USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 684 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0605) USER MOD Single : A 2 THR OG1 : rot 180:sc= -0.147 USER MOD Single : A 5 THR OG1 : rot -67:sc= 0.947 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 110:sc= 1.15 USER MOD Single : A 16 CYS SG : rot -163:sc= -0.978 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= -0.822 USER MOD Single : A 41 SER OG : rot 55:sc= 1.11 USER MOD Single : A 46 ASN : amide:sc= -1.31 X(o=-1.3,f=-0.84) USER MOD Single : A 47 THR OG1 : rot -73:sc= -0.781 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.104 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.00688 USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 94:sc= 1.05 USER MOD Single : A 78 ASN : amide:sc= -9.88! C(o=-9.9!,f=-21!) USER MOD Single : A 80 SER OG : rot -100:sc= -0.841 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= -0.0108 USER MOD Single : A 87 SER OG : rot 33:sc= 1.33 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 63.925 13.456 7.067 1.00 0.00 N ATOM 2 CA MET A 1 63.409 12.284 6.305 1.00 0.00 C ATOM 3 C MET A 1 63.624 12.514 4.812 1.00 0.00 C ATOM 4 O MET A 1 62.746 13.022 4.115 1.00 0.00 O ATOM 5 CB MET A 1 61.915 12.109 6.584 1.00 0.00 C ATOM 6 CG MET A 1 61.713 11.696 8.043 1.00 0.00 C ATOM 7 SD MET A 1 60.087 10.922 8.230 1.00 0.00 S ATOM 8 CE MET A 1 60.287 10.385 9.946 1.00 0.00 C ATOM 0 H1 MET A 1 63.857 13.264 8.087 1.00 0.00 H new ATOM 0 H2 MET A 1 64.919 13.625 6.812 1.00 0.00 H new ATOM 0 H3 MET A 1 63.360 14.297 6.834 1.00 0.00 H new ATOM 0 HA MET A 1 63.943 11.386 6.616 1.00 0.00 H new ATOM 0 HB2 MET A 1 61.385 13.040 6.382 1.00 0.00 H new ATOM 0 HB3 MET A 1 61.496 11.353 5.920 1.00 0.00 H new ATOM 0 HG2 MET A 1 62.496 11.001 8.347 1.00 0.00 H new ATOM 0 HG3 MET A 1 61.790 12.568 8.693 1.00 0.00 H new ATOM 0 HE1 MET A 1 59.383 9.873 10.275 1.00 0.00 H new ATOM 0 HE2 MET A 1 61.136 9.705 10.018 1.00 0.00 H new ATOM 0 HE3 MET A 1 60.463 11.253 10.581 1.00 0.00 H new ATOM 20 N THR A 2 64.805 12.134 4.332 1.00 0.00 N ATOM 21 CA THR A 2 65.132 12.303 2.919 1.00 0.00 C ATOM 22 C THR A 2 65.431 10.951 2.277 1.00 0.00 C ATOM 23 O THR A 2 65.841 10.006 2.950 1.00 0.00 O ATOM 24 CB THR A 2 66.350 13.217 2.755 1.00 0.00 C ATOM 25 OG1 THR A 2 66.717 13.277 1.383 1.00 0.00 O ATOM 26 CG2 THR A 2 67.517 12.667 3.577 1.00 0.00 C ATOM 0 H THR A 2 65.544 11.711 4.893 1.00 0.00 H new ATOM 0 HA THR A 2 64.272 12.757 2.426 1.00 0.00 H new ATOM 0 HB THR A 2 66.103 14.219 3.106 1.00 0.00 H new ATOM 0 HG1 THR A 2 67.495 13.863 1.278 1.00 0.00 H new ATOM 0 HG21 THR A 2 68.383 13.318 3.460 1.00 0.00 H new ATOM 0 HG22 THR A 2 67.234 12.626 4.629 1.00 0.00 H new ATOM 0 HG23 THR A 2 67.767 11.665 3.229 1.00 0.00 H new ATOM 34 N LEU A 3 65.220 10.873 0.965 1.00 0.00 N ATOM 35 CA LEU A 3 65.469 9.631 0.234 1.00 0.00 C ATOM 36 C LEU A 3 66.933 9.215 0.363 1.00 0.00 C ATOM 37 O LEU A 3 67.695 9.805 1.131 1.00 0.00 O ATOM 38 CB LEU A 3 65.105 9.799 -1.247 1.00 0.00 C ATOM 39 CG LEU A 3 66.055 10.672 -2.072 1.00 0.00 C ATOM 40 CD1 LEU A 3 65.848 10.381 -3.559 1.00 0.00 C ATOM 41 CD2 LEU A 3 65.757 12.148 -1.798 1.00 0.00 C ATOM 0 H LEU A 3 64.881 11.645 0.391 1.00 0.00 H new ATOM 0 HA LEU A 3 64.843 8.851 0.667 1.00 0.00 H new ATOM 0 HB2 LEU A 3 65.060 8.811 -1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 3 64.104 10.225 -1.309 1.00 0.00 H new ATOM 0 HG LEU A 3 67.086 10.451 -1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 3 66.523 11.001 -4.149 1.00 0.00 H new ATOM 0 HD12 LEU A 3 66.056 9.329 -3.756 1.00 0.00 H new ATOM 0 HD13 LEU A 3 64.817 10.605 -3.833 1.00 0.00 H new ATOM 0 HD21 LEU A 3 66.433 12.771 -2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 3 64.726 12.369 -2.076 1.00 0.00 H new ATOM 0 HD23 LEU A 3 65.899 12.357 -0.738 1.00 0.00 H new ATOM 53 N LEU A 4 67.317 8.192 -0.394 1.00 0.00 N ATOM 54 CA LEU A 4 68.692 7.703 -0.356 1.00 0.00 C ATOM 55 C LEU A 4 69.250 7.574 -1.776 1.00 0.00 C ATOM 56 O LEU A 4 68.739 8.189 -2.713 1.00 0.00 O ATOM 57 CB LEU A 4 68.761 6.351 0.384 1.00 0.00 C ATOM 58 CG LEU A 4 68.323 5.109 -0.419 1.00 0.00 C ATOM 59 CD1 LEU A 4 69.304 3.957 -0.174 1.00 0.00 C ATOM 60 CD2 LEU A 4 66.921 4.682 0.023 1.00 0.00 C ATOM 0 H LEU A 4 66.703 7.689 -1.035 1.00 0.00 H new ATOM 0 HA LEU A 4 69.304 8.422 0.188 1.00 0.00 H new ATOM 0 HB2 LEU A 4 69.786 6.197 0.720 1.00 0.00 H new ATOM 0 HB3 LEU A 4 68.140 6.418 1.277 1.00 0.00 H new ATOM 0 HG LEU A 4 68.314 5.356 -1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 4 68.989 3.083 -0.744 1.00 0.00 H new ATOM 0 HD12 LEU A 4 70.303 4.256 -0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 4 69.319 3.711 0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 4 66.612 3.804 -0.545 1.00 0.00 H new ATOM 0 HD22 LEU A 4 66.932 4.441 1.086 1.00 0.00 H new ATOM 0 HD23 LEU A 4 66.219 5.496 -0.157 1.00 0.00 H new ATOM 72 N THR A 5 70.303 6.773 -1.926 1.00 0.00 N ATOM 73 CA THR A 5 70.918 6.582 -3.235 1.00 0.00 C ATOM 74 C THR A 5 71.670 5.258 -3.297 1.00 0.00 C ATOM 75 O THR A 5 71.740 4.514 -2.319 1.00 0.00 O ATOM 76 CB THR A 5 71.896 7.716 -3.526 1.00 0.00 C ATOM 77 OG1 THR A 5 72.724 7.928 -2.390 1.00 0.00 O ATOM 78 CG2 THR A 5 71.112 8.987 -3.830 1.00 0.00 C ATOM 0 H THR A 5 70.743 6.252 -1.167 1.00 0.00 H new ATOM 0 HA THR A 5 70.121 6.576 -3.979 1.00 0.00 H new ATOM 0 HB THR A 5 72.517 7.456 -4.383 1.00 0.00 H new ATOM 0 HG1 THR A 5 72.182 8.270 -1.649 1.00 0.00 H new ATOM 0 HG21 THR A 5 71.806 9.801 -4.039 1.00 0.00 H new ATOM 0 HG22 THR A 5 70.474 8.822 -4.698 1.00 0.00 H new ATOM 0 HG23 THR A 5 70.495 9.248 -2.971 1.00 0.00 H new ATOM 86 N LEU A 6 72.239 4.982 -4.466 1.00 0.00 N ATOM 87 CA LEU A 6 72.998 3.749 -4.665 1.00 0.00 C ATOM 88 C LEU A 6 74.255 3.762 -3.808 1.00 0.00 C ATOM 89 O LEU A 6 74.654 2.743 -3.245 1.00 0.00 O ATOM 90 CB LEU A 6 73.397 3.594 -6.134 1.00 0.00 C ATOM 91 CG LEU A 6 74.108 2.284 -6.478 1.00 0.00 C ATOM 92 CD1 LEU A 6 73.165 1.107 -6.221 1.00 0.00 C ATOM 93 CD2 LEU A 6 74.513 2.297 -7.954 1.00 0.00 C ATOM 0 H LEU A 6 72.191 5.589 -5.285 1.00 0.00 H new ATOM 0 HA LEU A 6 72.365 2.911 -4.374 1.00 0.00 H new ATOM 0 HB2 LEU A 6 72.500 3.675 -6.749 1.00 0.00 H new ATOM 0 HB3 LEU A 6 74.047 4.425 -6.408 1.00 0.00 H new ATOM 0 HG LEU A 6 74.997 2.180 -5.856 1.00 0.00 H new ATOM 0 HD11 LEU A 6 73.672 0.174 -6.466 1.00 0.00 H new ATOM 0 HD12 LEU A 6 72.874 1.096 -5.171 1.00 0.00 H new ATOM 0 HD13 LEU A 6 72.276 1.211 -6.843 1.00 0.00 H new ATOM 0 HD21 LEU A 6 75.020 1.364 -8.200 1.00 0.00 H new ATOM 0 HD22 LEU A 6 73.623 2.401 -8.575 1.00 0.00 H new ATOM 0 HD23 LEU A 6 75.185 3.135 -8.140 1.00 0.00 H new ATOM 105 N SER A 7 74.871 4.932 -3.712 1.00 0.00 N ATOM 106 CA SER A 7 76.085 5.077 -2.915 1.00 0.00 C ATOM 107 C SER A 7 75.793 4.775 -1.449 1.00 0.00 C ATOM 108 O SER A 7 76.602 4.167 -0.751 1.00 0.00 O ATOM 109 CB SER A 7 76.636 6.498 -3.032 1.00 0.00 C ATOM 110 OG SER A 7 77.529 6.564 -4.136 1.00 0.00 O ATOM 0 H SER A 7 74.556 5.787 -4.170 1.00 0.00 H new ATOM 0 HA SER A 7 76.825 4.371 -3.293 1.00 0.00 H new ATOM 0 HB2 SER A 7 75.819 7.207 -3.167 1.00 0.00 H new ATOM 0 HB3 SER A 7 77.153 6.777 -2.114 1.00 0.00 H new ATOM 0 HG SER A 7 77.884 7.474 -4.216 1.00 0.00 H new ATOM 116 N ASP A 8 74.622 5.208 -0.991 1.00 0.00 N ATOM 117 CA ASP A 8 74.222 4.985 0.392 1.00 0.00 C ATOM 118 C ASP A 8 74.097 3.493 0.685 1.00 0.00 C ATOM 119 O ASP A 8 74.610 2.998 1.684 1.00 0.00 O ATOM 120 CB ASP A 8 72.878 5.659 0.663 1.00 0.00 C ATOM 121 CG ASP A 8 73.009 7.164 0.467 1.00 0.00 C ATOM 122 OD1 ASP A 8 74.060 7.695 0.787 1.00 0.00 O ATOM 123 OD2 ASP A 8 72.055 7.766 0.001 1.00 0.00 O ATOM 0 H ASP A 8 73.938 5.712 -1.555 1.00 0.00 H new ATOM 0 HA ASP A 8 74.988 5.413 1.039 1.00 0.00 H new ATOM 0 HB2 ASP A 8 72.118 5.260 -0.009 1.00 0.00 H new ATOM 0 HB3 ASP A 8 72.550 5.442 1.680 1.00 0.00 H new ATOM 128 N LEU A 9 73.402 2.785 -0.197 1.00 0.00 N ATOM 129 CA LEU A 9 73.202 1.348 -0.028 1.00 0.00 C ATOM 130 C LEU A 9 74.544 0.621 -0.023 1.00 0.00 C ATOM 131 O LEU A 9 74.921 -0.026 0.955 1.00 0.00 O ATOM 132 CB LEU A 9 72.348 0.807 -1.183 1.00 0.00 C ATOM 133 CG LEU A 9 71.621 -0.530 -0.950 1.00 0.00 C ATOM 134 CD1 LEU A 9 72.480 -1.498 -0.126 1.00 0.00 C ATOM 135 CD2 LEU A 9 70.304 -0.271 -0.216 1.00 0.00 C ATOM 0 H LEU A 9 72.969 3.178 -1.033 1.00 0.00 H new ATOM 0 HA LEU A 9 72.697 1.178 0.923 1.00 0.00 H new ATOM 0 HB2 LEU A 9 71.600 1.560 -1.433 1.00 0.00 H new ATOM 0 HB3 LEU A 9 72.991 0.695 -2.056 1.00 0.00 H new ATOM 0 HG LEU A 9 71.429 -0.986 -1.921 1.00 0.00 H new ATOM 0 HD11 LEU A 9 71.937 -2.432 0.020 1.00 0.00 H new ATOM 0 HD12 LEU A 9 73.411 -1.699 -0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 9 72.702 -1.052 0.843 1.00 0.00 H new ATOM 0 HD21 LEU A 9 69.788 -1.217 -0.050 1.00 0.00 H new ATOM 0 HD22 LEU A 9 70.509 0.203 0.744 1.00 0.00 H new ATOM 0 HD23 LEU A 9 69.675 0.385 -0.818 1.00 0.00 H new ATOM 147 N LEU A 10 75.243 0.727 -1.146 1.00 0.00 N ATOM 148 CA LEU A 10 76.548 0.074 -1.323 1.00 0.00 C ATOM 149 C LEU A 10 77.474 0.275 -0.119 1.00 0.00 C ATOM 150 O LEU A 10 78.059 -0.679 0.393 1.00 0.00 O ATOM 151 CB LEU A 10 77.231 0.620 -2.580 1.00 0.00 C ATOM 152 CG LEU A 10 76.858 -0.083 -3.892 1.00 0.00 C ATOM 153 CD1 LEU A 10 75.335 -0.183 -4.029 1.00 0.00 C ATOM 154 CD2 LEU A 10 77.416 0.716 -5.071 1.00 0.00 C ATOM 0 H LEU A 10 74.931 1.261 -1.957 1.00 0.00 H new ATOM 0 HA LEU A 10 76.361 -0.995 -1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 10 76.989 1.679 -2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 10 78.310 0.551 -2.445 1.00 0.00 H new ATOM 0 HG LEU A 10 77.282 -1.087 -3.886 1.00 0.00 H new ATOM 0 HD11 LEU A 10 75.086 -0.684 -4.964 1.00 0.00 H new ATOM 0 HD12 LEU A 10 74.931 -0.754 -3.193 1.00 0.00 H new ATOM 0 HD13 LEU A 10 74.903 0.818 -4.027 1.00 0.00 H new ATOM 0 HD21 LEU A 10 77.153 0.219 -6.005 1.00 0.00 H new ATOM 0 HD22 LEU A 10 76.993 1.720 -5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 10 78.501 0.779 -4.987 1.00 0.00 H new ATOM 166 N THR A 11 77.612 1.521 0.315 1.00 0.00 N ATOM 167 CA THR A 11 78.471 1.841 1.439 1.00 0.00 C ATOM 168 C THR A 11 78.046 1.079 2.694 1.00 0.00 C ATOM 169 O THR A 11 78.846 0.375 3.306 1.00 0.00 O ATOM 170 CB THR A 11 78.411 3.343 1.703 1.00 0.00 C ATOM 171 OG1 THR A 11 78.719 4.043 0.508 1.00 0.00 O ATOM 172 CG2 THR A 11 79.422 3.709 2.772 1.00 0.00 C ATOM 0 H THR A 11 77.138 2.325 -0.097 1.00 0.00 H new ATOM 0 HA THR A 11 79.491 1.544 1.193 1.00 0.00 H new ATOM 0 HB THR A 11 77.410 3.613 2.039 1.00 0.00 H new ATOM 0 HG1 THR A 11 77.911 4.483 0.169 1.00 0.00 H new ATOM 0 HG21 THR A 11 79.380 4.782 2.961 1.00 0.00 H new ATOM 0 HG22 THR A 11 79.192 3.169 3.691 1.00 0.00 H new ATOM 0 HG23 THR A 11 80.423 3.439 2.434 1.00 0.00 H new ATOM 180 N LEU A 12 76.777 1.234 3.068 1.00 0.00 N ATOM 181 CA LEU A 12 76.248 0.558 4.260 1.00 0.00 C ATOM 182 C LEU A 12 76.462 -0.944 4.166 1.00 0.00 C ATOM 183 O LEU A 12 76.995 -1.578 5.077 1.00 0.00 O ATOM 184 CB LEU A 12 74.754 0.829 4.408 1.00 0.00 C ATOM 185 CG LEU A 12 74.372 2.303 4.416 1.00 0.00 C ATOM 186 CD1 LEU A 12 72.972 2.480 3.824 1.00 0.00 C ATOM 187 CD2 LEU A 12 74.387 2.817 5.854 1.00 0.00 C ATOM 0 H LEU A 12 76.100 1.814 2.572 1.00 0.00 H new ATOM 0 HA LEU A 12 76.782 0.949 5.126 1.00 0.00 H new ATOM 0 HB2 LEU A 12 74.227 0.335 3.592 1.00 0.00 H new ATOM 0 HB3 LEU A 12 74.406 0.372 5.335 1.00 0.00 H new ATOM 0 HG LEU A 12 75.087 2.866 3.816 1.00 0.00 H new ATOM 0 HD11 LEU A 12 72.704 3.537 3.832 1.00 0.00 H new ATOM 0 HD12 LEU A 12 72.961 2.111 2.798 1.00 0.00 H new ATOM 0 HD13 LEU A 12 72.252 1.918 4.419 1.00 0.00 H new ATOM 0 HD21 LEU A 12 74.114 3.872 5.866 1.00 0.00 H new ATOM 0 HD22 LEU A 12 73.672 2.250 6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 12 75.386 2.696 6.273 1.00 0.00 H new ATOM 199 N LEU A 13 76.042 -1.501 3.042 1.00 0.00 N ATOM 200 CA LEU A 13 76.191 -2.939 2.806 1.00 0.00 C ATOM 201 C LEU A 13 77.662 -3.336 2.898 1.00 0.00 C ATOM 202 O LEU A 13 78.001 -4.431 3.348 1.00 0.00 O ATOM 203 CB LEU A 13 75.639 -3.314 1.424 1.00 0.00 C ATOM 204 CG LEU A 13 74.346 -4.131 1.446 1.00 0.00 C ATOM 205 CD1 LEU A 13 73.818 -4.293 0.018 1.00 0.00 C ATOM 206 CD2 LEU A 13 74.625 -5.513 2.046 1.00 0.00 C ATOM 0 H LEU A 13 75.598 -0.989 2.280 1.00 0.00 H new ATOM 0 HA LEU A 13 75.627 -3.475 3.569 1.00 0.00 H new ATOM 0 HB2 LEU A 13 75.464 -2.399 0.859 1.00 0.00 H new ATOM 0 HB3 LEU A 13 76.400 -3.880 0.886 1.00 0.00 H new ATOM 0 HG LEU A 13 73.602 -3.614 2.052 1.00 0.00 H new ATOM 0 HD11 LEU A 13 72.897 -4.875 0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 13 73.619 -3.311 -0.410 1.00 0.00 H new ATOM 0 HD13 LEU A 13 74.562 -4.809 -0.589 1.00 0.00 H new ATOM 0 HD21 LEU A 13 73.704 -6.095 2.062 1.00 0.00 H new ATOM 0 HD22 LEU A 13 75.370 -6.029 1.440 1.00 0.00 H new ATOM 0 HD23 LEU A 13 75.000 -5.399 3.063 1.00 0.00 H new ATOM 218 N ARG A 14 78.528 -2.427 2.467 1.00 0.00 N ATOM 219 CA ARG A 14 79.960 -2.678 2.502 1.00 0.00 C ATOM 220 C ARG A 14 80.484 -2.636 3.931 1.00 0.00 C ATOM 221 O ARG A 14 81.091 -3.595 4.408 1.00 0.00 O ATOM 222 CB ARG A 14 80.697 -1.641 1.662 1.00 0.00 C ATOM 223 CG ARG A 14 80.659 -2.072 0.191 1.00 0.00 C ATOM 224 CD ARG A 14 82.068 -2.441 -0.292 1.00 0.00 C ATOM 225 NE ARG A 14 82.161 -3.879 -0.558 1.00 0.00 N ATOM 226 CZ ARG A 14 82.326 -4.779 0.424 1.00 0.00 C ATOM 227 NH1 ARG A 14 82.427 -4.410 1.678 1.00 0.00 N ATOM 228 NH2 ARG A 14 82.390 -6.048 0.125 1.00 0.00 N ATOM 0 H ARG A 14 78.264 -1.516 2.092 1.00 0.00 H new ATOM 0 HA ARG A 14 80.137 -3.672 2.092 1.00 0.00 H new ATOM 0 HB2 ARG A 14 80.232 -0.662 1.780 1.00 0.00 H new ATOM 0 HB3 ARG A 14 81.729 -1.547 2.000 1.00 0.00 H new ATOM 0 HG2 ARG A 14 79.991 -2.925 0.072 1.00 0.00 H new ATOM 0 HG3 ARG A 14 80.257 -1.265 -0.421 1.00 0.00 H new ATOM 0 HD2 ARG A 14 82.306 -1.882 -1.197 1.00 0.00 H new ATOM 0 HD3 ARG A 14 82.803 -2.157 0.461 1.00 0.00 H new ATOM 0 HE ARG A 14 82.098 -4.207 -1.522 1.00 0.00 H new ATOM 0 HH11 ARG A 14 82.381 -3.421 1.924 1.00 0.00 H new ATOM 0 HH12 ARG A 14 82.552 -5.112 2.408 1.00 0.00 H new ATOM 0 HH21 ARG A 14 82.315 -6.347 -0.847 1.00 0.00 H new ATOM 0 HH22 ARG A 14 82.515 -6.740 0.864 1.00 0.00 H new ATOM 242 N GLU A 15 80.237 -1.522 4.620 1.00 0.00 N ATOM 243 CA GLU A 15 80.690 -1.388 6.003 1.00 0.00 C ATOM 244 C GLU A 15 80.098 -2.507 6.862 1.00 0.00 C ATOM 245 O GLU A 15 80.693 -2.929 7.853 1.00 0.00 O ATOM 246 CB GLU A 15 80.283 -0.030 6.578 1.00 0.00 C ATOM 247 CG GLU A 15 78.767 0.137 6.493 1.00 0.00 C ATOM 248 CD GLU A 15 78.374 1.511 7.026 1.00 0.00 C ATOM 249 OE1 GLU A 15 78.867 2.493 6.495 1.00 0.00 O ATOM 250 OE2 GLU A 15 77.587 1.561 7.957 1.00 0.00 O ATOM 0 H GLU A 15 79.735 -0.714 4.252 1.00 0.00 H new ATOM 0 HA GLU A 15 81.778 -1.461 6.013 1.00 0.00 H new ATOM 0 HB2 GLU A 15 80.609 0.048 7.615 1.00 0.00 H new ATOM 0 HB3 GLU A 15 80.777 0.771 6.028 1.00 0.00 H new ATOM 0 HG2 GLU A 15 78.436 0.028 5.460 1.00 0.00 H new ATOM 0 HG3 GLU A 15 78.272 -0.644 7.070 1.00 0.00 H new ATOM 257 N CYS A 16 78.927 -2.998 6.452 1.00 0.00 N ATOM 258 CA CYS A 16 78.277 -4.086 7.173 1.00 0.00 C ATOM 259 C CYS A 16 79.064 -5.368 6.960 1.00 0.00 C ATOM 260 O CYS A 16 79.364 -6.104 7.900 1.00 0.00 O ATOM 261 CB CYS A 16 76.850 -4.292 6.668 1.00 0.00 C ATOM 262 SG CYS A 16 75.897 -5.185 7.918 1.00 0.00 S ATOM 0 H CYS A 16 78.417 -2.663 5.635 1.00 0.00 H new ATOM 0 HA CYS A 16 78.244 -3.831 8.232 1.00 0.00 H new ATOM 0 HB2 CYS A 16 76.384 -3.329 6.458 1.00 0.00 H new ATOM 0 HB3 CYS A 16 76.860 -4.852 5.733 1.00 0.00 H new ATOM 0 HG CYS A 16 74.817 -5.667 7.378 1.00 0.00 H new ATOM 268 N ALA A 17 79.405 -5.615 5.699 1.00 0.00 N ATOM 269 CA ALA A 17 80.174 -6.806 5.339 1.00 0.00 C ATOM 270 C ALA A 17 81.511 -6.823 6.078 1.00 0.00 C ATOM 271 O ALA A 17 81.915 -7.844 6.634 1.00 0.00 O ATOM 272 CB ALA A 17 80.440 -6.836 3.833 1.00 0.00 C ATOM 0 H ALA A 17 79.164 -5.012 4.912 1.00 0.00 H new ATOM 0 HA ALA A 17 79.590 -7.681 5.623 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.013 -7.729 3.582 1.00 0.00 H new ATOM 0 HB2 ALA A 17 79.491 -6.851 3.296 1.00 0.00 H new ATOM 0 HB3 ALA A 17 81.005 -5.949 3.546 1.00 0.00 H new ATOM 278 N GLY A 18 82.190 -5.676 6.082 1.00 0.00 N ATOM 279 CA GLY A 18 83.479 -5.574 6.763 1.00 0.00 C ATOM 280 C GLY A 18 84.363 -4.506 6.121 1.00 0.00 C ATOM 281 O GLY A 18 84.868 -3.611 6.798 1.00 0.00 O ATOM 0 H GLY A 18 81.875 -4.818 5.629 1.00 0.00 H new ATOM 0 HA2 GLY A 18 83.319 -5.333 7.814 1.00 0.00 H new ATOM 0 HA3 GLY A 18 83.987 -6.538 6.730 1.00 0.00 H new ATOM 285 N GLU A 19 84.553 -4.617 4.809 1.00 0.00 N ATOM 286 CA GLU A 19 85.389 -3.662 4.087 1.00 0.00 C ATOM 287 C GLU A 19 84.793 -2.259 4.159 1.00 0.00 C ATOM 288 O GLU A 19 83.778 -2.029 4.816 1.00 0.00 O ATOM 289 CB GLU A 19 85.528 -4.076 2.619 1.00 0.00 C ATOM 290 CG GLU A 19 86.788 -4.926 2.444 1.00 0.00 C ATOM 291 CD GLU A 19 88.020 -4.034 2.539 1.00 0.00 C ATOM 292 OE1 GLU A 19 88.381 -3.446 1.533 1.00 0.00 O ATOM 293 OE2 GLU A 19 88.586 -3.953 3.617 1.00 0.00 O ATOM 0 H GLU A 19 84.145 -5.350 4.229 1.00 0.00 H new ATOM 0 HA GLU A 19 86.372 -3.656 4.557 1.00 0.00 H new ATOM 0 HB2 GLU A 19 84.650 -4.640 2.305 1.00 0.00 H new ATOM 0 HB3 GLU A 19 85.583 -3.191 1.985 1.00 0.00 H new ATOM 0 HG2 GLU A 19 86.827 -5.700 3.210 1.00 0.00 H new ATOM 0 HG3 GLU A 19 86.766 -5.433 1.479 1.00 0.00 H new ATOM 300 N GLU A 20 85.442 -1.324 3.469 1.00 0.00 N ATOM 301 CA GLU A 20 84.982 0.062 3.448 1.00 0.00 C ATOM 302 C GLU A 20 85.056 0.621 2.030 1.00 0.00 C ATOM 303 O GLU A 20 86.019 1.291 1.656 1.00 0.00 O ATOM 304 CB GLU A 20 85.843 0.927 4.371 1.00 0.00 C ATOM 305 CG GLU A 20 85.222 2.318 4.492 1.00 0.00 C ATOM 306 CD GLU A 20 85.640 2.952 5.815 1.00 0.00 C ATOM 307 OE1 GLU A 20 86.694 3.567 5.846 1.00 0.00 O ATOM 308 OE2 GLU A 20 84.902 2.814 6.775 1.00 0.00 O ATOM 0 H GLU A 20 86.283 -1.499 2.920 1.00 0.00 H new ATOM 0 HA GLU A 20 83.949 0.081 3.796 1.00 0.00 H new ATOM 0 HB2 GLU A 20 85.918 0.464 5.355 1.00 0.00 H new ATOM 0 HB3 GLU A 20 86.856 1.003 3.976 1.00 0.00 H new ATOM 0 HG2 GLU A 20 85.543 2.944 3.660 1.00 0.00 H new ATOM 0 HG3 GLU A 20 84.136 2.248 4.438 1.00 0.00 H new ATOM 315 N GLU A 21 84.025 0.329 1.246 1.00 0.00 N ATOM 316 CA GLU A 21 83.962 0.791 -0.136 1.00 0.00 C ATOM 317 C GLU A 21 82.544 0.594 -0.677 1.00 0.00 C ATOM 318 O GLU A 21 81.593 0.479 0.092 1.00 0.00 O ATOM 319 CB GLU A 21 84.974 0.009 -0.993 1.00 0.00 C ATOM 320 CG GLU A 21 85.879 0.987 -1.746 1.00 0.00 C ATOM 321 CD GLU A 21 86.565 0.264 -2.900 1.00 0.00 C ATOM 322 OE1 GLU A 21 87.209 -0.740 -2.644 1.00 0.00 O ATOM 323 OE2 GLU A 21 86.436 0.726 -4.023 1.00 0.00 O ATOM 0 H GLU A 21 83.222 -0.225 1.543 1.00 0.00 H new ATOM 0 HA GLU A 21 84.213 1.851 -0.178 1.00 0.00 H new ATOM 0 HB2 GLU A 21 85.575 -0.643 -0.359 1.00 0.00 H new ATOM 0 HB3 GLU A 21 84.447 -0.632 -1.700 1.00 0.00 H new ATOM 0 HG2 GLU A 21 85.292 1.823 -2.125 1.00 0.00 H new ATOM 0 HG3 GLU A 21 86.625 1.403 -1.069 1.00 0.00 H new ATOM 330 N SER A 22 82.406 0.560 -2.002 1.00 0.00 N ATOM 331 CA SER A 22 81.091 0.371 -2.612 1.00 0.00 C ATOM 332 C SER A 22 80.979 -1.041 -3.191 1.00 0.00 C ATOM 333 O SER A 22 80.475 -1.951 -2.534 1.00 0.00 O ATOM 334 CB SER A 22 80.844 1.421 -3.702 1.00 0.00 C ATOM 335 OG SER A 22 79.943 2.405 -3.210 