USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 949 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 87 SER OG : rot -86:sc= 1.2 USER MOD Set 1.2: A 90 GLN : amide:sc= 1.01 K(o=2.2,f=-4.8!) USER MOD Single : A 3 THR OG1 : rot -23:sc= 0.488 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 58:sc= 0.363 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -1.16 K(o=-1.2,f=-2.1) USER MOD Single : A 28 THR OG1 : rot 153:sc= -2.03 USER MOD Single : A 30 LYS NZ :NH3+ -139:sc= 0.445 (180deg=0) USER MOD Single : A 31 TYR OH : rot 104:sc= 0.3 USER MOD Single : A 34 SER OG : rot 67:sc= 0.469 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0468 USER MOD Single : A 41 GLN : amide:sc= -2.9 K(o=-2.9,f=-1.8) USER MOD Single : A 45 TYR OH : rot -77:sc= -1.56! USER MOD Single : A 46 GLN : amide:sc= -0.136 K(o=-0.14,f=-0.9) USER MOD Single : A 47 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.34) USER MOD Single : A 50 GLN : amide:sc= -0.484 X(o=-0.48,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.12) USER MOD Single : A 52 CYS SG : rot 49:sc= -2.21 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0486 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -97:sc= 0.333 USER MOD Single : A 85 ASN : amide:sc= -0.232 X(o=-0.23,f=-0.00071) USER MOD Single : A 93 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0127) USER MOD Single : A 94 THR OG1 : rot 61:sc= 1.43 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.024 USER MOD Single : A 98 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.321) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0202) USER MOD Single : A 106 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.061) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -145:sc= 0.0185 (180deg=-0.1) USER MOD Single : A 115 SER OG : rot 27:sc= 0.882 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0.894 K(o=0.89,f=-0.057) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -165:sc= -0.022 (180deg=-0.209) USER MOD ----------------------------------------------------------------- ATOM 13 N THR A 3 -3.296 -17.213 -10.404 1.00 0.00 N ATOM 14 CA THR A 3 -3.521 -16.043 -9.557 1.00 0.00 C ATOM 15 C THR A 3 -4.761 -15.279 -10.012 1.00 0.00 C ATOM 16 O THR A 3 -4.778 -14.696 -11.098 1.00 0.00 O ATOM 17 CB THR A 3 -2.299 -15.117 -9.576 1.00 0.00 C ATOM 18 OG1 THR A 3 -1.660 -15.143 -10.845 1.00 0.00 O ATOM 19 CG2 THR A 3 -1.265 -15.472 -8.527 1.00 0.00 C ATOM 0 HA THR A 3 -3.679 -16.392 -8.537 1.00 0.00 H new ATOM 0 HB THR A 3 -2.688 -14.123 -9.357 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.882 -15.979 -11.306 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.426 -14.779 -8.594 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.714 -15.404 -7.536 1.00 0.00 H new ATOM 0 HG23 THR A 3 -0.910 -16.489 -8.696 1.00 0.00 H new ATOM 27 N LYS A 4 -5.799 -15.289 -9.178 1.00 0.00 N ATOM 28 CA LYS A 4 -7.044 -14.598 -9.498 1.00 0.00 C ATOM 29 C LYS A 4 -7.263 -13.403 -8.575 1.00 0.00 C ATOM 30 O LYS A 4 -6.909 -13.444 -7.394 1.00 0.00 O ATOM 31 CB LYS A 4 -8.230 -15.562 -9.395 1.00 0.00 C ATOM 32 CG LYS A 4 -8.733 -16.058 -10.743 1.00 0.00 C ATOM 33 CD LYS A 4 -10.245 -15.932 -10.856 1.00 0.00 C ATOM 34 CE LYS A 4 -10.781 -16.694 -12.059 1.00 0.00 C ATOM 35 NZ LYS A 4 -10.992 -18.137 -11.758 1.00 0.00 N ATOM 0 H LYS A 4 -5.802 -15.768 -8.277 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.970 -14.231 -10.522 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.939 -16.419 -8.788 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.047 -15.064 -8.873 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.259 -15.487 -11.542 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.443 -17.100 -10.880 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -10.711 -16.311 -9.947 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -10.518 -14.880 -10.939 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -11.723 -16.249 -12.379 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.083 -16.596 -12.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.358 -18.618 -12.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.088 -18.569 -11.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.678 -18.233 -10.982 1.00 0.00 H new ATOM 49 N ILE A 5 -7.854 -12.342 -9.120 1.00 0.00 N ATOM 50 CA ILE A 5 -8.128 -11.134 -8.353 1.00 0.00 C ATOM 51 C ILE A 5 -9.629 -10.962 -8.131 1.00 0.00 C ATOM 52 O ILE A 5 -10.414 -10.997 -9.083 1.00 0.00 O ATOM 53 CB ILE A 5 -7.563 -9.875 -9.054 1.00 0.00 C ATOM 54 CG1 ILE A 5 -7.778 -8.637 -8.180 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.203 -9.681 -10.424 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.897 -7.468 -8.562 1.00 0.00 C ATOM 0 H ILE A 5 -8.153 -12.297 -10.094 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.631 -11.246 -7.389 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.492 -10.017 -9.199 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.822 -8.332 -8.247 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.589 -8.900 -7.139 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.789 -8.790 -10.896 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.998 -10.551 -11.048 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.281 -9.563 -10.309 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.103 -6.626 -7.901 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.850 -7.756 -8.468 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.103 -7.179 -9.593 1.00 0.00 H new ATOM 68 N ASP A 6 -10.022 -10.777 -6.874 1.00 0.00 N ATOM 69 CA ASP A 6 -11.429 -10.598 -6.536 1.00 0.00 C ATOM 70 C ASP A 6 -11.823 -9.129 -6.640 1.00 0.00 C ATOM 71 O ASP A 6 -11.318 -8.284 -5.897 1.00 0.00 O ATOM 72 CB ASP A 6 -11.714 -11.125 -5.128 1.00 0.00 C ATOM 73 CG ASP A 6 -13.134 -11.643 -4.976 1.00 0.00 C ATOM 74 OD1 ASP A 6 -13.671 -12.212 -5.950 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.705 -11.484 -3.878 1.00 0.00 O ATOM 0 H ASP A 6 -9.388 -10.747 -6.076 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.026 -11.168 -7.248 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.012 -11.925 -4.894 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.542 -10.329 -4.404 1.00 0.00 H new ATOM 80 N LYS A 7 -12.724 -8.833 -7.574 1.00 0.00 N ATOM 81 CA LYS A 7 -13.188 -7.463 -7.790 1.00 0.00 C ATOM 82 C LYS A 7 -14.070 -6.988 -6.637 1.00 0.00 C ATOM 83 O LYS A 7 -13.909 -5.870 -6.146 1.00 0.00 O ATOM 84 CB LYS A 7 -13.953 -7.363 -9.112 1.00 0.00 C ATOM 85 CG LYS A 7 -13.070 -7.024 -10.303 1.00 0.00 C ATOM 86 CD LYS A 7 -13.283 -7.999 -11.451 1.00 0.00 C ATOM 87 CE LYS A 7 -12.290 -7.759 -12.578 1.00 0.00 C ATOM 88 NZ LYS A 7 -10.989 -8.439 -12.327 1.00 0.00 N ATOM 0 H LYS A 7 -13.148 -9.523 -8.194 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.311 -6.817 -7.835 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.458 -8.310 -9.303 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.728 -6.602 -9.017 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.286 -6.010 -10.640 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.024 -7.042 -9.998 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.180 -9.021 -11.086 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.299 -7.897 -11.832 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -12.712 -8.118 -13.516 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -12.123 -6.688 -12.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -10.341 -8.251 -13.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.573 -8.078 -11.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.144 -9.464 -12.243 1.00 0.00 H new ATOM 102 N GLU A 8 -15.001 -7.842 -6.212 1.00 0.00 N ATOM 103 CA GLU A 8 -15.912 -7.512 -5.121 1.00 0.00 C ATOM 104 C GLU A 8 -15.146 -7.205 -3.833 1.00 0.00 C ATOM 105 O GLU A 8 -15.475 -6.252 -3.123 1.00 0.00 O ATOM 106 CB GLU A 8 -16.897 -8.662 -4.888 1.00 0.00 C ATOM 107 CG GLU A 8 -16.248 -10.038 -4.857 1.00 0.00 C ATOM 108 CD GLU A 8 -16.592 -10.874 -6.074 1.00 0.00 C ATOM 109 OE1 GLU A 8 -16.079 -10.564 -7.171 1.00 0.00 O ATOM 110 OE2 GLU A 8 -17.373 -11.837 -5.930 1.00 0.00 O ATOM 0 H GLU A 8 -15.143 -8.770 -6.610 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.467 -6.618 -5.405 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -17.417 -8.496 -3.944 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.651 -8.645 -5.675 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -15.166 -9.924 -4.794 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -16.566 -10.565 -3.957 1.00 0.00 H new ATOM 117 N ALA A 9 -14.125 -8.011 -3.538 1.00 0.00 N ATOM 118 CA ALA A 9 -13.318 -7.813 -2.337 1.00 0.00 C ATOM 119 C ALA A 9 -12.518 -6.519 -2.427 1.00 0.00 C ATOM 120 O ALA A 9 -12.627 -5.652 -1.558 1.00 0.00 O ATOM 121 CB ALA A 9 -12.390 -8.998 -2.115 1.00 0.00 C ATOM 0 H ALA A 9 -13.839 -8.804 -4.113 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.993 -7.737 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.797 -8.832 -1.216 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.981 -9.906 -1.997 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.726 -9.106 -2.973 1.00 0.00 H new ATOM 127 N CYS A 10 -11.720 -6.394 -3.487 1.00 0.00 N ATOM 128 CA CYS A 10 -10.902 -5.203 -3.701 1.00 0.00 C ATOM 129 C CYS A 10 -11.766 -3.941 -3.700 1.00 0.00 C ATOM 130 O CYS A 10 -11.396 -2.929 -3.103 1.00 0.00 O ATOM 131 CB CYS A 10 -10.142 -5.318 -5.025 1.00 0.00 C ATOM 132 SG CYS A 10 -8.991 -3.960 -5.339 1.00 0.00 S ATOM 0 H CYS A 10 -11.623 -7.105 -4.212 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.186 -5.128 -2.883 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -9.589 -6.257 -5.033 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.862 -5.365 -5.842 1.00 0.00 H new ATOM 0 HG CYS A 10 -8.122 -3.895 -4.374 1.00 0.00 H new ATOM 138 N ARG A 11 -12.919 -4.016 -4.367 1.00 0.00 N ATOM 139 CA ARG A 11 -13.844 -2.887 -4.442 1.00 0.00 C ATOM 140 C ARG A 11 -14.372 -2.523 -3.055 1.00 0.00 C ATOM 141 O ARG A 11 -14.419 -1.345 -2.696 1.00 0.00 O ATOM 142 CB ARG A 11 -15.007 -3.215 -5.383 1.00 0.00 C ATOM 143 CG ARG A 11 -15.868 -2.011 -5.738 1.00 0.00 C ATOM 144 CD ARG A 11 -16.041 -1.867 -7.244 1.00 0.00 C ATOM 145 NE ARG A 11 -15.540 -0.582 -7.733 1.00 0.00 N ATOM 146 CZ ARG A 11 -14.255 -0.329 -7.998 1.00 0.00 C ATOM 147 NH1 ARG A 11 -13.331 -1.269 -7.818 1.00 0.00 N ATOM 148 NH2 ARG A 11 -13.894 0.870 -8.442 1.00 0.00 N ATOM 0 H ARG A 11 -13.234 -4.849 -4.864 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.302 -2.028 -4.838 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.609 -3.648 -6.300 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.635 -3.975 -4.918 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -16.846 -2.111 -5.267 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -15.412 -1.106 -5.336 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -15.514 -2.677 -7.748 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.096 -1.965 -7.499 1.00 0.00 H new ATOM 0 HE ARG A 11 -16.215 0.168 -7.881 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.601 -2.191 -7.475 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -12.352 -1.068 -8.023 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -14.597 1.596 -8.580 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -12.914 1.065 -8.645 1.00 0.00 H new ATOM 162 N ALA A 12 -14.760 -3.539 -2.279 1.00 0.00 N ATOM 163 CA ALA A 12 -15.276 -3.324 -0.926 1.00 0.00 C ATOM 164 C ALA A 12 -14.307 -2.487 -0.097 1.00 0.00 C ATOM 165 O ALA A 12 -14.710 -1.531 0.567 1.00 0.00 O ATOM 166 CB ALA A 12 -15.545 -4.656 -0.239 1.00 0.00 C ATOM 0 H ALA A 12 -14.726 -4.517 -2.565 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.215 -2.776 -1.008 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -15.928 -4.476 0.766 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.281 -5.219 -0.813 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.619 -5.227 -0.177 1.00 0.00 H new ATOM 172 N ALA A 13 -13.026 -2.848 -0.147 1.00 0.00 N ATOM 173 CA ALA A 13 -11.994 -2.128 0.594 1.00 0.00 C ATOM 174 C ALA A 13 -11.784 -0.724 0.031 1.00 0.00 C ATOM 175 O ALA A 13 -11.459 0.202 0.773 1.00 0.00 O ATOM 176 CB ALA A 13 -10.687 -2.908 0.575 1.00 0.00 C ATOM 0 H ALA A 13 -12.678 -3.636 -0.694 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.330 -2.028 1.626 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -9.927 -2.359 1.131 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -10.839 -3.884 1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.357 -3.040 -0.455 1.00 0.00 H new ATOM 182 N TYR A 14 -11.968 -0.572 -1.282 1.00 0.00 N ATOM 183 CA TYR A 14 -11.792 0.719 -1.944 1.00 0.00 C ATOM 184 C TYR A 14 -12.761 1.767 -1.394 1.00 0.00 C ATOM 185 O TYR A 14 -12.342 2.832 -0.939 1.00 0.00 O ATOM 186 CB TYR A 14 -11.991 0.578 -3.457 1.00 0.00 C ATOM 187 CG TYR A 14 -11.340 1.685 -4.259 1.00 0.00 C ATOM 188 CD1 TYR A 14 -11.732 3.009 -4.098 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.327 1.408 -5.170 1.00 0.00 C ATOM 190 CE1 TYR A 14 -11.137 4.023 -4.821 1.00 0.00 C ATOM 191 CE2 TYR A 14 -9.725 2.420 -5.895 1.00 0.00 C ATOM 192 CZ TYR A 14 -10.133 3.724 -5.717 1.00 0.00 C ATOM 193 OH TYR A 14 -9.533 4.732 -6.433 1.00 0.00 O ATOM 0 H TYR A 14 -12.240 -1.330 -1.908 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.774 1.053 -1.743 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.586 -0.381 -3.781 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.059 0.562 -3.675 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -12.516 3.248 -3.395 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -10.005 0.387 -5.314 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.456 5.046 -4.685 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -8.938 2.189 -6.598 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.845 4.352 -7.019 1.00 0.00 H new ATOM 203 N ASN A 15 -14.057 1.465 -1.452 1.00 0.00 N ATOM 204 CA ASN A 15 -15.082 2.385 -0.974 1.00 0.00 C ATOM 205 C ASN A 15 -15.045 2.541 0.549 1.00 0.00 C ATOM 206 O ASN A 15 -15.492 3.558 1.082 1.00 0.00 O ATOM 207 CB ASN A 15 -16.469 1.914 -1.422 1.00 0.00 C ATOM 208 CG ASN A 15 -16.751 0.465 -1.068 1.00 0.00 C ATOM 209 OD1 ASN A 15 -16.817 0.102 0.106 1.00 0.00 O ATOM 210 ND2 ASN A 15 -16.924 -0.370 -2.087 1.00 0.00 N ATOM 0 H ASN A 15 -14.420 0.588 -1.826 1.00 0.00 H new ATOM 0 HA ASN A 15 -14.874 3.362 -1.411 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.227 2.548 -0.962 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -16.558 2.042 -2.501 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.120 -1.355 -1.911 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.861 -0.026 -3.045 1.00 0.00 H new ATOM 217 N LEU A 16 -14.516 1.533 1.244 1.00 0.00 N ATOM 218 CA LEU A 16 -14.431 