USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 983 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 130 ASN : amide:sc= -1.13 K(o=-1.1,f=-14!) USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0.0125 USER MOD Set 2.1: A 83 MET CE :methyl -158:sc= -1.92 (180deg=-2.54) USER MOD Set 2.2: A 85 TYR OH : rot 180:sc= -1.4 USER MOD Set 3.1: A 63 THR OG1 : rot -66:sc= 0.518 USER MOD Set 3.2: A 76 LYS NZ :NH3+ -112:sc= 0.791 (180deg=0) USER MOD Set 4.1: A 55 GLN : amide:sc= -12! C(o=-16!,f=-21!) USER MOD Set 4.2: A 56 ASN : amide:sc= -3.77! C(o=-16!,f=-25!) USER MOD Single : A 9 LYS NZ :NH3+ -167:sc=-0.000407 (180deg=-0.234) USER MOD Single : A 11 LYS NZ :NH3+ -156:sc= 0.00188 (180deg=-0.147) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0596) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 161:sc= -0.145 (180deg=-0.748) USER MOD Single : A 30 TYR OH : rot 80:sc= -2.69! USER MOD Single : A 35 THR OG1 : rot -65:sc= 0.25 USER MOD Single : A 38 GLN : amide:sc= -6.16! C(o=-6.2!,f=-4.7!) USER MOD Single : A 40 ASN : amide:sc= -6! C(o=-6!,f=-3.9!) USER MOD Single : A 44 SER OG : rot 120:sc= -1.13 USER MOD Single : A 49 ASN : amide:sc= -1.01 K(o=-1,f=-2.7!) USER MOD Single : A 51 SER OG : rot 180:sc= 0.14 USER MOD Single : A 58 SER OG : rot 180:sc= -2.46 USER MOD Single : A 62 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= -1.54 X(o=-1.5,f=-1.7!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -7.28! C(o=-7.3!,f=-14!) USER MOD Single : A 73 THR OG1 : rot 54:sc= 0.301 USER MOD Single : A 74 ASN : amide:sc= -3.39! C(o=-3.4!,f=-8.6!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.0571) USER MOD Single : A 82 SER OG : rot 61:sc= 0.681 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.121 USER MOD Single : A 94 LYS NZ :NH3+ -164:sc= -0.0295 (180deg=-0.318) USER MOD Single : A 95 TYR OH : rot 180:sc= -0.483 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 77:sc= 0.749 USER MOD Single : A 99 SER OG : rot 180:sc= -0.0569 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.432 USER MOD Single : A 126 CYS SG : rot -102:sc= 0.587 USER MOD Single : A 129 TYR OH : rot 148:sc= -1.4 USER MOD Single : A 132 LYS NZ :NH3+ -163:sc=-0.00946 (180deg=-0.279) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 162:sc= -0.0144 (180deg=-0.62) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.575 10.768 2.141 1.00 0.00 N ATOM 101 CA ILE A 7 11.117 10.792 1.818 1.00 0.00 C ATOM 102 C ILE A 7 10.662 12.252 1.631 1.00 0.00 C ATOM 103 O ILE A 7 10.660 13.011 2.579 1.00 0.00 O ATOM 104 CB ILE A 7 10.334 10.177 2.981 1.00 0.00 C ATOM 105 CG1 ILE A 7 10.980 8.848 3.376 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.887 9.939 2.545 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.171 8.187 4.496 1.00 0.00 C ATOM 0 HA ILE A 7 10.936 10.226 0.905 1.00 0.00 H new ATOM 0 HB ILE A 7 10.347 10.854 3.835 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.028 8.186 2.511 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.005 9.016 3.707 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.326 9.501 3.370 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.432 10.888 2.260 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.871 9.258 1.694 1.00 0.00 H new ATOM 0 HD11 ILE A 7 10.637 7.241 4.772 1.00 0.00 H new ATOM 0 HD12 ILE A 7 10.146 8.846 5.364 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.154 8.003 4.150 1.00 0.00 H new ATOM 119 N PRO A 8 10.273 12.661 0.439 1.00 0.00 N ATOM 120 CA PRO A 8 9.816 14.061 0.204 1.00 0.00 C ATOM 121 C PRO A 8 8.870 14.551 1.307 1.00 0.00 C ATOM 122 O PRO A 8 7.811 13.996 1.520 1.00 0.00 O ATOM 123 CB PRO A 8 9.092 13.980 -1.144 1.00 0.00 C ATOM 124 CG PRO A 8 9.775 12.869 -1.874 1.00 0.00 C ATOM 125 CD PRO A 8 10.218 11.862 -0.803 1.00 0.00 C ATOM 0 HA PRO A 8 10.643 14.771 0.207 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.030 13.773 -1.012 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.168 14.919 -1.692 1.00 0.00 H new ATOM 0 HG2 PRO A 8 9.101 12.402 -2.592 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.631 13.241 -2.436 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.512 11.036 -0.715 1.00 0.00 H new ATOM 0 HD3 PRO A 8 11.189 11.427 -1.041 1.00 0.00 H new ATOM 133 N LYS A 9 9.244 15.585 2.009 1.00 0.00 N ATOM 134 CA LYS A 9 8.364 16.104 3.095 1.00 0.00 C ATOM 135 C LYS A 9 7.170 16.832 2.476 1.00 0.00 C ATOM 136 O LYS A 9 6.159 17.044 3.116 1.00 0.00 O ATOM 137 CB LYS A 9 9.154 17.077 3.977 1.00 0.00 C ATOM 138 CG LYS A 9 10.393 16.376 4.558 1.00 0.00 C ATOM 139 CD LYS A 9 10.003 15.528 5.775 1.00 0.00 C ATOM 140 CE LYS A 9 11.269 14.998 6.451 1.00 0.00 C ATOM 141 NZ LYS A 9 11.961 14.048 5.536 1.00 0.00 N ATOM 0 H LYS A 9 10.119 16.092 1.878 1.00 0.00 H new ATOM 0 HA LYS A 9 8.010 15.272 3.703 1.00 0.00 H new ATOM 0 HB2 LYS A 9 9.458 17.945 3.392 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.521 17.443 4.785 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.852 15.744 3.798 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.137 17.118 4.847 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.425 16.126 6.479 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.368 14.698 5.465 1.00 0.00 H new ATOM 0 HE2 LYS A 9 11.933 15.825 6.703 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.013 14.498 7.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 12.688 13.524 6.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.269 13.379 5.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.410 14.577 4.761 1.00 0.00 H new ATOM 155 N ASP A 10 7.276 17.214 1.232 1.00 0.00 N ATOM 156 CA ASP A 10 6.146 17.924 0.572 1.00 0.00 C ATOM 157 C ASP A 10 5.072 16.910 0.177 1.00 0.00 C ATOM 158 O ASP A 10 5.234 16.153 -0.760 1.00 0.00 O ATOM 159 CB ASP A 10 6.658 18.641 -0.679 1.00 0.00 C ATOM 160 CG ASP A 10 7.620 19.758 -0.269 1.00 0.00 C ATOM 161 OD1 ASP A 10 7.538 20.197 0.867 1.00 0.00 O ATOM 162 OD2 ASP A 10 8.423 20.154 -1.097 1.00 0.00 O ATOM 0 H ASP A 10 8.097 17.065 0.645 1.00 0.00 H new ATOM 0 HA ASP A 10 5.721 18.654 1.260 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.164 17.933 -1.335 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.821 19.055 -1.242 1.00 0.00 H new ATOM 167 N LYS A 11 3.974 16.885 0.883 1.00 0.00 N ATOM 168 CA LYS A 11 2.893 15.920 0.547 1.00 0.00 C ATOM 169 C LYS A 11 2.456 16.125 -0.905 1.00 0.00 C ATOM 170 O LYS A 11 1.720 15.332 -1.459 1.00 0.00 O ATOM 171 CB LYS A 11 1.701 16.152 1.476 1.00 0.00 C ATOM 172 CG LYS A 11 2.185 16.249 2.927 1.00 0.00 C ATOM 173 CD LYS A 11 3.018 15.012 3.283 1.00 0.00 C ATOM 174 CE LYS A 11 3.108 14.870 4.804 1.00 0.00 C ATOM 175 NZ LYS A 11 3.781 16.070 5.376 1.00 0.00 N ATOM 0 H LYS A 11 3.780 17.493 1.679 1.00 0.00 H new ATOM 0 HA LYS A 11 3.262 14.902 0.673 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.181 17.068 1.194 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.986 15.336 1.375 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.782 17.151 3.061 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.331 16.329 3.600 1.00 0.00 H new ATOM 0 HD2 LYS A 11 2.564 14.120 2.851 1.00 0.00 H new ATOM 0 HD3 LYS A 11 4.017 15.100 2.857 1.00 0.00 H new ATOM 0 HE2 LYS A 11 2.110 14.762 5.230 1.00 0.00 H new ATOM 0 HE3 LYS A 11 3.664 13.969 5.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 4.204 15.826 6.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 4.526 16.393 4.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 3.083 16.830 5.508 1.00 0.00 H new ATOM 189 N SER A 12 2.900 17.187 -1.528 1.00 0.00 N ATOM 190 CA SER A 12 2.508 17.448 -2.947 1.00 0.00 C ATOM 191 C SER A 12 3.573 16.885 -3.890 1.00 0.00 C ATOM 192 O SER A 12 3.747 17.361 -4.994 1.00 0.00 O ATOM 193 CB SER A 12 2.384 18.957 -3.167 1.00 0.00 C ATOM 194 OG SER A 12 3.683 19.519 -3.304 1.00 0.00 O ATOM 0 H SER A 12 3.518 17.886 -1.115 1.00 0.00 H new ATOM 0 HA SER A 12 1.553 16.965 -3.153 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.792 19.159 -4.060 1.00 0.00 H new ATOM 0 HB3 SER A 12 1.863 19.417 -2.328 1.00 0.00 H new ATOM 0 HG SER A 12 3.608 20.486 -3.447 1.00 0.00 H new ATOM 200 N LYS A 13 4.285 15.869 -3.466 1.00 0.00 N ATOM 201 CA LYS A 13 5.344 15.266 -4.338 1.00 0.00 C ATOM 202 C LYS A 13 5.341 13.745 -4.167 1.00 0.00 C ATOM 203 O LYS A 13 5.331 13.229 -3.067 1.00 0.00 O ATOM 204 CB LYS A 13 6.722 15.820 -3.937 1.00 0.00 C ATOM 205 CG LYS A 13 6.912 17.236 -4.514 1.00 0.00 C ATOM 206 CD LYS A 13 7.391 17.160 -5.986 1.00 0.00 C ATOM 207 CE LYS A 13 6.828 18.342 -6.786 1.00 0.00 C ATOM 208 NZ LYS A 13 7.388 19.615 -6.253 1.00 0.00 N ATOM 0 H LYS A 13 4.179 15.430 -2.552 1.00 0.00 H new ATOM 0 HA LYS A 13 5.140 15.518 -5.379 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.810 15.847 -2.851 1.00 0.00 H new ATOM 0 HB3 LYS A 13 7.509 15.161 -4.304 1.00 0.00 H new ATOM 0 HG2 LYS A 13 5.973 17.787 -4.458 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.640 17.785 -3.916 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.480 17.172 -6.023 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.067 16.221 -6.434 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.081 18.234 -7.841 1.00 0.00 H new ATOM 0 HE3 LYS A 13 5.740 18.355 -6.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.116 20.402 -6.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 7.015 19.785 -5.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.425 19.548 -6.213 1.00 0.00 H new ATOM 222 N VAL A 14 5.345 13.027 -5.256 1.00 0.00 N ATOM 223 CA VAL A 14 5.337 11.539 -5.182 1.00 0.00 C ATOM 224 C VAL A 14 6.591 11.026 -4.472 1.00 0.00 C ATOM 225 O VAL A 14 7.676 11.542 -4.652 1.00 0.00 O ATOM 226 CB VAL A 14 5.311 10.962 -6.596 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.207 9.439 -6.515 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.112 11.526 -7.363 1.00 0.00 C ATOM 0 H VAL A 14 5.354 13.411 -6.201 1.00 0.00 H new ATOM 0 HA VAL A 14 4.454 11.227 -4.624 1.00 0.00 H new ATOM 0 HB VAL A 14 6.226 11.236 -7.120 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.188 9.022 -7.522 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.067 9.044 -5.974 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.292 9.164 -5.991 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.097 11.112 -8.371 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.191 11.257 -6.847 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.193 12.612 -7.418 1.00 0.00 H new ATOM 238 N ALA A 15 6.451 9.988 -3.687 1.00 0.00 N ATOM 239 CA ALA A 15 7.630 9.401 -2.982 1.00 0.00 C ATOM 240 C ALA A 15 8.096 8.174 -3.768 1.00 0.00 C ATOM 241 O ALA A 15 9.238 7.764 -3.689 1.00 0.00 O ATOM 242 CB ALA A 15 7.225 8.975 -1.571 1.00 0.00 C ATOM 0 H ALA A 15 5.564 9.519 -3.503 1.00 0.00 H new ATOM 0 HA ALA A 15 8.432 10.137 -2.915 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.087 8.547 -1.059 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.868 9.843 -1.017 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.431 8.230 -1.630 1.00 0.00 H new ATOM 248 N GLY A 16 7.210 7.589 -4.527 1.00 0.00 N ATOM 249 CA GLY A 16 7.573 6.389 -5.331 1.00 0.00 C ATOM 250 C GLY A 16 6.389 6.009 -6.226 1.00 0.00 C ATOM 251 O GLY A 16 5.487 6.794 -6.442 1.00 0.00 O ATOM 0 H GLY A 16 6.242 7.894 -4.625 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.453 6.596 -5.940 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.829 5.559 -4.673 1.00 0.00 H new ATOM 255 N TYR A 17 6.381 4.813 -6.749 1.00 0.00 N ATOM 256 CA TYR A 17 5.251 4.384 -7.629 1.00 0.00 C ATOM 257 C TYR A 17 5.050 2.878 -7.503 1.00 0.00 C ATOM 258 O TYR A 17 5.981 2.106 -7.624 1.00 0.00 O ATOM 259 CB TYR A 17 5.562 4.707 -9.097 1.00 0.00 C ATOM 260 CG TYR A 17 5.900 6.171 -9.269 1.00 0.00 C ATOM 261 CD1 TYR A 17 7.163 6.648 -8.900 1.00 0.00 C ATOM 262 CD2 TYR A 17 4.953 7.048 -9.815 1.00 0.00 C ATOM 263 CE1 TYR A 17 7.481 8.000 -9.074 1.00 0.00 C ATOM 264 CE2 TYR A 17 5.270 8.401 -9.988 1.00 0.00 C ATOM 265 CZ TYR A 17 6.534 8.877 -9.617 1.00 0.00 C ATOM 266 OH TYR A 17 6.847 10.210 -9.788 1.00 0.00 O ATOM 0 H TYR A 17 7.108 4.112 -6.606 1.00 0.00 H new ATOM 0 HA TYR A 17 4.352 4.917 -7.319 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.396 4.095 -9.439 1.00 0.00 H new ATOM 0 HB3 TYR A 17 4.704 4.453 -9.719 1.00 0.00 H new ATOM 0 HD1 TYR A 17 7.893 5.972 -8.480 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.979 6.680 -10.102 1.00 0.00 H new ATOM 0 HE1 TYR A 17 8.456 8.367 -8.790 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.540 9.077 -10.407 1.00 0.00 H new ATOM 0 HH TYR A 17 6.079 10.679 -10.177 1.00 0.00 H new ATOM 276 N ILE A 18 3.833 2.448 -7.289 1.00 0.00 N ATOM 277 CA ILE A 18 3.565 0.984 -7.186 1.00 0.00 C ATOM 278 C ILE A 18 3.113 0.497 -8.560 1.00 0.00 C ATOM 279 O ILE A 18 2.443 1.209 -9.279 1.00 0.00 O ATOM 280 CB ILE A 18 2.457 0.731 -6.159 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.075 -0.752 -6.173 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.228 1.574 -6.508 1.00 0.00 C ATOM 283 CD1 ILE A 18 1.248 -1.079 -4.927 1.00 0.00 C ATOM 0 H ILE A 18 3.015 3.047 -7.181 1.00 0.00 H new ATOM 0 HA ILE A 18 4.462 0.453 -6.867 1.00 0.00 H new ATOM 0 HB ILE A 18 2.816 1.007 -5.168 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.504 -0.983 -7.072 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.973 -1.369 -6.199 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.442 1.392 -5.775 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.496 2.630 -6.497 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.870 1.301 -7.501 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.976 -2.135 -4.937 1.00 0.00 H new ATOM 0 HD12 ILE A 18 1.835 -0.864 -4.034 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.343 -0.471 -4.921 1.00 0.00 H new ATOM 295 N GLU A 19 3.481 -0.697 -8.947 1.00 0.00 N ATOM 296 CA GLU A 19 3.071 -1.194 -10.296 1.00 0.00 C ATOM 297 C GLU A 19 2.827 -2.703 -10.255 1.00 0.00 C ATOM 298 O GLU A 19 3.528 -3.445 -9.596 1.00 0.00 O ATOM 299 CB GLU A 19 4.183 -0.894 -11.306 1.00 0.00 C ATOM 300 CG GLU A 19 4.707 0.527 -11.095 1.00 0.00 C ATOM 301 CD GLU A 19 5.717 0.865 -12.193 1.00 0.00 C ATOM 302 OE1 GLU A 19 6.293 -0.058 -12.744 1.00 0.00 O ATOM 303 OE2 GLU A 19 5.897 2.040 -12.463 1.00 0.00 O ATOM 0 H GLU A 19 4.042 -1.345 -8.394 1.00 0.00 H new ATOM 0 HA GLU A 19 2.150 -0.692 -10.592 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.995 -1.612 -11.190 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.803 -1.004 -12.322 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.881 1.238 -11.115 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.177 0.611 -10.115 1.00 0.00 H new ATOM 310 N ILE A 20 1.831 -3.155 -10.968 1.00 0.00 N ATOM 311 CA ILE A 20 1.511 -4.610 -11.004 1.00 0.00 C ATOM 312 C ILE A 20 0.889 -4.918 -12.381 1.00 0.00 C ATOM 313 O ILE A 20 0.003 -4.213 -12.820 1.00 0.00 O ATOM 314 CB ILE A 20 0.508 -4.931 -9.877 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.221 -4.785 -8.519 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.034 -6.371 -10.024 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.353 -5.350 -7.384 1.00 0.00 C ATOM 0 H ILE A 20 1.218 -2.569 -11.535 1.00 0.00 H new ATOM 0 HA ILE A 20 2.405 -5.216 -10.857 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.332 -4.239 -9.938 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.177 -5.308 -8.547 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.438 -3.734 -8.328 