USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 928 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 39 TYR OH : rot -112:sc= 0.392 USER MOD Set 1.2: A 64 ASN : amide:sc= -0.0314 K(o=0.36,f=-1.1) USER MOD Set 2.1: A 3 CYS SG : rot -123:sc= 0.403 USER MOD Set 2.2: A 5 CYS SG : rot -16:sc= -6.9! USER MOD Set 2.3: A 14 CYS SG : rot -80:sc= -0.41 USER MOD Set 2.4: A 15 CYS SG : rot 100:sc= -2.32 USER MOD Single : A 7 SER OG : rot -88:sc= 1.34 USER MOD Single : A 9 LYS NZ :NH3+ 144:sc= 0.0903 (180deg=0) USER MOD Single : A 10 THR OG1 : rot -108:sc= 0.473 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -36:sc= 0.185 USER MOD Single : A 24 SER OG : rot 180:sc= 0.017 USER MOD Single : A 27 SER OG : rot -5:sc= 0.892 USER MOD Single : A 32 MET CE :methyl 137:sc= -0.121 (180deg=-2.7!) USER MOD Single : A 34 SER OG : rot 119:sc= 1.16 USER MOD Single : A 36 TYR OH : rot 180:sc= -0.154 USER MOD Single : A 42 LYS NZ :NH3+ 170:sc=-0.000994 (180deg=-0.148) USER MOD Single : A 46 TYR OH : rot 180:sc= -1.44 USER MOD Single : A 50 THR OG1 : rot -66:sc= 1.11 USER MOD Single : A 51 THR OG1 : rot -150:sc= 1.07 USER MOD Single : A 61 HIS : no HD1:sc= -0.238 X(o=-0.24,f=-0.17) USER MOD Single : A 68 MET CE :methyl -151:sc= -0.541 (180deg=-1.47) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -154:sc= 0.901 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0.00388 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0848 USER MOD Single : A 104 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 105 SER OG : rot 41:sc= 0.321 USER MOD Single : A 106 HIS : no HD1:sc= -0.245 X(o=-0.25,f=0) USER MOD Single : A 107 HIS : no HD1:sc= 0.462 K(o=0.46,f=-3.6!) USER MOD Single : A 110 SER OG : rot -33:sc= 0.161 USER MOD Single : A 111 GLN : amide:sc= -2.12 K(o=-2.1,f=-6!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot -140:sc= 1.01 USER MOD Single : A 122 SER OG : rot -20:sc= -0.323 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.128 -4.736 -2.206 1.00 0.00 N ATOM 35 CA CYS A 3 -2.301 -5.392 -1.643 1.00 0.00 C ATOM 36 C CYS A 3 -1.887 -6.678 -0.950 1.00 0.00 C ATOM 37 O CYS A 3 -0.953 -7.348 -1.387 1.00 0.00 O ATOM 38 CB CYS A 3 -3.332 -5.711 -2.732 1.00 0.00 C ATOM 39 SG CYS A 3 -4.926 -6.305 -2.082 1.00 0.00 S ATOM 0 HA CYS A 3 -2.757 -4.712 -0.923 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -3.505 -4.816 -3.330 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -2.919 -6.466 -3.401 1.00 0.00 H new ATOM 0 HG CYS A 3 -5.195 -7.471 -2.590 1.00 0.00 H new ATOM 44 N VAL A 4 -2.596 -7.032 0.115 1.00 0.00 N ATOM 45 CA VAL A 4 -2.353 -8.286 0.830 1.00 0.00 C ATOM 46 C VAL A 4 -2.922 -9.480 0.051 1.00 0.00 C ATOM 47 O VAL A 4 -3.441 -10.431 0.636 1.00 0.00 O ATOM 48 CB VAL A 4 -2.977 -8.240 2.250 1.00 0.00 C ATOM 49 CG1 VAL A 4 -2.347 -7.121 3.078 1.00 0.00 C ATOM 50 CG2 VAL A 4 -4.497 -8.077 2.172 1.00 0.00 C ATOM 0 H VAL A 4 -3.349 -6.467 0.507 1.00 0.00 H new ATOM 0 HA VAL A 4 -1.274 -8.411 0.923 1.00 0.00 H new ATOM 0 HB VAL A 4 -2.768 -9.187 2.747 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -2.798 -7.105 4.070 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -1.275 -7.295 3.169 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -2.518 -6.164 2.586 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -4.912 -8.047 3.180 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -4.737 -7.149 1.653 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.926 -8.918 1.628 1.00 0.00 H new ATOM 60 N CYS A 5 -2.802 -9.437 -1.274 1.00 0.00 N ATOM 61 CA CYS A 5 -3.347 -10.483 -2.128 1.00 0.00 C ATOM 62 C CYS A 5 -2.831 -10.334 -3.559 1.00 0.00 C ATOM 63 O CYS A 5 -3.239 -9.415 -4.273 1.00 0.00 O ATOM 64 CB CYS A 5 -4.888 -10.450 -2.115 1.00 0.00 C ATOM 65 SG CYS A 5 -5.651 -9.745 -3.616 1.00 0.00 S ATOM 0 H CYS A 5 -2.331 -8.686 -1.778 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.016 -11.445 -1.736 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -5.258 -11.466 -1.979 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -5.218 -9.873 -1.251 1.00 0.00 H new ATOM 0 HG CYS A 5 -4.755 -9.089 -4.291 1.00 0.00 H new ATOM 70 N GLY A 6 -1.904 -11.214 -3.943 1.00 0.00 N ATOM 71 CA GLY A 6 -1.433 -11.295 -5.323 1.00 0.00 C ATOM 72 C GLY A 6 -1.051 -9.953 -5.928 1.00 0.00 C ATOM 73 O GLY A 6 0.083 -9.496 -5.775 1.00 0.00 O ATOM 0 H GLY A 6 -1.464 -11.883 -3.312 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -0.569 -11.958 -5.362 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -2.212 -11.749 -5.935 1.00 0.00 H new ATOM 77 N SER A 7 -2.011 -9.331 -6.611 1.00 0.00 N ATOM 78 CA SER A 7 -1.802 -8.067 -7.308 1.00 0.00 C ATOM 79 C SER A 7 -1.186 -7.007 -6.391 1.00 0.00 C ATOM 80 O SER A 7 -1.719 -6.711 -5.315 1.00 0.00 O ATOM 81 CB SER A 7 -3.141 -7.569 -7.857 1.00 0.00 C ATOM 82 OG SER A 7 -3.794 -8.589 -8.594 1.00 0.00 O ATOM 0 H SER A 7 -2.961 -9.694 -6.696 1.00 0.00 H new ATOM 0 HA SER A 7 -1.101 -8.239 -8.125 1.00 0.00 H new ATOM 0 HB2 SER A 7 -3.778 -7.244 -7.034 1.00 0.00 H new ATOM 0 HB3 SER A 7 -2.977 -6.701 -8.496 1.00 0.00 H new ATOM 0 HG SER A 7 -3.499 -8.557 -9.528 1.00 0.00 H new ATOM 88 N GLY A 8 -0.078 -6.422 -6.844 1.00 0.00 N ATOM 89 CA GLY A 8 0.622 -5.412 -6.069 1.00 0.00 C ATOM 90 C GLY A 8 -0.048 -4.050 -6.128 1.00 0.00 C ATOM 91 O GLY A 8 0.533 -3.050 -5.708 1.00 0.00 O ATOM 0 H GLY A 8 0.350 -6.634 -7.745 1.00 0.00 H new ATOM 0 HA2 GLY A 8 0.683 -5.736 -5.030 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.645 -5.324 -6.436 1.00 0.00 H new ATOM 95 N LYS A 9 -1.259 -3.999 -6.676 1.00 0.00 N ATOM 96 CA LYS A 9 -2.053 -2.771 -6.670 1.00 0.00 C ATOM 97 C LYS A 9 -2.622 -2.538 -5.275 1.00 0.00 C ATOM 98 O LYS A 9 -2.723 -3.477 -4.486 1.00 0.00 O ATOM 99 CB LYS A 9 -3.193 -2.856 -7.696 1.00 0.00 C ATOM 100 CG LYS A 9 -2.723 -3.204 -9.101 1.00 0.00 C ATOM 101 CD LYS A 9 -3.830 -3.048 -10.145 1.00 0.00 C ATOM 102 CE LYS A 9 -4.989 -4.010 -9.910 1.00 0.00 C ATOM 103 NZ LYS A 9 -6.062 -3.851 -10.929 1.00 0.00 N ATOM 0 H LYS A 9 -1.713 -4.792 -7.130 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.409 -1.935 -6.944 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.912 -3.606 -7.366 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.718 -1.901 -7.723 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.883 -2.563 -9.369 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.358 -4.231 -9.114 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -4.202 -2.024 -10.126 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -3.415 -3.218 -11.139 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.619 -5.035 -9.930 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.405 -3.841 -8.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.473 -4.781 -11.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.804 -3.224 -10.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.660 -3.437 -11.794 1.00 0.00 H new ATOM 117 N THR A 10 -3.007 -1.302 -4.980 1.00 0.00 N ATOM 118 CA THR A 10 -3.514 -0.946 -3.653 1.00 0.00 C ATOM 119 C THR A 10 -4.815 -1.681 -3.321 1.00 0.00 C ATOM 120 O THR A 10 -5.313 -2.498 -4.106 1.00 0.00 O ATOM 121 CB THR A 10 -3.775 0.573 -3.541 1.00 0.00 C ATOM 122 OG1 THR A 10 -4.745 0.968 -4.520 1.00 0.00 O ATOM 123 CG2 THR A 10 -2.493 1.371 -3.732 1.00 0.00 C ATOM 0 H THR A 10 -2.979 -0.526 -5.641 1.00 0.00 H new ATOM 0 HA THR A 10 -2.741 -1.244 -2.944 1.00 0.00 H new ATOM 0 HB THR A 10 -4.155 0.781 -2.541 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.303 1.477 -5.231 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.711 2.436 -3.647 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.770 1.087 -2.967 1.00 0.00 H new ATOM 0 HG23 THR A 10 -2.078 1.163 -4.718 1.00 0.00 H new ATOM 131 N TYR A 11 -5.355 -1.377 -2.146 1.00 0.00 N ATOM 132 CA TYR A 11 -6.649 -1.885 -1.716 1.00 0.00 C ATOM 133 C TYR A 11 -7.707 -1.606 -2.776 1.00 0.00 C ATOM 134 O TYR A 11 -8.310 -2.533 -3.325 1.00 0.00 O ATOM 135 CB TYR A 11 -7.039 -1.227 -0.385 1.00 0.00 C ATOM 136 CG TYR A 11 -8.472 -1.479 0.053 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.859 -2.709 0.571 1.00 0.00 C ATOM 138 CD2 TYR A 11 -9.437 -0.479 -0.047 1.00 0.00 C ATOM 139 CE1 TYR A 11 -10.161 -2.934 0.977 1.00 0.00 C ATOM 140 CE2 TYR A 11 -10.739 -0.697 0.360 1.00 0.00 C ATOM 141 CZ TYR A 11 -11.096 -1.926 0.870 1.00 0.00 C ATOM 142 OH TYR A 11 -12.393 -2.148 1.284 1.00 0.00 O ATOM 0 H TYR A 11 -4.904 -0.768 -1.463 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.582 -2.964 -1.576 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -6.367 -1.588 0.394 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.883 -0.151 -0.468 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -8.131 -3.502 0.658 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -9.162 0.484 -0.450 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -10.445 -3.896 1.377 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -11.473 0.091 0.279 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.925 -1.337 1.142 1.00 0.00 H new ATOM 152 N ASP A 12 -7.900 -0.327 -3.079 1.00 0.00 N ATOM 153 CA ASP A 12 -8.928 0.094 -4.022 1.00 0.00 C ATOM 154 C ASP A 12 -8.541 -0.250 -5.459 1.00 0.00 C ATOM 155 O ASP A 12 -9.362 -0.778 -6.204 1.00 0.00 O ATOM 156 CB ASP A 12 -9.223 1.594 -3.877 1.00 0.00 C ATOM 157 CG ASP A 12 -7.992 2.466 -4.050 1.00 0.00 C ATOM 158 OD1 ASP A 12 -7.269 2.681 -3.055 1.00 0.00 O ATOM 159 OD2 ASP A 12 -7.750 2.954 -5.172 1.00 0.00 O ATOM 0 H ASP A 12 -7.355 0.439 -2.683 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.839 -0.456 -3.785 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -9.972 1.883 -4.615 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -9.656 1.779 -2.894 1.00 0.00 H new ATOM 164 N ASP A 13 -7.290 0.018 -5.842 1.00 0.00 N ATOM 165 CA ASP A 13 -6.828 -0.293 -7.202 1.00 0.00 C ATOM 166 C ASP A 13 -6.984 -1.779 -7.509 1.00 0.00 C ATOM 167 O ASP A 13 -7.256 -2.162 -8.647 1.00 0.00 O ATOM 168 CB ASP A 13 -5.363 0.125 -7.418 1.00 0.00 C ATOM 169 CG ASP A 13 -5.200 1.608 -7.718 1.00 0.00 C ATOM 170 OD1 ASP A 13 -5.706 2.065 -8.766 1.00 0.00 O ATOM 171 OD2 ASP A 13 -4.536 2.317 -6.934 1.00 0.00 O ATOM 0 H ASP A 13 -6.585 0.444 -5.240 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.454 0.281 -7.885 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.786 -0.124 -6.528 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -4.945 -0.454 -8.242 1.00 0.00 H new ATOM 176 N CYS A 14 -6.796 -2.619 -6.497 1.00 0.00 N ATOM 177 CA CYS A 14 -6.944 -4.065 -6.668 1.00 0.00 C ATOM 178 C CYS A 14 -8.322 -4.549 -6.210 1.00 0.00 C ATOM 179 O CYS A 14 -9.218 -4.756 -7.025 1.00 0.00 O ATOM 180 CB CYS A 14 -5.835 -4.824 -5.919 1.00 0.00 C ATOM 181 SG CYS A 14 -6.147 -6.613 -5.746 1.00 0.00 S ATOM 0 H CYS A 14 -6.542 -2.328 -5.553 1.00 0.00 H new ATOM 0 HA CYS A 14 -6.852 -4.276 -7.733 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -4.891 -4.679 -6.445 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -5.717 -4.389 -4.927 1.00 0.00 H new ATOM 0 HG CYS A 14 -6.971 -6.817 -4.762 1.00 0.00 H new ATOM 186 N CYS A 15 -8.487 -4.726 -4.904 1.00 0.00 N ATOM 187 CA CYS A 15 -9.696 -5.334 -4.345 1.00 0.00 C ATOM 188 C CYS A 15 -10.912 -4.403 -4.391 1.00 0.00 C ATOM 189 O CYS A 15 -12.046 -4.872 -4.332 1.00 0.00 O ATOM 190 CB CYS A 15 -9.432 -5.808 -2.912 1.00 0.00 C ATOM 191 SG CYS A 15 -8.548 -7.401 -2.809 1.00 0.00 S ATOM 0 H CYS A 15 -7.795 -4.456 -4.205 1.00 0.00 H new ATOM 0 HA CYS A 15 -9.941 -6.190 -4.973 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -8.852 -5.048 -2.390 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.384 -5.898 -2.389 1.00 0.00 H new ATOM 0 HG CYS A 15 -7.290 -7.184 -2.565 1.00 0.00 H new ATOM 196 N GLY A 16 -10.671 -3.098 -4.505 1.00 0.00 N ATOM 197 CA GLY A 16 -11.733 -2.107 -4.344 1.00 0.00 C ATOM 198 C GLY A 16 -12.979 -2.353 -5.192 1.00 0.00 C ATOM 199 O GLY A 16 -14.080 -2.448 -4.641 1.00 0.00 O ATOM 0 H GLY A 16 -9.753 -2.703 -4.708 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -12.026 -2.078 -3.295 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.332 -1.124 -4.591 1.00 0.00 H new ATOM 203 N PRO A 17 -12.854 -2.487 -6.530 1.00 0.00 N ATOM 204 CA PRO A 17 -14.018 -2.685 -7.408 1.00 0.00 C ATOM 205 C PRO A 17 -14.749 -3.997 -7.115 1.00 0.00 C ATOM 206 O PRO A 17 -15.967 -4.101 -7.300 1.00 0.00 O ATOM 207 CB PRO A 17 -13.417 -2.688 -8.825 1.00 0.00 C ATOM 208 CG PRO A 17 -11.969 -2.997 -8.634 1.00 0.00 C ATOM 209 CD PRO A 17 -11.593 -2.425 -7.294 1.00 0.00 C ATOM 0 HA PRO A 17 -14.771 -1.910 -7.266 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -13.899 -3.435 -9.456 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -13.553 -1.723 -9.313 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.793 -4.072 -8.662 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -11.368 -2.555 -9.429 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.804 -3.006 -6.816 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.226 -1.402 -7.382 1.00 0.00 H new ATOM 217 N LEU A 18 -13.997 -4.987 -6.639 1.00 0.00 N ATOM 218 CA LEU A 18 -14.559 -6.290 -6.303 1.00 0.00 C ATOM 219 C LEU A 18 -15.333 -6.209 -4.990 1.00 0.00 C ATOM 220 O LEU A 18 -16.494 -6.611 -4.919 1.00 0.00 O ATOM 221 CB LEU A 18 -13.452 -7.357 -6.203 1.00 0.00 C ATOM 222 CG LEU A 18 -12.762 -7.742 -7.527 1.00 0.00 C ATOM 223 CD1 LEU A 18 -13.792 -8.069 -8.602 1.00 0.00 C ATOM 224 CD2 LEU A 18 -11.810 -6.646 -8.000 1.00 0.00 C ATOM 0 H LEU A 18 -12.993 -4.909 -6.477 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.243 -6.581 -7.100 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.691 -6.998 -5.511 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.882 -8.258 -5.765 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.168 -8.637 -7.341 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.280 -8.337 -9.526 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.409 -8.905 -8.273 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.424 -7.199 -8.777 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.341 -6.950 -8.936 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.368 -5.723 -8.157 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.041 -6.481 -7.245 1.00 0.00 H new ATOM 236 N LEU A 19 -14.684 -5.665 -3.964 1.00 0.00 N ATOM 237 CA LEU A 19 -15.285 -5.521 -2.637 1.00 0.00 C ATOM 238 C LEU A 19 -16.508 -4.609 -2.687 1.00 0.00 C ATOM 239 O LEU A 19 -17.468 -4.799 -1.941 1.00 0.00 O ATOM 240 CB LEU A 19 -14.244 -4.979 -1.641 1.00 0.00 C ATOM 241 CG LEU A 19 -13.307 -6.036 -1.027 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.112 -5.376 -0.347 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.067 -6.907 -0.030 1.00 0.00 C ATOM 0 H LEU A 19 -13.729 -5.312 -4.026 1.00 0.00 H new ATOM 0 HA LEU A 19 -15.615 -6.504 -2.300 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.636 -4.230 -2.148 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -14.769 -4.470 -0.833 1.00 0.00 H new ATOM 0 HG LEU A 19 -12.935 -6.668 -1.834 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -11.466 -6.144 0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -11.552 -4.795 -1.080 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -12.463 -4.717 0.447 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.391 -7.649 0.395 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -14.467 -6.282 0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -14.887 -7.413 -0.540 1.00 0.00 H new ATOM 255 N ALA A 20 -16.471 -3.625 -3.580 1.00 0.00 N ATOM 256 CA ALA A 20 -17.598 -2.716 -3.771 1.00 0.00 C ATOM 257 C ALA A 20 -18.714 -3.399 -4.563 1.00 0.00 C ATOM 258 O ALA A 20 -19.807 -2.849 -4.710 1.00 0.00 O ATOM 259 CB ALA A 20 -17.141 -1.443 -4.475 1.00 0.00 C ATOM 0 H ALA A 20 -15.671 -3.436 -4.184 1.00 0.00 H new ATOM 0 HA ALA A 20 -17.992 -2.446 -2.791 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -17.993 -0.776 -4.610 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -16.382 -0.945 -3.871 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -16.721 -1.696 -5.448 1.00 0.00 H new ATOM 265 N ARG A 21 -18.415 -4.597 -5.083 1.00 0.00 N ATOM 266 CA ARG A 21 -19.373 -5.384 -5.868 1.00 0.00 C ATOM 267 C ARG A 21 -19.832 -4.609 -7.104 1.00 0.00 C ATOM 268 O ARG A 21 -20.848 -4.940 -7.719 1.00 0.00 O ATOM 269 CB ARG A 21 -20.577 -5.784 -4.994 1.00 0.00 C ATOM 270 CG ARG A 21 -20.242 -6.806 -3.906 1.00 0.00 C ATOM 271 CD ARG A 21 -20.024 -8.203 -4.482 1.00 0.00 C ATOM 272 NE ARG A 21 -21.259 -8.755 -5.051 1.00 0.00 N ATOM 273 CZ ARG A 21 -21.309 -9.693 -6.001 1.00 0.00 C ATOM 274 NH1 ARG A 21 -20.190 -10.199 -6.505 1.00 0.00 N ATOM 275 NH2 ARG A 21 -22.485 -10.119 -6.450 1.00 0.00 N ATOM 0 H ARG A 21 -17.506 -5.046 -4.972 1.00 0.00 H new ATOM 0 HA ARG A 21 -18.876 -6.292 -6.209 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -20.986 -4.889 -4.525 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.358 -6.193 -5.635 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.345 -6.489 -3.374 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -21.051 -6.837 -3.176 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.255 -8.163 -5.253 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.656 -8.866 -3.699 1.00 0.00 H new ATOM 0 HE ARG A 21 -22.145 -8.396 -4.695 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.285 -9.872 -6.167 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -20.235 -10.915 -7.230 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -23.348 -9.730 -6.069 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -22.525 -10.835 -7.175 1.00 0.00 H new ATOM 289 N THR A 22 -19.053 -3.601 -7.483 1.00 0.00 N ATOM 290 CA THR A 22 -19.422 -2.705 -8.573 1.00 0.00 C ATOM 291 C THR A 22 -18.822 -3.174 -9.900 1.00 0.00 C ATOM 292 O THR A 22 -19.185 -2.671 -10.964 1.00 0.00 O ATOM 293 CB THR A 22 -18.969 -1.251 -8.271 1.00 0.00 C ATOM 294 OG1 THR A 22 -19.510 -0.343 -9.243 1.00 0.00 O ATOM 295 CG2 THR A 22 -17.446 -1.135 -8.256 1.00 0.00 C ATOM 0 H THR A 22 -18.156 -3.383 -7.048 1.00 0.00 H new ATOM 0 HA THR A 22 -20.508 -2.723 -8.659 1.00 0.00 H new ATOM 0 HB THR A 22 -19.346 -0.989 -7.282 1.00 0.00 H new ATOM 0 HG1 THR A 22 -19.535 -0.779 -10.120 1.00 0.00 H new ATOM 0 HG21 THR A 22 -17.162 -0.105 -8.042 1.00 0.00 H new ATOM 0 HG22 THR A 22 -17.039 -1.791 -7.487 1.00 0.00 H new ATOM 0 HG23 THR A 22 -17.049 -1.426 -9.229 1.00 0.00 H new ATOM 303 N ARG A 23 -17.906 -4.141 -9.837 1.00 0.00 N ATOM 304 CA ARG A 23 -17.254 -4.656 -11.039 1.00 0.00 C ATOM 305 C ARG A 23 -17.001 -6.158 -10.931 1.00 0.00 C ATOM 306 O ARG A 23 -16.701 -6.677 -9.852 1.00 0.00 O ATOM 307 CB ARG A 23 -15.925 -3.925 -11.291 1.00 0.00 C ATOM 308 CG ARG A 23 -15.141 -4.484 -12.476 1.00 0.00 C ATOM 309 CD ARG A 23 -13.805 -3.782 -12.678 1.00 0.00 C ATOM 310 NE ARG A 23 -13.020 -4.425 -13.734 1.00 0.00 N ATOM 311 CZ ARG A 23 -11.891 -3.937 -14.243 1.00 0.00 C ATOM 312 NH1 ARG A 23 -11.420 -2.767 -13.836 1.00 0.00 N ATOM 313 NH2 ARG A 23 -11.239 -4.622 -15.170 1.00 0.00 N ATOM 0 H ARG A 23 -17.600 -4.581 -8.969 1.00 0.00 H new ATOM 0 HA ARG A 23 -17.926 -4.477 -11.878 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -16.127 -2.868 -11.465 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -15.308 -3.988 -10.394 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.968 -5.549 -12.322 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -15.739 -4.386 -13.382 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -13.976 -2.737 -12.935 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.241 -3.793 -11.745 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.363 -5.311 -14.106 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.923 -2.233 -13.127 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -10.554 -2.400 -14.231 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.602 -5.519 -15.491 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -10.373 -4.252 -15.563 1.00 0.00 H new ATOM 327 N SER A 24 -17.129 -6.841 -12.062 1.00 0.00 N ATOM 328 CA SER A 24 -16.828 -8.260 -12.164 1.00 0.00 C ATOM 329 C SER A 24 -15.336 -8.468 -12.446 1.00 0.00 C ATOM 330 O SER A 24 -14.742 -7.753 -13.258 1.00 0.00 O ATOM 331 CB SER A 24 -17.680 -8.880 -13.279 1.00 0.00 C ATOM 332 OG SER A 24 -17.558 -8.139 -14.485 1.00 0.00 O ATOM 0 H SER A 24 -17.446 -6.423 -12.937 1.00 0.00 H new ATOM 0 HA SER A 24 -17.065 -8.750 -11.220 1.00 0.00 H new ATOM 0 HB2 SER A 24 -17.369 -9.911 -13.448 1.00 0.00 H new ATOM 0 HB3 SER A 24 -18.725 -8.909 -12.970 1.00 0.00 H new ATOM 0 HG SER A 24 -18.109 -8.554 -15.181 1.00 0.00 H new ATOM 338 N ALA A 25 -14.737 -9.445 -11.766 1.00 0.00 N ATOM 339 CA ALA A 25 -13.317 -9.758 -11.936 1.00 0.00 C ATOM 340 C ALA A 25 -13.007 -10.228 -13.359 1.00 0.00 C ATOM 341 O ALA A 25 -11.874 -10.109 -13.824 1.00 0.00 O ATOM 342 CB ALA A 25 -12.895 -10.816 -10.926 1.00 0.00 C ATOM 0 H ALA A 25 -15.216 -10.037 -11.088 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.749 -8.844 -11.762 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.837 -11.044 -11.058 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.062 -10.442 -9.916 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.483 -11.721 -11.080 1.00 0.00 H new ATOM 348 N ALA A 26 -14.019 -10.790 -14.025 1.00 0.00 N ATOM 349 CA ALA A 26 -13.902 -11.250 -15.415 1.00 0.00 C ATOM 350 C ALA A 26 -12.920 -12.419 -15.560 1.00 0.00 C ATOM 351 O ALA A 26 -12.634 -12.856 -16.673 1.00 0.00 O ATOM 352 CB ALA A 26 -13.504 -10.096 -16.335 1.00 0.00 C ATOM 0 H ALA A 26 -14.942 -10.940 -13.618 1.00 0.00 H new ATOM 0 HA ALA A 26 -14.884 -11.616 -15.714 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.423 -10.459 -17.360 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -14.261 -9.314 -16.286 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.543 -9.691 -16.016 1.00 0.00 H new ATOM 358 N SER A 27 -12.429 -12.934 -14.433 1.00 0.00 N ATOM 359 CA SER A 27 -11.475 -14.044 -14.427 1.00 0.00 C ATOM 360 C SER A 27 -11.464 -14.730 -13.056 1.00 0.00 C ATOM 361 O SER A 27 -11.591 -14.060 -12.025 1.00 0.00 O ATOM 362 CB SER A 27 -10.065 -13.542 -14.780 1.00 0.00 C ATOM 363 OG SER A 27 -10.006 -13.058 -16.114 1.00 0.00 O ATOM 0 H SER A 27 -12.679 -12.596 -13.504 1.00 0.00 H new ATOM 0 HA SER A 27 -11.785 -14.770 -15.179 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.776 -12.749 -14.090 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.346 -14.352 -14.653 1.00 0.00 H new ATOM 0 HG SER A 27 -10.865 -13.218 -16.558 1.00 0.00 H new ATOM 369 N PRO A 28 -11.304 -16.072 -13.025 1.00 0.00 N ATOM 370 CA PRO A 28 -11.331 -16.856 -11.779 1.00 0.00 C ATOM 371 C PRO A 28 -10.272 -16.397 -10.770 1.00 0.00 C ATOM 372 O PRO A 28 -10.588 -16.131 -9.609 1.00 0.00 O ATOM 373 CB PRO A 28 -11.060 -18.302 -12.245 1.00 0.00 C ATOM 374 CG PRO A 28 -10.470 -18.168 -13.611 1.00 0.00 C ATOM 375 CD PRO A 28 -11.091 -16.935 -14.205 1.00 0.00 C ATOM 0 HA PRO A 28 -12.279 -16.743 -11.254 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.375 -18.812 -11.568 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.979 -18.887 -12.269 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.385 -18.074 -13.561 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.687 -19.047 -14.219 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.434 -16.464 -14.937 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.027 -17.160 -14.715 1.00 0.00 H new ATOM 383 N GLU A 29 -9.019 -16.290 -11.221 1.00 0.00 N ATOM 384 CA GLU A 29 -7.919 -15.877 -10.345 1.00 0.00 C ATOM 385 C GLU A 29 -8.174 -14.480 -9.782 1.00 0.00 C ATOM 386 O GLU A 29 -7.984 -14.231 -8.588 1.00 0.00 O ATOM 387 CB GLU A 29 -6.579 -15.894 -11.099 1.00 0.00 C ATOM 388 CG GLU A 29 -6.547 -14.989 -12.329 1.00 0.00 C ATOM 389 CD GLU A 29 -5.137 -14.717 -12.826 1.00 0.00 C ATOM 390 OE1 GLU A 29 -4.589 -15.560 -13.561 1.00 0.00 O ATOM 391 OE2 GLU A 29 -4.569 -13.658 -12.473 1.00 0.00 O ATOM 0 H GLU A 29 -8.742 -16.483 -12.183 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.866 -16.589 -9.521 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.786 -15.590 -10.416 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.360 -16.916 -11.407 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.126 -15.451 -13.129 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.032 -14.042 -12.090 1.00 0.00 H new ATOM 398 N ALA A 30 -8.631 -13.583 -10.654 1.00 0.00 N ATOM 399 CA ALA A 30 -8.883 -12.196 -10.287 1.00 0.00 C ATOM 400 C ALA A 30 -9.938 -12.111 -9.190 1.00 0.00 C ATOM 401 O ALA A 30 -9.871 -11.251 -8.310 1.00 0.00 O ATOM 402 CB ALA A 30 -9.312 -11.397 -11.513 1.00 0.00 C ATOM 0 H ALA A 30 -8.835 -13.799 -11.630 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.959 -11.766 -9.899 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.498 -10.362 -11.226 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.522 -11.430 -12.263 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.224 -11.828 -11.927 1.00 0.00 H new ATOM 408 N LEU A 31 -10.906 -13.016 -9.245 1.00 0.00 N ATOM 409 CA LEU A 31 -11.960 -13.077 -8.242 1.00 0.00 C ATOM 410 C LEU A 31 -11.405 -13.664 -6.946 1.00 0.00 C ATOM 411 O LEU A 31 -11.545 -13.075 -5.871 1.00 0.00 O ATOM 412 CB LEU A 31 -13.139 -13.921 -8.777 1.00 0.00 C ATOM 413 CG LEU A 31 -14.442 -13.908 -7.944 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.322 -14.755 -6.685 1.00 0.00 C ATOM 415 CD2 LEU A 31 -14.852 -12.476 -7.603 1.00 0.00 C ATOM 0 H LEU A 31 -10.983 -13.721 -9.978 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.327 -12.072 -8.031 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.376 -13.574 -9.783 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -12.804 -14.954 -8.867 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.225 -14.354 -8.557 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.260 -14.717 -6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.104 -15.787 -6.960 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.516 -14.368 -6.062 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -15.771 -12.490 -7.017 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -14.060 -11.999 -7.025 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -15.017 -11.916 -8.523 1.00 0.00 H new ATOM 427 N MET A 32 -10.747 -14.814 -7.063 1.00 0.00 N ATOM 428 CA MET A 32 -10.292 -15.561 -5.896 1.00 0.00 C ATOM 429 C MET A 32 -9.319 -14.752 -5.046 1.00 0.00 C ATOM 430 O MET A 32 -9.490 -14.648 -3.829 1.00 0.00 O ATOM 431 CB MET A 32 -9.638 -16.883 -6.309 1.00 0.00 C ATOM 432 CG MET A 32 -9.238 -17.742 -5.117 1.00 0.00 C ATOM 433 SD MET A 32 -10.616 -17.992 -3.979 1.00 0.00 S ATOM 434 CE MET A 32 -9.806 -18.839 -2.624 1.00 0.00 C ATOM 0 H MET A 32 -10.517 -15.249 -7.956 1.00 0.00 H new ATOM 0 HA MET A 32 -11.176 -15.772 -5.295 1.00 0.00 H new ATOM 0 HB2 MET A 32 -10.329 -17.443 -6.939 1.00 0.00 H new ATOM 0 HB3 MET A 32 -8.755 -16.673 -6.912 1.00 0.00 H new ATOM 0 HG2 MET A 32 -8.878 -18.708 -5.470 1.00 0.00 H new ATOM 0 HG3 MET A 32 -8.411 -17.268 -4.588 1.00 0.00 H new ATOM 0 HE1 MET A 32 -10.157 -18.429 -1.677 1.00 0.00 H new ATOM 0 HE2 MET A 32 -10.040 -19.903 -2.668 1.00 0.00 H new ATOM 0 HE3 MET A 32 -8.728 -18.701 -2.702 1.00 0.00 H new ATOM 444 N ARG A 33 -8.303 -14.173 -5.680 1.00 0.00 N ATOM 445 CA ARG A 33 -7.270 -13.462 -4.934 1.00 0.00 C ATOM 446 C ARG A 33 -7.857 -12.221 -4.258 1.00 0.00 C ATOM 447 O ARG A 33 -7.359 -11.774 -3.224 1.00 0.00 O ATOM 448 CB ARG A 33 -6.049 -13.131 -5.828 1.00 0.00 C ATOM 449 CG ARG A 33 -5.871 -11.664 -6.235 1.00 0.00 C ATOM 450 CD ARG A 33 -6.757 -11.250 -7.407 1.00 0.00 C ATOM 451 NE ARG A 33 -6.194 -10.094 -8.118 1.00 0.00 N ATOM 452 CZ ARG A 33 -6.906 -9.175 -8.775 1.00 0.00 C ATOM 453 NH1 ARG A 33 -8.232 -9.212 -8.768 1.00 0.00 N ATOM 454 NH2 ARG A 33 -6.282 -8.208 -9.433 1.00 0.00 N ATOM 0 H ARG A 33 -8.174 -14.181 -6.692 1.00 0.00 H new ATOM 0 HA ARG A 33 -6.900 -14.117 -4.145 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -5.148 -13.451 -5.305 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.120 -13.730 -6.736 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.093 -11.027 -5.379 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -4.828 -11.492 -6.499 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -6.866 -12.087 -8.097 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -7.755 -11.005 -7.043 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.180 -9.985 -8.109 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -8.719 -9.948 -8.257 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -8.765 -8.504 -9.274 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -5.263 -8.168 -9.436 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -6.821 -7.504 -9.936 1.00 0.00 H new ATOM 468 N SER A 34 -8.938 -11.691 -4.825 1.00 0.00 N ATOM 469 CA SER A 34 -9.650 -10.575 -4.216 1.00 0.00 C ATOM 470 C SER A 34 -10.422 -11.057 -2.987 1.00 0.00 C ATOM 471 O SER A 34 -10.465 -10.371 -1.962 1.00 0.00 O ATOM 472 CB SER A 34 -10.600 -9.933 -5.231 1.00 0.00 C ATOM 473 OG SER A 34 -9.887 -9.469 -6.366 1.00 0.00 O ATOM 0 H SER A 34 -9.338 -12.017 -5.705 1.00 0.00 H new ATOM 0 HA SER A 34 -8.927 -9.823 -3.901 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.353 -10.658 -5.540 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.130 -9.103 -4.765 1.00 0.00 H new ATOM 0 HG SER A 34 -10.202 -9.940 -7.165 1.00 0.00 H new ATOM 479 N ARG A 35 -11.008 -12.251 -3.095 1.00 0.00 N ATOM 480 CA ARG A 35 -11.734 -12.856 -1.981 1.00 0.00 C ATOM 481 C ARG A 35 -10.798 -13.099 -0.795 1.00 0.00 C ATOM 482 O ARG A 35 -11.153 -12.819 0.351 1.00 0.00 O ATOM 483 CB ARG A 35 -12.407 -14.175 -2.404 1.00 0.00 C ATOM 484 CG ARG A 35 -13.636 -14.011 -3.292 1.00 0.00 C ATOM 485 CD ARG A 35 -14.511 -15.264 -3.262 1.00 0.00 C ATOM 486 NE ARG A 35 -13.719 -16.494 -3.401 1.00 0.00 N ATOM 487 CZ ARG A 35 -13.857 -17.567 -2.614 1.00 0.00 C ATOM 488 NH1 ARG A 35 -14.798 -17.592 -1.678 1.00 0.00 N ATOM 489 NH2 ARG A 35 -13.060 -18.616 -2.772 1.00 0.00 N ATOM 0 H ARG A 35 -10.993 -12.817 -3.944 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.514 -12.158 -1.677 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -11.675 -14.787 -2.931 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -12.695 -14.723 -1.507 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -14.217 -13.151 -2.959 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -13.323 -13.807 -4.316 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -15.067 -15.295 -2.325 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -15.245 -15.213 -4.066 1.00 0.00 H new ATOM 0 HE ARG A 35 -13.021 -16.532 -4.144 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -15.419 -16.792 -1.557 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -14.901 -18.412 -1.080 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -12.340 -18.605 -3.495 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -13.167 -19.433 -2.171 1.00 0.00 H new ATOM 503 N TYR A 36 -9.599 -13.607 -1.078 1.00 0.00 N ATOM 504 CA TYR A 36 -8.602 -13.858 -0.034 1.00 0.00 C ATOM 505 C TYR A 36 -8.385 -12.611 0.821 1.00 0.00 C ATOM 506 O TYR A 36 -8.283 -12.693 2.047 1.00 0.00 O ATOM 507 CB TYR A 36 -7.268 -14.302 -0.653 1.00 0.00 C ATOM 508 CG TYR A 36 -6.124 -14.375 0.350 1.00 0.00 C ATOM 509 CD1 TYR A 36 -5.901 -15.522 1.107 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.273 -13.288 0.544 1.00 0.00 C ATOM 511 CE1 TYR A 36 -4.868 -15.580 2.026 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.240 -13.342 1.459 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.042 -14.489 2.198 1.00 0.00 C ATOM 514 OH TYR A 36 -3.014 -14.543 3.111 1.00 0.00 O ATOM 0 H TYR A 36 -9.293 -13.853 -2.020 1.00 0.00 H new ATOM 0 HA TYR A 36 -8.980 -14.658 0.602 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -7.399 -15.281 -1.114 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -6.998 -13.608 -1.449 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.544 -16.380 0.975 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.424 -12.387 -0.032 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -4.709 -16.477 2.607 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.590 -12.490 1.595 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.528 -13.692 3.107 1.00 0.00 H new ATOM 524 N ALA A 37 -8.321 -11.458 0.162 1.00 0.00 N ATOM 525 CA ALA A 37 -8.098 -10.194 0.850 1.00 0.00 C ATOM 526 C ALA A 37 -9.211 -9.927 1.857 1.00 0.00 C ATOM 527 O ALA A 37 -8.955 -9.458 2.963 1.00 0.00 O ATOM 528 CB ALA A 37 -7.997 -9.054 -0.153 1.00 0.00 C ATOM 0 H ALA A 37 -8.421 -11.375 -0.850 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.155 -10.259 1.394 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.830 -8.116 0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.165 -9.240 -0.832 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.923 -8.988 -0.724 1.00 0.00 H new ATOM 534 N ALA A 38 -10.444 -10.253 1.473 1.00 0.00 N ATOM 535 CA ALA A 38 -11.603 -10.042 2.334 1.00 0.00 C ATOM 536 C ALA A 38 -11.500 -10.894 3.600 1.00 0.00 C ATOM 537 O ALA A 38 -11.868 -10.447 4.685 1.00 0.00 O ATOM 538 CB ALA A 38 -12.890 -10.339 1.576 1.00 0.00 C ATOM 0 H ALA A 38 -10.665 -10.666 0.567 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.622 -8.995 2.638 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -13.745 -10.177 2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.965 -9.678 0.713 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.883 -11.376 1.239 1.00 0.00 H new ATOM 544 N TYR A 39 -10.978 -12.116 3.459 1.00 0.00 N ATOM 545 CA TYR A 39 -10.728 -12.979 4.617 1.00 0.00 C ATOM 546 C TYR A 39 -9.760 -12.296 5.583 1.00 0.00 C ATOM 547 O TYR A 39 -10.008 -12.228 6.787 1.00 0.00 O ATOM 548 CB TYR A 39 -10.165 -14.346 4.186 1.00 0.00 C ATOM 549 CG TYR A 39 -11.232 -15.379 3.870 1.00 0.00 C ATOM 550 CD1 TYR A 39 -11.942 -15.331 2.680 1.00 0.00 C ATOM 551 CD2 TYR A 39 -11.531 -16.401 4.769 1.00 0.00 C ATOM 552 CE1 TYR A 39 -12.917 -16.266 2.394 1.00 0.00 C ATOM 553 CE2 TYR A 39 -12.506 -17.342 4.485 1.00 0.00 C ATOM 554 CZ TYR A 39 -13.198 -17.267 3.296 1.00 0.00 C ATOM 555 OH TYR A 39 -14.168 -18.203 2.999 1.00 0.00 O ATOM 0 H TYR A 39 -10.722 -12.528 2.562 1.00 0.00 H new ATOM 0 HA TYR A 39 -11.680 -13.149 5.120 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.535 -14.208 3.307 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.524 -14.731 4.980 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -11.729 -14.550 1.965 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -10.993 -16.460 5.703 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.460 -16.212 1.462 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -12.723 -18.130 5.191 1.00 0.00 H new ATOM 0 HH TYR A 39 -14.932 -18.085 3.602 1.00 0.00 H new ATOM 565 N ALA A 40 -8.664 -11.773 5.035 1.00 0.00 N ATOM 566 CA ALA A 40 -7.650 -11.080 5.832 1.00 0.00 C ATOM 567 C ALA A 40 -8.202 -9.770 6.399 1.00 0.00 C ATOM 568 O ALA A 40 -7.738 -9.278 7.432 1.00 0.00 O ATOM 569 CB ALA A 40 -6.407 -10.814 4.989 1.00 0.00 C ATOM 0 H ALA A 40 -8.454 -11.816 4.038 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.375 -11.722 6.669 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.661 -10.298 5.594 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.997 -11.760 4.636 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.673 -10.193 4.134 1.00 0.00 H new ATOM 575 N LEU A 41 -9.193 -9.212 5.710 1.00 0.00 N ATOM 576 CA LEU A 41 -9.854 -7.980 6.139 1.00 0.00 C ATOM 577 C LEU A 41 -11.144 -8.302 6.895 1.00 0.00 C ATOM 578 O LEU A 41 -12.027 -7.451 7.018 1.00 0.00 O ATOM 579 CB LEU A 41 -10.155 -7.090 4.921 1.00 0.00 C ATOM 580 CG LEU A 41 -8.921 -6.635 4.120 1.00 0.00 C ATOM 581 CD1 LEU A 41 -9.338 -5.823 2.897 1.00 0.00 C ATOM 582 CD2 LEU A 41 -7.964 -5.835 5.002 1.00 0.00 C ATOM 0 H LEU A 41 -9.561 -9.598 4.841 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.186 -7.441 6.811 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -10.823 -7.632 4.252 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.693 -6.206 5.262 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.396 -7.525 3.773 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.450 -5.512 2.347 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.969 -6.434 2.252 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.893 -4.941 3.218 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.100 -5.525 4.414 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.476 -4.953 5.388 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.632 -6.455 5.835 1.00 0.00 H new ATOM 594 N LYS A 42 -11.235 -9.550 7.377 1.00 0.00 N ATOM 595 CA LYS A 42 -12.357 -10.059 8.192 1.00 0.00 C ATOM 596 C LYS A 42 -13.737 -9.798 7.571 1.00 0.00 C ATOM 597 O LYS A 42 -14.765 -9.993 8.226 1.00 0.00 O ATOM 598 CB LYS A 42 -12.284 -9.553 9.661 1.00 0.00 C ATOM 599 CG LYS A 42 -12.285 -8.032 9.880 1.00 0.00 C ATOM 600 CD LYS A 42 -13.659 -7.388 9.672 1.00 0.00 C ATOM 601 CE LYS A 42 -14.708 -7.941 10.633 1.00 0.00 C ATOM 602 NZ LYS A 42 -14.308 -7.772 12.054 1.00 0.00 N ATOM 0 H LYS A 42 -10.515 -10.253 7.209 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.238 -11.142 8.207 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -13.129 -9.973 10.206 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -11.379 -9.959 10.114 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -11.941 -7.818 10.892 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -11.570 -7.574 9.197 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -13.577 -6.310 9.808 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -13.985 -7.556 8.646 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -15.658 -7.435 10.462 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -14.868 -8.999 10.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -15.113 -8.003 12.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -13.514 -8.408 12.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -14.017 -6.787 12.218 1.00 0.00 H new ATOM 616 N ASP A 43 -13.768 -9.407 6.302 1.00 0.00 N ATOM 617 CA ASP A 43 -15.029 -9.144 5.617 1.00 0.00 C ATOM 618 C ASP A 43 -15.466 -10.388 4.853 1.00 0.00 C ATOM 619 O ASP A 43 -15.352 -10.461 3.628 1.00 0.00 O ATOM 620 CB ASP A 43 -14.905 -7.941 4.666 1.00 0.00 C ATOM 621 CG ASP A 43 -16.260 -7.437 4.176 1.00 0.00 C ATOM 622 OD1 ASP A 43 -16.830 -8.030 3.241 1.00 0.00 O ATOM 623 OD2 ASP A 43 -16.764 -6.437 4.733 1.00 0.00 O ATOM 0 H ASP A 43 -12.937 -9.265 5.728 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.784 -8.898 6.363 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -14.384 -7.131 5.177 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.294 -8.222 3.808 1.00 0.00 H new ATOM 628 N PHE A 44 -15.924 -11.394 5.591 1.00 0.00 N ATOM 629 CA PHE A 44 -16.426 -12.618 4.975 1.00 0.00 C ATOM 630 C PHE A 44 -17.773 -12.357 4.305 1.00 0.00 C ATOM 631 O PHE A 44 -18.286 -13.195 3.560 1.00 0.00 O ATOM 632 CB PHE A 44 -16.517 -13.762 5.998 1.00 0.00 C ATOM 633 CG PHE A 44 -17.352 -13.465 7.222 1.00 0.00 C ATOM 634 CD1 PHE A 44 -18.725 -13.674 7.214 1.00 0.00 C ATOM 635 CD2 PHE A 44 -16.758 -12.993 8.385 1.00 0.00 C ATOM 636 CE1 PHE A 44 -19.485 -13.418 8.339 1.00 0.00 C ATOM 637 CE2 PHE A 44 -17.516 -12.733 9.511 1.00 0.00 C ATOM 638 CZ PHE A 44 -18.880 -12.947 9.488 1.00 0.00 C ATOM 0 H PHE A 44 -15.958 -11.387 6.610 1.00 0.00 H new ATOM 0 HA PHE A 44 -15.719 -12.932 4.207 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -16.929 -14.640 5.501 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -15.508 -14.021 6.320 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -19.204 -14.041 6.318 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -15.691 -12.827 8.410 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -20.552 -13.586 8.320 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -17.042 -12.363 10.408 1.00 0.00 H new ATOM 0 HZ PHE A 44 -19.473 -12.746 10.368 1.00 0.00 H new ATOM 648 N ASP A 45 -18.333 -11.181 4.585 1.00 0.00 N ATOM 649 CA ASP A 45 -19.565 -10.719 3.951 1.00 0.00 C ATOM 650 C ASP A 45 -19.423 -10.748 2.430 1.00 0.00 C ATOM 651 O ASP A 45 -20.227 -11.368 1.728 1.00 0.00 O ATOM 652 CB ASP A 45 -19.882 -9.292 4.423 1.00 0.00 C ATOM 653 CG ASP A 45 -21.186 -8.747 3.860 1.00 0.00 C ATOM 654 OD1 ASP A 45 -21.164 -8.120 2.779 1.00 0.00 O ATOM 655 OD2 ASP A 45 -22.236 -8.924 4.512 1.00 0.00 O ATOM 0 H ASP A 45 -17.944 -10.522 5.259 1.00 0.00 H new ATOM 0 HA ASP A 45 -20.381 -11.383 4.235 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -19.931 -9.280 5.512 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -19.065 -8.631 4.133 1.00 0.00 H new ATOM 660 N TYR A 46 -18.375 -10.091 1.936 1.00 0.00 N ATOM 661 CA TYR A 46 -18.079 -10.050 0.506 1.00 0.00 C ATOM 662 C TYR A 46 -17.938 -11.458 -0.062 1.00 0.00 C ATOM 663 O TYR A 46 -18.379 -11.735 -1.180 1.00 0.00 O ATOM 664 CB TYR A 46 -16.795 -9.243 0.249 1.00 0.00 C ATOM 665 CG TYR A 46 -16.183 -9.473 -1.122 1.00 0.00 C ATOM 666 CD1 TYR A 46 -16.775 -8.959 -2.268 1.00 0.00 C ATOM 667 CD2 TYR A 46 -15.011 -10.211 -1.264 1.00 0.00 C ATOM 668 CE1 TYR A 46 -16.219 -9.177 -3.512 1.00 0.00 C ATOM 669 CE2 TYR A 46 -14.450 -10.428 -2.505 1.00 0.00 C ATOM 670 CZ TYR A 46 -15.058 -9.911 -3.625 1.00 0.00 C ATOM 671 OH TYR A 46 -14.506 -10.132 -4.866 1.00 0.00 O ATOM 0 H TYR A 46 -17.711 -9.575 2.513 1.00 0.00 H new ATOM 0 HA TYR A 46 -18.911 -9.560 0.001 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -17.016 -8.182 0.363 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -16.059 -9.499 1.011 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -17.683 -8.381 -2.185 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.533 -10.621 -0.387 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -16.692 -8.773 -4.395 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -13.539 -11.000 -2.597 1.00 0.00 H new ATOM 0 HH TYR A 46 -13.690 -10.666 -4.771 1.00 0.00 H new ATOM 681 N ILE A 47 -17.322 -12.340 0.716 1.00 0.00 N ATOM 682 CA ILE A 47 -17.089 -13.717 0.293 1.00 0.00 C ATOM 683 C ILE A 47 -18.403 -14.397 -0.048 1.00 0.00 C ATOM 684 O ILE A 47 -18.564 -14.962 -1.130 1.00 0.00 O ATOM 685 CB ILE A 47 -16.372 -14.525 1.397 1.00 0.00 C ATOM 686 CG1 ILE A 47 -15.073 -13.816 1.797 1.00 0.00 C ATOM 687 CG2 ILE A 47 -16.100 -15.960 0.935 1.00 0.00 C ATOM 688 CD1 ILE A 47 -14.135 -13.578 0.637 1.00 0.00 C ATOM 0 H ILE A 47 -16.972 -12.125 1.650 1.00 0.00 H new ATOM 0 HA ILE A 47 -16.453 -13.686 -0.592 1.00 0.00 H new ATOM 0 HB ILE A 47 -17.021 -14.582 2.271 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.318 -12.859 2.258 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.561 -14.412 2.552 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.594 -16.508 1.730 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -17.044 -16.451 0.699 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.468 -15.943 0.047 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.237 -13.073 0.993 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -13.861 -14.533 0.189 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.630 -12.956 -0.109 1.00 0.00 H new ATOM 700 N VAL A 48 -19.336 -14.322 0.887 1.00 0.00 N ATOM 701 CA VAL A 48 -20.669 -14.882 0.699 1.00 0.00 C ATOM 702 C VAL A 48 -21.336 -14.272 -0.538 1.00 0.00 C ATOM 703 O VAL A 48 -22.016 -14.966 -1.299 1.00 0.00 O ATOM 704 CB VAL A 48 -21.559 -14.641 1.946 1.00 0.00 C ATOM 705 CG1 VAL A 48 -22.919 -15.311 1.782 1.00 0.00 C ATOM 706 CG2 VAL A 48 -20.860 -15.135 3.212 1.00 0.00 C ATOM 0 H VAL A 48 -19.195 -13.875 1.793 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.560 -15.957 0.555 1.00 0.00 H new ATOM 0 HB VAL A 48 -21.722 -13.568 2.043 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.524 -15.127 2.670 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -23.424 -14.901 0.907 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -22.782 -16.385 1.652 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.501 -14.956 4.075 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -20.659 -16.203 3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.920 -14.599 3.341 1.00 0.00 H new ATOM 716 N GLU A 49 -21.114 -12.974 -0.741 1.00 0.00 N ATOM 717 CA GLU A 49 -21.674 -12.259 -1.890 1.00 0.00 C ATOM 718 C GLU A 49 -21.038 -12.719 -3.203 1.00 0.00 C ATOM 719 O GLU A 49 -21.656 -12.628 -4.263 1.00 0.00 O ATOM 720 CB GLU A 49 -21.488 -10.745 -1.723 1.00 0.00 C ATOM 721 CG GLU A 49 -22.253 -10.156 -0.545 1.00 0.00 C ATOM 722 CD GLU A 49 -23.749 -10.420 -0.632 1.00 0.00 C ATOM 723 OE1 GLU A 49 -24.389 -9.923 -1.585 1.00 0.00 O ATOM 724 OE2 GLU A 49 -24.290 -11.128 0.245 1.00 0.00 O ATOM 0 H GLU A 49 -20.548 -12.393 -0.123 1.00 0.00 H new ATOM 0 HA GLU A 49 -22.739 -12.488 -1.931 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.427 -10.531 -1.598 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -21.808 -10.246 -2.638 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.866 -10.578 0.383 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.079 -9.081 -0.504 1.00 0.00 H new ATOM 731 N THR A 50 -19.800 -13.206 -3.134 1.00 0.00 N ATOM 732 CA THR A 50 -19.103 -13.700 -4.321 1.00 0.00 C ATOM 733 C THR A 50 -19.108 -15.223 -4.373 1.00 0.00 C ATOM 734 O THR A 50 -18.279 -15.838 -5.048 1.00 0.00 O ATOM 735 CB THR A 50 -17.653 -13.173 -4.402 1.00 0.00 C ATOM 736 OG1 THR A 50 -17.043 -13.182 -3.103 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.622 -11.766 -4.983 1.00 0.00 C ATOM 0 H THR A 50 -19.260 -13.269 -2.271 1.00 0.00 H new ATOM 0 HA THR A 50 -19.649 -13.319 -5.184 1.00 0.00 H new ATOM 0 HB THR A 50 -17.089 -13.833 -5.061 1.00 0.00 H new ATOM 0 HG1 THR A 50 -17.496 -12.534 -2.524 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.591 -11.415 -5.031 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.049 -11.777 -5.986 1.00 0.00 H new ATOM 0 HG23 THR A 50 -18.204 -11.097 -4.349 1.00 0.00 H new ATOM 745 N THR A 51 -20.059 -15.827 -3.677 1.00 0.00 N ATOM 746 CA THR A 51 -20.271 -17.261 -3.765 1.00 0.00 C ATOM 747 C THR A 51 -21.436 -17.550 -4.705 1.00 0.00 C ATOM 748 O THR A 51 -22.310 -16.703 -4.899 1.00 0.00 O ATOM 749 CB THR A 51 -20.559 -17.882 -2.380 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.496 -17.555 -1.476 1.00 0.00 O ATOM 751 CG2 THR A 51 -20.698 -19.401 -2.477 1.00 0.00 C ATOM 0 H THR A 51 -20.697 -15.344 -3.044 1.00 0.00 H new ATOM 0 HA THR A 51 -19.357 -17.711 -4.152 1.00 0.00 H new ATOM 0 HB THR A 51 -21.499 -17.473 -2.010 1.00 0.00 H new ATOM 0 HG1 THR A 51 -19.399 -18.270 -0.813 1.00 0.00 H new ATOM 0 HG21 THR A 51 -20.900 -19.812 -1.488 1.00 0.00 H new ATOM 0 HG22 THR A 51 -21.520 -19.649 -3.148 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.773 -19.827 -2.864 1.00 0.00 H new ATOM 759 N ASP A 52 -21.417 -18.736 -5.301 1.00 0.00 N ATOM 760 CA ASP A 52 -22.498 -19.204 -6.162 1.00 0.00 C ATOM 761 C ASP A 52 -23.850 -19.017 -5.476 1.00 0.00 C ATOM 762 O ASP A 52 -23.978 -19.297 -4.288 1.00 0.00 O ATOM 763 CB ASP A 52 -22.285 -20.685 -6.469 1.00 0.00 C ATOM 764 CG ASP A 52 -23.338 -21.258 -7.395 1.00 0.00 C ATOM 765 OD1 ASP A 52 -23.228 -21.072 -8.618 1.00 0.00 O ATOM 766 OD2 ASP A 52 -24.284 -21.894 -6.895 1.00 0.00 O ATOM 0 H ASP A 52 -20.651 -19.402 -5.201 1.00 0.00 H new ATOM 0 HA ASP A 52 -22.493 -18.624 -7.085 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -21.302 -20.819 -6.920 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -22.286 -21.247 -5.535 1.00 0.00 H new ATOM 771 N PRO A 53 -24.876 -18.556 -6.213 1.00 0.00 N ATOM 772 CA PRO A 53 -26.212 -18.295 -5.652 1.00 0.00 C ATOM 773 C PRO A 53 -26.806 -19.519 -4.948 1.00 0.00 C ATOM 774 O PRO A 53 -27.622 -19.387 -4.031 1.00 0.00 O ATOM 775 CB PRO A 53 -27.056 -17.908 -6.884 1.00 0.00 C ATOM 776 CG PRO A 53 -26.263 -18.379 -8.059 1.00 0.00 C ATOM 777 CD PRO A 53 -24.825 -18.252 -7.651 1.00 0.00 C ATOM 0 HA PRO A 53 -26.183 -17.522 -4.884 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -28.037 -18.382 -6.855 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -27.223 -16.832 -6.926 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -26.510 -19.411 -8.310 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -26.475 -17.776 -8.942 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -24.186 -18.951 -8.191 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -24.436 -17.252 -7.841 1.00 0.00 H new ATOM 785 N GLU A 54 -26.393 -20.708 -5.379 1.00 0.00 N ATOM 786 CA GLU A 54 -26.891 -21.955 -4.807 1.00 0.00 C ATOM 787 C GLU A 54 -25.963 -22.440 -3.692 1.00 0.00 C ATOM 788 O GLU A 54 -26.417 -22.787 -2.601 1.00 0.00 O ATOM 789 CB GLU A 54 -27.013 -23.022 -5.902 1.00 0.00 C ATOM 790 CG GLU A 54 -27.829 -22.566 -7.108 1.00 0.00 C ATOM 791 CD GLU A 54 -27.821 -23.581 -8.238 1.00 0.00 C ATOM 792 OE1 GLU A 54 -28.643 -24.521 -8.206 1.00 0.00 O ATOM 793 OE2 GLU A 54 -26.989 -23.451 -9.165 1.00 0.00 O ATOM 0 H GLU A 54 -25.711 -20.834 -6.127 1.00 0.00 H new ATOM 0 HA GLU A 54 -27.877 -21.775 -4.379 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -26.015 -23.305 -6.235 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -27.473 -23.915 -5.479 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -28.857 -22.382 -6.797 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -27.432 -21.619 -7.473 1.00 0.00 H new ATOM 800 N ARG A 55 -24.656 -22.440 -3.965 1.00 0.00 N ATOM 801 CA ARG A 55 -23.661 -22.889 -2.983 1.00 0.00 C ATOM 802 C ARG A 55 -23.657 -21.960 -1.769 1.00 0.00 C ATOM 803 O ARG A 55 -23.317 -22.366 -0.659 1.00 0.00 O ATOM 804 CB ARG A 55 -22.254 -22.947 -3.603 1.00 0.00 C ATOM 805 CG ARG A 55 -22.172 -23.766 -4.890 1.00 0.00 C ATOM 806 CD ARG A 55 -22.593 -25.217 -4.684 1.00 0.00 C ATOM 807 NE ARG A 55 -22.783 -25.918 -5.960 1.00 0.00 N ATOM 808 CZ ARG A 55 -22.097 -27.001 -6.341 1.00 0.00 C ATOM 809 NH1 ARG A 55 -21.116 -27.482 -5.585 1.00 0.00 N ATOM 810 NH2 ARG A 55 -22.387 -27.599 -7.489 1.00 0.00 N ATOM 0 H ARG A 55 -24.261 -22.135 -4.855 1.00 0.00 H new ATOM 0 HA ARG A 55 -23.936 -23.894 -2.664 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.918 -21.931 -3.810 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.564 -23.369 -2.872 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.808 -23.310 -5.649 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -21.151 -23.737 -5.271 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -21.836 -25.735 -4.095 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.520 -25.248 -4.111 1.00 0.00 H new ATOM 0 HE ARG A 55 -23.488 -25.553 -6.601 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -20.880 -27.025 -4.704 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -20.599 -28.309 -5.885 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -23.133 -27.233 -8.081 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -21.864 -28.425 -7.780 1.00 0.00 H new ATOM 824 N ARG A 56 -24.054 -20.711 -1.997 1.00 0.00 N ATOM 825 CA ARG A 56 -24.140 -19.708 -0.938 1.00 0.00 C ATOM 826 C ARG A 56 -25.132 -20.151 0.132 1.00 0.00 C ATOM 827 O ARG A 56 -24.955 -19.869 1.316 1.00 0.00 O ATOM 828 CB ARG A 56 -24.574 -18.359 -1.524 1.00 0.00 C ATOM 829 CG ARG A 56 -24.631 -17.226 -0.507 1.00 0.00 C ATOM 830 CD ARG A 56 -25.228 -15.963 -1.111 1.00 0.00 C ATOM 831 NE ARG A 56 -26.606 -16.184 -1.556 1.00 0.00 N ATOM 832 CZ ARG A 56 -27.191 -15.529 -2.556 1.00 0.00 C ATOM 833 NH1 ARG A 56 -26.535 -14.587 -3.222 1.00 0.00 N ATOM 834 NH2 ARG A 56 -28.443 -15.816 -2.885 1.00 0.00 N ATOM 0 H ARG A 56 -24.325 -20.366 -2.918 1.00 0.00 H new ATOM 0 HA ARG A 56 -23.156 -19.599 -0.482 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -23.884 -18.083 -2.321 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.558 -18.473 -1.980 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -25.226 -17.536 0.352 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -23.627 -17.015 -0.139 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -25.206 -15.160 -0.374 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -24.619 -15.638 -1.955 1.00 0.00 H new ATOM 0 HE ARG A 56 -27.156 -16.889 -1.065 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -25.573 -14.359 -2.969 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -26.992 -14.091 -3.987 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -28.953 -16.536 -2.373 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -28.896 -15.317 -3.651 1.00 0.00 H new ATOM 848 N ASP A 57 -26.168 -20.861 -0.299 1.00 0.00 N ATOM 849 CA ASP A 57 -27.188 -21.379 0.610 1.00 0.00 C ATOM 850 C ASP A 57 -26.585 -22.445 1.523 1.00 0.00 C ATOM 851 O ASP A 57 -27.086 -22.709 2.616 1.00 0.00 O ATOM 852 CB ASP A 57 -28.355 -21.961 -0.199 1.00 0.00 C ATOM 853 CG ASP A 57 -29.496 -22.459 0.674 1.00 0.00 C ATOM 854 OD1 ASP A 57 -30.305 -21.625 1.138 1.00 0.00 O ATOM 855 OD2 ASP A 57 -29.602 -23.685 0.885 1.00 0.00 O ATOM 0 H ASP A 57 -26.326 -21.093 -1.280 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.562 -20.565 1.231 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -28.733 -21.199 -0.880 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -27.989 -22.784 -0.813 1.00 0.00 H new ATOM 860 N LEU A 58 -25.490 -23.044 1.061 1.00 0.00 N ATOM 861 CA LEU A 58 -24.774 -24.065 1.823 1.00 0.00 C ATOM 862 C LEU A 58 -23.712 -23.416 2.714 1.00 0.00 C ATOM 863 O LEU A 58 -23.128 -24.067 3.584 1.00 0.00 O ATOM 864 CB LEU A 58 -24.118 -25.069 0.862 1.00 0.00 C ATOM 865 CG LEU A 58 -25.052 -25.650 -0.216 1.00 0.00 C ATOM 866 CD1 LEU A 58 -24.294 -26.608 -1.133 1.00 0.00 C ATOM 867 CD2 LEU A 58 -26.257 -26.343 0.421 1.00 0.00 C ATOM 0 H LEU A 58 -25.075 -22.837 0.152 1.00 0.00 H new ATOM 0 HA LEU A 58 -25.484 -24.594 2.459 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.279 -24.580 0.368 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -23.707 -25.892 1.447 1.00 0.00 H new ATOM 0 HG LEU A 58 -25.422 -24.823 -0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -24.974 -27.006 -1.886 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.481 -26.074 -1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -23.885 -27.429 -0.544 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -26.901 -26.745 -0.361 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -25.913 -27.156 1.061 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -26.817 -25.623 1.018 1.00 0.00 H new ATOM 879 N PHE A 59 -23.464 -22.129 2.479 1.00 0.00 N ATOM 880 CA PHE A 59 -22.488 -21.361 3.251 1.00 0.00 C ATOM 881 C PHE A 59 -23.057 -20.948 4.604 1.00 0.00 C ATOM 882 O PHE A 59 -24.260 -20.702 4.737 1.00 0.00 O ATOM 883 CB PHE A 59 -22.047 -20.108 2.471 1.00 0.00 C ATOM 884 CG PHE A 59 -20.791 -20.290 1.655 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.580 -21.440 0.907 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.818 -19.300 1.641 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.424 -21.597 0.164 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.664 -19.451 0.901 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.465 -20.601 0.162 1.00 0.00 C ATOM 0 H PHE A 59 -23.932 -21.590 1.750 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.623 -22.002 3.420 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.856 -19.805 1.807 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -21.892 -19.292 3.177 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.326 -22.221 0.905 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.967 -18.399 2.218 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -19.271 -22.496 -0.414 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.917 -18.671 0.899 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.561 -20.722 -0.417 1.00 0.00 H new ATOM 899 N ASP A 60 -22.180 -20.880 5.601 1.00 0.00 N ATOM 900 CA ASP A 60 -22.539 -20.394 6.930 1.00 0.00 C ATOM 901 C ASP A 60 -21.580 -19.283 7.337 1.00 0.00 C ATOM 902 O ASP A 60 -20.396 -19.316 6.982 1.00 0.00 O ATOM 903 CB ASP A 60 -22.474 -21.519 7.977 1.00 0.00 C ATOM 904 CG ASP A 60 -23.343 -22.718 7.628 1.00 0.00 C ATOM 905 OD1 ASP A 60 -24.581 -22.630 7.773 1.00 0.00 O ATOM 906 OD2 ASP A 60 -22.788 -23.762 7.222 1.00 0.00 O ATOM 0 H ASP A 60 -21.203 -21.159 5.511 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.562 -20.021 6.888 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -21.440 -21.847 8.083 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.784 -21.124 8.944 1.00 0.00 H new ATOM 911 N HIS A 61 -22.083 -18.311 8.087 1.00 0.00 N ATOM 912 CA HIS A 61 -21.252 -17.222 8.597 1.00 0.00 C ATOM 913 C HIS A 61 -20.224 -17.784 9.572 1.00 0.00 C ATOM 914 O HIS A 61 -19.087 -17.317 9.635 1.00 0.00 O ATOM 915 CB HIS A 61 -22.114 -16.158 9.298 1.00 0.00 C ATOM 916 CG HIS A 61 -23.112 -15.491 8.398 1.00 0.00 C ATOM 917 ND1 HIS A 61 -23.110 -14.137 8.142 1.00 0.00 N ATOM 918 CD2 HIS A 61 -24.157 -15.998 7.702 1.00 0.00 C ATOM 919 CE1 HIS A 61 -24.104 -13.843 7.328 1.00 0.00 C ATOM 920 NE2 HIS A 61 -24.754 -14.953 7.045 1.00 0.00 N ATOM 0 H HIS A 61 -23.065 -18.252 8.358 1.00 0.00 H new ATOM 0 HA HIS A 61 -20.742 -16.748 7.759 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -22.644 -16.624 10.129 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -21.459 -15.398 9.724 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -24.463 -17.033 7.670 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -24.345 -12.858 6.956 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -25.569 -15.024 6.436 1.00 0.00 H new ATOM 929 N ASP A 62 -20.644 -18.811 10.307 1.00 0.00 N ATOM 930 CA ASP A 62 -19.803 -19.471 11.304 1.00 0.00 C ATOM 931 C ASP A 62 -18.502 -19.973 10.684 1.00 0.00 C ATOM 932 O ASP A 62 -17.416 -19.688 11.188 1.00 0.00 O ATOM 933 CB ASP A 62 -20.558 -20.647 11.941 1.00 0.00 C ATOM 934 CG ASP A 62 -21.836 -20.212 12.639 1.00 0.00 C ATOM 935 OD1 ASP A 62 -22.867 -20.048 11.954 1.00 0.00 O ATOM 936 OD2 ASP A 62 -21.812 -20.014 13.874 1.00 0.00 O ATOM 0 H ASP A 62 -21.579 -19.210 10.228 1.00 0.00 H new ATOM 0 HA ASP A 62 -19.558 -18.737 12.072 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -20.800 -21.379 11.170 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -19.907 -21.145 12.660 1.00 0.00 H new ATOM 941 N VAL A 63 -18.621 -20.714 9.583 1.00 0.00 N ATOM 942 CA VAL A 63 -17.458 -21.288 8.907 1.00 0.00 C ATOM 943 C VAL A 63 -16.520 -20.187 8.415 1.00 0.00 C ATOM 944 O VAL A 63 -15.325 -20.194 8.720 1.00 0.00 O ATOM 945 CB VAL A 63 -17.876 -22.175 7.706 1.00 0.00 C ATOM 946 CG1 VAL A 63 -16.651 -22.790 7.026 1.00 0.00 C ATOM 947 CG2 VAL A 63 -18.852 -23.262 8.152 1.00 0.00 C ATOM 0 H VAL A 63 -19.513 -20.931 9.139 1.00 0.00 H new ATOM 0 HA VAL A 63 -16.940 -21.910 9.637 1.00 0.00 H new ATOM 0 HB VAL A 63 -18.381 -21.541 6.977 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -16.972 -23.407 6.187 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -15.999 -21.995 6.663 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -16.108 -23.406 7.743 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -19.133 -23.873 7.294 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -18.377 -23.890 8.905 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -19.744 -22.799 8.575 1.00 0.00 H new ATOM 957 N ASN A 64 -17.079 -19.234 7.673 1.00 0.00 N ATOM 958 CA ASN A 64 -16.298 -18.134 7.104 1.00 0.00 C ATOM 959 C ASN A 64 -15.585 -17.341 8.197 1.00 0.00 C ATOM 960 O ASN A 64 -14.450 -16.897 8.014 1.00 0.00 O ATOM 961 CB ASN A 64 -17.199 -17.212 6.271 1.00 0.00 C ATOM 962 CG ASN A 64 -17.579 -17.821 4.932 1.00 0.00 C ATOM 963 OD1 ASN A 64 -16.798 -18.557 4.329 1.00 0.00 O ATOM 964 ND2 ASN A 64 -18.780 -17.523 4.459 1.00 0.00 N ATOM 0 H ASN A 64 -18.074 -19.200 7.450 1.00 0.00 H new ATOM 0 HA ASN A 64 -15.538 -18.563 6.451 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -18.105 -16.989 6.835 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -16.687 -16.265 6.103 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -19.086 -17.908 3.565 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -19.399 -16.909 4.989 1.00 0.00 H new ATOM 971 N ARG A 65 -16.255 -17.173 9.332 1.00 0.00 N ATOM 972 CA ARG A 65 -15.658 -16.515 10.490 1.00 0.00 C ATOM 973 C ARG A 65 -14.516 -17.361 11.049 1.00 0.00 C ATOM 974 O ARG A 65 -13.404 -16.870 11.245 1.00 0.00 O ATOM 975 CB ARG A 65 -16.716 -16.282 11.579 1.00 0.00 C ATOM 976 CG ARG A 65 -16.125 -15.842 12.914 1.00 0.00 C ATOM 977 CD ARG A 65 -17.177 -15.738 14.010 1.00 0.00 C ATOM 978 NE ARG A 65 -18.068 -14.596 13.815 1.00 0.00 N ATOM 979 CZ ARG A 65 -17.849 -13.389 14.337 1.00 0.00 C ATOM 980 NH1 ARG A 65 -16.754 -13.163 15.056 1.00 0.00 N ATOM 981 NH2 ARG A 65 -18.720 -12.409 14.141 1.00 0.00 N ATOM 0 H ARG A 65 -17.216 -17.485 9.476 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.262 -15.551 10.172 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.420 -15.525 11.235 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.283 -17.201 11.727 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -15.356 -16.552 13.219 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.636 -14.876 12.791 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -17.765 -16.655 14.034 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -16.683 -15.650 14.978 1.00 0.00 H new ATOM 0 HE ARG A 65 -18.905 -14.730 13.247 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -16.080 -13.913 15.209 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -16.587 -12.239 15.455 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -19.561 -12.577 13.589 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -18.549 -11.487 14.542 1.00 0.00 H new ATOM 995 N ALA A 66 -14.806 -18.640 11.276 1.00 0.00 N ATOM 996 CA ALA A 66 -13.860 -19.567 11.891 1.00 0.00 C ATOM 997 C ALA A 66 -12.490 -19.500 11.221 1.00 0.00 C ATOM 998 O ALA A 66 -11.465 -19.501 11.900 1.00 0.00 O ATOM 999 CB ALA A 66 -14.410 -20.989 11.838 1.00 0.00 C ATOM 0 H ALA A 66 -15.703 -19.063 11.039 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.731 -19.272 12.932 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -13.697 -21.672 12.299 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -15.356 -21.033 12.377 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -14.570 -21.279 10.799 1.00 0.00 H new ATOM 1005 N TRP A 67 -12.484 -19.414 9.891 1.00 0.00 N ATOM 1006 CA TRP A 67 -11.239 -19.356 9.123 1.00 0.00 C ATOM 1007 C TRP A 67 -10.300 -18.266 9.643 1.00 0.00 C ATOM 1008 O TRP A 67 -9.166 -18.553 10.024 1.00 0.00 O ATOM 1009 CB TRP A 67 -11.529 -19.130 7.632 1.00 0.00 C ATOM 1010 CG TRP A 67 -11.969 -20.372 6.911 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -13.248 -20.763 6.639 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -11.116 -21.387 6.369 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -13.242 -21.958 5.963 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -11.945 -22.362 5.785 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -9.729 -21.565 6.323 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -11.433 -23.497 5.160 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -9.222 -22.691 5.703 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -10.072 -23.644 5.129 1.00 0.00 C ATOM 0 H TRP A 67 -13.329 -19.383 9.321 1.00 0.00 H new ATOM 0 HA TRP A 67 -10.740 -20.317 9.248 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -12.302 -18.368 7.532 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -10.632 -18.739 7.151 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -14.135 -20.213 6.915 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -14.069 -22.463 5.645 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -9.066 -20.835 6.764 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -12.086 -24.234 4.