1.00 0.00 O ATOM 0 H SER A 22 83.175 0.659 -2.664 1.00 0.00 H new ATOM 0 HA SER A 22 80.329 0.496 -1.843 1.00 0.00 H new ATOM 0 HB2 SER A 22 81.785 1.887 -3.995 1.00 0.00 H new ATOM 0 HB3 SER A 22 80.432 0.947 -4.593 1.00 0.00 H new ATOM 0 HG SER A 22 79.784 3.079 -3.904 1.00 0.00 H new ATOM 341 N ILE A 23 81.464 -1.226 -4.414 1.00 0.00 N ATOM 342 CA ILE A 23 81.422 -2.534 -5.043 1.00 0.00 C ATOM 343 C ILE A 23 82.788 -2.853 -5.634 1.00 0.00 C ATOM 344 O ILE A 23 82.985 -2.841 -6.849 1.00 0.00 O ATOM 345 CB ILE A 23 80.359 -2.583 -6.142 1.00 0.00 C ATOM 346 CG1 ILE A 23 78.994 -2.170 -5.561 1.00 0.00 C ATOM 347 CG2 ILE A 23 80.277 -4.005 -6.706 1.00 0.00 C ATOM 348 CD1 ILE A 23 78.580 -3.118 -4.424 1.00 0.00 C ATOM 0 H ILE A 23 81.886 -0.492 -4.982 1.00 0.00 H new ATOM 0 HA ILE A 23 81.162 -3.274 -4.287 1.00 0.00 H new ATOM 0 HB ILE A 23 80.628 -1.893 -6.942 1.00 0.00 H new ATOM 0 HG12 ILE A 23 79.046 -1.147 -5.188 1.00 0.00 H new ATOM 0 HG13 ILE A 23 78.239 -2.185 -6.347 1.00 0.00 H new ATOM 0 HG21 ILE A 23 79.520 -4.043 -7.489 1.00 0.00 H new ATOM 0 HG22 ILE A 23 81.244 -4.288 -7.122 1.00 0.00 H new ATOM 0 HG23 ILE A 23 80.008 -4.698 -5.909 1.00 0.00 H new ATOM 0 HD11 ILE A 23 77.613 -2.809 -4.027 1.00 0.00 H new ATOM 0 HD12 ILE A 23 78.507 -4.136 -4.807 1.00 0.00 H new ATOM 0 HD13 ILE A 23 79.326 -3.082 -3.630 1.00 0.00 H new ATOM 360 N ASP A 24 83.728 -3.125 -4.747 1.00 0.00 N ATOM 361 CA ASP A 24 85.092 -3.437 -5.165 1.00 0.00 C ATOM 362 C ASP A 24 85.236 -4.901 -5.587 1.00 0.00 C ATOM 363 O ASP A 24 86.203 -5.268 -6.255 1.00 0.00 O ATOM 364 CB ASP A 24 86.071 -3.155 -4.025 1.00 0.00 C ATOM 365 CG ASP A 24 87.479 -2.994 -4.588 1.00 0.00 C ATOM 366 OD1 ASP A 24 87.605 -2.424 -5.659 1.00 0.00 O ATOM 367 OD2 ASP A 24 88.410 -3.442 -3.939 1.00 0.00 O ATOM 0 H ASP A 24 83.579 -3.138 -3.738 1.00 0.00 H new ATOM 0 HA ASP A 24 85.318 -2.804 -6.023 1.00 0.00 H new ATOM 0 HB2 ASP A 24 85.775 -2.250 -3.494 1.00 0.00 H new ATOM 0 HB3 ASP A 24 86.048 -3.971 -3.303 1.00 0.00 H new ATOM 372 N LEU A 25 84.283 -5.739 -5.188 1.00 0.00 N ATOM 373 CA LEU A 25 84.348 -7.159 -5.538 1.00 0.00 C ATOM 374 C LEU A 25 83.856 -7.401 -6.965 1.00 0.00 C ATOM 375 O LEU A 25 84.239 -8.379 -7.607 1.00 0.00 O ATOM 376 CB LEU A 25 83.509 -8.021 -4.574 1.00 0.00 C ATOM 377 CG LEU A 25 83.205 -7.398 -3.204 1.00 0.00 C ATOM 378 CD1 LEU A 25 81.860 -6.666 -3.262 1.00 0.00 C ATOM 379 CD2 LEU A 25 83.143 -8.502 -2.143 1.00 0.00 C ATOM 0 H LEU A 25 83.471 -5.469 -4.633 1.00 0.00 H new ATOM 0 HA LEU A 25 85.396 -7.449 -5.459 1.00 0.00 H new ATOM 0 HB2 LEU A 25 82.563 -8.259 -5.061 1.00 0.00 H new ATOM 0 HB3 LEU A 25 84.031 -8.964 -4.414 1.00 0.00 H new ATOM 0 HG LEU A 25 83.992 -6.690 -2.944 1.00 0.00 H new ATOM 0 HD11 LEU A 25 81.644 -6.224 -2.289 1.00 0.00 H new ATOM 0 HD12 LEU A 25 81.906 -5.880 -4.016 1.00 0.00 H new ATOM 0 HD13 LEU A 25 81.072 -7.373 -3.522 1.00 0.00 H new ATOM 0 HD21 LEU A 25 82.927 -8.060 -1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 25 82.357 -9.211 -2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 25 84.101 -9.021 -2.101 1.00 0.00 H new ATOM 391 N GLY A 26 82.990 -6.516 -7.451 1.00 0.00 N ATOM 392 CA GLY A 26 82.445 -6.675 -8.800 1.00 0.00 C ATOM 393 C GLY A 26 82.565 -5.399 -9.632 1.00 0.00 C ATOM 394 O GLY A 26 82.694 -5.458 -10.855 1.00 0.00 O ATOM 0 H GLY A 26 82.655 -5.697 -6.945 1.00 0.00 H new ATOM 0 HA2 GLY A 26 82.968 -7.486 -9.307 1.00 0.00 H new ATOM 0 HA3 GLY A 26 81.396 -6.964 -8.733 1.00 0.00 H new ATOM 398 N GLY A 27 82.511 -4.246 -8.972 1.00 0.00 N ATOM 399 CA GLY A 27 82.604 -2.977 -9.683 1.00 0.00 C ATOM 400 C GLY A 27 81.339 -2.732 -10.501 1.00 0.00 C ATOM 401 O GLY A 27 81.135 -3.340 -11.551 1.00 0.00 O ATOM 0 H GLY A 27 82.405 -4.164 -7.961 1.00 0.00 H new ATOM 0 HA2 GLY A 27 82.748 -2.164 -8.972 1.00 0.00 H new ATOM 0 HA3 GLY A 27 83.474 -2.984 -10.340 1.00 0.00 H new ATOM 405 N ASP A 28 80.491 -1.833 -10.005 1.00 0.00 N ATOM 406 CA ASP A 28 79.242 -1.507 -10.686 1.00 0.00 C ATOM 407 C ASP A 28 78.342 -2.740 -10.761 1.00 0.00 C ATOM 408 O ASP A 28 78.541 -3.625 -11.593 1.00 0.00 O ATOM 409 CB ASP A 28 79.527 -0.992 -12.100 1.00 0.00 C ATOM 410 CG ASP A 28 78.228 -0.555 -12.772 1.00 0.00 C ATOM 411 OD1 ASP A 28 77.568 0.317 -12.230 1.00 0.00 O ATOM 412 OD2 ASP A 28 77.912 -1.100 -13.816 1.00 0.00 O ATOM 0 H ASP A 28 80.646 -1.320 -9.137 1.00 0.00 H new ATOM 0 HA ASP A 28 78.733 -0.728 -10.118 1.00 0.00 H new ATOM 0 HB2 ASP A 28 80.223 -0.154 -12.057 1.00 0.00 H new ATOM 0 HB3 ASP A 28 80.006 -1.773 -12.690 1.00 0.00 H new ATOM 417 N VAL A 29 77.352 -2.785 -9.871 1.00 0.00 N ATOM 418 CA VAL A 29 76.421 -3.912 -9.830 1.00 0.00 C ATOM 419 C VAL A 29 75.082 -3.476 -9.233 1.00 0.00 C ATOM 420 O VAL A 29 74.536 -4.125 -8.340 1.00 0.00 O ATOM 421 CB VAL A 29 77.013 -5.050 -8.993 1.00 0.00 C ATOM 422 CG1 VAL A 29 78.304 -5.547 -9.645 1.00 0.00 C ATOM 423 CG2 VAL A 29 77.319 -4.544 -7.582 1.00 0.00 C ATOM 0 H VAL A 29 77.174 -2.061 -9.174 1.00 0.00 H new ATOM 0 HA VAL A 29 76.255 -4.263 -10.849 1.00 0.00 H new ATOM 0 HB VAL A 29 76.295 -5.868 -8.938 1.00 0.00 H new ATOM 0 HG11 VAL A 29 78.724 -6.357 -9.049 1.00 0.00 H new ATOM 0 HG12 VAL A 29 78.088 -5.911 -10.650 1.00 0.00 H new ATOM 0 HG13 VAL A 29 79.021 -4.728 -9.702 1.00 0.00 H new ATOM 0 HG21 VAL A 29 77.740 -5.355 -6.988 1.00 0.00 H new ATOM 0 HG22 VAL A 29 78.036 -3.724 -7.637 1.00 0.00 H new ATOM 0 HG23 VAL A 29 76.400 -4.191 -7.115 1.00 0.00 H new ATOM 433 N GLU A 30 74.564 -2.363 -9.742 1.00 0.00 N ATOM 434 CA GLU A 30 73.293 -1.830 -9.263 1.00 0.00 C ATOM 435 C GLU A 30 72.117 -2.704 -9.706 1.00 0.00 C ATOM 436 O GLU A 30 71.054 -2.700 -9.083 1.00 0.00 O ATOM 437 CB GLU A 30 73.098 -0.411 -9.799 1.00 0.00 C ATOM 438 CG GLU A 30 73.068 -0.425 -11.333 1.00 0.00 C ATOM 439 CD GLU A 30 73.717 0.847 -11.867 1.00 0.00 C ATOM 440 OE1 GLU A 30 73.514 1.891 -11.269 1.00 0.00 O ATOM 441 OE2 GLU A 30 74.410 0.759 -12.869 1.00 0.00 O ATOM 0 H GLU A 30 75.002 -1.815 -10.482 1.00 0.00 H new ATOM 0 HA GLU A 30 73.321 -1.821 -8.173 1.00 0.00 H new ATOM 0 HB2 GLU A 30 72.168 0.007 -9.413 1.00 0.00 H new ATOM 0 HB3 GLU A 30 73.906 0.232 -9.449 1.00 0.00 H new ATOM 0 HG2 GLU A 30 73.596 -1.301 -11.709 1.00 0.00 H new ATOM 0 HG3 GLU A 30 72.039 -0.497 -11.686 1.00 0.00 H new ATOM 448 N ASP A 31 72.317 -3.440 -10.796 1.00 0.00 N ATOM 449 CA ASP A 31 71.267 -4.306 -11.326 1.00 0.00 C ATOM 450 C ASP A 31 71.605 -5.788 -11.127 1.00 0.00 C ATOM 451 O ASP A 31 70.987 -6.658 -11.739 1.00 0.00 O ATOM 452 CB ASP A 31 71.065 -4.039 -12.818 1.00 0.00 C ATOM 453 CG ASP A 31 70.205 -2.793 -12.999 1.00 0.00 C ATOM 454 OD1 ASP A 31 69.146 -2.736 -12.398 1.00 0.00 O ATOM 455 OD2 ASP A 31 70.618 -1.915 -13.738 1.00 0.00 O ATOM 0 H ASP A 31 73.188 -3.455 -11.326 1.00 0.00 H new ATOM 0 HA ASP A 31 70.352 -4.080 -10.778 1.00 0.00 H new ATOM 0 HB2 ASP A 31 72.029 -3.903 -13.308 1.00 0.00 H new ATOM 0 HB3 ASP A 31 70.586 -4.897 -13.290 1.00 0.00 H new ATOM 460 N VAL A 32 72.574 -6.074 -10.254 1.00 0.00 N ATOM 461 CA VAL A 32 72.949 -7.459 -9.984 1.00 0.00 C ATOM 462 C VAL A 32 72.386 -7.890 -8.632 1.00 0.00 C ATOM 463 O VAL A 32 72.465 -7.149 -7.652 1.00 0.00 O ATOM 464 CB VAL A 32 74.470 -7.619 -9.959 1.00 0.00 C ATOM 465 CG1 VAL A 32 74.825 -9.106 -9.936 1.00 0.00 C ATOM 466 CG2 VAL A 32 75.081 -6.970 -11.205 1.00 0.00 C ATOM 0 H VAL A 32 73.104 -5.377 -9.731 1.00 0.00 H new ATOM 0 HA VAL A 32 72.540 -8.082 -10.779 1.00 0.00 H new ATOM 0 HB VAL A 32 74.867 -7.133 -9.068 1.00 0.00 H new ATOM 0 HG11 VAL A 32 75.909 -9.221 -9.918 1.00 0.00 H new ATOM 0 HG12 VAL A 32 74.396 -9.569 -9.047 1.00 0.00 H new ATOM 0 HG13 VAL A 32 74.423 -9.590 -10.826 1.00 0.00 H new ATOM 0 HG21 VAL A 32 76.164 -7.087 -11.182 1.00 0.00 H new ATOM 0 HG22 VAL A 32 74.683 -7.451 -12.098 1.00 0.00 H new ATOM 0 HG23 VAL A 32 74.831 -5.909 -11.223 1.00 0.00 H new ATOM 476 N ALA A 33 71.809 -9.088 -8.587 1.00 0.00 N ATOM 477 CA ALA A 33 71.227 -9.592 -7.343 1.00 0.00 C ATOM 478 C ALA A 33 72.284 -9.688 -6.247 1.00 0.00 C ATOM 479 O ALA A 33 73.463 -9.915 -6.518 1.00 0.00 O ATOM 480 CB ALA A 33 70.607 -10.974 -7.552 1.00 0.00 C ATOM 0 H ALA A 33 71.731 -9.721 -9.383 1.00 0.00 H new ATOM 0 HA ALA A 33 70.452 -8.888 -7.039 1.00 0.00 H new ATOM 0 HB1 ALA A 33 70.181 -11.327 -6.613 1.00 0.00 H new ATOM 0 HB2 ALA A 33 69.822 -10.910 -8.306 1.00 0.00 H new ATOM 0 HB3 ALA A 33 71.376 -11.671 -7.887 1.00 0.00 H new ATOM 486 N PHE A 34 71.842 -9.514 -5.001 1.00 0.00 N ATOM 487 CA PHE A 34 72.748 -9.580 -3.851 1.00 0.00 C ATOM 488 C PHE A 34 73.500 -10.909 -3.822 1.00 0.00 C ATOM 489 O PHE A 34 74.653 -10.976 -3.398 1.00 0.00 O ATOM 490 CB PHE A 34 71.962 -9.434 -2.545 1.00 0.00 C ATOM 491 CG PHE A 34 71.260 -8.096 -2.513 1.00 0.00 C ATOM 492 CD1 PHE A 34 72.003 -6.911 -2.578 1.00 0.00 C ATOM 493 CD2 PHE A 34 69.866 -8.042 -2.408 1.00 0.00 C ATOM 494 CE1 PHE A 34 71.351 -5.672 -2.540 1.00 0.00 C ATOM 495 CE2 PHE A 34 69.214 -6.803 -2.370 1.00 0.00 C ATOM 496 CZ PHE A 34 69.957 -5.619 -2.435 1.00 0.00 C ATOM 0 H PHE A 34 70.868 -9.327 -4.762 1.00 0.00 H new ATOM 0 HA PHE A 34 73.463 -8.763 -3.949 1.00 0.00 H new ATOM 0 HB2 PHE A 34 71.233 -10.239 -2.458 1.00 0.00 H new ATOM 0 HB3 PHE A 34 72.636 -9.521 -1.693 1.00 0.00 H new ATOM 0 HD1 PHE A 34 73.079 -6.952 -2.657 1.00 0.00 H new ATOM 0 HD2 PHE A 34 69.293 -8.956 -2.356 1.00 0.00 H new ATOM 0 HE1 PHE A 34 71.924 -4.758 -2.592 1.00 0.00 H new ATOM 0 HE2 PHE A 34 68.138 -6.761 -2.291 1.00 0.00 H new ATOM 0 HZ PHE A 34 69.454 -4.664 -2.404 1.00 0.00 H new ATOM 506 N ASP A 35 72.832 -11.965 -4.278 1.00 0.00 N ATOM 507 CA ASP A 35 73.439 -13.289 -4.299 1.00 0.00 C