 -2.404 -5.540 -23.702 1.00 45.22 H new ATOM 0 HD3 ARG A 114 -2.579 -4.527 -22.283 1.00 45.22 H new ATOM 0 HE ARG A 114 -0.066 -3.944 -23.543 1.00 1.50 H new ATOM 0 HH11 ARG A 114 -3.548 -3.566 -23.978 1.00 55.35 H new ATOM 0 HH12 ARG A 114 -3.385 -2.096 -24.945 1.00 55.35 H new ATOM 0 HH21 ARG A 114 0.136 -2.054 -24.784 1.00 4.52 H new ATOM 0 HH22 ARG A 114 -1.308 -1.244 -25.399 1.00 4.52 H new ATOM 1754 N GLU A 115 -1.501 -9.817 -23.290 1.00 62.44 N ATOM 1755 CA GLU A 115 -2.662 -10.699 -23.274 1.00 12.02 C ATOM 1756 C GLU A 115 -2.471 -11.832 -22.269 1.00 52.32 C ATOM 1757 O GLU A 115 -3.440 -12.395 -21.762 1.00 32.43 O ATOM 1758 CB GLU A 115 -2.912 -11.276 -24.669 1.00 31.34 C ATOM 1759 CG GLU A 115 -1.843 -12.256 -25.122 1.00 72.40 C ATOM 1760 CD GLU A 115 -2.060 -12.740 -26.543 1.00 32.23 C ATOM 1761 OE1 GLU A 115 -2.856 -12.110 -27.269 1.00 75.35 O ATOM 1762 OE2 GLU A 115 -1.433 -13.749 -26.927 1.00 62.34 O ATOM 0 H GLU A 115 -1.009 -9.784 -24.183 1.00 62.44 H new ATOM 0 HA GLU A 115 -3.529 -10.111 -22.972 1.00 12.02 H new ATOM 0 HB2 GLU A 115 -3.880 -11.777 -24.678 1.00 31.34 H new ATOM 0 HB3 GLU A 115 -2.970 -10.458 -25.387 1.00 31.34 H new ATOM 0 HG2 GLU A 115 -0.865 -11.780 -25.050 1.00 72.40 H new ATOM 0 HG3 GLU A 115 -1.832 -13.113 -24.448 1.00 72.40 H new ATOM 1769 N ALA A 116 -1.214 -12.159 -21.988 1.00 33.40 N ATOM 1770 CA ALA A 116 -0.895 -13.223 -21.044 1.00 32.12 C ATOM 1771 C ALA A 116 -0.705 -12.669 -19.636 1.00 43.31 C ATOM 1772 O ALA A 116 -0.869 -13.384 -18.649 1.00 73.30 O ATOM 1773 CB ALA A 116 0.352 -13.970 -21.492 1.00 61.12 C ATOM 0 H ALA A 116 -0.400 -11.703 -22.400 1.00 33.40 H new ATOM 0 HA ALA A 116 -1.734 -13.919 -21.022 1.00 32.12 H new ATOM 0 HB1 ALA A 116 0.578 -14.762 -20.778 1.00 61.12 H new ATOM 0 HB2 ALA A 116 0.181 -14.407 -22.476 1.00 61.12 H new ATOM 0 HB3 ALA A 116 1.192 -13.277 -21.544 1.00 61.12 H new ATOM 1779 N GLY A 117 -0.356 -11.388 -19.551 1.00 61.42 N ATOM 1780 CA GLY A 117 -0.148 -10.760 -18.260 1.00 21.34 C ATOM 1781 C GLY A 117 1.260 -10.222 -18.097 1.00 14.52 C ATOM 1782 O GLY A 117 1.526 -9.419 -17.201 1.00 54.00 O ATOM 0 H GLY A 117 -0.214 -10.775 -20.354 1.00 61.42 H new ATOM 0 HA2 GLY A 117 -0.861 -9.945 -18.137 1.00 21.34 H new ATOM 0 HA3 GLY A 117 -0.351 -11.484 -17.471 1.00 21.34 H new ATOM 1786 N LEU A 118 2.164 -10.664 -18.963 1.00 44.21 N ATOM 1787 CA LEU A 118 3.554 -10.222 -18.911 1.00 33.13 C ATOM 1788 