USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=33 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 3 CYS SG : rot -91:sc= 0.376 USER MOD Set 1.2: A 5 CYS SG : rot 7:sc= -7.62! USER MOD Set 1.3: A 7 SER OG : rot 180:sc= -0.0336 USER MOD Set 1.4: A 14 CYS SG : rot -77:sc= -0.038 USER MOD Set 1.5: A 15 CYS SG : rot 109:sc= -2.51! USER MOD Single : A 9 LYS NZ :NH3+ -136:sc= 0.0817 (180deg=0) USER MOD Single : A 10 THR OG1 : rot -128:sc= -0.223 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -19:sc= 0.182 USER MOD Single : A 24 SER OG : rot 150:sc= -0.212 USER MOD Single : A 27 SER OG : rot 180:sc= -0.0265 USER MOD Single : A 32 MET CE :methyl -148:sc= -1.84 (180deg=-4.49!) USER MOD Single : A 34 SER OG : rot -92:sc= 1 USER MOD Single : A 36 TYR OH : rot 180:sc= -0.539 USER MOD Single : A 39 TYR OH : rot -136:sc= 0.336 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot -178:sc= -0.982 USER MOD Single : A 50 THR OG1 : rot -78:sc= 1.76 USER MOD Single : A 51 THR OG1 : rot 62:sc= 0.995 USER MOD Single : A 61 HIS :FLIP no HD1:sc= 0.0229 F(o=-0.69,f=0.023) USER MOD Single : A 64 ASN :FLIP amide:sc= -0.732 F(o=-1.9,f=-0.73) USER MOD Single : A 68 MET CE :methyl 155:sc= -1.21 (180deg=-2.54!) USER MOD Single : A 71 SER OG : rot 83:sc= 0.379 USER MOD Single : A 81 SER OG : rot 168:sc= 0.824 USER MOD Single : A 82 SER OG : rot 180:sc= -0.0539 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot -157:sc= 0.4 USER MOD Single : A 104 GLN : amide:sc= -0.0134 X(o=-0.013,f=-0.15) USER MOD Single : A 105 SER OG : rot 46:sc= 0.0839 USER MOD Single : A 106 HIS : no HD1:sc= -0.885 K(o=-0.88,f=-4.9!) USER MOD Single : A 107 HIS : no HE2:sc= -0.119 K(o=-0.12,f=-2.9!) USER MOD Single : A 110 SER OG : rot -112:sc= 0.489 USER MOD Single : A 111 GLN :FLIP amide:sc= -0.471 F(o=-1.6!,f=-0.47) USER MOD Single : A 114 LYS NZ :NH3+ 177:sc= 1.12 (180deg=1.12) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -58:sc= -0.371 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.533 -4.599 -1.477 1.00 0.00 N ATOM 35 CA CYS A 3 -2.765 -5.313 -1.179 1.00 0.00 C ATOM 36 C CYS A 3 -2.473 -6.790 -0.999 1.00 0.00 C ATOM 37 O CYS A 3 -1.888 -7.412 -1.887 1.00 0.00 O ATOM 38 CB CYS A 3 -3.769 -5.130 -2.319 1.00 0.00 C ATOM 39 SG CYS A 3 -5.514 -5.268 -1.829 1.00 0.00 S ATOM 0 HA CYS A 3 -3.189 -4.911 -0.259 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -3.610 -4.151 -2.771 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -3.563 -5.874 -3.089 1.00 0.00 H new ATOM 0 HG CYS A 3 -5.902 -6.503 -1.947 1.00 0.00 H new ATOM 44 N VAL A 4 -2.868 -7.344 0.143 1.00 0.00 N ATOM 45 CA VAL A 4 -2.772 -8.781 0.372 1.00 0.00 C ATOM 46 C VAL A 4 -3.571 -9.541 -0.688 1.00 0.00 C ATOM 47 O VAL A 4 -4.727 -9.914 -0.492 1.00 0.00 O ATOM 48 CB VAL A 4 -3.245 -9.165 1.795 1.00 0.00 C ATOM 49 CG1 VAL A 4 -2.210 -8.728 2.828 1.00 0.00 C ATOM 50 CG2 VAL A 4 -4.608 -8.539 2.094 1.00 0.00 C ATOM 0 H VAL A 4 -3.258 -6.818 0.925 1.00 0.00 H new ATOM 0 HA VAL A 4 -1.722 -9.063 0.291 1.00 0.00 H new ATOM 0 HB VAL A 4 -3.351 -10.248 1.849 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -2.553 -9.003 3.825 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -1.260 -9.221 2.622 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -2.077 -7.647 2.775 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -4.925 -8.820 3.098 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -4.532 -7.454 2.027 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.340 -8.897 1.370 1.00 0.00 H new ATOM 60 N CYS A 5 -2.943 -9.701 -1.839 1.00 0.00 N ATOM 61 CA CYS A 5 -3.542 -10.357 -2.992 1.00 0.00 C ATOM 62 C CYS A 5 -2.454 -10.733 -3.990 1.00 0.00 C ATOM 63 O CYS A 5 -1.435 -10.047 -4.079 1.00 0.00 O ATOM 64 CB CYS A 5 -4.556 -9.441 -3.687 1.00 0.00 C ATOM 65 SG CYS A 5 -5.973 -8.947 -2.661 1.00 0.00 S ATOM 0 H CYS A 5 -1.990 -9.376 -2.003 1.00 0.00 H new ATOM 0 HA CYS A 5 -4.059 -11.250 -2.640 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -4.040 -8.542 -4.024 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -4.930 -9.947 -4.577 1.00 0.00 H new ATOM 0 HG CYS A 5 -5.793 -9.365 -1.443 1.00 0.00 H new ATOM 70 N GLY A 6 -2.672 -11.811 -4.737 1.00 0.00 N ATOM 71 CA GLY A 6 -1.746 -12.185 -5.793 1.00 0.00 C ATOM 72 C GLY A 6 -1.833 -11.236 -6.975 1.00 0.00 C ATOM 73 O GLY A 6 -2.375 -11.589 -8.023 1.00 0.00 O ATOM 0 H GLY A 6 -3.473 -12.433 -4.631 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -0.729 -12.187 -5.402 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -1.962 -13.201 -6.124 1.00 0.00 H new ATOM 77 N SER A 7 -1.326 -10.019 -6.788 1.00 0.00 N ATOM 78 CA SER A 7 -1.336 -8.998 -7.830 1.00 0.00 C ATOM 79 C SER A 7 -0.376 -7.864 -7.469 1.00 0.00 C ATOM 80 O SER A 7 0.564 -7.571 -8.208 1.00 0.00 O ATOM 81 CB SER A 7 -2.761 -8.459 -8.034 1.00 0.00 C ATOM 82 OG SER A 7 -3.333 -8.002 -6.814 1.00 0.00 O ATOM 0 H SER A 7 -0.899 -9.715 -5.913 1.00 0.00 H new ATOM 0 HA SER A 7 -1.002 -9.447 -8.765 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.741 -7.641 -8.755 1.00 0.00 H new ATOM 0 HB3 SER A 7 -3.389 -9.243 -8.459 1.00 0.00 H new ATOM 0 HG SER A 7 -4.238 -7.665 -6.983 1.00 0.00 H new ATOM 88 N GLY A 8 -0.626 -7.229 -6.327 1.00 0.00 N ATOM 89 CA GLY A 8 0.269 -6.194 -5.829 1.00 0.00 C ATOM 90 C GLY A 8 -0.354 -4.811 -5.853 1.00 0.00 C ATOM 91 O GLY A 8 0.095 -3.916 -5.137 1.00 0.00 O ATOM 0 H GLY A 8 -1.435 -7.413 -5.734 1.00 0.00 H new ATOM 0 HA2 GLY A 8 0.563 -6.436 -4.808 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.178 -6.188 -6.430 1.00 0.00 H new ATOM 95 N LYS A 9 -1.397 -4.639 -6.669 1.00 0.00 N ATOM 96 CA LYS A 9 -2.057 -3.337 -6.813 1.00 0.00 C ATOM 97 C LYS A 9 -2.606 -2.853 -5.475 1.00 0.00 C ATOM 98 O LYS A 9 -2.814 -3.650 -4.560 1.00 0.00 O ATOM 99 CB LYS A 9 -3.189 -3.403 -7.847 1.00 0.00 C ATOM 100 CG LYS A 9 -2.776 -4.041 -9.169 1.00 0.00 C ATOM 101 CD LYS A 9 -3.545 -3.464 -10.359 1.00 0.00 C ATOM 102 CE LYS A 9 -5.052 -3.645 -10.223 1.00 0.00 C ATOM 103 NZ LYS A 9 -5.792 -2.951 -11.310 1.00 0.00 N ATOM 0 H LYS A 9 -1.802 -5.382 -7.239 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.307 -2.627 -7.162 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -4.021 -3.967 -7.426 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.553 -2.394 -8.039 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.707 -3.892 -9.323 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.944 -5.117 -9.118 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -3.317 -2.402 -10.455 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -3.206 -3.947 -11.275 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -5.293 -4.708 -10.240 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.379 -3.259 -9.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.609 -2.448 -10.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.162 -2.269 -11.