ATOM 508 C ASP A 35 74.683 -13.299 -5.184 1.00 0.00 C ATOM 509 O ASP A 35 75.638 -14.032 -4.930 1.00 0.00 O ATOM 510 CB ASP A 35 72.441 -14.317 -4.830 1.00 0.00 C ATOM 511 CG ASP A 35 71.914 -13.864 -6.188 1.00 0.00 C ATOM 512 OD1 ASP A 35 72.658 -13.958 -7.151 1.00 0.00 O ATOM 513 OD2 ASP A 35 70.774 -13.431 -6.245 1.00 0.00 O ATOM 0 H ASP A 35 71.877 -11.929 -4.635 1.00 0.00 H new ATOM 0 HA ASP A 35 73.724 -13.546 -3.279 1.00 0.00 H new ATOM 0 HB2 ASP A 35 72.921 -15.291 -4.921 1.00 0.00 H new ATOM 0 HB3 ASP A 35 71.615 -14.433 -4.128 1.00 0.00 H new ATOM 518 N ALA A 36 74.657 -12.478 -6.230 1.00 0.00 N ATOM 519 CA ALA A 36 75.781 -12.400 -7.153 1.00 0.00 C ATOM 520 C ALA A 36 76.882 -11.505 -6.588 1.00 0.00 C ATOM 521 O ALA A 36 78.070 -11.785 -6.748 1.00 0.00 O ATOM 522 CB ALA A 36 75.325 -11.851 -8.506 1.00 0.00 C ATOM 0 H ALA A 36 73.876 -11.863 -6.457 1.00 0.00 H new ATOM 0 HA ALA A 36 76.175 -13.407 -7.288 1.00 0.00 H new ATOM 0 HB1 ALA A 36 76.177 -11.799 -9.184 1.00 0.00 H new ATOM 0 HB2 ALA A 36 74.565 -12.509 -8.928 1.00 0.00 H new ATOM 0 HB3 ALA A 36 74.907 -10.853 -8.372 1.00 0.00 H new ATOM 528 N LEU A 37 76.477 -10.423 -5.924 1.00 0.00 N ATOM 529 CA LEU A 37 77.445 -9.495 -5.339 1.00 0.00 C ATOM 530 C LEU A 37 78.313 -10.209 -4.307 1.00 0.00 C ATOM 531 O LEU A 37 79.482 -9.873 -4.118 1.00 0.00 O ATOM 532 CB LEU A 37 76.733 -8.323 -4.658 1.00 0.00 C ATOM 533 CG LEU A 37 75.571 -7.708 -5.447 1.00 0.00 C ATOM 534 CD1 LEU A 37 75.086 -6.444 -4.735 1.00 0.00 C ATOM 535 CD2 LEU A 37 76.040 -7.348 -6.860 1.00 0.00 C ATOM 0 H LEU A 37 75.500 -10.169 -5.779 1.00 0.00 H new ATOM 0 HA LEU A 37 78.071 -9.117 -6.148 1.00 0.00 H new ATOM 0 HB2 LEU A 37 76.355 -8.661 -3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 37 77.466 -7.542 -4.457 1.00 0.00 H new ATOM 0 HG LEU A 37 74.756 -8.429 -5.510 1.00 0.00 H new ATOM 0 HD11 LEU A 37 74.260 -6.005 -5.295 1.00 0.00 H new ATOM 0 HD12 LEU A 37 74.749 -6.699 -3.730 1.00 0.00 H new ATOM 0 HD13 LEU A 37 75.903 -5.726 -4.672 1.00 0.00 H new ATOM 0 HD21 LEU A 37 75.212 -6.911 -7.418 1.00 0.00 H new ATOM 0 HD22 LEU A 37 76.857 -6.629 -6.800 1.00 0.00 H new ATOM 0 HD23 LEU A 37 76.386 -8.248 -7.369 1.00 0.00 H new ATOM 547 N GLY A 38 77.726 -11.200 -3.643 1.00 0.00 N ATOM 548 CA GLY A 38 78.452 -11.963 -2.632 1.00 0.00 C ATOM 549 C GLY A 38 77.869 -11.741 -1.236 1.00 0.00 C ATOM 550 O GLY A 38 78.544 -11.965 -0.231 1.00 0.00 O ATOM 0 H GLY A 38 76.759 -11.492 -3.784 1.00 0.00 H new ATOM 0 HA2 GLY A 38 78.414 -13.024 -2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 38 79.502 -11.671 -2.639 1.00 0.00 H new ATOM 554 N TYR A 39 76.610 -11.306 -1.175 1.00 0.00 N ATOM 555 CA TYR A 39 75.964 -11.071 0.112 1.00 0.00 C ATOM 556 C TYR A 39 75.203 -12.315 0.553 1.00 0.00 C ATOM 557 O TYR A 39 74.626 -13.029 -0.267 1.00 0.00 O ATOM 558 CB TYR A 39 74.986 -9.898 0.019 1.00 0.00 C ATOM 559 CG TYR A 39 75.752 -8.600 -0.092 1.00 0.00 C ATOM 560 CD1 TYR A 39 76.731 -8.278 0.857 1.00 0.00 C ATOM 561 CD2 TYR A 39 75.480 -7.716 -1.143 1.00 0.00 C ATOM 562 CE1 TYR A 39 77.436 -7.072 0.754 1.00 0.00 C ATOM 563 CE2 TYR A 39 76.185 -6.512 -1.245 1.00 0.00 C ATOM 564 CZ TYR A 39 77.163 -6.190 -0.297 1.00 0.00 C ATOM 565 OH TYR A 39 77.857 -5.001 -0.399 1.00 0.00 O ATOM 0 H TYR A 39 76.027 -11.112 -1.989 1.00 0.00 H new ATOM 0 HA TYR A 39 76.740 -10.836 0.840 1.00 0.00 H new ATOM 0 HB2 TYR A 39 74.336 -10.022 -0.847 1.00 0.00 H new ATOM 0 HB3 TYR A 39 74.344 -9.878 0.899 1.00 0.00 H new ATOM 0 HD1 TYR A 39 76.942 -8.959 1.668 1.00 0.00 H new ATOM 0 HD2 TYR A 39 74.726 -7.964 -1.875 1.00 0.00 H new ATOM 0 HE1 TYR A 39 78.190 -6.823 1.486 1.00 0.00 H new ATOM 0 HE2 TYR A 39 75.974 -5.830 -2.056 1.00 0.00 H new ATOM 0 HH TYR A 39 77.545 -4.507 -1.186 1.00 0.00 H new ATOM 575 N ASP A 40 75.201 -12.563 1.859 1.00 0.00 N ATOM 576 CA ASP A 40 74.499 -13.723 2.399 1.00 0.00 C ATOM 577 C ASP A 40 73.048 -13.364 2.682 1.00 0.00 C ATOM 578 O ASP A 40 72.129 -13.824 2.005 1.00 0.00 O ATOM 579 CB ASP A 40 75.161 -14.198 3.694 1.00 0.00 C ATOM 580 CG ASP A 40 76.244 -15.220 3.366 1.00 0.00 C ATOM 581 OD1 ASP A 40 77.256 -14.825 2.811 1.00 0.00 O ATOM 582 OD2 ASP A 40 76.046 -16.384 3.675 1.00 0.00 O ATOM 0 H ASP A 40 75.671 -11.985 2.556 1.00 0.00 H new ATOM 0 HA ASP A 40 74.544 -14.525 1.662 1.00 0.00 H new ATOM 0 HB2 ASP A 40 75.594 -13.351 4.225 1.00 0.00 H new ATOM 0 HB3 ASP A 40 74.416 -14.641 4.355 1.00 0.00 H new ATOM 587 N SER A 41 72.863 -12.527 3.695 1.00 0.00 N ATOM 588 CA SER A 41 71.531 -12.078 4.095 1.00 0.00 C ATOM 589 C SER A 41 71.641 -11.297 5.392 1.00 0.00 C ATOM 590 O SER A 41 71.053 -10.225 5.548 1.00 0.00 O ATOM 591 CB SER A 41 70.583 -13.264 4.308 1.00 0.00 C ATOM 592 OG SER A 41 69.905 -13.548 3.092 1.00 0.00 O ATOM 0 H SER A 41 73.621 -12.142 4.258 1.00 0.00 H new ATOM 0 HA SER A 41 71.127 -11.452 3.299 1.00 0.00 H new ATOM 0 HB2 SER A 41 71.144 -14.138 4.637 1.00 0.00 H new ATOM 0 HB3 SER A 41 69.863 -13.033 5.093 1.00 0.00 H new ATOM 0 HG SER A 41 70.560 -13.688 2.377 1.00 0.00 H new ATOM 598 N LEU A 42 72.423 -11.849 6.319 1.00 0.00 N ATOM 599 CA LEU A 42 72.635 -11.212 7.622 1.00 0.00 C ATOM 600 C LEU A 42 73.108 -9.772 7.449 1.00 0.00 C ATOM 601 O LEU A 42 72.753 -8.887 8.227 1.00 0.00 O ATOM 602 CB LEU A 42 73.680 -11.985 8.429 1.00 0.00 C ATOM 603 CG LEU A 42 73.140 -13.184 9.211 1.00 0.00 C ATOM 604 CD1 LEU A 42 72.153 -12.698 10.274 1.00 0.00 C ATOM 605 CD2 LEU A 42 72.424 -14.138 8.251 1.00 0.00 C ATOM 0 H LEU A 42 72.919 -12.732 6.195 1.00 0.00 H new ATOM 0 HA LEU A 42 71.684 -11.217 8.154 1.00 0.00 H new ATOM 0 HB2 LEU A 42 74.456 -12.335 7.748 1.00 0.00 H new ATOM 0 HB3 LEU A 42 74.156 -11.299 9.129 1.00 0.00 H new ATOM 0 HG LEU A 42 73.967 -13.705 9.694 1.00 0.00 H new ATOM 0 HD11 LEU A 42 71.768 -13.552 10.831 1.00 0.00 H new ATOM 0 HD12 LEU A 42 72.661 -12.018 10.958 1.00 0.00 H new ATOM 0 HD13 LEU A 42 71.326 -12.177 9.792 1.00 0.00 H new ATOM 0 HD21 LEU A 42 72.039 -14.993 8.807 1.00 0.00 H new ATOM 0 HD22 LEU A 42 71.597 -13.616 7.769 1.00 0.00 H new ATOM 0 HD23 LEU A 42 73.126 -14.485 7.492 1.00 0.00 H new ATOM 617 N ALA A 43 73.908 -9.547 6.410 1.00 0.00 N ATOM 618 CA ALA A 43 74.416 -8.209 6.138 1.00 0.00 C ATOM 619 C ALA A 43 73.286 -7.308 5.671 1.00 0.00 C ATOM 620 O ALA A 43 73.100 -6.211 6.192 1.00 0.00 O ATOM 621 CB ALA A 43 75.503 -8.253 5.061 1.00 0.00 C ATOM 0 H ALA A 43 74.214 -10.264 5.752 1.00 0.00 H new ATOM 0 HA ALA A 43 74.844 -7.813 7.059 1.00 0.00 H new ATOM 0 HB1 ALA A 43 75.869 -7.244 4.872 1.00 0.00 H new ATOM 0 HB2 ALA A 43 76.327 -8.880 5.401 1.00 0.00 H new ATOM 0 HB3 ALA A 43 75.088 -8.666 4.142 1.00 0.00 H new ATOM 627 N LEU A 44 72.526 -7.791 4.691 1.00 0.00 N ATOM 628 CA LEU A 44 71.398 -7.026 4.156 1.00 0.00 C ATOM 629 C LEU A 44 70.390 -6.742 5.259 1.00 0.00 C ATOM 630 O LEU A 44 69.868 -5.635 5.381 1.00 0.00 O ATOM 631 CB LEU A 44 70.712 -7.806 3.035 1.00 0.00 C ATOM 632 CG LEU A 44 71.393 -7.700 1.671 1.00 0.00 C ATOM 633 CD1 LEU A 44 70.612 -8.518 0.642 1.00 0.00 C ATOM 634 CD2 LEU A 44 71.423 -6.235 1.240 1.00 0.00 C ATOM 0 H LEU A 44 72.667 -8.701 4.253 1.00 0.00 H new ATOM 0 HA LEU A 44 71.778 -6.085 3.759 1.00 0.00 H new ATOM 0 HB2 LEU A 44 70.663 -8.857 3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 44 69.685 -7.453 2.941 1.00 0.00 H new ATOM 0 HG LEU A 44 72.410 -8.085 1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 44 71.099 -8.441 -0.330 1.00 0.00 H new ATOM 0 HD12 LEU A 44 70.585 -9.563 0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 44 69.594 -8.134 0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 44 71.908 -6.152 0.267 1.00 0.00 H new ATOM 0 HD22 LEU A 44 70.404 -5.855 1.171 1.00 0.00 H new ATOM 0 HD23 LEU A 44 71.979 -5.651 1.974 1.00 0.00 H new ATOM 646 N LEU A 45 70.135 -7.762 6.071 1.00 0.00 N ATOM 647 CA LEU A 45 69.195 -7.639 7.189 1.00 0.00 C ATOM 648 C LEU A 45 69.560 -6.439 8.069 1.00 0.00 C ATOM 649 O LEU A 45 68.699 -5.652 8.463 1.00 0.00 O ATOM 650 CB LEU A 45 69.217 -8.926 8.032 1.00 0.00 C ATOM 651 CG LEU A 45 68.550 -8.847 9.413 1.00 0.00 C ATOM 652 CD1 LEU A 45 67.147 -8.251 9.277 1.00 0.00 C ATOM 653 CD2 LEU A 45 68.450 -10.252 10.011 1.00 0.00 C ATOM 0 H LEU A 45 70.563 -8.683 5.980 1.00 0.00 H new ATOM 0 HA LEU A 45 68.194 -7.485 6.786 1.00 0.00 H new ATOM 0 HB2 LEU A 45 68.730 -9.717 7.462 1.00 0.00 H new ATOM 0 HB3 LEU A 45 70.256 -9.226 8.170 1.00 0.00 H new ATOM 0 HG LEU A 45 69.149 -8.213 10.066 1.00 0.00 H new ATOM 0 HD11 LEU A 45 66.678 -8.197 10.259 1.00 0.00 H new ATOM 0 HD12 LEU A 45 67.217 -7.249 8.853 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.546 -8.882 8.622 1.00 0.00 H new ATOM 0 HD21 LEU A 45 67.977 -10.197 10.991 1.00 0.00 H new ATOM 0 HD22 LEU A 45 67.853 -10.885 9.355 1.00 0.00 H new ATOM 0 HD23 LEU A 45 69.449 -10.676 10.114 1.00 0.00 H new ATOM 665 N ASN A 46 70.847 -6.316 8.367 1.00 0.00 N ATOM 666 CA ASN A 46 71.327 -5.218 9.196 1.00 0.00 C ATOM 667 C ASN A 46 71.240 -3.896 8.439 1.00 0.00 C ATOM 668 O ASN A 46 70.711 -2.909 8.948 1.00 0.00 O ATOM 669 CB ASN A 46 72.776 -5.454 9.613 1.00 0.00 C ATOM 670 CG ASN A 46 72.868 -6.726 10.445 1.00 0.00 C ATOM 671 OD1 ASN A 46 72.055 -6.949 11.344 1.00 0.00 O ATOM 672 ND2 ASN A 46 73.819 -7.583 10.199 1.00 0.00 N ATOM 0 H ASN A 46 71.573 -6.958 8.050 1.00 0.00 H new ATOM 0 HA ASN A 46 70.696 -5.171 10.084 1.00 0.00 H new ATOM 0 HB2 ASN A 46 73.410 -5.538 8.730 1.00 0.00 H new ATOM 0 HB3 ASN A 46 73.142 -4.604 10.188 1.00 0.00 H new ATOM 0 HD21 ASN A 46 73.890 -8.438 10.751 1.00 0.00 H new ATOM 0 HD22 ASN A 46 74.492 -7.399 9.455 1.00 0.00 H new ATOM 679 N THR A 47 71.774 -3.885 