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.740 -6.578 -9.220 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.538 -6.474 -10.985 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.794 -7.078 -9.971 1.00 0.00 H new ATOM 0 HD11 ILE A 20 0.876 -5.236 -6.435 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.592 -4.808 -7.345 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.158 -6.407 -7.567 1.00 0.00 H new ATOM 329 N PRO A 21 1.331 -5.953 -13.068 1.00 0.00 N ATOM 330 CA PRO A 21 0.771 -6.309 -14.406 1.00 0.00 C ATOM 331 C PRO A 21 -0.600 -6.986 -14.290 1.00 0.00 C ATOM 332 O PRO A 21 -1.546 -6.615 -14.957 1.00 0.00 O ATOM 333 CB PRO A 21 1.813 -7.276 -14.979 1.00 0.00 C ATOM 334 CG PRO A 21 2.400 -7.946 -13.780 1.00 0.00 C ATOM 335 CD PRO A 21 2.397 -6.895 -12.664 1.00 0.00 C ATOM 0 HA PRO A 21 0.602 -5.434 -15.033 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.355 -7.999 -15.653 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.575 -6.746 -15.550 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.813 -8.819 -13.495 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.412 -8.295 -13.985 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.187 -7.344 -11.693 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.362 -6.395 -12.583 1.00 0.00 H new ATOM 343 N ASP A 22 -0.710 -7.975 -13.447 1.00 0.00 N ATOM 344 CA ASP A 22 -2.014 -8.677 -13.286 1.00 0.00 C ATOM 345 C ASP A 22 -3.119 -7.653 -13.025 1.00 0.00 C ATOM 346 O ASP A 22 -4.263 -7.857 -13.382 1.00 0.00 O ATOM 347 CB ASP A 22 -1.928 -9.645 -12.103 1.00 0.00 C ATOM 348 CG ASP A 22 -0.636 -10.458 -12.201 1.00 0.00 C ATOM 349 OD1 ASP A 22 -0.422 -11.072 -13.233 1.00 0.00 O ATOM 350 OD2 ASP A 22 0.117 -10.451 -11.242 1.00 0.00 O ATOM 0 H ASP A 22 0.048 -8.328 -12.862 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.242 -9.231 -14.196 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.951 -9.092 -11.164 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.790 -10.312 -12.102 1.00 0.00 H new ATOM 355 N ALA A 23 -2.785 -6.549 -12.404 1.00 0.00 N ATOM 356 CA ALA A 23 -3.804 -5.494 -12.112 1.00 0.00 C ATOM 357 C ALA A 23 -3.575 -4.312 -13.051 1.00 0.00 C ATOM 358 O ALA A 23 -4.242 -3.301 -12.961 1.00 0.00 O ATOM 359 CB ALA A 23 -3.653 -5.029 -10.664 1.00 0.00 C ATOM 0 H ALA A 23 -1.841 -6.332 -12.084 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.806 -5.896 -12.260 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.395 -4.260 -10.450 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.803 -5.875 -9.993 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.654 -4.620 -10.515 1.00 0.00 H new ATOM 365 N ASP A 24 -2.629 -4.437 -13.948 1.00 0.00 N ATOM 366 CA ASP A 24 -2.336 -3.329 -14.904 1.00 0.00 C ATOM 367 C ASP A 24 -2.331 -1.990 -14.159 1.00 0.00 C ATOM 368 O ASP A 24 -2.661 -0.956 -14.706 1.00 0.00 O ATOM 369 CB ASP A 24 -3.398 -3.319 -16.009 1.00 0.00 C ATOM 370 CG ASP A 24 -4.732 -2.803 -15.461 1.00 0.00 C ATOM 371 OD1 ASP A 24 -4.864 -1.599 -15.318 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.598 -3.621 -15.195 1.00 0.00 O ATOM 0 H ASP A 24 -2.044 -5.265 -14.059 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.355 -3.482 -15.353 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.068 -2.688 -16.834 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.526 -4.325 -16.409 1.00 0.00 H new ATOM 377 N ILE A 25 -1.965 -2.011 -12.905 1.00 0.00 N ATOM 378 CA ILE A 25 -1.939 -0.758 -12.092 1.00 0.00 C ATOM 379 C ILE A 25 -0.536 -0.137 -12.139 1.00 0.00 C ATOM 380 O ILE A 25 0.465 -0.819 -12.223 1.00 0.00 O ATOM 381 CB ILE A 25 -2.370 -1.113 -10.646 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.896 -0.962 -10.526 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.673 -0.210 -9.612 1.00 0.00 C ATOM 384 CD1 ILE A 25 -4.373 -1.515 -9.186 1.00 0.00 C ATOM 0 H ILE A 25 -1.680 -2.852 -12.403 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.630 -0.017 -12.492 1.00 0.00 H new ATOM 0 HB ILE A 25 -2.076 -2.142 -10.440 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.174 0.088 -10.614 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.387 -1.491 -11.342 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.998 -0.487 -8.609 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.593 -0.334 -9.690 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.934 0.831 -9.804 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.455 -1.403 -9.111 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.111 -2.571 -9.114 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.894 -0.966 -8.375 1.00 0.00 H new ATOM 396 N LYS A 26 -0.485 1.166 -12.079 1.00 0.00 N ATOM 397 CA LYS A 26 0.808 1.898 -12.108 1.00 0.00 C ATOM 398 C LYS A 26 0.515 3.327 -11.654 1.00 0.00 C ATOM 399 O LYS A 26 0.256 4.201 -12.455 1.00 0.00 O ATOM 400 CB LYS A 26 1.397 1.892 -13.531 1.00 0.00 C ATOM 401 CG LYS A 26 0.351 2.364 -14.565 1.00 0.00 C ATOM 402 CD LYS A 26 0.676 1.776 -15.943 1.00 0.00 C ATOM 403 CE LYS A 26 -0.405 2.189 -16.943 1.00 0.00 C ATOM 404 NZ LYS A 26 -0.631 3.660 -16.853 1.00 0.00 N ATOM 0 H LYS A 26 -1.307 1.766 -12.009 1.00 0.00 H new ATOM 0 HA LYS A 26 1.540 1.425 -11.454 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.271 2.542 -13.569 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.736 0.887 -13.784 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.646 2.054 -14.254 1.00 0.00 H new ATOM 0 HG3 LYS A 26 0.344 3.453 -14.617 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.651 2.128 -16.279 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.733 0.689 -15.882 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.102 1.918 -17.954 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.332 1.655 -16.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.105 3.992 -17.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.229 3.870 -16.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.283 4.146 -16.751 1.00 0.00 H new ATOM 418 N GLU A 27 0.491 3.556 -10.365 1.00 0.00 N ATOM 419 CA GLU A 27 0.142 4.912 -9.838 1.00 0.00 C ATOM 420 C GLU A 27 1.147 5.362 -8.756 1.00 0.00 C ATOM 421 O GLU A 27 1.830 4.553 -8.159 1.00 0.00 O ATOM 422 CB GLU A 27 -1.267 4.805 -9.230 1.00 0.00 C ATOM 423 CG GLU A 27 -2.331 5.139 -10.284 1.00 0.00 C ATOM 424 CD GLU A 27 -3.721 5.073 -9.647 1.00 0.00 C ATOM 425 OE1 GLU A 27 -3.895 5.657 -8.590 1.00 0.00 O ATOM 426 OE2 GLU A 27 -4.587 4.441 -10.228 1.00 0.00 O ATOM 0 H GLU A 27 0.699 2.858 -9.651 1.00 0.00 H new ATOM 0 HA GLU A 27 0.176 5.650 -10.640 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.429 3.798 -8.847 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.358 5.486 -8.384 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.154 6.134 -10.692 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.267 4.437 -11.116 1.00 0.00 H new ATOM 433 N PRO A 28 1.226 6.660 -8.506 1.00 0.00 N ATOM 434 CA PRO A 28 2.149 7.245 -7.481 1.00 0.00 C ATOM 435 C PRO A 28 1.599 7.159 -6.046 1.00 0.00 C ATOM 436 O PRO A 28 0.420 6.953 -5.833 1.00 0.00 O ATOM 437 CB PRO A 28 2.239 8.709 -7.917 1.00 0.00 C ATOM 438 CG PRO A 28 0.884 9.004 -8.459 1.00 0.00 C ATOM 439 CD PRO A 28 0.446 7.726 -9.180 1.00 0.00 C ATOM 0 HA PRO A 28 3.100 6.714 -7.443 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.485 9.361 -7.079 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.012 8.855 -8.672 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.189 9.262 -7.660 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.911 9.852 -9.144 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.627 7.559 -9.084 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.667 7.771 -10.246 1.00 0.00 H new ATOM 447 N VAL A 29 2.455 7.335 -5.064 1.00 0.00 N ATOM 448 CA VAL A 29 2.013 7.291 -3.630 1.00 0.00 C ATOM 449 C VAL A 29 2.567 8.527 -2.900 1.00 0.00 C ATOM 450 O VAL A 29 3.729 8.854 -3.022 1.00 0.00 O ATOM 451 CB VAL A 29 2.558 6.020 -2.967 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.713 4.815 -3.389 1.00 0.00 C ATOM 453 CG2 VAL A 29 4.010 5.801 -3.403 1.00 0.00 C ATOM 0 H VAL A 29 3.451 7.509 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 29 0.924 7.287 -3.578 1.00 0.00 H new ATOM 0 HB VAL A 29 2.514 6.131 -1.884 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.103 3.914 -2.916 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.679 4.969 -3.079 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.754 4.703 -4.472 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.399 4.898 -2.933 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.052 5.693 -4.487 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.614 6.657 -3.100 1.00 0.00 H new ATOM 463 N TYR A 30 1.748 9.223 -2.146 1.00 0.00 N ATOM 464 CA TYR A 30 2.253 10.436 -1.422 1.00 0.00 C ATOM 465 C TYR A 30 2.834 10.027 -0.060 1.00 0.00 C ATOM 466 O TYR A 30 2.323 9.129 0.579 1.00 0.00 O ATOM 467 CB TYR A 30 1.102 11.412 -1.145 1.00 0.00 C ATOM 468 CG TYR A 30 0.305 11.684 -2.398 1.00 0.00 C ATOM 469 CD1 TYR A 30 0.876 12.410 -3.448 1.00 0.00 C ATOM 470 CD2 TYR A 30 -1.018 11.235 -2.495 1.00 0.00 C ATOM 471 CE1 TYR A 30 0.125 12.686 -4.596 1.00 0.00 C ATOM 472 CE2 TYR A 30 -1.769 11.506 -3.639 1.00 0.00 C ATOM 473 CZ TYR A 30 -1.199 12.234 -4.692 1.00 0.00 C ATOM 474 OH TYR A 30 -1.940 12.508 -5.824 1.00 0.00 O ATOM 0 H TYR A 30 0.762 9.007 -2.001 1.00 0.00 H new ATOM 0 HA TYR A 30 3.012 10.906 -2.048 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.448 10.999 -0.377 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.501 12.348 -0.754 1.00 0.00 H new ATOM 0 HD1 TYR A 30 1.896 12.757 -3.373 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -1.458 10.677 -1.682 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.565 13.247 -5.408 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.788 11.155 -3.713 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.698 11.877 -6.534 1.00 0.00 H new ATOM 484 N PRO A 31 3.863 10.696 0.416 1.00 0.00 N ATOM 485 CA PRO A 31 4.447 10.395 1.749 1.00 0.00 C ATOM 486 C PRO A 31 3.659 11.079 2.871 1.00 0.00 C ATOM 487 O PRO A 31 3.955 12.193 3.255 1.00 0.00 O ATOM 488 CB PRO A 31 5.851 10.975 1.645 1.00 0.00 C ATOM 489 CG PRO A 31 5.680 12.176 0.779 1.00 0.00 C ATOM 490 CD PRO A 31 4.599 11.799 -0.243 1.00 0.00 C ATOM 0 HA PRO A 31 4.432 9.332 1.989 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.246 11.242 2.625 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.547 10.261 1.205 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.378 13.043 1.367 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.615 12.437 0.282 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.944 12.642 -0.463 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.036 11.480 -1.189 1.00 0.00 H new ATOM 498 N GLY A 32 2.651 10.433 3.390 1.00 0.00 N ATOM 499 CA GLY A 32 1.853 11.076 4.472 1.00 0.00 C ATOM 500 C GLY A 32 0.905 10.061 5.115 1.00 0.00 C ATOM 501 O GLY A 32 0.978 8.877 4.855 1.00 0.00 O ATOM 0 H GLY A 32 2.348 9.499 3.116 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.521 11.488 5.228 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.281 11.909 4.064 1.00 0.00 H new ATOM 505 N PRO A 33 0.018 10.534 5.954 1.00 0.00 N ATOM 506 CA PRO A 33 -0.968 9.672 6.657 1.00 0.00 C ATOM 507 C PRO A 33 -2.165 9.345 5.763 1.00 0.00 C ATOM 508 O PRO A 33 -2.881 10.222 5.328 1.00 0.00 O ATOM 509 CB PRO A 33 -1.385 10.525 7.860 1.00 0.00 C ATOM 510 CG PRO A 33 -1.258 11.942 7.387 1.00 0.00 C ATOM 511 CD PRO A 33 -0.144 11.954 6.325 1.00 0.00 C ATOM 0 HA PRO A 33 -0.557 8.704 6.943 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.406 10.301 8.169 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.743 10.336 8.720 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.199 12.295 6.965 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.011 12.606 8.215 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.421 12.562 5.464 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.782 12.370 6.723 1.00 0.00 H new ATOM 519 N ALA A 34 -2.364 8.090 5.475 1.00 0.00 N ATOM 520 CA ALA A 34 -3.501 7.690 4.589 1.00 0.00 C ATOM 521 C ALA A 34 -4.790 8.407 5.004 1.00 0.00 C ATOM 522 O ALA A 34 -5.585 7.888 5.763 1.00 0.00 O ATOM 523 CB ALA A 34 -3.706 6.170 4.662 1.00 0.00 C ATOM 0 H ALA A 34 -1.789 7.319 5.814 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.260 7.976 3.565 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.535 5.883 4.015 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.798 5.664 4.334 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.931 5.882 5.689 1.00 0.00 H new ATOM 529 N THR A 35 -5.008 9.584 4.479 1.00 0.00 N ATOM 530 CA THR A 35 -6.252 10.352 4.791 1.00 0.00 C ATOM 531 C THR A 35 -7.109 10.380 3.517 1.00 0.00 C ATOM 532 O THR A 35 -6.596 10.239 2.424 1.00 0.00 O ATOM 533 CB THR A 35 -5.873 11.788 5.208 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.650 12.146 4.581 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.700 11.867 6.728 1.00 0.00 C ATOM 0 H THR A 35 -4.368 10.053 3.838 1.00 0.00 H new ATOM 0 HA THR A 35 -6.805 9.889 5.608 1.00 0.00 H new ATOM 0 HB THR A 35 -6.666 12.471 4.903 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.929 11.577 4.922 1.00 0.00 H new ATOM 0 HG21 THR A 35 -5.433 12.885 7.011 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.634 11.588 7.215 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.910 11.184 7.040 1.00 0.00 H new ATOM 543 N PRO A 36 -8.398 10.551 3.645 1.00 0.00 N ATOM 544 CA PRO A 36 -9.317 10.582 2.470 1.00 0.00 C ATOM 545 C PRO A 36 -9.126 11.847 1.623 1.00 0.00 C ATOM 546 O PRO A 36 -9.085 11.793 0.410 1.00 0.00 O ATOM 547 CB PRO A 36 -10.717 10.545 3.105 1.00 0.00 C ATOM 548 CG PRO A 36 -10.534 11.135 4.466 1.00 0.00 C ATOM 549 CD PRO A 36 -9.126 10.737 4.914 1.00 0.00 C ATOM 0 HA PRO A 36 -9.137 9.756 1.783 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.433 11.120 2.518 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.098 9.525 3.164 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.643 12.219 4.439 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.285 10.757 5.159 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.667 11.511 5.530 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -9.137 9.823 5.507 1.00 0.00 H new ATOM 557 N GLU A 37 -9.012 12.983 2.253 1.00 0.00 N ATOM 558 CA GLU A 37 -8.828 14.244 1.482 1.00 0.00 C ATOM 559 C GLU A 37 -7.513 14.188 0.704 1.00 0.00 C ATOM 560 O GLU A 37 -7.356 14.832 -0.314 1.00 0.00 O ATOM 561 CB GLU A 37 -8.802 15.436 2.442 1.00 0.00 C ATOM 562 CG GLU A 37 -7.586 15.324 3.363 1.00 0.00 C ATOM 563 CD GLU A 37 -7.698 16.355 4.486 1.00 0.00 C ATOM 564 OE1 GLU A 37 -8.732 16.997 4.576 1.00 0.00 O ATOM 565 OE2 GLU A 37 -6.747 16.486 5.239 1.00 0.00 O ATOM 0 H GLU A 37 -9.038 13.093 3.267 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.656 14.359 0.783 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.760 16.369 1.879 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.718 15.461 3.033 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.526 14.320 3.782 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.670 15.488 2.795 1.00 0.00 H new ATOM 572 N GLN A 38 -6.562 13.425 1.175 1.00 0.00 N ATOM 573 CA GLN A 38 -5.254 13.334 0.461 1.00 0.00 C ATOM 574 C GLN A 38 -5.367 12.292 -0.660 1.00 0.00 C ATOM 575 O GLN A 38 -5.228 12.604 -1.826 1.00 0.00 O ATOM 576 CB GLN A 38 -4.155 12.925 1.473 1.00 0.00 C ATOM 577 CG GLN A 38 -2.857 13.709 