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.124 -3.650 -12.005 1.00 0.00 H new ATOM 117 N THR A 10 -2.868 -1.553 -5.386 1.00 0.00 N ATOM 118 CA THR A 10 -3.290 -0.920 -4.135 1.00 0.00 C ATOM 119 C THR A 10 -4.641 -1.454 -3.652 1.00 0.00 C ATOM 120 O THR A 10 -5.263 -2.303 -4.302 1.00 0.00 O ATOM 121 CB THR A 10 -3.398 0.611 -4.296 1.00 0.00 C ATOM 122 OG1 THR A 10 -4.456 0.927 -5.210 1.00 0.00 O ATOM 123 CG2 THR A 10 -2.091 1.206 -4.803 1.00 0.00 C ATOM 0 H THR A 10 -2.795 -0.909 -6.173 1.00 0.00 H new ATOM 0 HA THR A 10 -2.527 -1.162 -3.396 1.00 0.00 H new ATOM 0 HB THR A 10 -3.613 1.041 -3.318 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.121 1.536 -5.901 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.199 2.286 -4.906 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.292 0.987 -4.094 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.845 0.772 -5.772 1.00 0.00 H new ATOM 131 N TYR A 11 -5.092 -0.946 -2.508 1.00 0.00 N ATOM 132 CA TYR A 11 -6.392 -1.312 -1.960 1.00 0.00 C ATOM 133 C TYR A 11 -7.498 -1.045 -2.981 1.00 0.00 C ATOM 134 O TYR A 11 -8.217 -1.968 -3.388 1.00 0.00 O ATOM 135 CB TYR A 11 -6.660 -0.532 -0.663 1.00 0.00 C ATOM 136 CG TYR A 11 -8.048 -0.751 -0.085 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.380 -1.943 0.553 1.00 0.00 C ATOM 138 CD2 TYR A 11 -9.030 0.233 -0.184 1.00 0.00 C ATOM 139 CE1 TYR A 11 -9.644 -2.145 1.074 1.00 0.00 C ATOM 140 CE2 TYR A 11 -10.295 0.035 0.334 1.00 0.00 C ATOM 141 CZ TYR A 11 -10.597 -1.154 0.962 1.00 0.00 C ATOM 142 OH TYR A 11 -11.858 -1.354 1.478 1.00 0.00 O ATOM 0 H TYR A 11 -4.572 -0.276 -1.941 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.385 -2.378 -1.732 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -5.918 -0.820 0.082 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.522 0.532 -0.856 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -7.638 -2.722 0.642 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.798 1.167 -0.674 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -9.885 -3.075 1.567 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -11.044 0.808 0.247 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.408 -0.559 1.316 1.00 0.00 H new ATOM 152 N ASP A 12 -7.606 0.211 -3.409 1.00 0.00 N ATOM 153 CA ASP A 12 -8.645 0.624 -4.351 1.00 0.00 C ATOM 154 C ASP A 12 -8.410 0.016 -5.727 1.00 0.00 C ATOM 155 O ASP A 12 -9.296 -0.634 -6.281 1.00 0.00 O ATOM 156 CB ASP A 12 -8.701 2.152 -4.463 1.00 0.00 C ATOM 157 CG ASP A 12 -9.764 2.629 -5.448 1.00 0.00 C ATOM 158 OD1 ASP A 12 -10.943 2.744 -5.047 1.00 0.00 O ATOM 159 OD2 ASP A 12 -9.426 2.890 -6.624 1.00 0.00 O ATOM 0 H ASP A 12 -6.983 0.964 -3.117 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.599 0.261 -3.968 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -8.904 2.578 -3.480 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -7.726 2.526 -4.777 1.00 0.00 H new ATOM 164 N ASP A 13 -7.206 0.207 -6.264 1.00 0.00 N ATOM 165 CA ASP A 13 -6.873 -0.272 -7.611 1.00 0.00 C ATOM 166 C ASP A 13 -7.133 -1.767 -7.745 1.00 0.00 C ATOM 167 O ASP A 13 -7.434 -2.263 -8.831 1.00 0.00 O ATOM 168 CB ASP A 13 -5.407 0.031 -7.957 1.00 0.00 C ATOM 169 CG ASP A 13 -5.183 1.481 -8.358 1.00 0.00 C ATOM 170 OD1 ASP A 13 -5.080 2.350 -7.464 1.00 0.00 O ATOM 171 OD2 ASP A 13 -5.118 1.758 -9.573 1.00 0.00 O ATOM 0 H ASP A 13 -6.443 0.690 -5.790 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.518 0.259 -8.311 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.780 -0.204 -7.097 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -5.089 -0.620 -8.772 1.00 0.00 H new ATOM 176 N CYS A 14 -7.004 -2.487 -6.638 1.00 0.00 N ATOM 177 CA CYS A 14 -7.247 -3.923 -6.634 1.00 0.00 C ATOM 178 C CYS A 14 -8.650 -4.263 -6.111 1.00 0.00 C ATOM 179 O CYS A 14 -9.558 -4.526 -6.896 1.00 0.00 O ATOM 180 CB CYS A 14 -6.165 -4.646 -5.822 1.00 0.00 C ATOM 181 SG CYS A 14 -6.599 -6.349 -5.357 1.00 0.00 S ATOM 0 H CYS A 14 -6.733 -2.101 -5.734 1.00 0.00 H new ATOM 0 HA CYS A 14 -7.198 -4.272 -7.666 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -5.242 -4.663 -6.401 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -5.963 -4.074 -4.917 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.441 -6.327 -4.367 1.00 0.00 H new ATOM 186 N CYS A 15 -8.827 -4.267 -4.789 1.00 0.00 N ATOM 187 CA CYS A 15 -10.089 -4.711 -4.176 1.00 0.00 C ATOM 188 C CYS A 15 -11.219 -3.690 -4.330 1.00 0.00 C ATOM 189 O CYS A 15 -12.392 -4.055 -4.247 1.00 0.00 O ATOM 190 CB CYS A 15 -9.879 -5.051 -2.695 1.00 0.00 C ATOM 191 SG CYS A 15 -9.040 -6.645 -2.411 1.00 0.00 S ATOM 0 H CYS A 15 -8.117 -3.969 -4.120 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.397 -5.608 -4.714 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.295 -4.257 -2.230 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.848 -5.068 -2.196 1.00 0.00 H new ATOM 0 HG CYS A 15 -7.834 -6.429 -1.978 1.00 0.00 H new ATOM 196 N GLY A 16 -10.865 -2.426 -4.559 1.00 0.00 N ATOM 197 CA GLY A 16 -11.844 -1.342 -4.518 1.00 0.00 C ATOM 198 C GLY A 16 -13.097 -1.582 -5.357 1.00 0.00 C ATOM 199 O GLY A 16 -14.207 -1.540 -4.818 1.00 0.00 O ATOM 0 H GLY A 16 -9.913 -2.129 -4.774 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -12.142 -1.179 -3.482 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.365 -0.425 -4.860 1.00 0.00 H new ATOM 203 N PRO A 17 -12.966 -1.867 -6.671 1.00 0.00 N ATOM 204 CA PRO A 17 -14.128 -2.044 -7.550 1.00 0.00 C ATOM 205 C PRO A 17 -14.919 -3.314 -7.230 1.00 0.00 C ATOM 206 O PRO A 17 -16.142 -3.354 -7.399 1.00 0.00 O ATOM 207 CB PRO A 17 -13.519 -2.107 -8.960 1.00 0.00 C ATOM 208 CG PRO A 17 -12.101 -2.525 -8.757 1.00 0.00 C ATOM 209 CD PRO A 17 -11.691 -2.001 -7.404 1.00 0.00 C ATOM 0 HA PRO A 17 -14.850 -1.236 -7.432 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -14.053 -2.820 -9.588 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -13.577 -1.139 -9.457 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -12.007 -3.610 -8.798 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -11.461 -2.120 -9.541 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -11.011 -2.687 -6.900 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.175 -1.044 -7.486 1.00 0.00 H new ATOM 217 N LEU A 18 -14.217 -4.337 -6.747 1.00 0.00 N ATOM 218 CA LEU A 18 -14.841 -5.619 -6.425 1.00 0.00 C ATOM 219 C LEU A 18 -15.708 -5.493 -5.176 1.00 0.00 C ATOM 220 O LEU A 18 -16.889 -5.846 -5.185 1.00 0.00 O ATOM 221 CB LEU A 18 -13.774 -6.713 -6.212 1.00 0.00 C ATOM 222 CG LEU A 18 -13.020 -7.180 -7.474 1.00 0.00 C ATOM 223 CD1 LEU A 18 -13.998 -7.598 -8.565 1.00 0.00 C ATOM 224 CD2 LEU A 18 -12.066 -6.104 -7.983 1.00 0.00 C ATOM 0 H LEU A 18 -13.213 -4.303 -6.570 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.470 -5.906 -7.267 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -13.043 -6.344 -5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -14.257 -7.580 -5.760 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.422 -8.049 -7.200 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.444 -7.923 -9.445 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.618 -8.418 -8.203 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.633 -6.752 -8.828 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.551 -6.466 -8.873 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.630 -5.205 -8.231 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.334 -5.871 -7.210 1.00 0.00 H new ATOM 236 N LEU A 19 -15.116 -4.956 -4.114 1.00 0.00 N ATOM 237 CA LEU A 19 -15.798 -4.815 -2.829 1.00 0.00 C ATOM 238 C LEU A 19 -16.931 -3.794 -2.920 1.00 0.00 C ATOM 239 O LEU A 19 -17.918 -3.885 -2.191 1.00 0.00 O ATOM 240 CB LEU A 19 -14.790 -4.416 -1.738 1.00 0.00 C ATOM 241 CG LEU A 19 -13.818 -5.531 -1.301 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.671 -4.964 -0.469 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.552 -6.611 -0.514 1.00 0.00 C ATOM 0 H LEU A 19 -14.157 -4.608 -4.117 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.238 -5.776 -2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -14.207 -3.568 -2.097 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.343 -4.075 -0.863 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.401 -5.979 -2.203 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -12.001 -5.772 -0.174 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -12.120 -4.233 -1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -13.072 -4.482 0.423 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.847 -7.387 -0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.003 -6.170 0.375 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -15.332 -7.049 -1.137 1.00 0.00 H new ATOM 255 N ALA A 20 -16.788 -2.833 -3.829 1.00 0.00 N ATOM 256 CA ALA A 20 -17.812 -1.810 -4.041 1.00 0.00 C ATOM 257 C ALA A 20 -18.905 -2.307 -4.989 1.00 0.00 C ATOM 258 O ALA A 20 -19.887 -1.607 -5.233 1.00 0.00 O ATOM 259 CB ALA A 20 -17.178 -0.536 -4.588 1.00 0.00 C ATOM 0 H ALA A 20 -15.971 -2.740 -4.433 1.00 0.00 H new ATOM 0 HA ALA A 20 -18.275 -1.592 -3.079 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -17.950 0.218 -4.742 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -16.442 -0.162 -3.877 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -16.688 -0.752 -5.537 1.00 0.00 H new ATOM 265 N ARG A 21 -18.708 -3.511 -5.538 1.00 0.00 N ATOM 266 CA ARG A 21 -19.648 -4.120 -6.493 1.00 0.00 C ATOM 267 C ARG A 21 -19.773 -3.304 -7.788 1.00 0.00 C ATOM 268 O ARG A 21 -20.541 -3.670 -8.681 1.00 0.00 O ATOM 269 CB ARG A 21 -21.049 -4.309 -5.876 1.00 0.00 C ATOM 270 CG ARG A 21 -21.182 -5.485 -4.905 1.00 0.00 C ATOM 271 CD ARG A 21 -20.588 -5.199 -3.530 1.00 0.00 C ATOM 272 NE ARG A 21 -21.124 -6.122 -2.524 1.00 0.00 N ATOM 273 CZ ARG A 21 -20.634 -6.276 -1.293 1.00 0.00 C ATOM 274 NH1 ARG A 21 -19.563 -5.595 -0.902 1.00 0.00 N ATOM 275 NH2 ARG A 21 -21.232 -7.112 -0.453 1.00 0.00 N ATOM 0 H ARG A 21 -17.895 -4.092 -5.335 1.00 0.00 H new ATOM 0 HA ARG A 21 -19.231 -5.097 -6.737 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -21.324 -3.394 -5.352 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.769 -4.443 -6.684 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -22.236 -5.738 -4.793 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -20.689 -6.358 -5.332 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.503 -5.292 -3.572 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -20.809 -4.172 -3.241 1.00 0.00 H new ATOM 0 HE ARG A 21 -21.931 -6.688 -2.785 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.108 -4.947 -1.545 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -19.196 -5.720 0.041 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -22.059 -7.630 -0.751 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -20.865 -7.237 0.490 1.00 0.00 H new ATOM 289 N THR A 22 -19.010 -2.218 -7.904 1.00 0.00 N ATOM 290 CA THR A 22 -19.111 -1.339 -9.066 1.00 0.00 C ATOM 291 C THR A 22 -18.548 -2.022 -10.312 1.00 0.00 C ATOM 292 O THR A 22 -18.801 -1.593 -11.439 1.00 0.00 O ATOM 293 CB THR A 22 -18.392 0.015 -8.831 1.00 0.00 C ATOM 294 OG1 THR A 22 -18.600 0.887 -9.952 1.00 0.00 O ATOM 295 CG2 THR A 22 -16.897 -0.175 -8.607 1.00 0.00 C ATOM 0 H THR A 22 -18.319 -1.928 -7.212 1.00 0.00 H new ATOM 0 HA THR A 22 -20.170 -1.132 -9.221 1.00 0.00 H new ATOM 0 HB THR A 22 -18.818 0.461 -7.933 1.00 0.00 H new ATOM 0 HG1 THR A 22 -18.882 0.360 -10.729 1.00 0.00 H new ATOM 0 HG21 THR A 22 -16.427 0.795 -8.446 1.00 0.00 H new ATOM 0 HG22 THR A 22 -16.737 -0.805 -7.732 1.00 0.00 H new ATOM 0 HG23 THR A 22 -16.456 -0.651 -9.483 1.00 0.00 H new ATOM 303 N ARG A 23 -17.788 -3.091 -10.098 1.00 0.00 N ATOM 304 CA ARG A 23 -17.244 -3.882 -11.192 1.00 0.00 C ATOM 305 C ARG A 23 -17.010 -5.317 -10.741 1.00 0.00 C ATOM 306 O ARG A 23 -16.422 -5.554 -9.684 1.00 0.00 O ATOM 307 CB ARG A 23 -15.927 -3.280 -11.698 1.00 0.00 C ATOM 308 CG ARG A 23 -15.264 -4.115 -12.788 1.00 0.00 C ATOM 309 CD ARG A 23 -13.942 -3.520 -13.250 1.00 0.00 C ATOM 310 NE ARG A 23 -13.320 -4.344 -14.288 1.00 0.00 N ATOM 311 CZ ARG A 23 -12.009 -4.410 -14.519 1.00 0.00 C ATOM 312 NH1 ARG A 23 -11.156 -3.688 -13.799 1.00 0.00 N ATOM 313 NH2 ARG A 23 -11.558 -5.201 -15.482 1.00 0.00 N ATOM 0 H ARG A 23 -17.535 -3.430 -9.170 1.00 0.00 H new ATOM 0 HA ARG A 23 -17.968 -3.874 -12.006 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -16.117 -2.278 -12.082 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -15.238 -3.175 -10.860 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -15.094 -5.125 -12.416 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -15.939 -4.198 -13.640 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -14.108 -2.513 -13.633 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.265 -3.430 -12.400 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.934 -4.908 -14.876 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.503 -3.075 -13.061 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -10.155 -3.747 -13.985 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.212 -5.752 -16.038 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -10.557 -5.259 -15.667 1.00 0.00 H new ATOM 327 N SER A 24 -17.482 -6.268 -11.536 1.00 0.00 N ATOM 328 CA SER A 24 -17.210 -7.676 -11.289 1.00 0.00 C ATOM 329 C SER A 24 -15.917 -8.081 -11.995 1.00 0.00 C ATOM 330 O SER A 24 -15.614 -7.583 -13.081 1.00 0.00 O ATOM 331 CB SER A 24 -18.388 -8.538 -11.760 1.00 0.00 C ATOM 332 OG SER A 24 -18.758 -8.235 -13.097 1.00 0.00 O ATOM 0 H SER A 24 -18.057 -6.088 -12.359 1.00 0.00 H new ATOM 0 HA SER A 24 -17.086 -7.836 -10.218 1.00 0.00 H new ATOM 0 HB2 SER A 24 -18.120 -9.592 -11.686 1.00 0.00 H new ATOM 0 HB3 SER A 24 -19.242 -8.379 -11.101 1.00 0.00 H new ATOM 0 HG SER A 24 -19.124 -9.037 -13.525 1.00 0.00 H new ATOM 338 N ALA A 25 -15.160 -8.978 -11.367 1.00 0.00 N ATOM 339 CA ALA A 25 -13.854 -9.396 -11.877 1.00 0.00 C ATOM 340 C ALA A 25 -13.952 -10.007 -13.277 1.00 0.00 C ATOM 341 O ALA A 25 -13.022 -9.894 -14.073 1.00 0.00 O ATOM 342 CB ALA A 25 -13.216 -10.386 -10.913 1.00 0.00 C ATOM 0 H ALA A 25 -15.431 -9.434 -10.496 1.00 0.00 H new ATOM 0 HA ALA A 25 -13.228 -8.507 -11.955 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -12.244 -10.694 -11.298 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.088 -9.914 -9.939 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.859 -11.260 -10.811 1.00 0.00 H new ATOM 348 N ALA A 26 -15.073 -10.679 -13.551 1.00 0.00 N ATOM 349 CA ALA A 26 -15.321 -11.302 -14.858 1.00 0.00 C ATOM 350 C ALA A 26 -14.250 -12.345 -15.204 1.00 0.00 C ATOM 351 O ALA A 26 -14.167 -12.813 -16.340 1.00 0.00 O ATOM 352 CB ALA A 26 -15.410 -10.233 -15.947 1.00 0.00 C ATOM 0 H ALA A 26 -15.831 -10.807 -12.880 1.00 0.00 H new ATOM 0 HA ALA A 26 -16.275 -11.826 -14.801 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -15.594 -10.709 -16.910 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -16.227 -9.548 -15.719 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -14.473 -9.678 -15.990 1.00 0.00 H new ATOM 358 N SER A 27 -13.469 -12.742 -14.203 1.00 0.00 N ATOM 359 CA SER A 27 -12.378 -13.695 -14.386 1.00 0.00 C ATOM 360 C SER A 27 -12.187 -14.503 -13.100 1.00 0.00 C ATOM 361 O SER A 27 -12.239 -13.937 -12.005 1.00 0.00 O ATOM 362 CB SER A 27 -11.084 -12.951 -14.756 1.00 0.00 C ATOM 363 OG SER A 27 -9.999 -13.848 -14.928 1.00 0.00 O ATOM 0 H SER A 27 -13.574 -12.413 -13.243 1.00 0.00 H new ATOM 0 HA SER A 27 -12.624 -14.378 -15.199 1.00 0.00 H new ATOM 0 HB2 SER A 27 -11.239 -12.385 -15.675 