USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 920 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: B 106 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 107 SER OG : rot 180:sc= 0 USER MOD Set 2.1: B 45 TYR OH : rot -15:sc= 0.0116 USER MOD Set 2.2: B 68 ASN : amide:sc= -0.0761 K(o=-0.065,f=1) USER MOD Set 3.1: B 53 ASN : amide:sc= -0.0285 X(o=-0.029,f=-0.33) USER MOD Set 3.2: B 54 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.0252 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -45:sc= 0.343 USER MOD Single : A 17 GLN : amide:sc= 0.0501 K(o=0.05,f=-0.5) USER MOD Single : A 21 THR OG1 : rot -79:sc= 1.24 USER MOD Single : A 22 SER OG : rot 150:sc= -0.789 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl -162:sc= -0.125 (180deg=-0.555) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 ASN : amide:sc= 0.15 K(o=0.15,f=-4.9!) USER MOD Single : B 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 40 SER OG : rot 180:sc= 0 USER MOD Single : B 41 HIS : no HD1:sc= 0 X(o=0,f=-0.25) USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0893) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= -0.0356 X(o=-0.036,f=-0.008) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 LYS NZ :NH3+ -175:sc=-0.00171 (180deg=-0.0673) USER MOD Single : B 81 TYR OH : rot 180:sc= 0.669 USER MOD Single : B 84 GLN : amide:sc= 0.0964 X(o=0.096,f=-0.11) USER MOD Single : B 87 SER OG : rot 180:sc= -0.506 USER MOD Single : B 89 GLN : amide:sc= 0.662 K(o=0.66,f=-2.3) USER MOD Single : B 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 91 TYR OH : rot 180:sc= 0 USER MOD Single : B 93 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.5!) USER MOD Single : B 94 GLN : amide:sc= -0.0155 K(o=-0.016,f=-0.69) USER MOD Single : B 97 THR OG1 : rot 80:sc= -0.715 USER MOD Single : B 102 THR OG1 : rot 180:sc= -1.06 USER MOD Single : B 103 THR OG1 : rot 180:sc= -0.131 USER MOD Single : B 104 THR OG1 : rot -130:sc= 0.89 USER MOD Single : B 105 SER OG : rot 180:sc= 0.0515 USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 111 SER OG : rot 180:sc= 0 USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 115 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.0091) USER MOD Single : B 116 HIS : no HD1:sc= -0.0122 X(o=-0.012,f=0) USER MOD Single : B 117 HIS : no HD1:sc= -0.0427 X(o=-0.043,f=-0.016) USER MOD Single : B 118 HIS : no HD1:sc=-0.00416 X(o=-0.0042,f=-0.0042) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.516 22.192 7.715 1.00 0.00 N ATOM 2 CA GLY A 1 10.245 21.553 7.296 1.00 0.00 C ATOM 3 C GLY A 1 9.880 20.383 8.183 1.00 0.00 C ATOM 4 O GLY A 1 10.758 19.687 8.694 1.00 0.00 O ATOM 0 H1 GLY A 1 11.317 23.130 8.118 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.983 21.600 8.431 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.141 22.295 6.890 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.443 22.291 7.321 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.333 21.212 6.264 1.00 0.00 H new ATOM 10 N SER A 2 8.586 20.168 8.379 1.00 0.00 N ATOM 11 CA SER A 2 8.115 19.066 9.200 1.00 0.00 C ATOM 12 C SER A 2 7.886 17.824 8.346 1.00 0.00 C ATOM 13 O SER A 2 6.947 17.767 7.548 1.00 0.00 O ATOM 14 CB SER A 2 6.822 19.459 9.917 1.00 0.00 C ATOM 15 OG SER A 2 7.008 20.632 10.693 1.00 0.00 O ATOM 0 H SER A 2 7.845 20.744 7.979 1.00 0.00 H new ATOM 0 HA SER A 2 8.877 18.838 9.945 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.032 19.624 9.185 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.495 18.641 10.560 1.00 0.00 H new ATOM 0 HG SER A 2 6.168 20.865 11.141 1.00 0.00 H new ATOM 21 N GLN A 3 8.744 16.827 8.520 1.00 0.00 N ATOM 22 CA GLN A 3 8.645 15.596 7.751 1.00 0.00 C ATOM 23 C GLN A 3 7.577 14.670 8.320 1.00 0.00 C ATOM 24 O GLN A 3 7.289 13.627 7.745 1.00 0.00 O ATOM 25 CB GLN A 3 9.988 14.865 7.713 1.00 0.00 C ATOM 26 CG GLN A 3 11.087 15.641 7.011 1.00 0.00 C ATOM 27 CD GLN A 3 12.378 14.854 6.915 1.00 0.00 C ATOM 28 OE1 GLN A 3 13.225 14.916 7.804 1.00 0.00 O ATOM 29 NE2 GLN A 3 12.540 14.113 5.832 1.00 0.00 N ATOM 0 H GLN A 3 9.516 16.848 9.187 1.00 0.00 H new ATOM 0 HA GLN A 3 8.361 15.873 6.736 1.00 0.00 H new ATOM 0 HB2 GLN A 3 10.303 14.650 8.734 1.00 0.00 H new ATOM 0 HB3 GLN A 3 9.855 13.906 7.211 1.00 0.00 H new ATOM 0 HG2 GLN A 3 10.754 15.911 6.009 1.00 0.00 H new ATOM 0 HG3 GLN A 3 11.271 16.572 7.548 1.00 0.00 H new ATOM 0 HE21 GLN A 3 11.813 14.089 5.117 1.00 0.00 H new ATOM 0 HE22 GLN A 3 13.392 13.566 5.711 1.00 0.00 H new ATOM 38 N THR A 4 6.990 15.044 9.449 1.00 0.00 N ATOM 39 CA THR A 4 5.947 14.227 10.050 1.00 0.00 C ATOM 40 C THR A 4 4.621 14.404 9.307 1.00 0.00 C ATOM 41 O THR A 4 3.757 13.529 9.347 1.00 0.00 O ATOM 42 CB THR A 4 5.761 14.538 11.554 1.00 0.00 C ATOM 43 OG1 THR A 4 4.913 13.551 12.157 1.00 0.00 O ATOM 44 CG2 THR A 4 5.162 15.922 11.769 1.00 0.00 C ATOM 0 H THR A 4 7.215 15.897 9.961 1.00 0.00 H new ATOM 0 HA THR A 4 6.266 13.188 9.963 1.00 0.00 H new ATOM 0 HB THR A 4 6.745 14.516 12.022 1.00 0.00 H new ATOM 0 HG1 THR A 4 4.801 13.754 13.109 1.00 0.00 H new ATOM 0 HG21 THR A 4 5.046 16.106 12.837 1.00 0.00 H new ATOM 0 HG22 THR A 4 5.823 16.675 11.341 1.00 0.00 H new ATOM 0 HG23 THR A 4 4.188 15.976 11.283 1.00 0.00 H new ATOM 52 N THR A 5 4.471 15.530 8.618 1.00 0.00 N ATOM 53 CA THR A 5 3.270 15.792 7.840 1.00 0.00 C ATOM 54 C THR A 5 3.574 15.731 6.346 1.00 0.00 C ATOM 55 O THR A 5 2.715 16.011 5.507 1.00 0.00 O ATOM 56 CB THR A 5 2.678 17.169 8.190 1.00 0.00 C ATOM 57 OG1 THR A 5 3.721 18.151 8.218 1.00 0.00 O ATOM 58 CG2 THR A 5 1.971 17.132 9.537 1.00 0.00 C ATOM 0 H THR A 5 5.167 16.275 8.584 1.00 0.00 H new ATOM 0 HA THR A 5 2.539 15.022 8.088 1.00 0.00 H new ATOM 0 HB THR A 5 1.947 17.433 7.426 1.00 0.00 H new ATOM 0 HG1 THR A 5 3.340 19.026 8.439 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.562 18.117 9.760 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.162 16.402 9.503 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.682 16.850 10.313 1.00 0.00 H new ATOM 66 N ALA A 6 4.806 15.359 6.028 1.00 0.00 N ATOM 67 CA ALA A 6 5.252 15.269 4.645 1.00 0.00 C ATOM 68 C ALA A 6 4.699 14.027 3.933 1.00 0.00 C ATOM 69 O ALA A 6 4.214 14.140 2.808 1.00 0.00 O ATOM 70 CB ALA A 6 6.773 15.299 4.570 1.00 0.00 C ATOM 0 H ALA A 6 5.519 15.113 6.715 1.00 0.00 H new ATOM 0 HA ALA A 6 4.855 16.139 4.123 1.00 0.00 H new ATOM 0 HB1 ALA A 6 7.087 15.231 3.529 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.140 16.231 4.999 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.181 14.457 5.128 1.00 0.00 H new ATOM 76 N PRO A 7 4.756 12.821 4.547 1.00 0.00 N ATOM 77 CA PRO A 7 4.249 11.607 3.913 1.00 0.00 C ATOM 78 C PRO A 7 2.729 11.571 3.892 1.00 0.00 C ATOM 79 O PRO A 7 2.080 11.773 4.916 1.00 0.00 O ATOM 80 CB PRO A 7 4.793 10.464 4.788 1.00 0.00 C ATOM 81 CG PRO A 7 5.751 11.102 5.736 1.00 0.00 C ATOM 82 CD PRO A 7 5.301 12.523 5.878 1.00 0.00 C ATOM 0 HA PRO A 7 4.564 11.539 2.872 1.00 0.00 H new ATOM 0 HB2 PRO A 7 3.987 9.964 5.324 1.00 0.00 H new ATOM 0 HB3 PRO A 7 5.289 9.708 4.180 1.00 0.00 H new ATOM 0 HG2 PRO A 7 5.745 10.592 6.699 1.00 0.00 H new ATOM 0 HG3 PRO A 7 6.771 11.051 5.354 1.00 0.00 H new ATOM 0 HD2 PRO A 7 4.548 12.634 6.658 1.00 0.00 H new ATOM 0 HD3 PRO A 7 6.127 13.186 6.136 1.00 0.00 H new ATOM 90 N ASP A 8 2.164 11.312 2.726 1.00 0.00 N ATOM 91 CA ASP A 8 0.721 11.201 2.591 1.00 0.00 C ATOM 92 C ASP A 8 0.319 9.735 2.512 1.00 0.00 C ATOM 93 O ASP A 8 -0.422 9.317 1.619 1.00 0.00 O ATOM 94 CB ASP A 8 0.230 11.958 1.359 1.00 0.00 C ATOM 95 CG ASP A 8 0.306 13.463 1.527 1.00 0.00 C ATOM 96 OD1 ASP A 8 -0.449 14.012 2.359 1.00 0.00 O ATOM 97 OD2 ASP A 8 1.091 14.115 0.805 1.00 0.00 O ATOM 0 H ASP A 8 2.682 11.174 1.858 1.00 0.00 H new ATOM 0 HA ASP A 8 0.255 11.649 3.468 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.825 11.663 0.495 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -0.801 11.672 1.149 1.00 0.00 H new ATOM 102 N ALA A 9 0.823 8.963 3.462 1.00 0.00 N ATOM 103 CA ALA A 9 0.559 7.535 3.520 1.00 0.00 C ATOM 104 C ALA A 9 -0.765 7.264 4.215 1.00 0.00 C ATOM 105 O ALA A 9 -1.052 7.850 5.265 1.00 0.00 O ATOM 106 CB ALA A 9 1.688 6.822 4.245 1.00 0.00 C ATOM 0 H ALA A 9 1.424 9.307 4.211 1.00 0.00 H new ATOM 0 HA ALA A 9 0.498 7.153 2.501 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.479 5.753 4.282 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.625 6.990 3.714 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.771 7.211 5.260 1.00 0.00 H new ATOM 112 N PRO A 10 -1.600 6.390 3.632 1.00 0.00 N ATOM 113 CA PRO A 10 -2.865 5.979 4.245 1.00 0.00 C ATOM 114 C PRO A 10 -2.653 5.387 5.636 1.00 0.00 C ATOM 115 O PRO A 10 -1.741 4.580 5.827 1.00 0.00 O ATOM 116 CB PRO A 10 -3.403 4.909 3.287 1.00 0.00 C ATOM 117 CG PRO A 10 -2.739 5.192 1.986 1.00 0.00 C ATOM 118 CD PRO A 10 -1.383 5.740 2.328 1.00 0.00 C ATOM 0 HA PRO A 10 -3.545 6.819 4.383 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.166 3.906 3.642 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.488 4.968 3.198 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -2.654 4.286 1.385 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.315 5.910 1.401 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.634 4.950 2.392 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.035 6.450 1.578 1.00 0.00 H new ATOM 126 N PRO A 11 -3.470 5.806 6.623 1.00 0.00 N ATOM 127 CA PRO A 11 -3.314 5.405 8.027 1.00 0.00 C ATOM 128 C PRO A 11 -3.011 3.921 8.197 1.00 0.00 C ATOM 129 O PRO A 11 -1.958 3.549 8.730 1.00 0.00 O ATOM 130 CB PRO A 11 -4.673 5.746 8.634 1.00 0.00 C ATOM 131 CG PRO A 11 -5.155 6.906 7.836 1.00 0.00 C ATOM 132 CD PRO A 11 -4.622 6.710 6.441 1.00 0.00 C ATOM 0 HA PRO A 11 -2.471 5.909 8.500 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.361 4.903 8.566 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.584 6.000 9.690 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -6.244 6.951 7.833 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.799 7.845 8.260 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.374 6.272 5.784 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.320 7.656 5.992 1.00 0.00 H new ATOM 140 N ASP A 12 -3.922 3.082 7.722 1.00 0.00 N ATOM 141 CA ASP A 12 -3.762 1.642 7.837 1.00 0.00 C ATOM 142 C ASP A 12 -4.578 0.912 6.780 1.00 0.00 C ATOM 143 O ASP A 12 -5.808 0.981 6.777 1.00 0.00 O ATOM 144 CB ASP A 12 -4.189 1.172 9.229 1.00 0.00 C ATOM 145 CG ASP A 12 -4.176 -0.338 9.357 1.00 0.00 C ATOM 146 OD1 ASP A 12 -5.244 -0.965 9.182 1.00 0.00 O ATOM 147 OD2 ASP A 12 -3.100 -0.906 9.638 1.00 0.00 O ATOM 0 H ASP A 12 -4.779 3.376 7.254 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.708 1.410 7.682 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -3.522 1.603 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.191 1.544 9.444 1.00 0.00 H new ATOM 152 N PRO A 13 -3.903 0.217 5.854 1.00 0.00 N ATOM 153 CA PRO A 13 -4.567 -0.663 4.899 1.00 0.00 C ATOM 154 C PRO A 13 -5.096 -1.911 5.594 1.00 0.00 C ATOM 155 O PRO A 13 -4.327 -2.714 6.129 1.00 0.00 O ATOM 156 CB PRO A 13 -3.462 -1.027 3.895 1.00 0.00 C ATOM 157 CG PRO A 13 -2.335 -0.093 4.189 1.00 0.00 C ATOM 158 CD PRO A 13 -2.453 0.249 5.644 1.00 0.00 C ATOM 0 HA PRO A 13 -5.427 -0.192 4.423 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -3.152 -2.065 4.011 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -3.810 -0.912 2.869 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -1.374 -0.561 3.974 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.399 0.803 3.571 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -1.934 -0.473 6.275 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.031 1.229 5.867 1.00 0.00 H new ATOM 166 N THR A 14 -6.407 -2.061 5.596 1.00 0.00 N ATOM 167 CA THR A 14 -7.049 -3.146 6.314 1.00 0.00 C ATOM 168 C THR A 14 -7.541 -4.221 5.356 1.00 0.00 C ATOM 169 O THR A 14 -8.015 -3.920 4.259 1.00 0.00 O ATOM 170 CB THR A 14 -8.238 -2.618 7.131 1.00 0.00 C ATOM 171 OG1 THR A 14 -7.878 -1.377 7.756 1.00 0.00 O ATOM 172 CG2 THR A 14 -8.655 -3.620 8.199 1.00 0.00 C ATOM 0 H THR A 14 -7.052 -1.441 5.105 1.00 0.00 H new ATOM 0 HA THR A 14 -6.308 -3.582 6.984 1.00 0.00 H new ATOM 0 HB THR A 14 -9.078 -2.464 6.454 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.988 -1.460 8.159 1.00 0.00 H new ATOM 0 HG21 THR A 14 -9.498 -3.221 8.763 1.00 0.00 H new ATOM 0 HG22 THR A 14 -8.946 -4.557 7.725 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.819 -3.800 8.875 1.00 0.00 H new ATOM 180 N VAL A 15 -7.423 -5.469 5.774 1.00 0.00 N ATOM 181 CA VAL A 15 -7.869 -6.590 4.968 1.00 0.00 C ATOM 182 C VAL A 15 -9.270 -7.028 5.382 1.00 0.00 C ATOM 183 O VAL A 15 -9.504 -7.391 6.537 1.00 0.00 O ATOM 184 CB VAL A 15 -6.883 -7.770 5.083 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.411 -9.007 4.376 1.00 0.00 C ATOM 186 CG2 VAL A 15 -5.530 -7.370 4.518 1.00 0.00 C ATOM 0 H VAL A 15 -7.019 -5.732 6.673 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.902 -6.267 3.927 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.771 -8.018 6.138 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.691 -9.819 4.477 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.359 -9.305 4.823 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.562 -8.786 3.319 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.838 -8.208 4.602 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.641 -7.095 3.469 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.139 -6.520 5.077 1.00 0.00 H new ATOM 196 N ASP A 16 -10.198 -6.975 4.440 1.00 0.00 N ATOM 197 CA ASP A 16 -11.594 -7.294 4.709 1.00 0.00 C ATOM 198 C ASP A 16 -12.117 -8.329 3.714 1.00 0.00 C ATOM 199 O ASP A 16 -11.744 -8.305 2.543 1.00 0.00 O ATOM 200 CB ASP A 16 -12.433 -6.012 4.638 1.00 0.00 C ATOM 201 CG ASP A 16 -13.917 -6.255 4.822 1.00 0.00 C ATOM 202 OD1 ASP A 16 -14.315 -6.775 5.886 1.00 0.00 O ATOM 203 OD2 ASP A 16 -14.696 -5.896 3.912 1.00 0.00 O ATOM 0 H ASP A 16 -10.008 -6.712 3.473 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.672 -7.722 5.709 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.088 -5.318 5.404 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -12.268 -5.531 3.674 1.00 0.00 H new ATOM 208 N GLN A 17 -12.952 -9.242 4.208 1.00 0.00 N ATOM 209 CA GLN A 17 -13.633 -10.242 3.379 1.00 0.00 C ATOM 210 C GLN A 17 -12.656 -11.159 2.648 1.00 0.00 C ATOM 211 O GLN A 17 -12.301 -10.918 1.491 1.00 0.00 O ATOM 212 CB GLN A 17 -14.571 -9.569 2.373 1.00 0.00 C ATOM 213 CG GLN A 17 -15.653 -8.728 3.026 1.00 0.00 C ATOM 214 CD GLN A 17 -16.591 -8.094 2.023 1.00 0.00 C ATOM 215 OE1 GLN A 17 -16.878 -8.663 0.968 1.00 0.00 O ATOM 216 NE2 GLN A 17 -17.055 -6.895 2.334 1.00 0.00 N ATOM 0 H GLN A 17 -13.178 -9.311 5.200 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.218 -10.862 4.058 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.984 -8.938 1.706 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.040 -10.335 1.756 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -16.228 -9.352 3.710 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -15.186 -7.946 3.625 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -16.792 -6.460 3.218 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -17.676 -6.405 1.689 1.00 0.00 H new ATOM 225 N VAL A 18 -12.235 -12.220 3.322 1.00 0.00 N ATOM 226 CA VAL A 18 -11.385 -13.220 2.702 1.00 0.00 C ATOM 227 C VAL A 18 -12.229 -14.191 1.872 1.00 0.00 C ATOM 228 O VAL A 18 -13.066 -14.928 2.394 1.00 0.00 O ATOM 229 CB VAL A 18 -10.531 -13.986 3.748 1.00 0.00 C ATOM 230 CG1 VAL A 18 -11.397 -14.626 4.823 1.00 0.00 C ATOM 231 CG2 VAL A 18 -9.656 -15.032 3.070 1.00 0.00 C ATOM 0 H VAL A 18 -12.469 -12.408 4.297 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.691 -12.701 2.041 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.885 -13.257 4.237 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.762 -15.152 5.536 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -11.963 -13.853 5.343 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -12.087 -15.332 4.361 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -9.067 -15.556 3.822 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -10.287 -15.746 2.541 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -8.988 -14.543 2.361 1.00 0.00 H new ATOM 241 N ASP A 19 -12.026 -14.155 0.567 1.00 0.00 N ATOM 242 CA ASP A 19 -12.760 -15.007 -0.358 1.00 0.00 C ATOM 243 C ASP A 19 -12.035 -16.345 -0.497 1.00 0.00 C ATOM 244 O ASP A 19 -11.237 -16.705 0.368 1.00 0.00 O ATOM 245 CB ASP A 19 -12.878 -14.316 -1.720 1.00 0.00 C ATOM 246 CG ASP A 19 -14.179 -14.639 -2.426 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.381 -15.808 -2.805 1.00 0.00 O ATOM 248 OD2 ASP A 19 -15.004 -13.718 -2.602 1.00 0.00 O ATOM 0 H ASP A 19 -11.350 -13.537 0.117 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.764 -15.186 0.026 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.801 -13.237 -1.584 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.042 -14.618 -2.350 1.00 0.00 H new ATOM 253 N ASP A 20 -12.298 -17.078 -1.579 1.00 0.00 N ATOM 254 CA ASP A 20 -11.662 -18.379 -1.790 1.00 0.00 C ATOM 255 C ASP A 20 -10.138 -18.235 -1.792 1.00 0.00 C ATOM 256 O ASP A 20 -9.437 -18.997 -1.132 1.00 0.00 O ATOM 257 CB ASP A 20 -12.149 -19.039 -3.095 1.00 0.00 C ATOM 258 CG ASP A 20 -11.547 -18.441 -4.354 1.00 0.00 C ATOM 259 OD1 ASP A 20 -12.064 -17.415 -4.844 1.00 0.00 O ATOM 260 OD2 ASP A 20 -10.553 -18.998 -4.866 1.00 0.00 O ATOM 0 H ASP A 20 -12.942 -16.796 -2.318 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.949 -19.030 -0.964 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.913 -20.103 -3.062 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.234 -18.955 -3.149 1.00 0.00 H new ATOM 265 N THR A 21 -9.641 -17.246 -2.527 1.00 0.00 N ATOM 266 CA THR A 21 -8.219 -16.923 -2.552 1.00 0.00 C ATOM 267 C THR A 21 -8.030 -15.437 -2.820 1.00 0.00 C ATOM 268 O THR A 21 -7.130 -15.029 -3.557 1.00 0.00 O ATOM 269 CB THR A 21 -7.455 -17.728 -3.627 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.229 -17.805 -4.830 1.00 0.00 O ATOM 271 CG2 THR A 21 -7.106 -19.125 -3.137 1.00 0.00 C ATOM 0 H THR A 21 -10.212 -16.646 -3.122 1.00 0.00 H new ATOM 0 HA THR A 21 -7.812 -17.190 -1.577 1.00 0.00 H new ATOM 0 HB THR A 21 -6.521 -17.205 -3.834 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.924 -18.488 -4.729 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.569 -19.662 -3.919 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.477 -19.053 -2.250 1.00 0.00 H new ATOM 0 HG23 THR A 21 -8.021 -19.663 -2.890 1.00 0.00 H new ATOM 279 N SER A 22 -8.901 -14.627 -2.246 1.00 0.00 N ATOM 280 CA SER A 22 -8.891 -13.201 -2.512 1.00 0.00 C ATOM 281 C SER A 22 -9.266 -12.415 -1.264 1.00 0.00 C ATOM 282 O SER A 22 -9.893 -12.951 -0.358 1.00 0.00 O ATOM 283 CB SER A 22 -9.866 -12.888 -3.648 1.00 0.00 C ATOM 284 OG SER A 22 -9.621 -13.730 -4.763 1.00 0.00 O ATOM 0 H SER A 22 -9.623 -14.932 -1.594 1.00 0.00 H new ATOM 0 HA SER A 22 -7.884 -12.905 -2.807 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.891 -13.023 -3.302 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.764 -11.844 -3.945 1.00 0.00 H new ATOM 0 HG SER A 22 -10.459 -13.882 -5.248 1.00 0.00 H new ATOM 290 N ILE A 23 -8.863 -11.158 -1.216 1.00 0.00 N ATOM 291 CA ILE A 23 -9.226 -10.275 -0.114 1.00 0.00 C ATOM 292 C ILE A 23 -9.654 -8.925 -0.657 1.00 0.00 C ATOM 293 O ILE A 23 -9.346 -8.592 -1.802 1.00 0.00 O ATOM 294 CB ILE A 23 -8.048 -10.020 0.854 1.00 0.00 C ATOM 295 CG1 ILE A 23 -6.962 -9.202 0.145 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.481 -11.332 1.384 1.00 0.00 C ATOM 297 CD1 ILE A 23 -5.992 -8.516 1.081 1.00 0.00 C ATOM 0 H ILE A 23 -8.281 -10.721 -1.930 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.032 -10.772 0.425 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.415 -9.452 1.709 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.403 -9.860 -0.520 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.441 -8.448 -0.480 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.654 -11.123 2.062 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.260 -11.876 1.918 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.123 -11.937 0.551 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.257 -7.960 0.499 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.536 -7.830 1.730 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.483 -9.264 1.689 1.00 0.00 H new ATOM 309 N VAL A 24 -10.351 -8.153 0.153 1.00 0.00 N ATOM 310 CA VAL A 24 -10.591 -6.763 -0.164 1.00 0.00 C ATOM 311 C VAL A 24 -9.746 -5.897 0.761 1.00 0.00 C ATOM 312 O VAL A 24 -10.054 -5.745 1.944 1.00 0.00 O ATOM 313 CB VAL A 24 -12.081 -6.383 -0.016 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.316 -4.941 -0.441 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.961 -7.328 -0.822 1.00 0.00 C ATOM 0 H VAL A 24 -10.760 -8.466 1.034 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.316 -6.597 -1.206 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.351 -6.477 1.036 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.372 -4.696 -0.328 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.720 -4.276 0.184 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -12.024 -4.817 -1.484 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -14.006 -7.042 -0.703 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.687 -7.271 -1.875 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.821 -8.348 -0.465 1.00 0.00 H new ATOM 325 N VAL A 25 -8.671 -5.350 0.225 1.00 0.00 N ATOM 326 CA VAL A 25 -7.783 -4.501 1.000 1.00 0.00 C ATOM 327 C VAL A 25 -8.215 -3.045 0.861 1.00 0.00 C ATOM 328 O VAL A 25 -8.286 -2.506 -0.244 1.00 0.00 O ATOM 329 CB VAL A 25 -6.297 -4.701 0.590 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.128 -4.672 -0.918 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.391 -3.674 1.247 1.00 0.00 C ATOM 0 H VAL A 25 -8.390 -5.479 -0.747 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.856 -4.786 2.049 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.000 -5.687 0.946 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.077 -4.815 -1.169 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.720 -5.470 -1.366 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.466 -3.710 -1.304 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.361 -3.846 0.936 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.698 -2.672 0.946 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.463 -3.765 2.331 1.00 0.00 H new ATOM 341 N ARG A 26 -8.549 -2.432 1.986 1.00 0.00 N ATOM 342 CA ARG A 26 -9.101 -1.085 1.994 1.00 0.00 C ATOM 343 C ARG A 26 -8.150 -0.115 2.678 1.00 0.00 C ATOM 344 O ARG A 26 -7.497 -0.468 3.660 1.00 0.00 O ATOM 345 CB ARG A 26 -10.443 -1.065 2.727 1.00 0.00 C ATOM 346 CG ARG A 26 -11.427 -2.120 2.255 1.00 0.00 C ATOM 347 CD ARG A 26 -12.773 -1.959 2.944 1.00 0.00 C ATOM 348 NE ARG A 26 -13.634 -3.125 2.752 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.746 -3.132 2.019 1.00 0.00 C ATOM 350 NH1 ARG A 26 -15.139 -2.040 1.372 1.00 0.00 N ATOM 351 NH2 ARG A 26 -15.468 -4.241 1.945 1.00 0.00 N ATOM 0 H ARG A 26 -8.447 -2.849 2.911 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.243 -0.777 0.958 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.264 -1.203 3.793 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.896 -0.081 2.605 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.556 -2.044 1.175 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.027 -3.113 2.459 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -12.616 -1.797 4.010 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.274 -1.072 2.557 1.00 0.00 H new ATOM 0 HE ARG A 26 -13.364 -3.994 3.212 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.587 -1.184 1.434 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -15.992 -2.057 0.814 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -15.170 -5.078 2.446 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.321 -4.258 1.387 1.00 0.00 H new ATOM 365 N TRP A 27 -8.079 1.101 2.163 1.00 0.00 N ATOM 366 CA TRP A 27 -7.262 2.141 2.769 1.00 0.00 C ATOM 367 C TRP A 27 -7.884 3.508 2.513 1.00 0.00 C ATOM 368 O TRP A 27 -8.588 3.703 1.521 1.00 0.00 O ATOM 369 CB TRP A 27 -5.827 2.095 2.222 1.00 0.00 C ATOM 370 CG TRP A 27 -5.733 2.301 0.739 1.00 0.00 C ATOM 371 CD1 TRP A 27 -5.599 3.492 0.086 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.755 1.288 -0.274 1.00 0.00 C ATOM 373 NE1 TRP A 27 -5.550 3.282 -1.270 1.00 0.00 N ATOM 374 CE2 TRP A 27 -5.640 1.937 -1.516 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.863 -0.105 -0.250 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -5.630 1.242 -2.722 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.851 -0.794 -1.448 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.736 -0.120 -2.669 1.00 0.00 C ATOM 0 H TRP A 27 -8.579 1.394 1.324 1.00 0.00 H new ATOM 0 HA TRP A 27 -7.221 1.967 3.844 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.233 2.860 2.723 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.384 1.131 2.474 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -5.540 4.458 0.566 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.461 4.009 -1.979 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.954 -0.633 0.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -5.542 1.760 -3.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.932 -1.871 -1.442 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.731 -0.687 -3.588 1.00 0.00 H new ATOM 389 N SER A 28 -7.642 4.444 3.409 1.00 0.00 N ATOM 390 CA SER A 28 -8.138 5.797 3.244 1.00 0.00 C ATOM 391 C SER A 28 -6.985 6.760 3.004 1.00 0.00 C ATOM 392 O SER A 28 -5.993 6.736 3.727 1.00 0.00 O ATOM 393 CB SER A 28 -8.945 6.210 4.475 1.00 0.00 C ATOM 394 OG SER A 28 -8.256 5.888 5.675 1.00 0.00 O ATOM 0 H SER A 28 -7.103 4.292 4.262 1.00 0.00 H new ATOM 0 HA SER A 28 -8.792 5.831 2.373 1.00 0.00 H new ATOM 0 HB2 SER A 28 -9.141 7.282 4.442 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.913 5.709 4.463 1.00 0.00 H new ATOM 0 HG SER A 28 -8.794 6.165 6.446 1.00 0.00 H new ATOM 400 N ARG A 29 -7.092 7.589 1.976 1.00 0.00 N ATOM 401 CA ARG A 29 -6.048 8.566 1.707 1.00 0.00 C ATOM 402 C ARG A 29 -6.349 9.863 2.457 1.00 0.00 C ATOM 403 O ARG A 29 -7.503 10.120 2.805 1.00 0.00 O ATOM 404 CB ARG A 29 -5.878 8.816 0.196 1.00 0.00 C ATOM 405 CG ARG A 29 -6.773 9.898 -0.385 1.00 0.00 C ATOM 406 CD ARG A 29 -8.237 9.542 -0.255 1.00 0.00 C ATOM 407 NE ARG A 29 -9.101 10.612 -0.749 1.00 0.00 N ATOM 408 CZ ARG A 29 -10.399 10.472 -1.005 1.00 0.00 C ATOM 409 NH1 ARG A 29 -11.002 9.307 -0.804 1.00 0.00 N ATOM 410 NH2 ARG A 29 -11.096 11.500 -1.467 1.00 0.00 N ATOM 0 H ARG A 29 -7.877 7.606 1.325 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.100 8.166 2.066 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -4.839 9.084 0.003 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.071 7.884 -0.334 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -6.581 10.842 0.125 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.527 10.048 -1.436 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -8.439 8.626 -0.810 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -8.471 9.339 0.790 1.00 0.00 H new ATOM 0 HE ARG A 29 -8.681 11.528 -0.908 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -10.470 8.512 -0.451 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -11.997 9.207 -1.002 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -10.637 12.397 -1.626 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -12.091 11.394 -1.664 1.00 0.00 H new ATOM 424 N PRO A 30 -5.319 10.672 2.751 1.00 0.00 N ATOM 425 CA PRO A 30 -5.495 11.954 3.443 1.00 0.00 C ATOM 426 C PRO A 30 -6.388 12.913 2.661 1.00 0.00 C ATOM 427 O PRO A 30 -5.909 13.506 1.673 1.00 0.00 O ATOM 428 CB PRO A 30 -4.071 12.511 3.554 1.00 0.00 C ATOM 429 CG PRO A 30 -3.180 11.330 3.388 1.00 0.00 C ATOM 430 CD PRO A 30 -3.901 10.406 2.452 1.00 0.00 C ATOM 431 OXT PRO A 30 -7.568 13.078 3.041 1.00 0.00 O ATOM 0 HA PRO A 30 -5.986 11.829 4.408 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.880 13.261 2.786 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.910 12.994 4.518 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -2.213 11.624 2.980 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.989 10.846 4.346 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -3.661 10.619 1.410 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -3.639 9.363 2.633 