USER MOD reduce.3.24.130724 H: found=0, std=0, add=694, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 688 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 60 MET CE :methyl -163:sc= -1.97 (180deg=-3.71!) USER MOD Set 2.1: A 42 ASN : amide:sc= -0.0219 X(o=-0.31,f=-0.12) USER MOD Set 2.2: A 55 ASN : amide:sc= -0.284 X(o=-0.31,f=-0.12) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 ASN : amide:sc= 0.43 K(o=0.43,f=-0.11) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -163:sc= 1.27 (180deg=1.23) USER MOD Single : A 33 ASN : amide:sc= 0.82 K(o=0.82,f=-5.4!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.814 K(o=0.81,f=0) USER MOD Single : A 37 GLN : amide:sc= 0.934 K(o=0.93,f=-5.4!) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 44 THR OG1 : rot 69:sc= 1.24 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -1.63 K(o=-1.6,f=-4.2!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.105 X(o=-0.1,f=-0.34) USER MOD Single : A 58 MET CE :methyl -176:sc= -0.0241 (180deg=-0.0563) USER MOD Single : A 61 SER OG : rot 74:sc= 0.889 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= 0.485 X(o=0.48,f=-0.0064) USER MOD Single : A 71 SER OG : rot 78:sc= 0.0884 USER MOD Single : A 72 SER OG : rot 64:sc= 0.0466 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 86:sc= 0.00548 USER MOD Single : A 83 SER OG : rot -90:sc= 1.22 USER MOD Single : A 87 HIS : no HD1:sc= -0.0021 X(o=-0.0021,f=-0.28) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HE2:sc= 0.267 K(o=0.27,f=-1.9) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.14) USER MOD Single : A 92 HIS : no HD1:sc= -0.112 X(o=-0.11,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 87.197 -4.018 16.432 1.00 10.00 N ATOM 2 CA MET A 1 86.934 -2.668 15.869 1.00 10.00 C ATOM 3 C MET A 1 85.590 -2.655 15.139 1.00 10.00 C ATOM 4 O MET A 1 85.404 -3.391 14.168 1.00 10.00 O ATOM 5 CB MET A 1 88.083 -2.216 14.943 1.00 10.00 C ATOM 6 CG MET A 1 87.883 -0.801 14.381 1.00 10.00 C ATOM 7 SD MET A 1 89.254 -0.225 13.340 1.00 10.00 S ATOM 8 CE MET A 1 88.621 1.415 12.889 1.00 10.00 C ATOM 0 H1 MET A 1 88.112 -4.016 16.926 1.00 10.00 H new ATOM 0 H2 MET A 1 86.442 -4.267 17.103 1.00 10.00 H new ATOM 0 H3 MET A 1 87.221 -4.717 15.662 1.00 10.00 H new ATOM 0 HA MET A 1 86.884 -1.954 16.691 1.00 10.00 H new ATOM 0 HB2 MET A 1 89.022 -2.252 15.495 1.00 10.00 H new ATOM 0 HB3 MET A 1 88.173 -2.920 14.115 1.00 10.00 H new ATOM 0 HG2 MET A 1 86.962 -0.779 13.798 1.00 10.00 H new ATOM 0 HG3 MET A 1 87.752 -0.106 15.210 1.00 10.00 H new ATOM 0 HE1 MET A 1 89.341 1.918 12.244 1.00 10.00 H new ATOM 0 HE2 MET A 1 87.674 1.307 12.360 1.00 10.00 H new ATOM 0 HE3 MET A 1 88.467 2.006 13.792 1.00 10.00 H new ATOM 20 N SER A 2 84.643 -1.830 15.598 1.00 10.00 N ATOM 21 CA SER A 2 83.328 -1.642 14.956 1.00 10.00 C ATOM 22 C SER A 2 83.449 -1.008 13.561 1.00 10.00 C ATOM 23 O SER A 2 84.243 -0.085 13.358 1.00 10.00 O ATOM 24 CB SER A 2 82.441 -0.742 15.827 1.00 10.00 C ATOM 25 OG SER A 2 82.324 -1.276 17.139 1.00 10.00 O ATOM 0 H SER A 2 84.766 -1.264 16.438 1.00 10.00 H new ATOM 0 HA SER A 2 82.883 -2.631 14.848 1.00 10.00 H new ATOM 0 HB2 SER A 2 82.865 0.261 15.873 1.00 10.00 H new ATOM 0 HB3 SER A 2 81.453 -0.650 15.376 1.00 10.00 H new ATOM 0 HG SER A 2 81.757 -0.689 17.682 1.00 10.00 H new ATOM 31 N ASN A 3 82.642 -1.471 12.600 1.00 10.00 N ATOM 32 CA ASN A 3 82.526 -0.845 11.276 1.00 10.00 C ATOM 33 C ASN A 3 81.847 0.548 11.345 1.00 10.00 C ATOM 34 O ASN A 3 81.058 0.799 12.266 1.00 10.00 O ATOM 35 CB ASN A 3 81.771 -1.799 10.330 1.00 10.00 C ATOM 36 CG ASN A 3 80.318 -2.032 10.721 1.00 10.00 C ATOM 37 OD1 ASN A 3 80.003 -2.905 11.518 1.00 10.00 O ATOM 38 ND2 ASN A 3 79.384 -1.276 10.183 1.00 10.00 N ATOM 0 H ASN A 3 82.049 -2.292 12.718 1.00 10.00 H new ATOM 0 HA ASN A 3 83.528 -0.671 10.884 1.00 10.00 H new ATOM 0 HB2 ASN A 3 81.805 -1.394 9.319 1.00 10.00 H new ATOM 0 HB3 ASN A 3 82.289 -2.758 10.307 1.00 10.00 H new ATOM 0 HD21 ASN A 3 78.405 -1.420 10.432 1.00 10.00 H new ATOM 0 HD22 ASN A 3 79.639 -0.546 9.518 1.00 10.00 H new ATOM 45 N PRO A 4 82.089 1.443 10.366 1.00 10.00 N ATOM 46 CA PRO A 4 81.367 2.711 10.254 1.00 10.00 C ATOM 47 C PRO A 4 79.920 2.494 9.758 1.00 10.00 C ATOM 48 O PRO A 4 79.630 1.459 9.140 1.00 10.00 O ATOM 49 CB PRO A 4 82.190 3.543 9.264 1.00 10.00 C ATOM 50 CG PRO A 4 82.802 2.493 8.339 1.00 10.00 C ATOM 51 CD PRO A 4 83.036 1.299 9.265 1.00 10.00 C ATOM 0 HA PRO A 4 81.266 3.213 11.216 1.00 10.00 H new ATOM 0 HB2 PRO A 4 81.565 4.247 8.714 1.00 10.00 H new ATOM 0 HB3 PRO A 4 82.958 4.127 9.772 1.00 10.00 H new ATOM 0 HG2 PRO A 4 82.131 2.240 7.519 1.00 10.00 H new ATOM 0 HG3 PRO A 4 83.732 2.844 7.893 1.00 10.00 H new ATOM 0 HD2 PRO A 4 82.877 0.359 8.736 1.00 10.00 H new ATOM 0 HD3 PRO A 4 84.062 1.288 9.633 1.00 10.00 H new ATOM 59 N PRO A 5 79.004 3.454 9.987 1.00 10.00 N ATOM 60 CA PRO A 5 77.638 3.397 9.464 1.00 10.00 C ATOM 61 C PRO A 5 77.589 3.597 7.940 1.00 10.00 C ATOM 62 O PRO A 5 78.490 4.189 7.336 1.00 10.00 O ATOM 63 CB PRO A 5 76.879 4.513 10.191 1.00 10.00 C ATOM 64 CG PRO A 5 77.967 5.542 10.498 1.00 10.00 C ATOM 65 CD PRO A 5 79.205 4.682 10.747 1.00 10.00 C ATOM 0 HA PRO A 5 77.194 2.417 9.638 1.00 10.00 H new ATOM 0 HB2 PRO A 5 76.091 4.935 9.567 1.00 10.00 H new ATOM 0 HB3 PRO A 5 76.403 4.148 11.101 1.00 10.00 H new ATOM 0 HG2 PRO A 5 78.116 6.230 9.666 1.00 10.00 H new ATOM 0 HG3 PRO A 5 77.715 6.146 11.370 1.00 10.00 H new ATOM 0 HD2 PRO A 5 80.109 5.197 10.423 1.00 10.00 H new ATOM 0 HD3 PRO A 5 79.324 4.468 11.809 1.00 10.00 H new ATOM 73 N THR A 6 76.491 3.152 7.326 1.00 10.00 N ATOM 74 CA THR A 6 76.196 3.300 5.889 1.00 10.00 C ATOM 75 C THR A 6 74.713 3.634 5.647 1.00 10.00 C ATOM 76 O THR A 6 73.875 3.412 6.531 1.00 10.00 O ATOM 77 CB THR A 6 76.601 2.052 5.084 1.00 10.00 C ATOM 78 OG1 THR A 6 75.922 0.901 5.545 1.00 10.00 O ATOM 79 CG2 THR A 6 78.103 1.761 5.135 1.00 10.00 C ATOM 0 H THR A 6 75.753 2.660 7.829 1.00 10.00 H new ATOM 0 HA THR A 6 76.799 4.136 5.534 1.00 10.00 H new ATOM 0 HB THR A 6 76.324 2.278 4.054 1.00 10.00 H new ATOM 0 HG1 THR A 6 76.197 0.124 5.015 1.00 10.00 H new ATOM 0 HG21 THR A 6 78.321 0.869 4.548 1.00 10.00 H new ATOM 0 HG22 THR A 6 78.652 2.609 4.725 1.00 10.00 H new ATOM 0 HG23 THR A 6 78.407 1.598 6.169 1.00 10.00 H new ATOM 87 N PRO A 7 74.379 4.223 4.480 1.00 10.00 N ATOM 88 CA PRO A 7 73.020 4.619 4.101 1.00 10.00 C ATOM 89 C PRO A 7 71.967 3.501 4.191 1.00 10.00 C ATOM 90 O PRO A 7 72.282 2.316 4.073 1.00 10.00 O ATOM 91 CB PRO A 7 73.138 5.139 2.662 1.00 10.00 C ATOM 92 CG PRO A 7 74.582 5.619 2.562 1.00 10.00 C ATOM 93 CD PRO A 7 75.323 4.630 3.449 1.00 10.00 C ATOM 0 HA PRO A 7 72.657 5.367 4.806 1.00 10.00 H new ATOM 0 HB2 PRO A 7 72.927 4.355 1.935 1.00 10.00 H new ATOM 0 HB3 PRO A 7 72.434 5.949 2.471 1.00 10.00 H new ATOM 0 HG2 PRO A 7 74.947 5.595 1.535 1.00 10.00 H new ATOM 0 HG3 PRO A 7 74.694 6.644 2.916 1.00 10.00 H new ATOM 0 HD2 PRO A 7 75.665 3.770 2.873 1.00 10.00 H new ATOM 0 HD3 PRO A 7 76.207 5.090 3.890 1.00 10.00 H new ATOM 101 N LEU A 8 70.695 3.898 4.307 1.00 10.00 N ATOM 102 CA LEU A 8 69.514 3.018 4.390 1.00 10.00 C ATOM 103 C LEU A 8 68.516 3.307 3.245 1.00 10.00 C ATOM 104 O LEU A 8 67.297 3.244 3.419 1.00 10.00 O ATOM 105 CB LEU A 8 68.873 3.139 5.790 1.00 10.00 C ATOM 106 CG LEU A 8 69.757 2.707 6.977 1.00 10.00 C ATOM 107 CD1 LEU A 8 68.975 2.893 8.278 1.00 10.00 C ATOM 108 CD2 LEU A 8 70.186 1.240 6.887 1.00 10.00 C ATOM 0 H LEU A 8 70.445 4.886 4.348 1.00 10.00 H new ATOM 0 HA LEU A 8 69.826 1.982 4.258 1.00 10.00 H new ATOM 0 HB2 LEU A 8 68.575 4.176 5.943 1.00 10.00 H new ATOM 0 HB3 LEU A 8 67.962 2.540 5.804 1.00 10.00 H new ATOM 0 HG LEU A 8 70.653 3.327 6.952 1.00 10.00 H new ATOM 0 HD11 LEU A 8 69.595 2.589 9.122 1.00 10.00 H new ATOM 0 HD12 LEU A 8 68.699 3.941 8.390 1.00 10.00 H new ATOM 0 HD13 LEU A 8 68.073 2.281 8.251 1.00 10.00 H new ATOM 0 HD21 LEU A 8 70.806 0.989 7.747 1.00 10.00 H new ATOM 0 HD22 LEU A 8 69.302 0.602 6.878 1.00 10.00 H new ATOM 0 HD23 LEU A 8 70.756 1.083 5.971 1.00 10.00 H new ATOM 120 N LEU A 9 69.044 3.676 2.071 1.00 10.00 N ATOM 121 CA LEU A 9 68.287 4.138 0.894 1.00 10.00 C ATOM 122 C LEU A 9 67.326 3.082 0.293 1.00 10.00 C ATOM 123 O LEU A 9 66.406 3.440 -0.445 1.00 10.00 O ATOM 124 CB LEU A 9 69.313 4.661 -0.134 1.00 10.00 C ATOM 125 CG LEU A 9 68.747 5.476 -1.317 1.00 10.00 C ATOM 126 CD1 LEU A 9 67.994 6.728 -0.860 1.00 10.00 C ATOM 127 CD2 LEU A 9 69.901 5.932 -2.213 1.00 10.00 C ATOM 0 H LEU A 9 70.050 3.661 1.906 1.00 10.00 H new ATOM 0 HA LEU A 9 67.610 4.934 1.204 1.00 10.00 H new ATOM 0 HB2 LEU A 9 70.038 5.282 0.393 1.00 10.00 H new ATOM 0 HB3 LEU A 9 69.858 3.807 -0.537 1.00 10.00 H new ATOM 0 HG LEU A 9 68.051 4.825 -1.847 1.00 10.00 H new ATOM 0 HD11 LEU A 9 67.617 7.264 -1.731 1.00 10.00 H new ATOM 0 HD12 LEU A 9 67.159 6.438 -0.223 1.00 10.00 H new ATOM 0 HD13 LEU A 9 68.670 7.375 -0.300 1.00 10.00 H new ATOM 0 HD21 LEU A 9 69.506 6.508 -3.050 1.00 10.00 H new ATOM 0 HD22 LEU A 9 70.586 6.553 -1.636 1.00 10.00 H new ATOM 0 HD23 LEU A 9 70.434 5.060 -2.592 1.00 10.00 H new ATOM 139 N ALA A 10 67.505 1.799 0.628 1.00 10.00 N ATOM 140 CA ALA A 10 66.604 0.694 0.283 1.00 10.00 C ATOM 141 C ALA A 10 66.607 -0.403 1.369 1.00 10.00 C ATOM 142 O ALA A 10 67.545 -0.506 2.164 1.00 10.00 O ATOM 143 CB ALA A 10 67.033 0.122 -1.077 1.00 10.00 C ATOM 0 H ALA A 10 68.313 1.490 1.168 1.00 10.00 H new ATOM 0 HA ALA A 10 65.583 1.070 0.222 1.00 10.00 H new ATOM 0 HB1 ALA A 10 66.373 -0.702 -1.350 1.00 10.00 H new ATOM 0 HB2 ALA A 10 66.972 0.902 -1.836 1.00 10.00 H new ATOM 0 HB3 ALA A 10 68.059 -0.241 -1.012 1.00 10.00 H new ATOM 149 N ASP A 11 65.580 -1.259 1.382 1.00 10.00 N ATOM 150 CA ASP A 11 65.412 -2.348 2.366 1.00 10.00 C ATOM 151 C ASP A 11 66.569 -3.366 2.374 1.00 10.00 C ATOM 152 O ASP A 11 66.855 -3.973 3.408 1.00 10.00 O ATOM 153 CB ASP A 11 64.087 -3.080 2.110 1.00 10.00 C ATOM 154 CG ASP A 11 62.868 -2.174 2.353 1.00 10.00 C ATOM 155 OD1 ASP A 11 62.465 -2.003 3.528 1.00 10.00 O ATOM 156 OD2 ASP A 11 62.309 -1.635 1.367 1.00 10.00 O ATOM 0 H ASP A 11 64.824 -1.218 0.698 1.00 10.00 H new ATOM 0 HA