1.221 1.00 0.00 C ATOM 578 CD GLN A 38 -2.499 13.669 -0.266 1.00 0.00 C ATOM 579 OE1 GLN A 38 -2.001 14.637 -0.809 1.00 0.00 O ATOM 580 NE2 GLN A 38 -2.732 12.587 -0.952 1.00 0.00 N ATOM 0 H GLN A 38 -6.634 12.861 2.022 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.992 14.297 0.023 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.504 13.109 2.489 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -3.960 11.856 1.392 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.978 14.742 1.546 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.045 13.282 1.810 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.150 11.775 -0.497 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.497 12.552 -1.944 1.00 0.00 H new ATOM 589 N LEU A 39 -5.614 11.055 -0.316 1.00 0.00 N ATOM 590 CA LEU A 39 -5.731 9.999 -1.358 1.00 0.00 C ATOM 591 C LEU A 39 -6.679 10.467 -2.459 1.00 0.00 C ATOM 592 O LEU A 39 -6.756 9.875 -3.516 1.00 0.00 O ATOM 593 CB LEU A 39 -6.284 8.714 -0.742 1.00 0.00 C ATOM 594 CG LEU A 39 -5.407 8.263 0.438 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.214 7.349 1.366 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.184 7.499 -0.083 1.00 0.00 C ATOM 0 H LEU A 39 -5.739 10.733 0.644 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.743 9.807 -1.775 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.306 8.877 -0.401 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.321 7.928 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.078 9.144 0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.588 7.033 2.200 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.080 7.891 1.747 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.550 6.473 0.812 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.567 7.183 0.758 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.513 6.623 -0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.601 8.148 -0.737 1.00 0.00 H new ATOM 608 N ASN A 40 -7.393 11.528 -2.227 1.00 0.00 N ATOM 609 CA ASN A 40 -8.321 12.028 -3.272 1.00 0.00 C ATOM 610 C ASN A 40 -7.495 12.409 -4.492 1.00 0.00 C ATOM 611 O ASN A 40 -7.956 12.375 -5.615 1.00 0.00 O ATOM 612 CB ASN A 40 -9.038 13.275 -2.758 1.00 0.00 C ATOM 613 CG ASN A 40 -10.151 12.894 -1.783 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.773 13.752 -1.190 1.00 0.00 O ATOM 615 ND2 ASN A 40 -10.433 11.640 -1.591 1.00 0.00 N ATOM 0 H ASN A 40 -7.375 12.069 -1.362 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.054 11.262 -3.523 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.324 13.933 -2.263 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.457 13.831 -3.596 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.176 11.378 -0.943 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -9.912 10.918 -2.088 1.00 0.00 H new ATOM 622 N ARG A 41 -6.271 12.775 -4.264 1.00 0.00 N ATOM 623 CA ARG A 41 -5.375 13.170 -5.385 1.00 0.00 C ATOM 624 C ARG A 41 -4.616 11.940 -5.871 1.00 0.00 C ATOM 625 O ARG A 41 -3.974 11.961 -6.902 1.00 0.00 O ATOM 626 CB ARG A 41 -4.375 14.218 -4.891 1.00 0.00 C ATOM 627 CG ARG A 41 -5.128 15.396 -4.265 1.00 0.00 C ATOM 628 CD ARG A 41 -4.141 16.288 -3.510 1.00 0.00 C ATOM 629 NE ARG A 41 -3.231 16.955 -4.482 1.00 0.00 N ATOM 630 CZ ARG A 41 -2.518 17.982 -4.110 1.00 0.00 C ATOM 631 NH1 ARG A 41 -2.604 18.429 -2.888 1.00 0.00 N ATOM 632 NH2 ARG A 41 -1.721 18.564 -4.963 1.00 0.00 N ATOM 0 H ARG A 41 -5.845 12.819 -3.338 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.966 13.587 -6.200 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.701 13.774 -4.158 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.760 14.567 -5.720 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.635 15.971 -5.040 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.897 15.030 -3.585 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.681 17.036 -2.929 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.563 15.692 -2.804 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.165 16.609 -5.439 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.229 17.975 -2.222 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.046 19.232 -2.598 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -1.656 18.216 -5.920 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.163 19.367 -4.673 1.00 0.00 H new ATOM 646 N GLY A 42 -4.687 10.862 -5.137 1.00 0.00 N ATOM 647 CA GLY A 42 -3.963 9.632 -5.575 1.00 0.00 C ATOM 648 C GLY A 42 -3.838 8.623 -4.422 1.00 0.00 C ATOM 649 O GLY A 42 -4.760 8.409 -3.660 1.00 0.00 O ATOM 0 H GLY A 42 -5.208 10.779 -4.264 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.493 9.172 -6.409 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.970 9.900 -5.937 1.00 0.00 H new ATOM 653 N VAL A 43 -2.693 7.988 -4.308 1.00 0.00 N ATOM 654 CA VAL A 43 -2.462 6.967 -3.230 1.00 0.00 C ATOM 655 C VAL A 43 -1.450 7.520 -2.214 1.00 0.00 C ATOM 656 O VAL A 43 -0.755 8.480 -2.477 1.00 0.00 O ATOM 657 CB VAL A 43 -1.893 5.697 -3.884 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.960 4.506 -2.927 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.698 5.366 -5.138 1.00 0.00 C ATOM 0 H VAL A 43 -1.895 8.136 -4.926 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.396 6.739 -2.716 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.850 5.885 -4.138 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.551 3.622 -3.417 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.379 4.726 -2.031 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.998 4.320 -2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.295 4.466 -5.602 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.741 5.199 -4.868 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.634 6.196 -5.841 1.00 0.00 H new ATOM 669 N SER A 44 -1.358 6.914 -1.060 1.00 0.00 N ATOM 670 CA SER A 44 -0.386 7.386 -0.028 1.00 0.00 C ATOM 671 C SER A 44 -0.114 6.239 0.948 1.00 0.00 C ATOM 672 O SER A 44 -0.912 5.331 1.079 1.00 0.00 O ATOM 673 CB SER A 44 -0.971 8.577 0.733 1.00 0.00 C ATOM 674 OG SER A 44 -1.730 8.100 1.833 1.00 0.00 O ATOM 0 H SER A 44 -1.918 6.107 -0.785 1.00 0.00 H new ATOM 0 HA SER A 44 0.541 7.697 -0.510 1.00 0.00 H new ATOM 0 HB2 SER A 44 -0.171 9.229 1.083 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.601 9.172 0.072 1.00 0.00 H new ATOM 0 HG SER A 44 -1.352 8.449 2.667 1.00 0.00 H new ATOM 680 N PHE A 45 0.999 6.257 1.632 1.00 0.00 N ATOM 681 CA PHE A 45 1.286 5.146 2.584 1.00 0.00 C ATOM 682 C PHE A 45 0.166 5.053 3.619 1.00 0.00 C ATOM 683 O PHE A 45 -0.738 5.864 3.646 1.00 0.00 O ATOM 684 CB PHE A 45 2.613 5.383 3.311 1.00 0.00 C ATOM 685 CG PHE A 45 3.774 5.203 2.353 1.00 0.00 C ATOM 686 CD1 PHE A 45 3.990 3.972 1.714 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.635 6.274 2.101 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.066 3.823 0.827 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.706 6.127 1.215 1.00 0.00 C ATOM 690 CZ PHE A 45 5.921 4.902 0.576 1.00 0.00 C ATOM 0 H PHE A 45 1.713 6.983 1.574 1.00 0.00 H new ATOM 0 HA PHE A 45 1.351 4.218 2.016 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.631 6.389 3.731 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.709 4.687 4.145 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.328 3.140 1.905 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.472 7.221 2.594 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.235 2.875 0.337 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.367 6.959 1.024 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.747 4.789 -0.111 1.00 0.00 H new ATOM 700 N ALA A 46 0.228 4.072 4.480 1.00 0.00 N ATOM 701 CA ALA A 46 -0.822 3.922 5.528 1.00 0.00 C ATOM 702 C ALA A 46 -0.415 4.723 6.762 1.00 0.00 C ATOM 703 O ALA A 46 -1.143 4.801 7.731 1.00 0.00 O ATOM 704 CB ALA A 46 -0.963 2.448 5.903 1.00 0.00 C ATOM 0 H ALA A 46 0.964 3.366 4.502 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.775 4.290 5.147 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.731 2.339 6.669 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.247 1.874 5.021 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.012 2.078 6.287 1.00 0.00 H new ATOM 710 N GLU A 47 0.748 5.319 6.737 1.00 0.00 N ATOM 711 CA GLU A 47 1.206 6.116 7.913 1.00 0.00 C ATOM 712 C GLU A 47 2.197 7.193 7.461 1.00 0.00 C ATOM 713 O GLU A 47 2.968 7.003 6.543 1.00 0.00 O ATOM 714 CB GLU A 47 1.891 5.194 8.919 1.00 0.00 C ATOM 715 CG GLU A 47 0.866 4.232 9.528 1.00 0.00 C ATOM 716 CD GLU A 47 1.461 3.574 10.776 1.00 0.00 C ATOM 717 OE1 GLU A 47 1.720 4.287 11.730 1.00 0.00 O ATOM 718 OE2 GLU A 47 1.648 2.369 10.753 1.00 0.00 O ATOM 0 H GLU A 47 1.400 5.288 5.953 1.00 0.00 H new ATOM 0 HA GLU A 47 0.342 6.592 8.377 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.684 4.630 8.427 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.360 5.785 9.706 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -0.045 4.771 9.788 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.589 3.470 8.799 1.00 0.00 H new ATOM 725 N GLU A 48 2.171 8.327 8.108 1.00 0.00 N ATOM 726 CA GLU A 48 3.095 9.441 7.738 1.00 0.00 C ATOM 727 C GLU A 48 4.559 9.027 7.940 1.00 0.00 C ATOM 728 O GLU A 48 5.443 9.501 7.254 1.00 0.00 O ATOM 729 CB GLU A 48 2.783 10.652 8.623 1.00 0.00 C ATOM 730 CG GLU A 48 3.825 11.749 8.386 1.00 0.00 C ATOM 731 CD GLU A 48 3.334 13.063 8.996 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.273 13.517 8.600 1.00 0.00 O ATOM 733 OE2 GLU A 48 4.027 13.592 9.849 1.00 0.00 O ATOM 0 H GLU A 48 1.543 8.532 8.885 1.00 0.00 H new ATOM 0 HA GLU A 48 2.950 9.688 6.686 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.786 11.030 8.399 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.784 10.357 9.672 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.777 11.463 8.832 1.00 0.00 H new ATOM 0 HG3 GLU A 48 3.999 11.875 7.317 1.00 0.00 H new ATOM 740 N ASN A 49 4.831 8.176 8.892 1.00 0.00 N ATOM 741 CA ASN A 49 6.247 7.770 9.153 1.00 0.00 C ATOM 742 C ASN A 49 6.649 6.589 8.265 1.00 0.00 C ATOM 743 O ASN A 49 7.720 6.036 8.409 1.00 0.00 O ATOM 744 CB ASN A 49 6.390 7.364 10.621 1.00 0.00 C ATOM 745 CG ASN A 49 5.542 6.122 10.893 1.00 0.00 C ATOM 746 OD1 ASN A 49 5.792 5.067 10.344 1.00 0.00 O ATOM 747 ND2 ASN A 49 4.538 6.202 11.723 1.00 0.00 N ATOM 0 H ASN A 49 4.137 7.743 9.501 1.00 0.00 H new ATOM 0 HA ASN A 49 6.898 8.614 8.927 1.00 0.00 H new ATOM 0 HB2 ASN A 49 7.436 7.161 10.853 1.00 0.00 H new ATOM 0 HB3 ASN A 49 6.073 8.182 11.268 1.00 0.00 H new ATOM 0 HD21 ASN A 49 3.964 5.380 11.910 1.00 0.00 H new ATOM 0 HD22 ASN A 49 4.327 7.087 12.184 1.00 0.00 H new ATOM 754 N GLU A 50 5.815 6.197 7.345 1.00 0.00 N ATOM 755 CA GLU A 50 6.182 5.054 6.460 1.00 0.00 C ATOM 756 C GLU A 50 7.435 5.416 5.658 1.00 0.00 C ATOM 757 O GLU A 50 7.702 6.569 5.383 1.00 0.00 O ATOM 758 CB GLU A 50 5.021 4.743 5.506 1.00 0.00 C ATOM 759 CG GLU A 50 5.281 3.420 4.767 1.00 0.00 C ATOM 760 CD GLU A 50 6.270 3.640 3.616 1.00 0.00 C ATOM 761 OE1 GLU A 50 6.537 4.785 3.295 1.00 0.00 O ATOM 762 OE2 GLU A 50 6.741 2.653 3.075 1.00 0.00 O ATOM 0 H GLU A 50 4.901 6.614 7.167 1.00 0.00 H new ATOM 0 HA GLU A 50 6.385 4.173 7.068 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.088 4.678 6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 50 4.905 5.553 4.786 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.679 2.680 5.461 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.343 3.022 4.379 1.00 0.00 H new ATOM 769 N SER A 51 8.201 4.430 5.286 1.00 0.00 N ATOM 770 CA SER A 51 9.443 4.673 4.500 1.00 0.00 C ATOM 771 C SER A 51 9.650 3.500 3.544 1.00 0.00 C ATOM 772 O SER A 51 9.068 2.446 3.707 1.00 0.00 O ATOM 773 CB SER A 51 10.638 4.765 5.452 1.00 0.00 C ATOM 774 OG SER A 51 10.910 3.477 5.989 1.00 0.00 O ATOM 0 H SER A 51 8.016 3.449 5.497 1.00 0.00 H new ATOM 0 HA SER A 51 9.355 5.604 3.940 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.512 5.143 4.922 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.424 5.469 6.256 1.00 0.00 H new ATOM 0 HG SER A 51 11.676 3.532 6.598 1.00 0.00 H new ATOM 780 N LEU A 52 10.476 3.665 2.552 1.00 0.00 N ATOM 781 CA LEU A 52 10.716 2.555 1.603 1.00 0.00 C ATOM 782 C LEU A 52 11.599 1.523 2.303 1.00 0.00 C ATOM 783 O LEU A 52 12.110 0.607 1.690 1.00 0.00 O ATOM 784 CB LEU A 52 11.419 3.081 0.331 1.00 0.00 C ATOM 785 CG LEU A 52 11.022 4.549 0.030 1.00 0.00 C ATOM 786 CD1 LEU A 52 9.497 4.756 0.185 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.810 5.541 0.933 1.00 0.00 C ATOM 0 H LEU A 52 10.994 4.522 2.360 1.00 0.00 H new ATOM 0 HA LEU A 52 9.770 2.104 1.303 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.500 3.013 0.457 1.00 0.00 H new ATOM 0 HB3 LEU A 52 11.157 2.450 -0.518 1.00 0.00 H new ATOM 0 HG LEU A 52 11.287 4.757 -1.007 1.00 0.00 H new ATOM 0 HD11 LEU A 52 9.247 5.794 -0.032 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.969 4.103 -0.509 1.00 0.00 H new ATOM 0 HD13 LEU A 52 9.199 4.517 1.206 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.510 6.563 0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.594 5.330 1.980 1.00 0.00 H new ATOM 0 HD23 LEU A 52 12.879 5.426 0.753 1.00 0.00 H new ATOM 799 N ASP A 53 11.782 1.680 3.594 1.00 0.00 N ATOM 800 CA ASP A 53 12.635 0.730 4.371 1.00 0.00 C ATOM 801 C ASP A 53 11.828 0.140 5.531 1.00 0.00 C ATOM 802 O ASP A 53 12.291 -0.742 6.228 1.00 0.00 O ATOM 803 CB ASP A 53 13.848 1.482 4.928 1.00 0.00 C ATOM 804 CG ASP A 53 14.854 1.738 3.804 1.00 0.00 C ATOM 805 OD1 ASP A 53 14.442 2.234 2.768 1.00 0.00 O ATOM 806 OD2 ASP A 53 16.019 1.434 3.999 1.00 0.00 O ATOM 0 H ASP A 53 11.372 2.434 4.145 1.00 0.00 H new ATOM 0 HA ASP A 53 12.968 -0.076 3.717 1.00 0.00 H new ATOM 0 HB2 ASP A 53 13.531 2.427 5.369 1.00 0.00 H new ATOM 0 HB3 ASP A 53 14.316 0.901 5.723 1.00 0.00 H new ATOM 811 N ASP A 54 10.629 0.610 5.753 1.00 0.00 N ATOM 812 CA ASP A 54 9.820 0.057 6.875 1.00 0.00 C ATOM 813 C ASP A 54 9.610 -1.445 6.656 1.00 0.00 C ATOM 814 O ASP A 54 8.953 -1.860 5.723 1.00 0.00 O ATOM 815 CB ASP A 54 8.462 0.769 6.923 1.00 0.00 C ATOM 816 CG ASP A 54 7.809 0.539 8.287 1.00 0.00 C ATOM 817 OD1 ASP A 54 8.120 1.283 9.203 1.00 0.00 O ATOM 818 OD2 ASP A 54 7.009 -0.376 8.395 1.00 0.00 O ATOM 0 H ASP A 54 10.179 1.347 5.210 1.00 0.00 H new ATOM 0 HA ASP A 54 10.343 0.215 7.818 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.594 1.837 6.747 1.00 0.00 H new ATOM 0 HB3 ASP A 54 7.815 0.393 6.131 1.00 0.00 H new ATOM 823 N GLN A 55 10.169 -2.263 7.510 1.00 0.00 N ATOM 824 CA GLN A 55 10.009 -3.741 7.355 1.00 0.00 C ATOM 825 C GLN A 55 8.541 -4.072 7.056 1.00 0.00 C ATOM 826 O GLN A 55 8.227 -5.136 6.562 1.00 0.00 O ATOM 827 CB GLN A 55 10.466 -4.449 8.646 1.00 0.00 C ATOM 828 CG GLN A 55 10.228 -3.540 9.858 1.00 0.00 C ATOM 829 CD GLN A 55 8.788 -3.021 9.847 1.00 0.00 C ATOM 830 OE1 GLN A 55 8.507 -1.987 9.273 1.00 0.00 O ATOM 831 NE2 GLN A 55 7.859 -3.697 10.466 1.00 0.00 N ATOM 0 H GLN A 55 10.731 -1.971 8.310 1.00 0.00 H new ATOM 0 HA GLN A 55 10.624 -4.090 6.526 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.920 -5.384 8.770 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.523 -4.704 8.575 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.418 -4.091 10.779 1.00 0.00 H new ATOM 0 HG3 GLN A 55 10.925 -2.703 9.838 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.095 -4.565 10.948 1.00 0.00 H new ATOM 0 HE22 GLN A 55 6.897 -3.358 10.468 1.00 0.00 H new ATOM 840 N ASN A 56 7.646 -3.162 7.346 1.00 