1.00 0.00 H new ATOM 0 HB3 SER A 27 -10.841 -12.231 -13.975 1.00 0.00 H new ATOM 0 HG SER A 27 -9.192 -13.344 -15.164 1.00 0.00 H new ATOM 369 N PRO A 28 -11.971 -15.833 -13.208 1.00 0.00 N ATOM 370 CA PRO A 28 -11.844 -16.712 -12.035 1.00 0.00 C ATOM 371 C PRO A 28 -10.666 -16.310 -11.145 1.00 0.00 C ATOM 372 O PRO A 28 -10.808 -16.180 -9.927 1.00 0.00 O ATOM 373 CB PRO A 28 -11.628 -18.111 -12.645 1.00 0.00 C ATOM 374 CG PRO A 28 -11.159 -17.858 -14.041 1.00 0.00 C ATOM 375 CD PRO A 28 -11.824 -16.579 -14.474 1.00 0.00 C ATOM 0 HA PRO A 28 -12.718 -16.662 -11.386 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.890 -18.679 -12.078 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.551 -18.691 -12.638 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -10.074 -17.766 -14.078 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -11.431 -18.682 -14.700 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.216 -16.033 -15.196 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.788 -16.766 -14.946 1.00 0.00 H new ATOM 383 N GLU A 29 -9.512 -16.093 -11.768 1.00 0.00 N ATOM 384 CA GLU A 29 -8.303 -15.698 -11.049 1.00 0.00 C ATOM 385 C GLU A 29 -8.487 -14.322 -10.405 1.00 0.00 C ATOM 386 O GLU A 29 -8.132 -14.110 -9.241 1.00 0.00 O ATOM 387 CB GLU A 29 -7.105 -15.671 -12.008 1.00 0.00 C ATOM 388 CG GLU A 29 -7.343 -14.812 -13.244 1.00 0.00 C ATOM 389 CD GLU A 29 -6.102 -14.638 -14.101 1.00 0.00 C ATOM 390 OE1 GLU A 29 -5.260 -13.779 -13.765 1.00 0.00 O ATOM 391 OE2 GLU A 29 -5.969 -15.347 -15.120 1.00 0.00 O ATOM 0 H GLU A 29 -9.387 -16.185 -12.776 1.00 0.00 H new ATOM 0 HA GLU A 29 -8.114 -16.428 -10.262 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.231 -15.296 -11.476 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.875 -16.690 -12.320 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.132 -15.264 -13.846 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.702 -13.831 -12.933 1.00 0.00 H new ATOM 398 N ALA A 30 -9.061 -13.398 -11.173 1.00 0.00 N ATOM 399 CA ALA A 30 -9.266 -12.030 -10.717 1.00 0.00 C ATOM 400 C ALA A 30 -10.226 -11.993 -9.532 1.00 0.00 C ATOM 401 O ALA A 30 -10.024 -11.241 -8.578 1.00 0.00 O ATOM 402 CB ALA A 30 -9.782 -11.162 -11.859 1.00 0.00 C ATOM 0 H ALA A 30 -9.394 -13.577 -12.121 1.00 0.00 H new ATOM 0 HA ALA A 30 -8.308 -11.630 -10.386 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.930 -10.143 -11.503 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -9.056 -11.160 -12.672 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.730 -11.562 -12.220 1.00 0.00 H new ATOM 408 N LEU A 31 -11.257 -12.824 -9.595 1.00 0.00 N ATOM 409 CA LEU A 31 -12.254 -12.899 -8.533 1.00 0.00 C ATOM 410 C LEU A 31 -11.636 -13.524 -7.286 1.00 0.00 C ATOM 411 O LEU A 31 -11.901 -13.092 -6.163 1.00 0.00 O ATOM 412 CB LEU A 31 -13.472 -13.709 -9.028 1.00 0.00 C ATOM 413 CG LEU A 31 -14.732 -13.708 -8.133 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.591 -14.657 -6.944 1.00 0.00 C ATOM 415 CD2 LEU A 31 -15.060 -12.291 -7.664 1.00 0.00 C ATOM 0 H LEU A 31 -11.426 -13.460 -10.375 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.594 -11.897 -8.271 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.755 -13.328 -10.009 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -13.156 -14.743 -9.166 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.561 -14.074 -8.739 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.499 -14.624 -6.342 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.432 -15.673 -7.306 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.741 -14.352 -6.334 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -15.950 -12.313 -7.035 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -14.221 -11.894 -7.092 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -15.243 -11.654 -8.530 1.00 0.00 H new ATOM 427 N MET A 32 -10.793 -14.529 -7.496 1.00 0.00 N ATOM 428 CA MET A 32 -10.182 -15.259 -6.391 1.00 0.00 C ATOM 429 C MET A 32 -9.275 -14.356 -5.549 1.00 0.00 C ATOM 430 O MET A 32 -9.428 -14.288 -4.328 1.00 0.00 O ATOM 431 CB MET A 32 -9.388 -16.467 -6.915 1.00 0.00 C ATOM 432 CG MET A 32 -8.729 -17.295 -5.813 1.00 0.00 C ATOM 433 SD MET A 32 -7.369 -16.425 -5.001 1.00 0.00 S ATOM 434 CE MET A 32 -7.142 -17.431 -3.539 1.00 0.00 C ATOM 0 H MET A 32 -10.517 -14.857 -8.422 1.00 0.00 H new ATOM 0 HA MET A 32 -10.988 -15.615 -5.749 1.00 0.00 H new ATOM 0 HB2 MET A 32 -10.057 -17.109 -7.488 1.00 0.00 H new ATOM 0 HB3 MET A 32 -8.618 -16.114 -7.602 1.00 0.00 H new ATOM 0 HG2 MET A 32 -9.479 -17.563 -5.069 1.00 0.00 H new ATOM 0 HG3 MET A 32 -8.356 -18.226 -6.239 1.00 0.00 H new ATOM 0 HE1 MET A 32 -6.808 -16.803 -2.713 1.00 0.00 H new ATOM 0 HE2 MET A 32 -8.086 -17.906 -3.274 1.00 0.00 H new ATOM 0 HE3 MET A 32 -6.393 -18.198 -3.738 1.00 0.00 H new ATOM 444 N ARG A 33 -8.347 -13.641 -6.194 1.00 0.00 N ATOM 445 CA ARG A 33 -7.340 -12.878 -5.446 1.00 0.00 C ATOM 446 C ARG A 33 -7.952 -11.629 -4.806 1.00 0.00 C ATOM 447 O ARG A 33 -7.396 -11.074 -3.856 1.00 0.00 O ATOM 448 CB ARG A 33 -6.099 -12.542 -6.310 1.00 0.00 C ATOM 449 CG ARG A 33 -6.090 -11.177 -7.006 1.00 0.00 C ATOM 450 CD ARG A 33 -7.100 -11.075 -8.141 1.00 0.00 C ATOM 451 NE ARG A 33 -6.725 -10.032 -9.103 1.00 0.00 N ATOM 452 CZ ARG A 33 -7.546 -9.085 -9.566 1.00 0.00 C ATOM 453 NH1 ARG A 33 -8.808 -9.020 -9.158 1.00 0.00 N ATOM 454 NH2 ARG A 33 -7.101 -8.211 -10.457 1.00 0.00 N ATOM 0 H ARG A 33 -8.271 -13.574 -7.209 1.00 0.00 H new ATOM 0 HA ARG A 33 -6.986 -13.517 -4.637 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -5.216 -12.605 -5.675 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -5.998 -13.313 -7.074 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.300 -10.400 -6.271 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -5.092 -10.983 -7.398 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -7.172 -12.035 -8.653 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -8.087 -10.857 -7.733 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.764 -10.030 -9.444 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.161 -9.698 -8.483 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -9.424 -8.292 -9.520 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.137 -8.264 -10.785 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.723 -7.486 -10.814 1.00 0.00 H new ATOM 468 N SER A 34 -9.085 -11.177 -5.339 1.00 0.00 N ATOM 469 CA SER A 34 -9.857 -10.107 -4.711 1.00 0.00 C ATOM 470 C SER A 34 -10.633 -10.660 -3.517 1.00 0.00 C ATOM 471 O SER A 34 -10.761 -10.000 -2.484 1.00 0.00 O ATOM 472 CB SER A 34 -10.809 -9.476 -5.732 1.00 0.00 C ATOM 473 OG SER A 34 -11.529 -10.466 -6.441 1.00 0.00 O ATOM 0 H SER A 34 -9.489 -11.535 -6.204 1.00 0.00 H new ATOM 0 HA SER A 34 -9.176 -9.334 -4.355 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.506 -8.812 -5.221 1.00 0.00 H new ATOM 0 HB3 SER A 34 -10.241 -8.864 -6.433 1.00 0.00 H new ATOM 0 HG SER A 34 -11.043 -10.701 -7.259 1.00 0.00 H new ATOM 479 N ARG A 35 -11.121 -11.888 -3.671 1.00 0.00 N ATOM 480 CA ARG A 35 -11.905 -12.560 -2.639 1.00 0.00 C ATOM 481 C ARG A 35 -11.023 -12.870 -1.426 1.00 0.00 C ATOM 482 O ARG A 35 -11.426 -12.667 -0.282 1.00 0.00 O ATOM 483 CB ARG A 35 -12.508 -13.853 -3.213 1.00 0.00 C ATOM 484 CG ARG A 35 -13.641 -14.440 -2.382 1.00 0.00 C ATOM 485 CD ARG A 35 -14.174 -15.736 -2.986 1.00 0.00 C ATOM 486 NE ARG A 35 -15.412 -16.171 -2.334 1.00 0.00 N ATOM 487 CZ ARG A 35 -15.600 -17.375 -1.789 