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -8.153 -22.838 5.661 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -9.645 -24.514 4.652 1.00 0.00 H new ATOM 1029 N MET A 68 -10.778 -17.024 9.680 1.00 0.00 N ATOM 1030 CA MET A 68 -9.928 -15.897 10.071 1.00 0.00 C ATOM 1031 C MET A 68 -9.471 -16.032 11.522 1.00 0.00 C ATOM 1032 O MET A 68 -8.404 -15.537 11.895 1.00 0.00 O ATOM 1033 CB MET A 68 -10.649 -14.549 9.887 1.00 0.00 C ATOM 1034 CG MET A 68 -11.847 -14.344 10.812 1.00 0.00 C ATOM 1035 SD MET A 68 -12.291 -12.604 11.006 1.00 0.00 S ATOM 1036 CE MET A 68 -10.819 -11.976 11.821 1.00 0.00 C ATOM 0 H MET A 68 -11.739 -16.772 9.447 1.00 0.00 H new ATOM 0 HA MET A 68 -9.057 -15.918 9.416 1.00 0.00 H new ATOM 0 HB2 MET A 68 -9.935 -13.743 10.053 1.00 0.00 H new ATOM 0 HB3 MET A 68 -10.985 -14.469 8.853 1.00 0.00 H new ATOM 0 HG2 MET A 68 -12.703 -14.891 10.417 1.00 0.00 H new ATOM 0 HG3 MET A 68 -11.622 -14.768 11.790 1.00 0.00 H new ATOM 0 HE1 MET A 68 -11.086 -11.128 12.452 1.00 0.00 H new ATOM 0 HE2 MET A 68 -10.380 -12.762 12.436 1.00 0.00 H new ATOM 0 HE3 MET A 68 -10.096 -11.656 11.071 1.00 0.00 H new ATOM 1046 N GLU A 69 -10.275 -16.713 12.334 1.00 0.00 N ATOM 1047 CA GLU A 69 -10.007 -16.820 13.764 1.00 0.00 C ATOM 1048 C GLU A 69 -8.972 -17.907 14.051 1.00 0.00 C ATOM 1049 O GLU A 69 -8.013 -17.680 14.793 1.00 0.00 O ATOM 1050 CB GLU A 69 -11.303 -17.108 14.532 1.00 0.00 C ATOM 1051 CG GLU A 69 -12.464 -16.202 14.132 1.00 0.00 C ATOM 1052 CD GLU A 69 -13.633 -16.274 15.100 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -14.239 -17.357 15.223 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -13.964 -15.240 15.723 1.00 0.00 O ATOM 0 H GLU A 69 -11.117 -17.199 12.026 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.601 -15.866 14.101 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.590 -18.147 14.367 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.116 -16.995 15.600 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.111 -15.172 14.073 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.807 -16.479 13.135 1.00 0.00 H new ATOM 1061 N GLU A 70 -9.159 -19.080 13.449 1.00 0.00 N ATOM 1062 CA GLU A 70 -8.283 -20.225 13.703 1.00 0.00 C ATOM 1063 C GLU A 70 -7.099 -20.240 12.738 1.00 0.00 C ATOM 1064 O GLU A 70 -6.175 -21.039 12.892 1.00 0.00 O ATOM 1065 CB GLU A 70 -9.066 -21.543 13.592 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.539 -21.874 12.178 1.00 0.00 C ATOM 1067 CD GLU A 70 -10.370 -23.147 12.120 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -9.780 -24.249 12.063 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -11.618 -23.055 12.140 1.00 0.00 O ATOM 0 H GLU A 70 -9.909 -19.264 12.782 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.898 -20.127 14.718 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -8.437 -22.357 13.953 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -9.933 -21.494 14.251 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.129 -21.042 11.792 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.673 -21.980 11.525 1.00 0.00 H new ATOM 1076 N SER A 71 -7.136 -19.370 11.735 1.00 0.00 N ATOM 1077 CA SER A 71 -6.055 -19.270 10.761 1.00 0.00 C ATOM 1078 C SER A 71 -5.727 -17.807 10.470 1.00 0.00 C ATOM 1079 O SER A 71 -6.525 -17.085 9.869 1.00 0.00 O ATOM 1080 CB SER A 71 -6.436 -20.004 9.468 1.00 0.00 C ATOM 1081 OG SER A 71 -6.693 -21.378 9.718 1.00 0.00 O ATOM 0 H SER A 71 -7.906 -18.721 11.575 1.00 0.00 H new ATOM 0 HA SER A 71 -5.166 -19.742 11.180 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.319 -19.540 9.029 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.630 -19.908 8.740 1.00 0.00 H new ATOM 0 HG SER A 71 -6.935 -21.823 8.879 1.00 0.00 H new ATOM 1087 N ASP A 72 -4.559 -17.372 10.930 1.00 0.00 N ATOM 1088 CA ASP A 72 -4.071 -16.020 10.668 1.00 0.00 C ATOM 1089 C ASP A 72 -3.481 -15.949 9.264 1.00 0.00 C ATOM 1090 O ASP A 72 -2.429 -16.520 9.007 1.00 0.00 O ATOM 1091 CB ASP A 72 -3.007 -15.630 11.705 1.00 0.00 C ATOM 1092 CG ASP A 72 -2.476 -14.220 11.498 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -3.249 -13.257 11.676 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -1.278 -14.065 11.177 1.00 0.00 O ATOM 0 H ASP A 72 -3.926 -17.941 11.492 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.904 -15.322 10.742 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -3.433 -15.710 12.705 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.179 -16.337 11.654 1.00 0.00 H new ATOM 1099 N PHE A 73 -4.167 -15.271 8.354 1.00 0.00 N ATOM 1100 CA PHE A 73 -3.731 -15.207 6.960 1.00 0.00 C ATOM 1101 C PHE A 73 -2.484 -14.332 6.810 1.00 0.00 C ATOM 1102 O PHE A 73 -2.507 -13.138 7.124 1.00 0.00 O ATOM 1103 CB PHE A 73 -4.867 -14.691 6.066 1.00 0.00 C ATOM 1104 CG PHE A 73 -6.054 -15.624 6.016 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -6.023 -16.761 5.220 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -7.190 -15.373 6.771 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -7.102 -17.624 5.176 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -8.270 -16.235 6.732 1.00 0.00 C ATOM 1109 CZ PHE A 73 -8.226 -17.362 5.935 1.00 0.00 C ATOM 0 H PHE A 73 -5.026 -14.758 8.552 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.470 -16.216 6.641 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.194 -13.717 6.430 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.487 -14.542 5.055 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.145 -16.974 4.628 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -7.231 -14.494 7.397 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.066 -18.502 4.549 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -9.148 -16.027 7.325 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.069 -18.037 5.905 1.00 0.00 H new ATOM 1119 N LEU A 74 -1.392 -14.940 6.344 1.00 0.00 N ATOM 1120 CA LEU A 74 -0.134 -14.226 6.121 1.00 0.00 C ATOM 1121 C LEU A 74 -0.048 -13.710 4.686 1.00 0.00 C ATOM 1122 O LEU A 74 -0.001 -12.500 4.451 1.00 0.00 O ATOM 1123 CB LEU A 74 1.084 -15.132 6.405 1.00 0.00 C ATOM 1124 CG LEU A 74 1.501 -15.287 7.881 1.00 0.00 C ATOM 1125 CD1 LEU A 74 0.432 -16.002 8.696 1.00 0.00 C ATOM 1126 CD2 LEU A 74 2.833 -16.025 7.979 1.00 0.00 C ATOM 0 H LEU A 74 -1.354 -15.933 6.112 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.117 -13.383 6.812 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.871 -16.124 6.005 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.936 -14.741 5.850 1.00 0.00 H new ATOM 0 HG LEU A 74 1.618 -14.288 8.300 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.763 -16.092 9.731 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.496 -15.431 8.660 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.262 -16.996 8.282 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.116 -16.128 9.027 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.735 -17.014 7.531 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.601 -15.461 7.449 1.00 0.00 H new ATOM 1138 N GLU A 75 -0.047 -14.638 3.731 1.00 0.00 N ATOM 1139 CA GLU A 75 0.246 -14.314 2.338 1.00 0.00 C ATOM 1140 C GLU A 75 -0.403 -15.329 1.395 1.00 0.00 C ATOM 1141 O GLU A 75 -0.575 -16.497 1.748 1.00 0.00 O ATOM 1142 CB GLU A 75 1.770 -14.295 2.138 1.00 0.00 C ATOM 1143 CG GLU A 75 2.224 -14.065 0.700 1.00 0.00 C ATOM 1144 CD GLU A 75 3.738 -14.052 0.563 1.00 0.00 C ATOM 1145 OE1 GLU A 75 4.385 -15.045 0.962 1.00 0.00 O ATOM 1146 OE2 GLU A 75 4.291 -13.045 0.073 1.00 0.00 O ATOM 0 H GLU A 75 -0.247 -15.624 3.899 1.00 0.00 H new ATOM 0 HA GLU A 75 -0.166 -13.332 2.104 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.195 -13.513 2.768 1.00 0.00 H new ATOM 0 HB3 GLU A 75 2.180 -15.243 2.486 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.811 -14.847 0.063 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.822 -13.117 0.343 1.00 0.00 H new ATOM 1153 N LEU A 76 -0.763 -14.872 0.198 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.351 -15.736 -0.823 1.00 0.00 C ATOM 1155 C LEU A 76 -0.371 -15.926 -1.977 1.00 0.00 C ATOM 1156 O LEU A 76 0.322 -14.984 -2.372 1.00 0.00 O ATOM 1157 CB LEU A 76 -2.658 -15.128 -1.352 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.371 -15.947 -2.445 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -3.845 -17.291 -1.897 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -4.536 -15.159 -3.038 1.00 0.00 C ATOM 0 H LEU A 76 -0.657 -13.899 -0.090 1.00 0.00 H new ATOM 0 HA LEU A 76 -1.568 -16.704 -0.372 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.343 -14.997 -0.515 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.444 -14.135 -1.747 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.654 -16.144 -3.242 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.345 -17.850 -2.688 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -2.988 -17.860 -1.537 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -4.541 -17.124 -1.075 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.025 -15.756 -3.808 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.253 -14.923 -2.252 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.163 -14.234 -3.479 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.329 -17.135 -2.523 1.00 0.00 N ATOM 1173 CA ARG A 77 0.534 -17.446 -3.654 1.00 0.00 C ATOM 1174 C ARG A 77 -0.259 -18.203 -4.716 1.00 0.00 C ATOM 1175 O ARG A 77 -0.484 -19.407 -4.597 1.00 0.00 O ATOM 1176 CB ARG A 77 1.745 -18.272 -3.194 1.00 0.00 C ATOM 1177 CG ARG A 77 2.709 -18.633 -4.321 1.00 0.00 C ATOM 1178 CD ARG A 77 3.920 -19.404 -3.810 1.00 0.00 C ATOM 1179 NE ARG A 77 4.915 -19.624 -4.861 1.00 0.00 N ATOM 1180 CZ ARG A 77 6.072 -20.261 -4.674 1.00 0.00 C ATOM 1181 NH1 ARG A 77 6.378 -20.772 -3.488 1.00 0.00 N ATOM 1182 NH2 ARG A 77 6.927 -20.390 -5.676 1.00 0.00 N ATOM 0 H ARG A 77 -0.889 -17.923 -2.196 1.00 0.00 H new ATOM 0 HA ARG A 77 0.902 -16.515 -4.086 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.286 -17.712 -2.431 1.00 0.00 H new ATOM 0 HB3 ARG A 77 1.390 -19.189 -2.724 1.00 0.00 H new ATOM 0 HG2 ARG A 77 2.187 -19.231 -5.067 1.00 0.00 H new ATOM 0 HG3 ARG A 77 3.042 -17.722 -4.819 1.00 0.00 H new ATOM 0 HD2 ARG A 77 4.378 -18.855 -2.987 1.00 0.00 H new ATOM 0 HD3 ARG A 77 3.596 -20.365 -3.411 1.00 0.00 H new ATOM 0 HE ARG A 77 4.711 -19.268 -5.795 1.00 0.00 H new ATOM 0 HH11 ARG A 77 5.726 -20.679 -2.709 1.00 0.00 H new ATOM 0 HH12 ARG A 77 7.265 -21.257 -3.355 1.00 0.00 H new ATOM 0 HH21 ARG A 77 6.701 -20.002 -6.592 1.00 0.00 H new ATOM 0 HH22 ARG A 77 7.812 -20.877 -5.532 1.00 0.00 H new ATOM 1196 N VAL A 78 -0.709 -17.482 -5.735 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.440 -18.086 -6.842 1.00 0.00 C ATOM 1198 C VAL A 78 -0.469 -18.814 -7.769 1.00 0.00 C ATOM 1199 O VAL A 78 0.527 -18.237 -8.207 1.00 0.00 O ATOM 1200 CB VAL A 78 -2.228 -17.019 -7.640 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -2.935 -17.641 -8.846 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -3.230 -16.300 -6.735 1.00 0.00 C ATOM 0 H VAL A 78 -0.580 -16.474 -5.818 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.154 -18.799 -6.429 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.515 -16.285 -8.014 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.480 -16.868 -9.387 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.196 -18.094 -9.507 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.633 -18.405 -8.504 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.774 -15.554 -7.315 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.934 -17.024 -6.324 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.697 -15.809 -5.920 1.00 0.00 H new ATOM 1212 N LEU A 79 -0.753 -20.082 -8.050 1.00 0.00 N ATOM 1213 CA LEU A 79 0.131 -20.904 -8.873 1.00 0.00 C ATOM 1214 C LEU A 79 -0.242 -20.789 -10.349 1.00 0.00 C ATOM 1215 O LEU A 79 0.590 -20.420 -11.183 1.00 0.00 O ATOM 1216 CB LEU A 79 0.067 -22.371 -8.422 1.00 0.00 C ATOM 1217 CG LEU A 79 0.456 -22.628 -6.955 1.00 0.00 C ATOM 1218 CD1 LEU A 79 0.382 -24.117 -6.633 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.850 -22.077 -6.655 1.00 0.00 C ATOM 0 H LEU A 79 -1.589 -20.564 -7.720 1.00 0.00 H new ATOM 0 HA LEU A 79 1.151 -20.541 -8.747 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.947 -22.738 -8.581 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.724 -22.959 -9.063 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.257 -22.104 -6.318 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.661 -24.278 -5.592 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.635 -24.474 -6.796 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.067 -24.664 -7.281 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.101 -22.271 -5.612 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.580 -22.564 -7.301 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.864 -21.002 -6.837 1.00 0.00 H new ATOM 1231 N GLY A 80 -1.499 -21.090 -10.661 1.00 0.00 N ATOM 1232 CA GLY A 80 -1.959 -21.055 -12.038 1.00 0.00 C ATOM 1233 C GLY A 80 -3.466 -20.960 -12.133 1.00 0.00 C ATOM 1234 O GLY A 80 -4.165 -21.089 -11.125 1.00 0.00 O ATOM 0 H GLY A 80 -2.210 -21.359 -9.981 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.510 -20.203 -12.548 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.619 -21.952 -12.556 1.00 0.00 H new ATOM 1238 N SER A 81 -3.970 -20.744 -13.343 