C LEU A 118 3.648 -8.706 -19.044 1.00 3.53 C ATOM 1789 O LEU A 118 2.738 -8.060 -19.564 1.00 24.01 O ATOM 1790 CB LEU A 118 4.365 -10.894 -20.019 1.00 63.35 C ATOM 1791 CG LEU A 118 5.741 -11.426 -19.616 1.00 41.01 C ATOM 1792 CD1 LEU A 118 5.615 -12.795 -18.965 1.00 54.34 C ATOM 1793 CD2 LEU A 118 6.663 -11.491 -20.825 1.00 21.30 C ATOM 0 H LEU A 118 1.960 -11.328 -19.710 1.00 44.21 H new ATOM 0 HA LEU A 118 3.965 -10.510 -17.943 1.00 33.13 H new ATOM 0 HB2 LEU A 118 3.780 -11.723 -20.418 1.00 63.35 H new ATOM 0 HB3 LEU A 118 4.498 -10.178 -20.830 1.00 63.35 H new ATOM 0 HG LEU A 118 6.176 -10.740 -18.889 1.00 41.01 H new ATOM 0 HD11 LEU A 118 6.604 -13.157 -18.685 1.00 54.34 H new ATOM 0 HD12 LEU A 118 4.991 -12.718 -18.074 1.00 54.34 H new ATOM 0 HD13 LEU A 118 5.159 -13.492 -19.668 1.00 54.34 H new ATOM 0 HD21 LEU A 118 7.638 -11.872 -20.519 1.00 21.30 H new ATOM 0 HD22 LEU A 118 6.233 -12.155 -21.575 1.00 21.30 H new ATOM 0 HD23 LEU A 118 6.780 -10.493 -21.248 1.00 21.30 H new ATOM 1805 N SER A 119 4.756 -8.143 -18.572 1.00 25.22 N ATOM 1806 CA SER A 119 4.970 -6.702 -18.637 1.00 34.15 C ATOM 1807 C SER A 119 6.116 -6.365 -19.585 1.00 1.41 C ATOM 1808 O SER A 119 7.284 -6.375 -19.195 1.00 33.34 O ATOM 1809 CB SER A 119 5.265 -6.146 -17.242 1.00 44.13 C ATOM 1810 OG SER A 119 5.299 -4.729 -17.255 1.00 64.31 O ATOM 0 H SER A 119 5.520 -8.663 -18.140 1.00 25.22 H new ATOM 0 HA SER A 119 4.059 -6.241 -19.019 1.00 34.15 H new ATOM 0 HB2 SER A 119 4.503 -6.488 -16.542 1.00 44.13 H new ATOM 0 HB3 SER A 119 6.220 -6.533 -16.887 1.00 44.13 H new ATOM 0 HG SER A 119 4.572 -4.379 -16.699 1.00 64.31 H new ATOM 1816 N VAL A 120 5.774 -6.065 -20.834 1.00 11.01 N ATOM 1817 CA VAL A 120 6.773 -5.723 -21.839 1.00 50.02 C ATOM 1818 C VAL A 120 6.969 -4.214 -21.928 1.00 52.32 C ATOM 1819 O VAL A 120 6.019 -3.444 -21.786 1.00 54.02 O ATOM 1820 CB VAL A 120 6.379 -6.261 -23.228 1.00 23.34 C ATOM 1821 CG1 VAL A 120 7.401 -5.840 -24.273 1.00 72.31 C ATOM 1822 CG2 VAL A 120 6.235 -7.775 -23.190 1.00 61.24 C ATOM 0 H VAL A 120 4.812 -6.052 -21.174 1.00 11.01 H new ATOM 0 HA VAL A 120 7.707 -6.190 -21.528 1.00 50.02 H new ATOM 0 HB VAL A 120 5.415 -5.834 -23.505 1.00 23.34 H new ATOM 0 HG11 VAL A 120 7.106 -6.229 -25.248 1.00 72.31 H new ATOM 0 HG12 VAL A 120 7.450 -4.752 -24.316 1.00 72.31 H new ATOM 0 HG13 VAL A 120 8.380 -6.237 -24.005 1.00 72.31 H new ATOM 0 HG21 VAL A 120 5.956 -8.139 -24.179 1.00 61.24 H new ATOM 0 HG22 VAL A 120 7.183 -8.223 -22.892 1.00 61.24 H new ATOM 0 HG23 VAL A 120 5.462 -8.049 -22.472 1.00 61.24 H new ATOM 1832 N VAL A 121 8.208 -3.796 -22.165 1.00 25.21 N ATOM 1833 CA VAL A 121 8.530 -2.378 -22.275 1.00 32.33 C ATOM 1834 C VAL A 121 9.463 -2.116 -23.451 1.00 5.11 C ATOM 1835 O VAL A 121 10.573 -2.646 -23.506 1.00 73.11 O ATOM 1836 CB VAL A 121 9.185 -1.850 -20.985 1.00 45.21 C ATOM 1837 CG1 VAL A 121 9.381 -0.343 -21.064 1.00 21.51 C ATOM 1838 CG2 VAL A 121 8.349 -2.224 -19.771 1.00 23.33 C ATOM 0 H VAL A 121 9.006 -4.420 -22.285 1.00 25.21 H new ATOM 0 HA VAL A 121 7.590 -1.851 -22.438 1.00 32.33 H new ATOM 0 HB VAL A 121 10.165 -2.315 -20.879 1.00 45.21 H new ATOM 0 HG11 VAL A 121 9.845 0.012 -20.144 1.00 21.51 H new ATOM 0 HG12 VAL A 121 10.024 -0.104 -21.911 1.00 21.51 H new ATOM 0 HG13 VAL A 121 8.414 0.143 -21.194 1.00 21.51 H new ATOM 0 HG21 VAL A 121 8.827 -1.843 -18.869 1.00 23.33 H new ATOM 0 HG22 VAL A 121 7.354 -1.789 -19.866 1.00 23.33 H new ATOM 0 HG23 VAL A 121 8.266 -3.309 -19.707 1.00 23.33 H new ATOM 1848 N MET A 122 9.007 -1.294 -24.390 1.00 12.21 N ATOM 1849 CA MET A 122 9.803 -0.959 -25.565 1.00 74.43 C ATOM 1850 C MET A 122 10.119 0.532 -25.601 1.00 42.41 C ATOM 1851 O MET A 122 9.582 1.309 -24.811 1.00 44.53 O ATOM 1852 CB MET A 122 9.063 -1.366 -26.841 1.00 70.41 C ATOM 1853 CG MET A 122 7.550 -1.277 -26.722 1.00 3.45 C ATOM 1854 SD MET A 122 6.976 0.406 -26.424 1.00 53.41 S ATOM 1855 CE MET A 122 5.862 0.145 -25.046 1.00 53.21 C ATOM 0 H MET A 122 8.090 -0.847 -24.360 1.00 12.21 H new ATOM 0 HA MET A 122 10.742 -1.510 -25.506 1.00 74.43 H new ATOM 0 HB2 MET A 122 9.393 -0.728 -27.661 1.00 70.41 H new ATOM 0 HB3 MET A 122 9.339 -2.388 -27.101 1.00 70.41 H new ATOM 0 HG2 MET A 122 7.094 -1.656 -27.637 1.00 3.45 H new ATOM 0 HG3 MET A 122 7.215 -1.921 -25.909 1.00 3.45 H new ATOM 0 HE1 MET A 122 5.009 0.818 -25.135 1.00 53.21 H new ATOM 0 HE2 MET A 122 5.512 -0.887 -25.052 1.00 53.21 H new ATOM 0 HE3 MET A 122 6.386 0.345 -24.111 1.00 53.21 H new ATOM 1865 N ASP A 123 10.993 0.925 -26.521 1.00 43.10 N ATOM 1866 CA ASP A 123 11.380 2.324 -26.660 1.00 5.22 C ATOM 1867 C ASP A 123 12.094 2.818 -25.405 1.00 60.30 C ATOM 1868 O ASP A 123 11.968 3.982 -25.025 1.00 22.23 O ATOM 1869 CB ASP A 123 10.151 3.191 -26.936 1.00 70.25 C ATOM 1870 CG ASP A 123 10.519 4.595 -27.372 1.00 51.53 C ATOM 1871 OD1 ASP A 123 