1.567 2.702 1.00 0.00 C ATOM 219 C LEU A 16 -13.211 2.360 3.175 1.00 0.00 C ATOM 220 O LEU A 16 -13.287 3.100 4.157 1.00 0.00 O ATOM 221 CB LEU A 16 -14.379 0.144 3.262 1.00 0.00 C ATOM 222 CG LEU A 16 -14.818 0.004 4.720 1.00 0.00 C ATOM 223 CD1 LEU A 16 -16.324 -0.183 4.805 1.00 0.00 C ATOM 224 CD2 LEU A 16 -14.099 -1.161 5.381 1.00 0.00 C ATOM 0 H LEU A 16 -14.141 0.685 0.820 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.324 2.069 3.075 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -15.011 -0.496 2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.359 -0.230 3.168 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.553 0.919 5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -16.620 -0.281 5.849 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.823 0.681 4.366 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -16.610 -1.083 4.261 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -14.423 -1.247 6.418 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.335 -2.083 4.850 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -13.023 -0.989 5.350 1.00 0.00 H new ATOM 236 N VAL A 17 -12.087 2.198 2.475 1.00 0.00 N ATOM 237 CA VAL A 17 -10.853 2.897 2.830 1.00 0.00 C ATOM 238 C VAL A 17 -10.941 4.389 2.500 1.00 0.00 C ATOM 239 O VAL A 17 -10.362 5.220 3.201 1.00 0.00 O ATOM 240 CB VAL A 17 -9.628 2.281 2.115 1.00 0.00 C ATOM 241 CG1 VAL A 17 -9.635 2.611 0.629 1.00 0.00 C ATOM 242 CG2 VAL A 17 -8.335 2.751 2.765 1.00 0.00 C ATOM 0 H VAL A 17 -12.007 1.590 1.660 1.00 0.00 H new ATOM 0 HA VAL A 17 -10.725 2.782 3.906 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.690 1.198 2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.762 2.165 0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.541 2.213 0.172 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.607 3.693 0.496 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -7.485 2.306 2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -8.270 3.837 2.702 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -8.322 2.446 3.812 1.00 0.00 H new ATOM 252 N ARG A 18 -11.669 4.722 1.433 1.00 0.00 N ATOM 253 CA ARG A 18 -11.830 6.114 1.022 1.00 0.00 C ATOM 254 C ARG A 18 -12.655 6.900 2.042 1.00 0.00 C ATOM 255 O ARG A 18 -12.538 8.124 2.125 1.00 0.00 O ATOM 256 CB ARG A 18 -12.488 6.195 -0.358 1.00 0.00 C ATOM 257 CG ARG A 18 -12.067 7.419 -1.153 1.00 0.00 C ATOM 258 CD ARG A 18 -12.394 7.270 -2.629 1.00 0.00 C ATOM 259 NE ARG A 18 -11.805 8.345 -3.427 1.00 0.00 N ATOM 260 CZ ARG A 18 -12.147 8.617 -4.688 1.00 0.00 C ATOM 261 NH1 ARG A 18 -13.078 7.896 -5.307 1.00 0.00 N ATOM 262 NH2 ARG A 18 -11.557 9.616 -5.334 1.00 0.00 N ATOM 0 H ARG A 18 -12.154 4.048 0.841 1.00 0.00 H new ATOM 0 HA ARG A 18 -10.837 6.561 0.968 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -12.238 5.298 -0.925 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -13.571 6.204 -0.237 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.569 8.301 -0.756 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -10.996 7.581 -1.032 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -12.027 6.308 -2.987 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -13.476 7.268 -2.763 1.00 0.00 H new ATOM 0 HE ARG A 18 -11.087 8.924 -2.992 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -13.537 7.128 -4.818 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.333 8.111 -6.271 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -10.843 10.175 -4.866 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -11.818 9.825 -6.298 1.00 0.00 H new ATOM 276 N ASP A 19 -13.484 6.194 2.816 1.00 0.00 N ATOM 277 CA ASP A 19 -14.315 6.836 3.830 1.00 0.00 C ATOM 278 C ASP A 19 -13.448 7.451 4.924 1.00 0.00 C ATOM 279 O ASP A 19 -12.994 6.755 5.837 1.00 0.00 O ATOM 280 CB ASP A 19 -15.296 5.828 4.441 1.00 0.00 C ATOM 281 CG ASP A 19 -16.342 6.498 5.310 1.00 0.00 C ATOM 282 OD1 ASP A 19 -17.352 6.981 4.757 1.00 0.00 O ATOM 283 OD2 ASP A 19 -16.151 6.542 6.543 1.00 0.00 O ATOM 0 H ASP A 19 -13.595 5.182 2.758 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.885 7.630 3.348 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -15.790 5.275 3.642 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.743 5.101 5.036 1.00 0.00 H new ATOM 318 N ALA A 23 -12.177 5.317 10.833 1.00 0.00 N ATOM 319 CA ALA A 23 -10.755 5.144 11.109 1.00 0.00 C ATOM 320 C ALA A 23 -10.152 4.095 10.175 1.00 0.00 C ATOM 321 O ALA A 23 -9.664 3.054 10.621 1.00 0.00 O ATOM 322 CB ALA A 23 -10.543 4.756 12.567 1.00 0.00 C ATOM 0 HA ALA A 23 -10.247 6.091 10.928 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.477 4.630 12.759 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -10.938 5.540 13.213 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.062 3.820 12.774 1.00 0.00 H new ATOM 328 N VAL A 24 -10.202 4.375 8.873 1.00 0.00 N ATOM 329 CA VAL A 24 -9.675 3.459 7.866 1.00 0.00 C ATOM 330 C VAL A 24 -8.895 4.212 6.788 1.00 0.00 C ATOM 331 O VAL A 24 -9.471 4.979 6.016 1.00 0.00 O ATOM 332 CB VAL A 24 -10.811 2.655 7.197 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.245 1.643 6.214 1.00 0.00 C ATOM 334 CG2 VAL A 24 -11.670 1.962 8.246 1.00 0.00 C ATOM 0 H VAL A 24 -10.604 5.232 8.492 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.003 2.772 8.380 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.442 3.352 6.645 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.062 1.087 5.754 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.679 2.163 5.441 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.588 0.952 6.741 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.464 1.401 7.753 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.052 1.279 8.829 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.110 2.709 8.907 1.00 0.00 H new ATOM 344 N ILE A 25 -7.581 3.988 6.742 1.00 0.00 N ATOM 345 CA ILE A 25 -6.725 4.646 5.754 1.00 0.00 C ATOM 346 C ILE A 25 -5.910 3.637 4.939 1.00 0.00 C ATOM 347 O ILE A 25 -5.609 3.883 3.770 1.00 0.00 O ATOM 348 CB ILE A 25 -5.758 5.657 6.412 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.810 4.949 7.385 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.536 6.753 7.125 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.372 4.919 6.915 1.00 0.00 C ATOM 0 H ILE A 25 -7.088 3.358 7.375 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.399 5.181 5.085 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.158 6.116 5.626 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.857 5.448 8.353 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.155 3.926 7.537 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.839 7.455 7.582 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.163 7.280 6.406 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.164 6.310 7.898 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -2.759 4.403 7.653 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.312 4.394 5.962 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.008 5.939 6.791 1.00 0.00 H new ATOM 363 N TRP A 26 -5.550 2.509 5.555 1.00 0.00 N ATOM 364 CA TRP A 26 -4.768 1.481 4.874 1.00 0.00 C ATOM 365 C TRP A 26 -5.487 0.134 4.886 1.00 0.00 C ATOM 366 O TRP A 26 -6.360 -0.112 5.720 1.00 0.00 O ATOM 367 CB TRP A 26 -3.382 1.338 5.520 1.00 0.00 C ATOM 368 CG TRP A 26 -3.421 0.861 6.945 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.221 1.617 8.062 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.673 -0.475 7.405 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.337 0.837 9.185 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.615 -0.448 8.811 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.944 -1.691 6.770 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.820 -1.584 9.588 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.147 -2.818 7.543 1.00 0.00 C ATOM 376 CH2 TRP A 26 -4.084 -2.757 8.938 1.00 0.00 C ATOM 0 H TRP A 26 -5.788 2.287 6.522 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.648 1.795 3.837 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.787 0.641 4.930 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -2.874 2.301 5.483 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.003 2.675 8.063 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.232 1.164 10.146 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -3.994 -1.748 5.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.772 -1.540 10.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.358 -3.761 7.062 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.247 -3.656 9.514 1.00 0.00 H new ATOM 387 N VAL A 27 -5.095 -0.739 3.963 1.00 0.00 N ATOM 388 CA VAL A 27 -5.674 -2.076 3.862 1.00 0.00 C ATOM 389 C VAL A 27 -4.578 -3.106 3.597 1.00 0.00 C ATOM 390 O VAL A 27 -3.603 -2.809 2.903 1.00 0.00 O ATOM 391 CB VAL A 27 -6.734 -2.159 2.743 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.013 -1.454 3.167 1.00 0.00 C ATOM 393 CG2 VAL A 27 -6.199 -1.571 1.444 1.00 0.00 C ATOM 0 H VAL A 27 -4.373 -0.543 3.269 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.164 -2.290 4.812 1.00 0.00 H new ATOM 0 HB VAL A 27 -6.963 -3.210 2.568 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.749 -1.523 2.366 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -8.409 -1.928 4.065 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.799 -0.406 3.374 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -6.964 -1.641 0.671 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.935 -0.525 1.600 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.315 -2.126 1.131 1.00 0.00 H new ATOM 403 N THR A 28 -4.722 -4.310 4.153 1.00 0.00 N ATOM 404 CA THR A 28 -3.707 -5.351 3.959 1.00 0.00 C ATOM 405 C THR A 28 -4.166 -6.401 2.950 1.00 0.00 C ATOM 406 O THR A 28 -4.888 -7.334 3.298 1.00 0.00 O ATOM 407 CB THR A 28 -3.354 -6.023 5.289 1.00 0.00 C ATOM 408 OG1 THR A 28 -4.500 -6.151 6.108 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.304 -5.272 6.082 1.00 0.00 C ATOM 0 H THR A 28 -5.515 -4.587 4.731 1.00 0.00 H new ATOM 0 HA THR A 28 -2.816 -4.864 3.562 1.00 0.00 H new ATOM 0 HB THR A 28 -2.952 -6.999 5.018 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.390 -6.919 6.707 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.102 -5.803 7.012 1.00 0.00 H new ATOM 0 HG22 THR A 28 -1.387 -5.202 5.497 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.667 -4.269 6.308 1.00 0.00 H new ATOM 417 N PHE A 29 -3.737 -6.248 1.700 1.00 0.00 N ATOM 418 CA PHE A 29 -4.108 -7.187 0.642 1.00 0.00 C ATOM 419 C PHE A 29 -3.272 -8.458 0.724 1.00 0.00 C ATOM 420 O PHE A 29 -2.068 -8.443 0.461 1.00 0.00 O ATOM 421 CB PHE A 29 -3.932 -6.539 -0.733 1.00 0.00 C ATOM 422 CG PHE A 29 -5.143 -5.791 -1.209 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.524 -4.603 -0.603 1.00 0.00 C ATOM 424 CD2 PHE A 29 -5.901 -6.273 -2.263 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.638 -3.913 -1.041 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.015 -5.588 -2.705 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.384 -4.406 -2.094 1.00 0.00 C ATOM 0 H PHE A 29 -3.133 -5.485 1.394 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.156 -7.451 0.781 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.085 -5.854 -0.696 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.685 -7.313 -1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.944 -4.213 0.220 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.617 -7.197 -2.745 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.925 -2.989 -0.561 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.597 -5.976 -3.528 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.255 -3.868 -2.439 1.00 0.00 H new ATOM 437 N LYS A 30 -3.922 -9.558 1.096 1.00 0.00 N ATOM 438 CA LYS A 30 -3.249 -10.847 1.223 1.00 0.00 C ATOM 439 C LYS A 30 -3.961 -11.927 0.412 1.00 0.00 C ATOM 440 O LYS A 30 -5.021 -11.687 -0.171 1.00 0.00 O ATOM 441 CB LYS A 30 -3.183 -11.261 2.696 1.00 0.00 C ATOM 442 CG LYS A 30 -4.548 -11.385 3.359 1.00 0.00 C ATOM 443 CD LYS A 30 -4.458 -11.201 4.865 1.00 0.00 C ATOM 444 CE LYS A 30 -5.610 -10.364 5.397 1.00 0.00 C ATOM 445 NZ LYS A 30 -5.915 -10.675 6.823 1.00 0.00 N ATOM 0 H LYS A 30 -4.918 -9.582 1.315 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.238 -10.739 0.830 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.664 -12.216 2.773 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.588 -10.530 3.243 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.225 -10.640 2.941 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.974 -12.363 3.136 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -4.461 -12.176 5.352 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.512 -10.721 5.118 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -5.364 -9.306 5.301 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.498 -10.541 4.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.946 -10.699 6.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.511 -11.601 7.