0.00 N ATOM 841 CA ASN A 56 6.192 -3.405 7.077 1.00 0.00 C ATOM 842 C ASN A 56 5.600 -2.176 6.387 1.00 0.00 C ATOM 843 O ASN A 56 5.265 -1.195 7.022 1.00 0.00 O ATOM 844 CB ASN A 56 5.461 -3.658 8.400 1.00 0.00 C ATOM 845 CG ASN A 56 5.790 -5.065 8.903 1.00 0.00 C ATOM 846 OD1 ASN A 56 6.944 -5.423 9.031 1.00 0.00 O ATOM 847 ND2 ASN A 56 4.818 -5.885 9.196 1.00 0.00 N ATOM 0 H ASN A 56 7.859 -2.255 7.760 1.00 0.00 H new ATOM 0 HA ASN A 56 6.077 -4.277 6.433 1.00 0.00 H new ATOM 0 HB2 ASN A 56 5.760 -2.916 9.141 1.00 0.00 H new ATOM 0 HB3 ASN A 56 4.385 -3.553 8.259 1.00 0.00 H new ATOM 0 HD21 ASN A 56 5.028 -6.825 9.532 1.00 0.00 H new ATOM 0 HD22 ASN A 56 3.849 -5.586 9.089 1.00 0.00 H new ATOM 854 N ILE A 57 5.475 -2.218 5.086 1.00 0.00 N ATOM 855 CA ILE A 57 4.912 -1.053 4.341 1.00 0.00 C ATOM 856 C ILE A 57 3.424 -1.277 4.084 1.00 0.00 C ATOM 857 O ILE A 57 3.035 -2.151 3.335 1.00 0.00 O ATOM 858 CB ILE A 57 5.631 -0.904 2.999 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.110 -0.594 3.242 1.00 0.00 C ATOM 860 CG2 ILE A 57 4.993 0.237 2.204 1.00 0.00 C ATOM 861 CD1 ILE A 57 7.882 -0.713 1.925 1.00 0.00 C ATOM 0 H ILE A 57 5.740 -3.013 4.505 1.00 0.00 H new ATOM 0 HA ILE A 57 5.051 -0.150 4.936 1.00 0.00 H new ATOM 0 HB ILE A 57 5.544 -1.833 2.435 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.219 0.411 3.650 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.520 -1.284 3.980 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.504 0.344 1.247 1.00 0.00 H new ATOM 0 HG22 ILE A 57 3.940 0.015 2.030 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.079 1.166 2.768 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.935 -0.492 2.099 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.783 -1.726 1.536 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.478 -0.005 1.201 1.00 0.00 H new ATOM 873 N SER A 58 2.589 -0.477 4.695 1.00 0.00 N ATOM 874 CA SER A 58 1.113 -0.606 4.498 1.00 0.00 C ATOM 875 C SER A 58 0.638 0.585 3.665 1.00 0.00 C ATOM 876 O SER A 58 0.814 1.725 4.045 1.00 0.00 O ATOM 877 CB SER A 58 0.423 -0.610 5.868 1.00 0.00 C ATOM 878 OG SER A 58 0.367 -1.943 6.357 1.00 0.00 O ATOM 0 H SER A 58 2.870 0.270 5.330 1.00 0.00 H new ATOM 0 HA SER A 58 0.869 -1.534 3.981 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.970 0.024 6.566 1.00 0.00 H new ATOM 0 HB3 SER A 58 -0.583 -0.198 5.784 1.00 0.00 H new ATOM 0 HG SER A 58 -0.072 -1.952 7.233 1.00 0.00 H new ATOM 884 N ILE A 59 0.060 0.328 2.518 1.00 0.00 N ATOM 885 CA ILE A 59 -0.411 1.440 1.633 1.00 0.00 C ATOM 886 C ILE A 59 -1.935 1.525 1.658 1.00 0.00 C ATOM 887 O ILE A 59 -2.616 0.611 2.078 1.00 0.00 O ATOM 888 CB ILE A 59 0.057 1.171 0.199 1.00 0.00 C ATOM 889 CG1 ILE A 59 1.587 1.191 0.155 1.00 0.00 C ATOM 890 CG2 ILE A 59 -0.494 2.249 -0.740 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.069 0.584 -1.164 1.00 0.00 C ATOM 0 H ILE A 59 -0.107 -0.610 2.154 1.00 0.00 H new ATOM 0 HA ILE A 59 0.002 2.383 1.992 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.309 0.196 -0.123 1.00 0.00 H new ATOM 0 HG12 ILE A 59 1.951 2.214 0.251 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.993 0.629 0.996 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.157 2.052 -1.758 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.583 2.236 -0.709 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.134 3.227 -0.422 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.158 0.599 -1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 59 1.718 -0.445 -1.241 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.675 1.165 -1.998 1.00 0.00 H new ATOM 903 N ALA A 60 -2.470 2.623 1.194 1.00 0.00 N ATOM 904 CA ALA A 60 -3.953 2.803 1.160 1.00 0.00 C ATOM 905 C ALA A 60 -4.319 3.404 -0.194 1.00 0.00 C ATOM 906 O ALA A 60 -3.788 4.426 -0.582 1.00 0.00 O ATOM 907 CB ALA A 60 -4.382 3.751 2.284 1.00 0.00 C ATOM 0 H ALA A 60 -1.936 3.413 0.832 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.459 1.848 1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.464 3.881 2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.091 3.330 3.246 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.897 4.718 2.149 1.00 0.00 H new ATOM 913 N GLY A 61 -5.200 2.770 -0.931 1.00 0.00 N ATOM 914 CA GLY A 61 -5.571 3.307 -2.283 1.00 0.00 C ATOM 915 C GLY A 61 -7.077 3.189 -2.518 1.00 0.00 C ATOM 916 O GLY A 61 -7.742 2.328 -1.976 1.00 0.00 O ATOM 0 H GLY A 61 -5.676 1.910 -0.659 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.267 4.351 -2.361 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.033 2.759 -3.057 1.00 0.00 H new ATOM 920 N HIS A 62 -7.612 4.062 -3.330 1.00 0.00 N ATOM 921 CA HIS A 62 -9.080 4.028 -3.622 1.00 0.00 C ATOM 922 C HIS A 62 -9.409 2.830 -4.528 1.00 0.00 C ATOM 923 O HIS A 62 -8.544 2.072 -4.914 1.00 0.00 O ATOM 924 CB HIS A 62 -9.489 5.339 -4.322 1.00 0.00 C ATOM 925 CG HIS A 62 -9.786 6.407 -3.300 1.00 0.00 C ATOM 926 ND1 HIS A 62 -11.030 6.528 -2.700 1.00 0.00 N ATOM 927 CD2 HIS A 62 -9.016 7.414 -2.770 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.974 7.572 -1.854 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.768 8.147 -1.857 1.00 0.00 N ATOM 0 H HIS A 62 -7.095 4.801 -3.807 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.632 3.924 -2.688 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.689 5.671 -4.983 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.367 5.168 -4.945 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.984 7.607 -3.023 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.803 7.905 -1.246 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.464 8.951 -1.308 1.00 0.00 H new ATOM 937 N THR A 63 -10.664 2.667 -4.874 1.00 0.00 N ATOM 938 CA THR A 63 -11.068 1.538 -5.758 1.00 0.00 C ATOM 939 C THR A 63 -12.472 1.812 -6.308 1.00 0.00 C ATOM 940 O THR A 63 -13.465 1.413 -5.733 1.00 0.00 O ATOM 941 CB THR A 63 -11.070 0.223 -4.969 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.886 -0.727 -5.639 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.618 0.450 -3.563 1.00 0.00 C ATOM 0 H THR A 63 -11.428 3.274 -4.577 1.00 0.00 H new ATOM 0 HA THR A 63 -10.358 1.451 -6.581 1.00 0.00 H new ATOM 0 HB THR A 63 -10.047 -0.147 -4.898 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.819 -0.427 -5.623 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.614 -0.492 -3.014 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.994 1.176 -3.042 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.638 0.828 -3.627 1.00 0.00 H new ATOM 951 N PHE A 64 -12.565 2.495 -7.421 1.00 0.00 N ATOM 952 CA PHE A 64 -13.906 2.801 -8.007 1.00 0.00 C ATOM 953 C PHE A 64 -14.332 1.641 -8.916 1.00 0.00 C ATOM 954 O PHE A 64 -13.634 1.267 -9.837 1.00 0.00 O ATOM 955 CB PHE A 64 -13.818 4.111 -8.817 1.00 0.00 C ATOM 956 CG PHE A 64 -14.124 5.301 -7.928 1.00 0.00 C ATOM 957 CD1 PHE A 64 -13.597 5.362 -6.632 1.00 0.00 C ATOM 958 CD2 PHE A 64 -14.935 6.341 -8.403 1.00 0.00 C ATOM 959 CE1 PHE A 64 -13.880 6.461 -5.812 1.00 0.00 C ATOM 960 CE2 PHE A 64 -15.216 7.440 -7.581 1.00 0.00 C ATOM 961 CZ PHE A 64 -14.689 7.499 -6.286 1.00 0.00 C ATOM 0 H PHE A 64 -11.770 2.854 -7.950 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.644 2.923 -7.215 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.821 4.215 -9.246 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.521 4.080 -9.649 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -12.972 4.561 -6.265 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -15.343 6.295 -9.402 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -13.473 6.507 -4.813 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -15.840 8.242 -7.947 1.00 0.00 H new ATOM 0 HZ PHE A 64 -14.907 8.346 -5.652 1.00 0.00 H new ATOM 971 N ILE A 65 -15.473 1.070 -8.649 1.00 0.00 N ATOM 972 CA ILE A 65 -15.963 -0.073 -9.475 1.00 0.00 C ATOM 973 C ILE A 65 -16.214 0.373 -10.914 1.00 0.00 C ATOM 974 O ILE A 65 -16.061 -0.390 -11.848 1.00 0.00 O ATOM 975 CB ILE A 65 -17.290 -0.593 -8.908 1.00 0.00 C ATOM 976 CG1 ILE A 65 -17.232 -0.637 -7.382 1.00 0.00 C ATOM 977 CG2 ILE A 65 -17.561 -1.999 -9.447 1.00 0.00 C ATOM 978 CD1 ILE A 65 -18.533 -1.238 -6.854 1.00 0.00 C ATOM 0 H ILE A 65 -16.093 1.347 -7.888 1.00 0.00 H new ATOM 0 HA ILE A 65 -15.202 -0.853 -9.454 1.00 0.00 H new ATOM 0 HB ILE A 65 -18.092 0.079 -9.214 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -16.381 -1.234 -7.054 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -17.091 0.367 -6.981 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -18.504 -2.368 -9.044 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.620 -1.967 -10.535 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -16.753 -2.666 -9.147 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -18.502 -1.274 -5.765 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -19.374 -0.622 -7.173 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -18.653 -2.248 -7.247 1.00 0.00 H new ATOM 990 N ASP A 66 -16.644 1.589 -11.095 1.00 0.00 N ATOM 991 CA ASP A 66 -16.961 2.068 -12.464 1.00 0.00 C ATOM 992 C ASP A 66 -15.691 2.531 -13.164 1.00 0.00 C ATOM 993 O ASP A 66 -15.730 3.089 -14.243 1.00 0.00 O ATOM 994 CB ASP A 66 -17.964 3.220 -12.369 1.00 0.00 C ATOM 995 CG ASP A 66 -17.282 4.459 -11.782 1.00 0.00 C ATOM 996 OD1 ASP A 66 -17.017 4.456 -10.592 1.00 0.00 O ATOM 997 OD2 ASP A 66 -17.037 5.388 -12.534 1.00 0.00 O ATOM 0 H ASP A 66 -16.789 2.272 -10.351 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.396 1.255 -13.045 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.363 3.448 -13.357 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -18.808 2.928 -11.744 1.00 0.00 H new ATOM 1002 N ARG A 67 -14.565 2.292 -12.561 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.265 2.697 -13.181 1.00 0.00 C ATOM 1004 C ARG A 67 -12.238 1.593 -12.921 1.00 0.00 C ATOM 1005 O ARG A 67 -11.373 1.734 -12.080 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.742 4.006 -12.562 1.00 0.00 C ATOM 1007 CG ARG A 67 -13.714 5.177 -12.804 1.00 0.00 C ATOM 1008 CD ARG A 67 -13.469 5.803 -14.183 1.00 0.00 C ATOM 1009 NE ARG A 67 -14.620 6.680 -14.537 1.00 0.00 N ATOM 1010 CZ ARG A 67 -14.510 7.539 -15.513 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -13.394 7.625 -16.183 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -15.517 8.312 -15.817 1.00 0.00 N ATOM 0 H ARG A 67 -14.482 1.829 -11.656 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.419 2.851 -14.249 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -12.596 3.869 -11.491 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.768 4.247 -12.988 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -14.743 4.823 -12.736 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -13.585 5.931 -12.028 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -12.545 6.382 -14.173 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -13.348 5.022 -14.933 1.00 0.00 H new ATOM 0 HE ARG A 67 -15.494 6.609 -14.016 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -12.608 7.021 -15.944 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -13.308 8.296 -16.946 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -16.389 8.244 -15.292 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -15.432 8.984 -16.580 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.341 0.498 -13.634 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.418 -0.678 -13.490 1.00 0.00 C ATOM 1028 C PRO A 68 -9.927 -0.302 -13.493 1.00 0.00 C ATOM 1029 O PRO A 68 -9.067 -1.158 -13.476 1.00 0.00 O ATOM 1030 CB PRO A 68 -11.767 -1.547 -14.702 1.00 0.00 C ATOM 1031 CG PRO A 68 -13.198 -1.235 -14.977 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.363 0.252 -14.667 1.00 0.00 C ATOM 0 HA PRO A 68 -11.555 -1.175 -12.530 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.136 -1.308 -15.558 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.625 -2.606 -14.487 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.453 -1.449 -16.015 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -13.857 -1.840 -14.355 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.198 0.868 -15.551 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.365 0.478 -14.303 1.00 0.00 H new ATOM 1040 N ASN A 69 -9.613 0.965 -13.502 1.00 0.00 N ATOM 1041 CA ASN A 69 -8.184 1.393 -13.490 1.00 0.00 C ATOM 1042 C ASN A 69 -8.073 2.656 -12.642 1.00 0.00 C ATOM 1043 O ASN A 69 -7.667 3.700 -13.114 1.00 0.00 O ATOM 1044 CB ASN A 69 -7.729 1.696 -14.920 1.00 0.00 C ATOM 1045 CG ASN A 69 -8.588 2.823 -15.498 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -8.221 3.979 -15.430 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -9.726 2.532 -16.066 1.00 0.00 N ATOM 0 H ASN A 69 -10.290 1.728 -13.517 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.556 0.603 -13.077 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -6.678 1.985 -14.926 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -7.817 0.803 -15.538 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.308 3.275 -16.453 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.034 1.561 -16.123 1.00 0.00 H new ATOM 1054 N TYR A 70 -8.453 2.570 -11.388 1.00 0.00 N ATOM 1055 CA TYR A 70 -8.397 3.765 -10.491 1.00 0.00 C ATOM 1056 C TYR A 70 -7.787 3.388 -9.140 1.00 0.00 C ATOM 1057 O TYR A 70 -8.469 2.934 -8.244 1.00 0.00 O ATOM 1058 CB TYR A 70 -9.818 4.288 -10.268 1.00 0.00 C ATOM 1059 CG TYR A 70 -9.770 5.615 -9.546 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -9.506 6.789 -10.261 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -10.000 5.673 -8.164 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -9.470 8.021 -9.596 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -9.962 6.907 -7.500 1.00 0.00 C ATOM 1064 CZ TYR A 70 -9.698 8.080 -8.216 1.00 0.00 C ATOM 1065 OH TYR A 70 -9.663 9.295 -7.562 1.00 0.00 O ATOM 0 H TYR A 70 -8.801 1.718 -10.947 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.779 4.532 -10.958 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.327 4.403 -11.225 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -10.393 3.568 -9.686 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -9.330 6.745 -11.326 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -10.206 4.768 -7.612 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -9.266 8.926 -10.148 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -10.137 6.952 -6.435 1.00 0.00 H new ATOM 0 HH TYR A 70 -9.843 9.159 -6.608 1.00 0.00 H new ATOM 1075 N GLN A 71 -6.511 3.612 -8.988 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.829 3.323 -7.691 1.00 0.00 C ATOM 1077 C GLN A 71 -5.918 1.834 -7.318 1.00 0.00 C ATOM 1078 O GLN A 71 -5.335 0.990 -7.966 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.463 4.188 -6.586 1.00 0.00 C ATOM 1080 CG GLN A 71 -6.560 5.674 -7.047 1.00 0.00 C ATOM 1081 CD GLN A 71 -5.698 6.572 -6.158 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -4.580 6.884 -6.504 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -6.176 7.001 -5.022 1.00 0.00 N ATOM 0 H GLN A 71 -5.903 3.988 -9.716 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.772 3.566 -7.796 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.456 3.810 -6.345 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.867 4.121 -5.676 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -6.235 5.760 -8.084 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -7.598 6.005 -7.009 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -7.118 