10.893 4.773 -28.551 1.00 34.31 O ATOM 1872 OD2 ASP A 123 10.432 5.518 -26.535 1.00 63.21 O ATOM 0 H ASP A 123 11.447 0.294 -27.182 1.00 43.10 H new ATOM 0 HA ASP A 123 12.067 2.403 -27.503 1.00 5.22 H new ATOM 0 HB2 ASP A 123 9.545 2.721 -27.710 1.00 70.25 H new ATOM 0 HB3 ASP A 123 9.537 3.242 -26.037 1.00 70.25 H new ATOM 1877 N ARG A 124 12.842 1.924 -24.766 1.00 1.21 N ATOM 1878 CA ARG A 124 13.574 2.268 -23.553 1.00 13.23 C ATOM 1879 C ARG A 124 14.761 1.332 -23.350 1.00 22.31 C ATOM 1880 O ARG A 124 14.639 0.116 -23.503 1.00 33.23 O ATOM 1881 CB ARG A 124 12.647 2.204 -22.337 1.00 52.43 C ATOM 1882 CG ARG A 124 11.843 3.475 -22.117 1.00 1.52 C ATOM 1883 CD ARG A 124 11.598 3.730 -20.638 1.00 3.22 C ATOM 1884 NE ARG A 124 10.462 2.965 -20.131 1.00 64.32 N ATOM 1885 CZ ARG A 124 9.805 3.274 -19.019 1.00 40.01 C ATOM 1886 NH1 ARG A 124 10.169 4.328 -18.302 1.00 34.04 N ATOM 1887 NH2 ARG A 124 8.781 2.529 -18.623 1.00 62.41 N ATOM 0 H ARG A 124 12.957 0.957 -25.068 1.00 1.21 H new ATOM 0 HA ARG A 124 13.950 3.285 -23.662 1.00 13.23 H new ATOM 0 HB2 ARG A 124 11.960 1.366 -22.458 1.00 52.43 H new ATOM 0 HB3 ARG A 124 13.243 2.002 -21.447 1.00 52.43 H new ATOM 0 HG2 ARG A 124 12.374 4.322 -22.550 1.00 1.52 H new ATOM 0 HG3 ARG A 124 10.888 3.398 -22.637 1.00 1.52 H new ATOM 0 HD2 ARG A 124 12.492 3.469 -20.072 1.00 3.22 H new ATOM 0 HD3 ARG A 124 11.419 4.793 -20.478 1.00 3.22 H new ATOM 0 HE ARG A 124 10.156 2.148 -20.660 1.00 64.32 H new ATOM 0 HH11 ARG A 124 10.955 4.903 -18.604 1.00 34.04 H new ATOM 0 HH12 ARG A 124 9.663 4.563 -17.448 1.00 34.04 H new ATOM 0 HH21 ARG A 124 8.498 1.718 -19.173 1.00 62.41 H new ATOM 0 HH22 ARG A 124 8.277 2.767 -17.769 1.00 62.41 H new ATOM 1901 N CYS A 125 15.909 1.906 -23.006 1.00 74.11 N ATOM 1902 CA CYS A 125 17.119 1.123 -22.784 1.00 30.23 C ATOM 1903 C CYS A 125 17.873 1.624 -21.556 1.00 41.25 C ATOM 1904 O CYS A 125 18.148 2.815 -21.410 1.00 12.40 O ATOM 1905 CB CYS A 125 18.025 1.185 -24.014 1.00 73.34 C ATOM 1906 SG CYS A 125 19.335 -0.061 -24.030 1.00 61.00 S ATOM 0 H CYS A 125 16.027 2.911 -22.875 1.00 74.11 H new ATOM 0 HA CYS A 125 16.825 0.088 -22.611 1.00 30.23 H new ATOM 0 HB2 CYS A 125 17.414 1.065 -24.909 1.00 73.34 H new ATOM 0 HB3 CYS A 125 18.479 2.175 -24.068 1.00 73.34 H new ATOM 0 HG CYS A 125 20.046 0.071 -25.110 1.00 61.00 H new ATOM 1912 N PRO A 126 18.215 0.695 -20.652 1.00 3.25 N ATOM 1913 CA PRO A 126 18.941 