1.00 0.00 N ATOM 1239 CA SER A 81 -5.403 -20.598 -13.568 1.00 0.00 C ATOM 1240 C SER A 81 -5.787 -21.083 -14.966 1.00 0.00 C ATOM 1241 O SER A 81 -4.977 -21.031 -15.898 1.00 0.00 O ATOM 1242 CB SER A 81 -5.812 -19.132 -13.377 1.00 0.00 C ATOM 1243 OG SER A 81 -5.029 -18.271 -14.190 1.00 0.00 O ATOM 0 H SER A 81 -3.403 -20.666 -14.188 1.00 0.00 H new ATOM 0 HA SER A 81 -5.934 -21.213 -12.842 1.00 0.00 H new ATOM 0 HB2 SER A 81 -6.867 -19.011 -13.624 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.696 -18.853 -12.330 1.00 0.00 H new ATOM 0 HG SER A 81 -4.993 -17.380 -13.783 1.00 0.00 H new ATOM 1249 N SER A 82 -7.020 -21.561 -15.098 1.00 0.00 N ATOM 1250 CA SER A 82 -7.550 -22.029 -16.373 1.00 0.00 C ATOM 1251 C SER A 82 -9.010 -21.598 -16.512 1.00 0.00 C ATOM 1252 O SER A 82 -9.850 -21.965 -15.687 1.00 0.00 O ATOM 1253 CB SER A 82 -7.443 -23.558 -16.458 1.00 0.00 C ATOM 1254 OG SER A 82 -6.110 -23.992 -16.243 1.00 0.00 O ATOM 0 H SER A 82 -7.680 -21.635 -14.324 1.00 0.00 H new ATOM 0 HA SER A 82 -6.969 -21.591 -17.184 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.100 -24.013 -15.717 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.785 -23.895 -17.437 1.00 0.00 H new ATOM 0 HG SER A 82 -6.071 -24.969 -16.301 1.00 0.00 H new ATOM 1260 N GLU A 83 -9.305 -20.808 -17.539 1.00 0.00 N ATOM 1261 CA GLU A 83 -10.664 -20.339 -17.784 1.00 0.00 C ATOM 1262 C GLU A 83 -11.222 -21.005 -19.040 1.00 0.00 C ATOM 1263 O GLU A 83 -10.709 -20.804 -20.141 1.00 0.00 O ATOM 1264 CB GLU A 83 -10.683 -18.811 -17.932 1.00 0.00 C ATOM 1265 CG GLU A 83 -12.086 -18.220 -18.040 1.00 0.00 C ATOM 1266 CD GLU A 83 -12.075 -16.711 -18.234 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -12.029 -15.972 -17.227 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -12.105 -16.258 -19.395 1.00 0.00 O ATOM 0 H GLU A 83 -8.618 -20.478 -18.217 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.291 -20.608 -16.934 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -10.176 -18.366 -17.076 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.113 -18.534 -18.819 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.608 -18.686 -18.876 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.648 -18.462 -17.138 1.00 0.00 H new ATOM 1275 N LYS A 84 -12.260 -21.813 -18.864 1.00 0.00 N ATOM 1276 CA LYS A 84 -12.884 -22.535 -19.970 1.00 0.00 C ATOM 1277 C LYS A 84 -14.268 -21.962 -20.260 1.00 0.00 C ATOM 1278 O LYS A 84 -15.253 -22.699 -20.370 1.00 0.00 O ATOM 1279 CB LYS A 84 -12.990 -24.031 -19.629 1.00 0.00 C ATOM 1280 CG LYS A 84 -11.653 -24.692 -19.321 1.00 0.00 C ATOM 1281 CD LYS A 84 -10.661 -24.505 -20.464 1.00 0.00 C ATOM 1282 CE LYS A 84 -9.399 -25.323 -20.252 1.00 0.00 C ATOM 1283 NZ LYS A 84 -8.396 -25.079 -21.322 1.00 0.00 N ATOM 0 H LYS A 84 -12.692 -21.987 -17.957 1.00 0.00 H new ATOM 0 HA LYS A 84 -12.265 -22.419 -20.860 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -13.650 -24.151 -18.770 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -13.457 -24.552 -20.465 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -11.239 -24.269 -18.406 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -11.805 -25.756 -19.140 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -11.130 -24.796 -21.404 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.401 -23.450 -20.551 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -8.964 -25.076 -19.283 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.653 -26.383 -20.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -7.549 -25.655 -21.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -8.802 -25.338 -22.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.135 -24.072 -21.330 1.00 0.00 H new ATOM 1297 N GLY A 85 -14.329 -20.644 -20.410 1.00 0.00 N ATOM 1298 CA GLY A 85 -15.587 -19.976 -20.690 1.00 0.00 C ATOM 1299 C GLY A 85 -16.307 -19.565 -19.421 1.00 0.00 C ATOM 1300 O GLY A 85 -15.823 -18.705 -18.683 1.00 0.00 O ATOM 0 H GLY A 85 -13.524 -20.022 -20.342 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -15.401 -19.094 -21.303 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.228 -20.639 -21.272 1.00 0.00 H new ATOM 1304 N SER A 86 -17.465 -20.169 -19.169 1.00 0.00 N ATOM 1305 CA SER A 86 -18.228 -19.894 -17.956 1.00 0.00 C ATOM 1306 C SER A 86 -17.659 -20.684 -16.776 1.00 0.00 C ATOM 1307 O SER A 86 -17.844 -20.313 -15.615 1.00 0.00 O ATOM 1308 CB SER A 86 -19.711 -20.223 -18.175 1.00 0.00 C ATOM 1309 OG SER A 86 -19.882 -21.525 -18.720 1.00 0.00 O ATOM 0 H SER A 86 -17.896 -20.853 -19.790 1.00 0.00 H new ATOM 0 HA SER A 86 -18.146 -18.833 -17.722 1.00 0.00 H new ATOM 0 HB2 SER A 86 -20.244 -20.152 -17.227 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.153 -19.486 -18.846 1.00 0.00 H new ATOM 0 HG SER A 86 -20.837 -21.704 -18.846 1.00 0.00 H new ATOM 1315 N ARG A 87 -16.963 -21.774 -17.088 1.00 0.00 N ATOM 1316 CA ARG A 87 -16.273 -22.572 -16.087 1.00 0.00 C ATOM 1317 C ARG A 87 -14.831 -22.092 -15.969 1.00 0.00 C ATOM 1318 O ARG A 87 -14.159 -21.895 -16.979 1.00 0.00 O ATOM 1319 CB ARG A 87 -16.300 -24.052 -16.495 1.00 0.00 C ATOM 1320 CG ARG A 87 -17.689 -24.695 -16.468 1.00 0.00 C ATOM 1321 CD ARG A 87 -18.050 -25.262 -15.094 1.00 0.00 C ATOM 1322 NE ARG A 87 -18.077 -24.246 -14.040 1.00 0.00 N ATOM 1323 CZ ARG A 87 -18.295 -24.516 -12.750 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -18.572 -25.754 -12.361 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -18.250 -23.544 -11.853 1.00 0.00 N ATOM 0 H ARG A 87 -16.863 -22.126 -18.040 1.00 0.00 H new ATOM 0 HA ARG A 87 -16.772 -22.462 -15.124 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -15.890 -24.146 -17.501 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -15.642 -24.611 -15.829 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -18.434 -23.954 -16.758 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -17.730 -25.494 -17.208 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -19.027 -25.743 -15.152 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -17.330 -26.035 -14.826 1.00 0.00 H new ATOM 0 HE ARG A 87 -17.920 -23.274 -14.307 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -18.619 -26.506 -13.048 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -18.737 -25.954 -11.375 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -18.049 -22.588 -12.147 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -18.417 -23.751 -10.868 1.00 0.00 H new ATOM 1339 N GLY A 88 -14.361 -21.899 -14.746 1.00 0.00 N ATOM 1340 CA GLY A 88 -12.996 -21.454 -14.536 1.00 0.00 C ATOM 1341 C GLY A 88 -12.460 -21.911 -13.202 1.00 0.00 C ATOM 1342 O GLY A 88 -13.164 -21.851 -12.197 1.00 0.00 O ATOM 0 H GLY A 88 -14.900 -22.042 -13.892 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.361 -21.838 -15.334 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.955 -20.366 -14.591 1.00 0.00 H new ATOM 1346 N THR A 89 -11.218 -22.367 -13.190 1.00 0.00 N ATOM 1347 CA THR A 89 -10.600 -22.884 -11.980 1.00 0.00 C ATOM 1348 C THR A 89 -9.240 -22.222 -11.755 1.00 0.00 C ATOM 1349 O THR A 89 -8.556 -21.853 -12.714 1.00 0.00 O ATOM 1350 CB THR A 89 -10.421 -24.418 -12.071 1.00 0.00 C ATOM 1351 OG1 THR A 89 -11.659 -25.038 -12.447 1.00 0.00 O ATOM 1352 CG2 THR A 89 -9.952 -24.998 -10.744 1.00 0.00 C ATOM 0 H THR A 89 -10.614 -22.389 -14.012 1.00 0.00 H new ATOM 0 HA THR A 89 -11.255 -22.655 -11.140 1.00 0.00 H new ATOM 0 HB THR A 89 -9.662 -24.620 -12.827 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.535 -26.008 -12.504 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.835 -26.078 -10.840 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.996 -24.553 -10.470 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.689 -24.780 -9.971 1.00 0.00 H new ATOM 1360 N VAL A 90 -8.858 -22.058 -10.492 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.562 -21.489 -10.144 1.00 0.00 C ATOM 1362 C VAL A 90 -6.915 -22.296 -9.020 1.00 0.00 C ATOM 1363 O VAL A 90 -7.581 -22.684 -8.055 1.00 0.00 O ATOM 1364 CB VAL A 90 -7.685 -19.995 -9.731 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -8.630 -19.823 -8.544 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.313 -19.396 -9.424 1.00 0.00 C ATOM 0 H VAL A 90 -9.432 -22.313 -9.689 1.00 0.00 H new ATOM 0 HA VAL A 90 -6.929 -21.538 -11.030 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.110 -19.454 -10.576 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.694 -18.767 -8.280 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.621 -20.191 -8.811 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.251 -20.388 -7.692 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.428 -18.351 -9.138 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.850 -19.947 -8.606 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.681 -19.462 -10.309 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.623 -22.568 -9.167 1.00 0.00 N ATOM 1377 CA GLU A 91 -4.865 -23.308 -8.168 1.00 0.00 C ATOM 1378 C GLU A 91 -3.932 -22.349 -7.440 1.00 0.00 C ATOM 1379 O GLU A 91 -3.230 -21.556 -8.075 1.00 0.00 O ATOM 1380 CB GLU A 91 -4.067 -24.434 -8.836 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.450 -25.422 -7.854 1.00 0.00 C ATOM 1382 CD GLU A 91 -2.712 -26.554 -8.551 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -3.340 -27.270 -9.359 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -1.501 -26.724 -8.305 1.00 0.00 O ATOM 0 H GLU A 91 -5.075 -22.283 -9.979 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.549 -23.759 -7.449 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.723 -24.976 -9.517 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.274 -23.994 -9.440 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.759 -24.893 -7.197 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.234 -25.839 -7.222 1.00 0.00 H new ATOM 1391 N PHE A 92 -3.922 -22.416 -6.115 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.180 -21.451 -5.313 1.00 0.00 C ATOM 1393 C PHE A 92 -2.667 -22.076 -4.021 1.00 0.00 C ATOM 1394 O PHE A 92 -2.935 -23.244 -3.722 1.00 0.00 O ATOM 1395 CB PHE A 92 -4.077 -20.248 -4.986 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.298 -20.616 -4.175 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -6.448 -21.081 -4.798 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -5.291 -20.512 -2.789 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -7.560 -21.430 -4.059 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -6.401 -20.862 -2.046 1.00 0.00 C ATOM 1401 CZ PHE A 92 -7.536 -21.322 -2.681 1.00 0.00 C ATOM 0 H PHE A 92 -4.417 -23.125 -5.574 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.319 -21.122 -5.894 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.495 -19.508 -4.437 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.395 -19.777 -5.916 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.473 -21.171 -5.874 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.405 -20.153 -2.286 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.449 -21.788 -4.557 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.381 -20.776 -0.970 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.405 -21.598 -2.102 1.00 0.00 H new ATOM 1411 N ILE A 93 -1.929 -21.272 -3.267 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.420 -21.649 -1.959 1.00 0.00 C ATOM 1413 C ILE A 93 -1.674 -20.512 -0.970 1.00 0.00 C ATOM 1414 O ILE A 93 -1.090 -19.434 -1.088 1.00 0.00 O ATOM 1415 CB ILE A 93 0.100 -21.969 -2.011 1.00 0.00 C ATOM 1416 CG1 ILE A 93 0.350 -23.267 -2.800 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.685 -22.073 -0.603 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.813 -23.639 -2.925 1.00 0.00 C ATOM 0 H ILE A 93 -1.665 -20.329 -3.552 1.00 0.00 H new ATOM 0 HA ILE A 93 -1.941 -22.550 -1.636 1.00 0.00 H new ATOM 0 HB ILE A 93 0.603 -21.150 -2.525 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.182 -24.084 -2.313 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.074 -23.161 -3.798 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.750 -22.298 -0.667 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.544 -21.127 -0.080 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.179 -22.869 -0.056 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.906 -24.564 -3.494 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.349 -22.841 -3.440 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.239 -23.779 -1.932 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.578 -20.744 -0.026 1.00 0.00 N ATOM 1431 CA ALA A 94 -2.876 -19.767 1.015 1.00 0.00 C ATOM 1432 C ALA A 94 -2.019 -20.041 2.246 1.00 0.00 C ATOM 1433 O ALA A 94 -2.193 -21.058 2.916 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.360 -19.803 1.370 1.00 0.00 C ATOM 0 H ALA A 94 -3.120 -21.605 0.040 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.641 -18.770 0.643 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.566 -19.068 2.148 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.952 -19.570 0.485 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.624 -20.797 1.731 1.00 0.00 H new ATOM 1440 N ARG A 95 -1.090 -19.139 2.535 1.00 0.00 N ATOM 1441 CA ARG A 95 -0.179 -19.304 3.662 1.00 0.00 C ATOM 1442 C ARG A 95 -0.727 -18.586 4.889 1.00 0.00 C ATOM 1443 O ARG A 95 -0.824 -17.356 4.912 1.00 0.00 O ATOM 1444 CB ARG A 95 1.214 -18.760 3.311 1.00 0.00 C ATOM 1445 CG ARG A 95 2.210 -18.819 4.469 1.00 0.00 C ATOM 1446 CD ARG A 95 3.546 -18.188 4.096 1.00 0.00 C ATOM 1447 NE ARG A 95 4.460 -18.107 5.238 1.00 0.00 N ATOM 1448 CZ ARG A 95 5.696 -17.607 5.172 1.00 0.00 C ATOM 1449 NH1 ARG A 95 6.192 -17.192 4.010 1.00 0.00 N ATOM 1450 NH2 ARG A 95 6.437 -17.541 6.268 1.00 0.00 N ATOM 0 H ARG A 95 -0.947 -18.281 2.002 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.091 -20.368 3.884 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.614 -19.328 2.471 1.00 0.00 H new ATOM 0 HB3 ARG A 95 1.117 -17.726 2.980 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.793 -18.304 5.334 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.367 -19.857 4.762 1.00 0.00 H new ATOM 0 HD2 ARG A 95 4.012 -18.771 3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.375 -17.188 3.699 1.00 0.00 H new ATOM 0 HE ARG A 95 4.132 -18.454 6.139 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.627 -17.255 3.163 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.137 -16.811 3.966 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.063 -17.871 7.157 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.382 -17.160 6.223 1.00 0.00 H new ATOM 1464 N PHE A 96 -1.089 -19.362 5.901 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.637 -18.822 7.139 1.00 0.00 C ATOM 1466 C PHE A 96 -0.982 -19.472 8.354 1.00 0.00 C ATOM 1467 O PHE A 96 -0.239 -20.444 8.227 1.00 0.00 O ATOM 1468 CB PHE A 96 -3.168 -19.000 7.181 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.661 -20.357 6.726 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -3.174 -21.526 7.297 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.620 -20.459 5.726 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -3.629 -22.761 6.879 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -5.077 -21.693 5.307 1.00 0.00 C ATOM 1474 CZ PHE A 96 -4.581 -22.844 5.885 1.00 0.00 C ATOM 0 H PHE A 96 -1.012 -20.379 5.888 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.417 -17.755 7.169 