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -0.640 24.916 -2.661 1.00 0.00 N ATOM 441 CA MET B 31 -1.952 24.703 -2.007 1.00 0.00 C ATOM 442 C MET B 31 -3.033 25.527 -2.696 1.00 0.00 C ATOM 443 O MET B 31 -3.977 24.979 -3.263 1.00 0.00 O ATOM 444 CB MET B 31 -1.883 25.074 -0.520 1.00 0.00 C ATOM 445 CG MET B 31 -3.176 24.810 0.237 1.00 0.00 C ATOM 446 SD MET B 31 -3.087 25.314 1.968 1.00 0.00 S ATOM 447 CE MET B 31 -1.760 24.268 2.567 1.00 0.00 C ATOM 0 HA MET B 31 -2.204 23.646 -2.093 1.00 0.00 H new ATOM 0 HB2 MET B 31 -1.076 24.510 -0.051 1.00 0.00 H new ATOM 0 HB3 MET B 31 -1.629 26.130 -0.430 1.00 0.00 H new ATOM 0 HG2 MET B 31 -3.993 25.343 -0.250 1.00 0.00 H new ATOM 0 HG3 MET B 31 -3.412 23.747 0.184 1.00 0.00 H new ATOM 0 HE1 MET B 31 -1.796 24.222 3.655 1.00 0.00 H new ATOM 0 HE2 MET B 31 -1.875 23.264 2.157 1.00 0.00 H new ATOM 0 HE3 MET B 31 -0.801 24.681 2.253 1.00 0.00 H new ATOM 459 N ARG B 32 -2.890 26.844 -2.647 1.00 0.00 N ATOM 460 CA ARG B 32 -3.857 27.739 -3.262 1.00 0.00 C ATOM 461 C ARG B 32 -3.262 28.382 -4.505 1.00 0.00 C ATOM 462 O ARG B 32 -2.066 28.673 -4.552 1.00 0.00 O ATOM 463 CB ARG B 32 -4.298 28.819 -2.271 1.00 0.00 C ATOM 464 CG ARG B 32 -5.066 28.274 -1.080 1.00 0.00 C ATOM 465 CD ARG B 32 -5.506 29.391 -0.149 1.00 0.00 C ATOM 466 NE ARG B 32 -6.258 28.883 0.997 1.00 0.00 N ATOM 467 CZ ARG B 32 -6.685 29.645 2.005 1.00 0.00 C ATOM 468 NH1 ARG B 32 -6.442 30.949 2.006 1.00 0.00 N ATOM 469 NH2 ARG B 32 -7.353 29.100 3.013 1.00 0.00 N ATOM 0 H ARG B 32 -2.112 27.316 -2.187 1.00 0.00 H new ATOM 0 HA ARG B 32 -4.731 27.155 -3.550 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -3.418 29.352 -1.912 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -4.921 29.546 -2.792 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -5.940 27.723 -1.429 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -4.441 27.567 -0.534 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -4.630 29.935 0.204 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -6.121 30.102 -0.701 1.00 0.00 H new ATOM 0 HE ARG B 32 -6.469 27.886 1.028 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -5.927 31.372 1.234 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -6.770 31.528 2.779 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -7.541 28.097 3.018 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -7.679 29.683 3.783 1.00 0.00 H new ATOM 483 N GLY B 33 -4.098 28.605 -5.506 1.00 0.00 N ATOM 484 CA GLY B 33 -3.629 29.167 -6.754 1.00 0.00 C ATOM 485 C GLY B 33 -4.745 29.297 -7.765 1.00 0.00 C ATOM 486 O GLY B 33 -5.837 29.755 -7.433 1.00 0.00 O ATOM 0 H GLY B 33 -5.098 28.406 -5.476 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -3.190 30.147 -6.569 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -2.840 28.536 -7.163 1.00 0.00 H new ATOM 490 N SER B 34 -4.484 28.877 -8.992 1.00 0.00 N ATOM 491 CA SER B 34 -5.481 28.951 -10.044 1.00 0.00 C ATOM 492 C SER B 34 -6.473 27.797 -9.923 1.00 0.00 C ATOM 493 O SER B 34 -7.682 28.012 -9.856 1.00 0.00 O ATOM 494 CB SER B 34 -4.806 28.937 -11.419 1.00 0.00 C ATOM 495 OG SER B 34 -5.753 29.119 -12.457 1.00 0.00 O ATOM 0 H SER B 34 -3.590 28.482 -9.283 1.00 0.00 H new ATOM 0 HA SER B 34 -6.029 29.887 -9.937 1.00 0.00 H new ATOM 0 HB2 SER B 34 -4.055 29.725 -11.466 1.00 0.00 H new ATOM 0 HB3 SER B 34 -4.284 27.991 -11.561 1.00 0.00 H new ATOM 0 HG SER B 34 -5.295 29.108 -13.323 1.00 0.00 H new ATOM 501 N ASN B 35 -5.956 26.576 -9.869 1.00 0.00 N ATOM 502 CA ASN B 35 -6.798 25.384 -9.794 1.00 0.00 C ATOM 503 C ASN B 35 -6.545 24.626 -8.495 1.00 0.00 C ATOM 504 O ASN B 35 -6.689 23.401 -8.432 1.00 0.00 O ATOM 505 CB ASN B 35 -6.542 24.469 -11.000 1.00 0.00 C ATOM 506 CG ASN B 35 -5.121 23.926 -11.047 1.00 0.00 C ATOM 507 OD1 ASN B 35 -4.179 24.560 -10.572 1.00 0.00 O ATOM 508 ND2 ASN B 35 -4.956 22.753 -11.634 1.00 0.00 N ATOM 0 H ASN B 35 -4.955 26.383 -9.876 1.00 0.00 H new ATOM 0 HA ASN B 35 -7.840 25.702 -9.811 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -7.243 23.634 -10.970 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -6.744 25.022 -11.917 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -4.024 22.345 -11.705 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.761 22.256 -12.016 1.00 0.00 H new ATOM 515 N ALA B 36 -6.177 25.385 -7.462 1.00 0.00 N ATOM 516 CA ALA B 36 -5.838 24.838 -6.149 1.00 0.00 C ATOM 517 C ALA B 36 -4.807 23.713 -6.255 1.00 0.00 C ATOM 518 O ALA B 36 -5.122 22.548 -6.007 1.00 0.00 O ATOM 519 CB ALA B 36 -7.092 24.353 -5.429 1.00 0.00 C ATOM 0 H ALA B 36 -6.106 26.401 -7.514 1.00 0.00 H new ATOM 0 HA ALA B 36 -5.389 25.641 -5.564 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -6.819 23.950 -4.454 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -7.781 25.187 -5.296 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -7.574 23.575 -6.021 1.00 0.00 H new ATOM 525 N PRO B 37 -3.559 24.044 -6.629 1.00 0.00 N ATOM 526 CA PRO B 37 -2.488 23.055 -6.777 1.00 0.00 C ATOM 527 C PRO B 37 -2.067 22.479 -5.431 1.00 0.00 C ATOM 528 O PRO B 37 -1.320 23.108 -4.678 1.00 0.00 O ATOM 529 CB PRO B 37 -1.329 23.846 -7.405 1.00 0.00 C ATOM 530 CG PRO B 37 -1.923 25.143 -7.844 1.00 0.00 C ATOM 531 CD PRO B 37 -3.082 25.399 -6.927 1.00 0.00 C ATOM 0 HA PRO B 37 -2.802 22.204 -7.381 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -0.527 24.006 -6.684 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -0.897 23.307 -8.248 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -1.191 25.948 -7.782 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -2.251 25.090 -8.882 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.776 25.929 -6.025 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.852 26.004 -7.406 1.00 0.00 H new ATOM 539 N GLN B 38 -2.567 21.293 -5.127 1.00 0.00 N ATOM 540 CA GLN B 38 -2.286 20.648 -3.858 1.00 0.00 C ATOM 541 C GLN B 38 -1.565 19.329 -4.082 1.00 0.00 C ATOM 542 O GLN B 38 -1.935 18.551 -4.961 1.00 0.00 O ATOM 543 CB GLN B 38 -3.587 20.399 -3.091 1.00 0.00 C ATOM 544 CG GLN B 38 -4.311 21.670 -2.688 1.00 0.00 C ATOM 545 CD GLN B 38 -5.586 21.392 -1.924 1.00 0.00 C ATOM 546 OE1 GLN B 38 -5.575 21.289 -0.697 1.00 0.00 O ATOM 547 NE2 GLN B 38 -6.690 21.268 -2.641 1.00 0.00 N ATOM 0 H GLN B 38 -3.173 20.756 -5.747 1.00 0.00 H new ATOM 0 HA GLN B 38 -1.646 21.307 -3.272 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -4.251 19.793 -3.707 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -3.365 19.819 -2.196 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -3.650 22.282 -2.075 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -4.545 22.250 -3.581 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -6.652 21.361 -3.656 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -7.580 21.079 -2.179 1.00 0.00 H new ATOM 556 N PRO B 39 -0.511 19.074 -3.285 1.00 0.00 N ATOM 557 CA PRO B 39 0.229 17.807 -3.316 1.00 0.00 C ATOM 558 C PRO B 39 -0.681 16.609 -3.069 1.00 0.00 C ATOM 559 O PRO B 39 -0.388 15.494 -3.503 1.00 0.00 O ATOM 560 CB PRO B 39 1.243 17.952 -2.178 1.00 0.00 C ATOM 561 CG PRO B 39 1.401 19.419 -1.991 1.00 0.00 C ATOM 562 CD PRO B 39 0.062 20.019 -2.307 1.00 0.00 C ATOM 0 HA PRO B 39 0.689 17.626 -4.287 1.00 0.00 H new ATOM 0 HB2 PRO B 39 0.885 17.474 -1.266 1.00 0.00 H new ATOM 0 HB3 PRO B 39 2.193 17.482 -2.433 1.00 0.00 H new ATOM 0 HG2 PRO B 39 1.703 19.653 -0.970 1.00 0.00 H new ATOM 0 HG3 PRO B 39 2.173 19.816 -2.650 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -0.561 20.104 -1.417 1.00 0.00 H new ATOM 0 HD3 PRO B 39 0.159 21.021 -2.725 1.00 0.00 H new ATOM 570 N SER B 40 -1.785 16.854 -2.371 1.00 0.00 N ATOM 571 CA SER B 40 -2.790 15.835 -2.132 1.00 0.00 C ATOM 572 C SER B 40 -3.530 15.522 -3.425 1.00 0.00 C ATOM 573 O SER B 40 -4.567 16.115 -3.724 1.00 0.00 O ATOM 574 CB SER B 40 -3.779 16.302 -1.057 1.00 0.00 C ATOM 575 OG SER B 40 -4.714 15.284 -0.736 1.00 0.00 O ATOM 0 H SER B 40 -2.004 17.761 -1.959 1.00 0.00 H new ATOM 0 HA SER B 40 -2.295 14.930 -1.779 1.00 0.00 H new ATOM 0 HB2 SER B 40 -3.233 16.592 -0.160 1.00 0.00 H new ATOM 0 HB3 SER B 40 -4.309 17.187 -1.408 1.00 0.00 H new ATOM 0 HG SER B 40 -5.330 15.611 -0.047 1.00 0.00 H new ATOM 581 N HIS B 41 -2.971 14.610 -4.200 1.00 0.00 N ATOM 582 CA HIS B 41 -3.574 14.185 -5.449 1.00 0.00 C ATOM 583 C HIS B 41 -2.930 12.885 -5.904 1.00 0.00 C ATOM 584 O HIS B 41 -1.937 12.895 -6.635 1.00 0.00 O ATOM 585 CB HIS B 41 -3.409 15.264 -6.524 1.00 0.00 C ATOM 586 CG HIS B 41 -4.229 15.014 -7.751 1.00 0.00 C ATOM 587 ND1 HIS B 41 -3.708 14.504 -8.920 1.00 0.00 N ATOM 588 CD2 HIS B 41 -5.549 15.199 -7.981 1.00 0.00 C ATOM 589 CE1 HIS B 41 -4.670 14.387 -9.811 1.00 0.00 C ATOM 590 NE2 HIS B 41 -5.798 14.801 -9.269 1.00 0.00 N ATOM 0 H HIS B 41 -2.090 14.145 -3.982 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.641 14.025 -5.291 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -3.685 16.231 -6.103 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -2.358 15.327 -6.806 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -6.273 15.588 -7.280 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -4.554 14.014 -10.818 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -6.707 14.822 -9.732 1.00 0.00 H new ATOM 599 N ILE B 42 -3.488 11.773 -5.458 1.00 0.00 N ATOM 600 CA ILE B 42 -2.938 10.465 -5.764 1.00 0.00 C ATOM 601 C ILE B 42 -3.294 10.056 -7.187 1.00 0.00 C ATOM 602 O ILE B 42 -4.463 10.031 -7.573 1.00 0.00 O ATOM 603 CB ILE B 42 -3.428 9.372 -4.777 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.895 9.611 -3.354 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.994 7.997 -5.262 1.00 0.00 C ATOM 606 CD1 ILE B 42 -3.569 10.747 -2.611 1.00 0.00 C ATOM 0 H ILE B 42 -4.327 11.751 -4.879 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.856 10.549 -5.662 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.516 9.423 -4.743 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -3.015 8.694 -2.776 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.826 9.815 -3.410 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -3.343 7.238 -4.562 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -3.421 7.807 -6.247 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.906 7.960 -5.325 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -3.130 10.843 -1.618 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -3.427 11.677 -3.162 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -4.635 10.539 -2.518 1.00 0.00 H new ATOM 618 N SER B 43 -2.267 9.752 -7.961 1.00 0.00 N ATOM 619 CA SER B 43 -2.436 9.308 -9.330 1.00 0.00 C ATOM 620 C SER B 43 -2.808 7.828 -9.362 1.00 0.00 C ATOM 621 O SER B 43 -3.711 7.416 -10.096 1.00 0.00 O ATOM 622 CB SER B 43 -1.139 9.536 -10.105 1.00 0.00 C ATOM 623 OG SER B 43 -0.704 10.883 -10.002 1.00 0.00 O ATOM 0 H SER B 43 -1.295 9.806 -7.657 1.00 0.00 H new ATOM 0 HA SER B 43 -3.239 9.880 -9.794 1.00 0.00 H new ATOM 0 HB2 SER B 43 -0.364 8.872 -9.723 1.00 0.00 H new ATOM 0 HB3 SER B 43 -1.290 9.280 -11.154 1.00 0.00 H new ATOM 0 HG SER B 43 0.128 10.997 -10.506 1.00 0.00 H new ATOM 629 N LYS B 44 -2.115 7.034 -8.552 1.00 0.00 N ATOM 630 CA LYS B 44 -2.335 5.596 -8.514 1.00 0.00 C ATOM 631 C LYS B 44 -1.756 4.994 -7.239 1.00 0.00 C ATOM 632 O LYS B 44 -0.870 5.576 -6.610 1.00 0.00 O ATOM 633 CB LYS B 44 -1.700 4.927 -9.740 1.00 0.00 C ATOM 634 CG LYS B 44 -0.197 5.154 -9.853 1.00 0.00 C ATOM 635 CD LYS B 44 0.367 4.547 -11.127 1.00 0.00 C ATOM 636 CE LYS B 44 1.853 4.841 -11.273 1.00 0.00 C ATOM 637 NZ LYS B 44 2.425 4.215 -12.495 1.00 0.00 N ATOM 0 H LYS B 44 -1.394 7.366 -7.911 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.410 5.417 -8.527 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.894 3.855 -9.699 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -2.184 5.305 -10.640 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.012 6.224 -9.835 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.303 4.717 -8.989 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.207 3.469 -11.120 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -0.170 4.943 -11.989 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.008 5.919 -11.311 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.384 4.474 -10.395 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.439 4.439 -12.558 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.301 3.184 -12.