USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 928 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 34 SER OG : rot -19:sc= 0.499 USER MOD Set 1.2: A 46 TYR OH : rot 179:sc= -2.13! USER MOD Set 2.1: A 3 CYS SG : rot -98:sc= -1.1 USER MOD Set 2.2: A 5 CYS SG : rot -111:sc= -6.78! USER MOD Set 2.3: A 7 SER OG : rot 34:sc= -0.0538 USER MOD Set 2.4: A 14 CYS SG : rot -76:sc= 0.0548 USER MOD Set 2.5: A 15 CYS SG : rot 98:sc= -6.11! USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot -119:sc= 1.55 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= -0.781 USER MOD Single : A 27 SER OG : rot -13:sc= 0.9 USER MOD Single : A 32 MET CE :methyl -166:sc= -3.06! (180deg=-3.37!) USER MOD Single : A 36 TYR OH : rot 180:sc= -0.419 USER MOD Single : A 39 TYR OH : rot -162:sc= 0.0375 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -68:sc= 1.14 USER MOD Single : A 51 THR OG1 : rot -156:sc= 1.42 USER MOD Single : A 61 HIS : no HD1:sc= 0.394 K(o=0.39,f=-1.3) USER MOD Single : A 64 ASN :FLIP amide:sc= -1.79! C(o=-2.8!,f=-1.8!) USER MOD Single : A 68 MET CE :methyl -154:sc= -2.89! (180deg=-3.27!) USER MOD Single : A 71 SER OG : rot 152:sc= 0.85 USER MOD Single : A 81 SER OG : rot 130:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc=-0.00453 USER MOD Single : A 104 GLN :FLIP amide:sc= -0.315 F(o=-2.2,f=-0.31) USER MOD Single : A 105 SER OG : rot 42:sc= 0.12 USER MOD Single : A 106 HIS : no HD1:sc= -0.213 X(o=-0.21,f=-0.083) USER MOD Single : A 107 HIS : no HD1:sc= 0.466 K(o=0.47,f=-2.9!) USER MOD Single : A 110 SER OG : rot -109:sc= 0.921 USER MOD Single : A 111 GLN :FLIP amide:sc= -0.948 F(o=-1.9,f=-0.95) USER MOD Single : A 114 LYS NZ :NH3+ 158:sc= 0.944 (180deg=0.641) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -63:sc= 0.123 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.943 -4.357 -1.614 1.00 0.00 N ATOM 35 CA CYS A 3 -3.103 -5.115 -1.162 1.00 0.00 C ATOM 36 C CYS A 3 -2.691 -6.480 -0.639 1.00 0.00 C ATOM 37 O CYS A 3 -1.762 -7.090 -1.165 1.00 0.00 O ATOM 38 CB CYS A 3 -4.075 -5.303 -2.326 1.00 0.00 C ATOM 39 SG CYS A 3 -5.781 -5.686 -1.831 1.00 0.00 S ATOM 0 HA CYS A 3 -3.581 -4.559 -0.356 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -4.080 -4.395 -2.928 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -3.707 -6.106 -2.964 1.00 0.00 H new ATOM 0 HG CYS A 3 -5.976 -6.969 -1.903 1.00 0.00 H new ATOM 44 N VAL A 4 -3.394 -6.959 0.382 1.00 0.00 N ATOM 45 CA VAL A 4 -3.214 -8.327 0.859 1.00 0.00 C ATOM 46 C VAL A 4 -3.739 -9.318 -0.183 1.00 0.00 C ATOM 47 O VAL A 4 -4.854 -9.833 -0.095 1.00 0.00 O ATOM 48 CB VAL A 4 -3.896 -8.559 2.230 1.00 0.00 C ATOM 49 CG1 VAL A 4 -3.133 -7.824 3.327 1.00 0.00 C ATOM 50 CG2 VAL A 4 -5.353 -8.109 2.190 1.00 0.00 C ATOM 0 H VAL A 4 -4.093 -6.422 0.895 1.00 0.00 H new ATOM 0 HA VAL A 4 -2.146 -8.492 1.003 1.00 0.00 H new ATOM 0 HB VAL A 4 -3.879 -9.626 2.451 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -3.621 -7.994 4.286 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -2.109 -8.196 3.370 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -3.122 -6.756 3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.814 -8.281 3.163 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -5.399 -7.047 1.949 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.889 -8.677 1.430 1.00 0.00 H new ATOM 60 N CYS A 5 -2.928 -9.515 -1.201 1.00 0.00 N ATOM 61 CA CYS A 5 -3.234 -10.398 -2.320 1.00 0.00 C ATOM 62 C CYS A 5 -1.958 -10.650 -3.107 1.00 0.00 C ATOM 63 O CYS A 5 -1.115 -9.758 -3.199 1.00 0.00 O ATOM 64 CB CYS A 5 -4.278 -9.778 -3.264 1.00 0.00 C ATOM 65 SG CYS A 5 -5.900 -9.424 -2.519 1.00 0.00 S ATOM 0 H CYS A 5 -2.019 -9.060 -1.281 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.642 -11.326 -1.919 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -3.872 -8.849 -3.666 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -4.425 -10.453 -4.107 1.00 0.00 H new ATOM 0 HG CYS A 5 -6.789 -10.237 -3.008 1.00 0.00 H new ATOM 70 N GLY A 6 -1.815 -11.850 -3.665 1.00 0.00 N ATOM 71 CA GLY A 6 -0.703 -12.131 -4.559 1.00 0.00 C ATOM 72 C GLY A 6 -0.792 -11.302 -5.828 1.00 0.00 C ATOM 73 O GLY A 6 -1.119 -11.818 -6.898 1.00 0.00 O ATOM 0 H GLY A 6 -2.450 -12.634 -3.514 1.00 0.00 H new ATOM 0 HA2 GLY A 6 0.238 -11.921 -4.050 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -0.697 -13.191 -4.814 1.00 0.00 H new ATOM 77 N SER A 7 -0.506 -10.011 -5.694 1.00 0.00 N ATOM 78 CA SER A 7 -0.684 -9.049 -6.768 1.00 0.00 C ATOM 79 C SER A 7 -0.058 -7.715 -6.370 1.00 0.00 C ATOM 80 O SER A 7 -0.336 -7.201 -5.282 1.00 0.00 O ATOM 81 CB SER A 7 -2.184 -8.860 -7.046 1.00 0.00 C ATOM 82 OG SER A 7 -2.879 -8.538 -5.846 1.00 0.00 O ATOM 0 H SER A 7 -0.143 -9.604 -4.832 1.00 0.00 H new ATOM 0 HA SER A 7 -0.196 -9.418 -7.670 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.326 -8.066 -7.779 1.00 0.00 H new ATOM 0 HB3 SER A 7 -2.597 -9.771 -7.479 1.00 0.00 H new ATOM 0 HG SER A 7 -2.298 -8.005 -5.264 1.00 0.00 H new ATOM 88 N GLY A 8 0.773 -7.159 -7.245 1.00 0.00 N ATOM 89 CA GLY A 8 1.403 -5.877 -6.981 1.00 0.00 C ATOM 90 C GLY A 8 0.451 -4.724 -7.218 1.00 0.00 C ATOM 91 O GLY A 8 0.704 -3.852 -8.050 1.00 0.00 O ATOM 0 H GLY A 8 1.024 -7.578 -8.141 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.756 -5.851 -5.950 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.278 -5.763 -7.621 1.00 0.00 H new ATOM 95 N LYS A 9 -0.664 -4.738 -6.495 1.00 0.00 N ATOM 96 CA LYS A 9 -1.699 -3.717 -6.630 1.00 0.00 C ATOM 97 C LYS A 9 -2.144 -3.244 -5.254 1.00 0.00 C ATOM 98 O LYS A 9 -1.989 -3.961 -4.262 1.00 0.00 O ATOM 99 CB LYS A 9 -2.911 -4.277 -7.389 1.00 0.00 C ATOM 100 CG LYS A 9 -2.557 -4.990 -8.694 1.00 0.00 C ATOM 101 CD LYS A 9 -3.075 -4.259 -9.933 1.00 0.00 C ATOM 102 CE LYS A 9 -2.482 -2.861 -10.067 1.00 0.00 C ATOM 103 NZ LYS A 9 -2.925 -2.187 -11.317 1.00 0.00 N ATOM 0 H LYS A 9 -0.876 -5.455 -5.801 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.284 -2.879 -7.190 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.442 -4.973 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.597 -3.459 -7.609 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.474 -5.091 -8.764 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.970 -5.998 -8.674 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.834 -4.841 -10.823 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -4.162 -4.188 -9.883 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -2.774 -2.259 -9.207 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -1.394 -2.926 -10.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -2.500 -1.239 -11.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.624 -2.748 -12.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.961 -2.102 -11.317 1.00 0.00 H new ATOM 117 N THR A 10 -2.727 -2.056 -5.208 1.00 0.00 N ATOM 118 CA THR A 10 -3.196 -1.471 -3.956 1.00 0.00 C ATOM 119 C THR A 10 -4.526 -2.094 -3.548 1.00 0.00 C ATOM 120 O THR A 10 -5.060 -2.955 -4.257 1.00 0.00 O ATOM 121 CB THR A 10 -3.383 0.056 -4.085 1.00 0.00 C ATOM 122 OG1 THR A 10 -4.457 0.336 -4.991 1.00 0.00 O ATOM 123 CG2 THR A 10 -2.109 0.725 -4.584 1.00 0.00 C ATOM 0 H THR A 10 -2.889 -1.472 -6.029 1.00 0.00 H new ATOM 0 HA THR A 10 -2.439 -1.673 -3.198 1.00 0.00 H new ATOM 0 HB THR A 10 -3.617 0.455 -3.098 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.116 0.847 -5.754 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.270 1.800 -4.665 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.298 0.532 -3.882 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.846 0.323 -5.562 1.00 0.00 H new ATOM 131 N TYR A 11 -5.062 -1.675 -2.406 1.00 0.00 N ATOM 132 CA TYR A 11 -6.391 -2.105 -1.997 1.00 0.00 C ATOM 133 C TYR A 11 -7.406 -1.696 -3.057 1.00 0.00 C ATOM 134 O TYR A 11 -8.153 -2.533 -3.580 1.00 0.00 O ATOM 135 CB TYR A 11 -6.779 -1.496 -0.639 1.00 0.00 C ATOM 136 CG TYR A 11 -8.263 -1.624 -0.326 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.806 -2.837 0.076 1.00 0.00 C ATOM 138 CD2 TYR A 11 -9.124 -0.535 -0.463 1.00 0.00 C ATOM 139 CE1 TYR A 11 -10.157 -2.962 0.337 1.00 0.00 C ATOM 140 CE2 TYR A 11 -10.476 -0.658 -0.208 1.00 0.00 C ATOM 141 CZ TYR A 11 -10.987 -1.872 0.192 1.00 0.00 C ATOM 142 OH TYR A 11 -12.334 -2.004 0.439 1.00 0.00 O ATOM 0 H TYR A 11 -4.599 -1.043 -1.753 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.385 -3.190 -1.891 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -6.205 -1.985 0.148 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.502 -0.442 -0.628 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -8.162 -3.697 0.186 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.727 0.420 -0.774 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -10.561 -3.912 0.654 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -11.129 0.194 -0.322 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.779 -1.143 0.292 1.00 0.00 H new ATOM 152 N ASP A 12 -7.386 -0.410 -3.383 1.00 0.00 N ATOM 153 CA ASP A 12 -8.339 0.189 -4.311 1.00 0.00 C ATOM 154 C ASP A 12 -8.177 -0.413 -5.702 1.00 0.00 C ATOM 155 O ASP A 12 -9.117 -0.981 -6.255 1.00 0.00 O ATOM 156 CB ASP A 12 -8.127 1.709 -4.370 1.00 0.00 C ATOM 157 CG ASP A 12 -8.030 2.343 -2.989 1.00 0.00 C ATOM 158 OD1 ASP A 12 -6.945 2.258 -2.365 1.00 0.00 O ATOM 159 OD2 ASP A 12 -9.025 2.924 -2.514 1.00 0.00 O ATOM 0 H ASP A 12 -6.705 0.251 -3.010 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.349 -0.018 -3.957 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.216 1.923 -4.928 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.951 2.166 -4.918 1.00 0.00 H new ATOM 164 N ASP A 13 -6.958 -0.324 -6.236 1.00 0.00 N ATOM 165 CA ASP A 13 -6.653 -0.820 -7.584 1.00 0.00 C ATOM 166 C ASP A 13 -6.981 -2.304 -7.722 1.00 0.00 C ATOM 167 O ASP A 13 -7.245 -2.793 -8.820 1.00 0.00 O ATOM 168 CB ASP A 13 -5.170 -0.588 -7.930 1.00 0.00 C ATOM 169 CG ASP A 13 -4.858 0.859 -8.287 1.00 0.00 C ATOM 170 OD1 ASP A 13 -4.956 1.212 -9.483 1.00 0.00 O ATOM 171 OD2 ASP A 13 -4.504 1.646 -7.383 1.00 0.00 O ATOM 0 H ASP A 13 -6.160 0.089 -5.754 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.277 -0.261 -8.281 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.554 -0.887 -7.082 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -4.894 -1.230 -8.767 1.00 0.00 H new ATOM 176 N CYS A 14 -6.945 -3.023 -6.608 1.00 0.00 N ATOM 177 CA CYS A 14 -7.215 -4.459 -6.617 1.00 0.00 C ATOM 178 C CYS A 14 -8.640 -4.779 -6.131 1.00 0.00 C ATOM 179 O CYS A 14 -9.546 -4.968 -6.939 1.00 0.00 O ATOM 180 CB CYS A 14 -6.157 -5.191 -5.779 1.00 0.00 C ATOM 181 SG CYS A 14 -6.550 -6.919 -5.367 1.00 0.00 S ATOM 0 H CYS A 14 -6.732 -2.639 -5.687 1.00 0.00 H new ATOM 0 HA CYS A 14 -7.153 -4.813 -7.646 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -5.211 -5.170 -6.320 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -6.006 -4.639 -4.851 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.435 -6.948 -4.415 1.00 0.00 H new ATOM 186 N CYS A 15 -8.837 -4.846 -4.812 1.00 0.00 N ATOM 187 CA CYS A 15 -10.129 -5.265 -4.245 1.00 0.00 C ATOM 188 C CYS A 15 -11.211 -4.188 -4.345 1.00 0.00 C ATOM 189 O CYS A 15 -12.394 -4.512 -4.302 1.00 0.00 O ATOM 190 CB CYS A 15 -9.974 -5.714 -2.785 1.00 0.00 C ATOM 191 SG CYS A 15 -9.135 -7.320 -2.594 1.00 0.00 S ATOM 0 H CYS A 15 -8.126 -4.618 -4.117 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.458 -6.109 -4.851 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.414 -4.955 -2.239 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.961 -5.774 -2.326 1.00 0.00 H new ATOM 0 HG CYS A 15 -7.881 -7.124 -2.311 1.00 0.00 H new ATOM 196 N GLY A 16 -10.807 -2.924 -4.486 1.00 0.00 N ATOM 197 CA GLY A 16 -11.745 -1.808 -4.357 1.00 0.00 C ATOM 198 C GLY A 16 -13.016 -1.945 -5.195 1.00 0.00 C ATOM 199 O GLY A 16 -14.118 -1.926 -4.642 1.00 0.00 O ATOM 0 H GLY A 16 -9.846 -2.649 -4.688 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -12.026 -1.706 -3.309 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.235 -0.887 -4.642 1.00 0.00 H new ATOM 203 N PRO A 17 -12.904 -2.134 -6.526 1.00 0.00 N ATOM 204 CA PRO A 17 -14.081 -2.241 -7.405 1.00 0.00 C ATOM 205 C PRO A 17 -14.874 -3.524 -7.157 1.00 0.00 C ATOM 206 O PRO A 17 -16.086 -3.583 -7.398 1.00 0.00 O ATOM 207 CB PRO A 17 -13.473 -2.236 -8.816 1.00 0.00 C ATOM 208 CG PRO A 17 -12.081 -2.736 -8.630 1.00 0.00 C ATOM 209 CD PRO A 17 -11.640 -2.226 -7.286 1.00 0.00 C ATOM 0 HA PRO A 17 -14.795 -1.435 -7.237 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -14.037 -2.878 -9.493 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -13.480 -1.235 -9.247 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -12.048 -3.825 -8.665 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -11.425 -2.372 -9.421 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.933 -2.906 -6.810 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.147 -1.257 -7.365 1.00 0.00 H new ATOM 217 N LEU A 18 -14.179 -4.546 -6.665 1.00 0.00 N ATOM 218 CA LEU A 18 -14.791 -5.841 -6.387 1.00 0.00 C ATOM 219 C LEU A 18 -15.636 -5.783 -5.118 1.00 0.00 C ATOM 220 O LEU A 18 -16.776 -6.250 -5.097 1.00 0.00 O ATOM 221 CB LEU A 18 -13.713 -6.934 -6.260 1.00 0.00 C ATOM 222 CG LEU A 18 -13.160 -7.486 -7.587 1.00 0.00 C ATOM 223 CD1 LEU A 18 -14.294 -7.996 -8.467 1.00 0.00 C ATOM 224 CD2 LEU A 18 -12.327 -6.440 -8.325 1.00 0.00 C ATOM 0 H LEU A 18 -13.183 -4.501 -6.449 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.444 -6.091 -7.223 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.882 -6.533 -5.681 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -14.129 -7.764 -5.688 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.501 -8.322 -7.352 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.885 -8.382 -9.400 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.828 -8.792 -7.948 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.982 -7.179 -8.683 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.953 -6.864 -9.257 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.947 -5.571 -8.545 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.486 -6.138 -7.701 1.00 0.00 H new ATOM 236 N LEU A 19 -15.068 -5.206 -4.066 1.00 0.00 N ATOM 237 CA LEU A 19 -15.764 -5.053 -2.792 1.00 0.00 C ATOM 238 C LEU A 19 -16.921 -4.074 -2.938 1.00 0.00 C ATOM 239 O LEU A 19 -17.969 -4.242 -2.317 1.00 0.00 O ATOM 240 CB LEU A 19 -14.782 -4.591 -1.703 1.00 0.00 C ATOM 241 CG LEU A 19 -13.975 -5.718 -1.033 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.786 -5.153 -0.263 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.870 -6.530 -0.103 1.00 0.00 C ATOM 0 H LEU A 19 -14.119 -4.833 -4.070 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.173 -6.018 -2.493 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -14.085 -3.878 -2.143 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.341 -4.058 -0.934 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.593 -6.374 -1.815 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -12.232 -5.969 0.201 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -12.132 -4.614 -0.948 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -13.143 -4.472 0.509 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -14.286 -7.323 0.363 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.279 -5.878 0.669 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -15.686 -6.970 -0.676 1.00 0.00 H new ATOM 255 N ALA A 20 -16.729 -3.062 -3.780 1.00 0.00 N ATOM 256 CA ALA A 20 -17.786 -2.104 -4.089 1.00 0.00 C ATOM 257 C ALA A 20 -18.942 -2.791 -4.820 1.00 0.00 C ATOM 258 O ALA A 20 -20.053 -2.262 -4.875 1.00 0.00 O ATOM 259 CB ALA A 20 -17.232 -0.956 -4.926 1.00 0.00 C ATOM 0 H ALA A 20 -15.848 -2.884 -4.262 1.00 0.00 H new ATOM 0 HA ALA A 20 -18.168 -1.699 -3.152 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -18.031 -0.249 -5.149 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -16.443 -0.448 -4.371 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -16.825 -1.349 -5.858 1.00 0.00 H new ATOM 265 N ARG A 21 -18.658 -3.974 -5.383 1.00 0.00 N ATOM 266 CA ARG A 21 -19.656 -4.773 -6.103 1.00 0.00 C ATOM 267 C ARG A 21 -20.118 -4.048 -7.368 1.00 0.00 C ATOM 268 O ARG A 21 -21.138 -4.394 -7.965 1.00 0.00 O ATOM 269 CB ARG A 21 -20.855 -5.094 -5.189 1.00 0.00 C ATOM 270 CG ARG A 21 -20.472 -5.850 -3.917 1.00 0.00 C ATOM 271 CD ARG A 21 -20.013 -7.278 -4.210 1.00 0.00 C ATOM 272 NE ARG A 21 -21.130 -8.145 -4.600 1.00 0.00 N ATOM 273 CZ ARG A 21 -21.063 -9.477 -4.682 1.00 0.00 C ATOM 274 NH1 ARG A 21 -19.910 -10.108 -4.489 1.00 0.00 N ATOM 275 NH2 ARG A 21 -22.153 -10.178 -4.961 1.00 0.00 N ATOM 0 H ARG A 21 -17.733 -4.402 -5.352 1.00 0.00 H new ATOM 0 HA ARG A 21 -19.192 -5.713 -6.401 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -21.350 -4.163 -4.913 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.579 -5.686 -5.749 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.675 -5.312 -3.403 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -21.327 -5.876 -3.241 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.270 -7.264 -5.007 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.525 -7.690 -3.327 1.00 0.00 H new ATOM 0 HE ARG A 21 -22.020 -7.700 -4.824 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.067 -9.575 -4.276 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -19.868 -11.125 -4.554 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -23.041 -9.701 -5.113 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -22.103 -11.195 -5.024 1.00 0.00 H new ATOM 289 N THR A 22 -19.333 -3.057 -7.782 1.00 0.00 N ATOM 290 CA THR A 22 -19.659 -2.240 -8.945 1.00 0.00 C ATOM 291 C THR A 22 -19.051 -2.843 -10.214 1.00 0.00 C ATOM 292 O THR A 22 -19.537 -2.605 -11.322 1.00 0.00 O ATOM 293 CB THR A 22 -19.155 -0.785 -8.749 1.00 0.00 C ATOM 294 OG1 THR A 22 -19.600 0.061 -9.820 1.00 0.00 O ATOM 295 CG2 THR A 22 -17.631 -0.732 -8.661 1.00 0.00 C ATOM 0 H THR A 22 -18.459 -2.800 -7.324 1.00 0.00 H new ATOM 0 HA THR A 22 -20.743 -2.221 -9.054 1.00 0.00 H new ATOM 0 HB THR A 22 -19.574 -0.424 -7.810 1.00 0.00 H new ATOM 0 HG1 THR A 22 -19.272 0.973 -9.674 1.00 0.00 H new ATOM 0 HG21 THR A 22 -17.310 0.301 -8.524 1.00 0.00 H new ATOM 0 HG22 THR A 22 -17.294 -1.332 -7.816 1.00 0.00 H new ATOM 0 HG23 THR A 22 -17.199 -1.127 -9.581 1.00 0.00 H new ATOM 303 N ARG A 23 -17.999 -3.642 -10.043 1.00 0.00 N ATOM 304 CA ARG A 23 -17.285 -4.238 -11.169 1.00 0.00 C ATOM 305 C ARG A 23 -17.138 -5.746 -10.980 1.00 0.00 C ATOM 306 O ARG A 23 -16.889 -6.221 -9.869 1.00 0.00 O ATOM 307 CB ARG A 23 -15.897 -3.595 -11.316 1.00 0.00 C ATOM 308 CG ARG A 23 -15.013 -4.263 -12.368 1.00 0.00 C ATOM 309 CD ARG A 23 -13.599 -3.695 -12.371 1.00 0.00 C ATOM 310 NE ARG A 23 -12.703 -4.470 -13.233 1.00 0.00 N ATOM 311 CZ ARG A 23 -11.392 -4.610 -13.024 1.00 0.00 C ATOM 312 NH1 ARG A 23 -10.798 -3.961 -12.028 1.00 0.00 N ATOM 313 NH2 ARG A 23 -10.671 -5.377 -13.830 1.00 0.00 N ATOM 0 H ARG A 23 -17.621 -3.892 -9.129 1.00 0.00 H new ATOM 0 HA ARG A 23 -17.864 -4.055 -12.075 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -16.020 -2.543 -11.574 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -15.388 -3.629 -10.353 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.972 -5.336 -12.179 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -15.459 -4.130 -13.354 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -13.624 -2.659 -12.710 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.208 -3.688 -11.354 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.108 -4.933 -14.047 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.344 -3.352 -11.419 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.796 -4.072 -11.873 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.118 -5.860 -14.609 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.669 -5.484 -13.671 1.00 0.00 H new ATOM 327 N SER A 24 -17.299 -6.487 -12.070 1.00 0.00 N ATOM 328 CA SER A 24 -17.099 -7.929 -12.071 1.00 0.00 C ATOM 329 C SER A 24 -15.608 -8.250 -12.236 1.00 0.00 C ATOM 330 O SER A 24 -14.904 -7.569 -12.983 1.00 0.00 O ATOM 331 CB SER A 24 -17.909 -8.562 -13.209 1.00 0.00 C ATOM 332 OG SER A 24 -19.277 -8.184 -13.133 1.00 0.00 O ATOM 0 H SER A 24 -17.571 -6.105 -12.976 1.00 0.00 H new ATOM 0 HA SER A 24 -17.442 -8.341 -11.122 1.00 0.00 H new ATOM 0 HB2 SER A 24 -17.496 -8.254 -14.169 1.00 0.00 H new ATOM 0 HB3 SER A 24 -17.825 -9.648 -13.160 1.00 0.00 H new ATOM 0 HG SER A 24 -19.772 -8.599 -13.870 1.00 0.00 H new ATOM 338 N ALA A 25 -15.134 -9.279 -11.529 1.00 0.00 N ATOM 339 CA ALA A 25 -13.726 -9.683 -11.591 1.00 0.00 C ATOM 340 C ALA A 25 -13.302 -10.028 -13.018 1.00 0.00 C ATOM 341 O ALA A 25 -12.158 -9.792 -13.407 1.00 0.00 O ATOM 342 CB ALA A 25 -13.478 -10.864 -10.660 1.00 0.00 C ATOM 0 H ALA A 25 -15.706 -9.849 -10.906 1.00 0.00 H new ATOM 0 HA ALA A 25 -13.120 -8.838 -11.264 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -12.429 -11.156 -10.714 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.723 -10.579 -9.637 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.104 -11.703 -10.962 1.00 0.00 H new ATOM 348 N ALA A 26 -14.232 -10.611 -13.777 1.00 0.00 N ATOM 349 CA ALA A 26 -14.021 -10.926 -15.193 1.00 0.00 C ATOM 350 C ALA A 26 -12.936 -11.992 -15.402 1.00 0.00 C ATOM 351 O ALA A 26 -12.547 -12.269 -16.536 1.00 0.00 O ATOM 352 CB ALA A 26 -13.692 -9.657 -15.980 1.00 0.00 C ATOM 0 H ALA A 26 -15.153 -10.878 -13.428 1.00 0.00 H new ATOM 0 HA ALA A 26 -14.953 -11.346 -15.571 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.538 -9.909 -17.029 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -14.518 -8.951 -15.894 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.785 -9.205 -15.579 1.00 0.00 H new ATOM 358 N SER A 27 -12.467 -12.599 -14.312 1.00 0.00 N ATOM 359 CA SER A 27 -11.456 -13.657 -14.374 1.00 0.00 C ATOM 360 C SER A 27 -11.461 -14.464 -13.069 1.00 0.00 C ATOM 361 O SER A 27 -11.703 -13.905 -11.996 1.00 0.00 O ATOM 362 CB SER A 27 -10.062 -13.060 -14.623 1.00 0.00 C ATOM 363 OG SER A 27 -10.002 -12.376 -15.866 1.00 0.00 O ATOM 0 H SER A 27 -12.774 -12.374 -13.366 1.00 0.00 H new ATOM 0 HA SER A 27 -11.698 -14.321 -15.204 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.810 -12.372 -13.816 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.317 -13.855 -14.608 1.00 0.00 H new ATOM 0 HG SER A 27 -10.794 -12.597 -16.399 1.00 0.00 H new ATOM 369 N PRO A 28 -11.201 -15.789 -13.142 1.00 0.00 N ATOM 370 CA PRO A 28 -11.227 -16.673 -11.966 1.00 0.00 C ATOM 371 C PRO A 28 -10.266 -16.217 -10.860 1.00 0.00 C ATOM 372 O PRO A 28 -10.670 -16.052 -9.705 1.00 0.00 O ATOM 373 CB PRO A 28 -10.816 -18.051 -12.526 1.00 0.00 C ATOM 374 CG PRO A 28 -10.197 -17.768 -13.857 1.00 0.00 C ATOM 375 CD PRO A 28 -10.871 -16.528 -14.375 1.00 0.00 C ATOM 0 HA PRO A 28 -12.208 -16.678 -11.490 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.110 -18.551 -11.862 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.680 -18.708 -12.626 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.122 -17.617 -13.762 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.342 -18.605 -14.540 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.213 -15.953 -15.026 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -11.763 -16.766 -14.954 1.00 0.00 H new ATOM 383 N GLU A 29 -8.998 -15.996 -11.215 1.00 0.00 N ATOM 384 CA GLU A 29 -7.995 -15.590 -10.231 1.00 0.00 C ATOM 385 C GLU A 29 -8.290 -14.188 -9.695 1.00 0.00 C ATOM 386 O GLU A 29 -8.049 -13.900 -8.520 1.00 0.00 O ATOM 387 CB GLU A 29 -6.565 -15.696 -10.806 1.00 0.00 C ATOM 388 CG GLU A 29 -6.377 -15.139 -12.220 1.00 0.00 C ATOM 389 CD GLU A 29 -6.471 -13.624 -12.304 1.00 0.00 C ATOM 390 OE1 GLU A 29 -5.592 -12.934 -11.749 1.00 0.00 O ATOM 391 OE2 GLU A 29 -7.415 -13.118 -12.945 1.00 0.00 O ATOM 0 H GLU A 29 -8.645 -16.090 -12.167 1.00 0.00 H new ATOM 0 HA GLU A 29 -8.052 -16.281 -9.390 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.883 -15.173 -10.135 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.270 -16.745 -10.806 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -5.404 -15.454 -12.597 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.130 -15.577 -12.875 1.00 0.00 H new ATOM 398 N ALA A 30 -8.849 -13.336 -10.550 1.00 0.00 N ATOM 399 CA ALA A 30 -9.230 -11.985 -10.154 1.00 0.00 C ATOM 400 C ALA A 30 -10.300 -12.018 -9.065 1.00 0.00 C ATOM 401 O ALA A 30 -10.379 -11.115 -8.228 1.00 0.00 O ATOM 402 CB ALA A 30 -9.721 -11.196 -11.362 1.00 0.00 C ATOM 0 H ALA A 30 -9.048 -13.559 -11.525 1.00 0.00 H new ATOM 0 HA ALA A 30 -8.349 -11.487 -9.748 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.002 -10.190 -11.050 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.926 -11.137 -12.106 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.587 -11.696 -11.796 1.00 0.00 H new ATOM 408 N LEU A 31 -11.115 -13.068 -9.077 1.00 0.00 N ATOM 409 CA LEU A 31 -12.183 -13.227 -8.096 1.00 0.00 C ATOM 410 C LEU A 31 -11.622 -13.801 -6.796 1.00 0.00 C ATOM 411 O LEU A 31 -11.972 -13.351 -5.705 1.00 0.00 O ATOM 412 CB LEU A 31 -13.292 -14.131 -8.671 1.00 0.00 C ATOM 413 CG LEU A 31 -14.628 -14.177 -7.891 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.532 -15.042 -6.635 1.00 0.00 C ATOM 415 CD2 LEU A 31 -15.100 -12.765 -7.542 1.00 0.00 C ATOM 0 H LEU A 31 -11.056 -13.825 -9.758 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.617 -12.252 -7.874 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.504 -13.804 -9.689 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -12.902 -15.147 -8.738 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.367 -14.640 -8.545 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.493 -15.044 -6.120 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.268 -16.062 -6.915 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.767 -14.638 -5.972 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -16.041 -12.821 -6.994 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -14.349 -12.273 -6.924 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -15.247 -12.194 -8.459 1.00 0.00 H new ATOM 427 N MET A 32 -10.741 -14.791 -6.908 1.00 0.00 N ATOM 428 CA MET A 32 -10.184 -15.432 -5.721 1.00 0.00 C ATOM 429 C MET A 32 -9.259 -14.471 -4.976 1.00 0.00 C ATOM 430 O MET A 32 -9.160 -14.524 -3.751 1.00 0.00 O ATOM 431 CB MET A 32 -9.425 -16.720 -6.077 1.00 0.00 C ATOM 432 CG MET A 32 -8.040 -16.487 -6.661 1.00 0.00 C ATOM 433 SD MET A 32 -7.143 -18.020 -6.942 1.00 0.00 S ATOM 434 CE MET A 32 -5.541 -17.384 -7.420 1.00 0.00 C ATOM 0 H MET A 32 -10.401 -15.163 -7.795 1.00 0.00 H new ATOM 0 HA MET A 32 -11.019 -15.700 -5.073 1.00 0.00 H new ATOM 0 HB2 MET A 32 -9.330 -17.332 -5.180 1.00 0.00 H new ATOM 0 HB3 MET A 32 -10.017 -17.291 -6.792 1.00 0.00 H new ATOM 0 HG2 MET A 32 -8.133 -15.946 -7.603 1.00 0.00 H new ATOM 0 HG3 MET A 32 -7.466 -15.853 -5.985 1.00 0.00 H new ATOM 0 HE1 MET A 32 -4.949 -18.185 -7.864 1.00 0.00 H new ATOM 0 HE2 MET A 32 -5.670 -16.582 -8.147 1.00 0.00 H new ATOM 0 HE3 MET A 32 -5.026 -16.997 -6.541 1.00 0.00 H new ATOM 444 N ARG A 33 -8.590 -13.588 -5.719 1.00 0.00 N ATOM 445 CA ARG A 33 -7.636 -12.654 -5.124 1.00 0.00 C ATOM 446 C ARG A 33 -8.364 -11.504 -4.426 1.00 0.00 C ATOM 447 O ARG A 33 -7.832 -10.901 -3.494 1.00 0.00 O ATOM 448 CB ARG A 33 -6.611 -12.165 -6.183 1.00 0.00 C ATOM 449 CG ARG A 33 -6.561 -10.655 -6.453 1.00 0.00 C ATOM 450 CD ARG A 33 -7.698 -10.180 -7.355 1.00 0.00 C ATOM 451 NE ARG A 33 -7.412 -8.874 -7.956 1.00 0.00 N ATOM 452 CZ ARG A 33 -8.269 -8.182 -8.714 1.00 0.00 C ATOM 453 NH1 ARG A 33 -9.511 -8.616 -8.897 1.00 0.00 N ATOM 454 NH2 ARG A 33 -7.873 -7.054 -9.292 1.00 0.00 N ATOM 0 H ARG A 33 -8.691 -13.501 -6.730 1.00 0.00 H new ATOM 0 HA ARG A 33 -7.066 -13.174 -4.354 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -5.618 -12.487 -5.869 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.827 -12.671 -7.124 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.606 -10.119 -5.505 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -5.607 -10.404 -6.916 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -7.866 -10.913 -8.144 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -8.619 -10.119 -6.776 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.494 -8.464 -7.784 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.818 -9.484 -8.458 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -10.158 -8.081 -9.477 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.919 -6.719 -9.157 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.523 -6.522 -9.871 1.00 0.00 H new ATOM 468 N SER A 34 -9.579 -11.198 -4.873 1.00 0.00 N ATOM 469 CA SER A 34 -10.421 -10.232 -4.177 1.00 0.00 C ATOM 470 C SER A 34 -11.035 -10.890 -2.943 1.00 0.00 C ATOM 471 O SER A 34 -11.014 -10.328 -1.846 1.00 0.00 O ATOM 472 CB SER A 34 -11.512 -9.692 -5.112 1.00 0.00 C ATOM 473 OG SER A 34 -12.235 -10.745 -5.719 1.00 0.00 O ATOM 0 H SER A 34 -10.000 -11.603 -5.709 1.00 0.00 H new ATOM 0 HA SER A 34 -9.811 -9.387 -3.859 1.00 0.00 H new ATOM 0 HB2 SER A 34 -12.195 -9.056 -4.549 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.058 -9.068 -5.882 1.00 0.00 H new ATOM 0 HG SER A 34 -11.712 -11.572 -5.669 1.00 0.00 H new ATOM 479 N ARG A 35 -11.555 -12.101 -3.146 1.00 0.00 N ATOM 480 CA ARG A 35 -12.159 -12.901 -2.081 1.00 0.00 C ATOM 481 C ARG A 35 -11.181 -13.100 -0.918 1.00 0.00 C ATOM 482 O ARG A 35 -11.521 -12.854 0.236 1.00 0.00 O ATOM 483 CB ARG A 35 -12.602 -14.260 -2.649 1.00 0.00 C ATOM 484 CG ARG A 35 -13.241 -15.197 -1.626 1.00 0.00 C ATOM 485 CD ARG A 35 -13.623 -16.540 -2.244 1.00 0.00 C ATOM 486 NE ARG A 35 -12.468 -17.215 -2.852 1.00 0.00 N ATOM 487 CZ ARG A 35 -12.221 -18.527 -2.761 1.00 0.00 C ATOM 488 NH1 ARG A 35 -13.030 -19.320 -2.069 1.00 0.00 N ATOM 489 NH2 ARG A 35 -11.158 -19.047 -3.360 1.00 0.00 N ATOM 0 H ARG A 35 -11.569 -12.556 -4.059 1.00 0.00 H new ATOM 0 HA ARG A 35 -13.029 -12.369 -1.695 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -13.312 -14.087 -3.458 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.736 -14.757 -3.086 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -12.547 -15.361 -0.801 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -14.129 -14.725 -1.206 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -14.056 -17.182 -1.477 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -14.392 -16.385 -3.001 1.00 0.00 H new ATOM 0 HE ARG A 35 -11.809 -16.644 -3.380 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -13.848 -18.930 -1.601 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -12.833 -20.319 -2.005 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -10.527 -18.447 -3.891 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -10.971 -20.047 -3.290 1.00 0.00 H new ATOM 503 N TYR A 36 -9.962 -13.531 -1.240 1.00 0.00 N ATOM 504 CA TYR A 36 -8.923 -13.765 -0.232 1.00 0.00 C ATOM 505 C TYR A 36 -8.737 -12.538 0.661 1.00 0.00 C ATOM 506 O TYR A 36 -8.672 -12.651 1.888 1.00 0.00 O ATOM 507 CB TYR A 36 -7.592 -14.125 -0.916 1.00 0.00 C ATOM 508 CG TYR A 36 -6.397 -14.137 0.025 1.00 0.00 C ATOM 509 CD1 TYR A 36 -6.105 -15.252 0.807 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.565 -13.026 0.136 1.00 0.00 C ATOM 511 CE1 TYR A 36 -5.024 -15.255 1.668 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.483 -13.024 0.993 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.217 -14.140 1.758 1.00 0.00 C ATOM 514 OH TYR A 36 -3.142 -14.138 2.616 1.00 0.00 O ATOM 0 H TYR A 36 -9.666 -13.727 -2.196 1.00 0.00 H new ATOM 0 HA TYR A 36 -9.241 -14.598 0.395 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -7.687 -15.107 -1.379 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.403 -13.412 -1.718 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.733 -16.128 0.739 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.770 -12.149 -0.460 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -4.812 -16.127 2.268 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.848 -12.153 1.064 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.678 -13.277 2.557 1.00 0.00 H new ATOM 524 N ALA A 37 -8.666 -11.370 0.034 1.00 0.00 N ATOM 525 CA ALA A 37 -8.426 -10.127 0.754 1.00 0.00 C ATOM 526 C ALA A 37 -9.540 -9.845 1.754 1.00 0.00 C ATOM 527 O ALA A 37 -9.295 -9.267 2.807 1.00 0.00 O ATOM 528 CB ALA A 37 -8.279 -8.967 -0.218 1.00 0.00 C ATOM 0 H ALA A 37 -8.772 -11.258 -0.974 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.495 -10.237 1.310 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.100 -8.047 0.338 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.439 -9.156 -0.886 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.193 -8.865 -0.804 1.00 0.00 H new ATOM 534 N ALA A 38 -10.758 -10.269 1.422 1.00 0.00 N ATOM 535 CA ALA A 38 -11.911 -10.048 2.290 1.00 0.00 C ATOM 536 C ALA A 38 -11.690 -10.690 3.657 1.00 0.00 C ATOM 537 O ALA A 38 -11.977 -10.085 4.688 1.00 0.00 O ATOM 538 CB ALA A 38 -13.182 -10.578 1.639 1.00 0.00 C ATOM 0 H ALA A 38 -10.971 -10.767 0.558 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.028 -8.974 2.437 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -14.030 -10.404 2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.349 -10.062 0.693 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.078 -11.647 1.456 1.00 0.00 H new ATOM 544 N TYR A 39 -11.152 -11.908 3.662 1.00 0.00 N ATOM 545 CA TYR A 39 -10.839 -12.599 4.913 1.00 0.00 C ATOM 546 C TYR A 39 -9.728 -11.870 5.668 1.00 0.00 C ATOM 547 O TYR A 39 -9.760 -11.771 6.897 1.00 0.00 O ATOM 548 CB TYR A 39 -10.437 -14.063 4.655 1.00 0.00 C ATOM 549 CG TYR A 39 -11.587 -15.063 4.702 1.00 0.00 C ATOM 550 CD1 TYR A 39 -12.768 -14.784 5.392 1.00 0.00 C ATOM 551 CD2 TYR A 39 -11.481 -16.297 4.068 1.00 0.00 C ATOM 552 CE1 TYR A 39 -13.800 -15.703 5.440 1.00 0.00 C ATOM 553 CE2 TYR A 39 -12.512 -17.218 4.117 1.00 0.00 C ATOM 554 CZ TYR A 39 -13.668 -16.915 4.803 1.00 0.00 C ATOM 555 OH TYR A 39 -14.696 -17.828 4.852 1.00 0.00 O ATOM 0 H TYR A 39 -10.924 -12.435 2.819 1.00 0.00 H new ATOM 0 HA TYR A 39 -11.739 -12.597 5.528 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.960 -14.126 3.677 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.691 -14.355 5.394 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -12.877 -13.835 5.896 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -10.578 -16.540 3.528 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -14.708 -15.470 5.977 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -12.411 -18.171 3.619 1.00 0.00 H new ATOM 0 HH TYR A 39 -14.357 -18.716 4.614 1.00 0.00 H new ATOM 565 N ALA A 40 -8.752 -11.354 4.928 1.00 0.00 N ATOM 566 CA ALA A 40 -7.648 -10.606 5.525 1.00 0.00 C ATOM 567 C ALA A 40 -8.133 -9.245 6.029 1.00 0.00 C ATOM 568 O ALA A 40 -7.553 -8.663 6.947 1.00 0.00 O ATOM 569 CB ALA A 40 -6.515 -10.444 4.520 1.00 0.00 C ATOM 0 H ALA A 40 -8.702 -11.439 3.913 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.268 -11.166 6.380 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.699 -9.885 4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.155 -11.427 4.216 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.879 -9.904 3.646 1.00 0.00 H new ATOM 575 N LEU A 41 -9.209 -8.754 5.421 1.00 0.00 N ATOM 576 CA LEU A 41 -9.848 -7.501 5.826 1.00 0.00 C ATOM 577 C LEU A 41 -11.041 -7.804 6.731 1.00 0.00 C ATOM 578 O LEU A 41 -11.930 -6.970 6.917 1.00 0.00 O ATOM 579 CB LEU A 41 -10.286 -6.708 4.589 1.00 0.00 C ATOM 580 CG LEU A 41 -9.144 -6.288 3.647 1.00 0.00 C ATOM 581 CD1 LEU A 41 -9.694 -5.628 2.388 1.00 0.00 C ATOM 582 CD2 LEU A 41 -8.163 -5.360 4.363 1.00 0.00 C ATOM 0 H LEU A 41 -9.665 -9.213 4.632 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.135 -6.893 6.382 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.000 -7.309 4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.813 -5.812 4.918 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.604 -7.187 3.349 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.868 -5.340 1.738 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.342 -6.330 1.863 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.266 -4.742 2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.364 -5.076 3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.688 -4.466 4.699 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.737 -5.875 5.224 1.00 0.00 H new ATOM 594 N LYS A 42 -11.020 -9.016 7.296 1.00 0.00 N ATOM 595 CA LYS A 42 -12.030 -9.523 8.236 1.00 0.00 C ATOM 596 C LYS A 42 -13.472 -9.196 7.822 1.00 0.00 C ATOM 597 O LYS A 42 -14.369 -9.109 8.666 1.00 0.00 O ATOM 598 CB LYS A 42 -11.741 -9.104 9.705 1.00 0.00 C ATOM 599 CG LYS A 42 -11.569 -7.603 9.992 1.00 0.00 C ATOM 600 CD LYS A 42 -10.162 -7.077 9.666 1.00 0.00 C ATOM 601 CE LYS A 42 -9.053 -7.955 10.242 1.00 0.00 C ATOM 602 NZ LYS A 42 -9.102 -8.039 11.725 1.00 0.00 N ATOM 0 H LYS A 42 -10.280 -9.692 7.108 1.00 0.00 H new ATOM 0 HA LYS A 42 -11.943 -10.609 8.189 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -12.555 -9.475 10.327 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -10.834 -9.615 10.029 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.302 -7.043 9.411 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -11.785 -7.415 11.044 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -10.044 -7.014 8.584 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -10.058 -6.065 10.057 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -9.134 -8.958 9.822 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.085 -7.558 9.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -8.329 -8.646 12.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -8.998 -7.087 12.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -10.014 -8.443 12.020 1.00 0.00 H new ATOM 616 N ASP A 43 -13.703 -9.068 6.517 1.00 0.00 N ATOM 617 CA ASP A 43 -15.058 -8.957 5.982 1.00 0.00 C ATOM 618 C ASP A 43 -15.468 -10.291 5.369 1.00 0.00 C ATOM 619 O ASP A 43 -15.285 -10.533 4.175 1.00 0.00 O ATOM 620 CB ASP A 43 -15.178 -7.839 4.937 1.00 0.00 C ATOM 621 CG ASP A 43 -16.623 -7.619 4.493 1.00 0.00 C ATOM 622 OD1 ASP A 43 -17.363 -6.901 5.204 1.00 0.00 O ATOM 623 OD2 ASP A 43 -17.031 -8.161 3.446 1.00 0.00 O ATOM 0 H ASP A 43 -12.968 -9.039 5.810 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.725 -8.701 6.805 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -14.782 -6.912 5.352 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.567 -8.087 4.069 1.00 0.00 H new ATOM 628 N PHE A 44 -15.989 -11.169 6.212 1.00 0.00 N ATOM 629 CA PHE A 44 -16.412 -12.501 5.789 1.00 0.00 C ATOM 630 C PHE A 44 -17.676 -12.433 4.929 1.00 0.00 C ATOM 631 O PHE A 44 -18.069 -13.421 4.301 1.00 0.00 O ATOM 632 CB PHE A 44 -16.648 -13.385 7.022 1.00 0.00 C ATOM 633 CG PHE A 44 -17.547 -12.757 8.061 1.00 0.00 C ATOM 634 CD1 PHE A 44 -18.926 -12.777 7.917 1.00 0.00 C ATOM 635 CD2 PHE A 44 -17.009 -12.141 9.182 1.00 0.00 C ATOM 636 CE1 PHE A 44 -19.745 -12.197 8.865 1.00 0.00 C ATOM 637 CE2 PHE A 44 -17.826 -11.562 10.134 1.00 0.00 C ATOM 638 CZ PHE A 44 -19.196 -11.589 9.975 1.00 0.00 C ATOM 0 H PHE A 44 -16.131 -10.983 7.205 1.00 0.00 H new ATOM 0 HA PHE A 44 -15.621 -12.938 5.180 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -17.085 -14.331 6.701 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -15.687 -13.617 7.480 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -19.365 -13.252 7.052 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -15.937 -12.114 9.312 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -20.817 -12.219 8.737 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -17.392 -11.088 11.002 1.00 0.00 H new ATOM 0 HZ PHE A 44 -19.837 -11.136 10.717 1.00 0.00 H new ATOM 648 N ASP A 45 -18.304 -11.260 4.909 1.00 0.00 N ATOM 649 CA ASP A 45 -19.549 -11.055 4.174 1.00 0.00 C ATOM 650 C ASP A 45 -19.319 -11.155 2.666 1.00 0.00 C ATOM 651 O ASP A 45 -20.039 -11.872 1.964 1.00 0.00 O ATOM 652 CB ASP A 45 -20.147 -9.689 4.531 1.00 0.00 C ATOM 653 CG ASP A 45 -21.490 -9.440 3.864 1.00 0.00 C ATOM 654 OD1 ASP A 45 -22.504 -9.988 4.346 1.00 0.00 O ATOM 655 OD2 ASP A 45 -21.538 -8.687 2.866 1.00 0.00 O ATOM 0 H ASP A 45 -17.967 -10.431 5.398 1.00 0.00 H new ATOM 0 HA ASP A 45 -20.250 -11.839 4.460 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -20.266 -9.621 5.612 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -19.450 -8.904 4.237 1.00 0.00 H new ATOM 660 N TYR A 46 -18.300 -10.448 2.178 1.00 0.00 N ATOM 661 CA TYR A 46 -17.974 -10.444 0.752 1.00 0.00 C ATOM 662 C TYR A 46 -17.692 -11.862 0.261 1.00 0.00 C ATOM 663 O TYR A 46 -18.015 -12.209 -0.877 1.00 0.00 O ATOM 664 CB TYR A 46 -16.769 -9.531 0.475 1.00 0.00 C ATOM 665 CG TYR A 46 -16.335 -9.500 -0.980 1.00 0.00 C ATOM 666 CD1 TYR A 46 -17.129 -8.897 -1.949 1.00 0.00 C ATOM 667 CD2 TYR A 46 -15.129 -10.067 -1.382 1.00 0.00 C ATOM 668 CE1 TYR A 46 -16.735 -8.863 -3.272 1.00 0.00 C ATOM 669 CE2 TYR A 46 -14.729 -10.035 -2.702 1.00 0.00 C ATOM 670 CZ TYR A 46 -15.535 -9.434 -3.642 1.00 0.00 C ATOM 671 OH TYR A 46 -15.144 -9.406 -4.961 1.00 0.00 O ATOM 0 H TYR A 46 -17.685 -9.870 2.750 1.00 0.00 H new ATOM 0 HA TYR A 46 -18.834 -10.055 0.207 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -17.015 -8.517 0.791 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -15.929 -9.861 1.086 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -18.069 -8.448 -1.662 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.495 -10.541 -0.647 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -17.363 -8.392 -4.013 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -13.789 -10.479 -2.996 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.268 -9.835 -5.052 1.00 0.00 H new ATOM 681 N ILE A 47 -17.103 -12.675 1.136 1.00 0.00 N ATOM 682 CA ILE A 47 -16.814 -14.076 0.830 1.00 0.00 C ATOM 683 C ILE A 47 -18.084 -14.790 0.383 1.00 0.00 C ATOM 684 O ILE A 47 -18.127 -15.409 -0.682 1.00 0.00 O ATOM 685 CB ILE A 47 -16.242 -14.816 2.065 1.00 0.00 C ATOM 686 CG1 ILE A 47 -14.993 -14.097 2.598 1.00 0.00 C ATOM 687 CG2 ILE A 47 -15.928 -16.276 1.730 1.00 0.00 C ATOM 688 CD1 ILE A 47 -13.814 -14.124 1.652 1.00 0.00 C ATOM 0 H ILE A 47 -16.814 -12.385 2.070 1.00 0.00 H new ATOM 0 HA ILE A 47 -16.073 -14.089 0.031 1.00 0.00 H new ATOM 0 HB ILE A 47 -17.001 -14.806 2.848 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.248 -13.059 2.813 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.698 -14.555 3.542 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.528 -16.774 2.613 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.840 -16.780 1.411 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.192 -16.315 0.927 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -12.974 -13.596 2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -13.529 -15.158 1.455 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.088 -13.638 0.715 1.00 0.00 H new ATOM 700 N VAL A 48 -19.119 -14.670 1.205 1.00 0.00 N ATOM 701 CA VAL A 48 -20.401 -15.314 0.945 1.00 0.00 C ATOM 702 C VAL A 48 -20.981 -14.833 -0.387 1.00 0.00 C ATOM 703 O VAL A 48 -21.482 -15.625 -1.186 1.00 0.00 O ATOM 704 CB VAL A 48 -21.413 -15.024 2.087 1.00 0.00 C ATOM 705 CG1 VAL A 48 -22.679 -15.856 1.919 1.00 0.00 C ATOM 706 CG2 VAL A 48 -20.780 -15.275 3.455 1.00 0.00 C ATOM 0 H VAL A 48 -19.094 -14.126 2.067 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.228 -16.389 0.896 1.00 0.00 H new ATOM 0 HB VAL A 48 -21.689 -13.971 2.029 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.371 -15.634 2.732 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -23.149 -15.614 0.966 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -22.424 -16.915 1.939 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.509 -15.065 4.237 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -20.464 -16.316 3.524 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.915 -14.624 3.581 1.00 0.00 H new ATOM 716 N GLU A 49 -20.870 -13.531 -0.628 1.00 0.00 N ATOM 717 CA GLU A 49 -21.431 -12.908 -1.826 1.00 0.00 C ATOM 718 C GLU A 49 -20.568 -13.150 -3.070 1.00 0.00 C ATOM 719 O GLU A 49 -20.919 -12.704 -4.167 1.00 0.00 O ATOM 720 CB GLU A 49 -21.644 -11.408 -1.590 1.00 0.00 C ATOM 721 CG GLU A 49 -22.771 -11.106 -0.606 1.00 0.00 C ATOM 722 CD GLU A 49 -24.105 -11.689 -1.058 1.00 0.00 C ATOM 723 OE1 GLU A 49 -24.722 -11.119 -1.983 1.00 0.00 O ATOM 724 OE2 GLU A 49 -24.538 -12.720 -0.499 1.00 0.00 O ATOM 0 H GLU A 49 -20.393 -12.880 -0.005 1.00 0.00 H new ATOM 0 HA GLU A 49 -22.395 -13.379 -2.019 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.718 -10.971 -1.216 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -21.863 -10.925 -2.542 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -22.514 -11.510 0.373 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.869 -10.027 -0.490 1.00 0.00 H new ATOM 731 N THR A 50 -19.426 -13.813 -2.901 1.00 0.00 N ATOM 732 CA THR A 50 -18.618 -14.248 -4.044 1.00 0.00 C ATOM 733 C THR A 50 -18.568 -15.768 -4.119 1.00 0.00 C ATOM 734 O THR A 50 -17.772 -16.345 -4.866 1.00 0.00 O ATOM 735 CB THR A 50 -17.185 -13.672 -4.002 1.00 0.00 C ATOM 736 OG1 THR A 50 -16.626 -13.805 -2.688 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.183 -12.209 -4.424 1.00 0.00 C ATOM 0 H THR A 50 -19.039 -14.061 -1.990 1.00 0.00 H new ATOM 0 HA THR A 50 -19.102 -13.859 -4.940 1.00 0.00 H new ATOM 0 HB THR A 50 -16.571 -14.239 -4.702 1.00 0.00 H new ATOM 0 HG1 THR A 50 -17.102 -13.214 -2.068 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.165 -11.821 -4.388 1.00 0.00 H new ATOM 0 HG22 THR A 50 -17.568 -12.123 -5.440 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.814 -11.634 -3.747 1.00 0.00 H new ATOM 745 N THR A 51 -19.431 -16.414 -3.349 1.00 0.00 N ATOM 746 CA THR A 51 -19.581 -17.854 -3.417 1.00 0.00 C ATOM 747 C THR A 51 -20.660 -18.204 -4.438 1.00 0.00 C ATOM 748 O THR A 51 -21.568 -17.406 -4.683 1.00 0.00 O ATOM 749 CB THR A 51 -19.956 -18.449 -2.045 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.005 -18.023 -1.061 1.00 0.00 O ATOM 751 CG2 THR A 51 -19.986 -19.974 -2.103 1.00 0.00 C ATOM 0 H