1.00 0.00 C ATOM 488 NH1 ARG A 35 -14.627 -18.284 -1.806 1.00 0.00 N ATOM 489 NH2 ARG A 35 -16.769 -17.673 -1.234 1.00 0.00 N ATOM 0 H ARG A 35 -10.984 -12.445 -4.514 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.714 -11.906 -2.316 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -12.877 -13.652 -4.219 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.718 -14.598 -3.306 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -13.288 -14.630 -1.368 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -14.451 -13.714 -2.307 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -14.355 -15.593 -4.051 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -13.420 -16.518 -2.893 1.00 0.00 H new ATOM 0 HE ARG A 35 -16.185 -15.507 -2.294 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -13.730 -18.063 -2.238 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -14.779 -19.202 -1.387 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -17.520 -16.983 -1.225 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -16.916 -18.592 -0.817 1.00 0.00 H new ATOM 503 N TYR A 36 -9.809 -13.346 -1.700 1.00 0.00 N ATOM 504 CA TYR A 36 -8.827 -13.666 -0.659 1.00 0.00 C ATOM 505 C TYR A 36 -8.627 -12.487 0.295 1.00 0.00 C ATOM 506 O TYR A 36 -8.525 -12.665 1.511 1.00 0.00 O ATOM 507 CB TYR A 36 -7.490 -14.056 -1.317 1.00 0.00 C ATOM 508 CG TYR A 36 -6.297 -14.099 -0.369 1.00 0.00 C ATOM 509 CD1 TYR A 36 -6.068 -15.194 0.462 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.393 -13.041 -0.317 1.00 0.00 C ATOM 511 CE1 TYR A 36 -4.977 -15.228 1.314 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.304 -13.070 0.532 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.100 -14.165 1.345 1.00 0.00 C ATOM 514 OH TYR A 36 -3.012 -14.199 2.189 1.00 0.00 O ATOM 0 H TYR A 36 -9.477 -13.521 -2.648 1.00 0.00 H new ATOM 0 HA TYR A 36 -9.202 -14.505 -0.073 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -7.602 -15.036 -1.781 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.275 -13.347 -2.117 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.752 -16.029 0.441 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.546 -12.181 -0.953 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -4.814 -16.084 1.952 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.615 -12.239 0.559 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.494 -13.373 2.088 1.00 0.00 H new ATOM 524 N ALA A 37 -8.586 -11.285 -0.268 1.00 0.00 N ATOM 525 CA ALA A 37 -8.343 -10.078 0.514 1.00 0.00 C ATOM 526 C ALA A 37 -9.469 -9.824 1.508 1.00 0.00 C ATOM 527 O ALA A 37 -9.235 -9.291 2.589 1.00 0.00 O ATOM 528 CB ALA A 37 -8.164 -8.878 -0.403 1.00 0.00 C ATOM 0 H ALA A 37 -8.718 -11.120 -1.266 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.424 -10.228 1.081 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.984 -7.986 0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.314 -9.049 -1.064 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.066 -8.738 -0.999 1.00 0.00 H new ATOM 534 N ALA A 38 -10.687 -10.218 1.141 1.00 0.00 N ATOM 535 CA ALA A 38 -11.849 -10.006 1.999 1.00 0.00 C ATOM 536 C ALA A 38 -11.675 -10.744 3.325 1.00 0.00 C ATOM 537 O ALA A 38 -12.042 -10.232 4.382 1.00 0.00 O ATOM 538 CB ALA A 38 -13.125 -10.445 1.288 1.00 0.00 C ATOM 0 H ALA A 38 -10.894 -10.684 0.258 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.934 -8.941 2.215 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -13.981 -10.280 1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.250 -9.865 0.374 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.057 -11.504 1.040 1.00 0.00 H new ATOM 544 N TYR A 39 -11.081 -11.935 3.263 1.00 0.00 N ATOM 545 CA TYR A 39 -10.780 -12.708 4.468 1.00 0.00 C ATOM 546 C TYR A 39 -9.739 -11.983 5.320 1.00 0.00 C ATOM 547 O TYR A 39 -9.855 -11.919 6.545 1.00 0.00 O ATOM 548 CB TYR A 39 -10.285 -14.120 4.107 1.00 0.00 C ATOM 549 CG TYR A 39 -11.325 -15.201 4.332 1.00 0.00 C ATOM 550 CD1 TYR A 39 -12.260 -15.508 3.356 1.00 0.00 C ATOM 551 CD2 TYR A 39 -11.378 -15.902 5.529 1.00 0.00 C ATOM 552 CE1 TYR A 39 -13.216 -16.483 3.564 1.00 0.00 C ATOM 553 CE2 TYR A 39 -12.330 -16.877 5.746 1.00 0.00 C ATOM 554 CZ TYR A 39 -13.247 -17.165 4.762 1.00 0.00 C ATOM 555 OH TYR A 39 -14.200 -18.133 4.978 1.00 0.00 O ATOM 0 H TYR A 39 -10.799 -12.386 2.392 1.00 0.00 H new ATOM 0 HA TYR A 39 -11.699 -12.807 5.045 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.979 -14.133 3.061 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.400 -14.349 4.701 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -12.241 -14.976 2.417 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -10.661 -15.680 6.305 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.936 -16.710 2.792 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -12.355 -17.412 6.684 1.00 0.00 H new ATOM 0 HH TYR A 39 -14.571 -18.031 5.879 1.00 0.00 H new ATOM 565 N ALA A 40 -8.726 -11.430 4.659 1.00 0.00 N ATOM 566 CA ALA A 40 -7.672 -10.684 5.342 1.00 0.00 C ATOM 567 C ALA A 40 -8.221 -9.374 5.909 1.00 0.00 C ATOM 568 O ALA A 40 -7.707 -8.842 6.894 1.00 0.00 O ATOM 569 CB ALA A 40 -6.512 -10.417 4.389 1.00 0.00 C ATOM 0 H ALA A 40 -8.612 -11.485 3.647 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.304 -11.284 6.174 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.733 -9.860 4.911 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.106 -11.365 4.036 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.866 -9.835 3.538 1.00 0.00 H new ATOM 575 N LEU A 41 -9.278 -8.868 5.278 1.00 0.00 N ATOM 576 CA LEU A 41 -9.959 -7.654 5.728 1.00 0.00 C ATOM 577 C LEU A 41 -11.147 -8.016 6.620 1.00 0.00 C ATOM 578 O LEU A 41 -12.045 -7.199 6.831 1.00 0.00 O ATOM 579 CB LEU A 41 -10.431 -6.830 4.519 1.00 0.00 C ATOM 580 CG LEU A 41 -9.312 -6.308 3.601 1.00 0.00 C ATOM 581 CD1 LEU A 41 -9.897 -5.574 2.397 1.00 0.00 C ATOM 582 CD2 LEU A 41 -8.355 -5.402 4.377 1.00 0.00 C ATOM 0 H LEU A 41 -9.687 -9.286 4.442 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.258 -7.053 6.307 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.109 -7.443 3.925 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.006 -5.979 4.883 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.747 -7.164 3.233 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.088 -5.214 1.762 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.529 -6.255 1.828 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.492 -4.728 2.741 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.571 -5.044 3.709 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.905 -4.552 4.780 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.905 -5.964 5.196 1.00 0.00 H new ATOM 594 N LYS A 42 -11.132 -9.259 7.120 1.00 0.00 N ATOM 595 CA LYS A 42 -12.139 -9.803 8.051 1.00 0.00 C ATOM 596 C LYS A 42 -13.581 -9.653 7.541 1.00 0.00 C ATOM 597 O LYS A 42 -14.539 -9.910 8.279 1.00 0.00 O ATOM 598 CB LYS A 42 -11.963 -9.227 9.489 1.00 0.00 C ATOM 599 CG LYS A 42 -12.249 -7.729 9.666 1.00 0.00 C ATOM 600 CD LYS A 42 -13.744 -7.426 9.771 1.00 0.00 C ATOM 601 CE LYS A 42 -14.054 -5.967 9.485 1.00 0.00 C ATOM 602 NZ LYS A 42 -15.518 -5.701 9.496 1.00 0.00 N ATOM 0 H LYS A 42 -10.403 -9.933 6.885 1.00 0.00 H new ATOM 0 HA LYS A 42 -11.956 -10.876 8.103 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -12.618 -9.781 10.161 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -10.940 -9.419 9.811 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -11.745 -7.370 10.563 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -11.829 -7.180 8.823 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -14.291 -8.056 9.070 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -14.096 -7.681 10.771 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -13.565 -5.339 10.229 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -13.642 -5.691 8.