7.216 1.00 0.00 N ATOM 680 CA THR A 47 71.756 -2.667 6.396 1.00 0.00 C ATOM 681 C THR A 47 70.328 -2.147 6.228 1.00 0.00 C ATOM 682 O THR A 47 70.081 -0.942 6.293 1.00 0.00 O ATOM 683 CB THR A 47 72.374 -2.924 5.007 1.00 0.00 C ATOM 684 OG1 THR A 47 72.514 -4.315 4.796 1.00 0.00 O ATOM 685 CG2 THR A 47 73.753 -2.263 4.921 1.00 0.00 C ATOM 0 H THR A 47 72.218 -4.690 6.775 1.00 0.00 H new ATOM 0 HA THR A 47 72.352 -1.916 6.914 1.00 0.00 H new ATOM 0 HB THR A 47 71.719 -2.502 4.245 1.00 0.00 H new ATOM 0 HG1 THR A 47 73.252 -4.656 5.343 1.00 0.00 H new ATOM 0 HG21 THR A 47 74.185 -2.448 3.937 1.00 0.00 H new ATOM 0 HG22 THR A 47 73.652 -1.189 5.077 1.00 0.00 H new ATOM 0 HG23 THR A 47 74.405 -2.681 5.688 1.00 0.00 H new ATOM 693 N VAL A 48 69.390 -3.066 6.026 1.00 0.00 N ATOM 694 CA VAL A 48 67.991 -2.681 5.865 1.00 0.00 C ATOM 695 C VAL A 48 67.466 -2.093 7.173 1.00 0.00 C ATOM 696 O VAL A 48 66.641 -1.180 7.174 1.00 0.00 O ATOM 697 CB VAL A 48 67.138 -3.893 5.465 1.00 0.00 C ATOM 698 CG1 VAL A 48 65.687 -3.457 5.233 1.00 0.00 C ATOM 699 CG2 VAL A 48 67.693 -4.500 4.171 1.00 0.00 C ATOM 0 H VAL A 48 69.568 -4.069 5.970 1.00 0.00 H new ATOM 0 HA VAL A 48 67.925 -1.933 5.075 1.00 0.00 H new ATOM 0 HB VAL A 48 67.170 -4.632 6.266 1.00 0.00 H new ATOM 0 HG11 VAL A 48 65.088 -4.322 4.950 1.00 0.00 H new ATOM 0 HG12 VAL A 48 65.287 -3.023 6.149 1.00 0.00 H new ATOM 0 HG13 VAL A 48 65.653 -2.715 4.435 1.00 0.00 H new ATOM 0 HG21 VAL A 48 67.089 -5.361 3.885 1.00 0.00 H new ATOM 0 HG22 VAL A 48 67.661 -3.754 3.377 1.00 0.00 H new ATOM 0 HG23 VAL A 48 68.724 -4.817 4.331 1.00 0.00 H new ATOM 709 N GLY A 49 67.960 -2.627 8.287 1.00 0.00 N ATOM 710 CA GLY A 49 67.543 -2.147 9.602 1.00 0.00 C ATOM 711 C GLY A 49 68.032 -0.719 9.828 1.00 0.00 C ATOM 712 O GLY A 49 67.360 0.095 10.463 1.00 0.00 O ATOM 0 H GLY A 49 68.643 -3.385 8.307 1.00 0.00 H new ATOM 0 HA2 GLY A 49 66.456 -2.183 9.681 1.00 0.00 H new ATOM 0 HA3 GLY A 49 67.941 -2.801 10.378 1.00 0.00 H new ATOM 716 N ARG A 50 69.216 -0.425 9.300 1.00 0.00 N ATOM 717 CA ARG A 50 69.793 0.902 9.447 1.00 0.00 C ATOM 718 C ARG A 50 69.033 1.912 8.597 1.00 0.00 C ATOM 719 O ARG A 50 68.771 3.032 9.032 1.00 0.00 O ATOM 720 CB ARG A 50 71.265 0.901 9.027 1.00 0.00 C ATOM 721 CG ARG A 50 71.933 2.194 9.501 1.00 0.00 C ATOM 722 CD ARG A 50 72.603 1.956 10.856 1.00 0.00 C ATOM 723 NE ARG A 50 73.780 2.814 11.007 1.00 0.00 N ATOM 724 CZ ARG A 50 74.725 2.573 11.928 1.00 0.00 C ATOM 725 NH1 ARG A 50 74.635 1.549 12.743 1.00 0.00 N ATOM 726 NH2 ARG A 50 75.752 3.373 12.015 1.00 0.00 N ATOM 0 H ARG A 50 69.789 -1.083 8.771 1.00 0.00 H new ATOM 0 HA ARG A 50 69.719 1.183 10.497 1.00 0.00 H new ATOM 0 HB2 ARG A 50 71.775 0.038 9.454 1.00 0.00 H new ATOM 0 HB3 ARG A 50 71.345 0.814 7.943 1.00 0.00 H new ATOM 0 HG2 ARG A 50 72.672 2.523 8.771 1.00 0.00 H new ATOM 0 HG3 ARG A 50 71.192 2.989 9.584 1.00 0.00 H new ATOM 0 HD2 ARG A 50 71.894 2.158 11.659 1.00 0.00 H new ATOM 0 HD3 ARG A 50 72.895 0.910 10.944 1.00 0.00 H new ATOM 0 HE ARG A 50 73.885 3.621 10.392 1.00 0.00 H new ATOM 0 HH11 ARG A 50 73.836 0.918 12.683 1.00 0.00 H new ATOM 0 HH12 ARG A 50 75.365 1.383 13.436 1.00 0.00 H new ATOM 0 HH21 ARG A 50 75.830 4.172 11.386 1.00 0.00 H new ATOM 0 HH22 ARG A 50 76.476 3.199 12.712 1.00 0.00 H new ATOM 740 N ILE A 51 68.681 1.508 7.381 1.00 0.00 N ATOM 741 CA ILE A 51 67.948 2.395 6.484 1.00 0.00 C ATOM 742 C ILE A 51 66.542 2.637 7.020 1.00 0.00 C ATOM 743 O ILE A 51 66.097 3.777 7.131 1.00 0.00 O ATOM 744 CB ILE A 51 67.855 1.795 5.077 1.00 0.00 C ATOM 745 CG1 ILE A 51 69.257 1.440 4.574 1.00 0.00 C ATOM 746 CG2 ILE A 51 67.223 2.814 4.125 1.00 0.00 C ATOM 747 CD1 ILE A 51 69.175 0.228 3.647 1.00 0.00 C ATOM 0 H ILE A 51 68.887 0.586 6.997 1.00 0.00 H new ATOM 0 HA ILE A 51 68.488 3.340 6.430 1.00 0.00 H new ATOM 0 HB ILE A 51 67.241 0.895 5.112 1.00 0.00 H new ATOM 0 HG12 ILE A 51 69.690 2.288 4.044 1.00 0.00 H new ATOM 0 HG13 ILE A 51 69.913 1.223 5.417 1.00 0.00 H new ATOM 0 HG21 ILE A 51 67.158 2.386 3.125 1.00 0.00 H new ATOM 0 HG22 ILE A 51 66.223 3.069 4.477 1.00 0.00 H new ATOM 0 HG23 ILE A 51 67.838 3.714 4.095 1.00 0.00 H new ATOM 0 HD11 ILE A 51 70.173 -0.024 3.289 1.00 0.00 H new ATOM 0 HD12 ILE A 51 68.760 -0.620 4.192 1.00 0.00 H new ATOM 0 HD13 ILE A 51 68.533 0.462 2.798 1.00 0.00 H new ATOM 759 N GLU A 52 65.845 1.556 7.349 1.00 0.00 N ATOM 760 CA GLU A 52 64.486 1.680 7.868 1.00 0.00 C ATOM 761 C GLU A 52 64.471 2.463 9.181 1.00 0.00 C ATOM 762 O GLU A 52 63.442 3.013 9.566 1.00 0.00 O ATOM 763 CB GLU A 52 63.857 0.303 8.092 1.00 0.00 C ATOM 764 CG GLU A 52 64.725 -0.509 9.050 1.00 0.00 C ATOM 765 CD GLU A 52 64.233 -0.306 10.479 1.00 0.00 C ATOM 766 OE1 GLU A 52 63.032 -0.204 10.663 1.00 0.00 O ATOM 767 OE2 GLU A 52 65.066 -0.255 11.369 1.00 0.00 O ATOM 0 H GLU A 52 66.189 0.599 7.268 1.00 0.00 H new ATOM 0 HA GLU A 52 63.902 2.221 7.124 1.00 0.00 H new ATOM 0 HB2 GLU A 52 62.853 0.413 8.501 1.00 0.00 H new ATOM 0 HB3 GLU A 52 63.759 -0.222 7.142 1.00 0.00 H new ATOM 0 HG2 GLU A 52 64.685 -1.566 8.787 1.00 0.00 H new ATOM 0 HG3 GLU A 52 65.767 -0.199 8.965 1.00 0.00 H new ATOM 774 N ARG A 53 65.613 2.511 9.870 1.00 0.00 N ATOM 775 CA ARG A 53 65.679 3.239 11.134 1.00 0.00 C ATOM 776 C ARG A 53 66.189 4.661 10.917 1.00 0.00 C ATOM 777 O ARG A 53 65.697 5.612 11.526 1.00 0.00 O ATOM 778 CB ARG A 53 66.602 2.522 12.122 1.00 0.00 C ATOM 779 CG ARG A 53 66.444 3.142 13.514 1.00 0.00 C ATOM 780 CD ARG A 53 67.528 4.201 13.731 1.00 0.00 C ATOM 781 NE ARG A 53 67.008 5.314 14.531 1.00 0.00 N ATOM 782 CZ ARG A 53 66.882 5.238 15.864 1.00 0.00 C ATOM 783 NH1 ARG A 53 67.215 4.152 16.518 1.00 0.00 N ATOM 784 NH2 ARG A 53 66.419 6.266 16.522 1.00 0.00 N ATOM 0 H ARG A 53 66.484 2.065 9.582 1.00 0.00 H new ATOM 0 HA ARG A 53 64.670 3.279 11.544 1.00 0.00 H new ATOM 0 HB2 ARG A 53 66.360 1.460 12.156 1.00 0.00 H new ATOM 0 HB3 ARG A 53 67.638 2.603 11.792 1.00 0.00 H new ATOM 0 HG2 ARG A 53 65.456 3.593 13.612 1.00 0.00 H new ATOM 0 HG3 ARG A 53 66.519 2.368 14.278 1.00 0.00 H new ATOM 0 HD2 ARG A 53 68.386 3.754 14.234 1.00 0.00 H new ATOM 0 HD3 ARG A 53 67.880 4.571 12.768 1.00 0.00 H new ATOM 0 HE ARG A 53 66.733 6.175 14.058 1.00 0.00 H new ATOM 0 HH11 ARG A 53 67.578 3.344 16.013 1.00 0.00 H new ATOM 0 HH12 ARG A 53 67.111 4.115 17.532 1.00 0.00 H new ATOM 0 HH21 ARG A 53 66.157 7.116 16.022 1.00 0.00 H new ATOM 0 HH22 ARG A 53 66.319 6.219 17.536 1.00 0.00 H new ATOM 798 N ASP A 54 67.181 4.796 10.045 1.00 0.00 N ATOM 799 CA ASP A 54 67.756 6.102 9.755 1.00 0.00 C ATOM 800 C ASP A 54 66.830 6.913 8.855 1.00 0.00 C ATOM 801 O ASP A 54 66.723 8.132 8.985 1.00 0.00 O ATOM 802 CB ASP A 54 69.108 5.946 9.060 1.00 0.00 C ATOM 803 CG ASP A 54 70.182 5.642 10.098 1.00 0.00 C ATOM 804 OD1 ASP A 54 69.941 4.793 10.941 1.00 0.00 O ATOM 805 OD2 ASP A 54 71.232 6.262 10.035 1.00 0.00 O ATOM 0 H ASP A 54 67.601 4.022 9.530 1.00 0.00 H new ATOM 0 HA ASP A 54 67.887 6.625 10.702 1.00 0.00 H new ATOM 0 HB2 ASP A 54 69.060 5.143 8.325 1.00 0.00 H new ATOM 0 HB3 ASP A 54 69.358 6.859 8.519 1.00 0.00 H new ATOM 810 N TYR A 55 66.166 6.220 7.935 1.00 0.00 N ATOM 811 CA TYR A 55 65.253 6.882 7.009 1.00 0.00 C ATOM 812 C TYR A 55 63.813 6.786 7.510 1.00 0.00 C ATOM 813 O TYR A 55 62.986 7.650 7.222 1.00 0.00 O ATOM 814 CB TYR A 55 65.354 6.256 5.616 1.00 0.00 C ATOM 815 CG TYR A 55 66.741 6.496 5.059 1.00 0.00 C ATOM 816 CD1 TYR A 55 67.845 5.859 5.638 1.00 0.00 C ATOM 817 CD2 TYR A 55 66.921 7.358 3.969 1.00 0.00 C ATOM 818 CE1 TYR A 55 69.129 6.082 5.125 1.00 0.00 C ATOM 819 CE2 TYR A 55 68.206 7.582 3.458 1.00 0.00 C ATOM 820 CZ TYR A 55 69.310 6.943 4.036 1.00 0.00 C ATOM 821 OH TYR A 55 70.576 7.164 3.532 1.00 0.00 O ATOM 0 H TYR A 55 66.241 5.210 7.811 1.00 0.00 H new ATOM 0 HA TYR A 55 65.538 7.932 6.950 1.00 0.00 H new ATOM 0 HB2 TYR A 55 65.151 5.186 5.670 1.00 0.00 H new ATOM 0 HB3 TYR A 55 64.604 6.690 4.955 1.00 0.00 H new ATOM 0 HD1 TYR A 55 67.707 5.196 6.479 1.00 0.00 H new ATOM 0 HD2 TYR A 55 66.069 7.850 3.523 1.00 0.00 H new ATOM 0 HE1 TYR A 55 69.981 5.589 5.570 1.00 0.00 H new ATOM 0 HE2 TYR A 55 68.345 8.247 2.619 1.00 0.00 H new ATOM 0 HH TYR A 55 70.523 7.786 2.777 1.00 0.00 H new ATOM 831 N GLY A 56 63.519 5.733 8.276 1.00 0.00 N ATOM 832 CA GLY A 56 62.172 5.559 8.816 1.00 0.00 C ATOM 833 C GLY A 56 61.199 5.070 7.746 1.00 0.00 C ATOM 834 O GLY A 56 60.037 5.475 7.718 1.00 0.00 O ATOM 0 H GLY A 56 64.182 5.002 8.532 1.00 0.00 H new ATOM 0 HA2 GLY A 56 62.198 4.845 9.639 1.00 0.00 H new ATOM 0 HA3 GLY A 56 61.818 6.505 9.226 1.00 0.00 H new ATOM 838 N VAL A 57 61.677 4.190 6.870 1.00 0.00 N ATOM 839 CA VAL A 57 60.819 3.657 5.811 1.00 0.00 C ATOM 840 C VAL A 57 59.987 2.487 6.345 1.00 0.00 C ATOM 841 O VAL A 57 60.461 1.685 7.150 1.00 0.00 O ATOM 842 CB VAL A 57 61.664 3.199 4.605 1.00 0.00 C ATOM 843 CG1 VAL A 57 62.632 2.083 5.025 1.00 0.00 C ATOM 844 CG2 VAL A 57 60.743 2.695 3.479 1.00 0.00 C ATOM 0 H VAL A 57 62.633 3.836 6.869 1.00 0.00 H new ATOM 0 HA VAL A 57 60.147 4.449 5.481 1.00 0.00 H new ATOM 0 HB VAL A 57 62.243 4.048 4.241 1.00 0.00 H new ATOM 0 HG11 VAL A 57 63.222 1.770 4.164 1.00 0.00 H new ATOM 0 HG12 VAL A 57 63.297 2.453 5.805 1.00 0.00 H new ATOM 0 HG13 VAL A 57 62.065 1.233 5.405 1.00 0.00 H new ATOM 0 HG21 VAL A 57 61.348 2.373 2.631 1.00 0.00 H new ATOM 0 HG22 VAL A 57 60.151 1.855 3.842 1.00 0.00 H new ATOM 0 HG23 VAL A 57 60.077 3.499 3.166 1.00 0.00 H new ATOM 854 N GLN A 58 58.737 2.406 5.893 1.00 0.00 N ATOM 855 CA GLN A 58 57.850 1.335 6.338 1.00 0.00 C ATOM 856 C GLN A 58 56.733 1.097 5.317 1.00 0.00 C ATOM 857 O GLN A 58 55.547 1.099 