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.501 -9.942 7.434 1.00 0.00 H new ATOM 459 N TYR A 31 -3.371 -13.121 0.383 1.00 0.00 N ATOM 460 CA TYR A 31 -3.947 -14.244 -0.350 1.00 0.00 C ATOM 461 C TYR A 31 -5.030 -14.933 0.474 1.00 0.00 C ATOM 462 O TYR A 31 -4.801 -15.311 1.624 1.00 0.00 O ATOM 463 CB TYR A 31 -2.865 -15.261 -0.718 1.00 0.00 C ATOM 464 CG TYR A 31 -2.175 -14.976 -2.032 1.00 0.00 C ATOM 465 CD1 TYR A 31 -2.772 -15.316 -3.241 1.00 0.00 C ATOM 466 CD2 TYR A 31 -0.925 -14.373 -2.065 1.00 0.00 C ATOM 467 CE1 TYR A 31 -2.141 -15.061 -4.444 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.288 -14.116 -3.263 1.00 0.00 C ATOM 469 CZ TYR A 31 -0.901 -14.461 -4.449 1.00 0.00 C ATOM 470 OH TYR A 31 -0.269 -14.208 -5.643 1.00 0.00 O ATOM 0 H TYR A 31 -2.494 -13.334 0.859 1.00 0.00 H new ATOM 0 HA TYR A 31 -4.393 -13.849 -1.263 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.118 -15.284 0.075 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.314 -16.253 -0.763 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.744 -15.787 -3.240 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -0.443 -14.100 -1.138 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -2.617 -15.331 -5.375 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.685 -13.647 -3.271 1.00 0.00 H new ATOM 0 HH TYR A 31 -0.338 -13.253 -5.854 1.00 0.00 H new ATOM 480 N ASP A 32 -6.203 -15.108 -0.128 1.00 0.00 N ATOM 481 CA ASP A 32 -7.315 -15.769 0.541 1.00 0.00 C ATOM 482 C ASP A 32 -7.360 -17.244 0.150 1.00 0.00 C ATOM 483 O ASP A 32 -8.258 -17.683 -0.574 1.00 0.00 O ATOM 484 CB ASP A 32 -8.635 -15.079 0.190 1.00 0.00 C ATOM 485 CG ASP A 32 -9.629 -15.119 1.335 1.00 0.00 C ATOM 486 OD1 ASP A 32 -9.529 -14.260 2.236 1.00 0.00 O ATOM 487 OD2 ASP A 32 -10.501 -16.012 1.331 1.00 0.00 O ATOM 0 H ASP A 32 -6.406 -14.800 -1.079 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.168 -15.699 1.619 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.439 -14.042 -0.082 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.072 -15.560 -0.685 1.00 0.00 H new ATOM 492 N GLY A 33 -6.364 -17.999 0.615 1.00 0.00 N ATOM 493 CA GLY A 33 -6.284 -19.415 0.298 1.00 0.00 C ATOM 494 C GLY A 33 -5.769 -19.689 -1.110 1.00 0.00 C ATOM 495 O GLY A 33 -5.411 -20.825 -1.427 1.00 0.00 O ATOM 0 H GLY A 33 -5.610 -17.652 1.207 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.629 -19.905 1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -7.272 -19.862 0.409 1.00 0.00 H new ATOM 499 N SER A 34 -5.731 -18.650 -1.956 1.00 0.00 N ATOM 500 CA SER A 34 -5.262 -18.780 -3.336 1.00 0.00 C ATOM 501 C SER A 34 -5.566 -17.515 -4.143 1.00 0.00 C ATOM 502 O SER A 34 -4.813 -17.159 -5.051 1.00 0.00 O ATOM 503 CB SER A 34 -5.911 -19.990 -4.018 1.00 0.00 C ATOM 504 OG SER A 34 -4.994 -21.065 -4.138 1.00 0.00 O ATOM 0 H SER A 34 -6.022 -17.706 -1.703 1.00 0.00 H new ATOM 0 HA SER A 34 -4.182 -18.924 -3.303 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.779 -20.312 -3.443 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.271 -19.704 -5.006 1.00 0.00 H new ATOM 0 HG SER A 34 -4.773 -21.408 -3.247 1.00 0.00 H new ATOM 510 N THR A 35 -6.670 -16.839 -3.809 1.00 0.00 N ATOM 511 CA THR A 35 -7.057 -15.616 -4.513 1.00 0.00 C ATOM 512 C THR A 35 -6.483 -14.383 -3.817 1.00 0.00 C ATOM 513 O THR A 35 -5.837 -14.494 -2.775 1.00 0.00 O ATOM 514 CB THR A 35 -8.585 -15.510 -4.618 1.00 0.00 C ATOM 515 OG1 THR A 35 -8.958 -14.405 -5.424 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.279 -15.352 -3.280 1.00 0.00 C ATOM 0 H THR A 35 -7.306 -17.117 -3.061 1.00 0.00 H new ATOM 0 HA THR A 35 -6.645 -15.663 -5.521 1.00 0.00 H new ATOM 0 HB THR A 35 -8.903 -16.454 -5.061 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.935 -14.356 -5.480 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.356 -15.284 -3.434 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.057 -16.214 -2.651 1.00 0.00 H new ATOM 0 HG23 THR A 35 -8.924 -14.445 -2.791 1.00 0.00 H new ATOM 524 N ILE A 36 -6.721 -13.210 -4.402 1.00 0.00 N ATOM 525 CA ILE A 36 -6.226 -11.957 -3.841 1.00 0.00 C ATOM 526 C ILE A 36 -7.378 -11.082 -3.355 1.00 0.00 C ATOM 527 O ILE A 36 -8.283 -10.746 -4.123 1.00 0.00 O ATOM 528 CB ILE A 36 -5.396 -11.163 -4.871 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.366 -12.075 -5.543 1.00 0.00 C ATOM 530 CG2 ILE A 36 -4.706 -9.982 -4.201 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.179 -11.789 -7.017 1.00 0.00 C ATOM 0 H ILE A 36 -7.254 -13.103 -5.265 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.587 -12.221 -2.998 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.070 -10.779 -5.637 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.408 -11.964 -5.035 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.675 -13.113 -5.418 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.125 -9.432 -4.941 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.456 -9.322 -3.765 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.043 -10.346 -3.416 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.436 -12.472 -7.429 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.127 -11.928 -7.538 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.840 -10.761 -7.148 1.00 0.00 H new ATOM 543 N VAL A 37 -7.337 -10.719 -2.076 1.00 0.00 N ATOM 544 CA VAL A 37 -8.375 -9.883 -1.481 1.00 0.00 C ATOM 545 C VAL A 37 -7.798 -8.975 -0.394 1.00 0.00 C ATOM 546 O VAL A 37 -6.772 -9.293 0.213 1.00 0.00 O ATOM 547 CB VAL A 37 -9.511 -10.741 -0.879 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.238 -11.513 -1.971 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.967 -11.688 0.183 1.00 0.00 C ATOM 0 H VAL A 37 -6.595 -10.991 -1.431 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.783 -9.266 -2.281 1.00 0.00 H new ATOM 0 HB VAL A 37 -10.227 -10.072 -0.401 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -11.034 -12.110 -1.526 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.667 -10.813 -2.687 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.534 -12.169 -2.483 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -9.784 -12.282 0.593 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.226 -12.350 -0.265 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -8.502 -11.110 0.982 1.00 0.00 H new ATOM 559 N PRO A 38 -8.455 -7.829 -0.128 1.00 0.00 N ATOM 560 CA PRO A 38 -8.002 -6.879 0.895 1.00 0.00 C ATOM 561 C PRO A 38 -8.097 -7.460 2.303 1.00 0.00 C ATOM 562 O PRO A 38 -8.808 -8.441 2.532 1.00 0.00 O ATOM 563 CB PRO A 38 -8.958 -5.693 0.742 1.00 0.00 C ATOM 564 CG PRO A 38 -10.172 -6.260 0.091 1.00 0.00 C ATOM 565 CD PRO A 38 -9.687 -7.374 -0.795 1.00 0.00 C ATOM 0 HA PRO A 38 -6.953 -6.612 0.763 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.198 -5.252 1.709 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -8.515 -4.905 0.133 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -10.876 -6.632 0.835 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -10.694 -5.500 -0.489 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.422 -8.175 -0.872 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.490 -7.024 -1.808 1.00 0.00 H new ATOM 573 N GLY A 39 -7.373 -6.853 3.239 1.00 0.00 N ATOM 574 CA GLY A 39 -7.381 -7.316 4.606 1.00 0.00 C ATOM 575 C GLY A 39 -7.568 -6.184 5.588 1.00 0.00 C ATOM 576 O GLY A 39 -8.187 -5.174 5.259 1.00 0.00 O ATOM 0 H GLY A 39 -6.778 -6.042 3.068 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.181 -8.045 4.737 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.444 -7.830 4.820 1.00 0.00 H new ATOM 580 N GLU A 40 -7.017 -6.365 6.786 1.00 0.00 N ATOM 581 CA GLU A 40 -7.100 -5.378 7.869 1.00 0.00 C ATOM 582 C GLU A 40 -7.250 -3.956 7.336 1.00 0.00 C ATOM 583 O GLU A 40 -6.540 -3.546 6.420 1.00 0.00 O ATOM 584 CB GLU A 40 -5.867 -5.467 8.774 1.00 0.00 C ATOM 585 CG GLU A 40 -5.901 -6.635 9.754 1.00 0.00 C ATOM 586 CD GLU A 40 -5.832 -7.986 9.066 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.945 -8.174 8.203 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.669 -8.857 9.381 1.00 0.00 O ATOM 0 H GLU A 40 -6.496 -7.205 7.038 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.992 -5.613 8.449 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.977 -5.554 8.151 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.773 -4.537 9.335 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.066 -6.544 10.449 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.815 -6.580 10.345 1.00 0.00 H new ATOM 595 N GLN A 41 -8.186 -3.219 7.920 1.00 0.00 N ATOM 596 CA GLN A 41 -8.452 -1.842 7.514 1.00 0.00 C ATOM 597 C GLN A 41 -8.442 -0.920 8.728 1.00 0.00 C ATOM 598 O GLN A 41 -9.427 -0.837 9.465 1.00 0.00 O ATOM 599 CB GLN A 41 -9.797 -1.754 6.786 1.00 0.00 C ATOM 600 CG GLN A 41 -9.974 -2.808 5.702 1.00 0.00 C ATOM 601 CD GLN A 41 -11.088 -2.475 4.727 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.015 -3.261 4.537 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.005 -1.307 4.097 1.00 0.00 N ATOM 0 H GLN A 41 -8.778 -3.553 8.681 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.666 -1.522 6.830 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.602 -1.855 7.514 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.894 -0.765 6.339 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.039 -2.917 5.153 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -10.183 -3.770 6.169 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.220 -0.682 4.282 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.726 -1.036 3.429 1.00 0.00 H new ATOM 612 N GLY A 42 -7.318 -0.239 8.936 1.00 0.00 N ATOM 613 CA GLY A 42 -7.193 0.660 10.074 1.00 0.00 C ATOM 614 C GLY A 42 -6.623 2.016 9.710 1.00 0.00 C ATOM 615 O GLY A 42 -5.988 2.176 8.666 1.00 0.00 O ATOM 0 H GLY A 42 -6.493 -0.292 8.339 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.174 0.797 10.529 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.555 0.196 10.826 1.00 0.00 H new ATOM 619 N ALA A 43 -6.847 2.992 10.587 1.00 0.00 N ATOM 620 CA ALA A 43 -6.352 4.351 10.384 1.00 0.00 C ATOM 621 C ALA A 43 -4.929 4.497 10.921 1.00 0.00 C ATOM 622 O ALA A 43 -4.169 5.355 10.470 1.00 0.00 O ATOM 623 CB ALA A 43 -7.274 5.357 11.059 1.00 0.00 C ATOM 0 H ALA A 43 -7.373 2.865 11.452 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.337 4.551 9.313 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.892 6.365 10.899 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.274 5.276 10.634 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.317 5.151 12.128 1.00 0.00 H new ATOM 629 N GLU A 44 -4.574 3.647 11.886 1.00 0.00 N ATOM 630 CA GLU A 44 -3.244 3.672 12.487 1.00 0.00 C ATOM 631 C GLU A 44 -2.302 2.727 11.742 1.00 0.00 C ATOM 632 O GLU A 44 -2.538 1.519 11.685 1.00 0.00 O ATOM 633 CB GLU A 44 -3.325 3.288 13.970 1.00 0.00 C ATOM 634 CG GLU A 44 -3.714 1.836 14.214 1.00 0.00 C ATOM 635 CD GLU A 44 -4.100 1.567 15.654 1.00 0.00 C ATOM 636 OE1 GLU A 44 -3.221 1.676 16.534 1.00 0.00 O ATOM 637 OE2 GLU A 44 -5.282 1.247 15.901 1.00 0.00 O ATOM 0 H GLU A 44 -5.193 2.931 12.267 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.847 4.684 12.410 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.359 3.478 14.437 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.050 3.935 14.463 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.548 1.574 13.564 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.880 1.190 13.939 1.00 0.00 H new ATOM 644 N TYR A 45 -1.237 3.282 11.164 1.00 0.00 N ATOM 645 CA TYR A 45 -0.271 2.479 10.419 1.00 0.00 C ATOM 646 C TYR A 45 0.494 1.524 11.335 1.00 0.00 C ATOM 647 O TYR A 45 1.067 0.540 10.867 1.00 0.00 O ATOM 648 CB TYR A 45 0.709 3.375 9.665 1.00 0.00 C ATOM 649 CG TYR A 45 1.364 2.677 8.497 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.654 2.419 7.332 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.688 2.272 8.564 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.248 1.775 6.264 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.290 1.628 7.500 1.00 0.00 C ATOM 654 CZ TYR A 45 2.567 1.382 6.352 1.00 0.00 C ATOM 655 OH TYR A 45 3.164 0.741 5.290 1.00 0.00 O ATOM 0 H TYR A 45 -1.023 4.279 11.197 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.832 1.882 9.700 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.182 4.259 9.305 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.480 3.722 10.353 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.379 2.727 7.260 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.258 2.463 9.461 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.682 1.580 5.365 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.323 1.319 7.567 1.00 0.00 H new ATOM 0 HH TYR A 45 2.871 -0.194 5.266 1.00 0.00 H new ATOM 665 N GLN A 46 0.497 1.816 12.640 1.00 0.00 N ATOM 666 CA GLN A 46 1.187 0.975 13.619 1.00 0.00 C ATOM 667 C GLN A 46 0.879 -0.507 13.386 1.00 0.00 C ATOM 668 O GLN A 46 1.762 -1.359 13.489 1.00 0.00 O ATOM 669 CB GLN A 46 0.775 1.373 15.040 1.00 0.00 C ATOM 670 CG GLN A 46 1.928 1.378 16.032 1.00 0.00 C ATOM 671 CD GLN A 46 2.356 2.778 16.429 1.00 0.00 C ATOM 672 OE1 GLN A 46 1.528 3.680 16.562 1.00 0.00 O ATOM 673 NE2 GLN A 46 3.656 2.968 16.622 1.00 0.00 N ATOM 0 H GLN A 46 0.029 2.629 13.041 1.00 0.00 H new ATOM 0 HA GLN A 46 2.260 1.127 13.498 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.325 2.366 15.014 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.007 0.684 15.392 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.635 0.826 16.925 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.778 0.853 15.597 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.308 2.193 16.501 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.002 3.889 16.891 1.00 0.00 H new ATOM 682 N HIS A 47 -0.380 -0.802 13.062 1.00 0.00 N ATOM 683 CA HIS A 47 -0.811 -2.173 12.805 1.00 0.00 C ATOM 684 C HIS A 47 -0.111 -2.753 11.578 1.00 0.00 C ATOM 685 O HIS A 47 0.229 -3.936 11.552 1.00 0.00 O ATOM 686 CB HIS A 47 -2.327 -2.224 12.607 1.00 0.00 C ATOM 687 CG HIS A 47 -3.094 -2.469 13.870 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.527 -2.404 15.126 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.397 -2.780 14.065 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.447 -2.664 16.037 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.591 -2.896 15.420 1.00 0.00 N ATOM 0 H HIS A 47 -1.120 -0.106 12.971 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.539 -2.775 13.672 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.659 -1.283 12.168 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.564 -3.011 11.891 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.145 -2.912 13.298 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.290 -2.684 17.105 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.475 -3.124 15.875 1.00 0.00 H new ATOM 700 N PHE A 48 0.100 -1.916 10.563 1.00 0.00 N ATOM 701 CA PHE A 48 0.755 -2.354 9.336 1.00 0.00 C ATOM 702 C PHE A 48 2.240 -2.633 9.568 1.00 0.00 C ATOM 703 O PHE A 48 2.741 -3.692 9.189 1.00 0.00 O ATOM 704 CB PHE A 48 0.578 -1.308 8.232 1.00 0.00 C ATOM 705 CG PHE A 48 0.893 -1.833 6.861 1.00 0.00 C ATOM 706 CD1 PHE A 48 2.190 -2.185 6.520 1.00 0.00 C ATOM 707 CD2 PHE A 48 -0.108 -1.984 5.917 1.00 0.00 C ATOM 708 CE1 PHE A 48 2.481 -2.679 5.263 1.00 0.00 C ATOM 709 CE2 PHE A 48 0.177 -2.476 4.657 1.00 0.00 C ATOM 710 CZ PHE A 48 1.474 -2.823 4.331 1.00 0.00 C ATOM 0 H PHE A 48 -0.173 -0.933 10.568 1.00 0.00 H new ATOM 0 HA PHE A 48 0.283 -3.284 9.020 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.449 -0.944 8.247 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.222 -0.454 8.443 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.982 -2.072 7.245 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.123 -1.714 6.168 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.495 -2.952 5.010 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.613 -2.589 3.929 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.699 -3.207 3.347 1.00 0.00 H new ATOM 720 N ILE A 49 2.939 -1.683 10.196 1.00 0.00 N ATOM 721 CA ILE A 49 4.370 -1.844 10.476 1.00 0.00 C ATOM 722 C ILE A 49 4.638 -3.075 11.349 1.00 0.00 C ATOM 723 O ILE A 49 5.742 -3.621 11.335 1.00 0.00 O ATOM 724 CB ILE A 49 4.973 -0.596 11.160 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.127 -0.176 12.365 1.00 0.00 C ATOM 726 CG2 ILE A 49 5.097 0.547 10.164 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.803 0.841 13.260 1.00 0.00 C ATOM 0 H ILE A 49 2.542 -0.801 10.518 1.00 0.00 H new