ASP A 11 65.410 -1.874 3.347 1.00 10.00 H new ATOM 0 HB2 ASP A 11 64.068 -3.445 1.083 1.00 10.00 H new ATOM 0 HB3 ASP A 11 64.024 -3.953 2.760 1.00 10.00 H new ATOM 161 N TYR A 12 67.280 -3.510 1.251 1.00 10.00 N ATOM 162 CA TYR A 12 68.486 -4.340 1.116 1.00 10.00 C ATOM 163 C TYR A 12 69.631 -3.932 2.068 1.00 10.00 C ATOM 164 O TYR A 12 70.521 -4.736 2.346 1.00 10.00 O ATOM 165 CB TYR A 12 68.964 -4.294 -0.344 1.00 10.00 C ATOM 166 CG TYR A 12 67.892 -4.622 -1.372 1.00 10.00 C ATOM 167 CD1 TYR A 12 67.314 -5.906 -1.401 1.00 10.00 C ATOM 168 CD2 TYR A 12 67.461 -3.637 -2.284 1.00 10.00 C ATOM 169 CE1 TYR A 12 66.300 -6.205 -2.333 1.00 10.00 C ATOM 170 CE2 TYR A 12 66.448 -3.932 -3.218 1.00 10.00 C ATOM 171 CZ TYR A 12 65.863 -5.218 -3.244 1.00 10.00 C ATOM 172 OH TYR A 12 64.882 -5.514 -4.141 1.00 10.00 O ATOM 0 H TYR A 12 67.026 -3.038 0.383 1.00 10.00 H new ATOM 0 HA TYR A 12 68.211 -5.355 1.402 1.00 10.00 H new ATOM 0 HB2 TYR A 12 69.357 -3.299 -0.553 1.00 10.00 H new ATOM 0 HB3 TYR A 12 69.790 -4.994 -0.464 1.00 10.00 H new ATOM 0 HD1 TYR A 12 67.649 -6.663 -0.707 1.00 10.00 H new ATOM 0 HD2 TYR A 12 67.908 -2.654 -2.267 1.00 10.00 H new ATOM 0 HE1 TYR A 12 65.857 -7.190 -2.351 1.00 10.00 H new ATOM 0 HE2 TYR A 12 66.119 -3.175 -3.914 1.00 10.00 H new ATOM 0 HH TYR A 12 64.696 -4.727 -4.694 1.00 10.00 H new ATOM 182 N GLU A 13 69.599 -2.705 2.603 1.00 10.00 N ATOM 183 CA GLU A 13 70.566 -2.188 3.583 1.00 10.00 C ATOM 184 C GLU A 13 70.122 -2.398 5.050 1.00 10.00 C ATOM 185 O GLU A 13 70.884 -2.102 5.972 1.00 10.00 O ATOM 186 CB GLU A 13 70.804 -0.689 3.324 1.00 10.00 C ATOM 187 CG GLU A 13 71.170 -0.325 1.873 1.00 10.00 C ATOM 188 CD GLU A 13 72.375 -1.126 1.334 1.00 10.00 C ATOM 189 OE1 GLU A 13 73.470 -1.086 1.946 1.00 10.00 O ATOM 190 OE2 GLU A 13 72.241 -1.789 0.277 1.00 10.00 O ATOM 0 H GLU A 13 68.880 -2.024 2.360 1.00 10.00 H new ATOM 0 HA GLU A 13 71.487 -2.755 3.450 1.00 10.00 H new ATOM 0 HB2 GLU A 13 69.904 -0.141 3.603 1.00 10.00 H new ATOM 0 HB3 GLU A 13 71.603 -0.345 3.981 1.00 10.00 H new ATOM 0 HG2 GLU A 13 70.307 -0.502 1.231 1.00 10.00 H new ATOM 0 HG3 GLU A 13 71.395 0.740 1.817 1.00 10.00 H new ATOM 197 N TRP A 14 68.907 -2.918 5.279 1.00 10.00 N ATOM 198 CA TRP A 14 68.254 -3.012 6.598 1.00 10.00 C ATOM 199 C TRP A 14 67.726 -4.425 6.932 1.00 10.00 C ATOM 200 O TRP A 14 67.234 -4.669 8.034 1.00 10.00 O ATOM 201 CB TRP A 14 67.139 -1.952 6.657 1.00 10.00 C ATOM 202 CG TRP A 14 66.636 -1.603 8.028 1.00 10.00 C ATOM 203 CD1 TRP A 14 67.228 -0.734 8.878 1.00 10.00 C ATOM 204 CD2 TRP A 14 65.457 -2.107 8.735 1.00 10.00 C ATOM 205 NE1 TRP A 14 66.504 -0.660 10.052 1.00 10.00 N ATOM 206 CE2 TRP A 14 65.406 -1.493 10.024 1.00 10.00 C ATOM 207 CE3 TRP A 14 64.435 -3.035 8.428 1.00 10.00 C ATOM 208 CZ2 TRP A 14 64.406 -1.789 10.962 1.00 10.00 C ATOM 209 CZ3 TRP A 14 63.428 -3.341 9.364 1.00 10.00 C ATOM 210 CH2 TRP A 14 63.412 -2.724 10.628 1.00 10.00 C ATOM 0 H TRP A 14 68.331 -3.298 4.528 1.00 10.00 H new ATOM 0 HA TRP A 14 69.002 -2.817 7.366 1.00 10.00 H new ATOM 0 HB2 TRP A 14 67.505 -1.041 6.183 1.00 10.00 H new ATOM 0 HB3 TRP A 14 66.297 -2.305 6.061 1.00 10.00 H new ATOM 0 HD1 TRP A 14 68.132 -0.181 8.670 1.00 10.00 H new ATOM 0 HE1 TRP A 14 66.751 -0.063 10.841 1.00 10.00 H new ATOM 0 HE3 TRP A 14 64.427 -3.516 7.461 1.00 10.00 H new ATOM 0 HZ2 TRP A 14 64.400 -1.305 11.927 1.00 10.00 H new ATOM 0 HZ3 TRP A 14 62.660 -4.057 9.109 1.00 10.00 H new ATOM 0 HH2 TRP A 14 62.638 -2.968 11.340 1.00 10.00 H new ATOM 221 N SER A 15 67.863 -5.388 6.013 1.00 10.00 N ATOM 222 CA SER A 15 67.391 -6.778 6.152 1.00 10.00 C ATOM 223 C SER A 15 67.888 -7.516 7.410 1.00 10.00 C ATOM 224 O SER A 15 67.197 -8.399 7.925 1.00 10.00 O ATOM 225 CB SER A 15 67.757 -7.575 4.895 1.00 10.00 C ATOM 226 OG SER A 15 69.164 -7.577 4.697 1.00 10.00 O ATOM 0 H SER A 15 68.322 -5.218 5.118 1.00 10.00 H new ATOM 0 HA SER A 15 66.310 -6.709 6.272 1.00 10.00 H new ATOM 0 HB2 SER A 15 67.396 -8.599 4.989 1.00 10.00 H new ATOM 0 HB3 SER A 15 67.262 -7.141 4.026 1.00 10.00 H new ATOM 0 HG SER A 15 69.380 -8.092 3.891 1.00 10.00 H new ATOM 232 N GLY A 16 69.042 -7.122 7.958 1.00 10.00 N ATOM 233 CA GLY A 16 69.583 -7.633 9.225 1.00 10.00 C ATOM 234 C GLY A 16 68.743 -7.302 10.464 1.00 10.00 C ATOM 235 O GLY A 16 68.725 -8.079 11.416 1.00 10.00 O ATOM 0 H GLY A 16 69.642 -6.421 7.523 1.00 10.00 H new ATOM 0 HA2 GLY A 16 69.683 -8.716 9.150 1.00 10.00 H new ATOM 0 HA3 GLY A 16 70.586 -7.229 9.365 1.00 10.00 H new ATOM 239 N TYR A 17 68.015 -6.185 10.440 1.00 10.00 N ATOM 240 CA TYR A 17 67.019 -5.815 11.459 1.00 10.00 C ATOM 241 C TYR A 17 65.636 -6.413 11.161 1.00 10.00 C ATOM 242 O TYR A 17 64.916 -6.814 12.078 1.00 10.00 O ATOM 243 CB TYR A 17 66.912 -4.288 11.543 1.00 10.00 C ATOM 244 CG TYR A 17 68.193 -3.578 11.935 1.00 10.00 C ATOM 245 CD1 TYR A 17 68.556 -3.476 13.292 1.00 10.00 C ATOM 246 CD2 TYR A 17 69.019 -3.012 10.943 1.00 10.00 C ATOM 247 CE1 TYR A 17 69.741 -2.807 13.659 1.00 10.00 C ATOM 248 CE2 TYR A 17 70.204 -2.343 11.304 1.00 10.00 C ATOM 249 CZ TYR A 17 70.568 -2.238 12.665 1.00 10.00 C ATOM 250 OH TYR A 17 71.710 -1.590 13.029 1.00 10.00 O ATOM 0 H TYR A 17 68.100 -5.493 9.696 1.00 10.00 H new ATOM 0 HA TYR A 17 67.356 -6.222 12.412 1.00 10.00 H new ATOM 0 HB2 TYR A 17 66.585 -3.908 10.575 1.00 10.00 H new ATOM 0 HB3 TYR A 17 66.137 -4.032 12.265 1.00 10.00 H new ATOM 0 HD1 TYR A 17 67.925 -3.911 14.053 1.00 10.00 H new ATOM 0 HD2 TYR A 17 68.742 -3.092 9.902 1.00 10.00 H new ATOM 0 HE1 TYR A 17 70.017 -2.729 14.700 1.00 10.00 H new ATOM 0 HE2 TYR A 17 70.834 -1.910 10.541 1.00 10.00 H new ATOM 0 HH TYR A 17 72.167 -1.257 12.228 1.00 10.00 H new ATOM 260 N LEU A 18 65.276 -6.544 9.879 1.00 10.00 N ATOM 261 CA LEU A 18 63.995 -7.107 9.425 1.00 10.00 C ATOM 262 C LEU A 18 63.731 -8.548 9.930 1.00 10.00 C ATOM 263 O LEU A 18 62.582 -8.980 10.019 1.00 10.00 O ATOM 264 CB LEU A 18 63.947 -7.012 7.887 1.00 10.00 C ATOM 265 CG LEU A 18 62.601 -7.358 7.217 1.00 10.00 C ATOM 266 CD1 LEU A 18 61.464 -6.428 7.645 1.00 10.00 C ATOM 267 CD2 LEU A 18 62.754 -7.246 5.699 1.00 10.00 C ATOM 0 H LEU A 18 65.880 -6.255 9.109 1.00 10.00 H new ATOM 0 HA LEU A 18 63.187 -6.521 9.863 1.00 10.00 H new ATOM 0 HB2 LEU A 18 64.220 -5.997 7.599 1.00 10.00 H new ATOM 0 HB3 LEU A 18 64.711 -7.675 7.480 1.00 10.00 H new ATOM 0 HG LEU A 18 62.345 -8.371 7.528 1.00 10.00 H new ATOM 0 HD11 LEU A 18 60.544 -6.722 7.140 1.00 10.00 H new ATOM 0 HD12 LEU A 18 61.324 -6.497 8.724 1.00 10.00 H new ATOM 0 HD13 LEU A 18 61.713 -5.401 7.376 1.00 10.00 H new ATOM 0 HD21 LEU A 18 61.806 -7.489 5.219 1.00 10.00 H new ATOM 0 HD22 LEU A 18 63.043 -6.228 5.437 1.00 10.00 H new ATOM 0 HD23 LEU A 18 63.522 -7.941 5.358 1.00 10.00 H new ATOM 279 N THR A 19 64.792 -9.253 10.330 1.00 10.00 N ATOM 280 CA THR A 19 64.816 -10.569 11.001 1.00 10.00 C ATOM 281 C THR A 19 63.815 -10.758 12.163 1.00 10.00 C ATOM 282 O THR A 19 63.304 -11.861 12.375 1.00 10.00 O ATOM 283 CB THR A 19 66.254 -10.803 11.509 1.00 10.00 C ATOM 284 OG1 THR A 19 66.454 -12.158 11.847 1.00 10.00 O ATOM 285 CG2 THR A 19 66.575 -9.944 12.739 1.00 10.00 C ATOM 0 H THR A 19 65.736 -8.895 10.184 1.00 10.00 H new ATOM 0 HA THR A 19 64.498 -11.300 10.258 1.00 10.00 H new ATOM 0 HB THR A 19 66.919 -10.518 10.694 1.00 10.00 H new ATOM 0 HG1 THR A 19 67.372 -12.284 12.165 1.00 10.00 H new ATOM 0 HG21 THR A 19 67.597 -10.140 13.063 1.00 10.00 H new ATOM 0 HG22 THR A 19 66.472 -8.889 12.483 1.00 10.00 H new ATOM 0 HG23 THR A 19 65.885 -10.191 13.546 1.00 10.00 H new ATOM 293 N GLY A 20 63.529 -9.693 12.924 1.00 10.00 N ATOM 294 CA GLY A 20 62.761 -9.741 14.181 1.00 10.00 C ATOM 295 C GLY A 20 62.437 -8.348 14.729 1.00 10.00 C ATOM 296 O GLY A 20 61.274 -8.058 15.011 1.00 10.00 O ATOM 0 H GLY A 20 63.831 -8.750 12.679 1.00 10.00 H new ATOM 0 HA2 GLY A 20 61.832 -10.286 14.014 1.00 10.00 H new ATOM 0 HA3 GLY A 20 63.328 -10.298 14.927 1.00 10.00 H new ATOM 300 N ILE A 21 63.431 -7.445 14.778 1.00 10.00 N ATOM 301 CA ILE A 21 63.214 -6.003 15.051 1.00 10.00 C ATOM 302 C ILE A 21 62.207 -5.451 14.024 1.00 10.00 C ATOM 303 O ILE A 21 61.357 -4.618 14.333 1.00 10.00 O ATOM 304 CB ILE A 21 64.543 -5.213 14.989 1.00 10.00 C ATOM 305 CG1 ILE A 21 65.696 -5.856 15.797 1.00 10.00 C ATOM 306 CG2 ILE A 21 64.337 -3.756 15.439 1.00 10.00 C ATOM 307 CD1 ILE A 21 65.414 -6.072 17.292 1.00 10.00 C ATOM 0 H ILE A 21 64.410 -7.689 14.630 1.00 10.00 H new ATOM 0 HA ILE A 21 62.816 -5.886 16.059 1.00 10.00 H new ATOM 0 HB ILE A 21 64.847 -5.239 13.942 1.00 10.00 H new ATOM 0 HG12 ILE A 21 65.939 -6.819 15.348 1.00 10.00 H new ATOM 0 HG13 ILE A 21 66.581 -5.227 15.699 1.00 10.00 H new ATOM 0 HG21 ILE A 21 65.285 -3.221 15.387 1.00 10.00 H new ATOM 0 HG22 ILE A 21 63.611 -3.272 14.785 1.00 10.00 H new ATOM 0 HG23 ILE A 21 63.968 -3.741 16.465 1.00 10.00 H new ATOM 0 HD11 ILE A 21 66.285 -6.527 17.764 1.00 10.00 H new ATOM 0 HD12 ILE A 21 65.204 -5.113 17.765 1.00 10.00 H new ATOM 0 HD13 ILE A 21 64.553 -6.730 17.408 1.00 10.00 H new ATOM 319 N GLY A 22 62.266 -6.025 12.818 1.00 10.00 N ATOM 320 CA GLY A 22 61.350 -5.924 11.689 1.00 10.00 C ATOM 321 C GLY A 22 59.851 -5.867 12.019 1.00 10.00 C ATOM 322 O GLY A 22 59.103 -5.191 11.311 1.00 10.00 O ATOM 0 H GLY A 22 63.047 -6.640 12.589 1.00 10.00 H new ATOM 0 HA2 GLY A 22 61.607 -5.030 11.121 1.00 10.00 H new ATOM 0 HA3 GLY A 22 61.522 -6.778 11.034 1.00 10.00 H new ATOM 326 N ARG A 23 59.418 -6.529 13.105 1.00 10.00 N ATOM 327 CA ARG A 23 58.024 -6.544 13.602 1.00 10.00 C ATOM 328 C ARG A 23 57.833 -5.973 15.013 1.00 10.00 C ATOM 329 O ARG A 23 56.726 -6.010 15.543 1.00 10.00 O ATOM 330 CB ARG A 23 57.408 -7.948 13.455 1.00 10.00 C ATOM 331 CG ARG A 23 58.040 -9.017 14.364 1.00 10.00 C ATOM 332 CD ARG A 23 57.180 -10.282 14.323 1.00 10.00 C ATOM 333 NE ARG A 23 57.796 -11.398 15.071 1.00 10.00 N ATOM 334 CZ ARG A 23 57.753 -12.681 14.748 1.00 10.00 C ATOM 335 NH1 ARG A 23 57.089 -13.139 13.731 1.00 10.00 N ATOM 336 NH2 ARG A 23 58.396 -13.572 15.443 1.00 10.00 N ATOM 0 H ARG A 23 60.046 -7.088 13.683 1.00 10.00 H new ATOM 0 HA ARG A 23 57.477 -5.851 12.962 1.00 10.00 H new ATOM 0 HB2 ARG A 23 56.341 -7.888 13.672 1.00 10.00 H new ATOM 0 HB3 ARG A 23 57.505 -8.267 12.417 1.00 10.00 H new ATOM 0 HG2 ARG A 23 59.054 -9.241 14.032 1.00 10.00 H new ATOM 0 HG3 ARG A 23 58.114 -8.646 15.386 1.00 10.00 H new ATOM 0 HD2 ARG A 23 56.197 -10.065 14.741 1.00 10.00 H new ATOM 0 HD3 ARG A 23 57.027 -10.582 13.286 1.00 10.00 H new ATOM 0 HE ARG A 23 58.305 -11.155 15.921 1.00 10.00 H new ATOM 0 HH11 ARG A 23 56.565 -12.499 13.134 1.00 10.00 H new ATOM 0 HH12 ARG A 23 57.091 -14.139 13.529 1.00 10.00 H new ATOM 0 HH21 ARG A 23 58.946 -13.287 16.253 1.00 10.00 H new ATOM 0 HH22 ARG A 23 58.350 -14.556 15.178 1.00 10.00 H new ATOM 350 N ALA A 24 58.867 -5.402 15.631 1.00 10.00 N ATOM 351 CA ALA A 24 58.705 -4.646 16.878 1.00 10.00 C ATOM 352 C ALA A 24 57.998 -3.294 16.674 1.00 10.00 C ATOM 353 O ALA A 24 57.501 -2.699 17.631 1.00 10.00 O ATOM 354 CB ALA A 24 60.070 -4.501 17.562 1.00 10.00 C ATOM 0 H ALA A 24 59.827 -5.447 15.290 1.00 10.00 H new ATOM 0 HA ALA A 24 58.041 -5.207 17.536 1.00 10.00 H new ATOM 0 HB1 ALA A 24 59.955 -3.940 18.489 1.00 10.00 H new ATOM 0 HB2 ALA A 24 60.473 -5.489 17.784 1.00 10.00 H new ATOM 0 HB3 ALA A 24 60.754 -3.971 16.900 1.00 10.00 H new ATOM 360 N PHE A 25 57.876 -2.846 15.420 1.00 10.00 N ATOM 361 CA PHE A 25 57.040 -1.709 15.027 1.00 10.00 C ATOM 362 C PHE A 25 55.542 -2.091 14.912 1.00 10.00 C ATOM 363 O PHE A 25 54.706 -1.279 14.513 1.00 10.00 O ATOM 364 CB PHE A 25 57.591 -1.121 13.717 1.00 10.00 C ATOM 365 CG PHE A 25 59.040 -0.672 13.812 1.00 10.00 C ATOM 366 CD1 PHE A 25 59.349 0.602 14.328 1.00 10.00 C ATOM 367 CD2 PHE A 25 60.082 -1.538 13.427 1.00 10.00 C ATOM 368 CE1 PHE A 25 60.691 1.007 14.457 1.00 10.00 C ATOM 369 CE2 PHE A 25 61.423 -1.136 13.570 1.00 10.00 C ATOM 370 CZ PHE A 25 61.728 0.137 14.081 1.00 10.00 C ATOM 0 H PHE A 25 58.366 -3.273 14.634 1.00 10.00 H new ATOM 0 HA PHE A 25 57.084 -0.949 15.807 1.00 10.00 H new ATOM 0 HB2 PHE A 25 57.502 -1.868 12.928 1.00 10.00 H new ATOM 0 HB3 PHE A 25 56.975 -0.271 13.423 1.00 10.00 H new ATOM 0 HD1 PHE A 25 58.554 1.270 14.625 1.00 10.00 H new ATOM 0 HD2 PHE A 25 59.851 -2.512 13.021 1.00 10.00 H new ATOM 0 HE1 PHE A 25 60.924 1.988 14.845 1.00 10.00 H new ATOM 0 HE2 PHE A 25 62.220 -1.808 13.286 1.00 10.00 H new ATOM 0 HZ PHE A 25 62.758 0.446 14.184 1.00 10.00 H new ATOM 380 N ASP A 26 55.202 -3.329 15.286 1.00 10.00 N ATOM 381 CA ASP A 26 53.888 -3.976 15.222 1.00 10.00 C ATOM 382 C ASP A 26 53.597 -4.699 16.557 1.00 10.00 C ATOM 383 O ASP A 26 52.997 -5.769 16.588 1.00 10.00 O ATOM 384 CB ASP A 26 53.883 -4.964 14.042 1.00 10.00 C ATOM 385 CG ASP A 26 54.099 -4.281 12.686 1.00 10.00 C ATOM 386 OD1 ASP A 26 53.096 -3.833 12.082 1.00 10.00 O ATOM 387 OD2 ASP A 26 55.248 -4.240 12.189 1.00 10.00 O ATOM 0 H ASP A 26 55.902 -3.960 15.676 1.00 10.00 H new ATOM 0 HA ASP A 26 53.105 -3.234 15.066 1.00 10.00 H new ATOM 0 HB2 ASP A 26 54.664 -5.709 14.196 1.00 10.00 H new ATOM 0 HB3 ASP A 26 52.933 -5.498 14.026 1.00 10.00 H new ATOM 392 N ASP A 27 54.069 -4.145 17.678 1.00 10.00 N ATOM 393 CA ASP A 27 54.097 -4.767 19.014 1.00 10.00 C ATOM 394 C ASP A 27 52.757 -5.328 19.553 1.00 10.00 C ATOM 395 O ASP A 27 52.770 -6.234 20.388 1.00 10.00 O ATOM 396 CB ASP A 27 54.725 -3.755 19.983 1.00 10.00 C ATOM 397 CG ASP A 27 55.032 -4.359 21.362 1.00 10.00 C ATOM 398 OD1 ASP A 27 55.976 -5.180 21.456 1.00 10.00 O ATOM 399 OD2 ASP A 27 54.359 -3.992 22.354 1.00 10.00 O ATOM 0 H ASP A 27 54.462 -3.204 17.683 1.00 10.00 H new ATOM 0 HA ASP A 27 54.696 -5.673 18.923 1.00 10.00 H new ATOM 0 HB2 ASP A 27 55.646 -3.367 19.549 1.00 10.00 H new ATOM 0 HB3 ASP A 27 54.049 -2.909 20.105 1.00 10.00 H new ATOM 404 N GLY A 28 51.608 -4.862 19.044 1.00 10.00 N ATOM 405 CA GLY A 28 50.269 -5.389 19.371 1.00 10.00 C ATOM 406 C GLY A 28 49.692 -6.387 18.353 1.00 10.00 C ATOM 407 O GLY A 28 48.576 -6.873 18.543 1.00 10.00 O ATOM 0 H GLY A 28 51.580 -4.090 18.378 1.00 10.00 H new ATOM 0 HA2 GLY A 28 50.315 -5.875 20.346 1.00 10.00 H new ATOM 0 HA3 GLY A 28 49.579 -4.550 19.465 1.00 10.00 H new ATOM 411 N VAL A 29 50.444 -6.720 17.295 1.00 10.00 N ATOM 412 CA VAL A 29 50.076 -7.694 16.242 1.00 10.00 C ATOM 413 C VAL A 29 51.193 -8.707 15.953 1.00 10.00 C ATOM 414 O VAL A 29 50.949 -9.714 15.286 1.00 10.00 O ATOM 415 CB VAL A 29 49.622 -7.017 14.925 1.00 10.00 C ATOM 416 CG1 VAL A 29 48.673 -7.953 14.162 1.00 10.00 C ATOM 417 CG2 VAL A 29 48.890 -5.683 15.130 1.00 10.00 C ATOM 0 H VAL A 29 51.363 -6.306 17.137 1.00 10.00 H new ATOM 0 HA VAL A 29 49.224 -8.237 16.651 1.00 10.00 H new ATOM 0 HB VAL A 29 50.537 -6.814 14.369 1.00 10.00 H new ATOM 0 HG11 VAL A 29 48.356 -7.473 13.236 1.00 10.00 H new ATOM 0 HG12 VAL A 29 49.189 -8.884 13.930 1.00 10.00 H new ATOM 0 HG13 VAL A 29 47.799 -8.166 14.778 1.00 10.00 H new ATOM 0 HG21 VAL A 29 48.605 -5.272 14.162 1.00 10.00 H new ATOM 0 HG22 VAL A 29 47.996 -5.847 15.732 1.00 10.00 H new ATOM 0 HG23 VAL A 29 49.549 -4.981 15.642 1.00 10.00 H new ATOM 427 N LYS A 30 52.398 -8.524 16.515 1.00 10.00 N ATOM 428 CA LYS A 30 53.482 -9.524 16.494 1.00 10.00 C ATOM 429 C LYS A 30 53.013 -10.910 16.957 1.00 10.00 C ATOM 430 O LYS A 30 53.496 -11.919 16.459 1.00 10.00 O ATOM 431 CB LYS A 30 54.705 -9.027 17.297 1.00 10.00 C ATOM 432 CG LYS A 30 54.475 -9.008 18.819 1.00 10.00 C ATOM 433 CD LYS A 30 55.696 -8.491 19.590 1.00 10.00 C ATOM 434 CE LYS A 30 55.391 -8.525 21.093 1.00 10.00 C ATOM 435 NZ LYS A 30 56.455 -7.863 21.888 1.00 10.00 N ATOM 0 H LYS A 30 52.652 -7.666 17.004 1.00 10.00 H new ATOM 0 HA LYS A 30 53.791 -9.644 15.456 1.00 10.00 H new ATOM 0 HB2 LYS A 30 55.559 -9.666 17.075 1.00 10.00 H new ATOM 0 HB3 LYS A 30 54.964 -8.022 16.964 1.00 10.00 H new ATOM 0 HG2 LYS A 30 53.613 -8.380 19.045 1.00 10.00 H new ATOM 0 HG3 LYS A 30 54.234 -10.015 19.160 1.00 10.00 H new ATOM 0 HD2 LYS A 30 56.568 -9.106 19.369 1.00 10.00 H new ATOM 0 HD3 LYS A 30 55.935 -7.475 19.278 1.00 10.00 H new ATOM 0 HE2 LYS A 30 54.437 -8.032 21.281 1.00 10.00 H new ATOM 0 HE3 LYS A 30 55.285 -9.560 21.419 1.00 10.00 H new ATOM 0 HZ1 LYS A 30 56.372 -8.148 22.885 1.00 10.00 H new ATOM 0 HZ2 LYS A 30 57.387 -8.145 21.524 1.00 10.00 H new ATOM 0 HZ3 LYS A 30 56.352 -6.831 21.814 1.00 10.00 H new ATOM 449 N ASP A 31 52.019 -10.947 17.847 1.00 10.00 N ATOM 450 CA ASP A 31 51.303 -12.145 18.291 1.00 10.00 C ATOM 451 C ASP A 31 50.653 -12.921 17.136 1.00 10.00 C ATOM 452 O ASP A 31 50.929 -14.101 16.923 1.00 10.00 O ATOM 453 CB ASP A 31 50.233 -11.697 19.298 1.00 10.00 C ATOM 454 CG ASP A 31 49.528 -12.907 19.942 1.00 10.00 C ATOM 455 OD1 ASP A 31 48.655 -13.523 19.286 1.00 10.00 O ATOM 456 OD2 ASP A 31 49.858 -13.248 21.104 1.00 10.00 O ATOM 0 H ASP A 31 51.675 -10.100 18.300 1.00 10.00 H new ATOM 0 HA ASP A 31 52.019 -12.831 18.744 1.00 10.00 H new ATOM 0 HB2 ASP A 31 50.694 -11.087 20.074 1.00 10.00 H new ATOM 0 HB3 ASP A 31 49.497 -11.070 18.795 1.00 10.00 H new ATOM 461 N LEU A 32 49.820 -12.237 16.355 1.00 10.00 N ATOM 462 CA LEU A 32 49.091 -12.795 15.219 1.00 10.00 C ATOM 463 C LEU A 32 50.063 -13.150 14.081 1.00 10.00 C ATOM 464 O LEU A 32 49.936 -14.184 13.429 1.00 10.00 O ATOM 465 CB LEU A 32 48.047 -11.744 14.797 1.00 10.00 C ATOM 466 CG LEU A 32 46.708 -12.309 14.289 1.00 10.00 C ATOM 467 CD1 LEU A 32 45.810 -11.144 13.867 1.00 10.00 C ATOM 468 CD2 LEU A 32 46.871 -13.265 13.110 1.00 10.00 C ATOM 0 H LEU A 32 49.628 -11.246 16.501 1.00 10.00 H new ATOM 0 HA LEU A 32 48.586 -13.724 15.482 1.00 10.00 H new ATOM 0 HB2 LEU A 32 47.847 -11.093 15.648 1.00 10.00 H new ATOM 0 HB3 LEU A 32 48.480 -11.121 14.014 1.00 10.00 H new ATOM 0 HG LEU A 32 46.265 -12.880 15.105 1.00 10.00 H new ATOM 0 HD11 LEU A 32 44.858 -11.531 13.505 1.00 10.00 H new ATOM 0 HD12 LEU A 32 45.635 -10.491 14.722 1.00 10.00 H new ATOM 0 HD13 LEU A 32 46.297 -10.578 13.073 1.00 10.00 H new ATOM 0 HD21 LEU A 32 45.892 -13.629 12.798 1.00 10.00 H new ATOM 0 HD22 LEU A 32 47.345 -12.741 12.280 1.00 10.00 H new ATOM 0 HD23 LEU A 32 47.493 -14.109 13.409 1.00 10.00 H new ATOM 480 N ASN A 33 51.103 -12.333 13.901 1.00 10.00 N ATOM 481 CA ASN A 33 52.191 -12.622 12.965 1.00 10.00 C ATOM 482 C ASN A 33 53.001 -13.870 13.374 1.00 10.00 C ATOM 483 O ASN A 33 53.392 -14.653 12.511 1.00 10.00 O ATOM 484 CB ASN A 33 53.067 -11.369 12.815 1.00 10.00 C ATOM 485 CG ASN A 33 54.128 -11.547 11.744 1.00 10.00 C ATOM 486 OD1 ASN A 33 55.286 -11.805 12.033 1.00 10.00 O ATOM 487 ND2 ASN A 33 53.778 -11.430 10.484 1.00 10.00 N ATOM 0 H ASN A 33 51.214 -11.451 14.401 1.00 10.00 H new ATOM 0 HA ASN A 33 51.766 -12.868 11.992 1.00 10.00 H new ATOM 0 HB2 ASN A 33 52.439 -10.514 12.565 1.00 10.00 H new ATOM 0 HB3 ASN A 33 53.547 -11.145 13.768 1.00 10.00 H new ATOM 0 HD21 ASN A 33 54.473 -11.555 9.748 1.00 10.00 H new ATOM 0 HD22 ASN A 33 52.811 -11.215 10.241 1.00 10.00 H new ATOM 494 N LYS A 34 53.195 -14.109 14.677 1.00 10.00 N ATOM 495 CA LYS A 34 53.811 -15.331 15.227 1.00 10.00 C ATOM 496 C LYS A 34 52.906 -16.560 15.086 1.00 10.00 C ATOM 497 O LYS A 34 53.398 -17.627 14.726 1.00 10.00 O ATOM 498 CB LYS A 34 54.245 -15.080 16.682 1.00 10.00 C ATOM 499 CG LYS A 34 55.076 -16.231 17.271 1.00 10.00 C ATOM 500 CD LYS A 34 55.547 -15.884 18.690 1.00 10.00 C ATOM 501 CE LYS A 34 56.371 -17.036 19.278 1.00 10.00 C ATOM 502 NZ LYS A 34 56.824 -16.735 20.661 1.00 10.00 N ATOM 0 H LYS A 34 52.922 -13.443 15.400 1.00 10.00 H new ATOM 0 HA LYS A 34 54.699 -15.563 14.639 1.00 10.00 H new ATOM 0 HB2 LYS A 34 54.827 -14.159 16.727 1.00 10.00 H new ATOM 0 HB3 LYS A 34 53.359 -14.928 17.298 1.00 10.00 H new ATOM 0 HG2 LYS A 34 54.480 -17.143 17.292 1.00 10.00 H new ATOM 0 HG3 LYS A 34 55.938 -16.428 16.634 1.00 10.00 H new ATOM 0 HD2 LYS A 34 56.147 -14.974 18.668 1.00 10.00 H new ATOM 0 HD3 LYS A 34 54.685 -15.683 19.327 1.00 10.00 H new ATOM 0 HE2 LYS A 34 55.773 -17.947 19.281 1.00 10.00 H new ATOM 0 HE3 LYS A 34 57.237 -17.225 18.644 1.00 10.00 H new ATOM 0 HZ1 LYS A 34 57.378 -17.536 21.027 1.00 10.00 H new ATOM 0 HZ2 LYS A 34 57.415 -15.879 20.654 1.00 10.00 H new ATOM 0 HZ3 LYS A 34 55.996 -16.579 21.271 1.00 10.00 H new ATOM 516 N GLN A 35 51.590 -16.414 15.265 1.00 10.00 N ATOM 517 CA GLN A 35 50.607 -17.468 14.945 1.00 