1.019 -19.420 1.00 3.40 C ATOM 1914 C PRO A 126 20.385 1.430 -19.689 1.00 60.01 C ATOM 1915 O PRO A 126 21.055 1.984 -18.818 1.00 42.13 O ATOM 1916 CB PRO A 126 18.896 -0.289 -18.627 1.00 24.11 C ATOM 1917 CG PRO A 126 18.742 -1.352 -19.659 1.00 31.42 C ATOM 1918 CD PRO A 126 17.920 -0.743 -20.761 1.00 63.31 C ATOM 0 HA PRO A 126 18.498 1.866 -18.896 1.00 3.40 H new ATOM 0 HB2 PRO A 126 19.807 -0.431 -18.045 1.00 24.11 H new ATOM 0 HB3 PRO A 126 18.064 -0.297 -17.923 1.00 24.11 H new ATOM 0 HG2 PRO A 126 19.713 -1.678 -20.031 1.00 31.42 H new ATOM 0 HG3 PRO A 126 18.248 -2.231 -19.244 1.00 31.42 H new ATOM 0 HD2 PRO A 126 18.201 -1.138 -21.737 1.00 63.31 H new ATOM 0 HD3 PRO A 126 16.857 -0.946 -20.629 1.00 63.31 H new ATOM 1926 N ALA A 127 20.858 1.155 -20.900 1.00 74.23 N ATOM 1927 CA ALA A 127 22.221 1.498 -21.284 1.00 42.04 C ATOM 1928 C ALA A 127 22.442 3.006 -21.235 1.00 42.04 C ATOM 1929 O ALA A 127 23.459 3.477 -20.726 1.00 45.32 O ATOM 1930 CB ALA A 127 22.528 0.962 -22.675 1.00 44.50 C ATOM 0 H ALA A 127 20.317 0.695 -21.632 1.00 74.23 H new ATOM 0 HA ALA A 127 22.901 1.034 -20.570 1.00 42.04 H new ATOM 0 HB1 ALA A 127 23.550 1.225 -22.949 1.00 44.50 H new ATOM 0 HB2 ALA A 127 22.419 -0.123 -22.679 1.00 44.50 H new ATOM 0 HB3 ALA A 127 21.835 1.399 -23.394 1.00 44.50 H new ATOM 1936 N ILE A 128 21.484 3.757 -21.768 1.00 44.31 N ATOM 1937 CA ILE A 128 21.575 5.212 -21.784 1.00 63.13 C ATOM 1938 C ILE A 128 20.754 5.827 -20.656 1.00 24.44 C ATOM 1939 O ILE A 128 20.965 6.979 -20.279 1.00 54.13 O ATOM 1940 CB ILE A 128 21.094 5.791 -23.128 1.00 5.21 C ATOM 1941 CG1 ILE A 128 21.846 5.137 -24.289 1.00 23.44 C ATOM 1942 CG2 ILE A 128 21.283 7.301 -23.152 1.00 31.43 C ATOM 1943 CD1 ILE A 128 21.296 5.505 -25.649 1.00 24.31 C ATOM 0 H ILE A 128 20.636 3.382 -22.194 1.00 44.31 H new ATOM 0 HA ILE A 128 22.626 5.464 -21.644 1.00 63.13 H new ATOM 0 HB ILE A 128 20.032 5.575 -23.240 1.00 5.21 H new ATOM 0 HG12 ILE A 128 22.896 5.426 -24.240 1.00 23.44 H new ATOM 0 HG13 ILE A 128 21.808 4.054 -24.172 1.00 23.44 H new ATOM 0 HG21 ILE A 128 20.939 7.696 -24.108 1.00 31.43 H new ATOM 0 HG22 ILE A 128 20.707 7.753 -22.344 1.00 31.43 H new ATOM 0 HG23 ILE A 128 22.339 7.538 -23.021 1.00 31.43 H new ATOM 0 HD11 ILE A 128 21.877 5.005 -26.424 1.00 24.31 H new ATOM 0 HD12 ILE A 128 20.255 5.191 -25.717 1.00 24.31 H new ATOM 0 HD13 ILE A 128 21.359 6.584 -25.787 1.00 24.31 H new