5.652 1.00 0.00 O ATOM 858 CB GLN A 58 57.232 1.685 7.695 1.00 0.00 C ATOM 859 CG GLN A 58 56.548 0.446 8.274 1.00 0.00 C ATOM 860 CD GLN A 58 56.207 0.692 9.740 1.00 0.00 C ATOM 861 OE1 GLN A 58 57.085 0.661 10.602 1.00 0.00 O ATOM 862 NE2 GLN A 58 54.970 0.938 10.077 1.00 0.00 N ATOM 0 H GLN A 58 58.321 3.059 5.229 1.00 0.00 H new ATOM 0 HA GLN A 58 58.442 0.425 6.434 1.00 0.00 H new ATOM 0 HB2 GLN A 58 58.003 2.041 8.378 1.00 0.00 H new ATOM 0 HB3 GLN A 58 56.510 2.493 7.581 1.00 0.00 H new ATOM 0 HG2 GLN A 58 55.642 0.221 7.711 1.00 0.00 H new ATOM 0 HG3 GLN A 58 57.203 -0.420 8.182 1.00 0.00 H new ATOM 0 HE21 GLN A 58 54.242 0.964 9.363 1.00 0.00 H new ATOM 0 HE22 GLN A 58 54.731 1.105 11.055 1.00 0.00 H new ATOM 871 N LEU A 59 57.129 0.887 4.065 1.00 0.00 N ATOM 872 CA LEU A 59 56.153 0.642 3.002 1.00 0.00 C ATOM 873 C LEU A 59 55.755 -0.832 2.960 1.00 0.00 C ATOM 874 O LEU A 59 54.640 -1.176 2.571 1.00 0.00 O ATOM 875 CB LEU A 59 56.707 1.065 1.632 1.00 0.00 C ATOM 876 CG LEU A 59 57.756 0.139 0.999 1.00 0.00 C ATOM 877 CD1 LEU A 59 57.913 0.498 -0.480 1.00 0.00 C ATOM 878 CD2 LEU A 59 59.104 0.317 1.707 1.00 0.00 C ATOM 0 H LEU A 59 58.103 0.881 3.762 1.00 0.00 H new ATOM 0 HA LEU A 59 55.271 1.243 3.224 1.00 0.00 H new ATOM 0 HB2 LEU A 59 55.870 1.156 0.939 1.00 0.00 H new ATOM 0 HB3 LEU A 59 57.146 2.058 1.734 1.00 0.00 H new ATOM 0 HG LEU A 59 57.431 -0.897 1.100 1.00 0.00 H new ATOM 0 HD11 LEU A 59 58.657 -0.156 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 59 56.957 0.371 -0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 59 58.237 1.535 -0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 59 59.843 -0.343 1.253 1.00 0.00 H new ATOM 0 HD22 LEU A 59 59.432 1.352 1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 59 58.996 0.069 2.763 1.00 0.00 H new ATOM 890 N GLY A 60 56.678 -1.701 3.366 1.00 0.00 N ATOM 891 CA GLY A 60 56.406 -3.134 3.370 1.00 0.00 C ATOM 892 C GLY A 60 57.586 -3.911 3.942 1.00 0.00 C ATOM 893 O GLY A 60 58.711 -3.813 3.450 1.00 0.00 O ATOM 0 H GLY A 60 57.609 -1.442 3.692 1.00 0.00 H new ATOM 0 HA2 GLY A 60 55.512 -3.337 3.960 1.00 0.00 H new ATOM 0 HA3 GLY A 60 56.201 -3.472 2.354 1.00 0.00 H new ATOM 897 N ASP A 61 57.316 -4.686 4.988 1.00 0.00 N ATOM 898 CA ASP A 61 58.360 -5.484 5.626 1.00 0.00 C ATOM 899 C ASP A 61 58.953 -6.481 4.634 1.00 0.00 C ATOM 900 O ASP A 61 60.128 -6.841 4.717 1.00 0.00 O ATOM 901 CB ASP A 61 57.794 -6.249 6.823 1.00 0.00 C ATOM 902 CG ASP A 61 57.158 -5.266 7.801 1.00 0.00 C ATOM 903 OD1 ASP A 61 56.266 -4.543 7.387 1.00 0.00 O ATOM 904 OD2 ASP A 61 57.573 -5.250 8.948 1.00 0.00 O ATOM 0 H ASP A 61 56.392 -4.779 5.410 1.00 0.00 H new ATOM 0 HA ASP A 61 59.140 -4.804 5.967 1.00 0.00 H new ATOM 0 HB2 ASP A 61 57.053 -6.975 6.487 1.00 0.00 H new ATOM 0 HB3 ASP A 61 58.587 -6.809 7.318 1.00 0.00 H new ATOM 909 N ASP A 62 58.126 -6.922 3.687 1.00 0.00 N ATOM 910 CA ASP A 62 58.580 -7.877 2.683 1.00 0.00 C ATOM 911 C ASP A 62 59.394 -7.193 1.581 1.00 0.00 C ATOM 912 O ASP A 62 59.888 -7.856 0.667 1.00 0.00 O ATOM 913 CB ASP A 62 57.387 -8.593 2.047 1.00 0.00 C ATOM 914 CG ASP A 62 56.409 -7.561 1.495 1.00 0.00 C ATOM 915 OD1 ASP A 62 55.594 -7.076 2.261 1.00 0.00 O ATOM 916 OD2 ASP A 62 56.490 -7.271 0.312 1.00 0.00 O ATOM 0 H ASP A 62 57.151 -6.637 3.596 1.00 0.00 H new ATOM 0 HA ASP A 62 59.218 -8.599 3.192 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.728 -9.250 1.247 1.00 0.00 H new ATOM 0 HB3 ASP A 62 56.890 -9.221 2.786 1.00 0.00 H new ATOM 921 N ALA A 63 59.555 -5.867 1.673 1.00 0.00 N ATOM 922 CA ALA A 63 60.335 -5.133 0.680 1.00 0.00 C ATOM 923 C ALA A 63 61.748 -5.698 0.604 1.00 0.00 C ATOM 924 O ALA A 63 62.375 -5.719 -0.456 1.00 0.00 O ATOM 925 CB ALA A 63 60.415 -3.656 1.060 1.00 0.00 C ATOM 0 H ALA A 63 59.160 -5.291 2.416 1.00 0.00 H new ATOM 0 HA ALA A 63 59.844 -5.236 -0.288 1.00 0.00 H new ATOM 0 HB1 ALA A 63 60.999 -3.119 0.312 1.00 0.00 H new ATOM 0 HB2 ALA A 63 59.410 -3.237 1.105 1.00 0.00 H new ATOM 0 HB3 ALA A 63 60.894 -3.556 2.034 1.00 0.00 H new ATOM 931 N VAL A 64 62.234 -6.167 1.749 1.00 0.00 N ATOM 932 CA VAL A 64 63.570 -6.748 1.817 1.00 0.00 C ATOM 933 C VAL A 64 63.596 -8.097 1.088 1.00 0.00 C ATOM 934 O VAL A 64 64.634 -8.521 0.579 1.00 0.00 O ATOM 935 CB VAL A 64 63.997 -6.932 3.283 1.00 0.00 C ATOM 936 CG1 VAL A 64 63.038 -7.894 3.993 1.00 0.00 C ATOM 937 CG2 VAL A 64 65.422 -7.495 3.345 1.00 0.00 C ATOM 0 H VAL A 64 61.728 -6.157 2.635 1.00 0.00 H new ATOM 0 HA VAL A 64 64.271 -6.070 1.330 1.00 0.00 H new ATOM 0 HB VAL A 64 63.968 -5.963 3.781 1.00 0.00 H new ATOM 0 HG11 VAL A 64 63.349 -8.018 5.030 1.00 0.00 H new ATOM 0 HG12 VAL A 64 62.027 -7.488 3.963 1.00 0.00 H new ATOM 0 HG13 VAL A 64 63.055 -8.861 3.491 1.00 0.00 H new ATOM 0 HG21 VAL A 64 65.718 -7.623 4.386 1.00 0.00 H new ATOM 0 HG22 VAL A 64 65.455 -8.459 2.838 1.00 0.00 H new ATOM 0 HG23 VAL A 64 66.108 -6.804 2.855 1.00 0.00 H new ATOM 947 N GLU A 65 62.442 -8.763 1.046 1.00 0.00 N ATOM 948 CA GLU A 65 62.345 -10.058 0.380 1.00 0.00 C ATOM 949 C GLU A 65 62.498 -9.894 -1.129 1.00 0.00 C ATOM 950 O GLU A 65 63.429 -10.427 -1.735 1.00 0.00 O ATOM 951 CB GLU A 65 60.993 -10.711 0.674 1.00 0.00 C ATOM 952 CG GLU A 65 61.044 -12.188 0.278 1.00 0.00 C ATOM 953 CD GLU A 65 59.731 -12.863 0.662 1.00 0.00 C ATOM 954 OE1 GLU A 65 58.691 -12.349 0.283 1.00 0.00 O ATOM 955 OE2 GLU A 65 59.785 -13.883 1.327 1.00 0.00 O ATOM 0 H GLU A 65 61.571 -8.431 1.461 1.00 0.00 H new ATOM 0 HA GLU A 65 63.146 -10.692 0.760 1.00 0.00 H new ATOM 0 HB2 GLU A 65 60.753 -10.615 1.733 1.00 0.00 H new ATOM 0 HB3 GLU A 65 60.203 -10.202 0.121 1.00 0.00 H new ATOM 0 HG2 GLU A 65 61.214 -12.282 -0.795 1.00 0.00 H new ATOM 0 HG3 GLU A 65 61.878 -12.681 0.777 1.00 0.00 H new ATOM 962 N LYS A 66 61.574 -9.148 -1.729 1.00 0.00 N ATOM 963 CA LYS A 66 61.610 -8.914 -3.171 1.00 0.00 C ATOM 964 C LYS A 66 62.907 -8.216 -3.570 1.00 0.00 C ATOM 965 O LYS A 66 63.424 -8.416 -4.669 1.00 0.00 O ATOM 966 CB LYS A 66 60.426 -8.045 -3.602 1.00 0.00 C ATOM 967 CG LYS A 66 59.130 -8.845 -3.472 1.00 0.00 C ATOM 968 CD LYS A 66 58.044 -8.199 -4.333 1.00 0.00 C ATOM 969 CE LYS A 66 57.236 -7.216 -3.483 1.00 0.00 C ATOM 970 NZ LYS A 66 55.936 -6.931 -4.155 1.00 0.00 N ATOM 0 H LYS A 66 60.797 -8.698 -1.245 1.00 0.00 H new ATOM 0 HA LYS A 66 61.552 -9.882 -3.668 1.00 0.00 H new ATOM 0 HB2 LYS A 66 60.376 -7.149 -2.984 1.00 0.00 H new ATOM 0 HB3 LYS A 66 60.560 -7.715 -4.632 1.00 0.00 H new ATOM 0 HG2 LYS A 66 59.293 -9.876 -3.786 1.00 0.00 H new ATOM 0 HG3 LYS A 66 58.812 -8.876 -2.430 1.00 0.00 H new ATOM 0 HD2 LYS A 66 58.496 -7.679 -5.178 1.00 0.00 H new ATOM 0 HD3 LYS A 66 57.387 -8.966 -4.744 1.00 0.00 H new ATOM 0 HE2 LYS A 66 57.061 -7.634 -2.492 1.00 0.00 H new ATOM 0 HE3 LYS A 66 57.797 -6.292 -3.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 55.386 -6.263 -3.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 56.113 -6.515 -5.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 55.401 -7.816 -4.265 1.00 0.00 H new ATOM 984 N ALA A 67 63.425 -7.392 -2.662 1.00 0.00 N ATOM 985 CA ALA A 67 64.665 -6.661 -2.920 1.00 0.00 C ATOM 986 C ALA A 67 65.808 -7.621 -3.247 1.00 0.00 C ATOM 987 O ALA A 67 66.429 -8.195 -2.352 1.00 0.00 O ATOM 988 CB ALA A 67 65.057 -5.827 -1.701 1.00 0.00 C ATOM 0 H ALA A 67 63.010 -7.214 -1.748 1.00 0.00 H new ATOM 0 HA ALA A 67 64.489 -6.007 -3.774 1.00 0.00 H new ATOM 0 HB1 ALA A 67 65.982 -5.289 -1.910 1.00 0.00 H new ATOM 0 HB2 ALA A 67 64.264 -5.113 -1.479 1.00 0.00 H new ATOM 0 HB3 ALA A 67 65.205 -6.483 -0.843 1.00 0.00 H new ATOM 994 N THR A 68 66.083 -7.776 -4.538 1.00 0.00 N ATOM 995 CA THR A 68 67.165 -8.655 -4.977 1.00 0.00 C ATOM 996 C THR A 68 68.394 -7.820 -5.328 1.00 0.00 C ATOM 997 O THR A 68 69.531 -8.237 -5.114 1.00 0.00 O ATOM 998 CB THR A 68 66.741 -9.481 -6.198 1.00 0.00 C ATOM 999 OG1 THR A 68 67.834 -10.282 -6.625 1.00 0.00 O ATOM 1000 CG2 THR A 68 66.314 -8.553 -7.339 1.00 0.00 C ATOM 0 H THR A 68 65.579 -7.311 -5.293 1.00 0.00 H new ATOM 0 HA THR A 68 67.403 -9.339 -4.163 1.00 0.00 H new ATOM 0 HB THR A 68 65.900 -10.118 -5.924 1.00 0.00 H new ATOM 0 HG1 THR A 68 67.566 -10.812 -7.404 1.00 0.00 H new ATOM 0 HG21 THR A 68 66.015 -9.150 -8.201 1.00 0.00 H new ATOM 0 HG22 THR A 68 65.474 -7.939 -7.014 1.00 0.00 H new ATOM 0 HG23 THR A 68 67.149 -7.909 -7.616 1.00 0.00 H new ATOM 1008 N THR A 69 68.140 -6.626 -5.859 1.00 0.00 N ATOM 1009 CA THR A 69 69.217 -5.712 -6.229 1.00 0.00 C ATOM 1010 C THR A 69 69.220 -4.523 -5.266 1.00 0.00 C ATOM 1011 O THR A 69 68.262 -4.330 -4.517 1.00 0.00 O ATOM 1012 CB THR A 69 69.019 -5.186 -7.664 1.00 0.00 C ATOM 1013 OG1 THR A 69 67.693 -5.461 -8.096 1.00 0.00 O ATOM 1014 CG2 THR A 69 70.010 -5.862 -8.610 1.00 0.00 C ATOM 0 H THR A 69 67.202 -6.270 -6.042 1.00 0.00 H new ATOM 0 HA THR A 69 70.163 -6.251 -6.176 1.00 0.00 H new ATOM 0 HB THR A 69 69.190 -4.110 -7.673 1.00 0.00 H new ATOM 0 HG1 THR A 69 67.570 -5.124 -9.008 1.00 0.00 H new ATOM 0 HG21 THR A 69 69.863 -5.484 -9.622 1.00 0.00 H new ATOM 0 HG22 THR A 69 71.028 -5.645 -8.286 1.00 0.00 H new ATOM 0 HG23 THR A 69 69.847 -6.940 -8.598 1.00 0.00 H new ATOM 1022 N PRO A 70 70.271 -3.693 -5.283 1.00 0.00 N ATOM 1023 CA PRO A 70 70.326 -2.518 -4.400 1.00 0.00 C ATOM 1024 C PRO A 70 69.309 -1.474 -4.830 1.00 0.00 C ATOM 1025 O PRO A 70 68.716 -0.782 -4.004 1.00 0.00 O ATOM 1026 CB PRO A 70 71.758 -2.028 -4.575 1.00 0.00 C ATOM 1027 CG PRO A 70 72.235 -2.563 -5.915 1.00 0.00 C ATOM 1028 CD PRO A 70 71.445 -3.848 -6.175 1.00 0.00 C ATOM 0 HA PRO A 70 70.083 -2.737 -3.360 1.00 0.00 H new ATOM 0 HB2 PRO A 70 71.801 -0.939 -4.554 