10.00 C ATOM 518 C GLN A 35 50.682 -17.866 13.463 1.00 10.00 C ATOM 519 O GLN A 35 50.659 -19.045 13.115 1.00 10.00 O ATOM 520 CB GLN A 35 49.170 -17.014 15.264 1.00 10.00 C ATOM 521 CG GLN A 35 48.843 -16.902 16.759 1.00 10.00 C ATOM 522 CD GLN A 35 47.404 -16.426 16.977 1.00 10.00 C ATOM 523 OE1 GLN A 35 46.447 -17.022 16.499 1.00 10.00 O ATOM 524 NE2 GLN A 35 47.167 -15.345 17.690 1.00 10.00 N ATOM 0 H GLN A 35 51.170 -15.562 15.636 1.00 10.00 H new ATOM 0 HA GLN A 35 50.857 -18.328 15.566 1.00 10.00 H new ATOM 0 HB2 GLN A 35 48.999 -16.044 14.796 1.00 10.00 H new ATOM 0 HB3 GLN A 35 48.473 -17.716 14.806 1.00 10.00 H new ATOM 0 HG2 GLN A 35 48.985 -17.870 17.239 1.00 10.00 H new ATOM 0 HG3 GLN A 35 49.535 -16.207 17.234 1.00 10.00 H new ATOM 0 HE21 GLN A 35 47.942 -14.826 18.102 1.00 10.00 H new ATOM 0 HE22 GLN A 35 46.208 -15.027 17.831 1.00 10.00 H new ATOM 533 N LEU A 36 50.816 -16.874 12.584 1.00 10.00 N ATOM 534 CA LEU A 36 50.934 -17.067 11.141 1.00 10.00 C ATOM 535 C LEU A 36 52.283 -17.657 10.720 1.00 10.00 C ATOM 536 O LEU A 36 52.324 -18.521 9.851 1.00 10.00 O ATOM 537 CB LEU A 36 50.646 -15.733 10.473 1.00 10.00 C ATOM 538 CG LEU A 36 50.502 -15.858 8.954 1.00 10.00 C ATOM 539 CD1 LEU A 36 49.415 -16.808 8.454 1.00 10.00 C ATOM 540 CD2 LEU A 36 50.113 -14.471 8.489 1.00 10.00 C ATOM 0 H LEU A 36 50.846 -15.893 12.862 1.00 10.00 H new ATOM 0 HA LEU A 36 50.207 -17.811 10.815 1.00 10.00 H new ATOM 0 HB2 LEU A 36 49.730 -15.312 10.888 1.00 10.00 H new ATOM 0 HB3 LEU A 36 51.450 -15.034 10.702 1.00 10.00 H new ATOM 0 HG LEU A 36 51.439 -16.261 8.571 1.00 10.00 H new ATOM 0 HD11 LEU A 36 49.409 -16.813 7.364 1.00 10.00 H new ATOM 0 HD12 LEU A 36 49.615 -17.815 8.820 1.00 10.00 H new ATOM 0 HD13 LEU A 36 48.444 -16.475 8.821 1.00 10.00 H new ATOM 0 HD21 LEU A 36 49.989 -14.472 7.406 1.00 10.00 H new ATOM 0 HD22 LEU A 36 49.175 -14.179 8.961 1.00 10.00 H new ATOM 0 HD23 LEU A 36 50.894 -13.763 8.764 1.00 10.00 H new ATOM 552 N GLN A 37 53.375 -17.253 11.368 1.00 10.00 N ATOM 553 CA GLN A 37 54.699 -17.857 11.197 1.00 10.00 C ATOM 554 C GLN A 37 54.723 -19.315 11.682 1.00 10.00 C ATOM 555 O GLN A 37 55.363 -20.160 11.060 1.00 10.00 O ATOM 556 CB GLN A 37 55.723 -16.986 11.945 1.00 10.00 C ATOM 557 CG GLN A 37 57.182 -17.435 11.764 1.00 10.00 C ATOM 558 CD GLN A 37 58.173 -16.500 12.462 1.00 10.00 C ATOM 559 OE1 GLN A 37 57.877 -15.830 13.445 1.00 10.00 O ATOM 560 NE2 GLN A 37 59.390 -16.394 11.973 1.00 10.00 N ATOM 0 H GLN A 37 53.366 -16.484 12.038 1.00 10.00 H new ATOM 0 HA GLN A 37 54.955 -17.891 10.138 1.00 10.00 H new ATOM 0 HB2 GLN A 37 55.626 -15.956 11.602 1.00 10.00 H new ATOM 0 HB3 GLN A 37 55.482 -16.993 13.008 1.00 10.00 H new ATOM 0 HG2 GLN A 37 57.300 -18.444 12.158 1.00 10.00 H new ATOM 0 HG3 GLN A 37 57.416 -17.479 10.700 1.00 10.00 H new ATOM 0 HE21 GLN A 37 59.661 -16.941 11.156 1.00 10.00 H new ATOM 0 HE22 GLN A 37 60.063 -15.765 12.411 1.00 10.00 H new ATOM 569 N ASP A 38 53.977 -19.641 12.739 1.00 10.00 N ATOM 570 CA ASP A 38 53.750 -21.025 13.164 1.00 10.00 C ATOM 571 C ASP A 38 52.928 -21.812 12.131 1.00 10.00 C ATOM 572 O ASP A 38 53.294 -22.940 11.801 1.00 10.00 O ATOM 573 CB ASP A 38 53.112 -21.061 14.560 1.00 10.00 C ATOM 574 CG ASP A 38 53.022 -22.494 15.113 1.00 10.00 C ATOM 575 OD1 ASP A 38 54.083 -23.122 15.341 1.00 10.00 O ATOM 576 OD2 ASP A 38 51.894 -22.984 15.356 1.00 10.00 O ATOM 0 H ASP A 38 53.511 -18.950 13.327 1.00 10.00 H new ATOM 0 HA ASP A 38 54.718 -21.522 13.228 1.00 10.00 H new ATOM 0 HB2 ASP A 38 53.697 -20.445 15.243 1.00 10.00 H new ATOM 0 HB3 ASP A 38 52.114 -20.626 14.514 1.00 10.00 H new ATOM 581 N ALA A 39 51.908 -21.192 11.517 1.00 10.00 N ATOM 582 CA ALA A 39 51.204 -21.779 10.370 1.00 10.00 C ATOM 583 C ALA A 39 52.169 -22.068 9.221 1.00 10.00 C ATOM 584 O ALA A 39 52.164 -23.159 8.662 1.00 10.00 O ATOM 585 CB ALA A 39 50.055 -20.893 9.853 1.00 10.00 C ATOM 0 H ALA A 39 51.552 -20.279 11.799 1.00 10.00 H new ATOM 0 HA ALA A 39 50.771 -22.711 10.733 1.00 10.00 H new ATOM 0 HB1 ALA A 39 49.573 -21.380 9.005 1.00 10.00 H new ATOM 0 HB2 ALA A 39 49.325 -20.743 10.648 1.00 10.00 H new ATOM 0 HB3 ALA A 39 50.453 -19.928 9.539 1.00 10.00 H new ATOM 591 N GLN A 40 53.027 -21.097 8.913 1.00 10.00 N ATOM 592 CA GLN A 40 54.041 -21.167 7.867 1.00 10.00 C ATOM 593 C GLN A 40 55.117 -22.214 8.177 1.00 10.00 C ATOM 594 O GLN A 40 55.731 -22.717 7.247 1.00 10.00 O ATOM 595 CB GLN A 40 54.660 -19.769 7.681 1.00 10.00 C ATOM 596 CG GLN A 40 55.334 -19.609 6.309 1.00 10.00 C ATOM 597 CD GLN A 40 55.876 -18.194 6.104 1.00 10.00 C ATOM 598 OE1 GLN A 40 55.141 -17.217 6.036 1.00 10.00 O ATOM 599 NE2 GLN A 40 57.178 -18.020 5.996 1.00 10.00 N ATOM 0 H GLN A 40 53.033 -20.204 9.407 1.00 10.00 H new ATOM 0 HA GLN A 40 53.566 -21.484 6.939 1.00 10.00 H new ATOM 0 HB2 GLN A 40 53.884 -19.012 7.793 1.00 10.00 H new ATOM 0 HB3 GLN A 40 55.394 -19.591 8.467 1.00 10.00 H new ATOM 0 HG2 GLN A 40 56.149 -20.327 6.219 1.00 10.00 H new ATOM 0 HG3 GLN A 40 54.616 -19.841 5.522 1.00 10.00 H new ATOM 0 HE21 GLN A 40 57.806 -18.822 6.050 1.00 10.00 H new ATOM 0 HE22 GLN A 40 57.558 -17.083 5.858 1.00 10.00 H new ATOM 608 N ALA A 41 55.361 -22.563 9.442 1.00 10.00 N ATOM 609 CA ALA A 41 56.199 -23.702 9.839 1.00 10.00 C ATOM 610 C ALA A 41 55.486 -25.056 9.768 1.00 10.00 C ATOM 611 O ALA A 41 56.101 -26.027 9.331 1.00 10.00 O ATOM 612 CB ALA A 41 56.836 -23.438 11.199 1.00 10.00 C ATOM 0 H ALA A 41 54.975 -22.053 10.237 1.00 10.00 H new ATOM 0 HA ALA A 41 56.995 -23.785 9.099 1.00 10.00 H new ATOM 0 HB1 ALA A 41 57.455 -24.289 11.482 1.00 10.00 H new ATOM 0 HB2 ALA A 41 57.455 -22.542 11.143 1.00 10.00 H new ATOM 0 HB3 ALA A 41 56.054 -23.293 11.945 1.00 10.00 H new ATOM 618 N ASN A 42 54.190 -25.141 10.099 1.00 10.00 N ATOM 619 CA ASN A 42 53.415 -26.353 9.823 1.00 10.00 C ATOM 620 C ASN A 42 53.382 -26.578 8.301 1.00 10.00 C ATOM 621 O ASN A 42 53.498 -27.706 7.819 1.00 10.00 O ATOM 622 CB ASN A 42 51.984 -26.256 10.397 1.00 10.00 C ATOM 623 CG ASN A 42 51.857 -25.801 11.844 1.00 10.00 C ATOM 624 OD1 ASN A 42 50.998 -24.999 12.179 1.00 10.00 O ATOM 625 ND2 ASN A 42 52.655 -26.317 12.753 1.00 10.00 N ATOM 0 H ASN A 42 53.664 -24.394 10.552 1.00 10.00 H new ATOM 0 HA ASN A 42 53.893 -27.202 10.312 1.00 10.00 H new ATOM 0 HB2 ASN A 42 51.413 -25.569 9.773 1.00 10.00 H new ATOM 0 HB3 ASN A 42 51.514 -27.235 10.306 1.00 10.00 H new ATOM 0 HD21 ASN A 42 52.555 -26.047 13.732 1.00 10.00 H new ATOM 0 HD22 ASN A 42 53.374 -26.987 12.479 1.00 10.00 H new ATOM 632 N LEU A 43 53.320 -25.474 7.549 1.00 10.00 N ATOM 633 CA LEU A 43 53.490 -25.433 6.115 1.00 10.00 C ATOM 634 C LEU A 43 54.928 -25.705 5.692 1.00 10.00 C ATOM 635 O LEU A 43 55.142 -26.395 4.721 1.00 10.00 O ATOM 636 CB LEU A 43 52.975 -24.077 5.589 1.00 10.00 C ATOM 637 CG LEU A 43 52.433 -24.201 4.177 1.00 10.00 C ATOM 638 CD1 LEU A 43 51.158 -25.018 4.245 1.00 10.00 C ATOM 639 CD2 LEU A 43 52.052 -22.872 3.550 1.00 10.00 C ATOM 0 H LEU A 43 53.142 -24.554 7.951 1.00 10.00 H new ATOM 0 HA LEU A 43 52.902 -26.235 5.669 1.00 10.00 H new ATOM 0 HB2 LEU A 43 52.193 -23.702 6.249 1.00 10.00 H new ATOM 0 HB3 LEU A 43 53.784 -23.347 5.607 1.00 10.00 H new ATOM 0 HG LEU A 43 53.222 -24.650 3.573 1.00 10.00 H new ATOM 0 HD11 LEU A 43 50.741 -25.126 3.244 1.00 10.00 H new ATOM 0 HD12 LEU A 43 51.379 -26.004 4.655 1.00 10.00 H new ATOM 0 HD13 LEU A 43 50.436 -24.512 4.886 1.00 10.00 H new ATOM 0 HD21 LEU A 43 51.673 -23.041 2.542 1.00 10.00 H new ATOM 0 HD22 LEU A 43 51.280 -22.393 4.152 1.00 10.00 H new ATOM 0 HD23 LEU A 43 52.929 -22.226 3.505 1.00 10.00 H new ATOM 651 N THR A 44 55.945 -25.265 6.418 1.00 10.00 N ATOM 652 CA THR A 44 57.340 -25.542 6.041 1.00 10.00 C ATOM 653 C THR A 44 57.627 -27.043 6.075 1.00 10.00 C ATOM 654 O THR A 44 58.336 -27.572 5.215 1.00 10.00 O ATOM 655 CB THR A 44 58.341 -24.809 6.935 1.00 10.00 C ATOM 656 OG1 THR A 44 58.313 -23.421 6.676 1.00 10.00 O ATOM 657 CG2 THR A 44 59.759 -25.289 6.676 1.00 10.00 C ATOM 0 H THR A 44 55.840 -24.715 7.271 1.00 10.00 H new ATOM 0 HA THR A 44 57.465 -25.171 5.024 1.00 10.00 H new ATOM 0 HB THR A 44 58.056 -25.015 7.967 1.00 10.00 H new ATOM 0 HG1 THR A 44 57.462 -23.047 6.987 1.00 10.00 H new ATOM 0 HG21 THR A 44 60.450 -24.751 7.325 1.00 10.00 H new ATOM 0 HG22 THR A 44 59.825 -26.357 6.882 1.00 10.00 H new ATOM 0 HG23 THR A 44 60.021 -25.104 5.634 1.00 10.00 H new ATOM 665 N LYS A 45 57.051 -27.739 7.060 1.00 10.00 N ATOM 666 CA LYS A 45 57.133 -29.201 7.170 1.00 10.00 C ATOM 667 C LYS A 45 56.507 -29.937 5.979 1.00 10.00 C ATOM 668 O LYS A 45 57.009 -30.993 5.590 1.00 10.00 O ATOM 669 CB LYS A 45 56.520 -29.639 8.504 1.00 10.00 C ATOM 670 CG LYS A 45 57.383 -29.250 9.716 1.00 10.00 C ATOM 671 CD LYS A 45 56.864 -29.820 11.045 1.00 10.00 C ATOM 672 CE LYS A 45 56.951 -31.353 11.092 1.00 10.00 C ATOM 673 NZ LYS A 45 56.611 -31.883 12.440 1.00 10.00 N ATOM 0 H LYS A 45 56.512 -27.303 7.808 1.00 10.00 H new ATOM 0 HA LYS A 45 58.186 -29.481 7.147 1.00 10.00 H new ATOM 0 HB2 LYS A 45 55.532 -29.190 8.609 1.00 10.00 H new ATOM 0 HB3 LYS A 45 56.380 -30.720 8.496 1.00 10.00 H new ATOM 0 HG2 LYS A 45 58.403 -29.599 9.553 1.00 10.00 H new ATOM 0 HG3 LYS A 45 57.426 -28.163 9.788 1.00 10.00 H new ATOM 0 HD2 LYS A 45 57.441 -29.400 11.869 1.00 10.00 H new ATOM 0 HD3 LYS A 45 55.829 -29.512 11.191 1.00 10.00 H new ATOM 0 HE2 LYS A 45 56.273 -31.779 10.352 1.00 10.00 H new ATOM 0 HE3 LYS A 45 57.958 -31.669 10.820 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 56.681 -32.921 12.433 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 57.273 -31.496 13.142 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 55.641 -31.603 12.689 1.00 10.00 H new ATOM 687 N ASN A 46 55.466 -29.370 5.365 1.00 10.00 N ATOM 688 CA ASN A 46 54.877 -29.817 4.111 1.00 10.00 C ATOM 689 C ASN A 46 54.221 -28.653 3.330 1.00 10.00 C ATOM 690 O ASN A 46 53.049 -28.348 3.574 1.00 10.00 O ATOM 691 CB ASN A 46 53.943 -30.980 4.428 1.00 10.00 C ATOM 692 CG ASN A 46 53.476 -31.713 3.172 1.00 10.00 C ATOM 693 OD1 ASN A 46 53.489 -31.202 2.060 1.00 10.00 O ATOM 694 ND2 ASN A 46 53.094 -32.964 3.299 1.00 10.00 N ATOM 0 H ASN A 