ATOM 0 HA ILE A 49 4.854 -1.978 9.508 1.00 0.00 H new ATOM 0 HB ILE A 49 5.970 -0.849 11.519 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.183 0.237 12.009 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.885 -1.061 12.954 1.00 0.00 H new ATOM 0 HG21 ILE A 49 5.523 1.418 10.661 1.00 0.00 H new ATOM 0 HG22 ILE A 49 5.746 0.245 9.342 1.00 0.00 H new ATOM 0 HG23 ILE A 49 4.111 0.798 9.774 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.143 1.090 14.091 1.00 0.00 H new ATOM 0 HD12 ILE A 49 5.733 0.424 13.647 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.020 1.742 12.687 1.00 0.00 H new ATOM 739 N GLN A 50 3.624 -3.508 12.104 1.00 0.00 N ATOM 740 CA GLN A 50 3.757 -4.676 12.972 1.00 0.00 C ATOM 741 C GLN A 50 3.343 -5.960 12.245 1.00 0.00 C ATOM 742 O GLN A 50 3.821 -7.046 12.572 1.00 0.00 O ATOM 743 CB GLN A 50 2.911 -4.496 14.237 1.00 0.00 C ATOM 744 CG GLN A 50 3.739 -4.329 15.503 1.00 0.00 C ATOM 745 CD GLN A 50 3.419 -3.046 16.249 1.00 0.00 C ATOM 746 OE1 GLN A 50 2.932 -3.079 17.378 1.00 0.00 O ATOM 747 NE2 GLN A 50 3.695 -1.908 15.621 1.00 0.00 N ATOM 0 H GLN A 50 2.705 -3.067 12.130 1.00 0.00 H new ATOM 0 HA GLN A 50 4.807 -4.767 13.251 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.270 -3.623 14.114 1.00 0.00 H new ATOM 0 HB3 GLN A 50 2.256 -5.359 14.352 1.00 0.00 H new ATOM 0 HG2 GLN A 50 3.564 -5.180 16.161 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.798 -4.339 15.244 1.00 0.00 H new ATOM 0 HE21 GLN A 50 4.099 -1.927 14.685 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.503 -1.015 16.075 1.00 0.00 H new ATOM 756 N GLN A 51 2.449 -5.828 11.263 1.00 0.00 N ATOM 757 CA GLN A 51 1.966 -6.977 10.496 1.00 0.00 C ATOM 758 C GLN A 51 2.950 -7.377 9.393 1.00 0.00 C ATOM 759 O GLN A 51 3.074 -8.560 9.068 1.00 0.00 O ATOM 760 CB GLN A 51 0.599 -6.660 9.877 1.00 0.00 C ATOM 761 CG GLN A 51 -0.538 -7.510 10.422 1.00 0.00 C ATOM 762 CD GLN A 51 -0.664 -7.427 11.933 1.00 0.00 C ATOM 763 OE1 GLN A 51 -0.298 -8.360 12.647 1.00 0.00 O ATOM 764 NE2 GLN A 51 -1.180 -6.307 12.428 1.00 0.00 N ATOM 0 H GLN A 51 2.045 -4.935 10.980 1.00 0.00 H new ATOM 0 HA GLN A 51 1.873 -7.816 11.185 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.368 -5.609 10.050 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.659 -6.800 8.798 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.475 -7.190 9.966 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -0.380 -8.549 10.132 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -1.471 -5.558 11.799 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.285 -6.196 13.436 1.00 0.00 H new ATOM 773 N CYS A 52 3.633 -6.387 8.813 1.00 0.00 N ATOM 774 CA CYS A 52 4.590 -6.625 7.737 1.00 0.00 C ATOM 775 C CYS A 52 5.805 -7.420 8.221 1.00 0.00 C ATOM 776 O CYS A 52 6.862 -6.854 8.507 1.00 0.00 O ATOM 777 CB CYS A 52 5.036 -5.291 7.135 1.00 0.00 C ATOM 778 SG CYS A 52 5.806 -4.159 8.318 1.00 0.00 S ATOM 0 H CYS A 52 3.537 -5.406 9.076 1.00 0.00 H new ATOM 0 HA CYS A 52 4.092 -7.222 6.973 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.741 -5.488 6.327 1.00 0.00 H new ATOM 0 HB3 CYS A 52 4.171 -4.799 6.690 1.00 0.00 H new ATOM 0 HG CYS A 52 6.719 -4.792 8.993 1.00 0.00 H new ATOM 784 N THR A 53 5.648 -8.737 8.298 1.00 0.00 N ATOM 785 CA THR A 53 6.730 -9.618 8.735 1.00 0.00 C ATOM 786 C THR A 53 7.556 -10.090 7.538 1.00 0.00 C ATOM 787 O THR A 53 7.051 -10.161 6.414 1.00 0.00 O ATOM 788 CB THR A 53 6.173 -10.826 9.499 1.00 0.00 C ATOM 789 OG1 THR A 53 4.901 -11.211 8.993 1.00 0.00 O ATOM 790 CG2 THR A 53 6.028 -10.578 10.988 1.00 0.00 C ATOM 0 H THR A 53 4.781 -9.221 8.063 1.00 0.00 H new ATOM 0 HA THR A 53 7.376 -9.051 9.405 1.00 0.00 H new ATOM 0 HB THR A 53 6.905 -11.620 9.350 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.569 -11.984 9.496 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.629 -11.471 11.469 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.003 -10.341 11.414 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.347 -9.743 11.153 1.00 0.00 H new ATOM 798 N ASP A 54 8.827 -10.409 7.781 1.00 0.00 N ATOM 799 CA ASP A 54 9.719 -10.870 6.719 1.00 0.00 C ATOM 800 C ASP A 54 9.638 -12.389 6.545 1.00 0.00 C ATOM 801 O ASP A 54 10.625 -13.103 6.733 1.00 0.00 O ATOM 802 CB ASP A 54 11.161 -10.443 7.011 1.00 0.00 C ATOM 803 CG ASP A 54 11.506 -9.111 6.375 1.00 0.00 C ATOM 804 OD1 ASP A 54 11.791 -9.090 5.159 1.00 0.00 O ATOM 805 OD2 ASP A 54 11.487 -8.088 7.091 1.00 0.00 O ATOM 0 H ASP A 54 9.261 -10.357 8.703 1.00 0.00 H new ATOM 0 HA ASP A 54 9.396 -10.408 5.786 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.307 -10.377 8.089 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.846 -11.207 6.643 1.00 0.00 H new ATOM 810 N ASP A 55 8.452 -12.874 6.183 1.00 0.00 N ATOM 811 CA ASP A 55 8.233 -14.305 5.981 1.00 0.00 C ATOM 812 C ASP A 55 7.010 -14.559 5.098 1.00 0.00 C ATOM 813 O ASP A 55 6.340 -15.582 5.242 1.00 0.00 O ATOM 814 CB ASP A 55 8.054 -15.003 7.333 1.00 0.00 C ATOM 815 CG ASP A 55 8.742 -16.354 7.385 1.00 0.00 C ATOM 816 OD1 ASP A 55 8.411 -17.224 6.550 1.00 0.00 O ATOM 817 OD2 ASP A 55 9.609 -16.544 8.263 1.00 0.00 O ATOM 0 H ASP A 55 7.627 -12.296 6.023 1.00 0.00 H new ATOM 0 HA ASP A 55 9.108 -14.713 5.475 1.00 0.00 H new ATOM 0 HB2 ASP A 55 8.452 -14.366 8.123 1.00 0.00 H new ATOM 0 HB3 ASP A 55 6.990 -15.133 7.533 1.00 0.00 H new ATOM 822 N VAL A 56 6.724 -13.620 4.188 1.00 0.00 N ATOM 823 CA VAL A 56 5.576 -13.728 3.282 1.00 0.00 C ATOM 824 C VAL A 56 5.409 -12.451 2.462 1.00 0.00 C ATOM 825 O VAL A 56 5.883 -11.385 2.856 1.00 0.00 O ATOM 826 CB VAL A 56 4.246 -13.988 4.036 1.00 0.00 C ATOM 827 CG1 VAL A 56 3.912 -15.474 4.065 1.00 0.00 C ATOM 828 CG2 VAL A 56 4.292 -13.414 5.448 1.00 0.00 C ATOM 0 H VAL A 56 7.276 -12.772 4.060 1.00 0.00 H new ATOM 0 HA VAL A 56 5.787 -14.578 2.633 1.00 0.00 H new ATOM 0 HB VAL A 56 3.453 -13.476 3.492 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.975 -15.626 4.600 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.812 -15.844 3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.711 -16.017 4.571 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.346 -13.612 5.952 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.104 -13.882 6.005 1.00 0.00 H new ATOM 0 HG23 VAL A 56 4.459 -12.338 5.398 1.00 0.00 H new ATOM 838 N ARG A 57 4.718 -12.564 1.330 1.00 0.00 N ATOM 839 CA ARG A 57 4.470 -11.414 0.462 1.00 0.00 C ATOM 840 C ARG A 57 3.014 -10.967 0.571 1.00 0.00 C ATOM 841 O ARG A 57 2.112 -11.796 0.711 1.00 0.00 O ATOM 842 CB ARG A 57 4.807 -11.755 -0.994 1.00 0.00 C ATOM 843 CG ARG A 57 3.896 -12.811 -1.604 1.00 0.00 C ATOM 844 CD ARG A 57 4.552 -14.182 -1.613 1.00 0.00 C ATOM 845 NE ARG A 57 3.852 -15.113 -2.495 1.00 0.00 N ATOM 846 CZ ARG A 57 2.759 -15.798 -2.148 1.00 0.00 C ATOM 847 NH1 ARG A 57 2.239 -15.672 -0.929 1.00 0.00 N ATOM 848 NH2 ARG A 57 2.182 -16.611 -3.026 1.00 0.00 N ATOM 0 H ARG A 57 4.320 -13.440 0.992 1.00 0.00 H new ATOM 0 HA ARG A 57 5.114 -10.597 0.787 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.747 -10.847 -1.593 1.00 0.00 H new ATOM 0 HB3 ARG A 57 5.838 -12.104 -1.046 1.00 0.00 H new ATOM 0 HG2 ARG A 57 2.964 -12.857 -1.040 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.638 -12.524 -2.623 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.589 -14.087 -1.935 1.00 0.00 H new ATOM 0 HD3 ARG A 57 4.568 -14.584 -0.600 1.00 0.00 H new ATOM 0 HE ARG A 57 4.222 -15.249 -3.436 1.00 0.00 H new ATOM 0 HH11 ARG A 57 2.675 -15.048 -0.250 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.404 -16.199 -0.674 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.574 -16.711 -3.962 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.347 -17.135 -2.764 1.00 0.00 H new ATOM 862 N LEU A 58 2.786 -9.657 0.507 1.00 0.00 N ATOM 863 CA LEU A 58 1.431 -9.114 0.600 1.00 0.00 C ATOM 864 C LEU A 58 1.355 -7.702 0.027 1.00 0.00 C ATOM 865 O LEU A 58 2.310 -6.932 0.117 1.00 0.00 O ATOM 866 CB LEU A 58 0.951 -9.114 2.056 1.00 0.00 C ATOM 867 CG LEU A 58 1.834 -8.336 3.036 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.267 -6.946 3.282 1.00 0.00 C ATOM 869 CD2 LEU A 58 1.973 -9.099 4.346 1.00 0.00 C ATOM 0 H LEU A 58 3.517 -8.955 0.392 1.00 0.00 H new ATOM 0 HA LEU A 58 0.778 -9.756 0.009 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.055 -8.697 2.090 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.880 -10.147 2.398 1.00 0.00 H new ATOM 0 HG LEU A 58 2.825 -8.226 2.595 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.909 -6.410 3.981 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.221 -6.400 2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.265 -7.031 3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.603 -8.533 5.032 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.988 -9.240 4.791 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.427 -10.071 4.154 1.00 0.00 H new ATOM 881 N PHE A 59 0.206 -7.369 -0.556 1.00 0.00 N ATOM 882 CA PHE A 59 -0.008 -6.048 -1.140 1.00 0.00 C ATOM 883 C PHE A 59 -0.493 -5.057 -0.085 1.00 0.00 C ATOM 884 O PHE A 59 -0.832 -5.443 1.035 1.00 0.00 O ATOM 885 CB PHE A 59 -1.017 -6.132 -2.285 1.00 0.00 C ATOM 886 CG PHE A 59 -0.383 -6.391 -3.620 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.120 -7.643 -3.932 1.00 0.00 C ATOM 888 CD2 PHE A 59 -0.288 -5.381 -4.563 1.00 0.00 C ATOM 889 CE1 PHE A 59 0.707 -7.883 -5.158 1.00 0.00 C ATOM 890 CE2 PHE A 59 0.299 -5.614 -5.792 1.00 0.00 C ATOM 891 CZ PHE A 59 0.796 -6.868 -6.090 1.00 0.00 C ATOM 0 H PHE A 59 -0.593 -7.998 -0.636 1.00 0.00 H new ATOM 0 HA PHE A 59 0.945 -5.692 -1.532 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.733 -6.926 -2.071 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.579 -5.200 -2.333 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.052 -8.441 -3.207 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.677 -4.400 -4.335 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.096 -8.864 -5.388 1.00 0.00 H new ATOM 0 HE2 PHE A 59 0.369 -4.818 -6.518 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.253 -7.054 -7.050 1.00 0.00 H new ATOM 901 N ALA A 60 -0.516 -3.776 -0.449 1.00 0.00 N ATOM 902 CA ALA A 60 -0.952 -2.728 0.466 1.00 0.00 C ATOM 903 C ALA A 60 -1.528 -1.534 -0.287 1.00 0.00 C ATOM 904 O ALA A 60 -1.189 -1.293 -1.448 1.00 0.00 O ATOM 905 CB ALA A 60 0.209 -2.283 1.342 1.00 0.00 C ATOM 0 H ALA A 60 -0.237 -3.441 -1.371 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.741 -3.140 1.095 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.127 -1.500 2.022 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.575 -3.132 1.919 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.012 -1.898 0.714 1.00 0.00 H new ATOM 911 N PHE A 61 -2.397 -0.786 0.387 1.00 0.00 N ATOM 912 CA PHE A 61 -3.021 0.391 -0.206 1.00 0.00 C ATOM 913 C PHE A 61 -3.330 1.430 0.866 1.00 0.00 C ATOM 914 O PHE A 61 -4.155 1.194 1.750 1.00 0.00 O ATOM 915 CB PHE A 61 -4.304 0.002 -0.944 1.00 0.00 C ATOM 916 CG PHE A 61 -4.624 0.906 -2.100 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.019 0.716 -3.332 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.529 1.944 -1.953 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.312 1.547 -4.396 1.00 0.00 C ATOM 920 CE2 PHE A 61 -5.826 2.777 -3.014 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.217 2.579 -4.237 1.00 0.00 C ATOM 0 H PHE A 61 -2.685 -0.976 1.347 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.322 0.824 -0.922 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.209 -1.021 -1.308 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.137 0.015 -0.241 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.311 -0.090 -3.462 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.008 2.104 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.834 1.390 -5.352 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.534 3.583 -2.887 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.447 3.229 -5.068 1.00 0.00 H new ATOM 931 N VAL A 62 -2.658 2.576 0.785 1.00 0.00 N ATOM 932 CA VAL A 62 -2.858 3.650 1.753 1.00 0.00 C ATOM 933 C VAL A 62 -3.226 4.959 1.056 1.00 0.00 C ATOM 934 O VAL A 62 -2.725 5.257 -0.030 1.00 0.00 O ATOM 935 CB VAL A 62 -1.596 3.878 2.613 1.00 0.00 C ATOM 936 CG1 VAL A 62 -1.900 4.821 3.768 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.047 2.555 3.129 1.00 0.00 C ATOM 0 H VAL A 62 -1.971 2.784 0.060 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.679 3.341 2.400 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.834 4.339 1.985 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.999 4.970 4.363 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.238 5.780 3.375 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.681 4.390 4.394 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.158 2.740 3.732 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.803 2.061 3.739 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -0.786 1.916 2.286 1.00 0.00 H new ATOM 947 N ARG A 63 -4.098 5.737 1.696 1.00 0.00 N ATOM 948 CA ARG A 63 -4.534 7.022 1.147 1.00 0.00 C ATOM 949 C ARG A 63 -4.133 8.174 2.067 1.00 0.00 C ATOM 950 O ARG A 63 -4.149 8.038 3.292 1.00 0.00 O ATOM 951 CB ARG A 63 -6.052 7.034 0.922 1.00 0.00 C ATOM 952 CG ARG A 63 -6.862 6.469 2.084 1.00 0.00 C ATOM 953 CD ARG A 63 -7.323 7.559 3.038 1.00 0.00 C ATOM 954 NE ARG A 63 -8.353 8.413 2.444 1.00 0.00 N ATOM 955 CZ ARG A 63 -8.190 9.709 2.152 1.00 0.00 C ATOM 956 NH1 ARG A 63 -7.029 10.320 2.377 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.199 10.395 1.627 1.00 0.00 N ATOM 0 H ARG A 63 -4.517 5.501 2.595 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.038 7.156 0.186 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.372 8.059 0.736 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.279 6.461 0.023 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.730 5.936 1.696 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.258 5.742 2.628 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.712 7.102 3.948 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.469 8.171 3.328 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.258 7.991 2.238 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.248 9.800 2.777 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.920 11.308 2.149 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.091 9.934 1.449 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -9.082 11.383 1.402 1.00 0.00 H new ATOM 971 N PHE A 64 -3.772 9.308 1.466 1.00 0.00 N ATOM 972 CA PHE A 64 -3.364 10.489 2.227 1.00 0.00 C ATOM 973 C PHE A 64 -4.139 11.723 1.778 1.00 0.00 C ATOM 974 O PHE A 64 -4.654 11.770 0.660 1.00 0.00 O ATOM 975 CB PHE A 64 -1.862 10.742 2.061 1.00 0.00 C ATOM 976 CG PHE A 64 -0.994 9.661 2.639 