THR A 51 -20.039 -15.959 -2.668 1.00 0.00 H new ATOM 0 HA THR A 51 -18.625 -18.281 -3.719 1.00 0.00 H new ATOM 0 HB THR A 51 -20.951 -18.095 -1.774 1.00 0.00 H new ATOM 0 HG1 THR A 51 -18.992 -18.664 -0.320 1.00 0.00 H new ATOM 0 HG21 THR A 51 -20.253 -20.370 -1.123 1.00 0.00 H new ATOM 0 HG22 THR A 51 -20.724 -20.296 -2.838 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.003 -20.347 -2.389 1.00 0.00 H new ATOM 759 N ASP A 52 -20.545 -19.384 -5.039 1.00 0.00 N ATOM 760 CA ASP A 52 -21.523 -19.866 -6.010 1.00 0.00 C ATOM 761 C ASP A 52 -22.933 -19.763 -5.432 1.00 0.00 C ATOM 762 O ASP A 52 -23.141 -20.092 -4.264 1.00 0.00 O ATOM 763 CB ASP A 52 -21.218 -21.322 -6.371 1.00 0.00 C ATOM 764 CG ASP A 52 -22.001 -21.816 -7.576 1.00 0.00 C ATOM 765 OD1 ASP A 52 -23.183 -22.185 -7.413 1.00 0.00 O ATOM 766 OD2 ASP A 52 -21.436 -21.844 -8.690 1.00 0.00 O ATOM 0 H ASP A 52 -19.775 -20.031 -4.868 1.00 0.00 H new ATOM 0 HA ASP A 52 -21.463 -19.251 -6.908 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -20.152 -21.424 -6.572 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -21.443 -21.957 -5.514 1.00 0.00 H new ATOM 771 N PRO A 53 -23.916 -19.308 -6.234 1.00 0.00 N ATOM 772 CA PRO A 53 -25.300 -19.137 -5.776 1.00 0.00 C ATOM 773 C PRO A 53 -25.836 -20.389 -5.077 1.00 0.00 C ATOM 774 O PRO A 53 -26.662 -20.297 -4.166 1.00 0.00 O ATOM 775 CB PRO A 53 -26.089 -18.843 -7.070 1.00 0.00 C ATOM 776 CG PRO A 53 -25.144 -19.130 -8.195 1.00 0.00 C ATOM 777 CD PRO A 53 -23.762 -18.921 -7.644 1.00 0.00 C ATOM 0 HA PRO A 53 -25.387 -18.342 -5.035 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -26.979 -19.469 -7.137 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -26.426 -17.807 -7.096 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -25.269 -20.150 -8.557 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -25.331 -18.467 -9.039 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -23.024 -19.539 -8.156 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -23.437 -17.886 -7.747 1.00 0.00 H new ATOM 785 N GLU A 54 -25.349 -21.553 -5.498 1.00 0.00 N ATOM 786 CA GLU A 54 -25.766 -22.822 -4.909 1.00 0.00 C ATOM 787 C GLU A 54 -24.984 -23.099 -3.625 1.00 0.00 C ATOM 788 O GLU A 54 -25.559 -23.445 -2.593 1.00 0.00 O ATOM 789 CB GLU A 54 -25.553 -23.967 -5.907 1.00 0.00 C ATOM 790 CG GLU A 54 -26.189 -23.725 -7.272 1.00 0.00 C ATOM 791 CD GLU A 54 -27.668 -23.383 -7.188 1.00 0.00 C ATOM 792 OE1 GLU A 54 -28.469 -24.268 -6.819 1.00 0.00 O ATOM 793 OE2 GLU A 54 -28.040 -22.236 -7.515 1.00 0.00 O ATOM 0 H GLU A 54 -24.663 -21.644 -6.247 1.00 0.00 H new ATOM 0 HA GLU A 54 -26.827 -22.756 -4.666 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -24.483 -24.126 -6.039 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -25.962 -24.885 -5.484 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -25.662 -22.913 -7.773 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -26.062 -24.615 -7.888 1.00 0.00 H new ATOM 800 N ARG A 55 -23.666 -22.919 -3.694 1.00 0.00 N ATOM 801 CA ARG A 55 -22.782 -23.219 -2.564 1.00 0.00 C ATOM 802 C ARG A 55 -23.006 -22.236 -1.422 1.00 0.00 C ATOM 803 O ARG A 55 -22.726 -22.542 -0.263 1.00 0.00 O ATOM 804 CB ARG A 55 -21.312 -23.163 -2.990 1.00 0.00 C ATOM 805 CG ARG A 55 -20.963 -24.049 -4.175 1.00 0.00 C ATOM 806 CD ARG A 55 -21.264 -25.521 -3.917 1.00 0.00 C ATOM 807 NE ARG A 55 -20.703 -26.373 -4.968 1.00 0.00 N ATOM 808 CZ ARG A 55 -21.226 -27.533 -5.362 1.00 0.00 C ATOM 809 NH1 ARG A 55 -22.366 -27.968 -4.838 1.00 0.00 N ATOM 810 NH2 ARG A 55 -20.613 -28.249 -6.297 1.00 0.00 N ATOM 0 H ARG A 55 -23.184 -22.566 -4.521 1.00 0.00 H new ATOM 0 HA ARG A 55 -23.020 -24.227 -2.224 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.058 -22.132 -3.236 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -20.690 -23.451 -2.142 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -21.522 -23.716 -5.050 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -19.905 -23.934 -4.410 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -20.853 -25.814 -2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -22.342 -25.669 -3.863 1.00 0.00 H new ATOM 0 HE ARG A 55 -19.851 -26.056 -5.431 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -22.846 -27.413 -4.130 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -22.761 -28.857 -5.144 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -19.745 -27.910 -6.711 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -21.011 -29.138 -6.601 1.00 0.00 H new ATOM 824 N ARG A 56 -23.509 -21.053 -1.759 1.00 0.00 N ATOM 825 CA ARG A 56 -23.741 -20.001 -0.776 1.00 0.00 C ATOM 826 C ARG A 56 -24.742 -20.468 0.280 1.00 0.00 C ATOM 827 O ARG A 56 -24.729 -19.995 1.416 1.00 0.00 O ATOM 828 CB ARG A 56 -24.236 -18.724 -1.472 1.00 0.00 C ATOM 829 CG ARG A 56 -24.411 -17.539 -0.527 1.00 0.00 C ATOM 830 CD ARG A 56 -24.718 -16.246 -1.275 1.00 0.00 C ATOM 831 NE ARG A 56 -25.957 -16.334 -2.049 1.00 0.00 N ATOM 832 CZ ARG A 56 -26.595 -15.282 -2.559 1.00 0.00 C ATOM 833 NH1 ARG A 56 -26.143 -14.051 -2.344 1.00 0.00 N ATOM 834 NH2 ARG A 56 -27.701 -15.467 -3.266 1.00 0.00 N ATOM 0 H ARG A 56 -23.765 -20.798 -2.713 1.00 0.00 H new ATOM 0 HA ARG A 56 -22.800 -19.776 -0.274 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -23.530 -18.451 -2.256 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.188 -18.932 -1.960 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -25.218 -17.752 0.174 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -23.503 -17.409 0.062 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -24.795 -15.426 -0.562 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -23.890 -16.010 -1.944 1.00 0.00 H new ATOM 0 HE ARG A 56 -26.357 -17.259 -2.208 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -25.302 -13.907 -1.785 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -26.637 -13.250 -2.738 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -28.058 -16.410 -3.416 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -28.195 -14.666 -3.660 1.00 0.00 H new ATOM 848 N ASP A 57 -25.587 -21.422 -0.102 1.00 0.00 N ATOM 849 CA ASP A 57 -26.565 -22.009 0.813 1.00 0.00 C ATOM 850 C ASP A 57 -25.859 -22.756 1.947 1.00 0.00 C ATOM 851 O ASP A 57 -26.391 -22.890 3.052 1.00 0.00 O ATOM 852 CB ASP A 57 -27.490 -22.964 0.046 1.00 0.00 C ATOM 853 CG ASP A 57 -28.539 -23.609 0.938 1.00 0.00 C ATOM 854 OD1 ASP A 57 -29.555 -22.948 1.240 1.00 0.00 O ATOM 855 OD2 ASP A 57 -28.355 -24.778 1.343 1.00 0.00 O ATOM 0 H ASP A 57 -25.615 -21.808 -1.046 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.162 -21.207 1.248 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -27.987 -22.416 -0.755 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -26.891 -23.743 -0.425 1.00 0.00 H new ATOM 860 N LEU A 58 -24.651 -23.231 1.658 1.00 0.00 N ATOM 861 CA LEU A 58 -23.849 -23.982 2.622 1.00 0.00 C ATOM 862 C LEU A 58 -23.034 -23.036 3.505 1.00 0.00 C ATOM 863 O LEU A 58 -22.455 -23.451 4.512 1.00 0.00 O ATOM 864 CB LEU A 58 -22.905 -24.939 1.877 1.00 0.00 C ATOM 865 CG LEU A 58 -23.584 -25.871 0.858 1.00 0.00 C ATOM 866 CD1 LEU A 58 -22.547 -26.713 0.117 1.00 0.00 C ATOM 867 CD2 LEU A 58 -24.615 -26.762 1.545 1.00 0.00 C ATOM 0 H LEU A 58 -24.200 -23.107 0.751 1.00 0.00 H new ATOM 0 HA LEU A 58 -24.522 -24.555 3.260 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.151 -24.348 1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -22.381 -25.551 2.611 1.00 0.00 H new ATOM 0 HG LEU A 58 -24.103 -25.253 0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.050 -27.364 -0.598 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -21.857 -26.057 -0.413 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -21.993 -27.320 0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -25.083 -27.413 0.807 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -24.123 -27.370 2.304 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -25.377 -26.141 2.016 1.00 0.00 H new ATOM 879 N PHE A 59 -22.987 -21.765 3.116 1.00 0.00 N ATOM 880 CA PHE A 59 -22.211 -20.755 3.835 1.00 0.00 C ATOM 881 C PHE A 59 -23.045 -20.087 4.923 1.00 0.00 C ATOM 882 O PHE A 59 -24.261 -20.293 5.010 1.00 0.00 O ATOM 883 CB PHE A 59 -21.684 -19.692 2.856 1.00 0.00 C ATOM 884 CG PHE A 59 -20.408 -20.080 2.152 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.267 -21.326 1.555 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.347 -19.190 2.090 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.092 -21.674 0.915 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.173 -19.531 1.452 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.043 -20.774 0.863 1.00 0.00 C ATOM 0 H PHE A 59 -23.482 -21.406 2.299 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.369 -21.258 4.310 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.451 -19.490 2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -21.517 -18.763 3.401 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.084 -22.031 1.591 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.441 -18.216 2.548 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -18.993 -22.647 0.456 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.355 -18.827 1.413 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.124 -21.042 0.363 1.00 0.00 H new ATOM 899 N ASP A 60 -22.375 -19.293 5.756 1.00 0.00 N ATOM 900 CA ASP A 60 -23.035 -18.513 6.799 1.00 0.00 C ATOM 901 C ASP A 60 -22.052 -17.521 7.412 1.00 0.00 C ATOM 902 O ASP A 60 -20.854 -17.801 7.505 1.00 0.00 O ATOM 903 CB ASP A 60 -23.616 -19.417 7.894 1.00 0.00 C ATOM 904 CG ASP A 60 -24.314 -18.620 8.985 1.00 0.00 C ATOM 905 OD1 ASP A 60 -25.436 -18.132 8.743 1.00 0.00 O ATOM 906 OD2 ASP A 60 -23.734 -18.458 10.078 1.00 0.00 O ATOM 0 H ASP A 60 -21.363 -19.173 5.727 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.860 -17.970 6.338 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -24.323 -20.117 7.448 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.816 -20.011 8.335 1.00 0.00 H new ATOM 911 N HIS A 61 -22.567 -16.368 7.830 1.00 0.00 N ATOM 912 CA HIS A 61 -21.740 -15.294 8.381 1.00 0.00 C ATOM 913 C HIS A 61 -20.904 -15.773 9.574 1.00 0.00 C ATOM 914 O HIS A 61 -19.727 -15.423 9.691 1.00 0.00 O ATOM 915 CB HIS A 61 -22.618 -14.100 8.791 1.00 0.00 C ATOM 916 CG HIS A 61 -23.245 -13.383 7.628 1.00 0.00 C ATOM 917 ND1 HIS A 61 -24.599 -13.395 7.370 1.00 0.00 N ATOM 918 CD2 HIS A 61 -22.690 -12.616 6.658 1.00 0.00 C ATOM 919 CE1 HIS A 61 -24.848 -12.671 6.293 1.00 0.00 C ATOM 920 NE2 HIS A 61 -23.706 -12.187 5.842 1.00 0.00 N ATOM 0 H HIS A 61 -23.563 -16.151 7.798 1.00 0.00 H new ATOM 0 HA HIS A 61 -21.049 -14.978 7.600 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -23.406 -14.452 9.457 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -22.013 -13.393 9.359 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -21.641 -12.385 6.548 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -25.821 -12.504 5.856 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -23.597 -11.591 5.021 1.00 0.00 H new ATOM 929 N ASP A 62 -21.506 -16.584 10.443 1.00 0.00 N ATOM 930 CA ASP A 62 -20.820 -17.078 11.642 1.00 0.00 C ATOM 931 C ASP A 62 -19.647 -17.958 11.255 1.00 0.00 C ATOM 932 O ASP A 62 -18.525 -17.787 11.735 1.00 0.00 O ATOM 933 CB ASP A 62 -21.771 -17.905 12.515 1.00 0.00 C ATOM 934 CG ASP A 62 -21.234 -18.118 13.924 1.00 0.00 C ATOM 935 OD1 ASP A 62 -21.378 -17.199 14.765 1.00 0.00 O ATOM 936 OD2 ASP A 62 -20.666 -19.197 14.198 1.00 0.00 O ATOM 0 H ASP A 62 -22.466 -16.914 10.342 1.00 0.00 H new ATOM 0 HA ASP A 62 -20.471 -16.209 12.200 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -22.737 -17.403 12.570 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -21.941 -18.873 12.044 1.00 0.00 H new ATOM 941 N VAL A 63 -19.934 -18.896 10.370 1.00 0.00 N ATOM 942 CA VAL A 63 -18.974 -19.910 9.973 1.00 0.00 C ATOM 943 C VAL A 63 -17.781 -19.276 9.261 1.00 0.00 C ATOM 944 O VAL A 63 -16.626 -19.605 9.542 1.00 0.00 O ATOM 945 CB VAL A 63 -19.635 -20.967 9.056 1.00 0.00 C ATOM 946 CG1 VAL A 63 -18.736 -22.184 8.920 1.00 0.00 C ATOM 947 CG2 VAL A 63 -21.012 -21.370 9.586 1.00 0.00 C ATOM 0 H VAL A 63 -20.839 -18.976 9.906 1.00 0.00 H new ATOM 0 HA VAL A 63 -18.620 -20.406 10.877 1.00 0.00 H new ATOM 0 HB VAL A 63 -19.773 -20.524 8.070 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -19.214 -22.919 8.272 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -17.782 -21.885 8.487 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -18.566 -22.623 9.903 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -21.454 -22.114 8.923 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -20.908 -21.792 10.586 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.657 -20.492 9.628 1.00 0.00 H new ATOM 957 N ASN A 64 -18.073 -18.352 8.351 1.00 0.00 N ATOM 958 CA ASN A 64 -17.031 -17.629 7.625 1.00 0.00 C ATOM 959 C ASN A 64 -16.162 -16.827 8.593 1.00 0.00 C ATOM 960 O ASN A 64 -14.948 -16.711 8.406 1.00 0.00 O ATOM 961 CB ASN A 64 -17.650 -16.695 6.575 1.00 0.00 C ATOM 962 CG ASN A 64 -18.274 -17.437 5.403 1.00 0.00 C ATOM 963 OD1 ASN A 64 -18.209 -16.833 4.226 1.00 0.00 O flip ATOM 964 ND2 ASN A 64 -18.805 -18.538 5.548 1.00 0.00 N flip ATOM 0 H ASN A 64 -19.024 -18.085 8.097 1.00 0.00 H new ATOM 0 HA ASN A 64 -16.404 -18.360 7.114 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -18.411 -16.077 7.052 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -16.880 -16.020 6.201 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -18.836 -18.972 6.471 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -19.214 -19.016 4.746 1.00 0.00 H new ATOM 971 N ARG A 65 -16.795 -16.281 9.633 1.00 0.00 N ATOM 972 CA ARG A 65 -16.082 -15.539 10.669 1.00 0.00 C ATOM 973 C ARG A 65 -15.096 -16.451 11.388 1.00 0.00 C ATOM 974 O ARG A 65 -13.922 -16.113 11.535 1.00 0.00 O ATOM 975 CB ARG A 65 -17.069 -14.937 11.681 1.00 0.00 C ATOM 976 CG ARG A 65 -16.391 -14.209 12.838 1.00 0.00 C ATOM 977 CD ARG A 65 -17.400 -13.696 13.856 1.00 0.00 C ATOM 978 NE ARG A 65 -16.748 -13.039 14.991 1.00 0.00 N ATOM 979 CZ ARG A 65 -17.358 -12.758 16.144 1.00 0.00 C ATOM 980 NH1 ARG A 65 -18.632 -13.091 16.328 1.00 0.00 N ATOM 981 NH2 ARG A 65 -16.687 -12.153 17.117 1.00 0.00 N ATOM 0 H ARG A 65 -17.803 -16.340 9.778 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.533 -14.727 10.191 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.729 -14.242 11.162 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.696 -15.733 12.082 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -15.690 -14.883 13.330 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.810 -13.373 12.450 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -18.079 -12.994 13.372 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -18.005 -14.527 14.217 1.00 0.00 H new ATOM 0 HE ARG A 65 -15.766 -12.780 14.894 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -19.148 -13.564 15.586 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -19.093 -12.874 17.211 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -15.707 -11.904 16.982 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.151 -11.937 17.999 1.00 0.00 H new ATOM 995 N ALA A 66 -15.581 -17.617 11.811 1.00 0.00 N ATOM 996 CA ALA A 66 -14.768 -18.578 12.556 1.00 0.00 C ATOM 997 C ALA A 66 -13.429 -18.821 11.863 1.00 0.00 C ATOM 998 O ALA A 66 -12.382 -18.871 12.512 1.00 0.00 O ATOM 999 CB ALA A 66 -15.527 -19.891 12.725 1.00 0.00 C ATOM 0 H ALA A 66 -16.541 -17.921 11.649 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.564 -18.159 13.541 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.911 -20.598 13.281 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -16.453 -19.708 13.271 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.760 -20.306 11.744 1.00 0.00 H new ATOM 1005 N TRP A 67 -13.471 -18.939 10.538 1.00 0.00 N ATOM 1006 CA TRP A 67 -12.273 -19.205 9.750 1.00 0.00 C ATOM 1007 C TRP A 67 -11.269 -18.052 9.879 1.00 0.00 C ATOM 1008 O TRP A 67 -10.095 -18.272 10.193 1.00 0.00 O ATOM 1009 CB TRP A 67 -12.647 -19.434 8.274 1.00 0.00 C ATOM 1010 CG TRP A 67 -11.551 -20.059 7.448 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -10.245 -20.248 7.810 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -11.672 -20.582 6.120 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -9.554 -20.854 6.793 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -10.405 -21.069 5.743 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -12.730 -20.687 5.212 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -10.170 -21.651 4.500 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -12.495 -21.263 3.978 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -11.223 -21.740 3.632 1.00 0.00 C ATOM 0 H TRP A 67 -14.325 -18.854 9.987 1.00 0.00 H new ATOM 0 HA TRP A 67 -11.801 -20.109 10.135 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.529 -20.073 8.229 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -12.922 -18.478 7.828 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.820 -19.961 8.760 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -8.565 -21.104 6.815 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -13.714 -20.324 5.