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.512 -18.827 8.201 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -3.626 -18.234 6.556 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.430 -21.468 8.078 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -5.013 -19.562 5.271 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -3.239 -23.661 7.330 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.822 -21.757 4.528 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.938 -23.810 5.559 1.00 0.00 H new ATOM 1484 N ARG A 97 -1.264 -18.923 9.526 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.727 -19.428 10.781 1.00 0.00 C ATOM 1486 C ARG A 97 -1.872 -19.960 11.637 1.00 0.00 C ATOM 1487 O ARG A 97 -2.710 -19.189 12.109 1.00 0.00 O ATOM 1488 CB ARG A 97 0.022 -18.303 11.509 1.00 0.00 C ATOM 1489 CG ARG A 97 0.796 -18.758 12.741 1.00 0.00 C ATOM 1490 CD ARG A 97 1.648 -17.630 13.312 1.00 0.00 C ATOM 1491 NE ARG A 97 2.702 -17.215 12.378 1.00 0.00 N ATOM 1492 CZ ARG A 97 2.816 -15.988 11.857 1.00 0.00 C ATOM 1493 NH1 ARG A 97 1.948 -15.033 12.180 1.00 0.00 N ATOM 1494 NH2 ARG A 97 3.802 -15.722 11.011 1.00 0.00 N ATOM 0 H ARG A 97 -1.874 -18.112 9.634 1.00 0.00 H new ATOM 0 HA ARG A 97 -0.026 -20.240 10.589 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.716 -17.834 10.811 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.696 -17.539 11.807 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.098 -19.109 13.501 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.435 -19.602 12.480 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.012 -16.776 13.544 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.100 -17.955 14.249 1.00 0.00 H new ATOM 0 HE ARG A 97 3.396 -17.911 12.107 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.188 -15.233 12.830 1.00 0.00 H new ATOM 0 HH12 ARG A 97 2.043 -14.100 11.778 1.00 0.00 H new ATOM 0 HH21 ARG A 97 4.469 -16.451 10.760 1.00 0.00 H new ATOM 0 HH22 ARG A 97 3.893 -14.788 10.611 1.00 0.00 H new ATOM 1508 N ARG A 98 -1.916 -21.275 11.817 1.00 0.00 N ATOM 1509 CA ARG A 98 -3.024 -21.913 12.519 1.00 0.00 C ATOM 1510 C ARG A 98 -2.895 -21.697 14.027 1.00 0.00 C ATOM 1511 O ARG A 98 -1.805 -21.834 14.593 1.00 0.00 O ATOM 1512 CB ARG A 98 -3.084 -23.412 12.182 1.00 0.00 C ATOM 1513 CG ARG A 98 -4.331 -24.116 12.717 1.00 0.00 C ATOM 1514 CD ARG A 98 -4.453 -25.544 12.190 1.00 0.00 C ATOM 1515 NE ARG A 98 -3.326 -26.387 12.598 1.00 0.00 N ATOM 1516 CZ ARG A 98 -2.984 -27.530 11.994 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -3.677 -27.984 10.954 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -1.952 -28.226 12.445 1.00 0.00 N ATOM 0 H ARG A 98 -1.198 -21.920 11.487 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.956 -21.454 12.188 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -3.046 -23.533 11.099 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -2.199 -23.902 12.589 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -4.298 -24.133 13.806 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.217 -23.548 12.434 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -5.382 -25.984 12.552 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -4.513 -25.523 11.102 1.00 0.00 H new ATOM 0 HE ARG A 98 -2.766 -26.082 13.394 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -4.480 -27.459 10.608 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -3.406 -28.857 10.502 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -1.422 -27.890 13.249 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -1.687 -29.099 11.988 1.00 0.00 H new ATOM 1553 N PRO A 102 2.103 -22.723 14.596 1.00 0.00 N ATOM 1554 CA PRO A 102 2.520 -23.361 13.343 1.00 0.00 C ATOM 1555 C PRO A 102 1.878 -22.726 12.109 1.00 0.00 C ATOM 1556 O PRO A 102 0.662 -22.510 12.059 1.00 0.00 O ATOM 1557 CB PRO A 102 2.047 -24.810 13.510 1.00 0.00 C ATOM 1558 CG PRO A 102 0.874 -24.713 14.426 1.00 0.00 C ATOM 1559 CD PRO A 102 1.185 -23.581 15.371 1.00 0.00 C ATOM 0 HA PRO A 102 3.593 -23.261 13.177 1.00 0.00 H new ATOM 0 HB2 PRO A 102 1.768 -25.250 12.553 1.00 0.00 H new ATOM 0 HB3 PRO A 102 2.831 -25.438 13.933 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -0.042 -24.517 13.869 1.00 0.00 H new ATOM 0 HG3 PRO A 102 0.724 -25.646 14.969 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.283 -23.043 15.662 1.00 0.00 H new ATOM 0 HD3 PRO A 102 1.651 -23.941 16.288 1.00 0.00 H new ATOM 1567 N GLU A 103 2.709 -22.419 11.122 1.00 0.00 N ATOM 1568 CA GLU A 103 2.233 -21.934 9.835 1.00 0.00 C ATOM 1569 C GLU A 103 1.936 -23.116 8.918 1.00 0.00 C ATOM 1570 O GLU A 103 2.626 -24.139 8.965 1.00 0.00 O ATOM 1571 CB GLU A 103 3.271 -21.005 9.187 1.00 0.00 C ATOM 1572 CG GLU A 103 3.389 -19.644 9.866 1.00 0.00 C ATOM 1573 CD GLU A 103 4.494 -18.777 9.279 1.00 0.00 C ATOM 1574 OE1 GLU A 103 4.708 -18.820 8.047 1.00 0.00 O ATOM 1575 OE2 GLU A 103 5.144 -18.033 10.048 1.00 0.00 O ATOM 0 H GLU A 103 3.724 -22.498 11.190 1.00 0.00 H new ATOM 0 HA GLU A 103 1.318 -21.363 9.992 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.244 -21.495 9.205 1.00 0.00 H new ATOM 0 HB3 GLU A 103 3.008 -20.856 8.140 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.438 -19.118 9.780 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.577 -19.790 10.930 1.00 0.00 H new ATOM 1582 N GLN A 104 0.905 -22.976 8.101 1.00 0.00 N ATOM 1583 CA GLN A 104 0.518 -24.005 7.149 1.00 0.00 C ATOM 1584 C GLN A 104 0.169 -23.357 5.817 1.00 0.00 C ATOM 1585 O GLN A 104 -0.360 -22.243 5.777 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.682 -24.807 7.676 1.00 0.00 C ATOM 1587 CG GLN A 104 -1.177 -25.887 6.715 1.00 0.00 C ATOM 1588 CD GLN A 104 -2.456 -26.568 7.180 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -2.625 -26.709 8.487 1.00 0.00 O flip ATOM 1590 NE2 GLN A 104 -3.280 -26.984 6.365 1.00 0.00 N flip ATOM 0 H GLN A 104 0.313 -22.146 8.079 1.00 0.00 H new ATOM 0 HA GLN A 104 1.353 -24.691 7.012 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -0.407 -25.275 8.621 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.501 -24.120 7.887 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.347 -25.441 5.735 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -0.397 -26.639 6.592 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -3.118 -26.858 5.366 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -4.125 -27.454 6.689 1.00 0.00 H new ATOM 1599 N SER A 105 0.479 -24.047 4.733 1.00 0.00 N ATOM 1600 CA SER A 105 0.169 -23.561 3.401 1.00 0.00 C ATOM 1601 C SER A 105 -0.945 -24.405 2.788 1.00 0.00 C ATOM 1602 O SER A 105 -0.744 -25.582 2.483 1.00 0.00 O ATOM 1603 CB SER A 105 1.430 -23.610 2.532 1.00 0.00 C ATOM 1604 OG SER A 105 2.037 -24.892 2.588 1.00 0.00 O ATOM 0 H SER A 105 0.949 -24.952 4.751 1.00 0.00 H new ATOM 0 HA SER A 105 -0.175 -22.528 3.458 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.174 -23.370 1.500 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.138 -22.853 2.870 1.00 0.00 H new ATOM 0 HG SER A 105 1.343 -25.584 2.559 1.00 0.00 H new ATOM 1610 N HIS A 106 -2.116 -23.804 2.617 1.00 0.00 N ATOM 1611 CA HIS A 106 -3.262 -24.500 2.047 1.00 0.00 C ATOM 1612 C HIS A 106 -3.169 -24.478 0.527 1.00 0.00 C ATOM 1613 O HIS A 106 -3.430 -23.454 -0.107 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.571 -23.844 2.517 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.816 -24.619 2.184 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -7.083 -24.132 2.423 1.00 0.00 N ATOM 1617 CD2 HIS A 106 -5.988 -25.860 1.664 1.00 0.00 C ATOM 1618 CE1 HIS A 106 -7.974 -25.036 2.067 1.00 0.00 C ATOM 1619 NE2 HIS A 106 -7.338 -26.093 1.604 1.00 0.00 N ATOM 0 H HIS A 106 -2.297 -22.832 2.866 1.00 0.00 H new ATOM 0 HA HIS A 106 -3.258 -25.536 2.387 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.524 -23.704 3.597 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.646 -22.853 2.070 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -5.207 -26.539 1.355 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -9.046 -24.928 2.142 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -7.778 -26.945 1.257 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.785 -25.606 -0.047 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.643 -25.734 -1.491 1.00 0.00 C ATOM 1630 C HIS A 107 -3.823 -26.509 -2.061 1.00 0.00 C ATOM 1631 O HIS A 107 -3.903 -27.731 -1.923 1.00 0.00 O ATOM 1632 CB HIS A 107 -1.316 -26.429 -1.833 1.00 0.00 C ATOM 1633 CG HIS A 107 -1.115 -26.703 -3.297 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -0.273 -27.689 -3.761 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.637 -26.111 -4.400 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -0.284 -27.695 -5.078 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -1.102 -26.749 -5.490 1.00 0.00 N ATOM 0 H HIS A 107 -2.563 -26.456 0.471 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.633 -24.741 -1.940 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.493 -25.809 -1.476 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.264 -27.372 -1.289 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.341 -25.292 -4.417 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.281 -28.362 -5.712 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.305 -26.526 -6.464 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.741 -25.793 -2.695 1.00 0.00 N ATOM 1647 CA GLU A 108 -5.918 -26.413 -3.285 1.00 0.00 C ATOM 1648 C GLU A 108 -6.182 -25.841 -4.672 1.00 0.00 C ATOM 1649 O GLU A 108 -5.409 -25.020 -5.180 1.00 0.00 O ATOM 1650 CB GLU A 108 -7.152 -26.209 -2.396 1.00 0.00 C ATOM 1651 CG GLU A 108 -7.646 -24.768 -2.340 1.00 0.00 C ATOM 1652 CD GLU A 108 -9.031 -24.653 -1.726 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -10.022 -24.966 -2.418 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -9.137 -24.263 -0.546 1.00 0.00 O ATOM 0 H GLU A 108 -4.693 -24.781 -2.814 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.725 -27.482 -3.370 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.959 -26.845 -2.761 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -6.917 -26.541 -1.385 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.944 -24.169 -1.760 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -7.663 -24.353 -3.348 1.00 0.00 H new ATOM 1661 N ARG A 109 -7.280 -26.282 -5.267 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.684 -25.850 -6.593 1.00 0.00 C ATOM 1663 C ARG A 109 -9.187 -25.564 -6.577 1.00 0.00 C ATOM 1664 O ARG A 109 -10.001 -26.489 -6.583 1.00 0.00 O ATOM 1665 CB ARG A 109 -7.329 -26.945 -7.614 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.459 -26.517 -9.069 1.00 0.00 C ATOM 1667 CD ARG A 109 -6.954 -27.596 -10.026 1.00 0.00 C ATOM 1668 NE ARG A 109 -6.974 -27.143 -11.421 1.00 0.00 N ATOM 1669 CZ ARG A 109 -5.972 -26.478 -12.006 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -4.842 -26.257 -11.349 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -6.079 -26.065 -13.261 1.00 0.00 N ATOM 0 H ARG A 109 -7.918 -26.953 -4.840 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.160 -24.939 -6.881 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.305 -27.273 -7.435 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.974 -27.807 -7.443 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.503 -26.295 -9.290 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.896 -25.597 -9.229 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -5.938 -27.879 -9.751 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.572 -28.488 -9.925 1.00 0.00 H new ATOM 0 HE ARG A 109 -7.803 -27.348 -11.979 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -4.734 -26.595 -10.393 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -4.081 -25.749 -11.800 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -6.931 -26.254 -13.789 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -5.309 -25.558 -13.699 1.00 0.00 H new ATOM 1685 N SER A 110 -9.544 -24.282 -6.512 1.00 0.00 N ATOM 1686 CA SER A 110 -10.939 -23.870 -6.358 1.00 0.00 C ATOM 1687 C SER A 110 -11.597 -23.611 -7.714 1.00 0.00 C ATOM 1688 O SER A 110 -11.019 -22.950 -8.584 1.00 0.00 O ATOM 1689 CB SER A 110 -11.017 -22.610 -5.488 1.00 0.00 C ATOM 1690 OG SER A 110 -10.381 -22.807 -4.235 1.00 0.00 O ATOM 0 H SER A 110 -8.883 -23.507 -6.564 1.00 0.00 H new ATOM 0 HA SER A 110 -11.480 -24.682 -5.872 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.547 -21.776 -6.009 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.061 -22.339 -5.330 1.00 0.00 H new ATOM 0 HG SER A 110 -10.490 -23.740 -3.956 1.00 0.00 H new ATOM 1696 N GLN A 111 -12.808 -24.141 -7.882 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.578 -23.972 -9.110 1.00 0.00 C ATOM 1698 C GLN A 111 -14.572 -22.820 -8.959 1.00 0.00 C ATOM 1699 O GLN A 111 -15.152 -22.614 -7.885 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.327 -25.269 -9.467 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.418 -26.467 -9.748 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.636 -26.934 -8.527 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -13.097 -26.811 -7.392 1.00 0.00 O ATOM 1704 NE2 GLN A 111 -11.445 -27.465 -8.751 1.00 0.00 N ATOM 0 H GLN A 111 -13.281 -24.699 -7.171 1.00 0.00 H new ATOM 0 HA GLN A 111 -12.884 -23.739 -9.917 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -15.000 -25.523 -8.648 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -14.948 -25.086 -10.344 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -14.024 -27.293 -10.120 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.717 -26.204 -10.540 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.096 -27.551 -9.706 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -10.876 -27.789 -7.969 1.00 0.00 H new ATOM 1713 N PHE A 112 -14.771 -22.079 -10.043 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.633 -20.900 -10.046 1.00 0.00 C ATOM 1715 C PHE A 112 -16.635 -20.967 -11.199 1.00 0.00 C ATOM 1716 O PHE A 112 -16.389 -21.612 -12.224 1.00 0.00 O ATOM 1717 CB PHE A 112 -14.788 -19.620 -10.147 1.00 0.00 C ATOM 1718 CG PHE A 112 -13.958 -19.355 -8.915 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -12.722 -19.962 -8.747 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.425 -18.510 -7.918 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -11.973 -19.732 -7.611 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -13.676 -18.277 -6.782 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.451 -18.889 -6.628 1.00 0.00 C ATOM 0 H PHE A 112 -14.340 -22.278 -10.946 1.00 0.00 H new ATOM 0 HA PHE A 112 -16.189 -20.879 -9.108 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -14.129 -19.695 -11.012 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.448 -18.770 -10.322 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.342 -20.621 -9.513 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -15.385 -18.029 -8.032 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -11.013 -20.212 -7.491 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -14.050 -17.616 -6.014 1.00 0.00 H new ATOM 0 HZ PHE A 112 -11.865 -18.709 -5.739 1.00 0.00 H new ATOM 1733 N ARG A 113 -17.767 -20.303 -11.013 1.00 0.00 N ATOM 1734 CA ARG A 113 -18.851 -20.282 -11.986 1.00 0.00 C ATOM 1735 C ARG A 113 -19.144 -18.854 -12.411 1.00 0.00 C ATOM 1736 O ARG A 113 -19.353 -17.979 -11.569 1.00 0.00 O ATOM 1737 CB ARG A 113 -20.105 -20.916 -11.370 1.00 0.00 C ATOM 1738 CG ARG A 113 -21.375 -20.778 -12.205 1.00 0.00 C ATOM 1739 CD ARG A 113 -22.517 -21.572 -11.583 1.00 0.00 C ATOM 1740 NE ARG A 113 -23.775 -21.452 -12.323 1.00 0.00 N ATOM 1741 CZ ARG A 113 -24.978 -21.673 -11.782 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -25.094 -21.894 -10.474 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -26.062 -21.637 -12.548 1.00 0.00 N ATOM 0 H ARG A 113 -17.961 -19.758 -10.173 1.00 0.00 H new ATOM 0 HA ARG A 113 -18.554 -20.853 -12.866 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -19.913 -21.976 -11.201 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.280 -20.464 -10.393 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.655 -19.727 -12.280 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.190 -21.132 -13.219 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.233 -22.623 -11.530 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -22.672 -21.232 -10.559 1.00 0.00 H new ATOM 0 HE ARG A 113 -23.731 -21.185 -13.306 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -24.264 -21.895 -9.881 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -26.013 -22.062 -10.065 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -25.975 -21.441 -13.545 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -26.981 -21.805 -12.139 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.139 -18.617 -13.712 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.461 -17.306 -14.243 1.00 0.00 C ATOM 1759 C LYS A 114 -20.975 -17.159 -14.354 1.00 0.00 C ATOM 1760 O LYS A 114 -21.606 -17.758 -15.230 1.00 0.00 O ATOM 1761 CB LYS A 114 -18.801 -17.115 -15.610 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.755 -15.666 -16.067 1.00 0.00 C ATOM 1763 CD LYS A 114 -18.119 -15.530 -17.443 1.00 0.00 C ATOM 1764 CE LYS A 114 -17.880 -14.074 -17.803 1.00 0.00 C ATOM 1765 NZ LYS A 114 -17.448 -13.915 -19.217 1.00 0.00 N ATOM 0 H LYS A 114 -18.915 -19.317 -14.419 1.00 0.00 H new ATOM 0 HA LYS A 114 -19.080 -16.539 -13.569 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -17.785 -17.507 -15.571 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -19.342 -17.704 -16.351 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.766 -15.260 -16.092 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -18.191 -15.074 -15.345 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -17.173 -16.071 -17.463 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -18.765 -15.990 -18.191 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -18.794 -13.504 -17.637 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -17.120 -13.657 -17.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -17.296 -12.907 -19.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -16.562 -14.437 -19.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -18.184 -14.289 -19.849 1.00 0.00 H new ATOM 1779 N ALA A 115 -21.554 -16.384 -13.448 1.00 0.00 N ATOM 1780 CA ALA A 115 -22.993 -16.163 -13.421 1.00 0.00 C ATOM 1781 C ALA A 115 -23.314 -14.721 -13.797 1.00 0.00 C ATOM 1782 O ALA A 115 -22.912 -13.786 -13.101 1.00 0.00 O ATOM 1783 CB ALA A 115 -23.557 -16.503 -12.046 1.00 0.00 C ATOM 0 H ALA A 115 -21.043 -15.893 -12.715 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.462 -16.820 -14.153 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -24.634 -16.333 -12.042 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.354 -17.550 -11.818 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -23.087 -15.870 -11.293 1.00 0.00 H new ATOM 1789 N ARG A 116 -24.009 -14.554 -14.920 1.00 0.00 N ATOM 1790 CA ARG A 116 -24.449 -13.240 -15.386 1.00 0.00 C ATOM 1791 C ARG A 116 -23.248 -12.298 -15.537 1.00 0.00 C ATOM 1792 O ARG A 116 -23.287 -11.140 -15.117 1.00 0.00 O ATOM 1793 CB ARG A 116 -25.496 -12.661 -14.407 1.00 0.00 C ATOM 1794 CG ARG A 116 -26.624 -11.874 -15.077 1.00 0.00 C ATOM 1795 CD ARG A 116 -26.131 -10.614 -15.776 1.00 0.00 C ATOM 1796 NE ARG A 116 -27.214 -9.904 -16.458 1.00 0.00 N ATOM 1797 CZ ARG A 116 -27.126 -8.644 -16.887 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -26.023 -7.937 -16.673 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -28.147 -8.088 -17.522 1.00 0.00 N ATOM 0 H ARG A 116 -24.283 -15.323 -15.531 1.00 0.00 H new ATOM 0 HA ARG A 116 -24.916 -13.343 -16.366 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.932 -13.480 -13.835 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -24.988 -12.010 -13.696 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -27.126 -12.514 -15.803 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -27.366 -11.601 -14.326 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -25.668 -9.952 -15.045 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -25.360 -10.879 -16.499 1.00 0.00 H new ATOM 0 HE ARG A 116 -28.090 -10.403 -16.615 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -25.236 -8.357 -16.178 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -25.962 -6.974 -17.004 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -29.000 -8.623 -17.683 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -28.080 -7.125 -17.850 1.00 0.00 H new ATOM 1813 N GLY A 117 -22.172 -12.810 -16.127 1.00 0.00 N ATOM 1814 CA GLY A 117 -20.999 -11.990 -16.379 1.00 0.00 C ATOM 1815 C GLY A 117 -20.034 -11.957 -15.212 1.00 0.00 C ATOM 1816 O GLY A 117 -18.852 -11.645 -15.377 1.00 0.00 O ATOM 0 H GLY A 117 -22.091 -13.779 -16.436 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -20.481 -12.369 -17.260 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -21.317 -10.973 -16.609 1.00 0.00 H new ATOM 1820 N ARG A 118 -20.531 -12.293 -14.032 1.00 0.00 N ATOM 1821 CA ARG A 118 -19.776 -12.131 -12.798 1.00 0.00 C ATOM 1822 C ARG A 118 -19.334 -13.488 -12.263 1.00 0.00 C ATOM 1823 O ARG A 118 -20.121 -14.429 -12.221 1.00 0.00 O ATOM 1824 CB ARG A 118 -20.656 -11.399 -11.779 1.00 0.00 C ATOM 1825 CG ARG A 118 -21.265 -10.110 -12.333 1.00 0.00 C ATOM 1826 CD ARG A 118 -22.433 -9.623 -11.491 1.00 0.00 C ATOM 1827 NE ARG A 118 -23.074 -8.438 -12.070 1.00 0.00 N ATOM 1828 CZ ARG A 118 -23.514 -7.395 -11.364 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -23.302 -7.326 -10.058 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -24.151 -6.407 -11.972 1.00 0.00 N ATOM 0 H ARG A 118 -21.464 -12.684 -13.902 1.00 0.00 H new ATOM 0 HA ARG A 118 -18.877 -11.544 -12.986 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -21.457 -12.063 -11.456 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -20.061 -11.163 -10.896 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -20.499 -9.335 -12.373 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -21.601 -10.279 -13.356 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -23.168 -10.422 -11.395 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -22.082 -9.390 -10.486 1.00 0.00 H new ATOM 0 HE ARG A 118 -23.192 -8.409 -13.083 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -22.798 -8.075 -9.583 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -23.643 -6.524 -9.528 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -24.305 -6.443 -12.980 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -24.488 -5.609 -11.433 1.00 0.00 H new ATOM 1844 N TRP A 119 -18.069 -13.589 -11.873 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.519 -14.841 -11.364 1.00 0.00 C ATOM 1846 C TRP A 119 -17.870 -15.047 -9.894 1.00 0.00 C ATOM 1847 O TRP A 119 -17.740 -14.131 -9.078 1.00 0.00 O ATOM 1848 CB TRP A 119 -16.001 -14.873 -11.571 1.00 0.00 C ATOM 1849 CG TRP A 119 -15.620 -15.142 -12.996 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -15.422 -14.226 -13.990 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.419 -16.427 -13.590 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -15.097 -14.867 -15.160 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -15.090 -16.218 -14.940 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -15.481 -17.734 -13.106 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -14.825 -17.267 -15.813 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -15.219 -18.777 -13.973 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -14.894 -18.538 -15.314 1.00 0.00 C ATOM 0 H TRP A 119 -17.403 -12.817 -11.899 1.00 0.00 H new ATOM 0 HA TRP A 119 -17.967 -15.661 -11.925 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -15.575 -13.920 -11.258 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -15.567 -15.641 -10.931 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -15.508 -13.156 -13.873 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -14.894 -14.410 -16.049 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.729 -17.927 -12.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -14.574 -17.085 -16.847 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.266 -19.793 -13.611 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.694 -19.374 -15.967 1.00 0.00 H new ATOM 1868 N TYR A 120 -18.324 -16.257 -9.576 1.00 0.00 N ATOM 1869 CA TYR A 120 -18.693 -16.632 -8.214 1.00 0.00 C ATOM 1870 C TYR A 120 -18.066 -17.978 -7.854 1.00 0.00 C ATOM 1871 O TYR A 120 -17.816 -18.805 -8.727 1.00 0.00 O ATOM 1872 CB TYR A 120 -20.222 -16.707 -8.074 1.00 0.00 C ATOM 1873 CG TYR A 120 -20.915 -15.367 -8.247 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -20.955 -14.452 -7.205 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.517 -15.013 -9.450 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -21.569 -13.226 -7.351 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -22.137 -13.786 -9.604 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.159 -12.897 -8.550 1.00 0.00 C ATOM 1879 OH TYR A 120 -22.766 -11.668 -8.697 1.00 0.00 O ATOM 0 H TYR A 120 -18.446 -17.006 -10.257 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.318 -15.871 -7.529 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.612 -17.406 -8.813 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.469 -17.110 -7.092 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -20.496 -14.705 -6.261 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -21.500 -15.707 -10.277 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -21.587 -12.527 -6.528 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.601 -13.526 -10.544 1.00 0.00 H new ATOM 0 HH TYR A 120 -23.594 -11.772 -9.210 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.808 -18.185 -6.570 1.00 0.00 N ATOM 1890 CA PHE A 121 -17.218 -19.430 -6.079 1.00 0.00 C ATOM 1891 C PHE A 121 -18.198 -20.595 -6.221 1.00 0.00 C ATOM 1892 O PHE A 121 -19.348 -20.492 -5.805 1.00 0.00 O ATOM 1893 CB PHE A 121 -16.796 -19.252 -4.613 1.00 0.00 C ATOM 1894 CG PHE A 121 -16.433 -20.534 -3.902 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -17.409 -21.283 -3.255 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -15.123 -20.988 -3.875 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -17.088 -22.453 -2.601 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -14.795 -22.157 -3.217 1.00 0.00 C ATOM 1899 CZ PHE A 121 -15.779 -22.891 -2.580 1.00 0.00 C ATOM 0 H PHE A 121 -18.000 -17.500 -5.839 1.00 0.00 H new ATOM 0 HA PHE A 121 -16.339 -19.664 -6.680 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.942 -18.576 -4.574 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -17.609 -18.769 -4.071 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -18.434 -20.943 -3.265 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -14.351 -20.421 -4.374 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -17.859 -23.026 -2.106 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -13.770 -22.498 -3.200 1.00 0.00 H new ATOM 0 HZ PHE A 121 -15.524 -23.806 -2.067 1.00 0.00 H new ATOM 1909 N SER A 122 -17.734 -21.700 -6.802 1.00 0.00 N ATOM 1910 CA SER A 122 -18.560 -22.897 -6.956 1.00 0.00 C ATOM 1911 C SER A 122 -18.203 -23.932 -5.894 1.00 0.00 C ATOM 1912 O SER A 122 -19.054 -24.365 -5.116 1.00 0.00 O ATOM 1913 CB SER A 122 -18.359 -23.502 -8.350 1.00 0.00 C ATOM 1914 OG SER A 122 -18.592 -22.541 -9.360 1.00 0.00 O ATOM 0 H SER A 122 -16.789 -21.792 -7.175 1.00 0.00 H new ATOM 0 HA SER A 122 -19.605 -22.611 -6.835 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.344 -23.889 -8.439 1.00 0.00 H new ATOM 0 HB3 SER A 122 -19.035 -24.347 -8.484 1.00 0.00 H new ATOM 0 HG SER A 122 -19.130 -21.807 -8.996 1.00 0.00 H new ATOM 1920 N GLU A 123 -16.928 -24.305 -5.863 1.00 0.00 N ATOM 1921 CA GLU A 123 -16.448 -25.362 -4.984 1.00 0.00 C ATOM 1922 C GLU A 123 -14.929 -25.285 -4.859 1.00 0.00 C ATOM 1923 O GLU A 123 -14.282 -24.506 -5.563 1.00 0.00 O ATOM 1924 CB GLU A 123 -16.883 -26.728 -5.533 1.00 0.00 C ATOM 1925 CG GLU A 123 -16.426 -26.981 -6.966 1.00 0.00 C ATOM 1926 CD GLU A 123 -17.135 -28.155 -7.616 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -16.660 -29.301 -7.479 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -18.175 -27.935 -8.275 1.00 0.00 O ATOM 0 H GLU A 123 -16.202 -23.885 -6.444 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.880 -25.234 -3.991 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.486 -27.513 -4.889 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -17.970 -26.799 -5.489 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -16.600 -26.084 -7.561 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.351 -27.164 -6.972 1.00 0.00 H new ATOM 1935 N GLY A 124 -14.370 -26.079 -3.956 1.00 0.00 N ATOM 1936 CA GLY A 124 -12.934 -26.084 -3.742 1.00 0.00 C ATOM 1937 C GLY A 124 -12.444 -27.438 -3.281 1.00 0.00 C ATOM 1938 O GLY A 124 -12.967 -27.992 -2.310 1.00 0.00 O ATOM 0 H GLY A 124 -14.890 -26.726 -3.362 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.427 -25.809 -4.667 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -12.674 -25.330 -2.999 1.00 0.00 H new ATOM 1942 N GLU A 125 -11.450 -27.977 -3.977 1.00 0.00 N ATOM 1943 CA GLU A 125 -10.920 -29.302 -3.675 1.00 0.00 C ATOM 1944 C GLU A 125 -9.405 -29.254 -3.499 1.00 0.00 C ATOM 1945 O GLU A 125 -8.722 -28.441 -4.126 1.00 0.00 O ATOM 1946 CB GLU A 125 -11.286 -30.283 -4.798 1.00 0.00 C ATOM 1947 CG GLU A 125 -10.764 -29.871 -6.172 1.00 0.00 C ATOM 1948 CD GLU A 125 -11.061 -30.903 -7.247 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -10.274 -31.868 -7.382 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -12.078 -30.761 -7.956 1.00 0.00 O ATOM 0 H GLU A 125 -10.991 -27.513 -4.761 1.00 0.00 H new ATOM 0 HA GLU A 125 -11.364 -29.644 -2.740 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -10.891 -31.268 -4.550 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -12.371 -30.378 -4.845 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -11.212 -28.918 -6.455 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.687 -29.712 -6.114 1.00 0.00 H new ATOM 1957 N ALA A 126 -8.886 -30.125 -2.642 1.00 0.00 N ATOM 1958 CA ALA A 126 -7.451 -30.235 -2.432 1.00 0.00 C ATOM 1959 C ALA A 126 -6.805 -30.950 -3.616 1.00 0.00 C ATOM 1960 O ALA A 126 -7.050 -32.138 -3.847 1.00 0.00 O ATOM 1961 CB ALA A 126 -7.158 -30.974 -1.130 1.00 0.00 C ATOM 0 H ALA A 126 -9.443 -30.768 -2.079 1.00 0.00 H new ATOM 0 HA ALA A 126 -7.027 -29.234 -2.356 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.080 -31.048 -0.988 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.597 -30.428 -0.295 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.587 -31.975 -1.175 1.00 0.00 H new