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.789 8.476 1.952 1.00 0.00 C ATOM 978 CD2 PHE A 64 -0.377 9.832 3.869 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.011 7.482 2.479 1.00 0.00 C ATOM 980 CE2 PHE A 64 0.424 8.842 4.402 1.00 0.00 C ATOM 981 CZ PHE A 64 0.619 7.664 3.706 1.00 0.00 C ATOM 0 H PHE A 64 -3.754 9.434 0.454 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.584 10.299 3.278 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.636 10.847 1.000 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.609 11.690 2.536 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.261 8.328 0.992 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.525 10.751 4.417 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.161 6.563 1.932 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.898 8.988 5.362 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.245 6.888 4.120 1.00 0.00 H new ATOM 991 N THR A 65 -4.204 12.726 2.650 1.00 0.00 N ATOM 992 CA THR A 65 -4.902 13.969 2.340 1.00 0.00 C ATOM 993 C THR A 65 -4.054 15.175 2.739 1.00 0.00 C ATOM 994 O THR A 65 -4.073 15.609 3.893 1.00 0.00 O ATOM 995 CB THR A 65 -6.271 14.016 3.034 1.00 0.00 C ATOM 996 OG1 THR A 65 -6.862 15.296 2.897 1.00 0.00 O ATOM 997 CG2 THR A 65 -6.214 13.691 4.514 1.00 0.00 C ATOM 0 H THR A 65 -3.781 12.701 3.578 1.00 0.00 H new ATOM 0 HA THR A 65 -5.067 14.006 1.263 1.00 0.00 H new ATOM 0 HB THR A 65 -6.866 13.250 2.537 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.734 15.303 3.345 1.00 0.00 H new ATOM 0 HG21 THR A 65 -7.217 13.744 4.937 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.815 12.686 4.651 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.569 14.409 5.020 1.00 0.00 H new ATOM 1122 N SER A 74 -6.313 14.650 -2.076 1.00 0.00 N ATOM 1123 CA SER A 74 -6.345 13.221 -1.778 1.00 0.00 C ATOM 1124 C SER A 74 -5.455 12.448 -2.747 1.00 0.00 C ATOM 1125 O SER A 74 -5.600 12.570 -3.965 1.00 0.00 O ATOM 1126 CB SER A 74 -7.780 12.692 -1.846 1.00 0.00 C ATOM 1127 OG SER A 74 -7.888 11.426 -1.216 1.00 0.00 O ATOM 0 HA SER A 74 -5.965 13.076 -0.767 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.455 13.400 -1.365 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.092 12.611 -2.887 1.00 0.00 H new ATOM 0 HG SER A 74 -8.814 11.111 -1.272 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.534 11.657 -2.199 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.619 10.866 -3.016 1.00 0.00 C ATOM 1135 C LYS A 75 -3.784 9.373 -2.740 1.00 0.00 C ATOM 1136 O LYS A 75 -4.361 8.978 -1.724 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.171 11.288 -2.753 1.00 0.00 C ATOM 1138 CG LYS A 75 -1.759 12.549 -3.499 1.00 0.00 C ATOM 1139 CD LYS A 75 -0.247 12.728 -3.497 1.00 0.00 C ATOM 1140 CE LYS A 75 0.260 13.197 -2.140 1.00 0.00 C ATOM 1141 NZ LYS A 75 0.764 14.598 -2.186 1.00 0.00 N ATOM 0 H LYS A 75 -4.403 11.548 -1.193 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.861 11.050 -4.063 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.037 11.448 -1.683 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.506 10.473 -3.039 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.119 12.500 -4.526 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.230 13.417 -3.037 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.232 11.785 -3.759 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.035 13.452 -4.262 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.544 13.125 -1.408 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.058 12.536 -1.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.099 14.877 -1.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.549 14.663 -2.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.004 15.234 -2.483 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.273 8.548 -3.653 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.358 7.097 -3.518 1.00 0.00 C ATOM 1157 C PHE A 76 -2.005 6.448 -3.785 1.00 0.00 C ATOM 1158 O PHE A 76 -1.347 6.753 -4.781 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.401 6.530 -4.485 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.817 6.789 -4.062 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.349 6.158 -2.949 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.618 7.663 -4.779 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -7.653 6.394 -2.558 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.922 7.904 -4.394 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.441 7.268 -3.282 1.00 0.00 C ATOM 0 H PHE A 76 -2.794 8.863 -4.497 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.659 6.872 -2.495 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.241 6.962 -5.473 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.250 5.455 -4.579 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.737 5.474 -2.380 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.218 8.162 -5.649 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.056 5.896 -1.688 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.536 8.588 -4.961 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.461 7.454 -2.979 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.595 5.551 -2.893 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.321 4.859 -3.035 1.00 0.00 C ATOM 1177 C ALA A 77 -0.492 3.352 -2.875 1.00 0.00 C ATOM 1178 O ALA A 77 -0.951 2.877 -1.834 1.00 0.00 O ATOM 1179 CB ALA A 77 0.683 5.389 -2.023 1.00 0.00 C ATOM 0 H ALA A 77 -2.128 5.287 -2.064 1.00 0.00 H new ATOM 0 HA ALA A 77 0.057 5.050 -4.039 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.630 4.863 -2.141 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.837 6.455 -2.188 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.302 5.229 -1.014 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.113 2.606 -3.911 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.214 1.150 -3.887 1.00 0.00 C ATOM 1187 C LEU A 78 1.160 0.529 -3.656 1.00 0.00 C ATOM 1188 O LEU A 78 1.973 0.423 -4.579 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.827 0.624 -5.191 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.192 1.157 -6.480 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -0.183 0.082 -7.555 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -0.933 2.393 -6.966 1.00 0.00 C ATOM 0 H LEU A 78 0.267 2.987 -4.778 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.870 0.865 -3.064 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.754 -0.464 -5.193 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.888 0.873 -5.200 1.00 0.00 H new ATOM 0 HG LEU A 78 0.840 1.436 -6.266 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.272 0.479 -8.463 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.392 -0.776 -7.207 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.206 -0.229 -7.767 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.469 2.759 -7.882 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.974 2.139 -7.163 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.887 3.169 -6.202 1.00 0.00 H new ATOM 1204 N ILE A 79 1.419 0.131 -2.413 1.00 0.00 N ATOM 1205 CA ILE A 79 2.697 -0.468 -2.050 1.00 0.00 C ATOM 1206 C ILE A 79 2.587 -1.987 -1.958 1.00 0.00 C ATOM 1207 O ILE A 79 1.560 -2.522 -1.543 1.00 0.00 O ATOM 1208 CB ILE A 79 3.216 0.082 -0.702 1.00 0.00 C ATOM 1209 CG1 ILE A 79 3.221 1.613 -0.715 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.611 -0.451 -0.408 1.00 0.00 C ATOM 1211 CD1 ILE A 79 3.044 2.230 0.655 1.00 0.00 C ATOM 0 H ILE A 79 0.758 0.213 -1.640 1.00 0.00 H new ATOM 0 HA ILE A 79 3.403 -0.205 -2.837 1.00 0.00 H new ATOM 0 HB ILE A 79 2.545 -0.256 0.088 1.00 0.00 H new ATOM 0 HG12 ILE A 79 4.161 1.961 -1.143 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.423 1.965 -1.369 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.959 -0.053 0.545 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.581 -1.539 -0.357 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.293 -0.143 -1.201 1.00 0.00 H new ATOM 0 HD11 ILE A 79 3.058 3.317 0.569 1.00 0.00 H new ATOM 0 HD12 ILE A 79 2.091 1.911 1.077 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.856 1.907 1.307 1.00 0.00 H new ATOM 1223 N THR A 80 3.659 -2.674 -2.340 1.00 0.00 N ATOM 1224 CA THR A 80 3.696 -4.131 -2.294 1.00 0.00 C ATOM 1225 C THR A 80 4.775 -4.601 -1.323 1.00 0.00 C ATOM 1226 O THR A 80 5.954 -4.280 -1.488 1.00 0.00 O ATOM 1227 CB THR A 80 3.953 -4.708 -3.689 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.094 -4.114 -4.649 1.00 0.00 O ATOM 1229 CG2 THR A 80 3.751 -6.206 -3.762 1.00 0.00 C ATOM 0 H THR A 80 4.516 -2.243 -2.686 1.00 0.00 H new ATOM 0 HA THR A 80 2.728 -4.489 -1.945 1.00 0.00 H new ATOM 0 HB THR A 80 4.998 -4.484 -3.903 1.00 0.00 H new ATOM 0 HG1 THR A 80 2.322 -4.698 -4.803 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.949 -6.551 -4.777 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.435 -6.699 -3.071 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.724 -6.448 -3.490 1.00 0.00 H new ATOM 1237 N TRP A 81 4.362 -5.356 -0.307 1.00 0.00 N ATOM 1238 CA TRP A 81 5.292 -5.865 0.697 1.00 0.00 C ATOM 1239 C TRP A 81 5.813 -7.249 0.320 1.00 0.00 C ATOM 1240 O TRP A 81 5.083 -8.073 -0.233 1.00 0.00 O ATOM 1241 CB TRP A 81 4.620 -5.922 2.073 1.00 0.00 C ATOM 1242 CG TRP A 81 5.495 -6.519 3.136 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.325 -7.721 3.762 1.00 0.00 C ATOM 1244 CD2 TRP A 81 6.683 -5.942 3.691 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.332 -7.925 4.673 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.177 -6.848 4.649 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.375 -4.749 3.472 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.332 -6.595 5.386 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 8.520 -4.500 4.204 1.00 0.00 C ATOM 1250 CH2 TRP A 81 8.989 -5.419 5.151 1.00 0.00 C ATOM 0 H TRP A 81 3.390 -5.628 -0.158 1.00 0.00 H new ATOM 0 HA TRP A 81 6.138 -5.179 0.739 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.333 -4.914 2.372 1.00 0.00 H new ATOM 0 HB3 TRP A 81 3.702 -6.505 1.998 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.516 -8.410 3.569 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.434 -8.745 5.270 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.022 -4.034 2.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 8.695 -7.302 6.117 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.063 -3.580 4.043 1.00 0.00 H new ATOM 0 HH2 TRP A 81 9.887 -5.194 5.707 1.00 0.00 H new ATOM 1261 N ILE A 82 7.081 -7.494 0.636 1.00 0.00 N ATOM 1262 CA ILE A 82 7.718 -8.773 0.352 1.00 0.00 C ATOM 1263 C ILE A 82 8.609 -9.188 1.522 1.00 0.00 C ATOM 1264 O ILE A 82 9.631 -8.556 1.791 1.00 0.00 O ATOM 1265 CB ILE A 82 8.555 -8.713 -0.944 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.699 -8.204 -2.108 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.137 -10.082 -1.267 1.00 0.00 C ATOM 1268 CD1 ILE A 82 8.471 -8.021 -3.398 1.00 0.00 C ATOM 0 H ILE A 82 7.691 -6.816 1.093 1.00 0.00 H new ATOM 0 HA ILE A 82 6.929 -9.513 0.213 1.00 0.00 H new ATOM 0 HB ILE A 82 9.380 -8.017 -0.792 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.882 -8.905 -2.280 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.248 -7.252 -1.827 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.724 -10.021 -2.184 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.777 -10.408 -0.447 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.327 -10.799 -1.402 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.799 -7.659 -4.176 1.00 0.00 H new ATOM 0 HD12 ILE A 82 9.271 -7.297 -3.244 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.899 -8.975 -3.704 1.00 0.00 H new ATOM 1280 N GLY A 83 8.200 -10.239 2.229 1.00 0.00 N ATOM 1281 CA GLY A 83 8.956 -10.705 3.376 1.00 0.00 C ATOM 1282 C GLY A 83 10.015 -11.732 3.022 1.00 0.00 C ATOM 1283 O GLY A 83 9.685 -12.880 2.732 1.00 0.00 O ATOM 0 H GLY A 83 7.357 -10.776 2.026 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.434 -9.852 3.858 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.269 -11.138 4.103 1.00 0.00 H new ATOM 1287 N GLU A 84 11.280 -11.289 3.076 1.00 0.00 N ATOM 1288 CA GLU A 84 12.482 -12.102 2.797 1.00 0.00 C ATOM 1289 C GLU A 84 12.209 -13.504 2.247 1.00 0.00 C ATOM 1290 O GLU A 84 12.537 -13.797 1.097 1.00 0.00 O ATOM 1291 CB GLU A 84 13.304 -12.242 4.072 1.00 0.00 C ATOM 1292 CG GLU A 84 14.373 -11.175 4.236 1.00 0.00 C ATOM 1293 CD GLU A 84 15.270 -11.428 5.432 1.00 0.00 C ATOM 1294 OE1 GLU A 84 14.860 -11.092 6.562 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.382 -11.963 5.238 1.00 0.00 O ATOM 0 H GLU A 84 11.506 -10.325 3.322 1.00 0.00 H new ATOM 0 HA GLU A 84 13.014 -11.563 2.013 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.634 -12.206 4.931 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.779 -13.223 4.080 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.981 -11.133 3.333 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.896 -10.201 4.344 1.00 0.00 H new ATOM 1302 N ASN A 85 11.641 -14.370 3.094 1.00 0.00 N ATOM 1303 CA ASN A 85 11.342 -15.757 2.733 1.00 0.00 C ATOM 1304 C ASN A 85 10.754 -15.866 1.332 1.00 0.00 C ATOM 1305 O ASN A 85 10.892 -16.897 0.672 1.00 0.00 O ATOM 1306 CB ASN A 85 10.379 -16.363 3.751 1.00 0.00 C ATOM 1307 CG ASN A 85 11.096 -16.880 4.984 1.00 0.00 C ATOM 1308 OD1 ASN A 85 11.345 -18.078 5.114 1.00 0.00 O ATOM 1309 ND2 ASN A 85 11.432 -15.977 5.901 1.00 0.00 N ATOM 0 H ASN A 85 11.376 -14.127 4.049 1.00 0.00 H new ATOM 0 HA ASN A 85 12.281 -16.310 2.740 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.647 -15.612 4.047 1.00 0.00 H new ATOM 0 HB3 ASN A 85 9.827 -17.179 3.285 1.00 0.00 H new ATOM 0 HD21 ASN A 85 11.915 -16.269 6.751 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.207 -14.993 5.754 1.00 0.00 H new ATOM 1316 N VAL A 86 10.111 -14.792 0.881 1.00 0.00 N ATOM 1317 CA VAL A 86 9.515 -14.754 -0.449 1.00 0.00 C ATOM 1318 C VAL A 86 10.560 -15.114 -1.510 1.00 0.00 C ATOM 1319 O VAL A 86 11.387 -14.284 -1.889 1.00 0.00 O ATOM 1320 CB VAL A 86 8.923 -13.361 -0.749 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.477 -13.261 -2.199 1.00 0.00 C ATOM 1322 CG2 VAL A 86 7.766 -13.056 0.192 1.00 0.00 C ATOM 0 H VAL A 86 9.990 -13.935 1.420 1.00 0.00 H new ATOM 0 HA VAL A 86 8.708 -15.486 -0.478 1.00 0.00 H new ATOM 0 HB VAL A 86 9.704 -12.619 -0.584 1.00 0.00 H new ATOM 0 HG11 VAL A 86 8.063 -12.270 -2.385 1.00 0.00 H new ATOM 0 HG12 VAL A 86 9.332 -13.426 -2.855 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.715 -14.015 -2.398 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.362 -12.069 -0.036 1.00 0.00 H new ATOM 0 HG22 VAL A 86 6.985 -13.806 0.064 1.00 0.00 H new ATOM 0 HG23 VAL A 86 8.121 -13.074 1.223 1.00 0.00 H new