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -9.191 -22.019 4.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -13.305 -21.347 3.268 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -11.072 -22.187 2.660 1.00 0.00 H new ATOM 1029 N MET A 68 -11.733 -16.822 9.655 1.00 0.00 N ATOM 1030 CA MET A 68 -10.847 -15.652 9.691 1.00 0.00 C ATOM 1031 C MET A 68 -10.313 -15.412 11.107 1.00 0.00 C ATOM 1032 O MET A 68 -9.277 -14.768 11.289 1.00 0.00 O ATOM 1033 CB MET A 68 -11.568 -14.390 9.181 1.00 0.00 C ATOM 1034 CG MET A 68 -12.524 -13.761 10.188 1.00 0.00 C ATOM 1035 SD MET A 68 -13.321 -12.272 9.558 1.00 0.00 S ATOM 1036 CE MET A 68 -14.128 -11.672 11.042 1.00 0.00 C ATOM 0 H MET A 68 -12.709 -16.608 9.448 1.00 0.00 H new ATOM 0 HA MET A 68 -10.006 -15.860 9.030 1.00 0.00 H new ATOM 0 HB2 MET A 68 -10.821 -13.649 8.896 1.00 0.00 H new ATOM 0 HB3 MET A 68 -12.125 -14.644 8.279 1.00 0.00 H new ATOM 0 HG2 MET A 68 -13.288 -14.489 10.461 1.00 0.00 H new ATOM 0 HG3 MET A 68 -11.977 -13.517 11.099 1.00 0.00 H new ATOM 0 HE1 MET A 68 -14.996 -11.072 10.767 1.00 0.00 H new ATOM 0 HE2 MET A 68 -14.449 -12.518 11.649 1.00 0.00 H new ATOM 0 HE3 MET A 68 -13.430 -11.060 11.613 1.00 0.00 H new ATOM 1046 N GLU A 69 -11.029 -15.928 12.105 1.00 0.00 N ATOM 1047 CA GLU A 69 -10.629 -15.777 13.503 1.00 0.00 C ATOM 1048 C GLU A 69 -9.474 -16.720 13.848 1.00 0.00 C ATOM 1049 O GLU A 69 -8.554 -16.347 14.582 1.00 0.00 O ATOM 1050 CB GLU A 69 -11.822 -16.045 14.435 1.00 0.00 C ATOM 1051 CG GLU A 69 -12.998 -15.089 14.237 1.00 0.00 C ATOM 1052 CD GLU A 69 -12.647 -13.640 14.535 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -12.609 -13.261 15.724 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -12.409 -12.868 13.585 1.00 0.00 O ATOM 0 H GLU A 69 -11.891 -16.456 11.971 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.290 -14.751 13.646 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -12.168 -17.067 14.279 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.483 -15.978 15.469 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.352 -15.167 13.209 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.821 -15.397 14.882 1.00 0.00 H new ATOM 1061 N GLU A 70 -9.521 -17.938 13.315 1.00 0.00 N ATOM 1062 CA GLU A 70 -8.505 -18.950 13.612 1.00 0.00 C ATOM 1063 C GLU A 70 -7.301 -18.838 12.671 1.00 0.00 C ATOM 1064 O GLU A 70 -6.181 -19.206 13.036 1.00 0.00 O ATOM 1065 CB GLU A 70 -9.116 -20.357 13.525 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.746 -20.674 12.173 1.00 0.00 C ATOM 1067 CD GLU A 70 -10.343 -22.070 12.109 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -11.456 -22.276 12.639 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -9.708 -22.969 11.515 1.00 0.00 O ATOM 0 H GLU A 70 -10.251 -18.251 12.675 1.00 0.00 H new ATOM 0 HA GLU A 70 -8.150 -18.774 14.627 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -8.340 -21.093 13.735 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -9.874 -20.462 14.302 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.525 -19.942 11.961 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.991 -20.572 11.394 1.00 0.00 H new ATOM 1076 N SER A 71 -7.531 -18.324 11.465 1.00 0.00 N ATOM 1077 CA SER A 71 -6.483 -18.246 10.448 1.00 0.00 C ATOM 1078 C SER A 71 -5.977 -16.810 10.262 1.00 0.00 C ATOM 1079 O SER A 71 -6.746 -15.901 9.938 1.00 0.00 O ATOM 1080 CB SER A 71 -7.010 -18.796 9.117 1.00 0.00 C ATOM 1081 OG SER A 71 -7.467 -20.132 9.264 1.00 0.00 O ATOM 0 H SER A 71 -8.434 -17.955 11.167 1.00 0.00 H new ATOM 0 HA SER A 71 -5.641 -18.850 10.787 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.824 -18.167 8.756 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.221 -18.758 8.366 1.00 0.00 H new ATOM 0 HG SER A 71 -8.168 -20.312 8.604 1.00 0.00 H new ATOM 1087 N ASP A 72 -4.679 -16.620 10.486 1.00 0.00 N ATOM 1088 CA ASP A 72 -4.010 -15.343 10.228 1.00 0.00 C ATOM 1089 C ASP A 72 -3.401 -15.366 8.827 1.00 0.00 C ATOM 1090 O ASP A 72 -2.352 -15.962 8.616 1.00 0.00 O ATOM 1091 CB ASP A 72 -2.914 -15.100 11.277 1.00 0.00 C ATOM 1092 CG ASP A 72 -2.209 -13.763 11.105 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -2.891 -12.714 11.146 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -0.970 -13.752 10.946 1.00 0.00 O ATOM 0 H ASP A 72 -4.060 -17.344 10.851 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.737 -14.534 10.292 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -3.356 -15.146 12.272 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.178 -15.902 11.218 1.00 0.00 H new ATOM 1099 N PHE A 73 -4.072 -14.743 7.867 1.00 0.00 N ATOM 1100 CA PHE A 73 -3.666 -14.831 6.463 1.00 0.00 C ATOM 1101 C PHE A 73 -2.414 -13.993 6.182 1.00 0.00 C ATOM 1102 O PHE A 73 -2.414 -12.772 6.366 1.00 0.00 O ATOM 1103 CB PHE A 73 -4.827 -14.404 5.554 1.00 0.00 C ATOM 1104 CG PHE A 73 -6.030 -15.309 5.669 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -6.139 -16.446 4.880 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -7.044 -15.032 6.576 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -7.233 -17.283 4.990 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -8.138 -15.867 6.692 1.00 0.00 C ATOM 1109 CZ PHE A 73 -8.234 -16.993 5.898 1.00 0.00 C ATOM 0 H PHE A 73 -4.900 -14.170 8.031 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.412 -15.869 6.248 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.121 -13.385 5.804 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.486 -14.393 4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.359 -16.679 4.171 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.976 -14.152 7.199 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.306 -18.162 4.367 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -8.918 -15.640 7.403 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.090 -17.646 5.986 1.00 0.00 H new ATOM 1119 N LEU A 74 -1.348 -14.663 5.734 1.00 0.00 N ATOM 1120 CA LEU A 74 -0.080 -14.001 5.413 1.00 0.00 C ATOM 1121 C LEU A 74 -0.082 -13.494 3.968 1.00 0.00 C ATOM 1122 O LEU A 74 -0.054 -12.280 3.726 1.00 0.00 O ATOM 1123 CB LEU A 74 1.115 -14.957 5.636 1.00 0.00 C ATOM 1124 CG LEU A 74 1.627 -15.084 7.088 1.00 0.00 C ATOM 1125 CD1 LEU A 74 0.527 -15.558 8.029 1.00 0.00 C ATOM 1126 CD2 LEU A 74 2.827 -16.029 7.155 1.00 0.00 C ATOM 0 H LEU A 74 -1.339 -15.672 5.584 1.00 0.00 H new ATOM 0 HA LEU A 74 0.028 -13.148 6.083 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.830 -15.949 5.286 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.942 -14.623 5.009 1.00 0.00 H new ATOM 0 HG LEU A 74 1.942 -14.093 7.414 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.923 -15.636 9.042 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.296 -14.844 8.015 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.166 -16.534 7.704 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.173 -16.105 8.186 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.533 -17.016 6.797 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.631 -15.641 6.530 1.00 0.00 H new ATOM 1138 N GLU A 75 -0.141 -14.424 3.016 1.00 0.00 N ATOM 1139 CA GLU A 75 -0.037 -14.092 1.595 1.00 0.00 C ATOM 1140 C GLU A 75 -0.702 -15.170 0.735 1.00 0.00 C ATOM 1141 O GLU A 75 -0.754 -16.344 1.115 1.00 0.00 O ATOM 1142 CB GLU A 75 1.445 -13.934 1.195 1.00 0.00 C ATOM 1143 CG GLU A 75 1.686 -13.737 -0.306 1.00 0.00 C ATOM 1144 CD GLU A 75 1.157 -12.410 -0.844 1.00 0.00 C ATOM 1145 OE1 GLU A 75 -0.077 -12.215 -0.875 1.00 0.00 O ATOM 1146 OE2 GLU A 75 1.978 -11.556 -1.247 1.00 0.00 O ATOM 0 H GLU A 75 -0.261 -15.419 3.204 1.00 0.00 H new ATOM 0 HA GLU A 75 -0.555 -13.148 1.424 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.863 -13.082 1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.992 -14.817 1.524 1.00 0.00 H new ATOM 0 HG2 GLU A 75 2.756 -13.798 -0.504 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.213 -14.554 -0.851 1.00 0.00 H new ATOM 1153 N LEU A 76 -1.209 -14.754 -0.423 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.801 -15.664 -1.393 1.00 0.00 C ATOM 1155 C LEU A 76 -0.778 -15.988 -2.479 1.00 0.00 C ATOM 1156 O LEU A 76 -0.133 -15.087 -3.024 1.00 0.00 O ATOM 1157 CB LEU A 76 -3.053 -15.035 -2.025 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.827 -15.944 -2.995 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -4.386 -17.162 -2.262 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -4.942 -15.167 -3.695 1.00 0.00 C ATOM 0 H LEU A 76 -1.220 -13.776 -0.713 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.094 -16.582 -0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.727 -14.726 -1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.756 -14.132 -2.558 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.134 -16.297 -3.759 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.930 -17.792 -2.966 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.566 -17.731 -1.824 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.062 -16.833 -1.472 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.476 -15.830 -4.376 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.636 -14.776 -2.951 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.511 -14.340 -4.258 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.637 -17.267 -2.797 1.00 0.00 N ATOM 1173 CA ARG A 77 0.324 -17.715 -3.789 1.00 0.00 C ATOM 1174 C ARG A 77 -0.421 -18.236 -5.010 1.00 0.00 C ATOM 1175 O ARG A 77 -0.965 -19.340 -4.996 1.00 0.00 O ATOM 1176 CB ARG A 77 1.238 -18.804 -3.211 1.00 0.00 C ATOM 1177 CG ARG A 77 2.322 -19.257 -4.182 1.00 0.00 C ATOM 1178 CD ARG A 77 3.252 -20.302 -3.578 1.00 0.00 C ATOM 1179 NE ARG A 77 4.353 -20.616 -4.489 1.00 0.00 N ATOM 1180 CZ ARG A 77 5.180 -21.651 -4.351 1.00 0.00 C ATOM 1181 NH1 ARG A 77 5.038 -22.502 -3.344 1.00 0.00 N ATOM 1182 NH2 ARG A 77 6.156 -21.832 -5.228 1.00 0.00 N ATOM 0 H ARG A 77 -1.183 -18.018 -2.376 1.00 0.00 H new ATOM 0 HA ARG A 77 0.953 -16.874 -4.081 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.708 -18.430 -2.301 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.632 -19.664 -2.926 1.00 0.00 H new ATOM 0 HG2 ARG A 77 1.854 -19.667 -5.077 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.908 -18.393 -4.495 1.00 0.00 H new ATOM 0 HD2 ARG A 77 3.651 -19.935 -2.633 1.00 0.00 H new ATOM 0 HD3 ARG A 77 2.690 -21.209 -3.356 1.00 0.00 H new ATOM 0 HE ARG A 77 4.498 -19.998 -5.287 1.00 0.00 H new ATOM 0 HH11 ARG A 77 4.289 -22.368 -2.665 1.00 0.00 H new ATOM 0 HH12 ARG A 77 5.678 -23.291 -3.249 1.00 0.00 H new ATOM 0 HH21 ARG A 77 6.271 -21.180 -6.004 1.00 0.00 H new ATOM 0 HH22 ARG A 77 6.792 -22.623 -5.127 1.00 0.00 H new ATOM 1196 N VAL A 78 -0.462 -17.420 -6.047 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.195 -17.741 -7.262 1.00 0.00 C ATOM 1198 C VAL A 78 -0.315 -18.548 -8.215 1.00 0.00 C ATOM 1199 O VAL A 78 0.727 -18.065 -8.664 1.00 0.00 O ATOM 1200 CB VAL A 78 -1.671 -16.447 -7.956 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -2.410 -16.755 -9.261 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -2.546 -15.623 -7.013 1.00 0.00 C ATOM 0 H VAL A 78 0.011 -16.516 -6.073 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.065 -18.340 -6.993 1.00 0.00 H new ATOM 0 HB VAL A 78 -0.790 -15.857 -8.209 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.732 -15.823 -9.725 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -1.743 -17.287 -9.940 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.281 -17.375 -9.048 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.872 -14.715 -7.520 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.418 -16.208 -6.721 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.973 -15.357 -6.124 1.00 0.00 H new ATOM 1212 N LEU A 79 -0.730 -19.777 -8.511 1.00 0.00 N ATOM 1213 CA LEU A 79 0.049 -20.666 -9.370 1.00 0.00 C ATOM 1214 C LEU A 79 -0.342 -20.485 -10.837 1.00 0.00 C ATOM 1215 O LEU A 79 0.509 -20.197 -11.683 1.00 0.00 O ATOM 1216 CB LEU A 79 -0.148 -22.126 -8.938 1.00 0.00 C ATOM 1217 CG LEU A 79 0.199 -22.429 -7.468 1.00 0.00 C ATOM 1218 CD1 LEU A 79 -0.020 -23.906 -7.149 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.634 -22.013 -7.145 1.00 0.00 C ATOM 0 H LEU A 79 -1.602 -20.181 -8.169 1.00 0.00 H new ATOM 0 HA LEU A 79 1.103 -20.408 -9.266 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.188 -22.403 -9.113 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.463 -22.763 -9.577 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.472 -21.843 -6.840 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.232 -24.094 -6.105 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.065 -24.165 -7.322 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.616 -24.515 -7.791 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.852 -22.238 -6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.325 -22.561 -7.786 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.750 -20.943 -7.317 1.00 0.00 H new ATOM 1231 N GLY A 80 -1.631 -20.654 -11.133 1.00 0.00 N ATOM 1232 CA GLY A 80 -2.115 -20.505 -12.498 1.00 0.00 C ATOM 1233 C GLY A 80 -3.625 -20.611 -12.587 1.00 0.00 C ATOM 1234 O GLY A 80 -4.262 -21.179 -11.698 1.00 0.00 O ATOM 0 H GLY A 80 -2.350 -20.892 -10.450 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.797 -19.539 -12.891 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.661 -21.270 -13.128 1.00 0.00 H new ATOM 1238 N SER A 81 -4.198 -20.074 -13.663 1.00 0.00 N ATOM 1239 CA SER A 81 -5.649 -20.050 -13.839 1.00 0.00 C ATOM 1240 C SER A 81 -6.032 -20.283 -15.300 1.00 0.00 C ATOM 1241 O SER A 81 -5.215 -20.095 -16.206 1.00 0.00 O ATOM 1242 CB SER A 81 -6.204 -18.703 -13.367 1.00 0.00 C ATOM 1243 OG SER A 81 -5.608 -17.631 -14.077 1.00 0.00 O ATOM 0 H SER A 81 -3.677 -19.648 -14.429 1.00 0.00 H new ATOM 0 HA SER A 81 -6.079 -20.854 -13.242 1.00 0.00 H new ATOM 0 HB2 SER A 81 -7.285 -18.681 -13.508 1.00 0.00 H new ATOM 0 HB3 SER A 81 -6.020 -18.584 -12.299 1.00 0.00 H new ATOM 0 HG SER A 81 -6.308 -17.037 -14.420 1.00 0.00 H new ATOM 1249 N SER A 82 -7.277 -20.694 -15.521 1.00 0.00 N ATOM 1250 CA SER A 82 -7.814 -20.878 -16.865 1.00 0.00 C ATOM 1251 C SER A 82 -9.320 -20.604 -16.878 1.00 0.00 C ATOM 1252 O SER A 82 -10.079 -21.212 -16.113 1.00 0.00 O ATOM 1253 CB SER A 82 -7.531 -22.303 -17.363 1.00 0.00 C ATOM 1254 OG SER A 82 -6.137 -22.582 -17.367 1.00 0.00 O ATOM 0 H SER A 82 -7.940 -20.908 -14.776 1.00 0.00 H new ATOM 0 HA SER A 82 -7.324 -20.170 -17.534 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.046 -23.022 -16.726 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.931 -22.425 -18.370 1.00 0.00 H new ATOM 0 HG SER A 82 -5.987 -23.496 -17.687 1.00 0.00 H new ATOM 1260 N GLU A 83 -9.743 -19.672 -17.729 1.00 0.00 N ATOM 1261 CA GLU A 83 -11.159 -19.371 -17.906 1.00 0.00 C ATOM 1262 C GLU A 83 -11.762 -20.315 -18.941 1.00 0.00 C ATOM 1263 O GLU A 83 -11.309 -20.367 -20.086 1.00 0.00 O ATOM 1264 CB GLU A 83 -11.365 -17.912 -18.345 1.00 0.00 C ATOM 1265 CG GLU A 83 -12.821 -17.572 -18.661 1.00 0.00 C ATOM 1266 CD GLU A 83 -13.027 -16.120 -19.064 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -12.750 -15.780 -20.234 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -13.474 -15.310 -18.221 1.00 0.00 O ATOM 0 H GLU A 83 -9.120 -19.110 -18.309 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.661 -19.511 -16.949 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.008 -17.249 -17.556 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.755 -17.716 -19.227 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.171 -18.218 -19.466 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.435 -17.790 -17.787 1.00 0.00 H new ATOM 1275 N LYS A 84 -12.776 -21.061 -18.530 1.00 0.00 N ATOM 1276 CA LYS A 84 -13.445 -22.018 -19.404 1.00 0.00 C ATOM 1277 C LYS A 84 -14.855 -21.516 -19.720 1.00 0.00 C ATOM 1278 O LYS A 84 -15.847 -22.210 -19.483 1.00 0.00 O ATOM 1279 CB LYS A 84 -13.496 -23.400 -18.727 1.00 0.00 C ATOM 1280 CG LYS A 84 -12.161 -23.854 -18.133 1.00 0.00 C ATOM 1281 CD LYS A 84 -11.073 -24.000 -19.196 1.00 0.00 C ATOM 1282 CE LYS A 84 -11.366 -25.139 -20.165 1.00 0.00 C ATOM 1283 NZ LYS A 84 -10.305 -25.275 -21.198 1.00 0.00 N ATOM 0 H LYS A 84 -13.159 -21.022 -17.585 1.00 0.00 H new ATOM 0 HA LYS A 84 -12.889 -22.115 -20.337 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -14.245 -23.377 -17.935 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -13.826 -24.139 -19.457 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -11.837 -23.134 -17.381 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -12.298 -24.808 -17.623 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.982 -23.067 -19.752 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.113 -24.176 -18.710 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.455 -26.073 -19.611 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -12.326 -24.964 -20.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.542 -26.060 -21.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.237 -24.393 -21.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -9.393 -25.467 -20.736 1.00 0.00 H new ATOM 1297 N GLY A 85 -14.929 -20.289 -20.229 1.00 0.00 N ATOM 1298 CA GLY A 85 -16.205 -19.688 -20.575 1.00 0.00 C ATOM 1299 C GLY A 85 -17.090 -19.455 -19.362 1.00 0.00 C ATOM 1300 O GLY A 85 -16.844 -18.543 -18.572 1.00 0.00 O ATOM 0 H GLY A 85 -14.119 -19.696 -20.409 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.030 -18.738 -21.080 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.726 -20.333 -21.282 1.00 0.00 H new ATOM 1304 N SER A 86 -18.109 -20.296 -19.204 1.00 0.00 N ATOM 1305 CA SER A 86 -19.069 -20.162 -18.112 1.00 0.00 C ATOM 1306 C SER A 86 -18.569 -20.870 -16.850 1.00 0.00 C ATOM 1307 O SER A 86 -19.241 -20.875 -15.814 1.00 0.00 O ATOM 1308 CB SER A 86 -20.420 -20.739 -18.542 1.00 0.00 C ATOM 1309 OG SER A 86 -20.832 -20.197 -19.788 1.00 0.00 O ATOM 0 H SER A 86 -18.292 -21.084 -19.825 1.00 0.00 H new ATOM 0 HA SER A 86 -19.184 -19.103 -17.880 1.00 0.00 H new ATOM 0 HB2 SER A 86 -20.348 -21.824 -18.619 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.170 -20.523 -17.782 1.00 0.00 H new ATOM 0 HG SER A 86 -21.697 -20.582 -20.042 1.00 0.00 H new ATOM 1315 N ARG A 87 -17.392 -21.475 -16.950 1.00 0.00 N ATOM 1316 CA ARG A 87 -16.753 -22.131 -15.816 1.00 0.00 C ATOM 1317 C ARG A 87 -15.283 -21.726 -15.790 1.00 0.00 C ATOM 1318 O ARG A 87 -14.780 -21.163 -16.759 1.00 0.00 O ATOM 1319 CB ARG A 87 -16.888 -23.660 -15.934 1.00 0.00 C ATOM 1320 CG ARG A 87 -16.732 -24.414 -14.611 1.00 0.00 C ATOM 1321 CD ARG A 87 -17.883 -24.113 -13.652 1.00 0.00 C ATOM 1322 NE ARG A 87 -17.854 -24.960 -12.454 1.00 0.00 N ATOM 1323 CZ ARG A 87 -18.626 -26.039 -12.279 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -19.444 -26.444 -13.246 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -18.575 -26.713 -11.138 1.00 0.00 N ATOM 0 H ARG A 87 -16.855 -21.525 -17.816 1.00 0.00 H new ATOM 0 HA ARG A 87 -17.238 -21.824 -14.889 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -17.864 -23.894 -16.358 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -16.139 -24.025 -16.637 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -16.691 -25.486 -14.805 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -15.787 -24.138 -14.144 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -17.838 -23.066 -13.353 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -18.831 -24.256 -14.171 1.00 0.00 H new ATOM 0 HE ARG A 87 -17.205 -24.711 -11.708 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -19.485 -25.932 -14.127 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -20.030 -27.267 -13.107 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -17.947 -26.409 -10.394 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -19.163 -27.535 -11.005 1.00 0.00 H new ATOM 1339 N GLY A 88 -14.600 -21.990 -14.691 1.00 0.00 N ATOM 1340 CA GLY A 88 -13.192 -21.661 -14.599 1.00 0.00 C ATOM 1341 C GLY A 88 -12.496 -22.468 -13.535 1.00 0.00 C ATOM 1342 O GLY A 88 -13.148 -23.091 -12.693 1.00 0.00 O ATOM 0 H GLY A 88 -14.994 -22.427 -13.858 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.714 -21.840 -15.562 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.081 -20.599 -14.380 1.00 0.00 H new ATOM 1346 N THR A 89 -11.175 -22.476 -13.577 1.00 0.00 N ATOM 1347 CA THR A 89 -10.379 -23.189 -12.593 1.00 0.00 C ATOM 1348 C THR A 89 -9.078 -22.438 -12.328 1.00 0.00 C ATOM 1349 O THR A 89 -8.465 -21.896 -13.253 1.00 0.00 O ATOM 1350 CB THR A 89 -10.065 -24.628 -13.069 1.00 0.00 C ATOM 1351 OG1 THR A 89 -11.282 -25.298 -13.434 1.00 0.00 O ATOM 1352 CG2 THR A 89 -9.353 -25.428 -11.981 1.00 0.00 C ATOM 0 H THR A 89 -10.627 -21.992 -14.289 1.00 0.00 H new ATOM 0 HA THR A 89 -10.956 -23.250 -11.671 1.00 0.00 H new ATOM 0 HB THR A 89 -9.406 -24.559 -13.934 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.077 -26.208 -13.736 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.146 -26.434 -12.346 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.415 -24.936 -11.722 1.00 0.00 H new ATOM 0 HG23 THR A 89 -9.988 -25.486 -11.097 1.00 0.00 H new ATOM 1360 N VAL A 90 -8.683 -22.381 -11.065 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.429 -21.761 -10.671 1.00 0.00 C ATOM 1362 C VAL A 90 -6.811 -22.543 -9.520 1.00 0.00 C ATOM 1363 O VAL A 90 -7.507 -22.950 -8.584 1.00 0.00 O ATOM 1364 CB VAL A 90 -7.618 -20.274 -10.264 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -8.617 -20.139 -9.119 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.277 -19.632 -9.899 1.00 0.00 C ATOM 0 H VAL A 90 -9.222 -22.762 -10.287 1.00 0.00 H new ATOM 0 HA VAL A 90 -6.762 -21.781 -11.533 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.024 -19.742 -11.124 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.729 -19.087 -8.856 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.582 -20.540 -9.429 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.255 -20.693 -8.253 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.437 -18.591 -9.618 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.832 -20.170 -9.062 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.606 -19.677 -10.757 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.516 -22.783 -9.614 1.00 0.00 N ATOM 1377 CA GLU A 91 -4.789 -23.486 -8.573 1.00 0.00 C ATOM 1378 C GLU A 91 -3.918 -22.492 -7.817 1.00 0.00 C ATOM 1379 O GLU A 91 -3.217 -21.680 -8.432 1.00 0.00 O ATOM 1380 CB GLU A 91 -3.936 -24.602 -9.185 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.378 -25.579 -8.161 1.00 0.00 C ATOM 1382 CD GLU A 91 -2.556 -26.685 -8.797 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -3.140 -27.540 -9.495 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -1.322 -26.697 -8.607 1.00 0.00 O ATOM 0 H GLU A 91 -4.942 -22.499 -10.408 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.493 -23.944 -7.878 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.538 -25.152 -9.908 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.108 -24.154 -9.735 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.759 -25.036 -7.446 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.201 -26.020 -7.599 1.00 0.00 H new ATOM 1391 N PHE A 92 -3.973 -22.540 -6.493 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.245 -21.587 -5.668 1.00 0.00 C ATOM 1393 C PHE A 92 -2.884 -22.188 -4.315 1.00 0.00 C ATOM 1394 O PHE A 92 -3.273 -23.314 -3.989 1.00 0.00 O ATOM 1395 CB PHE A 92 -4.068 -20.303 -5.478 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.408 -20.515 -4.813 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -6.532 -20.824 -5.567 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -5.546 -20.394 -3.435 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -7.760 -21.010 -4.962 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -6.773 -20.577 -2.828 1.00 0.00 C ATOM 1401 CZ PHE A 92 -7.881 -20.885 -3.592 1.00 0.00 C ATOM 0 H PHE A 92 -4.513 -23.228 -5.968 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.318 -21.339 -6.184 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.488 -19.598 -4.882 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.228 -19.841 -6.452 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.445 -20.920 -6.639 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.683 -20.154 -2.832 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.625 -21.253 -5.561 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.866 -20.479 -1.756 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.841 -21.028 -3.119 1.00 0.00 H new ATOM 1411 N ILE A 93 -2.129 -21.420 -3.541 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.707 -21.811 -2.206 1.00 0.00 C ATOM 1413 C ILE A 93 -1.948 -20.655 -1.239 1.00 0.00 C ATOM 1414 O ILE A 93 -1.354 -19.585 -1.381 1.00 0.00 O ATOM 1415 CB ILE A 93 -0.203 -22.200 -2.181 1.00 0.00 C ATOM 1416 CG1 ILE A 93 0.060 -23.417 -3.083 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.255 -22.482 -0.752 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.524 -23.782 -3.217 1.00 0.00 C ATOM 0 H ILE A 93 -1.790 -20.501 -3.826 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.290 -22.681 -1.905 1.00 0.00 H new ATOM 0 HB ILE A 93 0.373 -21.359 -2.567 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.482 -24.275 -2.685 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.345 -23.215 -4.074 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.311 -22.753 -0.755 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.111 -21.591 -0.141 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.329 -23.304 -0.338 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.624 -24.650 -3.869 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.071 -22.942 -3.645 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.932 -24.017 -2.234 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.841 -20.860 -0.279 1.00 0.00 N ATOM 1431 CA ALA A 94 -3.129 -19.849 0.733 1.00 0.00 C ATOM 1432 C ALA A 94 -2.194 -20.025 1.925 1.00 0.00 C ATOM 1433 O ALA A 94 -2.281 -21.023 2.643 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.589 -19.939 1.173 1.00 0.00 C ATOM 0 H ALA A 94 -3.380 -21.720 -0.179 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.963 -18.861 0.304 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.789 -19.179 1.928 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.239 -19.776 0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.782 -20.926 1.592 1.00 0.00 H new ATOM 1440 N ARG A 95 -1.289 -19.070 2.121 1.00 0.00 N ATOM 1441 CA ARG A 95 -0.336 -19.133 3.225 1.00 0.00 C ATOM 1442 C ARG A 95 -0.860 -18.338 4.416 1.00 0.00 C ATOM 1443 O ARG A 95 -1.049 -17.122 4.330 1.00 0.00 O ATOM 1444 CB ARG A 95 1.035 -18.596 2.791 1.00 0.00 C ATOM 1445 CG ARG A 95 2.089 -18.653 3.895 1.00 0.00 C ATOM 1446 CD ARG A 95 3.438 -18.120 3.428 1.00 0.00 C ATOM 1447 NE ARG A 95 4.433 -18.141 4.503 1.00 0.00 N ATOM 1448 CZ ARG A 95 5.734 -17.913 4.330 1.00 0.00 C ATOM 1449 NH1 ARG A 95 6.218 -17.671 3.117 1.00 0.00 N ATOM 1450 NH2 ARG A 95 6.548 -17.937 5.377 1.00 0.00 N ATOM 0 H ARG A 95 -1.196 -18.244 1.530 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.218 -20.176 3.519 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.387 -19.170 1.934 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.924 -17.564 2.459 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.747 -18.073 4.752 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.204 -19.683 4.233 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.795 -18.719 2.590 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.319 -17.100 3.063 1.00 0.00 H new ATOM 0 HE ARG A 95 4.108 -18.344 5.448 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.593 -17.659 2.311 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.215 -17.497 2.991 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.177 -18.129 6.307 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.545 -17.763 5.252 1.00 0.00 H new ATOM 1464 N PHE A 96 -1.095 -19.032 5.521 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.639 -18.418 6.723 1.00 0.00 C ATOM 1466 C PHE A 96 -0.964 -18.975 7.975 1.00 0.00 C ATOM 1467 O PHE A 96 -0.196 -19.935 7.910 1.00 0.00 O ATOM 1468 CB PHE A 96 -3.164 -18.626 6.786 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.611 -20.020 6.412 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -3.273 -21.112 7.198 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.368 -20.236 5.267 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -3.677 -22.386 6.852 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -4.776 -21.509 4.918 1.00 0.00 C ATOM 1474 CZ PHE A 96 -4.430 -22.585 5.711 1.00 0.00 C ATOM 0 H PHE A 96 -0.915 -20.032 5.609 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.437 -17.348 6.683 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.509 -18.404 7.796 