6.737 -4.733 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -5.608 7.600 -4.423 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.605 1.513 -6.249 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.691 0.089 -5.794 1.00 0.00 C ATOM 1094 C PHE A 72 -7.919 -0.603 -6.399 1.00 0.00 C ATOM 1095 O PHE A 72 -8.449 -1.537 -5.831 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.801 0.081 -4.250 1.00 0.00 C ATOM 1097 CG PHE A 72 -6.076 -1.111 -3.669 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -4.721 -1.004 -3.347 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -6.754 -2.316 -3.450 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -4.041 -2.097 -2.809 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -6.073 -3.415 -2.912 1.00 0.00 C ATOM 1102 CZ PHE A 72 -4.716 -3.305 -2.591 1.00 0.00 C ATOM 0 H PHE A 72 -7.113 2.180 -5.668 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.802 -0.451 -6.121 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.380 1.002 -3.846 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.850 0.054 -3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -4.199 -0.074 -3.515 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -7.802 -2.398 -3.696 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.993 -2.012 -2.560 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -6.595 -4.346 -2.745 1.00 0.00 H new ATOM 0 HZ PHE A 72 -4.189 -4.151 -2.175 1.00 0.00 H new ATOM 1112 N THR A 73 -8.378 -0.165 -7.534 1.00 0.00 N ATOM 1113 CA THR A 73 -9.573 -0.817 -8.134 1.00 0.00 C ATOM 1114 C THR A 73 -9.228 -2.234 -8.610 1.00 0.00 C ATOM 1115 O THR A 73 -10.027 -3.142 -8.494 1.00 0.00 O ATOM 1116 CB THR A 73 -10.071 -0.004 -9.329 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.354 1.325 -8.916 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.341 -0.656 -9.879 1.00 0.00 C ATOM 0 H THR A 73 -7.983 0.608 -8.069 1.00 0.00 H new ATOM 0 HA THR A 73 -10.350 -0.868 -7.372 1.00 0.00 H new ATOM 0 HB THR A 73 -9.306 0.020 -10.105 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.565 1.706 -8.476 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.704 -0.083 -10.732 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.119 -1.675 -10.195 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.106 -0.675 -9.103 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.053 -2.427 -9.168 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.663 -3.785 -9.681 1.00 0.00 C ATOM 1128 C ASN A 74 -6.595 -4.424 -8.790 1.00 0.00 C ATOM 1129 O ASN A 74 -6.368 -5.616 -8.852 1.00 0.00 O ATOM 1130 CB ASN A 74 -7.105 -3.639 -11.098 1.00 0.00 C ATOM 1131 CG ASN A 74 -8.236 -3.248 -12.050 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -9.298 -2.847 -11.618 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -8.052 -3.346 -13.338 1.00 0.00 N ATOM 0 H ASN A 74 -7.346 -1.702 -9.291 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.546 -4.424 -9.678 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.321 -2.882 -11.116 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.651 -4.576 -11.420 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.800 -3.086 -13.981 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.160 -3.683 -13.702 1.00 0.00 H new ATOM 1140 N LEU A 75 -5.930 -3.661 -7.968 1.00 0.00 N ATOM 1141 CA LEU A 75 -4.881 -4.267 -7.097 1.00 0.00 C ATOM 1142 C LEU A 75 -5.506 -5.442 -6.334 1.00 0.00 C ATOM 1143 O LEU A 75 -4.837 -6.379 -5.946 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.354 -3.193 -6.117 1.00 0.00 C ATOM 1145 CG LEU A 75 -2.868 -3.394 -5.743 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.562 -4.859 -5.404 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -1.962 -2.904 -6.882 1.00 0.00 C ATOM 0 H LEU A 75 -6.064 -2.656 -7.861 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.044 -4.631 -7.692 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.480 -2.207 -6.565 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.957 -3.210 -5.209 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.666 -2.802 -4.850 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.508 -4.960 -5.146 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.174 -5.172 -4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.787 -5.487 -6.266 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.918 -3.051 -6.606 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.180 -3.468 -7.789 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.144 -1.844 -7.061 1.00 0.00 H new ATOM 1159 N LYS A 76 -6.796 -5.404 -6.144 1.00 0.00 N ATOM 1160 CA LYS A 76 -7.485 -6.516 -5.430 1.00 0.00 C ATOM 1161 C LYS A 76 -7.732 -7.646 -6.424 1.00 0.00 C ATOM 1162 O LYS A 76 -8.045 -8.762 -6.058 1.00 0.00 O ATOM 1163 CB LYS A 76 -8.824 -6.016 -4.883 1.00 0.00 C ATOM 1164 CG LYS A 76 -9.606 -5.321 -6.004 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.026 -4.997 -5.526 1.00 0.00 C ATOM 1166 CE LYS A 76 -10.994 -3.838 -4.524 1.00 0.00 C ATOM 1167 NZ LYS A 76 -12.370 -3.291 -4.356 1.00 0.00 N ATOM 0 H LYS A 76 -7.405 -4.647 -6.454 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.870 -6.871 -4.603 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -9.401 -6.851 -4.486 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -8.656 -5.323 -4.058 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.095 -4.405 -6.302 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.647 -5.964 -6.883 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.653 -4.734 -6.378 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.471 -5.877 -5.062 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -10.608 -4.183 -3.565 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -10.321 -3.057 -4.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.414 -2.333 -4.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -13.050 -3.904 -4.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -12.608 -3.254 -3.344 1.00 0.00 H new ATOM 1181 N ALA A 77 -7.593 -7.352 -7.684 1.00 0.00 N ATOM 1182 CA ALA A 77 -7.814 -8.383 -8.728 1.00 0.00 C ATOM 1183 C ALA A 77 -6.583 -9.285 -8.806 1.00 0.00 C ATOM 1184 O ALA A 77 -6.623 -10.368 -9.355 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.034 -7.682 -10.069 1.00 0.00 C ATOM 0 H ALA A 77 -7.333 -6.431 -8.037 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.687 -8.989 -8.486 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.198 -8.428 -10.847 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -8.906 -7.031 -10.001 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.155 -7.087 -10.317 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.489 -8.841 -8.254 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.246 -9.659 -8.282 1.00 0.00 C ATOM 1193 C ALA A 78 -4.495 -10.994 -7.572 1.00 0.00 C ATOM 1194 O ALA A 78 -5.623 -11.401 -7.375 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.130 -8.897 -7.566 1.00 0.00 C ATOM 0 H ALA A 78 -5.402 -7.941 -7.782 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.955 -9.851 -9.315 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.216 -9.490 -7.582 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -2.955 -7.947 -8.072 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.422 -8.710 -6.533 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.451 -11.677 -7.185 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.629 -12.984 -6.488 1.00 0.00 C ATOM 1203 C LYS A 79 -2.268 -13.504 -6.020 1.00 0.00 C ATOM 1204 O LYS A 79 -1.240 -12.927 -6.307 1.00 0.00 O ATOM 1205 CB LYS A 79 -4.258 -13.993 -7.451 1.00 0.00 C ATOM 1206 CG LYS A 79 -3.554 -13.914 -8.807 1.00 0.00 C ATOM 1207 CD LYS A 79 -3.905 -15.147 -9.643 1.00 0.00 C ATOM 1208 CE LYS A 79 -5.427 -15.288 -9.741 1.00 0.00 C ATOM 1209 NZ LYS A 79 -5.768 -16.204 -10.868 1.00 0.00 N ATOM 0 H LYS A 79 -2.483 -11.387 -7.321 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.281 -12.850 -5.625 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.174 -15.001 -7.044 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -5.321 -13.785 -7.569 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -3.857 -13.008 -9.332 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -2.475 -13.854 -8.665 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -3.473 -15.057 -10.640 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -3.476 -16.040 -9.189 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.828 -15.679 -8.806 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.884 -14.311 -9.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -6.801 -16.301 -10.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.398 -15.813 -11.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.343 -17.138 -10.697 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.250 -14.594 -5.300 1.00 0.00 N ATOM 1224 CA LYS A 80 -0.952 -15.147 -4.817 1.00 0.00 C ATOM 1225 C LYS A 80 0.036 -15.220 -5.986 1.00 0.00 C ATOM 1226 O LYS A 80 -0.344 -15.401 -7.126 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.176 -16.556 -4.244 1.00 0.00 C ATOM 1228 CG LYS A 80 -1.715 -16.469 -2.805 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.570 -16.214 -1.806 1.00 0.00 C ATOM 1230 CE LYS A 80 -1.036 -16.562 -0.387 1.00 0.00 C ATOM 1231 NZ LYS A 80 -0.987 -18.040 -0.199 1.00 0.00 N ATOM 0 H LYS A 80 -3.077 -15.124 -5.026 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.547 -14.500 -4.039 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -1.880 -17.103 -4.871 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -0.239 -17.114 -4.256 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.450 -15.667 -2.735 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.229 -17.395 -2.548 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.299 -16.816 -2.072 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.260 -15.170 -1.852 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.399 -16.069 0.348 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.050 -16.197 -0.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.783 -18.340 0.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.052 -18.510 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.091 -18.302 0.260 1.00 0.00 H new ATOM 1245 N GLY A 81 1.305 -15.089 -5.708 1.00 0.00 N ATOM 1246 CA GLY A 81 2.322 -15.157 -6.796 1.00 0.00 C ATOM 1247 C GLY A 81 2.300 -13.863 -7.613 1.00 0.00 C ATOM 1248 O GLY A 81 3.179 -13.610 -8.412 1.00 0.00 O ATOM 0 H GLY A 81 1.682 -14.938 -4.772 1.00 0.00 H new ATOM 0 HA2 GLY A 81 3.313 -15.311 -6.370 1.00 0.00 H new ATOM 0 HA3 GLY A 81 2.118 -16.010 -7.444 1.00 0.00 H new ATOM 1252 N SER A 82 1.310 -13.037 -7.416 1.00 0.00 N ATOM 1253 CA SER A 82 1.245 -11.761 -8.178 1.00 0.00 C ATOM 1254 C SER A 82 2.464 -10.921 -7.825 1.00 0.00 C ATOM 1255 O SER A 82 2.470 -10.203 -6.845 1.00 0.00 O ATOM 1256 CB SER A 82 -0.023 -10.992 -7.805 1.00 0.00 C ATOM 1257 OG SER A 82 -1.158 -11.679 -8.316 1.00 0.00 O ATOM 0 H SER A 82 0.544 -13.191 -6.760 1.00 0.00 H new ATOM 0 HA SER A 82 1.228 -11.974 -9.247 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.099 -10.897 -6.722 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.018 -9.982 -8.212 1.00 0.00 H new ATOM 0 HG SER A 82 -1.201 -12.576 -7.924 1.00 0.00 H new ATOM 1263 N MET A 83 3.503 -11.008 -8.600 1.00 0.00 N ATOM 1264 CA MET A 83 4.711 -10.212 -8.279 1.00 0.00 C ATOM 1265 C MET A 83 4.390 -8.725 -8.437 1.00 0.00 C ATOM 1266 O MET A 83 3.416 -8.358 -9.063 1.00 0.00 O ATOM 1267 CB MET A 83 5.854 -10.601 -9.215 1.00 0.00 C ATOM 1268 CG MET A 83 5.512 -10.181 -10.646 1.00 0.00 C ATOM 1269 SD MET A 83 6.616 -11.026 -11.805 1.00 0.00 S ATOM 1270 CE MET A 83 8.179 -10.517 -11.046 1.00 0.00 C ATOM 0 H MET A 83 3.568 -11.591 -9.435 1.00 0.00 H new ATOM 0 HA MET A 83 5.016 -10.411 -7.252 1.00 0.00 H new ATOM 0 HB2 MET A 83 6.779 -10.120 -8.895 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.023 -11.677 -9.172 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.474 -10.428 -10.870 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.613 -9.101 -10.753 1.00 0.00 H new ATOM 0 HE1 MET A 83 8.980 -10.584 -11.782 1.00 0.00 H new ATOM 0 HE2 MET A 83 8.095 -9.489 -10.694 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.405 -11.172 -10.204 1.00 0.00 H new ATOM 1280 N VAL A 84 5.199 -7.866 -7.865 1.00 0.00 N ATOM 1281 CA VAL A 84 4.934 -6.395 -7.964 1.00 0.00 C ATOM 1282 C VAL A 84 6.255 -5.639 -8.152 1.00 0.00 C ATOM 1283 O VAL A 84 7.324 -6.217 -8.108 1.00 0.00 O ATOM 1284 CB VAL A 84 4.223 -5.931 -6.681 1.00 0.00 C ATOM 1285 CG1 VAL A 84 3.149 -6.954 -6.292 1.00 0.00 C ATOM 1286 CG2 VAL A 84 5.233 -5.808 -5.540 1.00 0.00 C ATOM 0 H VAL A 84 6.032 -8.120 -7.334 1.00 0.00 H new ATOM 0 HA VAL A 84 4.297 -6.188 -8.824 1.00 0.00 H new ATOM 0 HB VAL A 84 3.761 -4.960 -6.862 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.645 -6.625 -5.383 1.00 0.00 H new ATOM 0 HG12 VAL A 84 2.421 -7.042 -7.099 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.616 -7.923 -6.118 1.00 0.00 H new ATOM 0 HG21 VAL A 84 4.722 -5.479 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.700 -6.777 -5.361 1.00 0.00 H new ATOM 0 HG23 VAL A 84 5.999 -5.080 -5.809 1.00 0.00 H new ATOM 1296 N TYR A 85 6.188 -4.347 -8.371 1.00 0.00 N ATOM 1297 CA TYR A 85 7.437 -3.552 -8.574 1.00 0.00 C ATOM 1298 C TYR A 85 7.276 -2.158 -7.961 1.00 0.00 C ATOM 1299 O TYR A 85 6.557 -1.322 -8.472 1.00 0.00 O ATOM 1300 CB TYR A 85 7.709 -3.410 -10.074 1.00 0.00 C ATOM 1301 CG TYR A 85 8.202 -4.725 -10.629 1.00 0.00 C ATOM 1302 CD1 TYR A 85 7.285 -5.689 -11.063 1.00 0.00 C ATOM 1303 CD2 TYR A 85 9.578 -4.978 -10.714 1.00 0.00 C ATOM 1304 CE1 TYR A 85 7.742 -6.906 -11.582 1.00 0.00 C ATOM 1305 CE2 TYR A 85 10.034 -6.196 -11.234 1.00 0.00 C ATOM 1306 CZ TYR A 85 9.116 -7.160 -11.668 1.00 0.00 C ATOM 1307 OH TYR A 85 9.567 -8.358 -12.181 1.00 0.00 O ATOM 0 H TYR A 85 5.322 -3.811 -8.418 1.00 0.00 H new ATOM 0 HA TYR A 85 8.268 -4.065 -8.091 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.799 -3.104 -10.591 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.451 -2.630 -10.247 1.00 0.00 H new ATOM 0 HD1 TYR A 85 6.225 -5.494 -10.997 1.00 0.00 H new ATOM 0 HD2 TYR A 85 10.286 -4.234 -10.379 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.034 -7.650 -11.916 1.00 0.00 H new ATOM 0 HE2 TYR A 85 11.094 -6.392 -11.300 1.00 0.00 H new ATOM 0 HH TYR A 85 10.547 -8.370 -12.170 1.00 0.00 H new ATOM 1317 N PHE A 86 7.956 -1.900 -6.873 1.00 0.00 N ATOM 1318 CA PHE A 86 7.868 -0.557 -6.224 1.00 0.00 C ATOM 1319 C PHE A 86 9.030 0.303 -6.723 1.00 0.00 C ATOM 1320 O PHE A 86 10.181 0.022 -6.452 1.00 0.00 O ATOM 1321 CB PHE A 86 7.964 -0.721 -4.705 1.00 0.00 C ATOM 1322 CG PHE A 86 7.687 0.605 -4.032 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.416 1.181 -4.128 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.698 1.257 -3.312 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.153 2.406 -3.505 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.436 2.484 -2.690 1.00 0.00 C ATOM 1327 CZ PHE A 86 7.163 3.058 -2.786 1.00 0.00 C ATOM 0 H PHE A 86 8.571 -2.565 -6.404 1.00 0.00 H new ATOM 0 HA PHE A 86 6.920 -0.080 -6.473 1.00 0.00 H new ATOM 0 HB2 PHE A 86 7.249 -1.469 -4.364 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.956 -1.080 -4.430 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.637 0.680 -4.683 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.680 0.813 -3.237 1.00 0.00 H new ATOM 0 HE1 PHE A 86 5.171 2.849 -3.579 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.215 2.987 -2.137 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.959 4.004 -2.306 1.00 0.00 H new ATOM 1337 N LYS A 87 8.743 1.343 -7.464 1.00 0.00 N ATOM 1338 CA LYS A 87 9.839 2.212 -7.997 1.00 0.00 C ATOM 1339 C LYS A 87 10.042 3.426 -7.090 1.00 0.00 C ATOM 1340 O LYS A 87 9.107 3.970 -6.537 1.00 0.00 O ATOM 1341 CB LYS A 87 9.472 2.688 -9.404 1.00 0.00 C ATOM 1342 CG LYS A 87 9.323 1.479 -10.331 1.00 0.00 C ATOM 1343 CD LYS A 87 9.150 1.957 -11.774 1.00 0.00 C ATOM 1344 CE LYS A 87 9.305 0.771 -12.726 1.00 0.00 C ATOM 1345 NZ LYS A 87 8.978 1.205 -14.114 1.00 0.00 N ATOM 0 H LYS A 87 7.799 1.629 -7.723 1.00 0.00 H new ATOM 0 HA LYS A 87 10.763 1.635 -8.030 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.541 3.255 -9.376 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.242 3.359 -9.785 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.201 0.837 -10.253 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.463 0.881 -10.030 1.00 0.00 H new ATOM 0 HD2 LYS A 87 8.169 2.414 -11.902 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.890 2.722 -12.006 1.00 0.00 H new ATOM 0 HE2 LYS A 87 10.324 0.387 -12.684 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.645 -0.042 -12.