ATOM 1332 N SER A 87 10.522 -16.364 -1.969 1.00 0.00 N ATOM 1333 CA SER A 87 11.471 -16.850 -2.971 1.00 0.00 C ATOM 1334 C SER A 87 11.137 -16.319 -4.366 1.00 0.00 C ATOM 1335 O SER A 87 10.184 -15.558 -4.538 1.00 0.00 O ATOM 1336 CB SER A 87 11.483 -18.381 -2.981 1.00 0.00 C ATOM 1337 OG SER A 87 10.287 -18.900 -3.537 1.00 0.00 O ATOM 0 H SER A 87 9.843 -17.060 -1.662 1.00 0.00 H new ATOM 0 HA SER A 87 12.461 -16.481 -2.702 1.00 0.00 H new ATOM 0 HB2 SER A 87 12.338 -18.737 -3.555 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.605 -18.753 -1.964 1.00 0.00 H new ATOM 0 HG SER A 87 9.604 -18.969 -2.838 1.00 0.00 H new ATOM 1343 N GLY A 88 11.930 -16.735 -5.358 1.00 0.00 N ATOM 1344 CA GLY A 88 11.709 -16.304 -6.731 1.00 0.00 C ATOM 1345 C GLY A 88 10.290 -16.562 -7.203 1.00 0.00 C ATOM 1346 O GLY A 88 9.649 -15.674 -7.766 1.00 0.00 O ATOM 0 H GLY A 88 12.723 -17.364 -5.232 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.927 -15.239 -6.813 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.406 -16.824 -7.388 1.00 0.00 H new ATOM 1350 N LEU A 89 9.794 -17.777 -6.961 1.00 0.00 N ATOM 1351 CA LEU A 89 8.436 -18.145 -7.355 1.00 0.00 C ATOM 1352 C LEU A 89 7.415 -17.220 -6.695 1.00 0.00 C ATOM 1353 O LEU A 89 6.507 -16.712 -7.355 1.00 0.00 O ATOM 1354 CB LEU A 89 8.145 -19.603 -6.984 1.00 0.00 C ATOM 1355 CG LEU A 89 8.319 -20.612 -8.123 1.00 0.00 C ATOM 1356 CD1 LEU A 89 8.106 -22.029 -7.616 1.00 0.00 C ATOM 1357 CD2 LEU A 89 7.360 -20.306 -9.265 1.00 0.00 C ATOM 0 H LEU A 89 10.313 -18.521 -6.495 1.00 0.00 H new ATOM 0 HA LEU A 89 8.354 -18.037 -8.437 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.801 -19.890 -6.162 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.122 -19.670 -6.614 1.00 0.00 H new ATOM 0 HG LEU A 89 9.338 -20.528 -8.500 1.00 0.00 H new ATOM 0 HD11 LEU A 89 8.233 -22.733 -8.439 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.833 -22.249 -6.834 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.098 -22.123 -7.211 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.501 -21.035 -10.063 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.334 -20.359 -8.902 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.558 -19.305 -9.648 1.00 0.00 H new ATOM 1369 N GLN A 90 7.582 -16.996 -5.390 1.00 0.00 N ATOM 1370 CA GLN A 90 6.685 -16.120 -4.640 1.00 0.00 C ATOM 1371 C GLN A 90 6.811 -14.678 -5.130 1.00 0.00 C ATOM 1372 O GLN A 90 5.816 -13.958 -5.231 1.00 0.00 O ATOM 1373 CB GLN A 90 6.994 -16.196 -3.142 1.00 0.00 C ATOM 1374 CG GLN A 90 6.171 -17.236 -2.398 1.00 0.00 C ATOM 1375 CD GLN A 90 6.870 -18.580 -2.301 1.00 0.00 C ATOM 1376 OE1 GLN A 90 8.083 -18.650 -2.106 1.00 0.00 O ATOM 1377 NE2 GLN A 90 6.104 -19.659 -2.435 1.00 0.00 N ATOM 0 H GLN A 90 8.330 -17.409 -4.833 1.00 0.00 H new ATOM 0 HA GLN A 90 5.661 -16.456 -4.804 1.00 0.00 H new ATOM 0 HB2 GLN A 90 8.052 -16.421 -3.010 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.818 -15.218 -2.694 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.954 -16.871 -1.394 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.214 -17.365 -2.904 1.00 0.00 H new ATOM 0 HE21 GLN A 90 5.102 -19.556 -2.596 1.00 0.00 H new ATOM 0 HE22 GLN A 90 6.519 -20.589 -2.377 1.00 0.00 H new ATOM 1386 N ARG A 91 8.044 -14.270 -5.443 1.00 0.00 N ATOM 1387 CA ARG A 91 8.317 -12.921 -5.935 1.00 0.00 C ATOM 1388 C ARG A 91 7.625 -12.685 -7.278 1.00 0.00 C ATOM 1389 O ARG A 91 7.088 -11.604 -7.526 1.00 0.00 O ATOM 1390 CB ARG A 91 9.827 -12.707 -6.080 1.00 0.00 C ATOM 1391 CG ARG A 91 10.289 -11.310 -5.695 1.00 0.00 C ATOM 1392 CD ARG A 91 11.752 -11.086 -6.057 1.00 0.00 C ATOM 1393 NE ARG A 91 11.904 -10.380 -7.330 1.00 0.00 N ATOM 1394 CZ ARG A 91 13.027 -10.376 -8.054 1.00 0.00 C ATOM 1395 NH1 ARG A 91 14.103 -11.038 -7.633 1.00 0.00 N ATOM 1396 NH2 ARG A 91 13.074 -9.707 -9.200 1.00 0.00 N ATOM 0 H ARG A 91 8.872 -14.860 -5.363 1.00 0.00 H new ATOM 0 HA ARG A 91 7.924 -12.206 -5.212 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.349 -13.436 -5.460 1.00 0.00 H new ATOM 0 HB3 ARG A 91 10.115 -12.903 -7.113 1.00 0.00 H new ATOM 0 HG2 ARG A 91 9.670 -10.569 -6.201 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.151 -11.162 -4.624 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.237 -10.514 -5.266 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.262 -12.048 -6.113 1.00 0.00 H new ATOM 0 HE ARG A 91 11.103 -9.859 -7.687 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.073 -11.552 -6.753 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.957 -11.031 -8.191 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.253 -9.197 -9.527 1.00 0.00 H new ATOM 0 HH22 ARG A 91 13.931 -9.703 -9.754 1.00 0.00 H new ATOM 1410 N ALA A 92 7.634 -13.707 -8.136 1.00 0.00 N ATOM 1411 CA ALA A 92 7.002 -13.616 -9.450 1.00 0.00 C ATOM 1412 C ALA A 92 5.491 -13.425 -9.321 1.00 0.00 C ATOM 1413 O ALA A 92 4.875 -12.733 -10.133 1.00 0.00 O ATOM 1414 CB ALA A 92 7.307 -14.858 -10.273 1.00 0.00 C ATOM 0 H ALA A 92 8.073 -14.607 -7.943 1.00 0.00 H new ATOM 0 HA ALA A 92 7.412 -12.745 -9.961 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.829 -14.774 -11.249 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.385 -14.952 -10.404 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.926 -15.739 -9.757 1.00 0.00 H new ATOM 1420 N LYS A 93 4.903 -14.038 -8.291 1.00 0.00 N ATOM 1421 CA LYS A 93 3.467 -13.931 -8.047 1.00 0.00 C ATOM 1422 C LYS A 93 3.059 -12.476 -7.834 1.00 0.00 C ATOM 1423 O LYS A 93 2.076 -12.011 -8.412 1.00 0.00 O ATOM 1424 CB LYS A 93 3.064 -14.767 -6.830 1.00 0.00 C ATOM 1425 CG LYS A 93 1.942 -15.755 -7.110 1.00 0.00 C ATOM 1426 CD LYS A 93 2.348 -16.782 -8.156 1.00 0.00 C ATOM 1427 CE LYS A 93 3.416 -17.729 -7.626 1.00 0.00 C ATOM 1428 NZ LYS A 93 3.856 -18.708 -8.659 1.00 0.00 N ATOM 0 H LYS A 93 5.402 -14.614 -7.613 1.00 0.00 H new ATOM 0 HA LYS A 93 2.949 -14.313 -8.926 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.936 -15.314 -6.471 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.755 -14.098 -6.027 1.00 0.00 H new ATOM 0 HG2 LYS A 93 1.666 -16.265 -6.187 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.059 -15.216 -7.452 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.473 -17.355 -8.463 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.722 -16.271 -9.043 1.00 0.00 H new ATOM 0 HE2 LYS A 93 4.275 -17.152 -7.284 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.028 -18.265 -6.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 4.507 -19.396 -8.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.027 -19.206 -9.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 4.342 -18.205 -9.429 1.00 0.00 H new ATOM 1442 N THR A 94 3.826 -11.764 -7.006 1.00 0.00 N ATOM 1443 CA THR A 94 3.546 -10.358 -6.720 1.00 0.00 C ATOM 1444 C THR A 94 3.589 -9.523 -8.000 1.00 0.00 C ATOM 1445 O THR A 94 2.823 -8.570 -8.150 1.00 0.00 O ATOM 1446 CB THR A 94 4.538 -9.801 -5.689 1.00 0.00 C ATOM 1447 OG1 THR A 94 5.616 -10.696 -5.478 1.00 0.00 O ATOM 1448 CG2 THR A 94 3.902 -9.528 -4.344 1.00 0.00 C ATOM 0 H THR A 94 4.643 -12.138 -6.524 1.00 0.00 H new ATOM 0 HA THR A 94 2.542 -10.297 -6.301 1.00 0.00 H new ATOM 0 HB THR A 94 4.891 -8.861 -6.112 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.100 -10.829 -6.320 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.654 -9.136 -3.659 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.102 -8.797 -4.461 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.491 -10.454 -3.941 1.00 0.00 H new ATOM 1456 N GLY A 95 4.478 -9.892 -8.925 1.00 0.00 N ATOM 1457 CA GLY A 95 4.585 -9.171 -10.181 1.00 0.00 C ATOM 1458 C GLY A 95 3.307 -9.256 -10.995 1.00 0.00 C ATOM 1459 O GLY A 95 2.764 -8.234 -11.417 1.00 0.00 O ATOM 0 H GLY A 95 5.123 -10.676 -8.824 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.818 -8.125 -9.980 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.413 -9.576 -10.763 1.00 0.00 H new ATOM 1463 N THR A 96 2.818 -10.481 -11.199 1.00 0.00 N ATOM 1464 CA THR A 96 1.585 -10.704 -11.953 1.00 0.00 C ATOM 1465 C THR A 96 0.391 -10.085 -11.229 1.00 0.00 C ATOM 1466 O THR A 96 -0.513 -9.538 -11.861 1.00 0.00 O ATOM 1467 CB THR A 96 1.345 -12.205 -12.165 1.00 0.00 C ATOM 1468 OG1 THR A 96 2.574 -12.899 -12.308 1.00 0.00 O ATOM 1469 CG2 THR A 96 0.503 -12.508 -13.386 1.00 0.00 C ATOM 0 H THR A 96 3.258 -11.333 -10.852 1.00 0.00 H new ATOM 0 HA THR A 96 1.693 -10.224 -12.926 1.00 0.00 H new ATOM 0 HB THR A 96 0.807 -12.538 -11.278 1.00 0.00 H new ATOM 0 HG1 THR A 96 2.397 -13.854 -12.440 1.00 0.00 H new ATOM 0 HG21 THR A 96 0.371 -13.586 -13.478 1.00 0.00 H new ATOM 0 HG22 THR A 96 -0.471 -12.030 -13.284 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.002 -12.126 -14.276 1.00 0.00 H new ATOM 1477 N ASP A 97 0.400 -10.173 -9.899 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.674 -9.620 -9.080 1.00 0.00 C ATOM 1479 C ASP A 97 -0.798 -8.112 -9.283 1.00 0.00 C ATOM 1480 O ASP A 97 -1.906 -7.581 -9.369 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.430 -9.934 -7.602 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.912 -11.320 -7.208 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -1.034 -12.191 -8.098 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -1.160 -11.540 -6.004 1.00 0.00 O ATOM 0 H ASP A 97 1.143 -10.624 -9.366 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.610 -10.084 -9.392 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.636 -9.850 -7.388 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.937 -9.190 -6.988 1.00 0.00 H new ATOM 1489 N LYS A 98 0.346 -7.429 -9.367 1.00 0.00 N ATOM 1490 CA LYS A 98 0.363 -5.982 -9.573 1.00 0.00 C ATOM 1491 C LYS A 98 -0.361 -5.615 -10.870 1.00 0.00 C ATOM 1492 O LYS A 98 -0.979 -4.555 -10.965 1.00 0.00 O ATOM 1493 CB LYS A 98 1.806 -5.466 -9.614 1.00 0.00 C ATOM 1494 CG LYS A 98 1.990 -4.103 -8.958 1.00 0.00 C ATOM 1495 CD LYS A 98 2.798 -4.203 -7.672 1.00 0.00 C ATOM 1496 CE LYS A 98 4.283 -4.390 -7.954 1.00 0.00 C ATOM 1497 NZ LYS A 98 4.769 -5.725 -7.506 1.00 0.00 N ATOM 0 H LYS A 98 1.270 -7.855 -9.296 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.156 -5.511 -8.738 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.455 -6.188 -9.118 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.131 -5.406 -10.653 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.493 -3.430 -9.652 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.014 -3.668 -8.742 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.651 -3.301 -7.079 1.00 0.00 H new ATOM 0 HD3 LYS A 98 2.432 -5.039 -7.076 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.467 -4.276 -9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.850 -3.609 -7.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.599 -6.000 -8.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.033 -5.679 -6.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.015 -6.430 -7.634 1.00 0.00 H new ATOM 1511 N THR A 99 -0.285 -6.507 -11.860 1.00 0.00 N ATOM 1512 CA THR A 99 -0.937 -6.288 -13.150 1.00 0.00 C ATOM 1513 C THR A 99 -2.458 -6.365 -13.009 1.00 0.00 C ATOM 1514 O THR A 99 -3.181 -5.532 -13.556 1.00 0.00 O ATOM 1515 CB THR A 99 -0.449 -7.322 -14.172 1.00 0.00 C ATOM 1516 OG1 THR A 99 0.967 -7.346 -14.222 1.00 0.00 O ATOM 1517 CG2 THR A 99 -0.951 -7.068 -15.576 1.00 0.00 C ATOM 0 H THR A 99 0.223 -7.389 -11.791 1.00 0.00 H new ATOM 0 HA THR A 99 -0.674 -5.290 -13.502 1.00 0.00 H new ATOM 0 HB THR A 99 -0.852 -8.275 -13.829 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.260 -8.013 -14.878 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.566 -7.838 -16.245 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.041 -7.093 -15.583 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.608 -6.090 -15.914 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.932 -7.367 -12.267 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.360 -7.557 -12.044 1.00 0.00 C ATOM 1527 C LEU A 100 -4.960 -6.359 -11.309 1.00 0.00 C ATOM 1528 O LEU A 100 -6.009 -5.843 -11.699 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.600 -8.836 -11.241 1.00 0.00 C ATOM 1530 CG LEU A 100 -3.988 -10.107 -11.840 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -3.658 -11.112 -10.747 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -4.933 -10.723 -12.862 1.00 0.00 C ATOM 0 H LEU A 100 -2.341 -8.061 -11.809 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.849 -7.646 -13.014 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.198 -8.697 -10.237 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.675 -8.984 -11.136 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.061 -9.835 -12.345 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.225 -12.007 -11.194 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.944 -10.672 -10.051 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.569 -11.379 -10.211 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.482 -11.625 -13.277 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.876 -10.978 -12.378 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.118 -10.008 -13.663 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.283 -5.920 -10.247 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.742 -4.780 -9.457 1.00 0.00 C ATOM 1546 C VAL A 101 -4.668 -3.482 -10.265 1.00 0.00 C ATOM 1547 O VAL A 101 -5.497 -2.591 -10.096 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.918 -4.621 -8.160 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -4.529 -3.557 -7.259 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.809 -5.947 -7.421 1.00 0.00 C ATOM 0 H VAL A 101 -3.414 -6.338 -9.915 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.781 -4.978 -9.192 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.914 -4.301 -8.437 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.932 -3.462 -6.352 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.546 -2.602 -7.784 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.547 -3.844 -6.995 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.224 -5.810 -6.511 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.806 -6.302 -7.161 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.318 -6.681 -8.060 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.672 -3.386 -11.147 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.498 -2.201 -11.985 1.00 0.00 C ATOM 1562 C LYS A 102 -4.605 -2.107 -13.036 1.00 0.00 C ATOM 1563 O LYS A 102 -5.092 -1.017 -13.340 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.128 -2.237 -12.668 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.648 -0.881 -13.161 1.00 0.00 C ATOM 1566 CD LYS A 102 -0.789 -1.018 -14.409 1.00 0.00 C ATOM 1567 CE LYS A 102 -1.614 -0.866 -15.677 1.00 0.00 C ATOM 1568 NZ LYS A 102 -1.985 0.555 -15.934 1.00 0.00 N ATOM 0 H LYS A 102 -2.975 -4.115 -11.299 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.557 -1.320 -11.346 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.395 -2.638 -11.968 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.172 -2.925 -13.513 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.507 -0.245 -13.376 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.075 -0.388 -12.375 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.002 -0.264 -14.394 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.298 -1.991 -14.408 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.049 -1.253 -16.526 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -2.519 -1.468 -15.