1.00 0.00 H new ATOM 0 HB3 PRO A 70 72.393 -2.387 -3.765 1.00 0.00 H new ATOM 0 HG2 PRO A 70 72.063 -1.835 -6.707 1.00 0.00 H new ATOM 0 HG3 PRO A 70 73.306 -2.764 -5.894 1.00 0.00 H new ATOM 0 HD2 PRO A 70 71.150 -3.938 -7.221 1.00 0.00 H new ATOM 0 HD3 PRO A 70 72.026 -4.737 -5.930 1.00 0.00 H new ATOM 1036 N ARG A 71 69.090 -1.393 -6.140 1.00 0.00 N ATOM 1037 CA ARG A 71 68.113 -0.457 -6.679 1.00 0.00 C ATOM 1038 C ARG A 71 66.716 -0.796 -6.156 1.00 0.00 C ATOM 1039 O ARG A 71 65.850 0.074 -6.055 1.00 0.00 O ATOM 1040 CB ARG A 71 68.102 -0.513 -8.207 1.00 0.00 C ATOM 1041 CG ARG A 71 69.481 -0.125 -8.741 1.00 0.00 C ATOM 1042 CD ARG A 71 69.531 1.386 -8.977 1.00 0.00 C ATOM 1043 NE ARG A 71 70.375 1.699 -10.132 1.00 0.00 N ATOM 1044 CZ ARG A 71 70.484 2.943 -10.619 1.00 0.00 C ATOM 1045 NH1 ARG A 71 69.838 3.947 -10.075 1.00 0.00 N ATOM 1046 NH2 ARG A 71 71.250 3.161 -11.654 1.00 0.00 N ATOM 0 H ARG A 71 69.571 -1.958 -6.840 1.00 0.00 H new ATOM 0 HA ARG A 71 68.391 0.547 -6.359 1.00 0.00 H new ATOM 0 HB2 ARG A 71 67.839 -1.516 -8.543 1.00 0.00 H new ATOM 0 HB3 ARG A 71 67.344 0.164 -8.601 1.00 0.00 H new ATOM 0 HG2 ARG A 71 70.254 -0.418 -8.030 1.00 0.00 H new ATOM 0 HG3 ARG A 71 69.685 -0.656 -9.671 1.00 0.00 H new ATOM 0 HD2 ARG A 71 68.523 1.767 -9.142 1.00 0.00 H new ATOM 0 HD3 ARG A 71 69.920 1.886 -8.090 1.00 0.00 H new ATOM 0 HE ARG A 71 70.897 0.946 -10.580 1.00 0.00 H new ATOM 0 HH11 ARG A 71 69.238 3.789 -9.265 1.00 0.00 H new ATOM 0 HH12 ARG A 71 69.935 4.886 -10.462 1.00 0.00 H new ATOM 0 HH21 ARG A 71 71.758 2.388 -12.084 1.00 0.00 H new ATOM 0 HH22 ARG A 71 71.340 4.104 -12.032 1.00 0.00 H new ATOM 1060 N ALA A 72 66.506 -2.073 -5.820 1.00 0.00 N ATOM 1061 CA ALA A 72 65.212 -2.508 -5.302 1.00 0.00 C ATOM 1062 C ALA A 72 64.943 -1.853 -3.955 1.00 0.00 C ATOM 1063 O ALA A 72 63.932 -1.179 -3.764 1.00 0.00 O ATOM 1064 CB ALA A 72 65.184 -4.029 -5.136 1.00 0.00 C ATOM 0 H ALA A 72 67.206 -2.811 -5.897 1.00 0.00 H new ATOM 0 HA ALA A 72 64.442 -2.212 -6.014 1.00 0.00 H new ATOM 0 HB1 ALA A 72 64.212 -4.335 -4.749 1.00 0.00 H new ATOM 0 HB2 ALA A 72 65.356 -4.504 -6.102 1.00 0.00 H new ATOM 0 HB3 ALA A 72 65.964 -4.333 -4.438 1.00 0.00 H new ATOM 1070 N LEU A 73 65.872 -2.053 -3.024 1.00 0.00 N ATOM 1071 CA LEU A 73 65.744 -1.467 -1.688 1.00 0.00 C ATOM 1072 C LEU A 73 65.656 0.051 -1.790 1.00 0.00 C ATOM 1073 O LEU A 73 64.797 0.685 -1.179 1.00 0.00 O ATOM 1074 CB LEU A 73 66.948 -1.830 -0.818 1.00 0.00 C ATOM 1075 CG LEU A 73 67.275 -3.321 -0.745 1.00 0.00 C ATOM 1076 CD1 LEU A 73 68.733 -3.503 -0.318 1.00 0.00 C ATOM 1077 CD2 LEU A 73 66.358 -3.993 0.278 1.00 0.00 C ATOM 0 H LEU A 73 66.715 -2.610 -3.165 1.00 0.00 H new ATOM 0 HA LEU A 73 64.837 -1.865 -1.233 1.00 0.00 H new ATOM 0 HB2 LEU A 73 67.822 -1.301 -1.198 1.00 0.00 H new ATOM 0 HB3 LEU A 73 66.768 -1.464 0.193 1.00 0.00 H new ATOM 0 HG LEU A 73 67.123 -3.775 -1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 73 68.967 -4.566 -0.266 1.00 0.00 H new ATOM 0 HD12 LEU A 73 69.388 -3.023 -1.045 1.00 0.00 H new ATOM 0 HD13 LEU A 73 68.885 -3.050 0.662 1.00 0.00 H new ATOM 0 HD21 LEU A 73 66.590 -5.057 0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 73 66.511 -3.539 1.257 1.00 0.00 H new ATOM 0 HD23 LEU A 73 65.319 -3.863 -0.024 1.00 0.00 H new ATOM 1089 N ILE A 74 66.560 0.623 -2.583 1.00 0.00 N ATOM 1090 CA ILE A 74 66.593 2.073 -2.782 1.00 0.00 C ATOM 1091 C ILE A 74 65.234 2.574 -3.280 1.00 0.00 C ATOM 1092 O ILE A 74 64.795 3.670 -2.933 1.00 0.00 O ATOM 1093 CB ILE A 74 67.681 2.440 -3.809 1.00 0.00 C ATOM 1094 CG1 ILE A 74 69.055 2.058 -3.256 1.00 0.00 C ATOM 1095 CG2 ILE A 74 67.672 3.947 -4.101 1.00 0.00 C ATOM 1096 CD1 ILE A 74 70.079 2.077 -4.392 1.00 0.00 C ATOM 0 H ILE A 74 67.276 0.109 -3.096 1.00 0.00 H new ATOM 0 HA ILE A 74 66.820 2.547 -1.827 1.00 0.00 H new ATOM 0 HB ILE A 74 67.476 1.897 -4.731 1.00 0.00 H new ATOM 0 HG12 ILE A 74 69.351 2.755 -2.472 1.00 0.00 H new ATOM 0 HG13 ILE A 74 69.015 1.067 -2.803 1.00 0.00 H new ATOM 0 HG21 ILE A 74 68.449 4.181 -4.829 1.00 0.00 H new ATOM 0 HG22 ILE A 74 66.700 4.234 -4.503 1.00 0.00 H new ATOM 0 HG23 ILE A 74 67.861 4.497 -3.179 1.00 0.00 H new ATOM 0 HD11 ILE A 74 71.060 1.805 -4.002 1.00 0.00 H new ATOM 0 HD12 ILE A 74 69.783 1.363 -5.160 1.00 0.00 H new ATOM 0 HD13 ILE A 74 70.125 3.077 -4.824 1.00 0.00 H new ATOM 1108 N GLU A 75 64.581 1.766 -4.108 1.00 0.00 N ATOM 1109 CA GLU A 75 63.288 2.150 -4.659 1.00 0.00 C ATOM 1110 C GLU A 75 62.179 1.989 -3.630 1.00 0.00 C ATOM 1111 O GLU A 75 61.398 2.908 -3.396 1.00 0.00 O ATOM 1112 CB GLU A 75 62.955 1.305 -5.889 1.00 0.00 C ATOM 1113 CG GLU A 75 63.497 1.992 -7.143 1.00 0.00 C ATOM 1114 CD GLU A 75 62.914 1.323 -8.383 1.00 0.00 C ATOM 1115 OE1 GLU A 75 63.407 0.271 -8.752 1.00 0.00 O ATOM 1116 OE2 GLU A 75 61.981 1.873 -8.944 1.00 0.00 O ATOM 0 H GLU A 75 64.921 0.853 -4.409 1.00 0.00 H new ATOM 0 HA GLU A 75 63.356 3.200 -4.944 1.00 0.00 H new ATOM 0 HB2 GLU A 75 63.391 0.311 -5.789 1.00 0.00 H new ATOM 0 HB3 GLU A 75 61.876 1.173 -5.971 1.00 0.00 H new ATOM 0 HG2 GLU A 75 63.237 3.050 -7.132 1.00 0.00 H new ATOM 0 HG3 GLU A 75 64.585 1.931 -7.162 1.00 0.00 H new ATOM 1123 N MET A 76 62.114 0.816 -3.017 1.00 0.00 N ATOM 1124 CA MET A 76 61.090 0.557 -2.014 1.00 0.00 C ATOM 1125 C MET A 76 61.251 1.515 -0.838 1.00 0.00 C ATOM 1126 O MET A 76 60.275 2.050 -0.307 1.00 0.00 O ATOM 1127 CB MET A 76 61.200 -0.882 -1.507 1.00 0.00 C ATOM 1128 CG MET A 76 60.613 -1.837 -2.548 1.00 0.00 C ATOM 1129 SD MET A 76 58.814 -1.902 -2.361 1.00 0.00 S ATOM 1130 CE MET A 76 58.401 -1.869 -4.123 1.00 0.00 C ATOM 0 H MET A 76 62.749 0.037 -3.193 1.00 0.00 H new ATOM 0 HA MET A 76 60.113 0.707 -2.473 1.00 0.00 H new ATOM 0 HB2 MET A 76 62.243 -1.133 -1.316 1.00 0.00 H new ATOM 0 HB3 MET A 76 60.669 -0.987 -0.561 1.00 0.00 H new ATOM 0 HG2 MET A 76 60.873 -1.502 -3.552 1.00 0.00 H new ATOM 0 HG3 MET A 76 61.038 -2.833 -2.424 1.00 0.00 H new ATOM 0 HE1 MET A 76 57.318 -1.902 -4.244 1.00 0.00 H new ATOM 0 HE2 MET A 76 58.788 -0.954 -4.570 1.00 0.00 H new ATOM 0 HE3 MET A 76 58.848 -2.732 -4.618 1.00 0.00 H new ATOM 1140 N THR A 77 62.502 1.730 -0.446 1.00 0.00 N ATOM 1141 CA THR A 77 62.800 2.625 0.665 1.00 0.00 C ATOM 1142 C THR A 77 62.427 4.065 0.317 1.00 0.00 C ATOM 1143 O THR A 77 61.734 4.738 1.078 1.00 0.00 O ATOM 1144 CB THR A 77 64.289 2.563 1.023 1.00 0.00 C ATOM 1145 OG1 THR A 77 64.664 1.211 1.239 1.00 0.00 O ATOM 1146 CG2 THR A 77 64.553 3.374 2.294 1.00 0.00 C ATOM 0 H THR A 77 63.320 1.300 -0.878 1.00 0.00 H new ATOM 0 HA THR A 77 62.209 2.299 1.521 1.00 0.00 H new ATOM 0 HB THR A 77 64.874 2.981 0.204 1.00 0.00 H new ATOM 0 HG1 THR A 77 65.026 0.835 0.409 1.00 0.00 H new ATOM 0 HG21 THR A 77 65.613 3.326 2.543 1.00 0.00 H new ATOM 0 HG22 THR A 77 64.266 4.413 2.129 1.00 0.00 H new ATOM 0 HG23 THR A 77 63.968 2.962 3.116 1.00 0.00 H new ATOM 1154 N ASN A 78 62.899 4.536 -0.835 1.00 0.00 N ATOM 1155 CA ASN A 78 62.614 5.903 -1.258 1.00 0.00 C ATOM 1156 C ASN A 78 61.147 6.071 -1.608 1.00 0.00 C ATOM 1157 O ASN A 78 60.546 7.108 -1.349 1.00 0.00 O ATOM 1158 CB ASN A 78 63.457 6.251 -2.474 1.00 0.00 C ATOM 1159 CG ASN A 78 64.910 6.357 -2.042 1.00 0.00 C ATOM 1160 OD1 ASN A 78 65.200 6.749 -0.912 1.00 0.00 O ATOM 1161 ND2 ASN A 78 65.852 6.023 -2.873 1.00 0.00 N ATOM 0 H ASN A 78 63.473 3.999 -1.484 1.00 0.00 H new ATOM 0 HA ASN A 78 62.856 6.570 -0.431 1.00 0.00 H new ATOM 0 HB2 ASN A 78 63.346 5.486 -3.243 1.00 0.00 H new ATOM 0 HB3 ASN A 78 63.122 7.192 -2.910 1.00 0.00 H new ATOM 0 HD21 ASN A 78 66.829 6.086 -2.588 1.00 0.00 H new ATOM 0 HD22 ASN A 78 65.614 5.698 -3.810 1.00 0.00 H new ATOM 1168 N ALA A 79 60.581 5.029 -2.197 1.00 0.00 N ATOM 1169 CA ALA A 79 59.173 5.040 -2.590 1.00 0.00 C ATOM 1170 C ALA A 79 58.294 5.327 -1.383 1.00 0.00 C ATOM 1171 O ALA A 79 57.265 5.995 -1.483 1.00 0.00 O ATOM 1172 CB ALA A 79 58.775 3.687 -3.179 1.00 0.00 C ATOM 0 H ALA A 79 61.072 4.162 -2.415 1.00 0.00 H new ATOM 0 HA ALA A 79 59.035 5.819 -3.340 1.00 0.00 H new ATOM 0 HB1 ALA A 79 57.724 3.711 -3.467 1.00 0.00 H new ATOM 0 HB2 ALA A 79 59.387 3.478 -4.056 1.00 0.00 H new ATOM 0 HB3 ALA A 79 58.930 2.906 -2.434 1.00 0.00 H new ATOM 1178 N SER A 80 58.725 4.818 -0.235 1.00 0.00 N ATOM 1179 CA SER A 80 57.983 5.030 0.998 1.00 0.00 C ATOM 1180 C SER A 80 58.163 6.462 1.467 1.00 0.00 C ATOM 1181 O SER A 80 57.212 7.126 1.877 1.00 0.00 O ATOM 1182 CB SER A 80 58.474 4.090 2.096 1.00 0.00 C ATOM 1183 OG SER A 80 57.417 3.850 3.017 1.00 0.00 O ATOM 0 H SER A 80 59.574 4.262 -0.134 1.00 0.00 H new ATOM 0 HA SER A 80 56.931 4.828 0.798 1.00 0.00 H new ATOM 0 HB2 SER A 80 58.813 3.150 1.661 1.00 0.00 H new ATOM 0 HB3 SER A 80 59.328 4.529 2.611 1.00 0.00 H new ATOM 0 HG SER A 80 57.539 4.414 3.809 1.00 0.00 H new ATOM 1189 N LEU A 81 59.403 6.926 1.400 1.00 0.00 N ATOM 1190 CA LEU A 81 59.715 8.285 1.819 1.00 0.00 C ATOM 1191 C LEU A 81 59.053 9.299 0.895 1.00 0.00 C ATOM 1192 O LEU A 81 58.395 10.236 1.346 1.00 0.00 O ATOM 1193 CB LEU A 81 61.224 8.497 1.809 1.00 0.00 C ATOM 1194 CG LEU A 81 62.006 7.475 2.635 1.00 0.00 C ATOM 1195 CD1 LEU A 81 63.486 7.541 2.268 1.00 0.00 C ATOM 1196 CD2 LEU A 81 61.830 7.785 4.119 1.00 0.00 C ATOM 0 H LEU A 81 60.202 6.388 1.063 1.00 0.00 H new ATOM 0 HA LEU A 81 59.332 8.429 2.829 1.00 0.00 H new ATOM 0 HB2 LEU A 81 61.578 8.462 0.779 1.00 0.00 H new ATOM 0 HB3 LEU A 81 61.442 9.496 2.187 1.00 0.00 H new ATOM 0 HG LEU A 81 61.630 6.473 2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 81 64.040 6.811 2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 81 63.608 7.318 1.208 1.00 0.00 H new