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.083 0.399 -14.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 7.998 1.552 -14.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 9.625 1.967 -14.401 1.00 0.00 H new ATOM 1359 N VAL A 88 11.269 3.855 -6.942 1.00 0.00 N ATOM 1360 CA VAL A 88 11.568 5.037 -6.080 1.00 0.00 C ATOM 1361 C VAL A 88 12.691 5.853 -6.724 1.00 0.00 C ATOM 1362 O VAL A 88 13.855 5.671 -6.423 1.00 0.00 O ATOM 1363 CB VAL A 88 12.021 4.562 -4.698 1.00 0.00 C ATOM 1364 CG1 VAL A 88 12.103 5.758 -3.748 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.018 3.544 -4.152 1.00 0.00 C ATOM 0 H VAL A 88 12.084 3.432 -7.386 1.00 0.00 H new ATOM 0 HA VAL A 88 10.673 5.651 -5.978 1.00 0.00 H new ATOM 0 HB VAL A 88 13.003 4.095 -4.780 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.426 5.419 -2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 88 12.820 6.482 -4.136 1.00 0.00 H new ATOM 0 HG13 VAL A 88 11.122 6.226 -3.667 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.342 3.206 -3.167 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.035 4.009 -4.071 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.961 2.691 -4.828 1.00 0.00 H new ATOM 1375 N GLY A 89 12.355 6.748 -7.610 1.00 0.00 N ATOM 1376 CA GLY A 89 13.406 7.570 -8.275 1.00 0.00 C ATOM 1377 C GLY A 89 14.324 6.662 -9.094 1.00 0.00 C ATOM 1378 O GLY A 89 13.872 5.808 -9.831 1.00 0.00 O ATOM 0 H GLY A 89 11.398 6.947 -7.903 1.00 0.00 H new ATOM 0 HA2 GLY A 89 12.944 8.316 -8.922 1.00 0.00 H new ATOM 0 HA3 GLY A 89 13.986 8.112 -7.528 1.00 0.00 H new ATOM 1382 N ASN A 90 15.613 6.837 -8.974 1.00 0.00 N ATOM 1383 CA ASN A 90 16.558 5.981 -9.748 1.00 0.00 C ATOM 1384 C ASN A 90 16.753 4.646 -9.023 1.00 0.00 C ATOM 1385 O ASN A 90 17.834 4.094 -9.002 1.00 0.00 O ATOM 1386 CB ASN A 90 17.908 6.693 -9.873 1.00 0.00 C ATOM 1387 CG ASN A 90 17.767 7.902 -10.799 1.00 0.00 C ATOM 1388 OD1 ASN A 90 17.752 9.030 -10.347 1.00 0.00 O ATOM 1389 ND2 ASN A 90 17.665 7.716 -12.087 1.00 0.00 N ATOM 0 H ASN A 90 16.052 7.535 -8.374 1.00 0.00 H new ATOM 0 HA ASN A 90 16.148 5.799 -10.742 1.00 0.00 H new ATOM 0 HB2 ASN A 90 18.254 7.013 -8.890 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.658 6.006 -10.266 1.00 0.00 H new ATOM 0 HD21 ASN A 90 17.573 8.517 -12.712 1.00 0.00 H new ATOM 0 HD22 ASN A 90 17.677 6.770 -12.468 1.00 0.00 H new ATOM 1396 N GLU A 91 15.709 4.121 -8.428 1.00 0.00 N ATOM 1397 CA GLU A 91 15.821 2.818 -7.700 1.00 0.00 C ATOM 1398 C GLU A 91 14.581 1.975 -7.999 1.00 0.00 C ATOM 1399 O GLU A 91 13.520 2.496 -8.275 1.00 0.00 O ATOM 1400 CB GLU A 91 15.906 3.077 -6.192 1.00 0.00 C ATOM 1401 CG GLU A 91 17.238 3.756 -5.852 1.00 0.00 C ATOM 1402 CD GLU A 91 17.182 5.232 -6.249 1.00 0.00 C ATOM 1403 OE1 GLU A 91 16.176 5.863 -5.969 1.00 0.00 O ATOM 1404 OE2 GLU A 91 18.146 5.706 -6.828 1.00 0.00 O ATOM 0 H GLU A 91 14.780 4.541 -8.415 1.00 0.00 H new ATOM 0 HA GLU A 91 16.718 2.291 -8.026 1.00 0.00 H new ATOM 0 HB2 GLU A 91 15.075 3.708 -5.875 1.00 0.00 H new ATOM 0 HB3 GLU A 91 15.818 2.137 -5.647 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.442 3.664 -4.785 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.054 3.259 -6.376 1.00 0.00 H new ATOM 1411 N THR A 92 14.703 0.673 -7.954 1.00 0.00 N ATOM 1412 CA THR A 92 13.523 -0.196 -8.244 1.00 0.00 C ATOM 1413 C THR A 92 13.666 -1.535 -7.520 1.00 0.00 C ATOM 1414 O THR A 92 14.748 -2.073 -7.391 1.00 0.00 O ATOM 1415 CB THR A 92 13.431 -0.439 -9.751 1.00 0.00 C ATOM 1416 OG1 THR A 92 13.234 0.802 -10.417 1.00 0.00 O ATOM 1417 CG2 THR A 92 12.258 -1.374 -10.052 1.00 0.00 C ATOM 0 H THR A 92 15.565 0.176 -7.730 1.00 0.00 H new ATOM 0 HA THR A 92 12.618 0.302 -7.895 1.00 0.00 H new ATOM 0 HB THR A 92 14.355 -0.899 -10.101 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.176 0.649 -11.383 1.00 0.00 H new ATOM 0 HG21 THR A 92 12.195 -1.545 -11.127 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.410 -2.325 -9.542 1.00 0.00 H new ATOM 0 HG23 THR A 92 11.331 -0.919 -9.702 1.00 0.00 H new ATOM 1425 N ARG A 93 12.573 -2.079 -7.048 1.00 0.00 N ATOM 1426 CA ARG A 93 12.624 -3.390 -6.331 1.00 0.00 C ATOM 1427 C ARG A 93 11.361 -4.190 -6.665 1.00 0.00 C ATOM 1428 O ARG A 93 10.438 -3.682 -7.271 1.00 0.00 O ATOM 1429 CB ARG A 93 12.696 -3.145 -4.812 1.00 0.00 C ATOM 1430 CG ARG A 93 11.822 -1.924 -4.419 1.00 0.00 C ATOM 1431 CD ARG A 93 12.673 -0.646 -4.317 1.00 0.00 C ATOM 1432 NE ARG A 93 13.873 -0.883 -3.445 1.00 0.00 N ATOM 1433 CZ ARG A 93 13.759 -1.306 -2.214 1.00 0.00 C ATOM 1434 NH1 ARG A 93 12.592 -1.357 -1.634 1.00 0.00 N ATOM 1435 NH2 ARG A 93 14.830 -1.626 -1.539 1.00 0.00 N ATOM 0 H ARG A 93 11.642 -1.669 -7.129 1.00 0.00 H new ATOM 0 HA ARG A 93 13.506 -3.948 -6.645 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.355 -4.032 -4.278 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.730 -2.971 -4.514 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.035 -1.783 -5.159 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.331 -2.116 -3.465 1.00 0.00 H new ATOM 0 HD2 ARG A 93 12.994 -0.335 -5.311 1.00 0.00 H new ATOM 0 HD3 ARG A 93 12.073 0.166 -3.907 1.00 0.00 H new ATOM 0 HE ARG A 93 14.803 -0.709 -3.825 1.00 0.00 H new ATOM 0 HH11 ARG A 93 11.757 -1.065 -2.142 1.00 0.00 H new ATOM 0 HH12 ARG A 93 12.514 -1.689 -0.673 1.00 0.00 H new ATOM 0 HH21 ARG A 93 15.749 -1.545 -1.973 1.00 0.00 H new ATOM 0 HH22 ARG A 93 14.747 -1.957 -0.578 1.00 0.00 H new ATOM 1449 N LYS A 94 11.313 -5.441 -6.280 1.00 0.00 N ATOM 1450 CA LYS A 94 10.110 -6.278 -6.579 1.00 0.00 C ATOM 1451 C LYS A 94 9.828 -7.215 -5.406 1.00 0.00 C ATOM 1452 O LYS A 94 10.675 -7.454 -4.567 1.00 0.00 O ATOM 1453 CB LYS A 94 10.368 -7.104 -7.841 1.00 0.00 C ATOM 1454 CG LYS A 94 11.620 -7.961 -7.643 1.00 0.00 C ATOM 1455 CD LYS A 94 11.998 -8.625 -8.969 1.00 0.00 C ATOM 1456 CE LYS A 94 13.211 -9.533 -8.759 1.00 0.00 C ATOM 1457 NZ LYS A 94 14.398 -8.703 -8.413 1.00 0.00 N ATOM 0 H LYS A 94 12.056 -5.920 -5.771 1.00 0.00 H new ATOM 0 HA LYS A 94 9.248 -5.629 -6.735 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.509 -7.740 -8.054 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.497 -6.445 -8.700 1.00 0.00 H new ATOM 0 HG2 LYS A 94 12.444 -7.343 -7.285 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.438 -8.720 -6.883 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.158 -9.206 -9.349 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.225 -7.865 -9.717 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.009 -10.249 -7.962 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.408 -10.110 -9.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 15.263 -9.267 -8.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.435 -7.873 -9.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.326 -8.389 -7.424 1.00 0.00 H new ATOM 1471 N TYR A 95 8.633 -7.745 -5.340 1.00 0.00 N ATOM 1472 CA TYR A 95 8.266 -8.671 -4.226 1.00 0.00 C ATOM 1473 C TYR A 95 7.435 -9.822 -4.796 1.00 0.00 C ATOM 1474 O TYR A 95 7.244 -9.921 -5.992 1.00 0.00 O ATOM 1475 CB TYR A 95 7.443 -7.914 -3.173 1.00 0.00 C ATOM 1476 CG TYR A 95 8.143 -6.621 -2.797 1.00 0.00 C ATOM 1477 CD1 TYR A 95 8.205 -5.557 -3.714 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.727 -6.483 -1.528 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.851 -4.366 -3.358 1.00 0.00 C ATOM 1480 CE2 TYR A 95 9.370 -5.291 -1.178 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.433 -4.233 -2.092 1.00 0.00 C ATOM 1482 OH TYR A 95 10.066 -3.058 -1.742 1.00 0.00 O ATOM 0 H TYR A 95 7.889 -7.574 -6.017 1.00 0.00 H new ATOM 0 HA TYR A 95 9.169 -9.061 -3.757 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.448 -7.698 -3.563 1.00 0.00 H new ATOM 0 HB3 TYR A 95 7.310 -8.536 -2.288 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.756 -5.658 -4.691 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.680 -7.298 -0.821 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.900 -3.549 -4.062 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.818 -5.187 -0.201 1.00 0.00 H new ATOM 0 HH TYR A 95 10.414 -3.133 -0.829 1.00 0.00 H new ATOM 1492 N LYS A 96 6.942 -10.699 -3.953 1.00 0.00 N ATOM 1493 CA LYS A 96 6.127 -11.855 -4.448 1.00 0.00 C ATOM 1494 C LYS A 96 4.904 -12.053 -3.551 1.00 0.00 C ATOM 1495 O LYS A 96 5.016 -12.466 -2.411 1.00 0.00 O ATOM 1496 CB LYS A 96 6.984 -13.123 -4.423 1.00 0.00 C ATOM 1497 CG LYS A 96 6.153 -14.319 -4.909 1.00 0.00 C ATOM 1498 CD LYS A 96 7.050 -15.561 -5.066 1.00 0.00 C ATOM 1499 CE LYS A 96 7.733 -15.555 -6.439 1.00 0.00 C ATOM 1500 NZ LYS A 96 8.492 -16.825 -6.618 1.00 0.00 N ATOM 0 H LYS A 96 7.069 -10.664 -2.942 1.00 0.00 H new ATOM 0 HA LYS A 96 5.795 -11.652 -5.466 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.860 -12.994 -5.059 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.348 -13.308 -3.412 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.352 -14.527 -4.199 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.681 -14.080 -5.862 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.803 -15.576 -4.278 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.453 -16.466 -4.953 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.988 -15.449 -7.228 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.406 -14.701 -6.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.956 -16.824 -7.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 9.212 -16.907 -5.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.838 -17.632 -6.559 1.00 0.00 H new ATOM 1514 N MET A 97 3.735 -11.772 -4.062 1.00 0.00 N ATOM 1515 CA MET A 97 2.502 -11.959 -3.249 1.00 0.00 C ATOM 1516 C MET A 97 2.506 -13.367 -2.653 1.00 0.00 C ATOM 1517 O MET A 97 2.255 -14.340 -3.338 1.00 0.00 O ATOM 1518 CB MET A 97 1.271 -11.785 -4.142 1.00 0.00 C ATOM 1519 CG MET A 97 0.014 -11.705 -3.275 1.00 0.00 C ATOM 1520 SD MET A 97 -0.064 -10.083 -2.474 1.00 0.00 S ATOM 1521 CE MET A 97 -0.991 -9.232 -3.774 1.00 0.00 C ATOM 0 H MET A 97 3.582 -11.421 -5.008 1.00 0.00 H new ATOM 0 HA MET A 97 2.473 -11.221 -2.448 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.369 -10.880 -4.742 1.00 0.00 H new ATOM 0 HB3 MET A 97 1.193 -12.621 -4.837 1.00 0.00 H new ATOM 0 HG2 MET A 97 -0.874 -11.863 -3.887 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.027 -12.494 -2.523 1.00 0.00 H new ATOM 0 HE1 MET A 97 -1.155 -8.194 -3.484 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.425 -9.263 -4.705 1.00 0.00 H new ATOM 0 HE3 MET A 97 -1.952 -9.725 -3.918 1.00 0.00 H new ATOM 1531 N THR A 98 2.790 -13.488 -1.385 1.00 0.00 N ATOM 1532 CA THR A 98 2.815 -14.837 -0.741 1.00 0.00 C ATOM 1533 C THR A 98 2.280 -14.725 0.687 1.00 0.00 C ATOM 1534 O THR A 98 2.731 -15.405 1.586 1.00 0.00 O ATOM 1535 CB THR A 98 4.260 -15.355 -0.713 1.00 0.00 C ATOM 1536 OG1 THR A 98 4.900 -15.027 -1.939 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.266 -16.874 -0.526 1.00 0.00 C ATOM 0 H THR A 98 3.007 -12.709 -0.763 1.00 0.00 H new ATOM 0 HA THR A 98 2.192 -15.529 -1.307 1.00 0.00 H new ATOM 0 HB THR A 98 4.793 -14.891 0.117 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.152 -14.080 -1.934 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.295 -17.234 -0.507 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.776 -17.127 0.414 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.732 -17.344 -1.352 1.00 0.00 H new ATOM 1545 N SER A 99 1.318 -13.872 0.902 1.00 0.00 N ATOM 1546 CA SER A 99 0.754 -13.717 2.267 1.00 0.00 C ATOM 1547 C SER A 99 -0.445 -12.782 2.191 1.00 0.00 C ATOM 1548 O SER A 99 -0.383 -11.733 1.582 1.00 0.00 O ATOM 1549 CB SER A 99 1.812 -13.121 3.191 1.00 0.00 C ATOM 1550 OG SER A 99 1.204 -12.734 4.416 1.00 0.00 O ATOM 0 H SER A 99 0.899 -13.275 0.189 1.00 0.00 H new ATOM 0 HA SER A 99 0.446 -14.687 2.659 1.00 0.00 H new ATOM 0 HB2 SER A 99 2.600 -13.850 3.378 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.281 -12.259 2.717 1.00 0.00 H new ATOM 0 HG SER A 99 1.882 -12.352 5.012 1.00 0.00 H new ATOM 1556 N ILE A 100 -1.544 -13.156 2.784 1.00 0.00 N ATOM 1557 CA ILE A 100 -2.760 -12.291 2.733 1.00 0.00 C ATOM 1558 C ILE A 100 -3.429 -12.289 4.111 1.00 0.00 C ATOM 1559 O ILE A 100 -3.422 -13.280 4.815 1.00 0.00 O ATOM 1560 CB ILE A 100 -3.714 -12.842 1.661 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.174 -12.488 0.263 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.106 -12.227 1.831 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.813 -13.400 -0.785 1.00 0.00 C ATOM 0 H ILE A 100 -1.655 -14.026 3.304 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.494 -11.266 2.474 1.00 0.00 H new ATOM 0 HB ILE A 100 -3.782 -13.924 1.770 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.392 -11.445 0.032 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.090 -12.599 0.243 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.775 -12.623 1.067 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.495 -12.475 2.818 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.040 -11.144 1.729 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.428 -13.145 -1.772 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.573 -14.439 -0.558 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.895 -13.267 -0.772 1.00 0.00 H new ATOM 1842 N ASP A 118 11.737 -11.235 6.476 1.00 0.00 N ATOM 1843 CA ASP A 118 12.306 -10.272 5.480 1.00 0.00 C ATOM 1844 C ASP A 118 11.311 -9.140 5.239 1.00 0.00 C ATOM 1845 O ASP A 118 10.160 -9.217 5.622 1.00 0.00 O ATOM 1846 CB ASP A 118 12.563 -11.007 4.162 1.00 0.00 C ATOM 1847 CG ASP A 118 13.773 -11.930 4.319 1.00 0.00 C ATOM 1848 OD1 ASP A 118 14.395 -11.885 5.368 1.00 0.00 O ATOM 1849 OD2 ASP A 118 14.059 -12.664 3.388 1.00 0.00 O ATOM 0 HA ASP A 118 13.240 -9.860 5.862 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.684 -11.587 3.880 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.742 -10.289 3.362 1.00 0.00 H new ATOM 1854 N LYS A 119 11.745 -8.092 4.592 1.00 0.00 N ATOM 1855 CA LYS A 119 10.833 -6.951 4.299 1.00 0.00 C ATOM 1856 C LYS A 119 9.517 -7.506 3.756 1.00 0.00 C ATOM 1857 O LYS A 119 9.436 -8.653 3.361 1.00 0.00 O ATOM 1858 CB LYS A 119 11.481 -6.027 3.257 1.00 0.00 C ATOM 1859 CG LYS A 119 12.473 -5.081 3.944 1.00 0.00 C ATOM 1860 CD LYS A 119 13.520 -5.894 4.707 1.00 0.00 C ATOM 1861 CE LYS A 119 14.660 -4.974 5.144 1.00 0.00 C ATOM 1862 NZ LYS A 119 15.497 -5.669 6.163 1.00 0.00 N ATOM 0 H LYS A 119 12.700 -7.978 4.252 1.00 0.00 H new ATOM 0 HA LYS A 119 10.646 -6.378 5.207 1.00 0.00 H new ATOM 0 HB2 LYS A 119 11.995 -6.621 2.501 1.00 0.00 H new ATOM 0 HB3 LYS A 119 10.713 -5.451 2.741 1.00 0.00 H new ATOM 0 HG2 LYS A 119 12.960 -4.449 3.202 1.00 0.00 H new ATOM 0 HG3 LYS A 119 11.943 -4.419 4.629 1.00 0.00 H new ATOM 0 HD2 LYS A 119 13.065 -6.366 5.578 1.00 0.00 H new ATOM 0 HD3 LYS A 119 13.906 -6.694 4.075 1.00 0.00 H new ATOM 0 HE2 LYS A 119 15.270 -4.699 4.283 1.00 0.00 H new ATOM 0 HE3 LYS A 119 14.257 -4.050 5.