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 1.936 4.584 -13.335 1.00 0.00 H new ATOM 651 N TYR B 45 -2.276 3.841 -6.859 1.00 0.00 N ATOM 652 CA TYR B 45 -1.746 3.083 -5.737 1.00 0.00 C ATOM 653 C TYR B 45 -1.168 1.776 -6.254 1.00 0.00 C ATOM 654 O TYR B 45 -1.795 1.102 -7.069 1.00 0.00 O ATOM 655 CB TYR B 45 -2.838 2.768 -4.710 1.00 0.00 C ATOM 656 CG TYR B 45 -3.573 3.972 -4.161 1.00 0.00 C ATOM 657 CD1 TYR B 45 -4.844 4.299 -4.618 1.00 0.00 C ATOM 658 CD2 TYR B 45 -3.007 4.765 -3.171 1.00 0.00 C ATOM 659 CE1 TYR B 45 -5.529 5.383 -4.105 1.00 0.00 C ATOM 660 CE2 TYR B 45 -3.685 5.853 -2.656 1.00 0.00 C ATOM 661 CZ TYR B 45 -4.946 6.157 -3.125 1.00 0.00 C ATOM 662 OH TYR B 45 -5.626 7.236 -2.611 1.00 0.00 O ATOM 0 H TYR B 45 -3.075 3.403 -7.317 1.00 0.00 H new ATOM 0 HA TYR B 45 -0.977 3.683 -5.250 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.564 2.098 -5.170 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.387 2.227 -3.878 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.304 3.696 -5.387 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -2.022 4.527 -2.798 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.517 5.623 -4.470 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -3.230 6.463 -1.890 1.00 0.00 H new ATOM 0 HH TYR B 45 -6.379 7.458 -3.197 1.00 0.00 H new ATOM 672 N ILE B 46 0.021 1.423 -5.805 1.00 0.00 N ATOM 673 CA ILE B 46 0.618 0.157 -6.202 1.00 0.00 C ATOM 674 C ILE B 46 0.603 -0.810 -5.030 1.00 0.00 C ATOM 675 O ILE B 46 1.149 -0.522 -3.964 1.00 0.00 O ATOM 676 CB ILE B 46 2.066 0.313 -6.745 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.074 1.008 -8.115 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.749 -1.046 -6.853 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.749 2.486 -8.070 1.00 0.00 C ATOM 0 H ILE B 46 0.589 1.986 -5.172 1.00 0.00 H new ATOM 0 HA ILE B 46 0.015 -0.237 -7.021 1.00 0.00 H new ATOM 0 HB ILE B 46 2.617 0.934 -6.039 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.057 0.878 -8.568 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.355 0.510 -8.765 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.761 -0.915 -7.235 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.790 -1.512 -5.868 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.184 -1.684 -7.533 1.00 0.00 H new ATOM 0 HD11 ILE B 46 1.777 2.896 -9.080 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.754 2.627 -7.649 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.482 3.001 -7.449 1.00 0.00 H new ATOM 691 N LEU B 47 -0.050 -1.943 -5.232 1.00 0.00 N ATOM 692 CA LEU B 47 -0.157 -2.961 -4.202 1.00 0.00 C ATOM 693 C LEU B 47 0.865 -4.059 -4.478 1.00 0.00 C ATOM 694 O LEU B 47 0.796 -4.735 -5.505 1.00 0.00 O ATOM 695 CB LEU B 47 -1.585 -3.542 -4.194 1.00 0.00 C ATOM 696 CG LEU B 47 -2.130 -4.053 -2.844 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.240 -5.130 -2.244 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.310 -2.907 -1.862 1.00 0.00 C ATOM 0 H LEU B 47 -0.517 -2.181 -6.107 1.00 0.00 H new ATOM 0 HA LEU B 47 0.045 -2.524 -3.224 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.264 -2.774 -4.564 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.618 -4.367 -4.906 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.104 -4.501 -3.041 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.660 -5.462 -1.294 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.180 -5.975 -2.929 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.241 -4.726 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.695 -3.294 -0.918 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.350 -2.421 -1.690 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.015 -2.184 -2.272 1.00 0.00 H new ATOM 710 N ARG B 48 1.826 -4.200 -3.580 1.00 0.00 N ATOM 711 CA ARG B 48 2.826 -5.256 -3.682 1.00 0.00 C ATOM 712 C ARG B 48 2.643 -6.257 -2.552 1.00 0.00 C ATOM 713 O ARG B 48 2.492 -5.862 -1.398 1.00 0.00 O ATOM 714 CB ARG B 48 4.242 -4.674 -3.620 1.00 0.00 C ATOM 715 CG ARG B 48 4.662 -3.906 -4.852 1.00 0.00 C ATOM 716 CD ARG B 48 6.068 -3.356 -4.688 1.00 0.00 C ATOM 717 NE ARG B 48 6.513 -2.640 -5.876 1.00 0.00 N ATOM 718 CZ ARG B 48 7.544 -1.795 -5.900 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.216 -1.522 -4.788 1.00 0.00 N ATOM 720 NH2 ARG B 48 7.894 -1.217 -7.042 1.00 0.00 N ATOM 0 H ARG B 48 1.937 -3.594 -2.767 1.00 0.00 H new ATOM 0 HA ARG B 48 2.694 -5.757 -4.641 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.312 -4.014 -2.755 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.948 -5.488 -3.457 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.621 -4.558 -5.725 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.965 -3.088 -5.032 1.00 0.00 H new ATOM 0 HD2 ARG B 48 6.098 -2.687 -3.828 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.756 -4.175 -4.479 1.00 0.00 H new ATOM 0 HE ARG B 48 6.003 -2.795 -6.746 1.00 0.00 H new ATOM 0 HH11 ARG B 48 7.945 -1.960 -3.908 1.00 0.00 H new ATOM 0 HH12 ARG B 48 9.004 -0.875 -4.814 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.375 -1.420 -7.896 1.00 0.00 H new ATOM 0 HH22 ARG B 48 8.682 -0.570 -7.065 1.00 0.00 H new ATOM 734 N TRP B 49 2.648 -7.545 -2.876 1.00 0.00 N ATOM 735 CA TRP B 49 2.518 -8.571 -1.851 1.00 0.00 C ATOM 736 C TRP B 49 3.411 -9.773 -2.143 1.00 0.00 C ATOM 737 O TRP B 49 3.700 -10.083 -3.302 1.00 0.00 O ATOM 738 CB TRP B 49 1.055 -9.010 -1.693 1.00 0.00 C ATOM 739 CG TRP B 49 0.480 -9.727 -2.879 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.378 -11.079 -3.041 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.084 -9.139 -4.057 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.221 -11.366 -4.242 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.511 -10.193 -4.886 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.270 -7.825 -4.490 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.115 -9.969 -6.122 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.867 -7.606 -5.715 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.285 -8.672 -6.518 1.00 0.00 C ATOM 0 H TRP B 49 2.739 -7.900 -3.828 1.00 0.00 H new ATOM 0 HA TRP B 49 2.848 -8.132 -0.909 1.00 0.00 H new ATOM 0 HB2 TRP B 49 0.978 -9.660 -0.821 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.446 -8.129 -1.489 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.719 -11.815 -2.328 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.418 -12.302 -4.597 1.00 0.00 H new ATOM 0 HE3 TRP B 49 0.048 -6.994 -3.877 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.437 -10.791 -6.744 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.014 -6.593 -6.060 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.751 -8.466 -7.470 1.00 0.00 H new ATOM 758 N ARG B 50 3.854 -10.431 -1.076 1.00 0.00 N ATOM 759 CA ARG B 50 4.693 -11.622 -1.175 1.00 0.00 C ATOM 760 C ARG B 50 4.474 -12.505 0.049 1.00 0.00 C ATOM 761 O ARG B 50 4.044 -12.012 1.091 1.00 0.00 O ATOM 762 CB ARG B 50 6.176 -11.235 -1.248 1.00 0.00 C ATOM 763 CG ARG B 50 6.724 -10.684 0.051 1.00 0.00 C ATOM 764 CD ARG B 50 8.233 -10.572 0.003 1.00 0.00 C ATOM 765 NE ARG B 50 8.811 -10.591 1.339 1.00 0.00 N ATOM 766 CZ ARG B 50 10.014 -10.104 1.644 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.793 -9.600 0.695 1.00 0.00 N ATOM 768 NH2 ARG B 50 10.448 -10.143 2.897 1.00 0.00 N ATOM 0 H ARG B 50 3.642 -10.154 -0.118 1.00 0.00 H new ATOM 0 HA ARG B 50 4.419 -12.161 -2.082 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.758 -12.111 -1.535 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.310 -10.491 -2.034 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.290 -9.703 0.245 1.00 0.00 H new ATOM 0 HG3 ARG B 50 6.431 -11.332 0.877 1.00 0.00 H new ATOM 0 HD2 ARG B 50 8.642 -11.395 -0.583 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.515 -9.649 -0.504 1.00 0.00 H new ATOM 0 HE ARG B 50 8.259 -11.004 2.091 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.472 -9.584 -0.273 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.713 -9.229 0.934 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.861 -10.546 3.628 1.00 0.00 H new ATOM 0 HH22 ARG B 50 11.368 -9.770 3.130 1.00 0.00 H new ATOM 782 N PRO B 51 4.747 -13.818 -0.053 1.00 0.00 N ATOM 783 CA PRO B 51 4.707 -14.719 1.104 1.00 0.00 C ATOM 784 C PRO B 51 5.694 -14.276 2.185 1.00 0.00 C ATOM 785 O PRO B 51 6.904 -14.279 1.973 1.00 0.00 O ATOM 786 CB PRO B 51 5.106 -16.084 0.528 1.00 0.00 C ATOM 787 CG PRO B 51 5.745 -15.789 -0.788 1.00 0.00 C ATOM 788 CD PRO B 51 5.093 -14.534 -1.293 1.00 0.00 C ATOM 0 HA PRO B 51 3.728 -14.734 1.584 1.00 0.00 H new ATOM 0 HB2 PRO B 51 5.797 -16.604 1.192 1.00 0.00 H new ATOM 0 HB3 PRO B 51 4.235 -16.728 0.406 1.00 0.00 H new ATOM 0 HG2 PRO B 51 6.821 -15.652 -0.677 1.00 0.00 H new ATOM 0 HG3 PRO B 51 5.598 -16.613 -1.486 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.769 -13.952 -1.920 1.00 0.00 H new ATOM 0 HD3 PRO B 51 4.210 -14.752 -1.893 1.00 0.00 H new ATOM 796 N LYS B 52 5.160 -13.911 3.345 1.00 0.00 N ATOM 797 CA LYS B 52 5.947 -13.318 4.426 1.00 0.00 C ATOM 798 C LYS B 52 6.920 -14.335 5.021 1.00 0.00 C ATOM 799 O LYS B 52 7.979 -13.973 5.537 1.00 0.00 O ATOM 800 CB LYS B 52 4.987 -12.776 5.500 1.00 0.00 C ATOM 801 CG LYS B 52 5.634 -11.981 6.629 1.00 0.00 C ATOM 802 CD LYS B 52 6.093 -12.871 7.774 1.00 0.00 C ATOM 803 CE LYS B 52 6.672 -12.044 8.910 1.00 0.00 C ATOM 804 NZ LYS B 52 7.058 -12.882 10.074 1.00 0.00 N ATOM 0 H LYS B 52 4.170 -14.017 3.565 1.00 0.00 H new ATOM 0 HA LYS B 52 6.546 -12.498 4.029 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.247 -12.141 5.012 1.00 0.00 H new ATOM 0 HB3 LYS B 52 4.448 -13.617 5.936 1.00 0.00 H new ATOM 0 HG2 LYS B 52 6.488 -11.428 6.238 1.00 0.00 H new ATOM 0 HG3 LYS B 52 4.923 -11.246 7.006 1.00 0.00 H new ATOM 0 HD2 LYS B 52 5.252 -13.460 8.140 1.00 0.00 H new ATOM 0 HD3 LYS B 52 6.843 -13.575 7.414 1.00 0.00 H new ATOM 0 HE2 LYS B 52 7.545 -11.499 8.552 1.00 0.00 H new ATOM 0 HE3 LYS B 52 5.940 -11.301 9.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 7.448 -12.276 10.824 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.221 -13.383 10.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 7.776 -13.574 9.780 1.00 0.00 H new ATOM 818 N ASN B 53 6.565 -15.608 4.924 1.00 0.00 N ATOM 819 CA ASN B 53 7.384 -16.682 5.478 1.00 0.00 C ATOM 820 C ASN B 53 8.654 -16.903 4.655 1.00 0.00 C ATOM 821 O ASN B 53 9.563 -17.612 5.079 1.00 0.00 O ATOM 822 CB ASN B 53 6.571 -17.978 5.563 1.00 0.00 C ATOM 823 CG ASN B 53 5.937 -18.357 4.240 1.00 0.00 C ATOM 824 OD1 ASN B 53 4.836 -17.906 3.919 1.00 0.00 O ATOM 825 ND2 ASN B 53 6.610 -19.196 3.472 1.00 0.00 N ATOM 0 H ASN B 53 5.711 -15.926 4.465 1.00 0.00 H new ATOM 0 HA ASN B 53 7.688 -16.386 6.482 1.00 0.00 H new ATOM 0 HB2 ASN B 53 7.220 -18.788 5.896 1.00 0.00 H new ATOM 0 HB3 ASN B 53 5.791 -17.864 6.316 1.00 0.00 H new ATOM 0 HD21 ASN B 53 6.220 -19.493 2.577 1.00 0.00 H new ATOM 0 HD22 ASN B 53 7.519 -19.547 3.774 1.00 0.00 H new ATOM 832 N SER B 54 8.714 -16.289 3.483 1.00 0.00 N ATOM 833 CA SER B 54 9.885 -16.383 2.624 1.00 0.00 C ATOM 834 C SER B 54 10.177 -15.023 1.998 1.00 0.00 C ATOM 835 O SER B 54 9.645 -14.007 2.449 1.00 0.00 O ATOM 836 CB SER B 54 9.657 -17.433 1.535 1.00 0.00 C ATOM 837 OG SER B 54 9.360 -18.702 2.097 1.00 0.00 O ATOM 0 H SER B 54 7.960 -15.717 3.103 1.00 0.00 H new ATOM 0 HA SER B 54 10.743 -16.687 3.223 1.00 0.00 H new ATOM 0 HB2 SER B 54 8.838 -17.118 0.889 1.00 0.00 H new ATOM 0 HB3 SER B 54 10.546 -17.509 0.908 1.00 0.00 H new ATOM 0 HG SER B 54 9.217 -19.353 1.378 1.00 0.00 H new ATOM 843 N VAL B 55 11.035 -14.986 0.988 1.00 0.00 N ATOM 844 CA VAL B 55 11.239 -13.770 0.233 1.00 0.00 C ATOM 845 C VAL B 55 10.279 -13.736 -0.956 1.00 0.00 C ATOM 846 O VAL B 55 9.761 -12.681 -1.323 1.00 0.00 O ATOM 847 CB VAL B 55 12.703 -13.633 -0.242 1.00 0.00 C ATOM 848 CG1 VAL B 55 13.086 -14.748 -1.202 1.00 0.00 C ATOM 849 CG2 VAL B 55 12.926 -12.280 -0.879 1.00 0.00 C ATOM 0 H VAL B 55 11.595 -15.781 0.678 1.00 0.00 H new ATOM 0 HA VAL B 55 11.032 -12.923 0.887 1.00 0.00 H new ATOM 0 HB VAL B 55 13.347 -13.719 0.633 1.00 0.00 H new ATOM 0 HG11 VAL B 55 14.122 -14.619 -1.515 1.00 0.00 H new ATOM 0 HG12 VAL B 55 12.975 -15.711 -0.704 1.00 0.00 H new ATOM 0 HG13 VAL B 55 12.436 -14.714 -2.076 1.00 0.00 H new ATOM 0 HG21 VAL B 55 13.962 -12.199 -1.208 1.00 0.00 H new ATOM 0 HG22 VAL B 55 12.263 -12.168 -1.737 1.00 0.00 H new ATOM 0 HG23 VAL B 55 12.714 -11.496 -0.152 1.00 0.00 H new ATOM 859 N GLY B 56 10.037 -14.913 -1.537 1.00 0.00 N ATOM 860 CA GLY B 56 9.081 -15.048 -2.620 1.00 0.00 C ATOM 861 C GLY B 56 9.321 -14.075 -3.755 1.00 0.00 C ATOM 862 O GLY B 56 10.467 -13.764 -4.092 1.00 0.00 O ATOM 0 H GLY B 56 10.495 -15.784 -1.269 1.00 0.00 H new ATOM 0 HA2 GLY B 56 9.123 -16.066 -3.008 1.00 0.00 H new ATOM 0 HA3 GLY B 56 8.075 -14.898 -2.228 1.00 0.00 H new ATOM 866 N ARG B 57 8.235 -13.599 -4.343 1.00 0.00 N ATOM 867 CA ARG B 57 8.298 -12.628 -5.424 1.00 0.00 C ATOM 868 C ARG B 57 7.218 -11.574 -5.229 1.00 0.00 C ATOM 869 O ARG B 57 6.086 -11.903 -4.870 1.00 0.00 O ATOM 870 CB ARG B 57 8.108 -13.315 -6.775 1.00 0.00 C ATOM 871 CG ARG B 57 9.270 -14.204 -7.182 1.00 0.00 C ATOM 872 CD ARG B 57 8.959 -14.962 -8.458 1.00 0.00 C ATOM 873 NE ARG B 57 7.899 -15.954 -8.263 1.00 0.00 N ATOM 874 CZ ARG B 57 6.944 -16.219 -9.155 1.00 0.00 C ATOM 875 NH1 ARG B 57 6.874 -15.535 -10.292 1.00 0.00 N ATOM 876 NH2 ARG B 57 6.050 -17.165 -8.903 1.00 0.00 N ATOM 0 H ARG B 57 7.287 -13.874 -4.085 1.00 0.00 H new ATOM 0 HA ARG B 57 9.279 -12.153 -5.409 1.00 0.00 H new ATOM 0 HB2 ARG B 57 7.199 -13.915 -6.742 1.00 0.00 H new ATOM 0 HB3 ARG B 57 7.960 -12.554 -7.541 1.00 0.00 H new ATOM 0 HG2 ARG B 57 10.164 -13.596 -7.325 1.00 0.00 H new ATOM 0 HG3 ARG B 57 9.490 -14.910 -6.381 1.00 0.00 H new ATOM 0 HD2 ARG B 57 8.658 -14.258 -9.234 1.00 0.00 H new ATOM 0 HD3 ARG B 57 9.861 -15.460 -8.813 1.00 0.00 H new ATOM 0 HE ARG B 57 7.891 -16.477 -7.387 1.00 0.00 H new ATOM 0 HH11 ARG B 57 7.554 -14.801 -10.488 1.00 0.00 H new ATOM 0 HH12 ARG B 57 6.140 -15.744 -10.969 1.00 0.00 H new ATOM 0 HH21 ARG B 57 6.094 -17.688 -8.028 1.00 0.00 H new ATOM 0 HH22 ARG B 57 5.318 -17.370 -9.584 1.00 0.00 H new ATOM 890 N TRP B 58 7.563 -10.317 -5.459 1.00 0.00 N ATOM 891 CA TRP B 58 6.608 -9.226 -5.305 1.00 0.00 C ATOM 892 C TRP B 58 5.690 -9.130 -6.515 1.00 0.00 C ATOM 893 O TRP B 58 6.146 -8.874 -7.631 1.00 0.00 O ATOM 894 CB TRP B 58 7.325 -7.885 -5.118 1.00 0.00 C ATOM 895 CG TRP B 58 8.045 -7.742 -3.810 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.393 -7.788 -3.609 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.454 -7.514 -2.524 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.678 -7.598 -2.279 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.507 -7.429 -1.592 1.00 0.00 C ATOM 900 CE3 TRP B 58 6.141 -7.372 -2.069 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.284 -7.209 -0.235 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.922 -7.156 -0.720 1.00 0.00 C ATOM 903 CH2 TRP B 58 6.988 -7.075 0.182 1.00 0.00 C ATOM 0 H TRP B 58 8.495 -10.025 -5.753 1.00 0.00 H new ATOM 0 HA TRP B 58 6.015 -9.443 -4.417 1.00 0.00 H new ATOM 0 HB2 TRP B 58 8.042 -7.754 -5.929 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.594 -7.081 -5.206 1.00 0.00 H new ATOM 0 HD1 TRP B 58 10.129 -7.950 -4.383 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.612 -7.585 -1.869 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.311 -7.430 -2.758 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 9.105 -7.146 0.464 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.911 -7.048 -0.357 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.784 -6.903 1.229 1.00 0.00 H new ATOM 914 N LYS B 59 4.404 -9.353 -6.297 1.00 0.00 N ATOM 915 CA LYS B 59 3.409 -9.123 -7.334 1.00 0.00 C ATOM 916 C LYS B 59 2.936 -7.679 -7.252 1.00 0.00 C ATOM 917 O LYS B 59 2.720 -7.163 -6.155 1.00 0.00 O ATOM 918 CB LYS B 59 2.216 -10.068 -7.175 1.00 0.00 C ATOM 919 CG LYS B 59 2.563 -11.541 -7.314 1.00 0.00 C ATOM 920 CD LYS B 59 1.319 -12.411 -7.209 1.00 0.00 C ATOM 921 CE LYS B 59 1.647 -13.895 -7.288 1.00 0.00 C ATOM 922 NZ LYS B 59 2.436 -14.361 -6.117 1.00 0.00 N ATOM 0 H LYS B 59 4.024 -9.692 -5.413 1.00 0.00 H new ATOM 0 HA LYS B 59 3.863 -9.317 -8.306 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.765 -9.904 -6.196 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.463 -9.812 -7.920 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.051 -11.714 -8.273 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.275 -11.824 -6.539 1.00 0.00 H new ATOM 0 HD2 LYS B 59 0.810 -12.203 -6.268 1.00 0.00 H new ATOM 0 HD3 LYS B 59 0.627 -12.150 -8.010 1.00 0.00 H new ATOM 0 HE2 LYS B 59 0.721 -14.467 -7.350 1.00 0.00 H new ATOM 0 HE3 LYS B 59 2.206 -14.093 -8.202 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 2.491 -15.400 -6.126 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 3.396 -13.963 -6.