46 54.994 -28.552 5.749 1.00 10.00 H new ATOM 0 HA ASN A 46 55.644 -30.177 3.425 1.00 10.00 H new ATOM 0 HB2 ASN A 46 54.453 -31.683 5.087 1.00 10.00 H new ATOM 0 HB3 ASN A 46 53.075 -30.607 4.971 1.00 10.00 H new ATOM 0 HD21 ASN A 46 52.813 -33.497 2.476 1.00 10.00 H new ATOM 0 HD22 ASN A 46 53.079 -33.402 4.220 1.00 10.00 H new ATOM 701 N PRO A 47 54.979 -27.962 2.444 1.00 10.00 N ATOM 702 CA PRO A 47 54.575 -26.710 1.792 1.00 10.00 C ATOM 703 C PRO A 47 53.193 -26.639 1.146 1.00 10.00 C ATOM 704 O PRO A 47 52.642 -25.541 1.052 1.00 10.00 O ATOM 705 CB PRO A 47 55.680 -26.399 0.803 1.00 10.00 C ATOM 706 CG PRO A 47 56.928 -26.890 1.528 1.00 10.00 C ATOM 707 CD PRO A 47 56.431 -28.097 2.324 1.00 10.00 C ATOM 0 HA PRO A 47 54.451 -25.964 2.577 1.00 10.00 H new ATOM 0 HB2 PRO A 47 55.532 -26.917 -0.145 1.00 10.00 H new ATOM 0 HB3 PRO A 47 55.735 -25.334 0.579 1.00 10.00 H new ATOM 0 HG2 PRO A 47 57.715 -27.169 0.827 1.00 10.00 H new ATOM 0 HG3 PRO A 47 57.340 -26.121 2.181 1.00 10.00 H new ATOM 0 HD2 PRO A 47 56.691 -29.027 1.818 1.00 10.00 H new ATOM 0 HD3 PRO A 47 56.898 -28.129 3.308 1.00 10.00 H new ATOM 715 N SER A 48 52.605 -27.767 0.741 1.00 10.00 N ATOM 716 CA SER A 48 51.234 -27.835 0.277 1.00 10.00 C ATOM 717 C SER A 48 50.360 -28.914 0.913 1.00 10.00 C ATOM 718 O SER A 48 49.390 -29.388 0.314 1.00 10.00 O ATOM 719 CB SER A 48 51.262 -27.816 -1.238 1.00 10.00 C ATOM 720 OG SER A 48 51.804 -29.013 -1.779 1.00 10.00 O ATOM 0 H SER A 48 53.083 -28.668 0.729 1.00 10.00 H new ATOM 0 HA SER A 48 50.700 -26.955 0.635 1.00 10.00 H new ATOM 0 HB2 SER A 48 50.250 -27.674 -1.617 1.00 10.00 H new ATOM 0 HB3 SER A 48 51.852 -26.965 -1.578 1.00 10.00 H new ATOM 0 HG SER A 48 51.802 -28.960 -2.758 1.00 10.00 H new ATOM 726 N ASP A 49 50.685 -29.285 2.155 1.00 10.00 N ATOM 727 CA ASP A 49 49.804 -30.103 2.994 1.00 10.00 C ATOM 728 C ASP A 49 48.506 -29.295 3.152 1.00 10.00 C ATOM 729 O ASP A 49 48.555 -28.133 3.556 1.00 10.00 O ATOM 730 CB ASP A 49 50.473 -30.448 4.334 1.00 10.00 C ATOM 731 CG ASP A 49 49.520 -31.040 5.393 1.00 10.00 C ATOM 732 OD1 ASP A 49 48.514 -30.394 5.763 1.00 10.00 O ATOM 733 OD2 ASP A 49 49.778 -32.177 5.856 1.00 10.00 O ATOM 0 H ASP A 49 51.563 -29.028 2.606 1.00 10.00 H new ATOM 0 HA ASP A 49 49.588 -31.071 2.541 1.00 10.00 H new ATOM 0 HB2 ASP A 49 51.278 -31.159 4.151 1.00 10.00 H new ATOM 0 HB3 ASP A 49 50.931 -29.546 4.740 1.00 10.00 H new ATOM 738 N PRO A 50 47.341 -29.855 2.811 1.00 10.00 N ATOM 739 CA PRO A 50 46.121 -29.077 2.708 1.00 10.00 C ATOM 740 C PRO A 50 45.549 -28.577 4.028 1.00 10.00 C ATOM 741 O PRO A 50 44.861 -27.565 4.016 1.00 10.00 O ATOM 742 CB PRO A 50 45.140 -29.979 1.989 1.00 10.00 C ATOM 743 CG PRO A 50 45.615 -31.398 2.309 1.00 10.00 C ATOM 744 CD PRO A 50 47.123 -31.242 2.461 1.00 10.00 C ATOM 0 HA PRO A 50 46.331 -28.150 2.174 1.00 10.00 H new ATOM 0 HB2 PRO A 50 44.121 -29.814 2.338 1.00 10.00 H new ATOM 0 HB3 PRO A 50 45.144 -29.792 0.915 1.00 10.00 H new ATOM 0 HG2 PRO A 50 45.157 -31.778 3.222 1.00 10.00 H new ATOM 0 HG3 PRO A 50 45.362 -32.096 1.511 1.00 10.00 H new ATOM 0 HD2 PRO A 50 47.509 -31.906 3.234 1.00 10.00 H new ATOM 0 HD3 PRO A 50 47.638 -31.498 1.535 1.00 10.00 H new ATOM 752 N THR A 51 45.831 -29.220 5.160 1.00 10.00 N ATOM 753 CA THR A 51 45.467 -28.698 6.489 1.00 10.00 C ATOM 754 C THR A 51 46.462 -27.648 6.948 1.00 10.00 C ATOM 755 O THR A 51 46.042 -26.632 7.484 1.00 10.00 O ATOM 756 CB THR A 51 45.411 -29.841 7.495 1.00 10.00 C ATOM 757 OG1 THR A 51 44.239 -30.606 7.293 1.00 10.00 O ATOM 758 CG2 THR A 51 45.431 -29.381 8.949 1.00 10.00 C ATOM 0 H THR A 51 46.317 -30.116 5.189 1.00 10.00 H new ATOM 0 HA THR A 51 44.485 -28.230 6.420 1.00 10.00 H new ATOM 0 HB THR A 51 46.311 -30.431 7.321 1.00 10.00 H new ATOM 0 HG1 THR A 51 44.211 -31.340 7.942 1.00 10.00 H new ATOM 0 HG21 THR A 51 45.389 -30.250 9.606 1.00 10.00 H new ATOM 0 HG22 THR A 51 46.348 -28.824 9.142 1.00 10.00 H new ATOM 0 HG23 THR A 51 44.571 -28.740 9.140 1.00 10.00 H new ATOM 766 N ALA A 52 47.758 -27.826 6.709 1.00 10.00 N ATOM 767 CA ALA A 52 48.760 -26.785 6.914 1.00 10.00 C ATOM 768 C ALA A 52 48.440 -25.533 6.105 1.00 10.00 C ATOM 769 O ALA A 52 48.539 -24.417 6.614 1.00 10.00 O ATOM 770 CB ALA A 52 50.115 -27.390 6.528 1.00 10.00 C ATOM 0 H ALA A 52 48.146 -28.704 6.365 1.00 10.00 H new ATOM 0 HA ALA A 52 48.774 -26.462 7.955 1.00 10.00 H new ATOM 0 HB1 ALA A 52 50.899 -26.645 6.666 1.00 10.00 H new ATOM 0 HB2 ALA A 52 50.321 -28.254 7.160 1.00 10.00 H new ATOM 0 HB3 ALA A 52 50.090 -27.702 5.484 1.00 10.00 H new ATOM 776 N LEU A 53 48.014 -25.720 4.863 1.00 10.00 N ATOM 777 CA LEU A 53 47.704 -24.644 3.940 1.00 10.00 C ATOM 778 C LEU A 53 46.328 -24.048 4.242 1.00 10.00 C ATOM 779 O LEU A 53 46.175 -22.834 4.188 1.00 10.00 O ATOM 780 CB LEU A 53 47.883 -25.221 2.529 1.00 10.00 C ATOM 781 CG LEU A 53 48.095 -24.250 1.356 1.00 10.00 C ATOM 782 CD1 LEU A 53 48.642 -22.889 1.749 1.00 10.00 C ATOM 783 CD2 LEU A 53 49.141 -24.882 0.439 1.00 10.00 C ATOM 0 H LEU A 53 47.872 -26.647 4.463 1.00 10.00 H new ATOM 0 HA LEU A 53 48.373 -23.789 4.041 1.00 10.00 H new ATOM 0 HB2 LEU A 53 48.736 -25.899 2.555 1.00 10.00 H new ATOM 0 HB3 LEU A 53 47.003 -25.824 2.304 1.00 10.00 H new ATOM 0 HG LEU A 53 47.117 -24.089 0.902 1.00 10.00 H new ATOM 0 HD11 LEU A 53 48.759 -22.273 0.858 1.00 10.00 H new ATOM 0 HD12 LEU A 53 47.950 -22.404 2.438 1.00 10.00 H new ATOM 0 HD13 LEU A 53 49.610 -23.012 2.234 1.00 10.00 H new ATOM 0 HD21 LEU A 53 49.324 -24.225 -0.411 1.00 10.00 H new ATOM 0 HD22 LEU A 53 50.069 -25.028 0.992 1.00 10.00 H new ATOM 0 HD23 LEU A 53 48.777 -25.845 0.081 1.00 10.00 H new ATOM 795 N ALA A 54 45.358 -24.861 4.671 1.00 10.00 N ATOM 796 CA ALA A 54 44.084 -24.387 5.208 1.00 10.00 C ATOM 797 C ALA A 54 44.298 -23.559 6.484 1.00 10.00 C ATOM 798 O ALA A 54 43.683 -22.510 6.657 1.00 10.00 O ATOM 799 CB ALA A 54 43.183 -25.593 5.519 1.00 10.00 C ATOM 0 H ALA A 54 45.439 -25.878 4.654 1.00 10.00 H new ATOM 0 HA ALA A 54 43.608 -23.749 4.463 1.00 10.00 H new ATOM 0 HB1 ALA A 54 42.232 -25.243 5.920 1.00 10.00 H new ATOM 0 HB2 ALA A 54 43.005 -26.160 4.605 1.00 10.00 H new ATOM 0 HB3 ALA A 54 43.672 -26.233 6.253 1.00 10.00 H new ATOM 805 N ASN A 55 45.202 -24.010 7.354 1.00 10.00 N ATOM 806 CA ASN A 55 45.565 -23.362 8.608 1.00 10.00 C ATOM 807 C ASN A 55 46.230 -22.012 8.349 1.00 10.00 C ATOM 808 O ASN A 55 45.762 -20.981 8.822 1.00 10.00 O ATOM 809 CB ASN A 55 46.508 -24.306 9.372 1.00 10.00 C ATOM 810 CG ASN A 55 47.121 -23.734 10.624 1.00 10.00 C ATOM 811 OD1 ASN A 55 46.448 -23.340 11.563 1.00 10.00 O ATOM 812 ND2 ASN A 55 48.431 -23.720 10.665 1.00 10.00 N ATOM 0 H ASN A 55 45.721 -24.873 7.195 1.00 10.00 H new ATOM 0 HA ASN A 55 44.673 -23.167 9.203 1.00 10.00 H new ATOM 0 HB2 ASN A 55 45.955 -25.207 9.638 1.00 10.00 H new ATOM 0 HB3 ASN A 55 47.311 -24.611 8.701 1.00 10.00 H new ATOM 0 HD21 ASN A 55 48.912 -23.374 11.496 1.00 10.00 H new ATOM 0 HD22 ASN A 55 48.970 -24.055 9.866 1.00 10.00 H new ATOM 819 N TYR A 56 47.283 -22.017 7.532 1.00 10.00 N ATOM 820 CA TYR A 56 47.921 -20.795 7.031 1.00 10.00 C ATOM 821 C TYR A 56 46.937 -19.861 6.336 1.00 10.00 C ATOM 822 O TYR A 56 46.905 -18.695 6.695 1.00 10.00 O ATOM 823 CB TYR A 56 49.136 -21.195 6.182 1.00 10.00 C ATOM 824 CG TYR A 56 49.817 -20.164 5.307 1.00 10.00 C ATOM 825 CD1 TYR A 56 49.388 -19.989 3.977 1.00 10.00 C ATOM 826 CD2 TYR A 56 50.997 -19.537 5.754 1.00 10.00 C ATOM 827 CE1 TYR A 56 50.160 -19.226 3.081 1.00 10.00 C ATOM 828 CE2 TYR A 56 51.773 -18.774 4.860 1.00 10.00 C ATOM 829 CZ TYR A 56 51.367 -18.636 3.513 1.00 10.00 C ATOM 830 OH TYR A 56 52.130 -17.933 2.630 1.00 10.00 O ATOM 0 H TYR A 56 47.722 -22.874 7.196 1.00 10.00 H new ATOM 0 HA TYR A 56 48.282 -20.194 7.865 1.00 10.00 H new ATOM 0 HB2 TYR A 56 49.890 -21.593 6.861 1.00 10.00 H new ATOM 0 HB3 TYR A 56 48.824 -22.015 5.535 1.00 10.00 H new ATOM 0 HD1 TYR A 56 48.465 -20.441 3.644 1.00 10.00 H new ATOM 0 HD2 TYR A 56 51.307 -19.642 6.783 1.00 10.00 H new ATOM 0 HE1 TYR A 56 49.828 -19.092 2.062 1.00 10.00 H new ATOM 0 HE2 TYR A 56 52.678 -18.295 5.203 1.00 10.00 H new ATOM 0 HH TYR A 56 52.927 -17.591 3.086 1.00 10.00 H new ATOM 840 N GLN A 57 46.053 -20.336 5.461 1.00 10.00 N ATOM 841 CA GLN A 57 45.042 -19.477 4.822 1.00 10.00 C ATOM 842 C GLN A 57 44.022 -18.909 5.827 1.00 10.00 C ATOM 843 O GLN A 57 43.635 -17.746 5.712 1.00 10.00 O ATOM 844 CB GLN A 57 44.313 -20.222 3.690 1.00 10.00 C ATOM 845 CG GLN A 57 45.153 -20.325 2.403 1.00 10.00 C ATOM 846 CD GLN A 57 45.408 -18.980 1.716 1.00 10.00 C ATOM 847 OE1 GLN A 57 44.620 -18.045 1.769 1.00 10.00 O ATOM 848 NE2 GLN A 57 46.528 -18.823 1.040 1.00 10.00 N ATOM 0 H GLN A 57 46.012 -21.314 5.173 1.00 10.00 H new ATOM 0 HA GLN A 57 45.585 -18.632 4.398 1.00 10.00 H new ATOM 0 HB2 GLN A 57 44.053 -21.225 4.030 1.00 10.00 H new ATOM 0 HB3 GLN A 57 43.378 -19.709 3.467 1.00 10.00 H new ATOM 0 HG2 GLN A 57 46.111 -20.786 2.643 1.00 10.00 H new ATOM 0 HG3 GLN A 57 44.646 -20.989 1.703 1.00 10.00 H new ATOM 0 HE21 GLN A 57 47.200 -19.588 0.982 1.00 10.00 H new ATOM 0 HE22 GLN A 57 46.723 -17.936 0.575 1.00 10.00 H new ATOM 857 N MET A 58 43.610 -19.686 6.832 1.00 10.00 N ATOM 858 CA MET A 58 42.681 -19.262 7.887 1.00 10.00 C ATOM 859 C MET A 58 43.299 -18.214 8.814 1.00 10.00 C ATOM 860 O MET A 58 42.716 -17.150 9.031 1.00 10.00 O ATOM 861 CB MET A 58 42.201 -20.513 8.643 1.00 10.00 C ATOM 862 CG MET A 58 41.228 -20.249 9.798 1.00 10.00 C ATOM 863 SD MET A 58 41.945 -19.689 11.374 1.00 10.00 S ATOM 864 CE MET A 58 42.753 -21.215 11.935 1.00 10.00 C ATOM 0 H MET A 58 43.920 -20.652 6.939 1.00 10.00 H new ATOM 0 HA MET A 58 41.820 -18.767 7.437 1.00 10.00 H new ATOM 0 HB2 MET A 58 41.721 -21.185 7.932 1.00 10.00 H new ATOM 0 HB3 MET A 58 43.073 -21.036 9.037 1.00 10.00 H new ATOM 0 HG2 MET A 58 40.508 -19.500 9.469 1.00 10.00 H new ATOM 0 HG3 MET A 58 40.670 -21.166 9.987 1.00 10.00 H new ATOM 0 HE1 MET A 58 43.180 -21.058 12.925 1.00 10.00 H new ATOM 0 HE2 MET A 58 42.019 -22.020 11.980 1.00 10.00 H new ATOM 0 HE3 MET A 58 43.545 -21.485 11.237 1.00 10.00 H new ATOM 874 N ILE A 59 44.516 -18.463 9.302 1.00 10.00 N ATOM 