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 16.273 -5.043 6.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.911 -5.910 6.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 15.892 -6.539 5.753 1.00 0.00 H new ATOM 1876 N GLN A 120 8.481 -6.724 3.762 1.00 0.00 N ATOM 1877 CA GLN A 120 7.172 -7.233 3.277 1.00 0.00 C ATOM 1878 C GLN A 120 6.302 -6.052 2.850 1.00 0.00 C ATOM 1879 O GLN A 120 6.357 -4.984 3.428 1.00 0.00 O ATOM 1880 CB GLN A 120 6.497 -8.039 4.406 1.00 0.00 C ATOM 1881 CG GLN A 120 6.880 -7.451 5.773 1.00 0.00 C ATOM 1882 CD GLN A 120 6.420 -8.371 6.892 1.00 0.00 C ATOM 1883 OE1 GLN A 120 5.246 -8.648 7.036 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.318 -8.859 7.699 1.00 0.00 N ATOM 0 H GLN A 120 8.482 -5.755 4.081 1.00 0.00 H new ATOM 0 HA GLN A 120 7.311 -7.888 2.417 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.414 -8.017 4.282 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.803 -9.084 4.352 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.960 -7.313 5.827 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.427 -6.467 5.893 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.302 -8.621 7.571 1.00 0.00 H new ATOM 0 HE22 GLN A 120 7.038 -9.479 8.459 1.00 0.00 H new ATOM 1893 N LEU A 121 5.509 -6.235 1.829 1.00 0.00 N ATOM 1894 CA LEU A 121 4.636 -5.128 1.331 1.00 0.00 C ATOM 1895 C LEU A 121 3.193 -5.355 1.779 1.00 0.00 C ATOM 1896 O LEU A 121 2.506 -6.205 1.257 1.00 0.00 O ATOM 1897 CB LEU A 121 4.680 -5.116 -0.200 1.00 0.00 C ATOM 1898 CG LEU A 121 4.016 -3.831 -0.744 1.00 0.00 C ATOM 1899 CD1 LEU A 121 5.035 -2.687 -0.791 1.00 0.00 C ATOM 1900 CD2 LEU A 121 3.492 -4.080 -2.161 1.00 0.00 C ATOM 0 H LEU A 121 5.427 -7.111 1.313 1.00 0.00 H new ATOM 0 HA LEU A 121 4.993 -4.180 1.733 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.714 -5.172 -0.542 1.00 0.00 H new ATOM 0 HB3 LEU A 121 4.166 -5.994 -0.593 1.00 0.00 H new ATOM 0 HG LEU A 121 3.193 -3.560 -0.083 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.555 -1.787 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 121 5.413 -2.495 0.213 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.863 -2.964 -1.444 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.025 -3.172 -2.541 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.321 -4.361 -2.811 1.00 0.00 H new ATOM 0 HD23 LEU A 121 2.757 -4.885 -2.141 1.00 0.00 H new ATOM 1912 N THR A 122 2.719 -4.581 2.719 1.00 0.00 N ATOM 1913 CA THR A 122 1.306 -4.737 3.175 1.00 0.00 C ATOM 1914 C THR A 122 0.439 -3.779 2.354 1.00 0.00 C ATOM 1915 O THR A 122 0.884 -2.721 1.957 1.00 0.00 O ATOM 1916 CB THR A 122 1.206 -4.400 4.669 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.785 -5.454 5.424 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.262 -4.233 5.072 1.00 0.00 C ATOM 0 H THR A 122 3.248 -3.848 3.191 1.00 0.00 H new ATOM 0 HA THR A 122 0.966 -5.763 3.033 1.00 0.00 H new ATOM 0 HB THR A 122 1.737 -3.468 4.864 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.725 -5.243 6.379 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.323 -3.994 6.134 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.709 -3.425 4.492 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.801 -5.160 4.877 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.787 -4.153 2.069 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.677 -3.273 1.241 1.00 0.00 C ATOM 1928 C LEU A 123 -3.039 -3.101 1.917 1.00 0.00 C ATOM 1929 O LEU A 123 -3.502 -3.959 2.643 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.894 -3.930 -0.127 1.00 0.00 C ATOM 1931 CG LEU A 123 -0.553 -4.089 -0.878 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -0.647 -5.258 -1.866 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -0.223 -2.801 -1.650 1.00 0.00 C ATOM 0 H LEU A 123 -1.210 -5.030 2.374 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.203 -2.298 1.132 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.361 -4.906 0.003 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.579 -3.326 -0.721 1.00 0.00 H new ATOM 0 HG LEU A 123 0.234 -4.285 -0.150 1.00 0.00 H new ATOM 0 HD11 LEU A 123 0.301 -5.366 -2.393 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -0.867 -6.177 -1.323 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -1.442 -5.063 -2.586 1.00 0.00 H new ATOM 0 HD21 LEU A 123 0.724 -2.924 -2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -1.014 -2.596 -2.371 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.145 -1.968 -0.951 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.689 -1.992 1.662 1.00 0.00 N ATOM 1946 CA ILE A 124 -5.036 -1.734 2.259 1.00 0.00 C ATOM 1947 C ILE A 124 -5.916 -1.045 1.216 1.00 0.00 C ATOM 1948 O ILE A 124 -5.497 -0.112 0.563 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.916 -0.800 3.468 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.816 -1.286 4.412 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -6.249 -0.772 4.218 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.616 -0.247 5.514 1.00 0.00 C ATOM 0 H ILE A 124 -3.340 -1.247 1.059 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.468 -2.685 2.572 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.663 0.200 3.117 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.089 -2.248 4.846 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.887 -1.436 3.862 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.168 -0.109 5.079 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.033 -0.410 3.553 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.497 -1.778 4.557 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.833 -0.584 6.194 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.326 0.704 5.069 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.547 -0.120 6.067 1.00 0.00 H new ATOM 1964 N THR A 125 -7.136 -1.477 1.061 1.00 0.00 N ATOM 1965 CA THR A 125 -8.034 -0.816 0.067 1.00 0.00 C ATOM 1966 C THR A 125 -8.822 0.283 0.783 1.00 0.00 C ATOM 1967 O THR A 125 -8.928 0.287 1.993 1.00 0.00 O ATOM 1968 CB THR A 125 -9.006 -1.846 -0.523 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.189 -1.883 0.263 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.359 -3.239 -0.528 1.00 0.00 C ATOM 0 H THR A 125 -7.551 -2.254 1.575 1.00 0.00 H new ATOM 0 HA THR A 125 -7.442 -0.388 -0.742 1.00 0.00 H new ATOM 0 HB THR A 125 -9.249 -1.560 -1.546 1.00 0.00 H new ATOM 0 HG1 THR A 125 -10.812 -2.539 -0.114 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.057 -3.963 -0.949 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.452 -3.217 -1.132 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.108 -3.527 0.493 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.365 1.224 0.055 1.00 0.00 N ATOM 1979 CA CYS A 126 -10.132 2.326 0.713 1.00 0.00 C ATOM 1980 C CYS A 126 -11.308 2.743 -0.171 1.00 0.00 C ATOM 1981 O CYS A 126 -11.195 2.824 -1.375 1.00 0.00 O ATOM 1982 CB CYS A 126 -9.205 3.523 0.926 1.00 0.00 C ATOM 1983 SG CYS A 126 -8.088 3.176 2.308 1.00 0.00 S ATOM 0 H CYS A 126 -9.312 1.278 -0.962 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.514 1.978 1.673 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.631 3.719 0.020 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.791 4.419 1.133 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.508 3.794 3.372 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.435 3.012 0.429 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.632 3.433 -0.354 1.00 0.00 C ATOM 1991 C ASP A 127 -14.820 3.571 0.601 1.00 0.00 C ATOM 1992 O ASP A 127 -14.999 2.774 1.499 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.948 2.384 -1.430 1.00 0.00 C ATOM 1994 CG ASP A 127 -13.694 0.982 -0.872 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -13.541 0.863 0.333 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -13.662 0.049 -1.657 1.00 0.00 O ATOM 0 H ASP A 127 -12.579 2.958 1.437 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.437 4.387 -0.843 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.986 2.477 -1.749 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.328 2.554 -2.310 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.624 4.581 0.423 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.790 4.772 1.329 1.00 0.00 C ATOM 2003 C ASP A 128 -16.279 5.000 2.752 1.00 0.00 C ATOM 2004 O ASP A 128 -16.593 4.259 3.658 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.686 3.525 1.291 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.715 2.960 -0.130 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -18.472 3.475 -0.937 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -16.978 2.022 -0.389 1.00 0.00 O ATOM 0 H ASP A 128 -15.524 5.283 -0.311 1.00 0.00 H new ATOM 0 HA ASP A 128 -17.372 5.635 1.005 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -17.310 2.773 1.985 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.696 3.780 1.613 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.483 6.012 2.954 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.947 6.268 4.320 1.00 0.00 C ATOM 2015 C TYR A 129 -16.107 6.556 5.277 1.00 0.00 C ATOM 2016 O TYR A 129 -16.935 7.408 5.025 1.00 0.00 O ATOM 2017 CB TYR A 129 -13.984 7.461 4.277 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.379 7.690 5.644 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.114 8.343 6.639 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -12.077 7.255 5.910 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.543 8.559 7.900 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.506 7.469 7.168 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.239 8.122 8.164 1.00 0.00 C ATOM 2024 OH TYR A 129 -11.678 8.336 9.407 1.00 0.00 O ATOM 0 H TYR A 129 -15.181 6.671 2.236 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.406 5.390 4.674 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.195 7.275 3.548 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.515 8.355 3.951 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.120 8.680 6.436 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.510 6.752 5.141 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.109 9.063 8.669 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.501 7.131 7.370 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.063 7.603 9.619 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.182 5.841 6.374 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.299 6.067 7.339 1.00 0.00 C ATOM 2036 C ASN A 130 -16.927 7.198 8.304 1.00 0.00 C ATOM 2037 O ASN A 130 -15.981 7.099 9.060 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.542 4.778 8.129 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.645 5.004 9.162 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -19.320 6.015 9.136 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -18.860 4.098 10.076 1.00 0.00 N ATOM 0 H ASN A 130 -15.519 5.113 6.641 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.203 6.344 6.797 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.826 3.973 7.451 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.623 4.467 8.626 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -19.595 4.238 10.769 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -18.293 3.250 10.097 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.668 8.276 8.275 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.365 9.425 9.179 1.00 0.00 C ATOM 2050 C GLU A 131 -18.002 9.190 10.549 1.00 0.00 C ATOM 2051 O GLU A 131 -17.904 10.013 11.438 1.00 0.00 O ATOM 2052 CB GLU A 131 -17.931 10.712 8.572 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.363 10.465 8.093 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.043 11.805 7.805 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -19.373 12.691 7.300 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -21.223 11.924 8.095 1.00 0.00 O ATOM 0 H GLU A 131 -18.472 8.410 7.662 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.285 9.515 9.295 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.917 11.512 9.312 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.309 11.038 7.738 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.356 9.848 7.194 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -19.922 9.917 8.851 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.653 8.076 10.729 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.292 7.794 12.046 1.00 0.00 C ATOM 2065 C LYS A 132 -18.237 7.263 13.017 1.00 0.00 C ATOM 2066 O LYS A 132 -18.078 7.761 14.113 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.395 6.749 11.866 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.456 7.286 10.903 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.530 6.220 10.684 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.632 6.780 9.783 1.00 0.00 C ATOM 2071 NZ LYS A 132 -24.420 7.798 10.534 1.00 0.00 N ATOM 0 H LYS A 132 -18.771 7.349 10.023 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.726 8.711 12.445 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.972 5.822 11.478 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -20.848 6.514 12.829 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.905 8.193 11.308 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -20.997 7.556 9.952 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -22.089 5.333 10.228 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -22.951 5.911 11.641 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -23.194 7.229 8.891 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -24.285 5.975 9.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -25.323 7.967 10.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.606 7.452 11.