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 1.974 -14.047 -5.240 1.00 0.00 H new ATOM 936 N GLU B 60 2.788 -7.024 -8.395 1.00 0.00 N ATOM 937 CA GLU B 60 2.398 -5.620 -8.409 1.00 0.00 C ATOM 938 C GLU B 60 1.033 -5.429 -9.055 1.00 0.00 C ATOM 939 O GLU B 60 0.810 -5.837 -10.197 1.00 0.00 O ATOM 940 CB GLU B 60 3.433 -4.775 -9.157 1.00 0.00 C ATOM 941 CG GLU B 60 4.842 -4.895 -8.605 1.00 0.00 C ATOM 942 CD GLU B 60 5.757 -3.804 -9.116 1.00 0.00 C ATOM 943 OE1 GLU B 60 5.791 -2.721 -8.499 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.451 -4.022 -10.130 1.00 0.00 O ATOM 0 H GLU B 60 2.930 -7.437 -9.317 1.00 0.00 H new ATOM 0 HA GLU B 60 2.344 -5.291 -7.371 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.438 -5.070 -10.206 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.128 -3.729 -9.122 1.00 0.00 H new ATOM 0 HG2 GLU B 60 4.807 -4.856 -7.516 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.254 -5.867 -8.876 1.00 0.00 H new ATOM 951 N ALA B 61 0.128 -4.808 -8.321 1.00 0.00 N ATOM 952 CA ALA B 61 -1.171 -4.441 -8.856 1.00 0.00 C ATOM 953 C ALA B 61 -1.312 -2.926 -8.873 1.00 0.00 C ATOM 954 O ALA B 61 -0.937 -2.254 -7.913 1.00 0.00 O ATOM 955 CB ALA B 61 -2.284 -5.072 -8.035 1.00 0.00 C ATOM 0 H ALA B 61 0.270 -4.546 -7.346 1.00 0.00 H new ATOM 0 HA ALA B 61 -1.250 -4.814 -9.877 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.250 -4.786 -8.451 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -2.185 -6.157 -8.061 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.216 -4.726 -7.004 1.00 0.00 H new ATOM 961 N THR B 62 -1.832 -2.390 -9.965 1.00 0.00 N ATOM 962 CA THR B 62 -1.991 -0.951 -10.103 1.00 0.00 C ATOM 963 C THR B 62 -3.444 -0.549 -9.875 1.00 0.00 C ATOM 964 O THR B 62 -4.337 -0.948 -10.626 1.00 0.00 O ATOM 965 CB THR B 62 -1.536 -0.476 -11.495 1.00 0.00 C ATOM 966 OG1 THR B 62 -0.268 -1.068 -11.810 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.410 1.040 -11.541 1.00 0.00 C ATOM 0 H THR B 62 -2.151 -2.930 -10.769 1.00 0.00 H new ATOM 0 HA THR B 62 -1.365 -0.474 -9.349 1.00 0.00 H new ATOM 0 HB THR B 62 -2.285 -0.783 -12.225 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.022 -0.768 -12.697 1.00 0.00 H new ATOM 0 HG21 THR B 62 -1.087 1.348 -12.535 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.376 1.492 -11.317 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.676 1.367 -10.804 1.00 0.00 H new ATOM 975 N ILE B 63 -3.672 0.234 -8.834 1.00 0.00 N ATOM 976 CA ILE B 63 -5.011 0.680 -8.482 1.00 0.00 C ATOM 977 C ILE B 63 -5.153 2.170 -8.766 1.00 0.00 C ATOM 978 O ILE B 63 -4.343 2.969 -8.304 1.00 0.00 O ATOM 979 CB ILE B 63 -5.331 0.431 -6.983 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.232 -1.054 -6.626 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.718 0.954 -6.631 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.825 -1.534 -6.345 1.00 0.00 C ATOM 0 H ILE B 63 -2.940 0.577 -8.212 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.711 0.104 -9.087 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.587 0.974 -6.400 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -5.851 -1.247 -5.750 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.647 -1.641 -7.445 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -6.920 0.768 -5.576 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.763 2.025 -6.826 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.465 0.443 -7.239 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.845 -2.596 -6.101 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.204 -1.376 -7.227 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.411 -0.976 -5.505 1.00 0.00 H new ATOM 994 N PRO B 64 -6.170 2.558 -9.552 1.00 0.00 N ATOM 995 CA PRO B 64 -6.478 3.968 -9.802 1.00 0.00 C ATOM 996 C PRO B 64 -6.614 4.754 -8.501 1.00 0.00 C ATOM 997 O PRO B 64 -7.231 4.276 -7.540 1.00 0.00 O ATOM 998 CB PRO B 64 -7.816 3.914 -10.540 1.00 0.00 C ATOM 999 CG PRO B 64 -7.833 2.578 -11.194 1.00 0.00 C ATOM 1000 CD PRO B 64 -7.084 1.655 -10.273 1.00 0.00 C ATOM 0 HA PRO B 64 -5.692 4.471 -10.365 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.653 4.028 -9.851 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.896 4.715 -11.274 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.855 2.232 -11.347 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -7.360 2.618 -12.175 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.757 1.136 -9.590 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.539 0.890 -10.827 1.00 0.00 H new ATOM 1008 N GLY B 65 -6.056 5.959 -8.483 1.00 0.00 N ATOM 1009 CA GLY B 65 -6.001 6.757 -7.268 1.00 0.00 C ATOM 1010 C GLY B 65 -7.336 7.370 -6.884 1.00 0.00 C ATOM 1011 O GLY B 65 -7.424 8.565 -6.614 1.00 0.00 O ATOM 0 H GLY B 65 -5.635 6.404 -9.299 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.648 6.132 -6.448 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -5.269 7.554 -7.399 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.373 6.547 -6.860 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.700 6.988 -6.452 1.00 0.00 C ATOM 1017 C HIS B 66 -10.574 5.803 -6.039 1.00 0.00 C ATOM 1018 O HIS B 66 -11.760 5.968 -5.768 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.380 7.801 -7.568 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.395 7.136 -8.915 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.647 7.584 -9.985 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -11.083 6.062 -9.368 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -9.874 6.816 -11.032 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.740 5.884 -10.685 1.00 0.00 N ATOM 0 H HIS B 66 -8.321 5.562 -7.120 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.579 7.636 -5.584 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -11.408 8.010 -7.271 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.873 8.761 -7.659 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.774 5.457 -8.799 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -9.427 6.931 -12.008 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -11.097 5.150 -11.296 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.986 4.610 -5.988 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.729 3.422 -5.571 1.00 0.00 C ATOM 1035 C LEU B 67 -10.523 3.155 -4.087 1.00 0.00 C ATOM 1036 O LEU B 67 -11.475 2.914 -3.345 1.00 0.00 O ATOM 1037 CB LEU B 67 -10.306 2.185 -6.371 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.513 2.268 -7.884 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.179 0.936 -8.532 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.938 2.679 -8.216 1.00 0.00 C ATOM 0 H LEU B 67 -9.009 4.440 -6.227 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.784 3.617 -5.764 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -9.250 1.994 -6.178 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.860 1.325 -5.994 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.842 3.030 -8.281 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.330 1.007 -9.609 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.139 0.683 -8.328 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.828 0.161 -8.125 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -12.059 2.731 -9.298 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.633 1.945 -7.808 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -12.146 3.656 -7.781 1.00 0.00 H new ATOM 1052 N ASN B 68 -9.252 3.182 -3.680 1.00 0.00 N ATOM 1053 CA ASN B 68 -8.860 3.058 -2.273 1.00 0.00 C ATOM 1054 C ASN B 68 -9.258 1.709 -1.682 1.00 0.00 C ATOM 1055 O ASN B 68 -9.390 1.559 -0.466 1.00 0.00 O ATOM 1056 CB ASN B 68 -9.443 4.210 -1.451 1.00 0.00 C ATOM 1057 CG ASN B 68 -8.824 5.540 -1.827 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -9.306 6.236 -2.722 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -7.746 5.900 -1.151 1.00 0.00 N ATOM 0 H ASN B 68 -8.463 3.291 -4.318 1.00 0.00 H new ATOM 0 HA ASN B 68 -7.772 3.114 -2.231 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -10.521 4.255 -1.603 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -9.278 4.019 -0.391 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -7.282 6.783 -1.364 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -7.379 5.295 -0.417 1.00 0.00 H new ATOM 1066 N SER B 69 -9.427 0.733 -2.560 1.00 0.00 N ATOM 1067 CA SER B 69 -9.733 -0.633 -2.172 1.00 0.00 C ATOM 1068 C SER B 69 -9.482 -1.558 -3.356 1.00 0.00 C ATOM 1069 O SER B 69 -9.734 -1.178 -4.502 1.00 0.00 O ATOM 1070 CB SER B 69 -11.184 -0.735 -1.694 1.00 0.00 C ATOM 1071 OG SER B 69 -12.058 -0.041 -2.570 1.00 0.00 O ATOM 0 H SER B 69 -9.355 0.868 -3.568 1.00 0.00 H new ATOM 0 HA SER B 69 -9.088 -0.933 -1.346 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.479 -1.783 -1.636 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.269 -0.323 -0.688 1.00 0.00 H new ATOM 0 HG SER B 69 -12.979 -0.122 -2.245 1.00 0.00 H new ATOM 1077 N TYR B 70 -8.963 -2.749 -3.096 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.628 -3.672 -4.171 1.00 0.00 C ATOM 1079 C TYR B 70 -8.875 -5.115 -3.751 1.00 0.00 C ATOM 1080 O TYR B 70 -8.641 -5.485 -2.601 1.00 0.00 O ATOM 1081 CB TYR B 70 -7.163 -3.488 -4.579 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.762 -4.277 -5.807 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.942 -5.390 -5.704 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -7.202 -3.900 -7.070 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.569 -6.108 -6.825 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.836 -4.612 -8.194 1.00 0.00 C ATOM 1087 CZ TYR B 70 -6.018 -5.714 -8.067 1.00 0.00 C ATOM 1088 OH TYR B 70 -5.645 -6.421 -9.186 1.00 0.00 O ATOM 0 H TYR B 70 -8.766 -3.097 -2.158 1.00 0.00 H new ATOM 0 HA TYR B 70 -9.271 -3.452 -5.023 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.978 -2.430 -4.763 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.525 -3.783 -3.746 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -5.589 -5.701 -4.732 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.841 -3.035 -7.174 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.929 -6.973 -6.728 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -7.189 -4.307 -9.168 1.00 0.00 H new ATOM 0 HH TYR B 70 -6.048 -6.013 -9.980 1.00 0.00 H new ATOM 1098 N THR B 71 -9.357 -5.921 -4.686 1.00 0.00 N ATOM 1099 CA THR B 71 -9.539 -7.339 -4.447 1.00 0.00 C ATOM 1100 C THR B 71 -8.326 -8.115 -4.956 1.00 0.00 C ATOM 1101 O THR B 71 -8.198 -8.374 -6.155 1.00 0.00 O ATOM 1102 CB THR B 71 -10.811 -7.866 -5.139 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.925 -7.029 -4.805 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.109 -9.298 -4.716 1.00 0.00 C ATOM 0 H THR B 71 -9.629 -5.612 -5.619 1.00 0.00 H new ATOM 0 HA THR B 71 -9.646 -7.484 -3.372 1.00 0.00 H new ATOM 0 HB THR B 71 -10.645 -7.850 -6.216 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.732 -7.366 -5.248 1.00 0.00 H new ATOM 0 HG21 THR B 71 -12.012 -9.646 -5.219 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.271 -9.940 -4.989 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.258 -9.335 -3.637 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.429 -8.466 -4.046 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.232 -9.211 -4.410 1.00 0.00 C ATOM 1114 C ILE B 72 -6.580 -10.676 -4.626 1.00 0.00 C ATOM 1115 O ILE B 72 -6.934 -11.379 -3.681 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.139 -9.117 -3.326 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.881 -7.659 -2.934 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -3.856 -9.769 -3.821 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.867 -7.506 -1.820 1.00 0.00 C ATOM 0 H ILE B 72 -7.507 -8.248 -3.053 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.845 -8.769 -5.328 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.486 -9.648 -2.440 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.533 -7.111 -3.810 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.821 -7.202 -2.625 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.090 -9.698 -3.049 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.045 -10.818 -4.048 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.512 -9.259 -4.721 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.733 -6.448 -1.593 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.223 -8.026 -0.930 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.915 -7.934 -2.134 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.488 -11.128 -5.864 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.834 -12.498 -6.198 1.00 0.00 C ATOM 1133 C LYS B 73 -5.573 -13.321 -6.418 1.00 0.00 C ATOM 1134 O LYS B 73 -4.755 -13.006 -7.281 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.727 -12.531 -7.442 1.00 0.00 C ATOM 1136 CG LYS B 73 -9.016 -11.740 -7.273 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.919 -11.855 -8.488 1.00 0.00 C ATOM 1138 CE LYS B 73 -11.205 -11.066 -8.293 1.00 0.00 C ATOM 1139 NZ LYS B 73 -12.139 -11.222 -9.437 1.00 0.00 N ATOM 0 H LYS B 73 -6.176 -10.565 -6.656 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.388 -12.934 -5.367 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -7.172 -12.132 -8.291 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.972 -13.566 -7.679 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.548 -12.098 -6.391 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.777 -10.691 -7.097 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -9.394 -11.489 -9.370 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -10.156 -12.903 -8.670 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.696 -11.396 -7.378 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -10.965 -10.011 -8.