875 CA ILE A 59 45.261 -17.524 10.126 1.00 10.00 C ATOM 876 C ILE A 59 45.632 -16.289 9.300 1.00 10.00 C ATOM 877 O ILE A 59 45.589 -15.181 9.821 1.00 10.00 O ATOM 878 CB ILE A 59 46.481 -18.250 10.722 1.00 10.00 C ATOM 879 CG1 ILE A 59 46.048 -19.382 11.685 1.00 10.00 C ATOM 880 CG2 ILE A 59 47.374 -17.289 11.503 1.00 10.00 C ATOM 881 CD1 ILE A 59 47.232 -20.203 12.194 1.00 10.00 C ATOM 0 H ILE A 59 45.014 -19.336 9.130 1.00 10.00 H new ATOM 0 HA ILE A 59 44.656 -17.164 10.958 1.00 10.00 H new ATOM 0 HB ILE A 59 47.031 -18.668 9.879 1.00 10.00 H new ATOM 0 HG12 ILE A 59 45.518 -18.950 12.534 1.00 10.00 H new ATOM 0 HG13 ILE A 59 45.346 -20.041 11.174 1.00 10.00 H new ATOM 0 HG21 ILE A 59 48.226 -17.834 11.910 1.00 10.00 H new ATOM 0 HG22 ILE A 59 47.731 -16.502 10.838 1.00 10.00 H new ATOM 0 HG23 ILE A 59 46.804 -16.844 12.319 1.00 10.00 H new ATOM 0 HD11 ILE A 59 46.872 -20.983 12.865 1.00 10.00 H new ATOM 0 HD12 ILE A 59 47.747 -20.660 11.349 1.00 10.00 H new ATOM 0 HD13 ILE A 59 47.922 -19.552 12.731 1.00 10.00 H new ATOM 893 N MET A 60 45.934 -16.443 8.008 1.00 10.00 N ATOM 894 CA MET A 60 46.221 -15.324 7.111 1.00 10.00 C ATOM 895 C MET A 60 44.987 -14.468 6.808 1.00 10.00 C ATOM 896 O MET A 60 45.101 -13.249 6.702 1.00 10.00 O ATOM 897 CB MET A 60 46.860 -15.812 5.810 1.00 10.00 C ATOM 898 CG MET A 60 47.624 -14.674 5.145 1.00 10.00 C ATOM 899 SD MET A 60 48.675 -15.190 3.767 1.00 10.00 S ATOM 900 CE MET A 60 49.999 -15.931 4.757 1.00 10.00 C ATOM 0 H MET A 60 45.986 -17.355 7.553 1.00 10.00 H new ATOM 0 HA MET A 60 46.930 -14.686 7.639 1.00 10.00 H new ATOM 0 HB2 MET A 60 47.535 -16.642 6.016 1.00 10.00 H new ATOM 0 HB3 MET A 60 46.090 -16.187 5.136 1.00 10.00 H new ATOM 0 HG2 MET A 60 46.910 -13.934 4.785 1.00 10.00 H new ATOM 0 HG3 MET A 60 48.243 -14.181 5.894 1.00 10.00 H new ATOM 0 HE1 MET A 60 50.892 -16.047 4.142 1.00 10.00 H new ATOM 0 HE2 MET A 60 50.224 -15.285 5.605 1.00 10.00 H new ATOM 0 HE3 MET A 60 49.679 -16.908 5.120 1.00 10.00 H new ATOM 910 N SER A 61 43.807 -15.080 6.720 1.00 10.00 N ATOM 911 CA SER A 61 42.525 -14.371 6.609 1.00 10.00 C ATOM 912 C SER A 61 42.274 -13.496 7.843 1.00 10.00 C ATOM 913 O SER A 61 41.929 -12.322 7.708 1.00 10.00 O ATOM 914 CB SER A 61 41.368 -15.362 6.413 1.00 10.00 C ATOM 915 OG SER A 61 41.470 -16.002 5.152 1.00 10.00 O ATOM 0 H SER A 61 43.709 -16.095 6.723 1.00 10.00 H new ATOM 0 HA SER A 61 42.577 -13.723 5.734 1.00 10.00 H new ATOM 0 HB2 SER A 61 41.382 -16.108 7.208 1.00 10.00 H new ATOM 0 HB3 SER A 61 40.416 -14.837 6.485 1.00 10.00 H new ATOM 0 HG SER A 61 42.198 -16.657 5.176 1.00 10.00 H new ATOM 921 N GLU A 62 42.529 -14.028 9.043 1.00 10.00 N ATOM 922 CA GLU A 62 42.479 -13.258 10.292 1.00 10.00 C ATOM 923 C GLU A 62 43.571 -12.180 10.367 1.00 10.00 C ATOM 924 O GLU A 62 43.280 -11.028 10.695 1.00 10.00 O ATOM 925 CB GLU A 62 42.575 -14.206 11.505 1.00 10.00 C ATOM 926 CG GLU A 62 41.354 -15.123 11.675 1.00 10.00 C ATOM 927 CD GLU A 62 40.081 -14.336 12.044 1.00 10.00 C ATOM 928 OE1 GLU A 62 39.890 -14.012 13.242 1.00 10.00 O ATOM 929 OE2 GLU A 62 39.257 -14.042 11.144 1.00 10.00 O ATOM 0 H GLU A 62 42.777 -15.008 9.177 1.00 10.00 H new ATOM 0 HA GLU A 62 41.521 -12.739 10.310 1.00 10.00 H new ATOM 0 HB2 GLU A 62 43.469 -14.822 11.403 1.00 10.00 H new ATOM 0 HB3 GLU A 62 42.700 -13.611 12.410 1.00 10.00 H new ATOM 0 HG2 GLU A 62 41.183 -15.673 10.750 1.00 10.00 H new ATOM 0 HG3 GLU A 62 41.561 -15.860 12.451 1.00 10.00 H new ATOM 936 N TYR A 63 44.806 -12.530 10.002 1.00 10.00 N ATOM 937 CA TYR A 63 45.958 -11.627 9.966 1.00 10.00 C ATOM 938 C TYR A 63 45.702 -10.417 9.075 1.00 10.00 C ATOM 939 O TYR A 63 45.869 -9.279 9.507 1.00 10.00 O ATOM 940 CB TYR A 63 47.209 -12.382 9.485 1.00 10.00 C ATOM 941 CG TYR A 63 48.433 -11.514 9.261 1.00 10.00 C ATOM 942 CD1 TYR A 63 49.067 -10.864 10.339 1.00 10.00 C ATOM 943 CD2 TYR A 63 48.940 -11.367 7.955 1.00 10.00 C ATOM 944 CE1 TYR A 63 50.212 -10.074 10.110 1.00 10.00 C ATOM 945 CE2 TYR A 63 50.091 -10.596 7.725 1.00 10.00 C ATOM 946 CZ TYR A 63 50.730 -9.943 8.801 1.00 10.00 C ATOM 947 OH TYR A 63 51.844 -9.195 8.572 1.00 10.00 O ATOM 0 H TYR A 63 45.039 -13.480 9.714 1.00 10.00 H new ATOM 0 HA TYR A 63 46.122 -11.262 10.980 1.00 10.00 H new ATOM 0 HB2 TYR A 63 47.456 -13.150 10.218 1.00 10.00 H new ATOM 0 HB3 TYR A 63 46.970 -12.895 8.553 1.00 10.00 H new ATOM 0 HD1 TYR A 63 48.676 -10.971 11.340 1.00 10.00 H new ATOM 0 HD2 TYR A 63 48.441 -11.849 7.127 1.00 10.00 H new ATOM 0 HE1 TYR A 63 50.693 -9.569 10.934 1.00 10.00 H new ATOM 0 HE2 TYR A 63 50.487 -10.503 6.725 1.00 10.00 H new ATOM 0 HH TYR A 63 52.061 -9.215 7.616 1.00 10.00 H new ATOM 957 N ASN A 64 45.264 -10.660 7.842 1.00 10.00 N ATOM 958 CA ASN A 64 45.136 -9.620 6.829 1.00 10.00 C ATOM 959 C ASN A 64 43.980 -8.662 7.153 1.00 10.00 C ATOM 960 O ASN A 64 44.136 -7.449 7.024 1.00 10.00 O ATOM 961 CB ASN A 64 44.968 -10.283 5.452 1.00 10.00 C ATOM 962 CG ASN A 64 44.917 -9.257 4.331 1.00 10.00 C ATOM 963 OD1 ASN A 64 43.858 -8.821 3.901 1.00 10.00 O ATOM 964 ND2 ASN A 64 46.055 -8.832 3.827 1.00 10.00 N ATOM 0 H ASN A 64 44.988 -11.587 7.518 1.00 10.00 H new ATOM 0 HA ASN A 64 46.040 -9.011 6.817 1.00 10.00 H new ATOM 0 HB2 ASN A 64 45.795 -10.971 5.277 1.00 10.00 H new ATOM 0 HB3 ASN A 64 44.053 -10.876 5.444 1.00 10.00 H new ATOM 0 HD21 ASN A 64 46.054 -8.139 3.078 1.00 10.00 H new ATOM 0 HD22 ASN A 64 46.938 -9.195 4.185 1.00 10.00 H new ATOM 971 N LEU A 65 42.849 -9.192 7.632 1.00 10.00 N ATOM 972 CA LEU A 65 41.692 -8.399 8.060 1.00 10.00 C ATOM 973 C LEU A 65 42.010 -7.524 9.281 1.00 10.00 C ATOM 974 O LEU A 65 41.739 -6.323 9.277 1.00 10.00 O ATOM 975 CB LEU A 65 40.510 -9.350 8.334 1.00 10.00 C ATOM 976 CG LEU A 65 39.212 -8.651 8.785 1.00 10.00 C ATOM 977 CD1 LEU A 65 38.668 -7.686 7.729 1.00 10.00 C ATOM 978 CD2 LEU A 65 38.137 -9.698 9.074 1.00 10.00 C ATOM 0 H LEU A 65 42.710 -10.197 7.734 1.00 10.00 H new ATOM 0 HA LEU A 65 41.423 -7.709 7.260 1.00 10.00 H new ATOM 0 HB2 LEU A 65 40.303 -9.921 7.429 1.00 10.00 H new ATOM 0 HB3 LEU A 65 40.807 -10.065 9.101 1.00 10.00 H new ATOM 0 HG LEU A 65 39.457 -8.078 9.680 1.00 10.00 H new ATOM 0 HD11 LEU A 65 37.754 -7.221 8.098 1.00 10.00 H new ATOM 0 HD12 LEU A 65 39.410 -6.915 7.524 1.00 10.00 H new ATOM 0 HD13 LEU A 65 38.452 -8.234 6.812 1.00 10.00 H new ATOM 0 HD21 LEU A 65 37.221 -9.201 9.393 1.00 10.00 H new ATOM 0 HD22 LEU A 65 37.941 -10.277 8.171 1.00 10.00 H new ATOM 0 HD23 LEU A 65 38.482 -10.365 9.865 1.00 10.00 H new ATOM 990 N TYR A 66 42.619 -8.113 10.312 1.00 10.00 N ATOM 991 CA TYR A 66 42.991 -7.394 11.535 1.00 10.00 C ATOM 992 C TYR A 66 44.087 -6.350 11.280 1.00 10.00 C ATOM 993 O TYR A 66 44.001 -5.218 11.763 1.00 10.00 O ATOM 994 CB TYR A 66 43.407 -8.405 12.612 1.00 10.00 C ATOM 995 CG TYR A 66 43.562 -7.796 13.992 1.00 10.00 C ATOM 996 CD1 TYR A 66 42.417 -7.485 14.751 1.00 10.00 C ATOM 997 CD2 TYR A 66 44.844 -7.541 14.515 1.00 10.00 C ATOM 998 CE1 TYR A 66 42.550 -6.922 16.037 1.00 10.00 C ATOM 999 CE2 TYR A 66 44.982 -6.986 15.803 1.00 10.00 C ATOM 1000 CZ TYR A 66 43.836 -6.673 16.566 1.00 10.00 C ATOM 1001 OH TYR A 66 43.978 -6.134 17.809 1.00 10.00 O ATOM 0 H TYR A 66 42.869 -9.102 10.324 1.00 10.00 H new ATOM 0 HA TYR A 66 42.123 -6.838 11.889 1.00 10.00 H new ATOM 0 HB2 TYR A 66 42.664 -9.201 12.657 1.00 10.00 H new ATOM 0 HB3 TYR A 66 44.350 -8.866 12.320 1.00 10.00 H new ATOM 0 HD1 TYR A 66 41.434 -7.678 14.347 1.00 10.00 H new ATOM 0 HD2 TYR A 66 45.722 -7.771 13.929 1.00 10.00 H new ATOM 0 HE1 TYR A 66 41.671 -6.682 16.616 1.00 10.00 H new ATOM 0 HE2 TYR A 66 45.966 -6.800 16.207 1.00 10.00 H new ATOM 0 HH TYR A 66 44.931 -6.031 18.014 1.00 10.00 H new ATOM 1011 N ARG A 67 45.079 -6.691 10.447 1.00 10.00 N ATOM 1012 CA ARG A 67 46.120 -5.762 9.985 1.00 10.00 C ATOM 1013 C ARG A 67 45.543 -4.620 9.150 1.00 10.00 C ATOM 1014 O ARG A 67 45.890 -3.475 9.406 1.00 10.00 O ATOM 1015 CB ARG A 67 47.230 -6.526 9.243 1.00 10.00 C ATOM 1016 CG ARG A 67 48.408 -5.603 8.905 1.00 10.00 C ATOM 1017 CD ARG A 67 49.660 -6.400 8.515 1.00 10.00 C ATOM 1018 NE ARG A 67 50.851 -5.529 8.461 1.00 10.00 N ATOM 1019 CZ ARG A 67 51.519 -5.051 9.498 1.00 10.00 C ATOM 1020 NH1 ARG A 67 51.227 -5.345 10.730 1.00 10.00 N ATOM 1021 NH2 ARG A 67 52.519 -4.235 9.352 1.00 10.00 N ATOM 0 H ARG A 67 45.183 -7.633 10.070 1.00 10.00 H new ATOM 0 HA ARG A 67 46.567 -5.294 10.862 1.00 10.00 H new ATOM 0 HB2 ARG A 67 47.579 -7.355 9.859 1.00 10.00 H new ATOM 0 HB3 ARG A 67 46.828 -6.957 8.326 1.00 10.00 H new ATOM 0 HG2 ARG A 67 48.128 -4.941 8.085 1.00 10.00 H new ATOM 0 HG3 ARG A 67 48.632 -4.970 9.764 1.00 10.00 H new ATOM 0 HD2 ARG A 67 49.824 -7.201 9.236 1.00 10.00 H new ATOM 0 HD3 ARG A 67 49.507 -6.872 7.544 1.00 10.00 H new ATOM 0 HE ARG A 67 51.192 -5.271 7.535 1.00 10.00 H new ATOM 0 HH11 ARG A 67 50.449 -5.973 10.934 1.00 10.00 H new ATOM 0 HH12 ARG A 67 51.776 -4.948 11.493 1.00 10.00 H new ATOM 0 HH21 ARG A 67 52.809 -3.946 8.418 1.00 10.00 H new ATOM 0 HH22 ARG A 67 53.014 -3.884 10.171 1.00 10.00 H new ATOM 1035 N ASN A 68 44.616 -4.889 8.227 1.00 10.00 N ATOM 1036 CA ASN A 68 43.890 -3.851 7.484 1.00 10.00 C ATOM 1037 C ASN A 68 43.144 -2.886 8.411 1.00 10.00 C ATOM 1038 O ASN A 68 43.261 -1.670 8.252 1.00 10.00 O ATOM 1039 CB ASN A 68 42.969 -4.517 6.447 1.00 10.00 C ATOM 1040 CG ASN A 68 42.161 -3.502 5.655 1.00 10.00 C ATOM 1041 OD1 ASN A 68 41.025 -3.188 5.980 1.00 10.00 O ATOM 1042 ND2 ASN A 68 42.716 -2.955 4.596 1.00 10.00 N ATOM 0 H ASN A 68 44.345 -5.839 7.971 1.00 10.00 H new ATOM 0 HA ASN A 68 44.610 -3.230 6.952 1.00 10.00 H new ATOM 0 HB2 ASN A 68 43.570 -5.114 5.761 1.00 10.00 H new ATOM 0 HB3 ASN A 68 42.290 -5.202 6.955 1.00 10.00 H new ATOM 0 HD21 ASN A 68 42.199 -2.269 4.046 1.00 10.00 H new ATOM 0 HD22 ASN A 68 43.664 -3.217 4.324 1.00 10.00 H new ATOM 1049 N ALA A 69 42.455 -3.413 9.422 1.00 10.00 N ATOM 1050 CA ALA A 69 41.750 -2.581 10.388 1.00 10.00 C ATOM 1051 C ALA A 69 42.701 -1.708 11.238 1.00 10.00 C ATOM 1052 O ALA A 69 42.409 -0.534 11.480 1.00 10.00 O ATOM 1053 CB ALA A 69 40.854 -3.476 11.255 1.00 10.00 C ATOM 0 H ALA A 69 42.372 -4.415 9.591 1.00 10.00 H