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -23.882 8.686 10.583 1.00 0.00 H new ATOM 2085 N THR A 133 -17.508 6.253 12.619 1.00 0.00 N ATOM 2086 CA THR A 133 -16.454 5.681 13.512 1.00 0.00 C ATOM 2087 C THR A 133 -15.101 6.304 13.163 1.00 0.00 C ATOM 2088 O THR A 133 -14.150 6.206 13.912 1.00 0.00 O ATOM 2089 CB THR A 133 -16.384 4.168 13.307 1.00 0.00 C ATOM 2090 OG1 THR A 133 -16.359 3.880 11.916 1.00 0.00 O ATOM 2091 CG2 THR A 133 -17.609 3.508 13.943 1.00 0.00 C ATOM 0 H THR A 133 -17.597 5.797 11.711 1.00 0.00 H new ATOM 0 HA THR A 133 -16.698 5.898 14.552 1.00 0.00 H new ATOM 0 HB THR A 133 -15.480 3.780 13.775 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.313 2.910 11.784 1.00 0.00 H new ATOM 0 HG21 THR A 133 -17.558 2.429 13.796 1.00 0.00 H new ATOM 0 HG22 THR A 133 -17.628 3.729 15.010 1.00 0.00 H new ATOM 0 HG23 THR A 133 -18.515 3.895 13.476 1.00 0.00 H new ATOM 2099 N GLY A 134 -15.007 6.942 12.030 1.00 0.00 N ATOM 2100 CA GLY A 134 -13.714 7.569 11.633 1.00 0.00 C ATOM 2101 C GLY A 134 -12.766 6.493 11.104 1.00 0.00 C ATOM 2102 O GLY A 134 -11.591 6.483 11.413 1.00 0.00 O ATOM 0 H GLY A 134 -15.769 7.057 11.361 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.885 8.326 10.868 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.266 8.075 12.488 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.268 5.584 10.311 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.400 4.499 9.758 1.00 0.00 C ATOM 2108 C VAL A 135 -12.889 4.116 8.362 1.00 0.00 C ATOM 2109 O VAL A 135 -14.055 4.249 8.046 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.489 3.267 10.664 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -11.316 2.327 10.370 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.439 3.701 12.131 1.00 0.00 C ATOM 0 H VAL A 135 -14.245 5.545 10.020 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.370 4.853 9.707 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.428 2.747 10.472 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -11.381 1.451 11.016 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.354 2.013 9.327 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.377 2.847 10.558 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.503 2.822 12.773 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.502 4.224 12.324 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -13.276 4.366 12.342 1.00 0.00 H new ATOM 2122 N TRP A 136 -12.018 3.620 7.529 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.456 3.212 6.174 1.00 0.00 C ATOM 2124 C TRP A 136 -13.539 2.141 6.324 1.00 0.00 C ATOM 2125 O TRP A 136 -13.286 1.054 6.803 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.253 2.668 5.388 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.477 3.818 4.822 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.285 4.263 5.282 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.835 4.687 3.711 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.893 5.351 4.521 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.813 5.647 3.539 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.938 4.729 2.846 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.883 6.621 2.542 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -12.014 5.705 1.839 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.988 6.650 1.688 1.00 0.00 C ATOM 0 H TRP A 136 -11.028 3.481 7.730 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.861 4.063 5.626 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.617 2.070 6.040 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.593 2.013 4.586 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.731 3.839 6.107 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -8.028 5.871 4.669 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.734 4.007 2.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -9.090 7.346 2.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.867 5.728 1.177 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -11.052 7.399 0.912 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.753 2.469 5.949 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.898 1.515 6.081 1.00 0.00 C ATOM 2148 C GLU A 137 -15.444 0.074 5.828 1.00 0.00 C ATOM 2149 O GLU A 137 -15.148 -0.663 6.747 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.993 1.887 5.075 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.110 0.839 5.115 1.00 0.00 C ATOM 2152 CD GLU A 137 -19.349 1.383 4.400 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.977 2.277 4.941 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -19.648 0.894 3.322 1.00 0.00 O ATOM 0 H GLU A 137 -15.002 3.374 5.550 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.286 1.582 7.097 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.397 2.872 5.310 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.573 1.946 4.071 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -17.776 -0.082 4.636 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -18.353 0.591 6.148 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.392 -0.332 4.584 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.963 -1.730 4.252 1.00 0.00 C ATOM 2163 C LYS A 138 -13.561 -1.702 3.645 1.00 0.00 C ATOM 2164 O LYS A 138 -13.118 -0.697 3.125 1.00 0.00 O ATOM 2165 CB LYS A 138 -15.939 -2.335 3.240 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.029 -1.433 2.009 1.00 0.00 C ATOM 2167 CD LYS A 138 -17.052 -2.012 1.029 1.00 0.00 C ATOM 2168 CE LYS A 138 -17.336 -0.993 -0.075 1.00 0.00 C ATOM 2169 NZ LYS A 138 -18.152 -1.637 -1.143 1.00 0.00 N ATOM 0 H LYS A 138 -15.629 0.247 3.778 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.956 -2.333 5.160 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -15.606 -3.331 2.949 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -16.924 -2.448 3.693 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.321 -0.425 2.304 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -15.053 -1.355 1.530 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -16.672 -2.937 0.595 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -17.974 -2.261 1.554 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -17.866 -0.134 0.335 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.400 -0.621 -0.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.347 -0.946 -1.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.629 -2.444 -1.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -19.050 -1.972 -0.739 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.856 -2.798 3.711 1.00 0.00 N ATOM 2184 CA ARG A 139 -11.481 -2.831 3.141 1.00 0.00 C ATOM 2185 C ARG A 139 -10.920 -4.253 3.229 1.00 0.00 C ATOM 2186 O ARG A 139 -11.392 -5.073 3.991 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.581 -1.873 3.929 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.867 -2.018 5.432 1.00 0.00 C ATOM 2189 CD ARG A 139 -9.883 -1.155 6.259 1.00 0.00 C ATOM 2190 NE ARG A 139 -9.372 -1.937 7.432 1.00 0.00 N ATOM 2191 CZ ARG A 139 -10.178 -2.636 8.190 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -11.469 -2.592 8.003 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -9.690 -3.358 9.160 1.00 0.00 N ATOM 0 H ARG A 139 -13.173 -3.670 4.134 1.00 0.00 H new ATOM 0 HA ARG A 139 -11.514 -2.523 2.096 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -9.533 -2.092 3.725 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.760 -0.846 3.612 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.892 -1.714 5.644 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.777 -3.064 5.726 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.049 -0.839 5.632 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.383 -0.250 6.605 1.00 0.00 H new ATOM 0 HE ARG A 139 -8.374 -1.924 7.644 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -11.857 -2.009 7.261 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -12.090 -3.140 8.599 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -8.684 -3.376 9.326 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -10.315 -3.904 9.753 1.00 0.00 H new ATOM 2207 N LYS A 140 -9.907 -4.542 2.448 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.280 -5.902 2.461 1.00 0.00 C ATOM 2209 C LYS A 140 -7.771 -5.748 2.661 1.00 0.00 C ATOM 2210 O LYS A 140 -7.198 -4.728 2.322 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.549 -6.601 1.127 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.044 -6.906 1.001 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.300 -7.689 -0.288 1.00 0.00 C ATOM 2214 CE LYS A 140 -12.703 -8.295 -0.248 1.00 0.00 C ATOM 2215 NZ LYS A 140 -13.661 -7.290 0.293 1.00 0.00 N ATOM 0 H LYS A 140 -9.482 -3.885 1.794 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.703 -6.497 3.270 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.226 -5.968 0.301 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -8.973 -7.524 1.065 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.382 -7.483 1.862 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.616 -5.978 0.995 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -11.201 -7.031 -1.151 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -10.555 -8.477 -0.401 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -13.007 -8.602 -1.249 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -12.707 -9.190 0.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -14.632 -7.568 0.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -13.568 -7.243 1.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -13.453 -6.357 -0.116 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.128 -6.747 3.222 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.650 -6.671 3.472 1.00 0.00 C ATOM 2231 C ILE A 141 -4.908 -7.729 2.647 1.00 0.00 C ATOM 2232 O ILE A 141 -5.330 -8.862 2.539 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.381 -6.934 4.958 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.239 -5.998 5.823 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -3.899 -6.704 5.263 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -6.031 -4.536 5.410 1.00 0.00 C ATOM 0 H ILE A 141 -7.567 -7.618 3.520 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.297 -5.681 3.185 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.641 -7.967 5.188 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -7.291 -6.264 5.721 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -5.978 -6.125 6.874 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.712 -6.892 6.320 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.294 -7.382 4.661 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.634 -5.674 5.025 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.648 -3.890 6.035 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -4.982 -4.268 5.536 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -6.315 -4.409 4.365 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.781 -7.362 2.089 1.00 0.00 N ATOM 2249 CA PHE A 142 -2.965 -8.329 1.289 1.00 0.00 C ATOM 2250 C PHE A 142 -1.495 -8.143 1.679 1.00 0.00 C ATOM 2251 O PHE A 142 -1.122 -7.116 2.210 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.142 -8.053 -0.207 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.608 -7.877 -0.516 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -5.206 -6.617 -0.392 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -5.373 -8.976 -0.929 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -6.566 -6.456 -0.681 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -6.732 -8.815 -1.216 1.00 0.00 C ATOM 2258 CZ PHE A 142 -7.330 -7.554 -1.092 1.00 0.00 C ATOM 0 H PHE A 142 -3.387 -6.423 2.154 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.287 -9.350 1.492 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.590 -7.157 -0.490 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.733 -8.878 -0.791 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.618 -5.769 -0.073 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.913 -9.948 -1.026 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -7.026 -5.483 -0.587 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -7.321 -9.663 -1.533 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.380 -7.430 -1.313 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.653 -9.120 1.442 1.00 0.00 N ATOM 2269 CA VAL A 143 0.786 -8.965 1.830 1.00 0.00 C ATOM 2270 C VAL A 143 1.699 -9.725 0.860 1.00 0.00 C ATOM 2271 O VAL A 143 1.334 -10.747 0.305 1.00 0.00 O ATOM 2272 CB VAL A 143 0.992 -9.514 3.246 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.456 -9.335 3.652 1.00 0.00 C ATOM 2274 CG2 VAL A 143 0.097 -8.752 4.227 1.00 0.00 C ATOM 0 H VAL A 143 -0.895 -10.008 1.002 1.00 0.00 H new ATOM 0 HA VAL A 143 1.041 -7.906 1.794 1.00 0.00 H new ATOM 0 HB VAL A 143 0.733 -10.573 3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.605 -9.725 4.659 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.096 -9.877 2.955 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.712 -8.276 3.632 1.00 0.00 H new ATOM 0 HG21 VAL A 143 0.245 -9.143 5.234 1.00 0.00 H new ATOM 0 HG22 VAL A 143 0.355 -7.693 4.208 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -0.947 -8.876 3.939 1.00 0.00 H new ATOM 2284 N ALA A 144 2.897 -9.229 0.664 1.00 0.00 N ATOM 2285 CA ALA A 144 3.868 -9.902 -0.252 1.00 0.00 C ATOM 2286 C ALA A 144 5.264 -9.819 0.372 1.00 0.00 C ATOM 2287 O ALA A 144 5.672 -8.782 0.858 1.00 0.00 O ATOM 2288 CB ALA A 144 3.868 -9.184 -1.605 1.00 0.00 C ATOM 0 H ALA A 144 3.246 -8.378 1.105 1.00 0.00 H new ATOM 0 HA ALA A 144 3.587 -10.945 -0.399 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.575 -9.672 -2.276 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.869 -9.225 -2.039 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.160 -8.143 -1.465 1.00 0.00 H new ATOM 2294 N THR A 145 6.000 -10.905 0.380 1.00 0.00 N ATOM 2295 CA THR A 145 7.369 -10.882 0.993 1.00 0.00 C ATOM 2296 C THR A 145 8.425 -10.641 -0.091 1.00 0.00 C ATOM 2297 O THR A 145 8.310 -11.117 -1.202 1.00 0.00 O ATOM 2298 CB THR A 145 7.640 -12.216 1.704 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.778 -12.078 2.542 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.894 -13.324 0.679 1.00 0.00 C ATOM 0 H THR A 145 5.715 -11.803 -0.009 1.00 0.00 H new ATOM 0 HA THR A 145 7.421 -10.072 1.721 1.00 0.00 H new ATOM 0 HB THR A 145 6.768 -12.483 2.302 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.953 -12.927 2.999 1.00 0.00 H new ATOM 0 HG21 THR A 145 8.085 -14.263 1.198 1.00 0.00 H new ATOM 0 HG22 THR A 145 7.019 -13.434 0.038 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.760 -13.064 0.069 1.00 0.00 H new ATOM 2308 N GLU A 146 9.453 -9.903 0.229 1.00 0.00 N ATOM 2309 CA GLU A 146 10.518 -9.627 -0.775 1.00 0.00 C ATOM 2310 C GLU A 146 11.144 -10.950 -1.227 1.00 0.00 C ATOM 2311 O GLU A 146 11.266 -11.885 -0.459 1.00 0.00 O ATOM 2312 CB GLU A 146 11.592 -8.729 -0.140 1.00 0.00 C ATOM 2313 CG GLU A 146 12.442 -8.058 -1.228 1.00 0.00 C ATOM 2314 CD GLU A 146 13.425 -9.072 -1.815 1.00 0.00 C ATOM 2315 OE1 GLU A 146 14.323 -9.478 -1.095 1.00 0.00 O ATOM 2316 OE2 GLU A 146 13.267 -9.421 -2.973 1.00 0.00 O ATOM 0 H GLU A 146 9.601 -9.479 1.145 1.00 0.00 H new ATOM 0 HA GLU A 146 10.090 -9.120 -1.640 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.118 -7.968 0.481 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.230 -9.322 0.515 1.00 0.00 H new ATOM 0 HG2 GLU A 146 11.798 -7.664 -2.014 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.986 -7.212 -0.808 1.00 0.00 H new ATOM 2323 N VAL A 147 11.540 -11.039 -2.470 1.00 0.00 N ATOM 2324 CA VAL A 147 12.155 -12.303 -2.978 1.00 0.00 C ATOM 2325 C VAL A 147 13.674 -12.234 -2.802 1.00 0.00 C ATOM 2326 O VAL A 147 14.175 -11.712 -1.826 1.00 0.00 O ATOM 2327 CB VAL A 147 11.804 -12.472 -4.468 1.00 0.00 C ATOM 2328 CG1 VAL A 147 11.833 -13.959 -4.851 1.00 0.00 C ATOM 2329 CG2 VAL A 147 10.401 -11.908 -4.722 1.00 0.00 C ATOM 0 H VAL A 147 11.464 -10.289 -3.157 1.00 0.00 H new ATOM 0 HA VAL A 147 11.770 -13.155 -2.419 1.00 0.00 H new ATOM 0 HB VAL A 147 12.535 -11.935 -5.072 1.00 0.00 H new ATOM 0 HG11 VAL A 147 11.583 -14.068 -5.906 1.00 0.00 H new ATOM 0 HG12 VAL A 147 12.830 -14.362 -4.670 1.00 0.00 H new ATOM 0 HG13 VAL A 147 11.107 -14.504 -4.248 1.00 0.00 H new ATOM 0 HG21 VAL A 147 10.147 -12.025 -5.776 1.00 0.00 H new ATOM 0 HG22 VAL A 147 9.676 -12.447 -4.112 1.00 0.00 H new ATOM 0 HG23 VAL A 147 10.381 -10.850 -4.459 1.00 0.00 H new