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -13.001 -10.667 -9.260 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -11.682 -10.883 -10.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -12.390 -12.225 -9.546 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.420 -14.375 -5.632 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.226 -15.191 -5.712 1.00 0.00 C ATOM 1155 C GLY B 74 -3.564 -15.360 -4.360 1.00 0.00 C ATOM 1156 O GLY B 74 -2.387 -15.712 -4.274 1.00 0.00 O ATOM 0 H GLY B 74 -6.103 -14.681 -4.938 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.482 -16.171 -6.115 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.521 -14.735 -6.407 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.323 -15.111 -3.304 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.813 -15.225 -1.947 1.00 0.00 C ATOM 1162 C LEU B 75 -4.279 -16.528 -1.323 1.00 0.00 C ATOM 1163 O LEU B 75 -5.462 -16.850 -1.360 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.295 -14.048 -1.101 1.00 0.00 C ATOM 1165 CG LEU B 75 -3.822 -12.672 -1.567 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.475 -11.587 -0.737 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.307 -12.570 -1.479 1.00 0.00 C ATOM 0 H LEU B 75 -5.301 -14.827 -3.362 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.724 -15.214 -1.982 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.385 -14.054 -1.087 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -3.963 -14.200 -0.074 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.114 -12.538 -2.609 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.130 -10.611 -1.078 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.558 -11.648 -0.846 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.208 -11.720 0.311 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -1.989 -11.583 -1.815 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -1.992 -12.721 -0.447 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -1.854 -13.333 -2.112 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.350 -17.278 -0.760 1.00 0.00 N ATOM 1180 CA LYS B 76 -3.675 -18.562 -0.164 1.00 0.00 C ATOM 1181 C LYS B 76 -4.081 -18.386 1.299 1.00 0.00 C ATOM 1182 O LYS B 76 -3.309 -17.866 2.107 1.00 0.00 O ATOM 1183 CB LYS B 76 -2.467 -19.492 -0.274 1.00 0.00 C ATOM 1184 CG LYS B 76 -1.932 -19.606 -1.692 1.00 0.00 C ATOM 1185 CD LYS B 76 -0.640 -20.400 -1.739 1.00 0.00 C ATOM 1186 CE LYS B 76 -0.003 -20.347 -3.119 1.00 0.00 C ATOM 1187 NZ LYS B 76 -0.888 -20.910 -4.172 1.00 0.00 N ATOM 0 H LYS B 76 -2.365 -17.021 -0.702 1.00 0.00 H new ATOM 0 HA LYS B 76 -4.517 -19.002 -0.698 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -1.674 -19.127 0.379 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -2.745 -20.483 0.084 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -2.678 -20.086 -2.326 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -1.762 -18.609 -2.099 1.00 0.00 H new ATOM 0 HD2 LYS B 76 0.057 -20.006 -1.000 1.00 0.00 H new ATOM 0 HD3 LYS B 76 -0.839 -21.437 -1.469 1.00 0.00 H new ATOM 0 HE2 LYS B 76 0.239 -19.313 -3.365 1.00 0.00 H new ATOM 0 HE3 LYS B 76 0.937 -20.899 -3.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 -0.379 -20.930 -5.079 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -1.167 -21.877 -3.910 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 -1.738 -20.317 -4.265 1.00 0.00 H new ATOM 1201 N PRO B 77 -5.305 -18.811 1.655 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.815 -18.710 3.027 1.00 0.00 C ATOM 1203 C PRO B 77 -4.949 -19.468 4.027 1.00 0.00 C ATOM 1204 O PRO B 77 -4.725 -20.674 3.888 1.00 0.00 O ATOM 1205 CB PRO B 77 -7.210 -19.340 2.950 1.00 0.00 C ATOM 1206 CG PRO B 77 -7.585 -19.267 1.511 1.00 0.00 C ATOM 1207 CD PRO B 77 -6.302 -19.401 0.744 1.00 0.00 C ATOM 0 HA PRO B 77 -5.821 -17.677 3.375 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -7.198 -20.371 3.303 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.923 -18.799 3.572 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -8.282 -20.063 1.248 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -8.079 -18.322 1.284 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -6.075 -20.443 0.518 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.343 -18.870 -0.207 1.00 0.00 H new ATOM 1215 N GLY B 78 -4.453 -18.751 5.026 1.00 0.00 N ATOM 1216 CA GLY B 78 -3.630 -19.368 6.045 1.00 0.00 C ATOM 1217 C GLY B 78 -2.162 -19.043 5.866 1.00 0.00 C ATOM 1218 O GLY B 78 -1.350 -19.282 6.762 1.00 0.00 O ATOM 0 H GLY B 78 -4.607 -17.750 5.148 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -3.958 -19.031 7.028 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -3.768 -20.449 6.016 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.822 -18.500 4.710 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.452 -18.110 4.421 1.00 0.00 C ATOM 1224 C VAL B 79 -0.250 -16.639 4.759 1.00 0.00 C ATOM 1225 O VAL B 79 -1.050 -15.789 4.369 1.00 0.00 O ATOM 1226 CB VAL B 79 -0.102 -18.356 2.936 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.320 -17.925 2.624 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.288 -19.817 2.573 1.00 0.00 C ATOM 0 H VAL B 79 -2.480 -18.318 3.952 1.00 0.00 H new ATOM 0 HA VAL B 79 0.210 -18.721 5.034 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.784 -17.752 2.337 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.534 -18.112 1.572 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.432 -16.861 2.834 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.016 -18.492 3.242 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -0.036 -19.966 1.523 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.364 -20.432 3.194 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.326 -20.104 2.741 1.00 0.00 H new ATOM 1238 N VAL B 80 0.794 -16.349 5.519 1.00 0.00 N ATOM 1239 CA VAL B 80 1.112 -14.976 5.877 1.00 0.00 C ATOM 1240 C VAL B 80 1.770 -14.256 4.701 1.00 0.00 C ATOM 1241 O VAL B 80 2.702 -14.772 4.081 1.00 0.00 O ATOM 1242 CB VAL B 80 2.024 -14.912 7.130 1.00 0.00 C ATOM 1243 CG1 VAL B 80 3.323 -15.674 6.910 1.00 0.00 C ATOM 1244 CG2 VAL B 80 2.298 -13.469 7.533 1.00 0.00 C ATOM 0 H VAL B 80 1.435 -17.045 5.900 1.00 0.00 H new ATOM 0 HA VAL B 80 0.177 -14.471 6.120 1.00 0.00 H new ATOM 0 HB VAL B 80 1.493 -15.395 7.950 1.00 0.00 H new ATOM 0 HG11 VAL B 80 3.939 -15.609 7.807 1.00 0.00 H new ATOM 0 HG12 VAL B 80 3.100 -16.720 6.698 1.00 0.00 H new ATOM 0 HG13 VAL B 80 3.862 -15.240 6.068 1.00 0.00 H new ATOM 0 HG21 VAL B 80 2.940 -13.453 8.414 1.00 0.00 H new ATOM 0 HG22 VAL B 80 2.794 -12.950 6.713 1.00 0.00 H new ATOM 0 HG23 VAL B 80 1.356 -12.970 7.761 1.00 0.00 H new ATOM 1254 N TYR B 81 1.266 -13.074 4.380 1.00 0.00 N ATOM 1255 CA TYR B 81 1.810 -12.287 3.285 1.00 0.00 C ATOM 1256 C TYR B 81 2.258 -10.910 3.761 1.00 0.00 C ATOM 1257 O TYR B 81 1.749 -10.383 4.754 1.00 0.00 O ATOM 1258 CB TYR B 81 0.774 -12.115 2.172 1.00 0.00 C ATOM 1259 CG TYR B 81 0.452 -13.375 1.399 1.00 0.00 C ATOM 1260 CD1 TYR B 81 -0.667 -14.139 1.706 1.00 0.00 C ATOM 1261 CD2 TYR B 81 1.258 -13.791 0.347 1.00 0.00 C ATOM 1262 CE1 TYR B 81 -0.971 -15.280 0.988 1.00 0.00 C ATOM 1263 CE2 TYR B 81 0.962 -14.929 -0.374 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.153 -15.670 -0.051 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.454 -16.804 -0.771 1.00 0.00 O ATOM 0 H TYR B 81 0.480 -12.639 4.863 1.00 0.00 H new ATOM 0 HA TYR B 81 2.674 -12.828 2.899 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.147 -11.730 2.610 1.00 0.00 H new ATOM 0 HB3 TYR B 81 1.135 -11.360 1.473 1.00 0.00 H new ATOM 0 HD1 TYR B 81 -1.310 -13.836 2.519 1.00 0.00 H new ATOM 0 HD2 TYR B 81 2.133 -13.213 0.089 1.00 0.00 H new ATOM 0 HE1 TYR B 81 -1.845 -15.863 1.239 1.00 0.00 H new ATOM 0 HE2 TYR B 81 1.601 -15.237 -1.188 1.00 0.00 H new ATOM 0 HH TYR B 81 0.221 -16.938 -1.468 1.00 0.00 H new ATOM 1275 N GLU B 82 3.205 -10.345 3.028 1.00 0.00 N ATOM 1276 CA GLU B 82 3.676 -8.986 3.251 1.00 0.00 C ATOM 1277 C GLU B 82 3.069 -8.074 2.202 1.00 0.00 C ATOM 1278 O GLU B 82 3.210 -8.329 1.008 1.00 0.00 O ATOM 1279 CB GLU B 82 5.202 -8.924 3.145 1.00 0.00 C ATOM 1280 CG GLU B 82 5.934 -9.392 4.388 1.00 0.00 C ATOM 1281 CD GLU B 82 5.885 -8.373 5.505 1.00 0.00 C ATOM 1282 OE1 GLU B 82 6.740 -7.459 5.518 1.00 0.00 O ATOM 1283 OE2 GLU B 82 5.004 -8.473 6.378 1.00 0.00 O ATOM 0 H GLU B 82 3.672 -10.820 2.256 1.00 0.00 H new ATOM 0 HA GLU B 82 3.378 -8.667 4.250 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.521 -9.533 2.299 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.498 -7.898 2.928 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.495 -10.328 4.734 1.00 0.00 H new ATOM 0 HG3 GLU B 82 6.974 -9.602 4.137 1.00 0.00 H new ATOM 1290 N GLY B 83 2.394 -7.028 2.641 1.00 0.00 N ATOM 1291 CA GLY B 83 1.744 -6.133 1.712 1.00 0.00 C ATOM 1292 C GLY B 83 2.289 -4.726 1.795 1.00 0.00 C ATOM 1293 O GLY B 83 2.643 -4.254 2.875 1.00 0.00 O ATOM 0 H GLY B 83 2.284 -6.782 3.625 1.00 0.00 H new ATOM 0 HA2 GLY B 83 1.872 -6.510 0.697 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.673 -6.118 1.914 1.00 0.00 H new ATOM 1297 N GLN B 84 2.373 -4.062 0.656 1.00 0.00 N ATOM 1298 CA GLN B 84 2.823 -2.681 0.607 1.00 0.00 C ATOM 1299 C GLN B 84 1.882 -1.855 -0.254 1.00 0.00 C ATOM 1300 O GLN B 84 1.632 -2.195 -1.412 1.00 0.00 O ATOM 1301 CB GLN B 84 4.240 -2.585 0.038 1.00 0.00 C ATOM 1302 CG GLN B 84 5.262 -3.441 0.767 1.00 0.00 C ATOM 1303 CD GLN B 84 6.654 -3.274 0.195 1.00 0.00 C ATOM 1304 OE1 GLN B 84 7.437 -2.446 0.655 1.00 0.00 O ATOM 1305 NE2 GLN B 84 6.958 -4.041 -0.837 1.00 0.00 N ATOM 0 H GLN B 84 2.134 -4.459 -0.253 1.00 0.00 H new ATOM 0 HA GLN B 84 2.826 -2.294 1.626 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.219 -2.879 -1.012 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.563 -1.545 0.072 1.00 0.00 H new ATOM 0 HG2 GLN B 84 5.270 -3.175 1.824 1.00 0.00 H new ATOM 0 HG3 GLN B 84 4.968 -4.489 0.705 1.00 0.00 H new ATOM 0 HE21 GLN B 84 6.279 -4.716 -1.188 1.00 0.00 H new ATOM 0 HE22 GLN B 84 7.872 -3.958 -1.282 1.00 0.00 H new ATOM 1314 N LEU B 85 1.349 -0.788 0.319 1.00 0.00 N ATOM 1315 CA LEU B 85 0.513 0.140 -0.423 1.00 0.00 C ATOM 1316 C LEU B 85 1.333 1.374 -0.765 1.00 0.00 C ATOM 1317 O LEU B 85 1.672 2.167 0.112 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.735 0.516 0.398 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.845 1.282 -0.347 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.461 2.735 -0.595 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -2.171 0.599 -1.665 1.00 0.00 C ATOM 0 H LEU B 85 1.482 -0.543 1.300 1.00 0.00 H new ATOM 0 HA LEU B 85 0.170 -0.329 -1.345 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.166 -0.400 0.802 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.415 1.120 1.247 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.729 1.273 0.290 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.270 3.240 -1.122 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.283 3.232 0.359 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.554 2.774 -1.199 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.957 1.154 -2.178 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -1.279 0.571 -2.291 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.511 -0.419 -1.473 1.00 0.00 H new ATOM 1333 N ILE B 86 1.668 1.519 -2.033 1.00 0.00 N ATOM 1334 CA ILE B 86 2.479 2.636 -2.481 1.00 0.00 C ATOM 1335 C ILE B 86 1.602 3.703 -3.118 1.00 0.00 C ATOM 1336 O ILE B 86 1.090 3.519 -4.224 1.00 0.00 O ATOM 1337 CB ILE B 86 3.536 2.169 -3.498 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.214 0.895 -2.991 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.570 3.265 -3.733 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.960 0.136 -4.062 1.00 0.00 C ATOM 0 H ILE B 86 1.390 0.875 -2.774 1.00 0.00 H new ATOM 0 HA ILE B 86 2.985 3.055 -1.611 1.00 0.00 H new ATOM 0 HB ILE B 86 3.044 1.955 -4.447 1.00 0.00 H new ATOM 0 HG12 ILE B 86 4.909 1.157 -2.193 1.00 0.00 H new ATOM 0 HG13 ILE B 86 3.459 0.241 -2.554 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.310 2.918 -4.454 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.075 4.155 -4.120 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.065 3.506 -2.792 1.00 0.00 H new ATOM 0 HD11 ILE B 86 5.414 -0.755 -3.628 1.00 0.00 H new ATOM 0 HD12 ILE B 86 4.266 -0.158 -4.850 1.00 0.00 H new ATOM 0 HD13 ILE B 86 5.739 0.772 -4.483 1.00 0.00 H new ATOM 1352 N SER B 87 1.409 4.804 -2.413 1.00 0.00 N ATOM 1353 CA SER B 87 0.601 5.897 -2.919 1.00 0.00 C ATOM 1354 C SER B 87 1.449 6.857 -3.748 1.00 0.00 C ATOM 1355 O SER B 87 2.351 7.518 -3.231 1.00 0.00 O ATOM 1356 CB SER B 87 -0.079 6.628 -1.759 1.00 0.00 C ATOM 1357 OG SER B 87 0.821 6.832 -0.683 1.00 0.00 O ATOM 0 H SER B 87 1.803 4.964 -1.486 1.00 0.00 H new ATOM 0 HA SER B 87 -0.172 5.489 -3.570 1.00 0.00 H new ATOM 0 HB2 SER B 87 -0.460 7.589 -2.105 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.937 6.050 -1.415 1.00 0.00 H new ATOM 0 HG SER B 87 0.361 7.302 0.044 1.00 0.00 H new ATOM 1363 N ILE B 88 1.170 6.900 -5.043 1.00 0.00 N ATOM 1364 CA ILE B 88 1.879 7.784 -5.955 1.00 0.00 C ATOM 1365 C ILE B 88 1.102 9.082 -6.126 1.00 0.00 C ATOM 1366 O ILE B 88 -0.003 9.076 -6.671 1.00 0.00 O ATOM 1367 CB ILE B 88 2.056 7.135 -7.348 1.00 0.00 C ATOM 1368 CG1 ILE B 88 2.640 5.723 -7.225 1.00 0.00 C ATOM 1369 CG2 ILE B 88 2.937 8.006 -8.235 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.012 5.671 -6.589 1.00 0.00 C ATOM 0 H ILE B 88 0.452 6.328 -5.488 1.00 0.00 H new ATOM 0 HA ILE B 88 2.862 7.978 -5.526 1.00 0.00 H new ATOM 0 HB ILE B 88 1.073 7.053 -7.812 1.00 0.00 H new ATOM 0 HG12 ILE B 88 1.957 5.109 -6.638 1.00 0.00 H new ATOM 0 HG13 ILE B 88 2.695 5.277 -8.218 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.051 7.534 -9.211 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.475 8.985 -8.357 1.00 0.00 H new ATOM 0 HG23 ILE B 88 3.917 8.123 -7.772 1.00 0.00 H new ATOM 0 HD11 ILE B 88 4.351 4.636 -6.540 1.00 0.00 H new ATOM 0 HD12 ILE B 88 4.712 6.255 -7.186 1.00 0.00 H new