new ATOM 0 HA ALA A 69 41.129 -1.870 9.843 1.00 10.00 H new ATOM 0 HB1 ALA A 69 40.321 -2.863 11.982 1.00 10.00 H new ATOM 0 HB2 ALA A 69 40.135 -3.994 10.621 1.00 10.00 H new ATOM 0 HB3 ALA A 69 41.469 -4.208 11.779 1.00 10.00 H new ATOM 1059 N GLN A 70 43.863 -2.240 11.638 1.00 10.00 N ATOM 1060 CA GLN A 70 44.926 -1.474 12.301 1.00 10.00 C ATOM 1061 C GLN A 70 45.553 -0.414 11.370 1.00 10.00 C ATOM 1062 O GLN A 70 45.791 0.720 11.798 1.00 10.00 O ATOM 1063 CB GLN A 70 45.981 -2.457 12.846 1.00 10.00 C ATOM 1064 CG GLN A 70 47.170 -1.800 13.569 1.00 10.00 C ATOM 1065 CD GLN A 70 46.763 -0.997 14.805 1.00 10.00 C ATOM 1066 OE1 GLN A 70 46.766 -1.483 15.928 1.00 10.00 O ATOM 1067 NE2 GLN A 70 46.403 0.260 14.652 1.00 10.00 N ATOM 0 H GLN A 70 44.094 -3.225 11.509 1.00 10.00 H new ATOM 0 HA GLN A 70 44.492 -0.915 13.130 1.00 10.00 H new ATOM 0 HB2 GLN A 70 45.492 -3.146 13.535 1.00 10.00 H new ATOM 0 HB3 GLN A 70 46.363 -3.053 12.017 1.00 10.00 H new ATOM 0 HG2 GLN A 70 47.878 -2.574 13.865 1.00 10.00 H new ATOM 0 HG3 GLN A 70 47.690 -1.142 12.873 1.00 10.00 H new ATOM 0 HE21 GLN A 70 46.396 0.679 13.722 1.00 10.00 H new ATOM 0 HE22 GLN A 70 46.132 0.815 15.463 1.00 10.00 H new ATOM 1076 N SER A 71 45.789 -0.751 10.099 1.00 10.00 N ATOM 1077 CA SER A 71 46.335 0.160 9.083 1.00 10.00 C ATOM 1078 C SER A 71 45.433 1.364 8.809 1.00 10.00 C ATOM 1079 O SER A 71 45.951 2.455 8.582 1.00 10.00 O ATOM 1080 CB SER A 71 46.615 -0.573 7.766 1.00 10.00 C ATOM 1081 OG SER A 71 47.732 -1.436 7.911 1.00 10.00 O ATOM 0 H SER A 71 45.602 -1.686 9.737 1.00 10.00 H new ATOM 0 HA SER A 71 47.270 0.533 9.500 1.00 10.00 H new ATOM 0 HB2 SER A 71 45.738 -1.148 7.469 1.00 10.00 H new ATOM 0 HB3 SER A 71 46.806 0.150 6.973 1.00 10.00 H new ATOM 0 HG SER A 71 47.459 -2.247 8.389 1.00 10.00 H new ATOM 1087 N SER A 72 44.104 1.225 8.892 1.00 10.00 N ATOM 1088 CA SER A 72 43.165 2.352 8.746 1.00 10.00 C ATOM 1089 C SER A 72 43.368 3.468 9.784 1.00 10.00 C ATOM 1090 O SER A 72 43.115 4.634 9.481 1.00 10.00 O ATOM 1091 CB SER A 72 41.712 1.865 8.807 1.00 10.00 C ATOM 1092 OG SER A 72 41.439 0.982 7.729 1.00 10.00 O ATOM 0 H SER A 72 43.646 0.330 9.062 1.00 10.00 H new ATOM 0 HA SER A 72 43.380 2.780 7.767 1.00 10.00 H new ATOM 0 HB2 SER A 72 41.531 1.358 9.755 1.00 10.00 H new ATOM 0 HB3 SER A 72 41.034 2.718 8.767 1.00 10.00 H new ATOM 0 HG SER A 72 41.989 0.176 7.819 1.00 10.00 H new ATOM 1098 N ALA A 73 43.864 3.143 10.987 1.00 10.00 N ATOM 1099 CA ALA A 73 44.251 4.138 11.994 1.00 10.00 C ATOM 1100 C ALA A 73 45.658 4.712 11.741 1.00 10.00 C ATOM 1101 O ALA A 73 45.858 5.926 11.790 1.00 10.00 O ATOM 1102 CB ALA A 73 44.150 3.490 13.382 1.00 10.00 C ATOM 0 H ALA A 73 44.008 2.179 11.288 1.00 10.00 H new ATOM 0 HA ALA A 73 43.570 4.987 11.931 1.00 10.00 H new ATOM 0 HB1 ALA A 73 44.434 4.216 14.144 1.00 10.00 H new ATOM 0 HB2 ALA A 73 43.125 3.163 13.557 1.00 10.00 H new ATOM 0 HB3 ALA A 73 44.819 2.631 13.432 1.00 10.00 H new ATOM 1108 N VAL A 74 46.627 3.853 11.408 1.00 10.00 N ATOM 1109 CA VAL A 74 48.019 4.216 11.107 1.00 10.00 C ATOM 1110 C VAL A 74 48.139 5.092 9.849 1.00 10.00 C ATOM 1111 O VAL A 74 49.010 5.962 9.784 1.00 10.00 O ATOM 1112 CB VAL A 74 48.834 2.912 11.011 1.00 10.00 C ATOM 1113 CG1 VAL A 74 50.234 3.121 10.457 1.00 10.00 C ATOM 1114 CG2 VAL A 74 48.970 2.255 12.392 1.00 10.00 C ATOM 0 H VAL A 74 46.459 2.849 11.338 1.00 10.00 H new ATOM 0 HA VAL A 74 48.422 4.836 11.908 1.00 10.00 H new ATOM 0 HB VAL A 74 48.281 2.272 10.323 1.00 10.00 H new ATOM 0 HG11 VAL A 74 50.755 2.165 10.415 1.00 10.00 H new ATOM 0 HG12 VAL A 74 50.169 3.543 9.454 1.00 10.00 H new ATOM 0 HG13 VAL A 74 50.783 3.805 11.104 1.00 10.00 H new ATOM 0 HG21 VAL A 74 49.549 1.336 12.302 1.00 10.00 H new ATOM 0 HG22 VAL A 74 49.478 2.939 13.072 1.00 10.00 H new ATOM 0 HG23 VAL A 74 47.980 2.023 12.784 1.00 10.00 H new ATOM 1124 N LYS A 75 47.218 4.953 8.884 1.00 10.00 N ATOM 1125 CA LYS A 75 47.066 5.832 7.709 1.00 10.00 C ATOM 1126 C LYS A 75 46.977 7.317 8.084 1.00 10.00 C ATOM 1127 O LYS A 75 47.527 8.148 7.368 1.00 10.00 O ATOM 1128 CB LYS A 75 45.842 5.366 6.893 1.00 10.00 C ATOM 1129 CG LYS A 75 45.534 6.192 5.629 1.00 10.00 C ATOM 1130 CD LYS A 75 46.652 6.248 4.574 1.00 10.00 C ATOM 1131 CE LYS A 75 46.960 4.864 3.985 1.00 10.00 C ATOM 1132 NZ LYS A 75 47.941 4.950 2.869 1.00 10.00 N ATOM 0 H LYS A 75 46.532 4.198 8.899 1.00 10.00 H new ATOM 0 HA LYS A 75 47.963 5.748 7.095 1.00 10.00 H new ATOM 0 HB2 LYS A 75 45.997 4.328 6.599 1.00 10.00 H new ATOM 0 HB3 LYS A 75 44.966 5.386 7.541 1.00 10.00 H new ATOM 0 HG2 LYS A 75 44.639 5.783 5.160 1.00 10.00 H new ATOM 0 HG3 LYS A 75 45.297 7.211 5.933 1.00 10.00 H new ATOM 0 HD2 LYS A 75 46.360 6.926 3.772 1.00 10.00 H new ATOM 0 HD3 LYS A 75 47.555 6.659 5.025 1.00 10.00 H new ATOM 0 HE2 LYS A 75 47.353 4.214 4.767 1.00 10.00 H new ATOM 0 HE3 LYS A 75 46.038 4.407 3.625 1.00 10.00 H new ATOM 0 HZ1 LYS A 75 48.126 3.997 2.495 1.00 10.00 H new ATOM 0 HZ2 LYS A 75 47.555 5.550 2.113 1.00 10.00 H new ATOM 0 HZ3 LYS A 75 48.829 5.363 3.219 1.00 10.00 H new ATOM 1146 N SER A 76 46.377 7.646 9.231 1.00 10.00 N ATOM 1147 CA SER A 76 46.311 9.016 9.771 1.00 10.00 C ATOM 1148 C SER A 76 47.698 9.654 9.981 1.00 10.00 C ATOM 1149 O SER A 76 47.861 10.863 9.809 1.00 10.00 O ATOM 1150 CB SER A 76 45.529 8.997 11.092 1.00 10.00 C ATOM 1151 OG SER A 76 45.147 10.309 11.472 1.00 10.00 O ATOM 0 H SER A 76 45.913 6.958 9.825 1.00 10.00 H new ATOM 0 HA SER A 76 45.801 9.634 9.032 1.00 10.00 H new ATOM 0 HB2 SER A 76 44.642 8.372 10.986 1.00 10.00 H new ATOM 0 HB3 SER A 76 46.141 8.551 11.876 1.00 10.00 H new ATOM 0 HG SER A 76 44.649 10.273 12.315 1.00 10.00 H new ATOM 1157 N MET A 77 48.718 8.837 10.281 1.00 10.00 N ATOM 1158 CA MET A 77 50.114 9.267 10.449 1.00 10.00 C ATOM 1159 C MET A 77 50.942 9.075 9.168 1.00 10.00 C ATOM 1160 O MET A 77 51.736 9.948 8.815 1.00 10.00 O ATOM 1161 CB MET A 77 50.759 8.496 11.615 1.00 10.00 C ATOM 1162 CG MET A 77 50.032 8.700 12.951 1.00 10.00 C ATOM 1163 SD MET A 77 49.942 10.420 13.530 1.00 10.00 S ATOM 1164 CE MET A 77 48.959 10.176 15.034 1.00 10.00 C ATOM 0 H MET A 77 48.592 7.834 10.417 1.00 10.00 H new ATOM 0 HA MET A 77 50.105 10.334 10.670 1.00 10.00 H new ATOM 0 HB2 MET A 77 50.773 7.433 11.375 1.00 10.00 H new ATOM 0 HB3 MET A 77 51.797 8.813 11.721 1.00 10.00 H new ATOM 0 HG2 MET A 77 49.018 8.312 12.857 1.00 10.00 H new ATOM 0 HG3 MET A 77 50.533 8.103 13.713 1.00 10.00 H new ATOM 0 HE1 MET A 77 48.803 11.136 15.526 1.00 10.00 H new ATOM 0 HE2 MET A 77 47.994 9.741 14.772 1.00 10.00 H new ATOM 0 HE3 MET A 77 49.488 9.504 15.709 1.00 10.00 H new ATOM 1174 N LYS A 78 50.733 7.979 8.422 1.00 10.00 N ATOM 1175 CA LYS A 78 51.407 7.745 7.128 1.00 10.00 C ATOM 1176 C LYS A 78 51.053 8.790 6.065 1.00 10.00 C ATOM 1177 O LYS A 78 51.914 9.156 5.270 1.00 10.00 O ATOM 1178 CB LYS A 78 51.136 6.322 6.615 1.00 10.00 C ATOM 1179 CG LYS A 78 51.901 5.275 7.440 1.00 10.00 C ATOM 1180 CD LYS A 78 51.693 3.862 6.872 1.00 10.00 C ATOM 1181 CE LYS A 78 52.525 2.807 7.617 1.00 10.00 C ATOM 1182 NZ LYS A 78 53.976 2.903 7.303 1.00 10.00 N ATOM 0 H LYS A 78 50.095 7.231 8.694 1.00 10.00 H new ATOM 0 HA LYS A 78 52.475 7.851 7.316 1.00 10.00 H new ATOM 0 HB2 LYS A 78 50.067 6.114 6.661 1.00 10.00 H new ATOM 0 HB3 LYS A 78 51.430 6.249 5.568 1.00 10.00 H new ATOM 0 HG2 LYS A 78 52.964 5.516 7.443 1.00 10.00 H new ATOM 0 HG3 LYS A 78 51.564 5.307 8.476 1.00 10.00 H new ATOM 0 HD2 LYS A 78 50.637 3.599 6.934 1.00 10.00 H new ATOM 0 HD3 LYS A 78 51.962 3.854 5.816 1.00 10.00 H new ATOM 0 HE2 LYS A 78 52.380 2.926 8.691 1.00 10.00 H new ATOM 0 HE3 LYS A 78 52.164 1.812 7.355 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 54.494 2.171 7.829 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 54.120 2.763 6.283 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 54.329 3.842 7.577 1.00 10.00 H new ATOM 1196 N ASP A 79 49.838 9.339 6.085 1.00 10.00 N ATOM 1197 CA ASP A 79 49.432 10.468 5.233 1.00 10.00 C ATOM 1198 C ASP A 79 50.302 11.729 5.439 1.00 10.00 C ATOM 1199 O ASP A 79 50.494 12.507 4.502 1.00 10.00 O ATOM 1200 CB ASP A 79 47.949 10.771 5.487 1.00 10.00 C ATOM 1201 CG ASP A 79 47.409 11.879 4.566 1.00 10.00 C ATOM 1202 OD1 ASP A 79 47.257 11.631 3.345 1.00 10.00 O ATOM 1203 OD2 ASP A 79 47.103 12.990 5.064 1.00 10.00 O ATOM 0 H ASP A 79 49.094 9.010 6.701 1.00 10.00 H new ATOM 0 HA ASP A 79 49.583 10.177 4.194 1.00 10.00 H new ATOM 0 HB2 ASP A 79 47.365 9.863 5.339 1.00 10.00 H new ATOM 0 HB3 ASP A 79 47.815 11.070 6.527 1.00 10.00 H new ATOM 1208 N ILE A 80 50.877 11.908 6.638 1.00 10.00 N ATOM 1209 CA ILE A 80 51.865 12.957 6.933 1.00 10.00 C ATOM 1210 C ILE A 80 53.251 12.527 6.425 1.00 10.00 C ATOM 1211 O ILE A 80 53.889 13.244 5.652 1.00 10.00 O ATOM 1212 CB ILE A 80 51.911 13.281 8.452 1.00 10.00 C ATOM 1213 CG1 ILE A 80 50.503 13.583 9.024 1.00 10.00 C ATOM 1214 CG2 ILE A 80 52.865 14.463 8.710 1.00 10.00 C ATOM 1215 CD1 ILE A 80 50.467 13.760 10.548 1.00 10.00 C ATOM 0 H ILE A 80 50.665 11.318 7.443 1.00 10.00 H new ATOM 0 HA ILE A 80 51.564 13.867 6.415 1.00 10.00 H new ATOM 0 HB ILE A 80 52.285 12.397 8.969 1.00 10.00 H new ATOM 0 HG12 ILE A 80 50.120 14.489 8.555 1.00 10.00 H new ATOM 0 HG13 ILE A 80 49.829 12.772 8.748 1.00 10.00 H new ATOM 0 HG21 ILE A 80 52.891 14.683 9.777 1.00 10.00 H new ATOM 0 HG22 ILE A 80 53.867 14.203 8.369 1.00 10.00 H new ATOM 0 HG23 ILE A 80 52.513 15.340 8.167 1.00 10.00 H new ATOM 0 HD11 ILE A 80 49.445 13.968 10.866 1.00 10.00 H new ATOM 0 HD12 ILE A 80 50.818 12.847 11.029 1.00 10.00 H new ATOM 0 HD13 ILE A 80 51.112 14.591 10.833 1.00 10.00 H new ATOM 1227 N ASP A 81 53.715 11.347 6.840 1.00 10.00 N ATOM 1228 CA ASP A 81 55.084 10.866 6.596 1.00 10.00 C ATOM 1229 C ASP A 81 55.425 10.659 5.108 1.00 10.00 C ATOM 1230 O ASP A 81 56.514 11.025 4.660 1.00 10.00 O ATOM 1231 CB ASP A 81 55.303 9.574 7.391 1.00 10.00 C ATOM 1232 CG ASP A 81 56.765 9.098 7.320 1.00 10.00 C ATOM 1233 OD1 ASP A 81 57.641 9.741 7.947 1.00 10.00 O ATOM 1234 OD2 ASP A 81 57.037 8.065 6.662 1.00 10.00 O ATOM 0 H ASP A 81 53.144 10.684 7.364 1.00 10.00 H new ATOM 0 HA ASP A 81 55.764 