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.397 0.640 -16.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.681 0.865 -15.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -1.136 1.152 -15.870 1.00 0.00 H new ATOM 1582 N GLU A 103 -4.997 -3.258 -13.586 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.047 -3.309 -14.603 1.00 0.00 C ATOM 1584 C GLU A 103 -7.415 -2.962 -14.012 1.00 0.00 C ATOM 1585 O GLU A 103 -8.274 -2.414 -14.705 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.096 -4.698 -15.246 1.00 0.00 C ATOM 1587 CG GLU A 103 -5.546 -4.730 -16.663 1.00 0.00 C ATOM 1588 CD GLU A 103 -4.030 -4.780 -16.703 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -3.393 -3.742 -16.421 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -3.479 -5.855 -17.015 1.00 0.00 O ATOM 0 H GLU A 103 -4.603 -4.167 -13.344 1.00 0.00 H new ATOM 0 HA GLU A 103 -5.807 -2.567 -15.364 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.529 -5.395 -14.629 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.128 -5.048 -15.257 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -5.948 -5.599 -17.184 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -5.890 -3.847 -17.202 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.613 -3.284 -12.733 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.879 -3.003 -12.059 1.00 0.00 C ATOM 1599 C VAL A 104 -8.840 -1.646 -11.348 1.00 0.00 C ATOM 1600 O VAL A 104 -9.861 -0.963 -11.245 1.00 0.00 O ATOM 1601 CB VAL A 104 -9.240 -4.118 -11.048 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -8.230 -4.178 -9.910 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -10.650 -3.925 -10.506 1.00 0.00 C ATOM 0 H VAL A 104 -6.914 -3.738 -12.145 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.651 -2.971 -12.828 1.00 0.00 H new ATOM 0 HB VAL A 104 -9.205 -5.070 -11.578 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -8.510 -4.971 -9.216 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.239 -4.383 -10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -8.217 -3.223 -9.384 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.880 -4.721 -9.798 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.717 -2.961 -10.002 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.364 -3.955 -11.329 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.658 -1.257 -10.864 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.488 0.017 -10.173 1.00 0.00 C ATOM 1615 C VAL A 105 -6.436 0.877 -10.869 1.00 0.00 C ATOM 1616 O VAL A 105 -5.242 0.572 -10.831 1.00 0.00 O ATOM 1617 CB VAL A 105 -7.081 -0.185 -8.698 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -7.067 1.144 -7.956 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -8.013 -1.175 -8.014 1.00 0.00 C ATOM 0 H VAL A 105 -6.804 -1.810 -10.940 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.452 0.525 -10.203 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.072 -0.597 -8.676 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -6.778 0.978 -6.918 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.352 1.817 -8.429 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.061 1.589 -7.989 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.709 -1.303 -6.975 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -9.035 -0.797 -8.049 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.964 -2.135 -8.527 1.00 0.00 H new ATOM 1629 N GLN A 106 -6.890 1.950 -11.512 1.00 0.00 N ATOM 1630 CA GLN A 106 -5.996 2.857 -12.227 1.00 0.00 C ATOM 1631 C GLN A 106 -5.885 4.215 -11.526 1.00 0.00 C ATOM 1632 O GLN A 106 -4.942 4.969 -11.774 1.00 0.00 O ATOM 1633 CB GLN A 106 -6.486 3.043 -13.666 1.00 0.00 C ATOM 1634 CG GLN A 106 -6.107 1.893 -14.590 1.00 0.00 C ATOM 1635 CD GLN A 106 -7.308 1.092 -15.058 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -7.773 1.253 -16.185 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -7.816 0.220 -14.193 1.00 0.00 N ATOM 0 H GLN A 106 -7.875 2.213 -11.552 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.002 2.410 -12.236 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.570 3.152 -13.661 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.074 3.970 -14.065 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.580 2.289 -15.458 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -5.414 1.230 -14.072 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -7.399 0.118 -13.268 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -8.622 -0.347 -14.455 1.00 0.00 H new ATOM 1646 N ASN A 107 -6.847 4.525 -10.649 1.00 0.00 N ATOM 1647 CA ASN A 107 -6.844 5.794 -9.921 1.00 0.00 C ATOM 1648 C ASN A 107 -5.814 5.776 -8.792 1.00 0.00 C ATOM 1649 O ASN A 107 -6.160 5.572 -7.625 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.241 6.089 -9.354 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.134 6.802 -10.351 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.482 7.967 -10.164 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.515 6.104 -11.415 1.00 0.00 N ATOM 0 H ASN A 107 -7.634 3.915 -10.428 1.00 0.00 H new ATOM 0 HA ASN A 107 -6.571 6.583 -10.622 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.712 5.153 -9.053 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.144 6.700 -8.457 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.120 6.532 -12.116 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -9.203 5.140 -11.531 1.00 0.00 H new ATOM 1660 N PHE A 108 -4.549 5.989 -9.146 1.00 0.00 N ATOM 1661 CA PHE A 108 -3.466 5.999 -8.164 1.00 0.00 C ATOM 1662 C PHE A 108 -2.448 7.092 -8.480 1.00 0.00 C ATOM 1663 O PHE A 108 -2.373 7.575 -9.612 1.00 0.00 O ATOM 1664 CB PHE A 108 -2.776 4.632 -8.117 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.258 4.160 -9.448 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.100 4.698 -9.988 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -2.925 3.174 -10.156 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -0.620 4.263 -11.207 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.450 2.735 -11.377 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.296 3.280 -11.903 1.00 0.00 C ATOM 0 H PHE A 108 -4.248 6.157 -10.106 1.00 0.00 H new ATOM 0 HA PHE A 108 -3.900 6.210 -7.187 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -1.946 4.680 -7.412 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.480 3.895 -7.731 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.567 5.467 -9.448 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.828 2.743 -9.749 1.00 0.00 H new ATOM 0 HE1 PHE A 108 0.283 4.691 -11.616 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -2.981 1.966 -11.919 1.00 0.00 H new ATOM 0 HZ PHE A 108 -0.922 2.938 -12.857 1.00 0.00 H new ATOM 1680 N ALA A 109 -1.664 7.478 -7.474 1.00 0.00 N ATOM 1681 CA ALA A 109 -0.648 8.514 -7.646 1.00 0.00 C ATOM 1682 C ALA A 109 0.743 7.909 -7.815 1.00 0.00 C ATOM 1683 O ALA A 109 1.434 8.193 -8.794 1.00 0.00 O ATOM 1684 CB ALA A 109 -0.665 9.475 -6.464 1.00 0.00 C ATOM 0 H ALA A 109 -1.713 7.089 -6.532 1.00 0.00 H new ATOM 0 HA ALA A 109 -0.886 9.065 -8.556 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.097 10.241 -6.607 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.645 9.947 -6.393 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.460 8.925 -5.545 1.00 0.00 H new ATOM 1690 N LYS A 110 1.153 7.079 -6.854 1.00 0.00 N ATOM 1691 CA LYS A 110 2.466 6.442 -6.899 1.00 0.00 C ATOM 1692 C LYS A 110 2.370 4.950 -6.579 1.00 0.00 C ATOM 1693 O LYS A 110 1.491 4.521 -5.828 1.00 0.00 O ATOM 1694 CB LYS A 110 3.418 7.128 -5.915 1.00 0.00 C ATOM 1695 CG LYS A 110 4.804 7.382 -6.482 1.00 0.00 C ATOM 1696 CD LYS A 110 5.826 7.577 -5.374 1.00 0.00 C ATOM 1697 CE LYS A 110 7.157 8.066 -5.919 1.00 0.00 C ATOM 1698 NZ LYS A 110 8.143 6.957 -6.065 1.00 0.00 N ATOM 0 H LYS A 110 0.594 6.834 -6.037 1.00 0.00 H new ATOM 0 HA LYS A 110 2.856 6.547 -7.911 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.983 8.078 -5.604 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.508 6.511 -5.021 1.00 0.00 H new ATOM 0 HG2 LYS A 110 5.102 6.543 -7.111 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.782 8.266 -7.119 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.444 8.295 -4.648 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.973 6.636 -4.844 1.00 0.00 H new ATOM 0 HE2 LYS A 110 7.000 8.541 -6.887 1.00 0.00 H new ATOM 0 HE3 LYS A 110 7.564 8.827 -5.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.098 7.311 -5.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.904 6.191 -5.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.116 6.595 -7.039 1.00 0.00 H new ATOM 1712 N GLU A 111 3.282 4.168 -7.156 1.00 0.00 N ATOM 1713 CA GLU A 111 3.307 2.722 -6.940 1.00 0.00 C ATOM 1714 C GLU A 111 4.743 2.204 -6.851 1.00 0.00 C ATOM 1715 O GLU A 111 5.546 2.421 -7.760 1.00 0.00 O ATOM 1716 CB GLU A 111 2.563 2.004 -8.071 1.00 0.00 C ATOM 1717 CG GLU A 111 3.036 2.395 -9.464 1.00 0.00 C ATOM 1718 CD GLU A 111 3.197 1.198 -10.381 1.00 0.00 C ATOM 1719 OE1 GLU A 111 4.109 0.381 -10.136 1.00 0.00 O ATOM 1720 OE2 GLU A 111 2.408 1.077 -11.342 1.00 0.00 O ATOM 0 H GLU A 111 4.014 4.512 -7.777 1.00 0.00 H new ATOM 0 HA GLU A 111 2.808 2.514 -5.994 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.682 0.928 -7.946 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.498 2.218 -7.986 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.323 3.092 -9.904 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.988 2.920 -9.387 1.00 0.00 H new ATOM 1727 N PHE A 112 5.058 1.519 -5.754 1.00 0.00 N ATOM 1728 CA PHE A 112 6.399 0.971 -5.555 1.00 0.00 C ATOM 1729 C PHE A 112 6.395 -0.144 -4.513 1.00 0.00 C ATOM 1730 O PHE A 112 5.543 -0.175 -3.622 1.00 0.00 O ATOM 1731 CB PHE A 112 7.377 2.073 -5.135 1.00 0.00 C ATOM 1732 CG PHE A 112 6.903 2.897 -3.970 1.00 0.00 C ATOM 1733 CD1 PHE A 112 6.139 4.035 -4.176 1.00 0.00 C ATOM 1734 CD2 PHE A 112 7.223 2.536 -2.670 1.00 0.00 C ATOM 1735 CE1 PHE A 112 5.704 4.797 -3.109 1.00 0.00 C ATOM 1736 CE2 PHE A 112 6.790 3.295 -1.600 1.00 0.00 C ATOM 1737 CZ PHE A 112 6.030 4.426 -1.819 1.00 0.00 C ATOM 0 H PHE A 112 4.407 1.330 -4.992 1.00 0.00 H new ATOM 0 HA PHE A 112 6.725 0.550 -6.506 1.00 0.00 H new ATOM 0 HB2 PHE A 112 8.334 1.618 -4.880 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.554 2.732 -5.985 1.00 0.00 H new ATOM 0 HD1 PHE A 112 5.881 4.329 -5.182 1.00 0.00 H new ATOM 0 HD2 PHE A 112 7.817 1.652 -2.492 1.00 0.00 H new ATOM 0 HE1 PHE A 112 5.110 5.682 -3.283 1.00 0.00 H new ATOM 0 HE2 PHE A 112 7.046 3.003 -0.592 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.691 5.020 -0.983 1.00 0.00 H new ATOM 1747 N VAL A 113 7.358 -1.055 -4.629 1.00 0.00 N ATOM 1748 CA VAL A 113 7.484 -2.169 -3.705 1.00 0.00 C ATOM 1749 C VAL A 113 8.398 -1.808 -2.534 1.00 0.00 C ATOM 1750 O VAL A 113 9.273 -0.950 -2.661 1.00 0.00 O ATOM 1751 CB VAL A 113 8.039 -3.418 -4.418 1.00 0.00 C ATOM 1752 CG1 VAL A 113 6.975 -4.053 -5.303 1.00 0.00 C ATOM 1753 CG2 VAL A 113 9.280 -3.073 -5.234 1.00 0.00 C ATOM 0 H VAL A 113 8.067 -1.039 -5.363 1.00 0.00 H new ATOM 0 HA VAL A 113 6.487 -2.390 -3.324 1.00 0.00 H new ATOM 0 HB VAL A 113 8.325 -4.141 -3.654 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.389 -4.932 -5.796 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.122 -4.348 -4.692 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.651 -3.334 -6.056 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.652 -3.971 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.025 -2.325 -5.985 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.051 -2.676 -4.574 1.00 0.00 H new ATOM 1763 N ILE A 114 8.190 -2.467 -1.396 1.00 0.00 N ATOM 1764 CA ILE A 114 8.998 -2.216 -0.205 1.00 0.00 C ATOM 1765 C ILE A 114 9.328 -3.521 0.515 1.00 0.00 C ATOM 1766 O ILE A 114 8.498 -4.430 0.586 1.00 0.00 O ATOM 1767 CB ILE A 114 8.283 -1.257 0.776 1.00 0.00 C ATOM 1768 CG1 ILE A 114 7.906 0.048 0.069 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.167 -0.969 1.984 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.146 1.017 0.949 1.00 0.00 C ATOM 0 H ILE A 114 7.469 -3.178 -1.274 1.00 0.00 H new ATOM 0 HA ILE A 114 9.922 -1.746 -0.541 1.00 0.00 H new ATOM 0 HB ILE A 114 7.370 -1.740 1.124 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.814 0.532 -0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.301 -0.185 -0.807 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.647 -0.293 2.662 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.391 -1.902 2.502 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.097 -0.506 1.653 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.913 1.918 0.381 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.220 0.552 1.288 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.757 1.280 1.813 1.00 0.00 H new ATOM 1782 N SER A 115 10.546 -3.606 1.045 1.00 0.00 N ATOM 1783 CA SER A 115 10.993 -4.798 1.761 1.00 0.00 C ATOM 1784 C SER A 115 11.692 -4.432 3.072 1.00 0.00 C ATOM 1785 O SER A 115 12.526 -5.188 3.574 1.00 0.00 O ATOM 1786 CB SER A 115 11.936 -5.619 0.877 1.00 0.00 C ATOM 1787 OG SER A 115 11.698 -7.008 1.025 1.00 0.00 O ATOM 0 H SER A 115 11.242 -2.862 0.992 1.00 0.00 H new ATOM 0 HA SER A 115 10.113 -5.394 2.003 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.801 -5.333 -0.166 1.00 0.00 H new ATOM 0 HB3 SER A 115 12.970 -5.395 1.138 1.00 0.00 H new ATOM 0 HG SER A 115 10.767 -7.154 1.293 1.00 0.00 H new ATOM 1793 N ASP A 116 11.344 -3.268 3.624 1.00 0.00 N ATOM 1794 CA ASP A 116 11.932 -2.802 4.874 1.00 0.00 C ATOM 1795 C ASP A 116 10.874 -2.164 5.768 1.00 0.00 C ATOM 1796 O ASP A 116 10.004 -1.432 5.294 1.00 0.00 O ATOM 1797 CB ASP A 116 13.051 -1.799 4.592 1.00 0.00 C ATOM 1798 CG ASP A 116 13.917 -1.546 5.808 1.00 0.00 C ATOM 1799 OD1 ASP A 116 14.844 -2.345 6.057 1.00 0.00 O ATOM 1800 OD2 ASP A 116 13.663 -0.551 6.516 1.00 0.00 O ATOM 0 H ASP A 116 10.656 -2.632 3.221 1.00 0.00 H new ATOM 0 HA ASP A 116 12.349 -3.664 5.394 1.00 0.00 H new ATOM 0 HB2 ASP A 116 13.672 -2.171 3.777 1.00 0.00 H new ATOM 0 