ATOM 0 HD13 LEU A 81 63.868 8.541 2.475 1.00 0.00 H new ATOM 0 HD21 LEU A 81 62.386 7.058 4.711 1.00 0.00 H new ATOM 0 HD22 LEU A 81 62.205 8.787 4.328 1.00 0.00 H new ATOM 0 HD23 LEU A 81 60.773 7.732 4.379 1.00 0.00 H new ATOM 1208 N THR A 82 59.233 9.100 -0.406 1.00 0.00 N ATOM 1209 CA THR A 82 58.647 10.003 -1.393 1.00 0.00 C ATOM 1210 C THR A 82 57.137 9.785 -1.496 1.00 0.00 C ATOM 1211 O THR A 82 56.384 10.706 -1.815 1.00 0.00 O ATOM 1212 CB THR A 82 59.288 9.786 -2.771 1.00 0.00 C ATOM 1213 OG1 THR A 82 58.731 10.707 -3.698 1.00 0.00 O ATOM 1214 CG2 THR A 82 59.037 8.355 -3.261 1.00 0.00 C ATOM 0 H THR A 82 59.774 8.330 -0.800 1.00 0.00 H new ATOM 0 HA THR A 82 58.838 11.025 -1.065 1.00 0.00 H new ATOM 0 HB THR A 82 60.363 9.945 -2.689 1.00 0.00 H new ATOM 0 HG1 THR A 82 59.139 10.572 -4.579 1.00 0.00 H new ATOM 0 HG21 THR A 82 59.498 8.219 -4.239 1.00 0.00 H new ATOM 0 HG22 THR A 82 59.470 7.647 -2.554 1.00 0.00 H new ATOM 0 HG23 THR A 82 57.964 8.180 -3.339 1.00 0.00 H new ATOM 1222 N GLY A 83 56.705 8.555 -1.226 1.00 0.00 N ATOM 1223 CA GLY A 83 55.285 8.227 -1.295 1.00 0.00 C ATOM 1224 C GLY A 83 54.520 8.897 -0.161 1.00 0.00 C ATOM 1225 O GLY A 83 53.425 9.421 -0.364 1.00 0.00 O ATOM 0 H GLY A 83 57.310 7.778 -0.961 1.00 0.00 H new ATOM 0 HA2 GLY A 83 54.879 8.549 -2.254 1.00 0.00 H new ATOM 0 HA3 GLY A 83 55.154 7.146 -1.240 1.00 0.00 H new ATOM 1229 N ALA A 84 55.115 8.862 1.041 1.00 0.00 N ATOM 1230 CA ALA A 84 54.514 9.459 2.253 1.00 0.00 C ATOM 1231 C ALA A 84 53.551 8.488 2.940 1.00 0.00 C ATOM 1232 O ALA A 84 53.535 8.382 4.166 1.00 0.00 O ATOM 1233 CB ALA A 84 53.770 10.770 1.950 1.00 0.00 C ATOM 0 H ALA A 84 56.021 8.423 1.204 1.00 0.00 H new ATOM 0 HA ALA A 84 55.346 9.678 2.922 1.00 0.00 H new ATOM 0 HB1 ALA A 84 53.346 11.169 2.872 1.00 0.00 H new ATOM 0 HB2 ALA A 84 54.466 11.494 1.527 1.00 0.00 H new ATOM 0 HB3 ALA A 84 52.969 10.577 1.236 1.00 0.00 H new ATOM 1239 N SER A 85 52.749 7.780 2.148 1.00 0.00 N ATOM 1240 CA SER A 85 51.789 6.825 2.703 1.00 0.00 C ATOM 1241 C SER A 85 50.763 7.551 3.583 1.00 0.00 C ATOM 1242 O SER A 85 50.902 7.582 4.806 1.00 0.00 O ATOM 1243 CB SER A 85 52.504 5.760 3.538 1.00 0.00 C ATOM 1244 OG SER A 85 53.757 5.457 2.939 1.00 0.00 O ATOM 0 H SER A 85 52.743 7.847 1.130 1.00 0.00 H new ATOM 0 HA SER A 85 51.278 6.341 1.871 1.00 0.00 H new ATOM 0 HB2 SER A 85 52.652 6.119 4.557 1.00 0.00 H new ATOM 0 HB3 SER A 85 51.892 4.861 3.603 1.00 0.00 H new ATOM 0 HG SER A 85 54.218 4.776 3.472 1.00 0.00 H new ATOM 1250 N PRO A 86 49.722 8.146 2.975 1.00 0.00 N ATOM 1251 CA PRO A 86 48.685 8.869 3.735 1.00 0.00 C ATOM 1252 C PRO A 86 47.617 7.936 4.303 1.00 0.00 C ATOM 1253 O PRO A 86 46.423 8.110 4.054 1.00 0.00 O ATOM 1254 CB PRO A 86 48.093 9.791 2.676 1.00 0.00 C ATOM 1255 CG PRO A 86 48.371 9.153 1.319 1.00 0.00 C ATOM 1256 CD PRO A 86 49.506 8.143 1.509 1.00 0.00 C ATOM 0 HA PRO A 86 49.085 9.385 4.608 1.00 0.00 H new ATOM 0 HB2 PRO A 86 47.021 9.916 2.830 1.00 0.00 H new ATOM 0 HB3 PRO A 86 48.542 10.783 2.734 1.00 0.00 H new ATOM 0 HG2 PRO A 86 47.478 8.658 0.938 1.00 0.00 H new ATOM 0 HG3 PRO A 86 48.651 9.912 0.589 1.00 0.00 H new ATOM 0 HD2 PRO A 86 49.229 7.154 1.145 1.00 0.00 H new ATOM 0 HD3 PRO A 86 50.405 8.441 0.969 1.00 0.00 H new ATOM 1264 N SER A 87 48.060 6.945 5.070 1.00 0.00 N ATOM 1265 CA SER A 87 47.134 5.988 5.670 1.00 0.00 C ATOM 1266 C SER A 87 47.878 5.040 6.605 1.00 0.00 C ATOM 1267 O SER A 87 49.006 4.630 6.328 1.00 0.00 O ATOM 1268 CB SER A 87 46.433 5.169 4.586 1.00 0.00 C ATOM 1269 OG SER A 87 45.266 5.860 4.158 1.00 0.00 O ATOM 0 H SER A 87 49.043 6.783 5.290 1.00 0.00 H new ATOM 0 HA SER A 87 46.392 6.550 6.237 1.00 0.00 H new ATOM 0 HB2 SER A 87 47.105 5.009 3.743 1.00 0.00 H new ATOM 0 HB3 SER A 87 46.166 4.185 4.972 1.00 0.00 H new ATOM 0 HG SER A 87 45.420 6.826 4.211 1.00 0.00 H new ATOM 1275 N ALA A 88 47.234 4.698 7.717 1.00 0.00 N ATOM 1276 CA ALA A 88 47.842 3.796 8.690 1.00 0.00 C ATOM 1277 C ALA A 88 47.186 2.419 8.622 1.00 0.00 C ATOM 1278 O ALA A 88 47.066 1.721 9.629 1.00 0.00 O ATOM 1279 CB ALA A 88 47.684 4.352 10.107 1.00 0.00 C ATOM 0 H ALA A 88 46.301 5.028 7.965 1.00 0.00 H new ATOM 0 HA ALA A 88 48.902 3.707 8.450 1.00 0.00 H new ATOM 0 HB1 ALA A 88 48.143 3.667 10.820 1.00 0.00 H new ATOM 0 HB2 ALA A 88 48.172 5.325 10.173 1.00 0.00 H new ATOM 0 HB3 ALA A 88 46.625 4.461 10.339 1.00 0.00 H new ATOM 1285 N GLY A 89 46.766 2.036 7.419 1.00 0.00 N ATOM 1286 CA GLY A 89 46.122 0.740 7.226 1.00 0.00 C ATOM 1287 C GLY A 89 44.830 0.652 8.028 1.00 0.00 C ATOM 1288 O GLY A 89 43.942 1.496 7.898 1.00 0.00 O ATOM 0 H GLY A 89 46.858 2.597 6.572 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.909 0.589 6.168 1.00 0.00 H new ATOM 0 HA3 GLY A 89 46.800 -0.057 7.532 1.00 0.00 H new ATOM 1292 N GLY A 90 44.733 -0.381 8.861 1.00 0.00 N ATOM 1293 CA GLY A 90 43.545 -0.574 9.685 1.00 0.00 C ATOM 1294 C GLY A 90 42.309 -0.773 8.814 1.00 0.00 C ATOM 1295 O GLY A 90 41.657 0.187 8.405 1.00 0.00 O ATOM 0 H GLY A 90 45.456 -1.091 8.982 1.00 0.00 H new ATOM 0 HA2 GLY A 90 43.683 -1.440 10.332 1.00 0.00 H new ATOM 0 HA3 GLY A 90 43.403 0.290 10.334 1.00 0.00 H new ATOM 1299 N ALA A 91 41.995 -2.036 8.535 1.00 0.00 N ATOM 1300 CA ALA A 91 40.834 -2.357 7.709 1.00 0.00 C ATOM 1301 C ALA A 91 39.603 -2.571 8.584 1.00 0.00 C ATOM 1302 O ALA A 91 39.333 -3.683 9.039 1.00 0.00 O ATOM 1303 CB ALA A 91 41.091 -3.624 6.891 1.00 0.00 C ATOM 0 H ALA A 91 42.521 -2.845 8.864 1.00 0.00 H new ATOM 0 HA ALA A 91 40.660 -1.520 7.033 1.00 0.00 H new ATOM 0 HB1 ALA A 91 40.215 -3.848 6.282 1.00 0.00 H new ATOM 0 HB2 ALA A 91 41.954 -3.470 6.243 1.00 0.00 H new ATOM 0 HB3 ALA A 91 41.287 -4.458 7.564 1.00 0.00 H new ATOM 1309 N ALA A 92 38.858 -1.492 8.813 1.00 0.00 N ATOM 1310 CA ALA A 92 37.652 -1.566 9.637 1.00 0.00 C ATOM 1311 C ALA A 92 37.997 -2.024 11.051 1.00 0.00 C ATOM 1312 O ALA A 92 39.089 -2.534 11.304 1.00 0.00 O ATOM 1313 CB ALA A 92 36.642 -2.543 9.027 1.00 0.00 C ATOM 0 H ALA A 92 39.065 -0.564 8.444 1.00 0.00 H new ATOM 0 HA ALA A 92 37.212 -0.569 9.676 1.00 0.00 H new ATOM 0 HB1 ALA A 92 35.751 -2.584 9.654 1.00 0.00 H new ATOM 0 HB2 ALA A 92 36.367 -2.205 8.028 1.00 0.00 H new ATOM 0 HB3 ALA A 92 37.088 -3.536 8.964 1.00 0.00 H new ATOM 1319 N ARG A 93 37.054 -1.837 11.968 1.00 0.00 N ATOM 1320 CA ARG A 93 37.266 -2.235 13.359 1.00 0.00 C ATOM 1321 C ARG A 93 37.437 -3.748 13.465 1.00 0.00 C ATOM 1322 O ARG A 93 38.143 -4.245 14.341 1.00 0.00 O ATOM 1323 CB ARG A 93 36.086 -1.800 14.235 1.00 0.00 C ATOM 1324 CG ARG A 93 34.770 -2.256 13.598 1.00 0.00 C ATOM 1325 CD ARG A 93 33.673 -2.296 14.664 1.00 0.00 C ATOM 1326 NE ARG A 93 33.541 -0.991 15.319 1.00 0.00 N ATOM 1327 CZ ARG A 93 32.899 0.034 14.742 1.00 0.00 C ATOM 1328 NH1 ARG A 93 32.357 -0.085 13.553 1.00 0.00 N ATOM 1329 NH2 ARG A 93 32.812 1.171 15.374 1.00 0.00 N ATOM 0 H ARG A 93 36.144 -1.417 11.779 1.00 0.00 H new ATOM 0 HA ARG A 93 38.173 -1.743 13.710 1.00 0.00 H new ATOM 0 HB2 ARG A 93 36.185 -2.228 15.233 1.00 0.00 H new ATOM 0 HB3 ARG A 93 36.088 -0.716 14.351 1.00 0.00 H new ATOM 0 HG2 ARG A 93 34.487 -1.575 12.795 1.00 0.00 H new ATOM 0 HG3 ARG A 93 34.893 -3.242 13.151 1.00 0.00 H new ATOM 0 HD2 ARG A 93 32.724 -2.577 14.207 1.00 0.00 H new ATOM 0 HD3 ARG A 93 33.907 -3.059 15.406 1.00 0.00 H new ATOM 0 HE ARG A 93 33.951 -0.859 16.244 1.00 0.00 H new ATOM 0 HH11 ARG A 93 32.420 -0.970 13.050 1.00 0.00 H new ATOM 0 HH12 ARG A 93 31.873 0.708 13.132 1.00 0.00 H new ATOM 0 HH21 ARG A 93 33.230 1.274 16.299 1.00 0.00 H new ATOM 0 HH22 ARG A 93 32.326 1.958 14.944 1.00 0.00 H new ATOM 1343 N ASP A 94 36.783 -4.475 12.561 1.00 0.00 N ATOM 1344 CA ASP A 94 36.868 -5.935 12.560 1.00 0.00 C ATOM 1345 C ASP A 94 36.356 -6.503 13.880 1.00 0.00 C ATOM 1346 O ASP A 94 37.046 -6.467 14.898 1.00 0.00 O ATOM 1347 CB ASP A 94 38.316 -6.388 12.352 1.00 0.00 C ATOM 1348 CG ASP A 94 38.634 -6.404 10.861 1.00 0.00 C ATOM 1349 OD1 ASP A 94 37.812 -6.897 10.105 1.00 0.00 O ATOM 1350 OD2 ASP A 94 39.695 -5.926 10.497 1.00 0.00 O ATOM 0 H ASP A 94 36.194 -4.083 11.827 1.00 0.00 H new ATOM 0 HA ASP A 94 36.250 -6.305 11.742 1.00 0.00 H new ATOM 0 HB2 ASP A 94 38.997 -5.715 12.873 1.00 0.00 H new ATOM 0 HB3 ASP A 94 38.462 -7.381 12.777 1.00 0.00 H new ATOM 1355 N LYS A 95 35.134 -7.028 13.850 1.00 0.00 N ATOM 1356 CA LYS A 95 34.532 -7.603 15.050 1.00 0.00 C ATOM 1357 C LYS A 95 35.341 -8.805 15.526 1.00 0.00 C ATOM 1358 O LYS A 95 35.667 -9.641 14.699 1.00 0.00 O ATOM 1359 CB LYS A 95 33.096 -8.047 14.769 1.00 0.00 C ATOM 1360 CG LYS A 95 32.276 -6.851 14.284 1.00 0.00 C ATOM 1361 CD LYS A 95 31.139 -7.341 13.385 1.00 0.00 C ATOM 1362 CE LYS A 95 30.743 -6.231 12.411 1.00 0.00 C ATOM 1363 NZ LYS A 95 30.325 -6.834 11.114 1.00 0.00 N ATOM 1364 OXT LYS A 95 35.623 -8.873 16.712 1.00 0.00 O ATOM 0 H LYS A 95 34.546 -7.067 13.017 1.00 0.00 H new ATOM 0 HA LYS A 95 34.528 -6.837 15.825 1.00 0.00 H new ATOM 0 HB2 LYS A 95 33.089 -8.835 14.016 1.00 0.00 H new ATOM 0 HB3 LYS A 95 32.650 -8.465 15.672 1.00 0.00 H new ATOM 0 HG2 LYS A 95 31.870 -6.305 15.136 1.00 0.00 H new ATOM 0 HG3 LYS A 95 32.914 -6.158 13.736 1.00 0.00 H new ATOM 0 HD2 LYS A 95 31.453 -8.227 12.834 1.00 0.00 H new ATOM 0 HD3 LYS A 95 30.281 -7.630 13.991 1.00 0.00 H new ATOM 0 HE2 LYS A 95 29.928 -5.640 12.829 1.00 0.00 H new ATOM 0 HE3 LYS A 95 31.582 -5.553 12.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 30.056 -6.079 10.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 31.115 -7.380 10.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 29.512 -7.464 11.270 1.00 0.00 H new TER 1378 LYS A 95