11.648 6.934 1.00 10.00 H new ATOM 0 HB2 ASP A 81 55.024 9.737 8.432 1.00 10.00 H new ATOM 0 HB3 ASP A 81 54.648 8.794 7.004 1.00 10.00 H new ATOM 1239 N SER A 82 54.483 10.134 4.322 1.00 10.00 N ATOM 1240 CA SER A 82 54.643 9.858 2.883 1.00 10.00 C ATOM 1241 C SER A 82 54.744 11.113 1.995 1.00 10.00 C ATOM 1242 O SER A 82 54.972 10.988 0.791 1.00 10.00 O ATOM 1243 CB SER A 82 53.502 8.962 2.380 1.00 10.00 C ATOM 1244 OG SER A 82 53.577 7.678 2.987 1.00 10.00 O ATOM 0 H SER A 82 53.560 9.880 4.674 1.00 10.00 H new ATOM 0 HA SER A 82 55.602 9.348 2.795 1.00 10.00 H new ATOM 0 HB2 SER A 82 52.541 9.423 2.608 1.00 10.00 H new ATOM 0 HB3 SER A 82 53.559 8.863 1.296 1.00 10.00 H new ATOM 0 HG SER A 82 53.116 7.697 3.852 1.00 10.00 H new ATOM 1250 N SER A 83 54.612 12.323 2.556 1.00 10.00 N ATOM 1251 CA SER A 83 54.901 13.585 1.847 1.00 10.00 C ATOM 1252 C SER A 83 56.392 13.789 1.509 1.00 10.00 C ATOM 1253 O SER A 83 56.721 14.631 0.668 1.00 10.00 O ATOM 1254 CB SER A 83 54.382 14.789 2.647 1.00 10.00 C ATOM 1255 OG SER A 83 55.089 14.959 3.865 1.00 10.00 O ATOM 0 H SER A 83 54.301 12.458 3.518 1.00 10.00 H new ATOM 0 HA SER A 83 54.374 13.511 0.896 1.00 10.00 H new ATOM 0 HB2 SER A 83 54.475 15.692 2.044 1.00 10.00 H new ATOM 0 HB3 SER A 83 53.321 14.654 2.859 1.00 10.00 H new ATOM 0 HG SER A 83 54.639 14.458 4.577 1.00 10.00 H new ATOM 1261 N ILE A 84 57.296 13.027 2.141 1.00 10.00 N ATOM 1262 CA ILE A 84 58.747 13.053 1.897 1.00 10.00 C ATOM 1263 C ILE A 84 59.117 12.666 0.447 1.00 10.00 C ATOM 1264 O ILE A 84 58.415 11.882 -0.199 1.00 10.00 O ATOM 1265 CB ILE A 84 59.452 12.157 2.949 1.00 10.00 C ATOM 1266 CG1 ILE A 84 60.967 12.417 3.096 1.00 10.00 C ATOM 1267 CG2 ILE A 84 59.234 10.657 2.682 1.00 10.00 C ATOM 1268 CD1 ILE A 84 61.304 13.849 3.530 1.00 10.00 C ATOM 0 H ILE A 84 57.030 12.354 2.859 1.00 10.00 H new ATOM 0 HA ILE A 84 59.101 14.078 2.011 1.00 10.00 H new ATOM 0 HB ILE A 84 58.975 12.441 3.887 1.00 10.00 H new ATOM 0 HG12 ILE A 84 61.378 11.719 3.825 1.00 10.00 H new ATOM 0 HG13 ILE A 84 61.457 12.210 2.145 1.00 10.00 H new ATOM 0 HG21 ILE A 84 59.747 10.073 3.446 1.00 10.00 H new ATOM 0 HG22 ILE A 84 58.168 10.434 2.710 1.00 10.00 H new ATOM 0 HG23 ILE A 84 59.632 10.400 1.700 1.00 10.00 H new ATOM 0 HD11 ILE A 84 62.385 13.959 3.613 1.00 10.00 H new ATOM 0 HD12 ILE A 84 60.923 14.553 2.790 1.00 10.00 H new ATOM 0 HD13 ILE A 84 60.843 14.054 4.496 1.00 10.00 H new ATOM 1280 N LEU A 85 60.239 13.195 -0.061 1.00 10.00 N ATOM 1281 CA LEU A 85 60.758 12.913 -1.408 1.00 10.00 C ATOM 1282 C LEU A 85 62.300 12.996 -1.430 1.00 10.00 C ATOM 1283 O LEU A 85 62.890 13.954 -1.930 1.00 10.00 O ATOM 1284 CB LEU A 85 60.050 13.834 -2.436 1.00 10.00 C ATOM 1285 CG LEU A 85 59.969 13.329 -3.894 1.00 10.00 C ATOM 1286 CD1 LEU A 85 61.326 13.115 -4.566 1.00 10.00 C ATOM 1287 CD2 LEU A 85 59.169 12.030 -4.018 1.00 10.00 C ATOM 0 H LEU A 85 60.824 13.845 0.464 1.00 10.00 H new ATOM 0 HA LEU A 85 60.527 11.888 -1.700 1.00 10.00 H new ATOM 0 HB2 LEU A 85 59.035 14.016 -2.084 1.00 10.00 H new ATOM 0 HB3 LEU A 85 60.564 14.795 -2.439 1.00 10.00 H new ATOM 0 HG LEU A 85 59.458 14.140 -4.413 1.00 10.00 H new ATOM 0 HD11 LEU A 85 61.175 12.761 -5.586 1.00 10.00 H new ATOM 0 HD12 LEU A 85 61.874 14.057 -4.587 1.00 10.00 H new ATOM 0 HD13 LEU A 85 61.897 12.375 -4.005 1.00 10.00 H new ATOM 0 HD21 LEU A 85 59.142 11.718 -5.062 1.00 10.00 H new ATOM 0 HD22 LEU A 85 59.643 11.252 -3.419 1.00 10.00 H new ATOM 0 HD23 LEU A 85 58.152 12.194 -3.662 1.00 10.00 H new ATOM 1299 N GLU A 86 62.955 11.990 -0.839 1.00 10.00 N ATOM 1300 CA GLU A 86 64.428 11.894 -0.733 1.00 10.00 C ATOM 1301 C GLU A 86 64.998 10.516 -1.144 1.00 10.00 C ATOM 1302 O GLU A 86 66.210 10.307 -1.098 1.00 10.00 O ATOM 1303 CB GLU A 86 64.881 12.252 0.696 1.00 10.00 C ATOM 1304 CG GLU A 86 64.497 13.673 1.131 1.00 10.00 C ATOM 1305 CD GLU A 86 65.236 14.087 2.422 1.00 10.00 C ATOM 1306 OE1 GLU A 86 65.132 13.377 3.452 1.00 10.00 O ATOM 1307 OE2 GLU A 86 65.928 15.135 2.419 1.00 10.00 O ATOM 0 H GLU A 86 62.472 11.200 -0.410 1.00 10.00 H new ATOM 0 HA GLU A 86 64.831 12.612 -1.447 1.00 10.00 H new ATOM 0 HB2 GLU A 86 64.445 11.538 1.395 1.00 10.00 H new ATOM 0 HB3 GLU A 86 65.963 12.142 0.762 1.00 10.00 H new ATOM 0 HG2 GLU A 86 64.735 14.376 0.333 1.00 10.00 H new ATOM 0 HG3 GLU A 86 63.420 13.727 1.293 1.00 10.00 H new ATOM 1314 N HIS A 87 64.140 9.579 -1.567 1.00 10.00 N ATOM 1315 CA HIS A 87 64.491 8.181 -1.879 1.00 10.00 C ATOM 1316 C HIS A 87 63.834 7.662 -3.178 1.00 10.00 C ATOM 1317 O HIS A 87 63.776 6.454 -3.420 1.00 10.00 O ATOM 1318 CB HIS A 87 64.147 7.310 -0.658 1.00 10.00 C ATOM 1319 CG HIS A 87 62.677 7.303 -0.312 1.00 10.00 C ATOM 1320 ND1 HIS A 87 61.684 6.628 -0.986 1.00 10.00 N ATOM 1321 CD2 HIS A 87 62.075 7.992 0.708 1.00 10.00 C ATOM 1322 CE1 HIS A 87 60.510 6.905 -0.394 1.00 10.00 C ATOM 1323 NE2 HIS A 87 60.698 7.736 0.647 1.00 10.00 N ATOM 0 H HIS A 87 63.149 9.776 -1.707 1.00 10.00 H new ATOM 0 HA HIS A 87 65.561 8.125 -2.078 1.00 10.00 H new ATOM 0 HB2 HIS A 87 64.471 6.287 -0.850 1.00 10.00 H new ATOM 0 HB3 HIS A 87 64.712 7.667 0.203 1.00 10.00 H new ATOM 0 HD2 HIS A 87 62.573 8.621 1.431 1.00 10.00 H new ATOM 0 HE1 HIS A 87 59.553 6.516 -0.709 1.00 10.00 H new ATOM 0 HE2 HIS A 87 59.980 8.107 1.269 1.00 10.00 H new ATOM 1331 N HIS A 88 63.320 8.568 -4.020 1.00 10.00 N ATOM 1332 CA HIS A 88 62.678 8.251 -5.306 1.00 10.00 C ATOM 1333 C HIS A 88 63.642 7.606 -6.328 1.00 10.00 C ATOM 1334 O HIS A 88 63.207 6.877 -7.223 1.00 10.00 O ATOM 1335 CB HIS A 88 62.060 9.553 -5.848 1.00 10.00 C ATOM 1336 CG HIS A 88 61.234 9.427 -7.107 1.00 10.00 C ATOM 1337 ND1 HIS A 88 60.483 8.343 -7.513 1.00 10.00 N ATOM 1338 CD2 HIS A 88 61.047 10.411 -8.042 1.00 10.00 C ATOM 1339 CE1 HIS A 88 59.874 8.659 -8.668 1.00 10.00 C ATOM 1340 NE2 HIS A 88 60.188 9.915 -9.034 1.00 10.00 N ATOM 0 H HIS A 88 63.339 9.568 -3.822 1.00 10.00 H new ATOM 0 HA HIS A 88 61.907 7.498 -5.143 1.00 10.00 H new ATOM 0 HB2 HIS A 88 61.432 9.984 -5.068 1.00 10.00 H new ATOM 0 HB3 HIS A 88 62.866 10.262 -6.037 1.00 10.00 H new ATOM 0 HD2 HIS A 88 61.485 11.398 -8.019 1.00 10.00 H new ATOM 0 HE1 HIS A 88 59.225 7.999 -9.224 1.00 10.00 H new ATOM 0 HE2 HIS A 88 59.866 10.408 -9.867 1.00 10.00 H new ATOM 1348 N HIS A 89 64.952 7.836 -6.180 1.00 10.00 N ATOM 1349 CA HIS A 89 66.026 7.291 -7.022 1.00 10.00 C ATOM 1350 C HIS A 89 67.185 6.768 -6.147 1.00 10.00 C ATOM 1351 O HIS A 89 67.384 7.235 -5.022 1.00 10.00 O ATOM 1352 CB HIS A 89 66.548 8.385 -7.976 1.00 10.00 C ATOM 1353 CG HIS A 89 65.532 9.063 -8.872 1.00 10.00 C ATOM 1354 ND1 HIS A 89 64.296 8.590 -9.256 1.00 10.00 N ATOM 1355 CD2 HIS A 89 65.686 10.290 -9.464 1.00 10.00 C ATOM 1356 CE1 HIS A 89 63.711 9.511 -10.040 1.00 10.00 C ATOM 1357 NE2 HIS A 89 64.526 10.570 -10.203 1.00 10.00 N ATOM 0 H HIS A 89 65.310 8.435 -5.436 1.00 10.00 H new ATOM 0 HA HIS A 89 65.625 6.462 -7.605 1.00 10.00 H new ATOM 0 HB2 HIS A 89 67.035 9.153 -7.375 1.00 10.00 H new ATOM 0 HB3 HIS A 89 67.316 7.942 -8.610 1.00 10.00 H new ATOM 0 HD1 HIS A 89 63.893 7.692 -8.990 1.00 10.00 H new ATOM 0 HD2 HIS A 89 66.551 10.931 -9.377 1.00 10.00 H new ATOM 0 HE1 HIS A 89 62.728 9.415 -10.477 1.00 10.00 H new ATOM 1365 N HIS A 90 67.977 5.827 -6.673 1.00 10.00 N ATOM 1366 CA HIS A 90 69.133 5.230 -5.976 1.00 10.00 C ATOM 1367 C HIS A 90 70.439 6.051 -6.102 1.00 10.00 C ATOM 1368 O HIS A 90 71.466 5.676 -5.530 1.00 10.00 O ATOM 1369 CB HIS A 90 69.328 3.789 -6.479 1.00 10.00 C ATOM 1370 CG HIS A 90 68.147 2.892 -6.191 1.00 10.00 C ATOM 1371 ND1 HIS A 90 67.754 2.433 -4.953 1.00 10.00 N ATOM 1372 CD2 HIS A 90 67.260 2.389 -7.107 1.00 10.00 C ATOM 1373 CE1 HIS A 90 66.656 1.674 -5.115 1.00 10.00 C ATOM 1374 NE2 HIS A 90 66.315 1.616 -6.416 1.00 10.00 N ATOM 0 H HIS A 90 67.835 5.450 -7.610 1.00 10.00 H new ATOM 0 HA HIS A 90 68.906 5.232 -4.910 1.00 10.00 H new ATOM 0 HB2 HIS A 90 69.508 3.808 -7.554 1.00 10.00 H new ATOM 0 HB3 HIS A 90 70.219 3.366 -6.014 1.00 10.00 H new ATOM 0 HD2 HIS A 90 67.284 2.558 -8.173 1.00 10.00 H new ATOM 0 HE1 HIS A 90 66.123 1.181 -4.315 1.00 10.00 H new ATOM 0 HE2 HIS A 90 65.526 1.110 -6.819 1.00 10.00 H new ATOM 1382 N HIS A 91 70.413 7.169 -6.836 1.00 10.00 N ATOM 1383 CA HIS A 91 71.522 8.115 -7.014 1.00 10.00 C ATOM 1384 C HIS A 91 70.980 9.548 -7.200 1.00 10.00 C ATOM 1385 O HIS A 91 69.818 9.727 -7.584 1.00 10.00 O ATOM 1386 CB HIS A 91 72.363 7.665 -8.221 1.00 10.00 C ATOM 1387 CG HIS A 91 73.601 8.497 -8.451 1.00 10.00 C ATOM 1388 ND1 HIS A 91 74.716 8.547 -7.641 1.00 10.00 N ATOM 1389 CD2 HIS A 91 73.824 9.356 -9.495 1.00 10.00 C ATOM 1390 CE1 HIS A 91 75.589 9.413 -8.183 1.00 10.00 C ATOM 1391 NE2 HIS A 91 75.091 9.931 -9.321 1.00 10.00 N ATOM 0 H HIS A 91 69.577 7.453 -7.347 1.00 10.00 H new ATOM 0 HA HIS A 91 72.155 8.124 -6.127 1.00 10.00 H new ATOM 0 HB2 HIS A 91 72.658 6.625 -8.078 1.00 10.00 H new ATOM 0 HB3 HIS A 91 71.743 7.700 -9.116 1.00 10.00 H new ATOM 0 HD2 HIS A 91 73.143 9.555 -10.309 1.00 10.00 H new ATOM 0 HE1 HIS A 91 76.554 9.659 -7.765 1.00 10.00 H new ATOM 0 HE2 HIS A 91 75.545 10.607 -9.935 1.00 10.00 H new ATOM 1399 N HIS A 92 71.816 10.563 -6.936 1.00 10.00 N ATOM 1400 CA HIS A 92 71.428 11.983 -6.860 1.00 10.00 C ATOM 1401 C HIS A 92 72.470 12.903 -7.528 1.00 10.00 C ATOM 1402 O HIS A 92 72.092 13.650 -8.460 1.00 10.00 O ATOM 1403 CB HIS A 92 71.197 12.383 -5.388 1.00 10.00 C ATOM 1404 CG HIS A 92 70.360 11.418 -4.579 1.00 10.00 C ATOM 1405 ND1 HIS A 92 69.039 11.091 -4.790 1.00 10.00 N ATOM 1406 CD2 HIS A 92 70.792 10.670 -3.516 1.00 10.00 C ATOM 1407 CE1 HIS A 92 68.685 10.164 -3.883 1.00 10.00 C ATOM 1408 NE2 HIS A 92 69.724 9.876 -3.078 1.00 10.00 N ATOM 1409 OXT HIS A 92 73.656 12.879 -7.124 1.00 10.00 O ATOM 0 H HIS A 92 72.811 10.416 -6.764 1.00 10.00 H new ATOM 0 HA HIS A 92 70.498 12.110 -7.413 1.00 10.00 H new ATOM 0 HB2 HIS A 92 72.167 12.493 -4.902 1.00 10.00 H new ATOM 0 HB3 HIS A 92 70.717 13.361 -5.366 1.00 10.00 H new ATOM 0 HD2 HIS A 92 71.784 10.689 -3.089 1.00 10.00 H new ATOM 0 HE1 HIS A 92 67.706 9.714 -3.811 1.00 10.00 H new ATOM 0 HE2 HIS A 92 69.732 9.212 -2.304 1.00 10.00 H new TER 1417 HIS A 92