HB3 ASP A 116 12.616 -0.858 4.257 1.00 0.00 H new ATOM 1805 N ARG A 117 10.959 -2.447 7.066 1.00 0.00 N ATOM 1806 CA ARG A 117 10.014 -1.901 8.035 1.00 0.00 C ATOM 1807 C ARG A 117 10.179 -0.388 8.168 1.00 0.00 C ATOM 1808 O ARG A 117 9.196 0.338 8.324 1.00 0.00 O ATOM 1809 CB ARG A 117 10.201 -2.572 9.398 1.00 0.00 C ATOM 1810 CG ARG A 117 8.969 -2.500 10.287 1.00 0.00 C ATOM 1811 CD ARG A 117 9.258 -1.763 11.584 1.00 0.00 C ATOM 1812 NE ARG A 117 8.123 -1.812 12.505 1.00 0.00 N ATOM 1813 CZ ARG A 117 8.110 -1.233 13.707 1.00 0.00 C ATOM 1814 NH1 ARG A 117 9.169 -0.551 14.139 1.00 0.00 N ATOM 1815 NH2 ARG A 117 7.034 -1.332 14.479 1.00 0.00 N ATOM 0 H ARG A 117 11.674 -3.052 7.470 1.00 0.00 H new ATOM 0 HA ARG A 117 9.006 -2.105 7.675 1.00 0.00 H new ATOM 0 HB2 ARG A 117 10.468 -3.618 9.245 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.038 -2.102 9.913 1.00 0.00 H new ATOM 0 HG2 ARG A 117 8.163 -1.996 9.753 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.621 -3.509 10.511 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.133 -2.202 12.063 1.00 0.00 H new ATOM 0 HD3 ARG A 117 9.502 -0.724 11.364 1.00 0.00 H new ATOM 0 HE ARG A 117 7.289 -2.320 12.210 1.00 0.00 H new ATOM 0 HH11 ARG A 117 9.998 -0.468 13.550 1.00 0.00 H new ATOM 0 HH12 ARG A 117 9.152 -0.111 15.059 1.00 0.00 H new ATOM 0 HH21 ARG A 117 6.218 -1.850 14.153 1.00 0.00 H new ATOM 0 HH22 ARG A 117 7.023 -0.890 15.398 1.00 0.00 H new ATOM 1829 N LYS A 118 11.426 0.079 8.093 1.00 0.00 N ATOM 1830 CA LYS A 118 11.717 1.507 8.194 1.00 0.00 C ATOM 1831 C LYS A 118 11.139 2.258 6.996 1.00 0.00 C ATOM 1832 O LYS A 118 10.512 3.306 7.156 1.00 0.00 O ATOM 1833 CB LYS A 118 13.228 1.744 8.283 1.00 0.00 C ATOM 1834 CG LYS A 118 13.599 3.109 8.838 1.00 0.00 C ATOM 1835 CD LYS A 118 14.960 3.564 8.335 1.00 0.00 C ATOM 1836 CE LYS A 118 15.382 4.875 8.980 1.00 0.00 C ATOM 1837 NZ LYS A 118 16.389 5.604 8.161 1.00 0.00 N ATOM 0 H LYS A 118 12.248 -0.511 7.963 1.00 0.00 H new ATOM 0 HA LYS A 118 11.250 1.886 9.103 1.00 0.00 H new ATOM 0 HB2 LYS A 118 13.672 0.973 8.912 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.663 1.635 7.290 1.00 0.00 H new ATOM 0 HG2 LYS A 118 12.841 3.838 8.550 1.00 0.00 H new ATOM 0 HG3 LYS A 118 13.607 3.070 9.927 1.00 0.00 H new ATOM 0 HD2 LYS A 118 15.704 2.796 8.549 1.00 0.00 H new ATOM 0 HD3 LYS A 118 14.928 3.684 7.252 1.00 0.00 H new ATOM 0 HE2 LYS A 118 14.505 5.507 9.123 1.00 0.00 H new ATOM 0 HE3 LYS A 118 15.795 4.675 9.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 16.648 6.491 8.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 17.237 5.013 8.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 15.987 5.818 7.226 1.00 0.00 H new ATOM 1851 N GLU A 119 11.346 1.707 5.799 1.00 0.00 N ATOM 1852 CA GLU A 119 10.835 2.318 4.572 1.00 0.00 C ATOM 1853 C GLU A 119 9.308 2.244 4.516 1.00 0.00 C ATOM 1854 O GLU A 119 8.665 3.060 3.854 1.00 0.00 O ATOM 1855 CB GLU A 119 11.431 1.632 3.342 1.00 0.00 C ATOM 1856 CG GLU A 119 12.795 2.172 2.944 1.00 0.00 C ATOM 1857 CD GLU A 119 13.905 1.164 3.159 1.00 0.00 C ATOM 1858 OE1 GLU A 119 14.043 0.245 2.324 1.00 0.00 O ATOM 1859 OE2 GLU A 119 14.636 1.293 4.164 1.00 0.00 O ATOM 0 H GLU A 119 11.863 0.840 5.654 1.00 0.00 H new ATOM 0 HA GLU A 119 11.132 3.367 4.574 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.516 0.563 3.538 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.745 1.749 2.503 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.774 2.465 1.894 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.009 3.071 3.522 1.00 0.00 H new ATOM 1866 N LEU A 120 8.734 1.265 5.214 1.00 0.00 N ATOM 1867 CA LEU A 120 7.285 1.087 5.247 1.00 0.00 C ATOM 1868 C LEU A 120 6.621 2.162 6.107 1.00 0.00 C ATOM 1869 O LEU A 120 5.487 2.561 5.844 1.00 0.00 O ATOM 1870 CB LEU A 120 6.927 -0.301 5.791 1.00 0.00 C ATOM 1871 CG LEU A 120 6.528 -1.339 4.740 1.00 0.00 C ATOM 1872 CD1 LEU A 120 6.103 -2.635 5.414 1.00 0.00 C ATOM 1873 CD2 LEU A 120 5.411 -0.807 3.848 1.00 0.00 C ATOM 0 H LEU A 120 9.253 0.582 5.765 1.00 0.00 H new ATOM 0 HA LEU A 120 6.915 1.178 4.226 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.781 -0.685 6.349 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.106 -0.193 6.500 1.00 0.00 H new ATOM 0 HG LEU A 120 7.395 -1.541 4.111 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.822 -3.365 4.655 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.931 -3.027 6.005 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.251 -2.443 6.066 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.145 -1.563 3.109 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.539 -0.573 4.458 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.750 0.095 3.339 1.00 0.00 H new ATOM 1885 N GLU A 121 7.337 2.621 7.137 1.00 0.00 N ATOM 1886 CA GLU A 121 6.829 3.642 8.047 1.00 0.00 C ATOM 1887 C GLU A 121 6.261 4.836 7.283 1.00 0.00 C ATOM 1888 O GLU A 121 6.850 5.303 6.304 1.00 0.00 O ATOM 1889 CB GLU A 121 7.942 4.100 8.993 1.00 0.00 C ATOM 1890 CG GLU A 121 7.430 4.773 10.259 1.00 0.00 C ATOM 1891 CD GLU A 121 8.400 5.799 10.822 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.624 5.547 10.792 1.00 0.00 O ATOM 1893 OE2 GLU A 121 7.931 6.853 11.299 1.00 0.00 O ATOM 0 H GLU A 121 8.278 2.296 7.360 1.00 0.00 H new ATOM 0 HA GLU A 121 6.019 3.203 8.630 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.549 3.238 9.270 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.596 4.793 8.463 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.479 5.260 10.045 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.236 4.012 11.015 1.00 0.00 H new ATOM 1900 N GLU A 122 5.106 5.314 7.741 1.00 0.00 N ATOM 1901 CA GLU A 122 4.419 6.450 7.116 1.00 0.00 C ATOM 1902 C GLU A 122 5.360 7.634 6.879 1.00 0.00 C ATOM 1903 O GLU A 122 5.179 8.384 5.919 1.00 0.00 O ATOM 1904 CB GLU A 122 3.226 6.892 7.971 1.00 0.00 C ATOM 1905 CG GLU A 122 3.607 7.368 9.366 1.00 0.00 C ATOM 1906 CD GLU A 122 2.708 6.793 10.445 1.00 0.00 C ATOM 1907 OE1 GLU A 122 1.496 7.094 10.431 1.00 0.00 O ATOM 1908 OE2 GLU A 122 3.216 6.039 11.302 1.00 0.00 O ATOM 0 H GLU A 122 4.619 4.930 8.551 1.00 0.00 H new ATOM 0 HA GLU A 122 4.062 6.112 6.143 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.700 7.695 7.455 1.00 0.00 H new ATOM 0 HB3 GLU A 122 2.528 6.060 8.060 1.00 0.00 H new ATOM 0 HG2 GLU A 122 4.640 7.088 9.572 1.00 0.00 H new ATOM 0 HG3 GLU A 122 3.559 8.456 9.400 1.00 0.00 H new ATOM 1915 N ASN A 123 6.363 7.794 7.744 1.00 0.00 N ATOM 1916 CA ASN A 123 7.323 8.888 7.601 1.00 0.00 C ATOM 1917 C ASN A 123 8.042 8.788 6.259 1.00 0.00 C ATOM 1918 O ASN A 123 8.248 9.791 5.575 1.00 0.00 O ATOM 1919 CB ASN A 123 8.345 8.863 8.744 1.00 0.00 C ATOM 1920 CG ASN A 123 8.166 10.021 9.710 1.00 0.00 C ATOM 1921 OD1 ASN A 123 8.177 11.186 9.309 1.00 0.00 O ATOM 1922 ND2 ASN A 123 8.002 9.709 10.991 1.00 0.00 N ATOM 0 H ASN A 123 6.531 7.185 8.545 1.00 0.00 H new ATOM 0 HA ASN A 123 6.777 9.830 7.642 1.00 0.00 H new ATOM 0 HB2 ASN A 123 8.254 7.923 9.288 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.352 8.894 8.328 1.00 0.00 H new ATOM 0 HD21 ASN A 123 7.879 10.447 11.684 1.00 0.00 H new ATOM 0 HD22 ASN A 123 7.999 8.731 11.281 1.00 0.00 H new ATOM 1929 N PHE A 124 8.411 7.564 5.891 1.00 0.00 N ATOM 1930 CA PHE A 124 9.098 7.309 4.632 1.00 0.00 C ATOM 1931 C PHE A 124 8.125 7.352 3.456 1.00 0.00 C ATOM 1932 O PHE A 124 8.428 7.928 2.409 1.00 0.00 O ATOM 1933 CB PHE A 124 9.790 5.947 4.684 1.00 0.00 C ATOM 1934 CG PHE A 124 10.726 5.710 3.536 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.240 5.329 2.297 1.00 0.00 C ATOM 1936 CD2 PHE A 124 12.093 5.871 3.696 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.097 5.114 1.237 1.00 0.00 C ATOM 1938 CE2 PHE A 124 12.956 5.656 2.640 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.457 5.277 1.408 1.00 0.00 C ATOM 0 H PHE A 124 8.243 6.729 6.453 1.00 0.00 H new ATOM 0 HA PHE A 124 9.844 8.091 4.486 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.345 5.865 5.619 1.00 0.00 H new ATOM 0 HB3 PHE A 124 9.033 5.163 4.693 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.177 5.198 2.158 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.487 6.168 4.657 1.00 0.00 H new ATOM 0 HE1 PHE A 124 10.704 4.819 0.275 1.00 0.00 H new ATOM 0 HE2 PHE A 124 14.020 5.784 2.776 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.130 5.109 0.580 1.00 0.00 H new ATOM 1949 N ILE A 125 6.957 6.735 3.635 1.00 0.00 N ATOM 1950 CA ILE A 125 5.933 6.692 2.592 1.00 0.00 C ATOM 1951 C ILE A 125 5.473 8.098 2.209 1.00 0.00 C ATOM 1952 O ILE A 125 5.383 8.428 1.026 1.00 0.00 O ATOM 1953 CB ILE A 125 4.707 5.863 3.034 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.143 4.480 3.530 1.00 0.00 C ATOM 1955 CG2 ILE A 125 3.710 5.730 1.892 1.00 0.00 C ATOM 1956 CD1 ILE A 125 5.966 3.701 2.525 1.00 0.00 C ATOM 0 H ILE A 125 6.696 6.256 4.497 1.00 0.00 H new ATOM 0 HA ILE A 125 6.390 6.214 1.725 1.00 0.00 H new ATOM 0 HB ILE A 125 4.219 6.386 3.857 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.722 4.599 4.446 1.00 0.00 H new ATOM 0 HG13 ILE A 125 4.256 3.900 3.787 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.854 5.143 2.223 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.374 6.720 1.585 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.187 5.231 1.048 1.00 0.00 H new ATOM 0 HD11 ILE A 125 6.237 2.734 2.948 1.00 0.00 H new ATOM 0 HD12 ILE A 125 5.383 3.549 1.617 1.00 0.00 H new ATOM 0 HD13 ILE A 125 6.872 4.259 2.286 1.00 0.00 H new ATOM 1968 N LYS A 126 5.184 8.918 3.218 1.00 0.00 N ATOM 1969 CA LYS A 126 4.734 10.290 2.992 1.00 0.00 C ATOM 1970 C LYS A 126 5.809 11.112 2.278 1.00 0.00 C ATOM 1971 O LYS A 126 5.492 12.001 1.485 1.00 0.00 O ATOM 1972 CB LYS A 126 4.357 10.949 4.323 1.00 0.00 C ATOM 1973 CG LYS A 126 3.155 11.876 4.232 1.00 0.00 C ATOM 1974 CD LYS A 126 3.233 12.993 5.260 1.00 0.00 C ATOM 1975 CE LYS A 126 2.401 12.677 6.496 1.00 0.00 C ATOM 1976 NZ LYS A 126 2.155 13.889 7.329 1.00 0.00 N ATOM 0 H LYS A 126 5.254 8.655 4.201 1.00 0.00 H new ATOM 0 HA LYS A 126 3.853 10.257 2.351 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.148 10.170 5.057 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.212 11.514 4.693 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.100 12.304 3.231 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.240 11.303 4.384 1.00 0.00 H new ATOM 0 HD2 LYS A 126 4.272 13.149 5.550 1.00 0.00 H new ATOM 0 HD3 LYS A 126 2.883 13.924 4.814 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.447 12.247 6.191 1.00 0.00 H new ATOM 0 HE3 LYS A 126 2.913 11.924 7.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 1.585 13.630 8.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 3.064 14.285 7.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 1.644 14.599 6.767 1.00 0.00 H new ATOM 1990 N SER A 127 7.078 10.807 2.557 1.00 0.00 N ATOM 1991 CA SER A 127 8.195 11.515 1.934 1.00 0.00 C ATOM 1992 C SER A 127 8.280 11.181 0.444 1.00 0.00 C ATOM 1993 O SER A 127 8.404 12.075 -0.394 1.00 0.00 O ATOM 1994 CB SER A 127 9.511 11.153 2.630 1.00 0.00 C ATOM 1995 OG SER A 127 10.574 11.976 2.178 1.00 0.00 O ATOM 0 H SER A 127 7.356 10.075 3.210 1.00 0.00 H new ATOM 0 HA SER A 127 8.023 12.586 2.041 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.397 11.262 3.709 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.751 10.107 2.439 1.00 0.00 H new ATOM 0 HG SER A 127 11.401 11.725 2.639 1.00 0.00 H new ATOM 2001 N GLU A 128 8.204 9.889 0.124 1.00 0.00 N ATOM 2002 CA GLU A 128 8.266 9.429 -1.261 1.00 0.00 C ATOM 2003 C GLU A 128 7.045 9.900 -2.054 1.00 0.00 C ATOM 2004 O GLU A 128 7.164 10.290 -3.218 1.00 0.00 O ATOM 2005 CB GLU A 128 8.367 7.901 -1.303 1.00 0.00 C ATOM 2006 CG GLU A 128 8.615 7.338 -2.695 1.00 0.00 C ATOM 2007 CD GLU A 128 9.851 7.920 -3.357 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.971 7.503 -2.995 1.00 0.00 O ATOM 2009 OE2 GLU A 128 9.700 8.791 -4.238 1.00 0.00 O ATOM 0 H GLU A 128 8.099 9.141 0.809 1.00 0.00 H new ATOM 0 HA GLU A 128 9.155 9.859 -1.723 1.00 0.00 H new ATOM 0 HB2 GLU A 128 9.174 7.582 -0.643 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.445 7.475 -0.908 1.00 0.00 H new ATOM 0 HG2 GLU A 128 8.720 6.255 -2.630 1.00 0.00 H new ATOM 0 HG3 GLU A 128 7.746 7.537 -3.322 1.00 0.00 H new ATOM 2016 N LEU A 129 5.873 9.861 -1.419 1.00 0.00 N ATOM 2017 CA LEU A 129 4.630 10.283 -2.067 1.00 0.00 C ATOM 2018 C LEU A 129 4.677 11.758 -2.473 1.00 0.00 C ATOM 2019 O LEU A 129 3.955 12.178 -3.379 1.00 0.00 O ATOM 2020 CB LEU A 129 3.433 10.035 -1.144 1.00 0.00 C ATOM 2021 CG LEU A 129 2.568 8.828 -1.521 1.00 0.00 C ATOM 2022 CD1 LEU A 129 3.107 7.563 -0.873 1.00 0.00 C ATOM 2023 CD2 LEU A 129 1.119 9.062 -1.118 1.00 0.00 C ATOM 0 H LEU A 129 5.758 9.542 -0.457 1.00 0.00 H new ATOM 0 HA LEU A 129 4.516 9.687 -2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.799 9.898 -0.127 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.805 10.926 -1.139 1.00 0.00 H new ATOM 0 HG LEU A 129 2.606 8.702 -2.603 1.00 0.00 H new ATOM 0 HD11 LEU A 129 2.480 6.716 -1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 129 4.128 7.387 -1.213 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.100 7.678 0.211 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.520 8.194 -1.394 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.061 9.215 -0.040 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.737 9.945 -1.631 1.00 0.00 H new ATOM 2035 N LYS A 130 5.530 12.540 -1.804 1.00 0.00 N ATOM 2036 CA LYS A 130 5.668 13.963 -2.108 1.00 0.00 C ATOM 2037 C LYS A 130 6.037 14.183 -3.574 1.00 0.00 C ATOM 2038 O LYS A 130 5.613 15.163 -4.187 1.00 0.00 O ATOM 2039 CB LYS A 130 6.728 14.597 -1.206 1.00 0.00 C ATOM 2040 CG LYS A 130 6.395 16.016 -0.783 1.00 0.00 C ATOM 2041 CD LYS A 130 5.229 16.048 0.193 1.00 0.00 C ATOM 2042 CE LYS A 130 4.959 17.459 0.690 1.00 0.00 C ATOM 2043 NZ LYS A 130 6.093 17.993 1.494 1.00 0.00 N ATOM 0 H LYS A 130 6.133 12.210 -1.050 1.00 0.00 H new ATOM 0 HA LYS A 130 4.705 14.439 -1.922 1.00 0.00 H new ATOM 0 HB2 LYS A 130 6.851 13.981 -0.315 1.00 0.00 H new ATOM 0 HB3 LYS A 130 7.685 14.597 -1.728 1.00 0.00 H new ATOM 0 HG2 LYS A 130 7.270 16.474 -0.321 1.00 0.00 H new ATOM 0 HG3 LYS A 130 6.151 16.611 -1.663 1.00 0.00 H new ATOM 0 HD2 LYS A 130 4.336 15.655 -0.292 1.00 0.00 H new ATOM 0 HD3 LYS A 130 5.444 15.397 1.041 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.778 18.115 -0.161 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.052 17.463 1.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.780 18.834 2.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.416 17.266 2.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.876 18.253 0.860 1.00 0.00 H new