ATOM 0 HD13 ILE B 88 3.962 6.084 -5.582 1.00 0.00 H new ATOM 1382 N GLN B 89 1.655 10.184 -5.650 1.00 0.00 N ATOM 1383 CA GLN B 89 0.977 11.464 -5.766 1.00 0.00 C ATOM 1384 C GLN B 89 1.529 12.307 -6.905 1.00 0.00 C ATOM 1385 O GLN B 89 2.636 12.060 -7.382 1.00 0.00 O ATOM 1386 CB GLN B 89 1.036 12.235 -4.448 1.00 0.00 C ATOM 1387 CG GLN B 89 0.108 11.664 -3.389 1.00 0.00 C ATOM 1388 CD GLN B 89 0.026 12.507 -2.131 1.00 0.00 C ATOM 1389 OE1 GLN B 89 -1.017 12.560 -1.482 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.118 13.163 -1.771 1.00 0.00 N ATOM 0 H GLN B 89 2.562 10.220 -5.184 1.00 0.00 H new ATOM 0 HA GLN B 89 -0.066 11.250 -5.998 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.059 12.224 -4.072 1.00 0.00 H new ATOM 0 HB3 GLN B 89 0.774 13.277 -4.630 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.891 11.560 -3.812 1.00 0.00 H new ATOM 0 HG3 GLN B 89 0.447 10.663 -3.123 1.00 0.00 H new ATOM 0 HE21 GLN B 89 1.964 13.094 -2.336 1.00 0.00 H new ATOM 0 HE22 GLN B 89 1.113 13.738 -0.928 1.00 0.00 H new ATOM 1399 N GLN B 90 0.746 13.293 -7.324 1.00 0.00 N ATOM 1400 CA GLN B 90 1.036 14.106 -8.507 1.00 0.00 C ATOM 1401 C GLN B 90 2.485 14.601 -8.547 1.00 0.00 C ATOM 1402 O GLN B 90 3.149 14.527 -9.588 1.00 0.00 O ATOM 1403 CB GLN B 90 0.068 15.290 -8.537 1.00 0.00 C ATOM 1404 CG GLN B 90 0.087 16.081 -9.832 1.00 0.00 C ATOM 1405 CD GLN B 90 -1.020 17.115 -9.885 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -2.132 16.824 -10.321 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -0.724 18.329 -9.454 1.00 0.00 N ATOM 0 H GLN B 90 -0.118 13.557 -6.850 1.00 0.00 H new ATOM 0 HA GLN B 90 0.903 13.479 -9.389 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.943 14.922 -8.365 1.00 0.00 H new ATOM 0 HB3 GLN B 90 0.307 15.961 -7.712 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.051 16.577 -9.939 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -0.015 15.398 -10.675 1.00 0.00 H new ATOM 0 HE21 GLN B 90 0.211 18.530 -9.099 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -1.431 19.064 -9.476 1.00 0.00 H new ATOM 1416 N TYR B 91 2.983 15.070 -7.409 1.00 0.00 N ATOM 1417 CA TYR B 91 4.320 15.659 -7.333 1.00 0.00 C ATOM 1418 C TYR B 91 5.415 14.594 -7.256 1.00 0.00 C ATOM 1419 O TYR B 91 6.557 14.892 -6.906 1.00 0.00 O ATOM 1420 CB TYR B 91 4.412 16.597 -6.126 1.00 0.00 C ATOM 1421 CG TYR B 91 3.611 17.871 -6.285 1.00 0.00 C ATOM 1422 CD1 TYR B 91 4.247 19.082 -6.526 1.00 0.00 C ATOM 1423 CD2 TYR B 91 2.224 17.864 -6.200 1.00 0.00 C ATOM 1424 CE1 TYR B 91 3.524 20.249 -6.677 1.00 0.00 C ATOM 1425 CE2 TYR B 91 1.495 19.029 -6.350 1.00 0.00 C ATOM 1426 CZ TYR B 91 2.150 20.217 -6.589 1.00 0.00 C ATOM 1427 OH TYR B 91 1.430 21.381 -6.742 1.00 0.00 O ATOM 0 H TYR B 91 2.481 15.055 -6.521 1.00 0.00 H new ATOM 0 HA TYR B 91 4.481 16.226 -8.250 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.065 16.068 -5.238 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.457 16.854 -5.955 1.00 0.00 H new ATOM 0 HD1 TYR B 91 5.324 19.112 -6.596 1.00 0.00 H new ATOM 0 HD2 TYR B 91 1.708 16.934 -6.014 1.00 0.00 H new ATOM 0 HE1 TYR B 91 4.034 21.183 -6.863 1.00 0.00 H new ATOM 0 HE2 TYR B 91 0.417 19.008 -6.280 1.00 0.00 H new ATOM 0 HH TYR B 91 0.473 21.188 -6.653 1.00 0.00 H new ATOM 1437 N GLY B 92 5.071 13.356 -7.582 1.00 0.00 N ATOM 1438 CA GLY B 92 6.048 12.285 -7.570 1.00 0.00 C ATOM 1439 C GLY B 92 6.371 11.825 -6.169 1.00 0.00 C ATOM 1440 O GLY B 92 7.410 11.210 -5.927 1.00 0.00 O ATOM 0 H GLY B 92 4.130 13.073 -7.855 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.669 11.443 -8.149 1.00 0.00 H new ATOM 0 HA3 GLY B 92 6.961 12.623 -8.060 1.00 0.00 H new ATOM 1444 N HIS B 93 5.485 12.142 -5.242 1.00 0.00 N ATOM 1445 CA HIS B 93 5.657 11.749 -3.857 1.00 0.00 C ATOM 1446 C HIS B 93 5.144 10.331 -3.681 1.00 0.00 C ATOM 1447 O HIS B 93 3.976 10.057 -3.952 1.00 0.00 O ATOM 1448 CB HIS B 93 4.887 12.704 -2.948 1.00 0.00 C ATOM 1449 CG HIS B 93 5.572 12.997 -1.648 1.00 0.00 C ATOM 1450 ND1 HIS B 93 5.149 12.502 -0.438 1.00 0.00 N ATOM 1451 CD2 HIS B 93 6.641 13.781 -1.376 1.00 0.00 C ATOM 1452 CE1 HIS B 93 5.921 12.974 0.520 1.00 0.00 C ATOM 1453 NE2 HIS B 93 6.836 13.751 -0.019 1.00 0.00 N ATOM 0 H HIS B 93 4.634 12.674 -5.426 1.00 0.00 H new ATOM 0 HA HIS B 93 6.713 11.790 -3.589 1.00 0.00 H new ATOM 0 HB2 HIS B 93 4.723 13.641 -3.479 1.00 0.00 H new ATOM 0 HB3 HIS B 93 3.905 12.279 -2.741 1.00 0.00 H new ATOM 0 HD1 HIS B 93 4.361 11.869 -0.303 1.00 0.00 H new ATOM 0 HD2 HIS B 93 7.232 14.329 -2.095 1.00 0.00 H new ATOM 0 HE1 HIS B 93 5.819 12.759 1.573 1.00 0.00 H new ATOM 1462 N GLN B 94 6.016 9.431 -3.257 1.00 0.00 N ATOM 1463 CA GLN B 94 5.643 8.036 -3.111 1.00 0.00 C ATOM 1464 C GLN B 94 5.702 7.625 -1.651 1.00 0.00 C ATOM 1465 O GLN B 94 6.754 7.708 -1.014 1.00 0.00 O ATOM 1466 CB GLN B 94 6.577 7.144 -3.933 1.00 0.00 C ATOM 1467 CG GLN B 94 6.690 7.553 -5.393 1.00 0.00 C ATOM 1468 CD GLN B 94 7.621 6.651 -6.180 1.00 0.00 C ATOM 1469 OE1 GLN B 94 8.562 6.079 -5.630 1.00 0.00 O ATOM 1470 NE2 GLN B 94 7.372 6.522 -7.474 1.00 0.00 N ATOM 0 H GLN B 94 6.983 9.641 -3.009 1.00 0.00 H new ATOM 0 HA GLN B 94 4.623 7.915 -3.476 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.570 7.161 -3.483 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.221 6.115 -3.880 1.00 0.00 H new ATOM 0 HG2 GLN B 94 5.700 7.535 -5.849 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.049 8.580 -5.452 1.00 0.00 H new ATOM 0 HE21 GLN B 94 6.582 7.013 -7.893 1.00 0.00 H new ATOM 0 HE22 GLN B 94 7.970 5.932 -8.052 1.00 0.00 H new ATOM 1479 N GLU B 95 4.572 7.186 -1.131 1.00 0.00 N ATOM 1480 CA GLU B 95 4.502 6.691 0.230 1.00 0.00 C ATOM 1481 C GLU B 95 4.233 5.200 0.231 1.00 0.00 C ATOM 1482 O GLU B 95 3.193 4.746 -0.243 1.00 0.00 O ATOM 1483 CB GLU B 95 3.413 7.413 1.020 1.00 0.00 C ATOM 1484 CG GLU B 95 3.926 8.542 1.897 1.00 0.00 C ATOM 1485 CD GLU B 95 4.552 9.676 1.116 1.00 0.00 C ATOM 1486 OE1 GLU B 95 3.802 10.492 0.546 1.00 0.00 O ATOM 1487 OE2 GLU B 95 5.797 9.777 1.102 1.00 0.00 O ATOM 0 H GLU B 95 3.685 7.162 -1.634 1.00 0.00 H new ATOM 0 HA GLU B 95 5.462 6.884 0.709 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.679 7.815 0.322 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.893 6.688 1.647 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.101 8.933 2.492 1.00 0.00 H new ATOM 0 HG3 GLU B 95 4.661 8.143 2.596 1.00 0.00 H new ATOM 1494 N VAL B 96 5.177 4.438 0.751 1.00 0.00 N ATOM 1495 CA VAL B 96 5.024 3.001 0.829 1.00 0.00 C ATOM 1496 C VAL B 96 4.534 2.610 2.213 1.00 0.00 C ATOM 1497 O VAL B 96 5.285 2.655 3.189 1.00 0.00 O ATOM 1498 CB VAL B 96 6.349 2.271 0.525 1.00 0.00 C ATOM 1499 CG1 VAL B 96 6.145 0.763 0.517 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.932 2.747 -0.800 1.00 0.00 C ATOM 0 H VAL B 96 6.057 4.792 1.125 1.00 0.00 H new ATOM 0 HA VAL B 96 4.293 2.702 0.078 1.00 0.00 H new ATOM 0 HB VAL B 96 7.060 2.511 1.315 1.00 0.00 H new ATOM 0 HG11 VAL B 96 7.092 0.269 0.301 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.782 0.440 1.493 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.415 0.499 -0.248 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.866 2.221 -0.997 1.00 0.00 H new ATOM 0 HG22 VAL B 96 6.224 2.543 -1.603 1.00 0.00 H new ATOM 0 HG23 VAL B 96 7.123 3.819 -0.749 1.00 0.00 H new ATOM 1510 N THR B 97 3.272 2.235 2.295 1.00 0.00 N ATOM 1511 CA THR B 97 2.685 1.820 3.551 1.00 0.00 C ATOM 1512 C THR B 97 2.797 0.308 3.692 1.00 0.00 C ATOM 1513 O THR B 97 2.125 -0.444 2.981 1.00 0.00 O ATOM 1514 CB THR B 97 1.208 2.245 3.630 1.00 0.00 C ATOM 1515 OG1 THR B 97 1.074 3.601 3.182 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.685 2.131 5.053 1.00 0.00 C ATOM 0 H THR B 97 2.632 2.210 1.501 1.00 0.00 H new ATOM 0 HA THR B 97 3.225 2.303 4.365 1.00 0.00 H new ATOM 0 HB THR B 97 0.625 1.582 2.991 1.00 0.00 H new ATOM 0 HG1 THR B 97 1.073 3.623 2.202 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.361 2.437 5.082 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.770 1.098 5.390 1.00 0.00 H new ATOM 0 HG23 THR B 97 1.270 2.776 5.708 1.00 0.00 H new ATOM 1524 N ARG B 98 3.661 -0.137 4.593 1.00 0.00 N ATOM 1525 CA ARG B 98 3.905 -1.559 4.766 1.00 0.00 C ATOM 1526 C ARG B 98 2.938 -2.162 5.772 1.00 0.00 C ATOM 1527 O ARG B 98 2.720 -1.614 6.854 1.00 0.00 O ATOM 1528 CB ARG B 98 5.346 -1.818 5.212 1.00 0.00 C ATOM 1529 CG ARG B 98 6.384 -1.492 4.152 1.00 0.00 C ATOM 1530 CD ARG B 98 7.752 -2.039 4.529 1.00 0.00 C ATOM 1531 NE ARG B 98 7.736 -3.497 4.679 1.00 0.00 N ATOM 1532 CZ ARG B 98 8.829 -4.254 4.761 1.00 0.00 C ATOM 1533 NH1 ARG B 98 10.033 -3.699 4.690 1.00 0.00 N ATOM 1534 NH2 ARG B 98 8.718 -5.569 4.923 1.00 0.00 N ATOM 0 H ARG B 98 4.203 0.465 5.213 1.00 0.00 H new ATOM 0 HA ARG B 98 3.746 -2.037 3.800 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.552 -1.226 6.104 1.00 0.00 H new ATOM 0 HB3 ARG B 98 5.446 -2.866 5.495 1.00 0.00 H new ATOM 0 HG2 ARG B 98 6.074 -1.912 3.195 1.00 0.00 H new ATOM 0 HG3 ARG B 98 6.446 -0.412 4.021 1.00 0.00 H new ATOM 0 HD2 ARG B 98 8.477 -1.761 3.764 1.00 0.00 H new ATOM 0 HD3 ARG B 98 8.081 -1.582 5.462 1.00 0.00 H new ATOM 0 HE ARG B 98 6.829 -3.962 4.723 1.00 0.00 H new ATOM 0 HH11 ARG B 98 10.123 -2.690 4.572 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.868 -4.282 4.753 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.795 -5.999 4.985 1.00 0.00 H new ATOM 0 HH22 ARG B 98 9.556 -6.148 4.986 1.00 0.00 H new ATOM 1548 N PHE B 99 2.356 -3.286 5.401 1.00 0.00 N ATOM 1549 CA PHE B 99 1.450 -4.009 6.269 1.00 0.00 C ATOM 1550 C PHE B 99 1.610 -5.505 6.046 1.00 0.00 C ATOM 1551 O PHE B 99 2.409 -5.935 5.213 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.004 -3.571 6.031 1.00 0.00 C ATOM 1553 CG PHE B 99 -0.502 -3.771 4.623 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -0.217 -2.843 3.632 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -1.270 -4.878 4.293 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -0.685 -3.015 2.344 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -1.738 -5.055 3.005 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.445 -4.122 2.030 1.00 0.00 C ATOM 0 H PHE B 99 2.498 -3.722 4.490 1.00 0.00 H new ATOM 0 HA PHE B 99 1.697 -3.780 7.305 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -0.651 -4.124 6.712 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -0.097 -2.516 6.288 1.00 0.00 H new ATOM 0 HD1 PHE B 99 0.379 -1.974 3.871 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -1.505 -5.610 5.052 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -0.456 -2.283 1.583 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -2.333 -5.923 2.761 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.811 -4.259 1.023 1.00 0.00 H new ATOM 1568 N ASP B 100 0.864 -6.289 6.796 1.00 0.00 N ATOM 1569 CA ASP B 100 0.908 -7.738 6.682 1.00 0.00 C ATOM 1570 C ASP B 100 -0.484 -8.299 6.885 1.00 0.00 C ATOM 1571 O ASP B 100 -1.317 -7.673 7.541 1.00 0.00 O ATOM 1572 CB ASP B 100 1.872 -8.342 7.710 1.00 0.00 C ATOM 1573 CG ASP B 100 1.463 -8.053 9.141 1.00 0.00 C ATOM 1574 OD1 ASP B 100 0.719 -8.865 9.730 1.00 0.00 O ATOM 1575 OD2 ASP B 100 1.884 -7.006 9.684 1.00 0.00 O ATOM 0 H ASP B 100 0.211 -5.945 7.500 1.00 0.00 H new ATOM 0 HA ASP B 100 1.269 -7.999 5.687 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.924 -9.421 7.563 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.874 -7.948 7.537 1.00 0.00 H new ATOM 1580 N PHE B 101 -0.748 -9.462 6.318 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.062 -10.069 6.442 1.00 0.00 C ATOM 1582 C PHE B 101 -1.987 -11.586 6.392 1.00 0.00 C ATOM 1583 O PHE B 101 -1.090 -12.164 5.772 1.00 0.00 O ATOM 1584 CB PHE B 101 -3.016 -9.536 5.367 1.00 0.00 C ATOM 1585 CG PHE B 101 -2.501 -9.634 3.957 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -1.767 -8.598 3.403 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -2.771 -10.748 3.181 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -1.304 -8.674 2.104 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -2.308 -10.830 1.884 1.00 0.00 C ATOM 1590 CZ PHE B 101 -1.578 -9.791 1.342 1.00 0.00 C ATOM 0 H PHE B 101 -0.077 -10.002 5.771 1.00 0.00 H new ATOM 0 HA PHE B 101 -2.457 -9.792 7.419 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -3.957 -10.083 5.433 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -3.238 -8.491 5.585 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -1.554 -7.720 3.994 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -3.350 -11.561 3.595 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -0.729 -7.861 1.686 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -2.517 -11.709 1.292 1.00 0.00 H new ATOM 0 HZ PHE B 101 -1.222 -9.852 0.324 1.00 0.00 H new ATOM 1600 N THR B 102 -2.913 -12.213 7.097 1.00 0.00 N ATOM 1601 CA THR B 102 -3.034 -13.661 7.134 1.00 0.00 C ATOM 1602 C THR B 102 -4.471 -14.024 7.481 1.00 0.00 C ATOM 1603 O THR B 102 -5.106 -14.848 6.822 1.00 0.00 O ATOM 1604 CB THR B 102 -2.100 -14.277 8.197 1.00 0.00 C ATOM 1605 OG1 THR B 102 -0.816 -13.649 8.144 1.00 0.00 O ATOM 1606 CG2 THR B 102 -1.941 -15.774 7.978 1.00 0.00 C ATOM 0 H THR B 102 -3.608 -11.728 7.665 1.00 0.00 H new ATOM 0 HA THR B 102 -2.754 -14.054 6.157 1.00 0.00 H new ATOM 0 HB THR B 102 -2.547 -14.113 9.177 1.00 0.00 H new ATOM 0 HG1 THR B 102 -0.230 -14.045 8.823 1.00 0.00 H new ATOM 0 HG21 THR B 102 -1.278 -16.185 8.740 1.00 0.00 H new ATOM 0 HG22 THR B 102 -2.916 -16.257 8.046 1.00 0.00 H new ATOM 0 HG23 THR B 102 -1.515 -15.954 6.991 1.00 0.00 H new ATOM 1614 N THR B 103 -4.967 -13.388 8.531 1.00 0.00 N ATOM 1615 CA THR B 103 -6.332 -13.562 8.992 1.00 0.00 C ATOM 1616 C THR B 103 -6.741 -12.331 9.796 1.00 0.00 C ATOM 1617 O THR B 103 -6.023 -11.921 10.710 1.00 0.00 O ATOM 1618 CB THR B 103 -6.469 -14.832 9.861 1.00 0.00 C ATOM 1619 OG1 THR B 103 -6.063 -15.984 9.106 1.00 0.00 O ATOM 1620 CG2 THR B 103 -7.899 -15.020 10.345 1.00 0.00 C ATOM 0 H THR B 103 -4.426 -12.730 9.092 1.00 0.00 H new ATOM 0 HA THR B 103 -6.986 -13.679 8.128 1.00 0.00 H new ATOM 0 HB THR B 103 -5.825 -14.715 10.733 1.00 0.00 H new ATOM 0 HG1 THR B 103 -6.150 -16.787 9.662 1.00 0.00 H new ATOM 0 HG21 THR B 103 -7.962 -15.922 10.954 1.00 0.00 H new ATOM 0 HG22 THR B 103 -8.197 -14.158 10.942 1.00 0.00 