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -3.646 -17.910 6.120 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.686 -20.964 8.092 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.641 -19.398 4.642 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -3.405 -23.227 7.473 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.365 -21.662 4.026 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.748 -23.581 5.440 1.00 0.00 H new ATOM 1484 N ARG A 97 -1.266 -18.361 9.108 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.697 -18.735 10.394 1.00 0.00 C ATOM 1486 C ARG A 97 -1.824 -19.141 11.338 1.00 0.00 C ATOM 1487 O ARG A 97 -2.743 -18.359 11.583 1.00 0.00 O ATOM 1488 CB ARG A 97 0.085 -17.543 10.966 1.00 0.00 C ATOM 1489 CG ARG A 97 0.777 -17.811 12.297 1.00 0.00 C ATOM 1490 CD ARG A 97 1.623 -16.617 12.736 1.00 0.00 C ATOM 1491 NE ARG A 97 0.872 -15.356 12.675 1.00 0.00 N ATOM 1492 CZ ARG A 97 0.905 -14.406 13.611 1.00 0.00 C ATOM 1493 NH1 ARG A 97 1.647 -14.556 14.702 1.00 0.00 N ATOM 1494 NH2 ARG A 97 0.200 -13.297 13.441 1.00 0.00 N ATOM 0 H ARG A 97 -1.920 -17.580 9.162 1.00 0.00 H new ATOM 0 HA ARG A 97 -0.015 -19.577 10.276 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.836 -17.236 10.238 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.599 -16.704 11.091 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.030 -18.029 13.060 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.410 -18.694 12.209 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.977 -16.779 13.754 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.505 -16.544 12.100 1.00 0.00 H new ATOM 0 HE ARG A 97 0.283 -15.195 11.858 1.00 0.00 H new ATOM 0 HH11 ARG A 97 2.199 -15.404 14.831 1.00 0.00 H new ATOM 0 HH12 ARG A 97 1.665 -13.823 15.411 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -0.363 -13.174 12.599 1.00 0.00 H new ATOM 0 HH22 ARG A 97 0.220 -12.566 14.152 1.00 0.00 H new ATOM 1508 N ARG A 98 -1.769 -20.364 11.848 1.00 0.00 N ATOM 1509 CA ARG A 98 -2.830 -20.882 12.704 1.00 0.00 C ATOM 1510 C ARG A 98 -2.607 -20.488 14.155 1.00 0.00 C ATOM 1511 O ARG A 98 -1.481 -20.542 14.661 1.00 0.00 O ATOM 1512 CB ARG A 98 -2.935 -22.406 12.584 1.00 0.00 C ATOM 1513 CG ARG A 98 -3.418 -22.871 11.220 1.00 0.00 C ATOM 1514 CD ARG A 98 -3.705 -24.367 11.196 1.00 0.00 C ATOM 1515 NE ARG A 98 -2.526 -25.177 11.528 1.00 0.00 N ATOM 1516 CZ ARG A 98 -2.462 -26.503 11.361 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -3.504 -27.167 10.878 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -1.360 -27.163 11.690 1.00 0.00 N ATOM 0 H ARG A 98 -1.002 -21.016 11.685 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.768 -20.440 12.367 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -1.959 -22.847 12.786 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -3.617 -22.777 13.349 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -4.321 -22.324 10.949 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.665 -22.634 10.469 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -4.505 -24.590 11.902 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -4.066 -24.647 10.207 1.00 0.00 H new ATOM 0 HE ARG A 98 -1.708 -24.701 11.908 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -4.358 -26.667 10.632 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -3.451 -28.178 10.752 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -0.559 -26.660 12.071 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -1.313 -28.174 11.562 1.00 0.00 H new ATOM 1553 N PRO A 102 2.361 -21.358 14.603 1.00 0.00 N ATOM 1554 CA PRO A 102 2.630 -22.263 13.476 1.00 0.00 C ATOM 1555 C PRO A 102 1.935 -21.824 12.185 1.00 0.00 C ATOM 1556 O PRO A 102 0.748 -21.484 12.184 1.00 0.00 O ATOM 1557 CB PRO A 102 2.076 -23.609 13.963 1.00 0.00 C ATOM 1558 CG PRO A 102 1.018 -23.242 14.947 1.00 0.00 C ATOM 1559 CD PRO A 102 1.516 -21.997 15.633 1.00 0.00 C ATOM 0 HA PRO A 102 3.689 -22.290 13.221 1.00 0.00 H new ATOM 0 HB2 PRO A 102 1.666 -24.192 13.138 1.00 0.00 H new ATOM 0 HB3 PRO A 102 2.855 -24.215 14.425 1.00 0.00 H new ATOM 0 HG2 PRO A 102 0.066 -23.061 14.449 1.00 0.00 H new ATOM 0 HG3 PRO A 102 0.854 -24.046 15.665 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.694 -21.349 15.938 1.00 0.00 H new ATOM 0 HD3 PRO A 102 2.086 -22.233 16.532 1.00 0.00 H new ATOM 1567 N GLU A 103 2.688 -21.831 11.091 1.00 0.00 N ATOM 1568 CA GLU A 103 2.153 -21.499 9.774 1.00 0.00 C ATOM 1569 C GLU A 103 1.567 -22.736 9.092 1.00 0.00 C ATOM 1570 O GLU A 103 1.709 -23.861 9.578 1.00 0.00 O ATOM 1571 CB GLU A 103 3.256 -20.912 8.880 1.00 0.00 C ATOM 1572 CG GLU A 103 3.714 -19.509 9.263 1.00 0.00 C ATOM 1573 CD GLU A 103 4.903 -19.052 8.432 1.00 0.00 C ATOM 1574 OE1 GLU A 103 4.752 -18.918 7.199 1.00 0.00 O ATOM 1575 OE2 GLU A 103 5.999 -18.859 8.997 1.00 0.00 O ATOM 0 H GLU A 103 3.681 -22.065 11.090 1.00 0.00 H new ATOM 0 HA GLU A 103 1.363 -20.762 9.916 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.118 -21.579 8.905 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.898 -20.893 7.851 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.889 -18.809 9.131 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.981 -19.491 10.320 1.00 0.00 H new ATOM 1582 N GLN A 104 0.894 -22.499 7.975 1.00 0.00 N ATOM 1583 CA GLN A 104 0.427 -23.553 7.085 1.00 0.00 C ATOM 1584 C GLN A 104 0.114 -22.938 5.727 1.00 0.00 C ATOM 1585 O GLN A 104 -0.286 -21.775 5.647 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.825 -24.252 7.635 1.00 0.00 C ATOM 1587 CG GLN A 104 -1.336 -25.379 6.731 1.00 0.00 C ATOM 1588 CD GLN A 104 -2.727 -25.874 7.092 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -3.072 -25.824 8.367 1.00 0.00 O flip ATOM 1590 NE2 GLN A 104 -3.485 -26.308 6.226 1.00 0.00 N flip ATOM 0 H GLN A 104 0.654 -21.560 7.658 1.00 0.00 H new ATOM 0 HA GLN A 104 1.211 -24.306 6.998 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -0.602 -24.659 8.621 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.616 -23.514 7.767 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.342 -25.029 5.699 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -0.639 -26.216 6.780 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -3.185 -26.332 5.251 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -4.413 -26.644 6.483 1.00 0.00 H new ATOM 1599 N SER A 105 0.297 -23.706 4.667 1.00 0.00 N ATOM 1600 CA SER A 105 -0.021 -23.244 3.326 1.00 0.00 C ATOM 1601 C SER A 105 -0.929 -24.257 2.634 1.00 0.00 C ATOM 1602 O SER A 105 -0.513 -25.378 2.331 1.00 0.00 O ATOM 1603 CB SER A 105 1.271 -23.005 2.531 1.00 0.00 C ATOM 1604 OG SER A 105 2.155 -24.111 2.626 1.00 0.00 O ATOM 0 H SER A 105 0.666 -24.656 4.709 1.00 0.00 H new ATOM 0 HA SER A 105 -0.555 -22.296 3.382 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.026 -22.823 1.485 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.767 -22.109 2.903 1.00 0.00 H new ATOM 0 HG SER A 105 1.645 -24.945 2.554 1.00 0.00 H new ATOM 1610 N HIS A 106 -2.175 -23.858 2.403 1.00 0.00 N ATOM 1611 CA HIS A 106 -3.178 -24.750 1.834 1.00 0.00 C ATOM 1612 C HIS A 106 -3.143 -24.680 0.309 1.00 0.00 C ATOM 1613 O HIS A 106 -3.553 -23.682 -0.289 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.573 -24.385 2.363 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.639 -25.384 2.015 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -5.916 -26.490 2.789 1.00 0.00 N ATOM 1617 CD2 HIS A 106 -6.508 -25.429 0.980 1.00 0.00 C ATOM 1618 CE1 HIS A 106 -6.907 -27.170 2.244 1.00 0.00 C ATOM 1619 NE2 HIS A 106 -7.286 -26.548 1.145 1.00 0.00 N ATOM 0 H HIS A 106 -2.516 -22.917 2.602 1.00 0.00 H new ATOM 0 HA HIS A 106 -2.953 -25.773 2.136 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.524 -24.284 3.447 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.858 -23.411 1.965 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -6.577 -24.716 0.172 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -7.335 -28.082 2.633 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -8.034 -26.849 0.520 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.635 -25.741 -0.303 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.497 -25.829 -1.753 1.00 0.00 C ATOM 1630 C HIS A 107 -3.715 -26.523 -2.354 1.00 0.00 C ATOM 1631 O HIS A 107 -3.823 -27.750 -2.315 1.00 0.00 O ATOM 1632 CB HIS A 107 -1.209 -26.597 -2.099 1.00 0.00 C ATOM 1633 CG HIS A 107 -0.957 -26.795 -3.566 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -0.042 -27.708 -4.045 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.484 -26.189 -4.660 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -0.013 -27.654 -5.363 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -0.878 -26.742 -5.760 1.00 0.00 N ATOM 0 H HIS A 107 -2.305 -26.569 0.193 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.434 -24.826 -2.174 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.361 -26.064 -1.670 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.248 -27.574 -1.618 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.239 -25.416 -4.664 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.613 -28.255 -6.007 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.067 -26.488 -6.730 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.632 -25.740 -2.910 1.00 0.00 N ATOM 1647 CA GLU A 108 -5.865 -26.288 -3.461 1.00 0.00 C ATOM 1648 C GLU A 108 -6.073 -25.854 -4.906 1.00 0.00 C ATOM 1649 O GLU A 108 -5.509 -24.856 -5.366 1.00 0.00 O ATOM 1650 CB GLU A 108 -7.077 -25.870 -2.616 1.00 0.00 C ATOM 1651 CG GLU A 108 -7.340 -24.368 -2.591 1.00 0.00 C ATOM 1652 CD GLU A 108 -8.660 -24.020 -1.917 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -8.693 -23.928 -0.671 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -9.673 -23.845 -2.628 1.00 0.00 O ATOM 0 H GLU A 108 -4.545 -24.727 -2.991 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.772 -27.374 -3.437 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.963 -26.375 -2.999 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -6.929 -26.218 -1.594 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.525 -23.868 -2.067 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -7.345 -23.986 -3.612 1.00 0.00 H new ATOM 1661 N ARG A 109 -6.878 -26.634 -5.612 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.304 -26.314 -6.964 1.00 0.00 C ATOM 1663 C ARG A 109 -8.797 -26.006 -6.938 1.00 0.00 C ATOM 1664 O ARG A 109 -9.622 -26.910 -6.785 1.00 0.00 O ATOM 1665 CB ARG A 109 -6.992 -27.491 -7.902 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.506 -27.320 -9.328 1.00 0.00 C ATOM 1667 CD ARG A 109 -7.058 -28.470 -10.229 1.00 0.00 C ATOM 1668 NE ARG A 109 -7.372 -29.783 -9.650 1.00 0.00 N ATOM 1669 CZ ARG A 109 -7.816 -30.831 -10.350 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -8.070 -30.711 -11.649 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -8.028 -31.994 -9.744 1.00 0.00 N ATOM 0 H ARG A 109 -7.256 -27.513 -5.259 1.00 0.00 H new ATOM 0 HA ARG A 109 -6.767 -25.443 -7.339 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.912 -27.637 -7.934 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.424 -28.399 -7.481 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.595 -27.267 -9.319 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.144 -26.376 -9.735 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.543 -28.378 -11.201 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -5.984 -28.398 -10.400 1.00 0.00 H new ATOM 0 HE ARG A 109 -7.242 -29.903 -8.645 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -7.926 -29.816 -12.116 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -8.409 -31.514 -12.179 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -7.852 -32.087 -8.744 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -8.367 -32.794 -10.279 1.00 0.00 H new ATOM 1685 N SER A 110 -9.136 -24.727 -7.045 1.00 0.00 N ATOM 1686 CA SER A 110 -10.514 -24.277 -6.888 1.00 0.00 C ATOM 1687 C SER A 110 -11.174 -24.024 -8.243 1.00 0.00 C ATOM 1688 O SER A 110 -10.559 -23.467 -9.158 1.00 0.00 O ATOM 1689 CB SER A 110 -10.552 -23.006 -6.029 1.00 0.00 C ATOM 1690 OG SER A 110 -11.881 -22.562 -5.811 1.00 0.00 O ATOM 0 H SER A 110 -8.471 -23.979 -7.241 1.00 0.00 H new ATOM 0 HA SER A 110 -11.076 -25.066 -6.388 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.071 -23.200 -5.070 1.00 0.00 H new ATOM 0 HB3 SER A 110 -9.980 -22.218 -6.519 1.00 0.00 H new ATOM 0 HG SER A 110 -12.039 -21.740 -6.320 1.00 0.00 H new ATOM 1696 N GLN A 111 -12.420 -24.472 -8.371 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.229 -24.209 -9.552 1.00 0.00 C ATOM 1698 C GLN A 111 -14.199 -23.065 -9.269 1.00 0.00 C ATOM 1699 O GLN A 111 -14.786 -22.982 -8.184 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.022 -25.453 -9.981 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.175 -26.646 -10.421 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.439 -27.328 -9.276 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -11.196 -26.939 -9.052 1.00 0.00 O flip ATOM 1704 NE2 GLN A 111 -12.979 -28.218 -8.614 1.00 0.00 N flip ATOM 0 H GLN A 111 -12.895 -25.027 -7.659 1.00 0.00 H new ATOM 0 HA GLN A 111 -12.555 -23.936 -10.364 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -14.655 -25.764 -9.150 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -14.685 -25.177 -10.801 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -13.818 -27.375 -10.914 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.448 -26.311 -11.161 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -13.941 -28.492 -8.816 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -12.464 -28.680 -7.865 1.00 0.00 H new ATOM 1713 N PHE A 112 -14.361 -22.192 -10.250 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.268 -21.053 -10.151 1.00 0.00 C ATOM 1715 C PHE A 112 -16.252 -21.090 -11.314 1.00 0.00 C ATOM 1716 O PHE A 112 -15.885 -21.473 -12.428 1.00 0.00 O ATOM 1717 CB PHE A 112 -14.479 -19.732 -10.171 1.00 0.00 C ATOM 1718 CG PHE A 112 -13.633 -19.502 -8.940 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -12.429 -20.170 -8.770 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.045 -18.619 -7.952 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -11.658 -19.962 -7.642 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -13.276 -18.408 -6.824 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.082 -19.081 -6.669 1.00 0.00 C ATOM 0 H PHE A 112 -13.867 -22.251 -11.141 1.00 0.00 H new ATOM 0 HA PHE A 112 -15.813 -21.113 -9.209 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -13.834 -19.719 -11.050 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.180 -18.904 -10.278 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.090 -20.861 -9.528 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -14.979 -18.090 -8.066 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -10.723 -20.489 -7.522 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -13.609 -17.717 -6.064 1.00 0.00 H new ATOM 0 HZ PHE A 112 -11.480 -18.918 -5.787 1.00 0.00 H new ATOM 1733 N ARG A 113 -17.498 -20.718 -11.059 1.00 0.00 N ATOM 1734 CA ARG A 113 -18.509 -20.660 -12.108 1.00 0.00 C ATOM 1735 C ARG A 113 -18.870 -19.213 -12.416 1.00 0.00 C ATOM 1736 O ARG A 113 -18.996 -18.384 -11.512 1.00 0.00 O ATOM 1737 CB ARG A 113 -19.758 -21.464 -11.712 1.00 0.00 C ATOM 1738 CG ARG A 113 -20.906 -21.356 -12.715 1.00 0.00 C ATOM 1739 CD ARG A 113 -21.890 -22.516 -12.593 1.00 0.00 C ATOM 1740 NE ARG A 113 -22.424 -22.673 -11.238 1.00 0.00 N ATOM 1741 CZ ARG A 113 -23.395 -23.530 -10.914 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -23.936 -24.318 -11.837 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -23.816 -23.614 -9.661 1.00 0.00 N ATOM 0 H ARG A 113 -17.835 -20.451 -10.134 1.00 0.00 H new ATOM 0 HA ARG A 113 -18.095 -21.111 -13.010 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -19.483 -22.513 -11.601 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.106 -21.120 -10.738 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.435 -20.416 -12.559 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -20.501 -21.330 -13.727 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.716 -22.359 -13.287 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -21.394 -23.439 -12.891 1.00 0.00 H new ATOM 0 HE ARG A 113 -22.030 -22.093 -10.497 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -23.610 -24.271 -12.802 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -24.677 -24.970 -11.580 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -23.398 -23.023 -8.942 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -24.558 -24.269 -9.415 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.009 -18.917 -13.701 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.339 -17.577 -14.158 1.00 0.00 C ATOM 1759 C LYS A 114 -20.857 -17.421 -14.209 1.00 0.00 C ATOM 1760 O LYS A 114 -21.514 -17.953 -15.106 1.00 0.00 O ATOM 1761 CB LYS A 114 -18.715 -17.349 -15.542 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.408 -15.891 -15.854 1.00 0.00 C ATOM 1763 CD LYS A 114 -17.589 -15.758 -17.135 1.00 0.00 C ATOM 1764 CE LYS A 114 -16.986 -14.370 -17.275 1.00 0.00 C ATOM 1765 NZ LYS A 114 -16.160 -14.246 -18.508 1.00 0.00 N ATOM 0 H LYS A 114 -18.896 -19.597 -14.453 1.00 0.00 H new ATOM 0 HA LYS A 114 -18.939 -16.833 -13.470 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -17.793 -17.926 -15.612 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -19.393 -17.737 -16.302 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.340 -15.335 -15.956 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -17.861 -15.446 -15.023 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -16.793 -16.503 -17.137 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -18.224 -15.968 -17.996 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -17.784 -13.628 -17.296 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -16.371 -14.152 -16.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -16.077 -13.243 -18.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.213 -14.637 -18.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -16.613 -14.771 -19.283 1.00 0.00 H new ATOM 1779 N ALA A 115 -21.409 -16.703 -13.238 1.00 0.00 N ATOM 1780 CA ALA A 115 -22.850 -16.503 -13.140 1.00 0.00 C ATOM 1781 C ALA A 115 -23.200 -15.036 -13.361 1.00 0.00 C ATOM 1782 O ALA A 115 -22.725 -14.156 -12.637 1.00 0.00 O ATOM 1783 CB ALA A 115 -23.363 -16.982 -11.785 1.00 0.00 C ATOM 0 H ALA A 115 -20.874 -16.245 -12.500 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.336 -17.092 -13.918 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -24.440 -16.826 -11.728 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.143 -18.043 -11.667 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -22.872 -16.420 -10.991 1.00 0.00 H new ATOM 1789 N ARG A 116 -24.013 -14.784 -14.384 1.00 0.00 N ATOM 1790 CA ARG A 116 -24.450 -13.434 -14.736 1.00 0.00 C ATOM 1791 C ARG A 116 -23.245 -12.562 -15.107 1.00 0.00 C ATOM 1792 O ARG A 116 -23.304 -11.331 -15.034 1.00 0.00 O ATOM 1793 CB ARG A 116 -25.246 -12.797 -13.578 1.00 0.00 C ATOM 1794 CG ARG A 116 -26.343 -11.838 -14.037 1.00 0.00 C ATOM 1795 CD ARG A 116 -27.466 -12.588 -14.748 1.00 0.00 C ATOM 1796 NE ARG A 116 -28.493 -11.692 -15.283 1.00 0.00 N ATOM 1797 CZ ARG A 116 -29.792 -11.991 -15.331 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -30.247 -13.099 -14.755 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -30.643 -11.173 -15.936 1.00 0.00 N ATOM 0 H ARG A 116 -24.388 -15.511 -14.994 1.00 0.00 H new ATOM 0 HA ARG A 116 -25.108 -13.501 -15.602 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.696 -13.589 -12.980 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -24.556 -12.260 -12.928 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -26.746 -11.303 -13.177 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -25.920 -11.090 -14.707 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -27.045 -13.178 -15.562 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -27.927 -13.288 -14.052 1.00 0.00 H new ATOM 0 HE ARG A 116 -28.197 -10.784 -15.641 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -29.602 -13.725 -14.273 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -31.241 -13.323 -14.795 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -30.305 -10.312 -16.366 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -31.636 -11.405 -15.971 1.00 0.00 H new ATOM 1813 N GLY A 117 -22.162 -13.211 -15.528 1.00 0.00 N ATOM 1814 CA GLY A 117 -20.950 -12.502 -15.907 1.00 0.00 C ATOM 1815 C GLY A 117 -19.959 -12.358 -14.764 1.00 0.00 C ATOM 1816 O GLY A 117 -18.794 -12.023 -14.989 1.00 0.00 O ATOM 0 H GLY A 117 -22.102 -14.226 -15.614 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -20.470 -13.030 -16.731 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -21.216 -11.511 -16.275 1.00 0.00 H new ATOM 1820 N ARG A 118 -20.406 -12.615 -13.535 1.00 0.00 N ATOM 1821 CA ARG A 118 -19.527 -12.524 -12.368 1.00 0.00 C ATOM 1822 C ARG A 118 -19.025 -13.910 -11.996 1.00 0.00 C ATOM 1823 O ARG A 118 -19.715 -14.901 -12.212 1.00 0.00 O ATOM 1824 CB ARG A 118 -20.238 -11.894 -11.154 1.00 0.00 C ATOM 1825 CG ARG A 118 -20.679 -10.445 -11.352 1.00 0.00 C ATOM 1826 CD ARG A 118 -21.853 -10.324 -12.313 1.00 0.00 C ATOM 1827 NE ARG A 118 -22.231 -8.929 -12.536 1.00 0.00 N ATOM 1828 CZ ARG A 118 -23.391 -8.397 -12.151 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -24.273 -9.127 -11.476 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -23.659 -7.128 -12.429 1.00 0.00 N ATOM 0 H ARG A 118 -21.366 -12.886 -13.322 1.00 0.00 H new ATOM 0 HA ARG A 118 -18.691 -11.878 -12.637 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -21.114 -12.496 -10.911 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -19.570 -11.942 -10.294 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -20.956 -10.017 -10.388 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -19.840 -9.861 -11.731 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -21.593 -10.787 -13.265 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -22.707 -10.873 -11.915 1.00 0.00 H new ATOM 0 HE ARG A 118 -21.565 -8.325 -13.017 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -24.064 -10.099 -11.250 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -25.159 -8.715 -11.184 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -22.978 -6.562 -12.936 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -24.546 -6.718 -12.136 1.00 0.00 H new ATOM 1844 N TRP A 119 -17.822 -13.977 -11.448 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.248 -15.245 -11.020 1.00 0.00 C ATOM 1846 C TRP A 119 -17.627 -15.548 -9.578 1.00 0.00 C ATOM 1847 O TRP A 119 -17.621 -14.658 -8.725 1.00 0.00 O ATOM 1848 CB TRP A 119 -15.727 -15.220 -11.192 1.00 0.00 C ATOM 1849 CG TRP A 119 -15.315 -15.286 -12.626 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -14.998 -14.247 -13.453 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.210 -16.471 -13.411 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -14.686 -14.723 -14.703 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -14.812 -16.087 -14.699 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -15.408 -17.824 -13.140 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -14.614 -17.006 -15.719 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -15.213 -18.737 -14.153 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -14.818 -18.325 -15.431 1.00 0.00 C ATOM 0 H TRP A 119 -17.223 -13.167 -11.288 1.00 0.00 H new ATOM 0 HA TRP A 119 -17.653 -16.040 -11.646 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -15.328 -14.310 -10.744 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -15.289 -16.060 -10.652 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -14.993 -13.206 -13.167 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -14.407 -14.155 -15.502 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.708 -18.150 -12.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -14.309 -16.690 -16.706 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.367 -19.788 -13.958 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.672 -19.065 -16.204 1.00 0.00 H new ATOM 1868 N TYR A 120 -17.977 -16.804 -9.322 1.00 0.00 N ATOM 1869 CA TYR A 120 -18.354 -17.255 -7.989 1.00 0.00 C ATOM 1870 C TYR A 120 -17.671 -18.584 -7.668 1.00 0.00 C ATOM 1871 O TYR A 120 -17.525 -19.443 -8.541 1.00 0.00 O ATOM 1872 CB TYR A 120 -19.879 -17.404 -7.885 1.00 0.00 C ATOM 1873 CG TYR A 120 -20.639 -16.093 -8.013 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -20.866 -15.287 -6.902 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.129 -15.663 -9.242 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -21.555 -14.094 -7.012 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -21.819 -14.471 -9.358 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.030 -13.691 -8.241 1.00 0.00 C ATOM 1879 OH TYR A 120 -22.714 -12.499 -8.354 1.00 0.00 O ATOM 0 H TYR A 120 -18.007 -17.536 -10.032 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.028 -16.508 -7.265 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.221 -18.088 -8.662 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.124 -17.862 -6.927 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -20.497 -15.599 -5.936 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -20.968 -16.271 -10.120 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -21.720 -13.480 -6.139 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.191 -14.152 -10.320 1.00 0.00 H new ATOM 0 HH TYR A 120 -22.980 -12.362 -9.287 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.246 -18.736 -6.418 1.00 0.00 N ATOM 1890 CA PHE A 121 -16.569 -19.947 -5.959 1.00 0.00 C ATOM 1891 C PHE A 121 -17.515 -21.147 -5.963 1.00 0.00 C ATOM 1892 O PHE A 121 -18.471 -21.192 -5.188 1.00 0.00 O ATOM 1893 CB PHE A 121 -15.999 -19.720 -4.551 1.00 0.00 C ATOM 1894 CG PHE A 121 -15.586 -20.987 -3.845 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -14.392 -21.617 -4.158 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -16.400 -21.552 -2.870 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -14.019 -22.780 -3.516 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -16.031 -22.715 -2.227 1.00 0.00 C ATOM 1899 CZ PHE A 121 -14.838 -23.331 -2.550 1.00 0.00 C ATOM 0 H PHE A 121 -17.360 -18.026 -5.695 1.00 0.00 H new ATOM 0 HA PHE A 121 -15.753 -20.166 -6.647 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.136 -19.058 -4.622 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -16.746 -19.206 -3.946 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -13.746 -21.193 -4.913 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -17.334 -21.074 -2.613 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -13.085 -23.260 -3.769 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -16.674 -23.143 -1.472 1.00 0.00 H new ATOM 0 HZ PHE A 121 -14.546 -24.242 -2.048 1.00 0.00 H new ATOM 1909 N SER A 122 -17.231 -22.123 -6.819 1.00 0.00 N ATOM 1910 CA SER A 122 -18.075 -23.305 -6.948 1.00 0.00 C ATOM 1911 C SER A 122 -17.597 -24.418 -6.015 1.00 0.00 C ATOM 1912 O SER A 122 -18.365 -24.934 -5.205 1.00 0.00 O ATOM 1913 CB SER A 122 -18.083 -23.786 -8.401 1.00 0.00 C ATOM 1914 OG SER A 122 -18.509 -22.752 -9.272 1.00 0.00 O ATOM 0 H SER A 122 -16.419 -22.118 -7.436 1.00 0.00 H new ATOM 0 HA SER A 122 -19.092 -23.039 -6.660 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.084 -24.118 -8.684 1.00 0.00 H new ATOM 0 HB3 SER A 122 -18.745 -24.647 -8.500 1.00 0.00 H new ATOM 0 HG SER A 122 -19.431 -22.500 -9.055 1.00 0.00 H new ATOM 1920 N GLU A 123 -16.329 -24.790 -6.126 1.00 0.00 N ATOM 1921 CA GLU A 123 -15.754 -25.800 -5.244 1.00 0.00 C ATOM 1922 C GLU A 123 -14.233 -25.714 -5.243 1.00 0.00 C ATOM 1923 O GLU A 123 -13.643 -24.954 -6.012 1.00 0.00 O ATOM 1924 CB GLU A 123 -16.215 -27.222 -5.623 1.00 0.00 C ATOM 1925 CG GLU A 123 -15.984 -27.617 -7.083 1.00 0.00 C ATOM 1926 CD GLU A 123 -17.107 -27.175 -8.010 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -18.290 -27.414 -7.678 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -16.813 -26.619 -9.090 1.00 0.00 O ATOM 0 H GLU A 123 -15.680 -24.410 -6.815 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.116 -25.594 -4.237 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.696 -27.937 -4.984 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -17.279 -27.312 -5.403 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -15.046 -27.181 -7.426 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.874 -28.700 -7.146 1.00 0.00 H new ATOM 1935 N GLY A 124 -13.610 -26.484 -4.362 1.00 0.00 N ATOM 1936 CA GLY A 124 -12.167 -26.474 -4.231 1.00 0.00 C ATOM 1937 C GLY A 124 -11.694 -27.583 -3.318 1.00 0.00 C ATOM 1938 O GLY A 124 -12.431 -28.005 -2.421 1.00 0.00 O ATOM 0 H GLY A 124 -14.087 -27.124 -3.727 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -11.709 -26.588 -5.214 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -11.841 -25.511 -3.837 1.00 0.00 H new ATOM 1942 N GLU A 125 -10.478 -28.062 -3.538 1.00 0.00 N ATOM 1943 CA GLU A 125 -9.938 -29.173 -2.762 1.00 0.00 C ATOM 1944 C GLU A 125 -8.416 -29.187 -2.835 1.00 0.00 C ATOM 1945 O GLU A 125 -7.832 -28.710 -3.815 1.00 0.00 O ATOM 1946 CB GLU A 125 -10.503 -30.498 -3.287 1.00 0.00 C ATOM 1947 CG GLU A 125 -10.187 -30.755 -4.756 1.00 0.00 C ATOM 1948 CD GLU A 125 -10.825 -32.029 -5.274 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -10.236 -33.114 -5.088 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -11.922 -31.953 -5.861 1.00 0.00 O ATOM 0 H GLU A 125 -9.844 -27.698 -4.249 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.232 -29.047 -1.720 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -10.103 -31.317 -2.689 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -11.584 -30.502 -3.150 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.534 -29.911 -5.352 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.107 -30.815 -4.887 1.00 0.00 H new ATOM 1957 N ALA A 126 -7.782 -29.724 -1.795 1.00 0.00 N ATOM 1958 CA ALA A 126 -6.331 -29.859 -1.762 1.00 0.00 C ATOM 1959 C ALA A 126 -5.849 -30.693 -2.946 1.00 0.00 C ATOM 1960 O ALA A 126 -6.275 -31.838 -3.126 1.00 0.00 O ATOM 1961 CB ALA A 126 -5.884 -30.485 -0.445 1.00 0.00 C ATOM 0 H ALA A 126 -8.255 -30.074 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 126 -5.887 -28.866 -1.837 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -4.798 -30.579 -0.437 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.200 -29.852 0.384 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.334 -31.472 -0.340 1.00 0.00 H new