H new ATOM 0 HG23 THR B 103 -8.564 -15.115 9.487 1.00 0.00 H new ATOM 1628 N THR B 104 -7.866 -11.730 9.440 1.00 0.00 N ATOM 1629 CA THR B 104 -8.321 -10.513 10.092 1.00 0.00 C ATOM 1630 C THR B 104 -8.759 -10.795 11.529 1.00 0.00 C ATOM 1631 O THR B 104 -9.922 -11.114 11.787 1.00 0.00 O ATOM 1632 CB THR B 104 -9.486 -9.879 9.312 1.00 0.00 C ATOM 1633 OG1 THR B 104 -9.182 -9.863 7.909 1.00 0.00 O ATOM 1634 CG2 THR B 104 -9.742 -8.460 9.788 1.00 0.00 C ATOM 0 H THR B 104 -8.482 -12.067 8.700 1.00 0.00 H new ATOM 0 HA THR B 104 -7.484 -9.815 10.110 1.00 0.00 H new ATOM 0 HB THR B 104 -10.381 -10.476 9.487 1.00 0.00 H new ATOM 0 HG1 THR B 104 -9.332 -8.963 7.552 1.00 0.00 H new ATOM 0 HG21 THR B 104 -10.570 -8.031 9.223 1.00 0.00 H new ATOM 0 HG22 THR B 104 -9.994 -8.472 10.848 1.00 0.00 H new ATOM 0 HG23 THR B 104 -8.847 -7.858 9.634 1.00 0.00 H new ATOM 1642 N SER B 105 -7.824 -10.666 12.462 1.00 0.00 N ATOM 1643 CA SER B 105 -8.084 -10.956 13.864 1.00 0.00 C ATOM 1644 C SER B 105 -8.755 -9.776 14.568 1.00 0.00 C ATOM 1645 O SER B 105 -8.271 -9.277 15.585 1.00 0.00 O ATOM 1646 CB SER B 105 -6.773 -11.334 14.558 1.00 0.00 C ATOM 1647 OG SER B 105 -5.706 -10.500 14.125 1.00 0.00 O ATOM 0 H SER B 105 -6.871 -10.359 12.269 1.00 0.00 H new ATOM 0 HA SER B 105 -8.776 -11.796 13.922 1.00 0.00 H new ATOM 0 HB2 SER B 105 -6.891 -11.247 15.638 1.00 0.00 H new ATOM 0 HB3 SER B 105 -6.533 -12.376 14.346 1.00 0.00 H new ATOM 0 HG SER B 105 -4.880 -10.760 14.584 1.00 0.00 H new ATOM 1653 N THR B 106 -9.873 -9.334 14.016 1.00 0.00 N ATOM 1654 CA THR B 106 -10.642 -8.256 14.605 1.00 0.00 C ATOM 1655 C THR B 106 -11.694 -8.830 15.548 1.00 0.00 C ATOM 1656 O THR B 106 -12.265 -9.889 15.275 1.00 0.00 O ATOM 1657 CB THR B 106 -11.322 -7.393 13.514 1.00 0.00 C ATOM 1658 OG1 THR B 106 -12.115 -6.355 14.108 1.00 0.00 O ATOM 1659 CG2 THR B 106 -12.194 -8.247 12.608 1.00 0.00 C ATOM 0 H THR B 106 -10.269 -9.710 13.154 1.00 0.00 H new ATOM 0 HA THR B 106 -9.961 -7.616 15.166 1.00 0.00 H new ATOM 0 HB THR B 106 -10.533 -6.939 12.914 1.00 0.00 H new ATOM 0 HG1 THR B 106 -12.535 -5.820 13.403 1.00 0.00 H new ATOM 0 HG21 THR B 106 -12.660 -7.616 11.851 1.00 0.00 H new ATOM 0 HG22 THR B 106 -11.580 -9.005 12.121 1.00 0.00 H new ATOM 0 HG23 THR B 106 -12.968 -8.733 13.201 1.00 0.00 H new ATOM 1667 N SER B 107 -11.924 -8.144 16.664 1.00 0.00 N ATOM 1668 CA SER B 107 -12.900 -8.580 17.656 1.00 0.00 C ATOM 1669 C SER B 107 -12.587 -9.992 18.155 1.00 0.00 C ATOM 1670 O SER B 107 -13.365 -10.925 17.956 1.00 0.00 O ATOM 1671 CB SER B 107 -14.313 -8.517 17.071 1.00 0.00 C ATOM 1672 OG SER B 107 -14.636 -7.194 16.666 1.00 0.00 O ATOM 0 H SER B 107 -11.443 -7.277 16.904 1.00 0.00 H new ATOM 0 HA SER B 107 -12.843 -7.904 18.509 1.00 0.00 H new ATOM 0 HB2 SER B 107 -14.388 -9.191 16.218 1.00 0.00 H new ATOM 0 HB3 SER B 107 -15.034 -8.861 17.813 1.00 0.00 H new ATOM 0 HG SER B 107 -15.542 -7.178 16.294 1.00 0.00 H new ATOM 1678 N THR B 108 -11.437 -10.141 18.794 1.00 0.00 N ATOM 1679 CA THR B 108 -11.029 -11.425 19.338 1.00 0.00 C ATOM 1680 C THR B 108 -10.812 -11.325 20.855 1.00 0.00 C ATOM 1681 O THR B 108 -9.703 -11.071 21.332 1.00 0.00 O ATOM 1682 CB THR B 108 -9.764 -11.966 18.620 1.00 0.00 C ATOM 1683 OG1 THR B 108 -9.282 -13.152 19.267 1.00 0.00 O ATOM 1684 CG2 THR B 108 -8.656 -10.921 18.563 1.00 0.00 C ATOM 0 H THR B 108 -10.769 -9.386 18.948 1.00 0.00 H new ATOM 0 HA THR B 108 -11.833 -12.139 19.159 1.00 0.00 H new ATOM 0 HB THR B 108 -10.053 -12.208 17.597 1.00 0.00 H new ATOM 0 HG1 THR B 108 -8.485 -13.479 18.799 1.00 0.00 H new ATOM 0 HG21 THR B 108 -7.788 -11.339 18.053 1.00 0.00 H new ATOM 0 HG22 THR B 108 -9.010 -10.045 18.019 1.00 0.00 H new ATOM 0 HG23 THR B 108 -8.377 -10.631 19.576 1.00 0.00 H new ATOM 1692 N PRO B 109 -11.889 -11.503 21.636 1.00 0.00 N ATOM 1693 CA PRO B 109 -11.827 -11.455 23.093 1.00 0.00 C ATOM 1694 C PRO B 109 -11.392 -12.792 23.686 1.00 0.00 C ATOM 1695 O PRO B 109 -12.188 -13.508 24.302 1.00 0.00 O ATOM 1696 CB PRO B 109 -13.265 -11.129 23.478 1.00 0.00 C ATOM 1697 CG PRO B 109 -14.089 -11.780 22.421 1.00 0.00 C ATOM 1698 CD PRO B 109 -13.261 -11.765 21.158 1.00 0.00 C ATOM 0 HA PRO B 109 -11.099 -10.733 23.464 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -13.509 -11.517 24.467 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -13.434 -10.053 23.507 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -14.346 -12.801 22.704 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -15.027 -11.244 22.276 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -13.325 -12.715 20.627 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -13.598 -10.991 20.468 1.00 0.00 H new ATOM 1706 N GLY B 110 -10.130 -13.134 23.469 1.00 0.00 N ATOM 1707 CA GLY B 110 -9.595 -14.375 23.985 1.00 0.00 C ATOM 1708 C GLY B 110 -9.487 -14.367 25.492 1.00 0.00 C ATOM 1709 O GLY B 110 -8.612 -13.707 26.054 1.00 0.00 O ATOM 0 H GLY B 110 -9.464 -12.569 22.941 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -10.233 -15.202 23.673 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -8.610 -14.552 23.553 1.00 0.00 H new ATOM 1713 N SER B 111 -10.383 -15.087 26.146 1.00 0.00 N ATOM 1714 CA SER B 111 -10.374 -15.186 27.594 1.00 0.00 C ATOM 1715 C SER B 111 -9.188 -16.021 28.059 1.00 0.00 C ATOM 1716 O SER B 111 -9.289 -17.243 28.191 1.00 0.00 O ATOM 1717 CB SER B 111 -11.685 -15.806 28.079 1.00 0.00 C ATOM 1718 OG SER B 111 -12.798 -15.110 27.544 1.00 0.00 O ATOM 0 H SER B 111 -11.130 -15.614 25.693 1.00 0.00 H new ATOM 0 HA SER B 111 -10.278 -14.186 28.018 1.00 0.00 H new ATOM 0 HB2 SER B 111 -11.729 -16.854 27.783 1.00 0.00 H new ATOM 0 HB3 SER B 111 -11.724 -15.781 29.168 1.00 0.00 H new ATOM 0 HG SER B 111 -13.627 -15.523 27.865 1.00 0.00 H new ATOM 1724 N ARG B 112 -8.064 -15.356 28.297 1.00 0.00 N ATOM 1725 CA ARG B 112 -6.851 -16.033 28.728 1.00 0.00 C ATOM 1726 C ARG B 112 -6.933 -16.402 30.202 1.00 0.00 C ATOM 1727 O ARG B 112 -6.193 -15.875 31.035 1.00 0.00 O ATOM 1728 CB ARG B 112 -5.619 -15.164 28.472 1.00 0.00 C ATOM 1729 CG ARG B 112 -5.364 -14.879 27.002 1.00 0.00 C ATOM 1730 CD ARG B 112 -3.989 -14.269 26.791 1.00 0.00 C ATOM 1731 NE ARG B 112 -2.929 -15.165 27.254 1.00 0.00 N ATOM 1732 CZ ARG B 112 -1.629 -14.957 27.059 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -1.212 -13.880 26.407 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -0.744 -15.838 27.511 1.00 0.00 N ATOM 0 H ARG B 112 -7.969 -14.345 28.198 1.00 0.00 H new ATOM 0 HA ARG B 112 -6.756 -16.948 28.144 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -5.737 -14.218 29.001 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -4.744 -15.658 28.894 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -5.446 -15.803 26.430 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -6.128 -14.200 26.623 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -3.845 -14.050 25.733 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -3.924 -13.321 27.325 1.00 0.00 H new ATOM 0 HE ARG B 112 -3.205 -16.006 27.761 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -1.889 -13.205 26.052 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -0.214 -13.727 26.261 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -1.061 -16.671 28.006 1.00 0.00 H new ATOM 0 HH22 ARG B 112 0.253 -15.681 27.363 1.00 0.00 H new ATOM 1748 N SER B 113 -7.845 -17.305 30.517 1.00 0.00 N ATOM 1749 CA SER B 113 -8.020 -17.775 31.876 1.00 0.00 C ATOM 1750 C SER B 113 -6.904 -18.751 32.238 1.00 0.00 C ATOM 1751 O SER B 113 -6.575 -18.932 33.411 1.00 0.00 O ATOM 1752 CB SER B 113 -9.393 -18.439 32.025 1.00 0.00 C ATOM 1753 OG SER B 113 -9.636 -18.832 33.365 1.00 0.00 O ATOM 0 H SER B 113 -8.480 -17.730 29.841 1.00 0.00 H new ATOM 0 HA SER B 113 -7.970 -16.928 32.560 1.00 0.00 H new ATOM 0 HB2 SER B 113 -10.170 -17.747 31.701 1.00 0.00 H new ATOM 0 HB3 SER B 113 -9.450 -19.311 31.373 1.00 0.00 H new ATOM 0 HG SER B 113 -10.520 -19.251 33.428 1.00 0.00 H new ATOM 1759 N HIS B 114 -6.304 -19.358 31.221 1.00 0.00 N ATOM 1760 CA HIS B 114 -5.206 -20.295 31.430 1.00 0.00 C ATOM 1761 C HIS B 114 -3.881 -19.547 31.489 1.00 0.00 C ATOM 1762 O HIS B 114 -2.959 -19.821 30.717 1.00 0.00 O ATOM 1763 CB HIS B 114 -5.169 -21.350 30.319 1.00 0.00 C ATOM 1764 CG HIS B 114 -6.385 -22.222 30.271 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -7.493 -21.929 29.505 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -6.665 -23.388 30.900 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -8.398 -22.874 29.665 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -7.922 -23.771 30.506 1.00 0.00 N ATOM 0 H HIS B 114 -6.559 -19.218 30.243 1.00 0.00 H new ATOM 0 HA HIS B 114 -5.368 -20.805 32.380 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -5.056 -20.848 29.358 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -4.289 -21.978 30.457 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -6.019 -23.918 31.584 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -9.366 -22.908 29.188 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -8.409 -24.613 30.814 1.00 0.00 H new ATOM 1777 N HIS B 115 -3.798 -18.593 32.401 1.00 0.00 N ATOM 1778 CA HIS B 115 -2.599 -17.791 32.568 1.00 0.00 C ATOM 1779 C HIS B 115 -2.107 -17.901 34.006 1.00 0.00 C ATOM 1780 O HIS B 115 -2.368 -17.028 34.832 1.00 0.00 O ATOM 1781 CB HIS B 115 -2.886 -16.325 32.213 1.00 0.00 C ATOM 1782 CG HIS B 115 -1.655 -15.495 32.000 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -0.960 -14.890 33.025 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -0.998 -15.169 30.863 1.00 0.00 C ATOM 1785 CE1 HIS B 115 0.069 -14.229 32.527 1.00 0.00 C ATOM 1786 NE2 HIS B 115 0.069 -14.381 31.216 1.00 0.00 N ATOM 0 H HIS B 115 -4.554 -18.354 33.042 1.00 0.00 H new ATOM 0 HA HIS B 115 -1.824 -18.162 31.897 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -3.494 -16.293 31.309 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -3.479 -15.878 33.011 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -1.264 -15.473 29.861 1.00 0.00 H new ATOM 0 HE1 HIS B 115 0.789 -13.660 33.096 1.00 0.00 H new ATOM 0 HE2 HIS B 115 0.750 -13.979 30.571 1.00 0.00 H new ATOM 1795 N HIS B 116 -1.426 -18.993 34.308 1.00 0.00 N ATOM 1796 CA HIS B 116 -0.899 -19.222 35.648 1.00 0.00 C ATOM 1797 C HIS B 116 0.607 -19.011 35.674 1.00 0.00 C ATOM 1798 O HIS B 116 1.369 -19.943 35.936 1.00 0.00 O ATOM 1799 CB HIS B 116 -1.234 -20.638 36.134 1.00 0.00 C ATOM 1800 CG HIS B 116 -2.663 -20.827 36.538 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -3.404 -21.936 36.193 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -3.479 -20.053 37.292 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -4.612 -21.836 36.717 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -4.682 -20.705 37.388 1.00 0.00 N ATOM 0 H HIS B 116 -1.223 -19.739 33.643 1.00 0.00 H new ATOM 0 HA HIS B 116 -1.369 -18.503 36.319 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -0.995 -21.348 35.342 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -0.593 -20.880 36.982 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -3.229 -19.100 37.735 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -5.408 -22.559 36.613 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -5.499 -20.368 37.897 1.00 0.00 H new ATOM 1813 N HIS B 117 1.036 -17.786 35.408 1.00 0.00 N ATOM 1814 CA HIS B 117 2.459 -17.465 35.373 1.00 0.00 C ATOM 1815 C HIS B 117 2.989 -17.245 36.790 1.00 0.00 C ATOM 1816 O HIS B 117 3.272 -16.121 37.198 1.00 0.00 O ATOM 1817 CB HIS B 117 2.706 -16.224 34.501 1.00 0.00 C ATOM 1818 CG HIS B 117 4.156 -15.880 34.320 1.00 0.00 C ATOM 1819 ND1 HIS B 117 4.983 -16.536 33.435 1.00 0.00 N ATOM 1820 CD2 HIS B 117 4.922 -14.937 34.917 1.00 0.00 C ATOM 1821 CE1 HIS B 117 6.193 -16.015 33.498 1.00 0.00 C ATOM 1822 NE2 HIS B 117 6.184 -15.043 34.389 1.00 0.00 N ATOM 0 H HIS B 117 0.420 -16.996 35.213 1.00 0.00 H new ATOM 0 HA HIS B 117 2.996 -18.305 34.933 1.00 0.00 H new ATOM 0 HB2 HIS B 117 2.257 -16.387 33.521 1.00 0.00 H new ATOM 0 HB3 HIS B 117 2.195 -15.372 34.948 1.00 0.00 H new ATOM 0 HD2 HIS B 117 4.600 -14.232 35.669 1.00 0.00 H new ATOM 0 HE1 HIS B 117 7.047 -16.331 32.918 1.00 0.00 H new ATOM 0 HE2 HIS B 117 6.984 -14.464 34.644 1.00 0.00 H new ATOM 1831 N HIS B 118 3.096 -18.328 37.546 1.00 0.00 N ATOM 1832 CA HIS B 118 3.614 -18.264 38.910 1.00 0.00 C ATOM 1833 C HIS B 118 4.554 -19.432 39.176 1.00 0.00 C ATOM 1834 O HIS B 118 4.925 -19.697 40.318 1.00 0.00 O ATOM 1835 CB HIS B 118 2.474 -18.275 39.935 1.00 0.00 C ATOM 1836 CG HIS B 118 1.556 -17.092 39.851 1.00 0.00 C ATOM 1837 ND1 HIS B 118 0.213 -17.202 39.566 1.00 0.00 N ATOM 1838 CD2 HIS B 118 1.793 -15.772 40.027 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -0.335 -16.002 39.568 1.00 0.00 C ATOM 1840 NE2 HIS B 118 0.601 -15.114 39.845 1.00 0.00 N ATOM 0 H HIS B 118 2.831 -19.264 37.240 1.00 0.00 H new ATOM 0 HA HIS B 118 4.164 -17.329 39.014 1.00 0.00 H new ATOM 0 HB2 HIS B 118 1.889 -19.184 39.800 1.00 0.00 H new ATOM 0 HB3 HIS B 118 2.902 -18.317 40.937 1.00 0.00 H new ATOM 0 HD2 HIS B 118 2.744 -15.319 40.266 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -1.375 -15.783 39.375 1.00 0.00 H new ATOM 0 HE2 HIS B 118 0.462 -14.106 39.913 1.00 0.00 H new ATOM 1849 N HIS B 119 4.931 -20.130 38.115 1.00 0.00 N ATOM 1850 CA HIS B 119 5.804 -21.291 38.229 1.00 0.00 C ATOM 1851 C HIS B 119 6.978 -21.154 37.273 1.00 0.00 C ATOM 1852 O HIS B 119 8.121 -20.986 37.750 1.00 0.00 O ATOM 1853 CB HIS B 119 5.038 -22.589 37.939 1.00 0.00 C ATOM 1854 CG HIS B 119 3.942 -22.882 38.919 1.00 0.00 C ATOM 1855 ND1 HIS B 119 4.162 -23.493 40.133 1.00 0.00 N ATOM 1856 CD2 HIS B 119 2.611 -22.642 38.857 1.00 0.00 C ATOM 1857 CE1 HIS B 119 3.016 -23.617 40.775 1.00 0.00 C ATOM 1858 NE2 HIS B 119 2.059 -23.108 40.023 1.00 0.00 N ATOM 1859 OXT HIS B 119 6.750 -21.169 36.043 1.00 0.00 O ATOM 0 H HIS B 119 4.645 -19.912 37.161 1.00 0.00 H new ATOM 0 HA HIS B 119 6.176 -21.338 39.252 1.00 0.00 H new ATOM 0 HB2 HIS B 119 4.610 -22.531 36.938 1.00 0.00 H new ATOM 0 HB3 HIS B 119 5.742 -23.421 37.937 1.00 0.00 H new ATOM 0 HD2 HIS B 119 2.082 -22.171 38.041 1.00 0.00 H new ATOM 0 HE1 HIS B 119 2.884 -24.060 41.751 1.00 0.00 H new ATOM 0 HE2 HIS B 119 1.070 -23.068 40.269 1.00 0.00 H new TER 1868 HIS B 119