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -15.690 -4.695 9.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -15.982 -6.282 8.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -15.907 -5.940 10.430 1.00 0.00 H new ATOM 616 N ASP A 43 -13.746 -9.280 6.275 1.00 0.00 N ATOM 617 CA ASP A 43 -15.080 -9.102 5.706 1.00 0.00 C ATOM 618 C ASP A 43 -15.520 -10.365 4.978 1.00 0.00 C ATOM 619 O ASP A 43 -15.287 -10.527 3.778 1.00 0.00 O ATOM 620 CB ASP A 43 -15.139 -7.896 4.757 1.00 0.00 C ATOM 621 CG ASP A 43 -16.561 -7.618 4.276 1.00 0.00 C ATOM 622 OD1 ASP A 43 -17.380 -7.128 5.089 1.00 0.00 O ATOM 623 OD2 ASP A 43 -16.876 -7.905 3.099 1.00 0.00 O ATOM 0 H ASP A 43 -12.980 -9.096 5.627 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.764 -8.908 6.532 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -14.749 -7.014 5.266 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.494 -8.079 3.897 1.00 0.00 H new ATOM 628 N PHE A 44 -16.131 -11.277 5.725 1.00 0.00 N ATOM 629 CA PHE A 44 -16.655 -12.514 5.155 1.00 0.00 C ATOM 630 C PHE A 44 -17.905 -12.239 4.316 1.00 0.00 C ATOM 631 O PHE A 44 -18.381 -13.114 3.591 1.00 0.00 O ATOM 632 CB PHE A 44 -16.946 -13.547 6.260 1.00 0.00 C ATOM 633 CG PHE A 44 -17.910 -13.076 7.325 1.00 0.00 C ATOM 634 CD1 PHE A 44 -17.457 -12.356 8.425 1.00 0.00 C ATOM 635 CD2 PHE A 44 -19.266 -13.359 7.232 1.00 0.00 C ATOM 636 CE1 PHE A 44 -18.335 -11.930 9.403 1.00 0.00 C ATOM 637 CE2 PHE A 44 -20.146 -12.936 8.210 1.00 0.00 C ATOM 638 CZ PHE A 44 -19.681 -12.220 9.296 1.00 0.00 C ATOM 0 H PHE A 44 -16.276 -11.183 6.730 1.00 0.00 H new ATOM 0 HA PHE A 44 -15.894 -12.934 4.497 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -17.347 -14.449 5.799 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -16.006 -13.824 6.737 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -16.406 -12.127 8.516 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -19.638 -13.917 6.385 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -17.969 -11.370 10.251 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -21.198 -13.165 8.125 1.00 0.00 H new ATOM 0 HZ PHE A 44 -20.369 -11.888 10.060 1.00 0.00 H new ATOM 648 N ASP A 45 -18.425 -11.015 4.417 1.00 0.00 N ATOM 649 CA ASP A 45 -19.614 -10.611 3.665 1.00 0.00 C ATOM 650 C ASP A 45 -19.392 -10.766 2.163 1.00 0.00 C ATOM 651 O ASP A 45 -20.136 -11.484 1.492 1.00 0.00 O ATOM 652 CB ASP A 45 -19.990 -9.159 3.990 1.00 0.00 C ATOM 653 CG ASP A 45 -21.106 -8.627 3.099 1.00 0.00 C ATOM 654 OD1 ASP A 45 -22.283 -8.980 3.334 1.00 0.00 O ATOM 655 OD2 ASP A 45 -20.814 -7.845 2.166 1.00 0.00 O ATOM 0 H ASP A 45 -18.040 -10.284 5.015 1.00 0.00 H new ATOM 0 HA ASP A 45 -20.434 -11.265 3.962 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -20.301 -9.093 5.033 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -19.109 -8.526 3.879 1.00 0.00 H new ATOM 660 N TYR A 46 -18.353 -10.110 1.640 1.00 0.00 N ATOM 661 CA TYR A 46 -18.050 -10.180 0.212 1.00 0.00 C ATOM 662 C TYR A 46 -17.766 -11.624 -0.201 1.00 0.00 C ATOM 663 O TYR A 46 -18.047 -12.026 -1.332 1.00 0.00 O ATOM 664 CB TYR A 46 -16.874 -9.264 -0.162 1.00 0.00 C ATOM 665 CG TYR A 46 -16.580 -9.242 -1.654 1.00 0.00 C ATOM 666 CD1 TYR A 46 -17.526 -8.768 -2.559 1.00 0.00 C ATOM 667 CD2 TYR A 46 -15.363 -9.697 -2.157 1.00 0.00 C ATOM 668 CE1 TYR A 46 -17.269 -8.749 -3.916 1.00 0.00 C ATOM 669 CE2 TYR A 46 -15.100 -9.678 -3.514 1.00 0.00 C ATOM 670 CZ TYR A 46 -16.057 -9.206 -4.389 1.00 0.00 C ATOM 671 OH TYR A 46 -15.798 -9.192 -5.741 1.00 0.00 O ATOM 0 H TYR A 46 -17.713 -9.529 2.181 1.00 0.00 H new ATOM 0 HA TYR A 46 -18.925 -9.826 -0.333 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -17.091 -8.250 0.174 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -15.982 -9.592 0.372 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -18.477 -8.409 -2.194 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.613 -10.071 -1.476 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -18.014 -8.378 -4.604 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -14.150 -10.031 -3.888 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.912 -9.576 -5.908 1.00 0.00 H new ATOM 681 N ILE A 47 -17.207 -12.397 0.726 1.00 0.00 N ATOM 682 CA ILE A 47 -16.958 -13.817 0.498 1.00 0.00 C ATOM 683 C ILE A 47 -18.259 -14.537 0.160 1.00 0.00 C ATOM 684 O ILE A 47 -18.338 -15.264 -0.833 1.00 0.00 O ATOM 685 CB ILE A 47 -16.322 -14.487 1.739 1.00 0.00 C ATOM 686 CG1 ILE A 47 -14.999 -13.795 2.097 1.00 0.00 C ATOM 687 CG2 ILE A 47 -16.110 -15.984 1.501 1.00 0.00 C ATOM 688 CD1 ILE A 47 -13.968 -13.849 0.993 1.00 0.00 C ATOM 0 H ILE A 47 -16.917 -12.062 1.645 1.00 0.00 H new ATOM 0 HA ILE A 47 -16.263 -13.894 -0.338 1.00 0.00 H new ATOM 0 HB ILE A 47 -17.006 -14.377 2.580 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.200 -12.753 2.344 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.586 -14.261 2.991 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.662 -16.433 2.387 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -17.070 -16.460 1.299 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.447 -16.126 0.647 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.060 -13.340 1.318 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -13.738 -14.889 0.761 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.361 -13.357 0.103 1.00 0.00 H new ATOM 700 N VAL A 48 -19.271 -14.327 0.998 1.00 0.00 N ATOM 701 CA VAL A 48 -20.592 -14.914 0.787 1.00 0.00 C ATOM 702 C VAL A 48 -21.181 -14.426 -0.537 1.00 0.00 C ATOM 703 O VAL A 48 -21.720 -15.215 -1.318 1.00 0.00 O ATOM 704 CB VAL A 48 -21.560 -14.564 1.946 1.00 0.00 C ATOM 705 CG1 VAL A 48 -22.914 -15.244 1.754 1.00 0.00 C ATOM 706 CG2 VAL A 48 -20.948 -14.944 3.293 1.00 0.00 C ATOM 0 H VAL A 48 -19.200 -13.750 1.836 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.471 -15.997 0.757 1.00 0.00 H new ATOM 0 HB VAL A 48 -21.722 -13.486 1.936 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.574 -14.981 2.581 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -23.358 -14.911 0.816 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -22.778 -16.325 1.728 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.643 -14.690 4.093 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -20.748 -16.015 3.312 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -20.015 -14.398 3.436 1.00 0.00 H new ATOM 716 N GLU A 49 -21.043 -13.125 -0.784 1.00 0.00 N ATOM 717 CA GLU A 49 -21.509 -12.501 -2.024 1.00 0.00 C ATOM 718 C GLU A 49 -20.953 -13.230 -3.248 1.00 0.00 C ATOM 719 O GLU A 49 -21.664 -13.461 -4.228 1.00 0.00 O ATOM 720 CB GLU A 49 -21.065 -11.032 -2.064 1.00 0.00 C ATOM 721 CG GLU A 49 -21.621 -10.182 -0.927 1.00 0.00 C ATOM 722 CD GLU A 49 -23.080 -9.814 -1.122 1.00 0.00 C ATOM 723 OE1 GLU A 49 -23.963 -10.594 -0.706 1.00 0.00 O ATOM 724 OE2 GLU A 49 -23.347 -8.737 -1.696 1.00 0.00 O ATOM 0 H GLU A 49 -20.606 -12.473 -0.132 1.00 0.00 H new ATOM 0 HA GLU A 49 -22.597 -12.562 -2.047 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -19.976 -10.992 -2.034 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -21.374 -10.596 -3.014 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.511 -10.724 0.012 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -21.030 -9.270 -0.840 1.00 0.00 H new ATOM 731 N THR A 50 -19.678 -13.595 -3.172 1.00 0.00 N ATOM 732 CA THR A 50 -18.978 -14.230 -4.284 1.00 0.00 C ATOM 733 C THR A 50 -19.009 -15.753 -4.177 1.00 0.00 C ATOM 734 O THR A 50 -18.165 -16.439 -4.753 1.00 0.00 O ATOM 735 CB THR A 50 -17.511 -13.747 -4.345 1.00 0.00 C ATOM 736 OG1 THR A 50 -16.901 -13.868 -3.049 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.434 -12.300 -4.815 1.00 0.00 C ATOM 0 H THR A 50 -19.102 -13.460 -2.341 1.00 0.00 H new ATOM 0 HA THR A 50 -19.496 -13.942 -5.199 1.00 0.00 H new ATOM 0 HB THR A 50 -16.975 -14.372 -5.060 1.00 0.00 H new ATOM 0 HG1 THR A 50 -17.196 -13.128 -2.478 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.391 -11.984 -4.849 1.00 0.00 H new ATOM 0 HG22 THR A 50 -17.872 -12.217 -5.810 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.984 -11.663 -4.122 1.00 0.00 H new ATOM 745 N THR A 51 -19.980 -16.286 -3.444 1.00 0.00 N ATOM 746 CA THR A 51 -20.125 -17.729 -3.316 1.00 0.00 C ATOM 747 C THR A 51 -21.234 -18.246 -4.227 1.00 0.00 C ATOM 748 O THR A 51 -22.225 -17.550 -4.472 1.00 0.00 O ATOM 749 CB THR A 51 -20.432 -18.150 -1.865 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.429 -17.622 -0.990 1.00 0.00 O ATOM 751 CG2 THR A 51 -20.477 -19.671 -1.738 1.00 0.00 C ATOM 0 H THR A 51 -20.675 -15.743 -2.932 1.00 0.00 H new ATOM 0 HA THR A 51 -19.171 -18.166 -3.611 1.00 0.00 H new ATOM 0 HB THR A 51 -21.408 -17.752 -1.588 1.00 0.00 H new ATOM 0 HG1 THR A 51 -19.446 -16.643 -1.026 1.00 0.00 H new ATOM 0 HG21 THR A 51 -20.695 -19.944 -0.705 1.00 0.00 H new ATOM 0 HG22 THR A 51 -21.255 -20.068 -2.390 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.513 -20.089 -2.028 1.00 0.00 H new ATOM 759 N ASP A 52 -21.041 -19.465 -4.726 1.00 0.00 N ATOM 760 CA ASP A 52 -22.036 -20.167 -5.537 1.00 0.00 C ATOM 761 C ASP A 52 -23.403 -20.106 -4.863 1.00 0.00 C ATOM 762 O ASP A 52 -23.482 -20.244 -3.650 1.00 0.00 O ATOM 763 CB ASP A 52 -21.613 -21.631 -5.683 1.00 0.00 C ATOM 764 CG ASP A 52 -22.414 -22.385 -6.724 1.00 0.00 C ATOM 765 OD1 ASP A 52 -23.469 -22.948 -6.369 1.00 0.00 O ATOM 766 OD2 ASP A 52 -21.988 -22.424 -7.897 1.00 0.00 O ATOM 0 H ASP A 52 -20.184 -19.998 -4.578 1.00 0.00 H new ATOM 0 HA ASP A 52 -22.101 -19.693 -6.516 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -20.556 -21.672 -5.948 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -21.720 -22.131 -4.720 1.00 0.00 H new ATOM 771 N PRO A 53 -24.495 -19.914 -5.625 1.00 0.00 N ATOM 772 CA PRO A 53 -25.849 -19.828 -5.055 1.00 0.00 C ATOM 773 C PRO A 53 -26.194 -21.054 -4.209 1.00 0.00 C ATOM 774 O PRO A 53 -26.825 -20.941 -3.155 1.00 0.00 O ATOM 775 CB PRO A 53 -26.764 -19.739 -6.292 1.00 0.00 C ATOM 776 CG PRO A 53 -25.917 -20.196 -7.434 1.00 0.00 C ATOM 777 CD PRO A 53 -24.515 -19.775 -7.091 1.00 0.00 C ATOM 0 HA PRO A 53 -25.956 -18.978 -4.381 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -27.645 -20.370 -6.177 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -27.119 -18.720 -6.447 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -25.982 -21.277 -7.562 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -26.244 -19.744 -8.370 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -23.771 -20.411 -7.570 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -24.309 -18.752 -7.405 1.00 0.00 H new ATOM 785 N GLU A 54 -25.741 -22.217 -4.663 1.00 0.00 N ATOM 786 CA GLU A 54 -26.039 -23.478 -3.997 1.00 0.00 C ATOM 787 C GLU A 54 -25.187 -23.636 -2.738 1.00 0.00 C ATOM 788 O GLU A 54 -25.661 -24.120 -1.707 1.00 0.00 O ATOM 789 CB GLU A 54 -25.801 -24.641 -4.966 1.00 0.00 C ATOM 790 CG GLU A 54 -26.561 -24.488 -6.281 1.00 0.00 C ATOM 791 CD GLU A 54 -26.260 -25.597 -7.273 1.00 0.00 C ATOM 792 OE1 GLU A 54 -26.898 -26.667 -7.185 1.00 0.00 O ATOM 793 OE2 GLU A 54 -25.392 -25.402 -8.154 1.00 0.00 O ATOM 0 H GLU A 54 -25.161 -22.312 -5.497 1.00 0.00 H new ATOM 0 HA GLU A 54 -27.086 -23.482 -3.694 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -24.734 -24.719 -5.176 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -26.100 -25.573 -4.486 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -27.631 -24.472 -6.076 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -26.309 -23.528 -6.731 1.00 0.00 H new ATOM 800 N ARG A 55 -23.929 -23.209 -2.822 1.00 0.00 N ATOM 801 CA ARG A 55 -23.015 -23.267 -1.679 1.00 0.00 C ATOM 802 C ARG A 55 -23.342 -22.155 -0.682 1.00 0.00 C ATOM 803 O ARG A 55 -23.152 -22.303 0.524 1.00 0.00 O ATOM 804 CB ARG A 55 -21.560 -23.127 -2.147 1.00 0.00 C ATOM 805 CG ARG A 55 -21.138 -24.144 -3.202 1.00 0.00 C ATOM 806 CD ARG A 55 -21.245 -25.582 -2.705 1.00 0.00 C ATOM 807 NE ARG A 55 -20.717 -26.537 -3.685 1.00 0.00 N ATOM 808 CZ ARG A 55 -20.571 -27.847 -3.463 1.00 0.00 C ATOM 809 NH1 ARG A 55 -20.895 -28.365 -2.284 1.00 0.00 N ATOM 810 NH2 ARG A 55 -20.077 -28.634 -4.416 1.00 0.00 N ATOM 0 H ARG A 55 -23.517 -22.818 -3.670 1.00 0.00 H new ATOM 0 HA ARG A 55 -23.139 -24.234 -1.191 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.415 -22.124 -2.548 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -20.902 -23.223 -1.283 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -21.761 -24.022 -4.088 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -20.110 -23.943 -3.504 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -20.699 -25.684 -1.767 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -22.288 -25.817 -2.494 1.00 0.00 H new ATOM 0 HE ARG A 55 -20.442 -26.177 -4.599 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -21.257 -27.763 -1.544 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -20.782 -29.365 -2.118 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -19.809 -28.238 -5.317 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -19.966 -29.633 -4.245 1.00 0.00 H new ATOM 824 N ARG A 56 -23.859 -21.050 -1.205 1.00 0.00 N ATOM 825 CA ARG A 56 -24.184 -19.871 -0.405 1.00 0.00 C ATOM 826 C ARG A 56 -25.354 -20.185 0.521 1.00 0.00 C ATOM 827 O ARG A 56 -25.515 -19.576 1.578 1.00 0.00 O ATOM 828 CB ARG A 56 -24.516 -18.698 -1.342 1.00 0.00 C ATOM 829 CG ARG A 56 -24.634 -17.342 -0.658 1.00 0.00 C ATOM 830 CD ARG A 56 -24.714 -16.209 -1.681 1.00 0.00 C ATOM 831 NE ARG A 56 -25.897 -16.320 -2.541 1.00 0.00 N ATOM 832 CZ ARG A 56 -25.865 -16.365 -3.879 1.00 0.00 C ATOM 833 NH1 ARG A 56 -24.707 -16.376 -4.533 1.00 0.00 N ATOM 834 NH2 ARG A 56 -26.997 -16.424 -4.568 1.00 0.00 N ATOM 0 H ARG A 56 -24.066 -20.944 -2.198 1.00 0.00 H new ATOM 0 HA ARG A 56 -23.330 -19.591 0.212 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -23.744 -18.635 -2.109 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.455 -18.914 -1.852 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -25.522 -17.327 -0.026 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -23.775 -17.186 -0.005 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -24.735 -15.252 -1.160 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -23.816 -16.216 -2.299 1.00 0.00 H new ATOM 0 HE ARG A 56 -26.809 -16.366 -2.087 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -23.829 -16.350 -4.015 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -24.697 -16.410 -5.552 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -27.892 -16.435 -4.079 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -26.973 -16.458 -5.587 1.00 0.00 H new ATOM 848 N ASP A 57 -26.154 -21.159 0.103 1.00 0.00 N ATOM 849 CA ASP A 57 -27.254 -21.684 0.908 1.00 0.00 C ATOM 850 C ASP A 57 -26.714 -22.424 2.137 1.00 0.00 C ATOM 851 O ASP A 57 -27.401 -22.558 3.151 1.00 0.00 O ATOM 852 CB ASP A 57 -28.111 -22.621 0.041 1.00 0.00 C ATOM 853 CG ASP A 57 -29.180 -23.371 0.822 1.00 0.00 C ATOM 854 OD1 ASP A 57 -30.137 -22.729 1.299 1.00 0.00 O ATOM 855 OD2 ASP A 57 -29.077 -24.611 0.943 1.00 0.00 O ATOM 0 H ASP A 57 -26.059 -21.610 -0.807 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.872 -20.858 1.261 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -28.590 -22.037 -0.745 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -27.459 -23.343 -0.451 1.00 0.00 H new ATOM 860 N LEU A 58 -25.470 -22.888 2.038 1.00 0.00 N ATOM 861 CA LEU A 58 -24.824 -23.641 3.115 1.00 0.00 C ATOM 862 C LEU A 58 -23.951 -22.729 3.981 1.00 0.00 C ATOM 863 O LEU A 58 -23.756 -22.990 5.170 1.00 0.00 O ATOM 864 CB LEU A 58 -23.969 -24.769 2.521 1.00 0.00 C ATOM 865 CG LEU A 58 -24.724 -25.748 1.606 1.00 0.00 C ATOM 866 CD1 LEU A 58 -23.768 -26.776 1.006 1.00 0.00 C ATOM 867 CD2 LEU A 58 -25.853 -26.438 2.369 1.00 0.00 C ATOM 0 H LEU A 58 -24.883 -22.755 1.215 1.00 0.00 H new ATOM 0 HA LEU A 58 -25.603 -24.067 3.747 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.151 -24.324 1.954 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -23.520 -25.333 3.339 1.00 0.00 H new ATOM 0 HG LEU A 58 -25.165 -25.178 0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -24.324 -27.458 0.363 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.005 -26.264 0.419 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -23.291 -27.341 1.807 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -26.374 -27.126 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -25.438 -26.992 3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -26.554 -25.689 2.738 1.00 0.00 H new ATOM 879 N PHE A 59 -23.422 -21.668 3.373 1.00 0.00 N ATOM 880 CA PHE A 59 -22.543 -20.727 4.071 1.00 0.00 C ATOM 881 C PHE A 59 -23.227 -20.110 5.292 1.00 0.00 C ATOM 882 O PHE A 59 -24.388 -19.702 5.232 1.00 0.00 O ATOM 883 CB PHE A 59 -22.065 -19.621 3.112 1.00 0.00 C ATOM 884 CG PHE A 59 -20.795 -19.963 2.367 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.593 -21.233 1.842 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.799 -19.010 2.199 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.426 -21.543 1.167 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.633 -19.315 1.525 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.446 -20.582 1.008 1.00 0.00 C ATOM 0 H PHE A 59 -23.587 -21.437 2.393 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.678 -21.289 4.424 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.854 -19.414 2.389 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -21.906 -18.705 3.680 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.356 -21.988 1.962 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.938 -18.017 2.601 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -19.281 -22.535 0.765 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.868 -18.563 1.402 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.535 -20.821 0.480 1.00 0.00 H new ATOM 899 N ASP A 60 -22.486 -20.049 6.396 1.00 0.00 N ATOM 900 CA ASP A 60 -22.978 -19.480 7.651 1.00 0.00 C ATOM 901 C ASP A 60 -22.043 -18.364 8.115 1.00 0.00 C ATOM 902 O ASP A 60 -20.834 -18.440 7.901 1.00 0.00 O ATOM 903 CB ASP A 60 -23.079 -20.572 8.726 1.00 0.00 C ATOM 904 CG ASP A 60 -23.471 -20.022 10.090 1.00 0.00 C ATOM 905 OD1 ASP A 60 -24.684 -19.948 10.384 1.00 0.00 O ATOM 906 OD2 ASP A 60 -22.570 -19.652 10.870 1.00 0.00 O ATOM 0 H ASP A 60 -21.527 -20.392 6.447 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.972 -19.064 7.487 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -23.813 -21.315 8.414 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.121 -21.085 8.808 1.00 0.00 H new ATOM 911 N HIS A 61 -22.605 -17.348 8.767 1.00 0.00 N ATOM 912 CA HIS A 61 -21.846 -16.153 9.153 1.00 0.00 C ATOM 913 C HIS A 61 -20.680 -16.514 10.076 1.00 0.00 C ATOM 914 O HIS A 61 -19.540 -16.098 9.850 1.00 0.00 O ATOM 915 CB HIS A 61 -22.761 -15.132 9.851 1.00 0.00 C ATOM 916 CG HIS A 61 -23.954 -14.716 9.037 1.00 0.00 C ATOM 917 ND1 HIS A 61 -25.048 -15.416 8.648 1.00 0.00 N flip ATOM 918 CD2 HIS A 61 -24.125 -13.442 8.539 1.00 0.00 C flip ATOM 919 CE1 HIS A 61 -25.845 -14.561 7.935 1.00 0.00 C flip ATOM 920 NE2 HIS A 61 -25.269 -13.377 7.882 1.00 0.00 N flip ATOM 0 H HIS A 61 -23.587 -17.326 9.041 1.00 0.00 H new ATOM 0 HA HIS A 61 -21.444 -15.709 8.242 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -23.108 -15.557 10.793 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -22.176 -14.246 10.097 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -23.431 -12.624 8.666 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -26.794 -14.816 7.487 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -25.643 -12.551 7.414 1.00 0.00 H new ATOM 929 N ASP A 62 -20.973 -17.307 11.102 1.00 0.00 N ATOM 930 CA ASP A 62 -19.981 -17.672 12.114 1.00 0.00 C ATOM 931 C ASP A 62 -18.942 -18.620 11.536 1.00 0.00 C ATOM 932 O ASP A 62 -17.753 -18.516 11.846 1.00 0.00 O ATOM 933 CB ASP A 62 -20.657 -18.331 13.321 1.00 0.00 C ATOM 934 CG ASP A 62 -21.596 -17.389 14.055 1.00 0.00 C ATOM 935 OD1 ASP A 62 -22.760 -17.242 13.624 1.00 0.00 O ATOM 936 OD2 ASP A 62 -21.179 -16.789 15.067 1.00 0.00 O ATOM 0 H ASP A 62 -21.896 -17.713 11.257 1.00 0.00 H new ATOM 0 HA ASP A 62 -19.485 -16.757 12.437 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -21.215 -19.206 12.987 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -19.892 -18.686 14.012 1.00 0.00 H new ATOM 941 N VAL A 63 -19.398 -19.549 10.704 1.00 0.00 N ATOM 942 CA VAL A 63 -18.507 -20.527 10.086 1.00 0.00 C ATOM 943 C VAL A 63 -17.514 -19.833 9.153 1.00 0.00 C ATOM 944 O VAL A 63 -16.309 -20.095 9.206 1.00 0.00 O ATOM 945 CB VAL A 63 -19.300 -21.603 9.303 1.00 0.00 C ATOM 946 CG1 VAL A 63 -18.355 -22.600 8.637 1.00 0.00 C ATOM 947 CG2 VAL A 63 -20.280 -22.327 10.227 1.00 0.00 C ATOM 0 H VAL A 63 -20.379 -19.647 10.441 1.00 0.00 H new ATOM 0 HA VAL A 63 -17.960 -21.024 10.887 1.00 0.00 H new ATOM 0 HB VAL A 63 -19.869 -21.101 8.521 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -18.936 -23.345 8.094 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -17.701 -22.073 7.942 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -17.752 -23.095 9.399 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -20.828 -23.079 9.659 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -19.729 -22.811 11.034 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -20.982 -21.608 10.648 1.00 0.00 H new ATOM 957 N ASN A 64 -18.028 -18.930 8.316 1.00 0.00 N ATOM 958 CA ASN A 64 -17.188 -18.158 7.398 1.00 0.00 C ATOM 959 C ASN A 64 -16.144 -17.370 8.181 1.00 0.00 C ATOM 960 O ASN A 64 -14.994 -17.242 7.757 1.00 0.00 O ATOM 961 CB ASN A 64 -18.038 -17.194 6.550 1.00 0.00 C ATOM 962 CG ASN A 64 -19.005 -17.907 5.618 1.00 0.00 C ATOM 963 OD1 ASN A 64 -20.124 -17.263 5.317 1.00 0.00 O flip ATOM 964 ND2 ASN A 64 -18.752 -19.024 5.171 1.00 0.00 N flip ATOM 0 H ASN A 64 -19.023 -18.715 8.255 1.00 0.00 H new ATOM 0 HA ASN A 64 -16.687 -18.857 6.728 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -18.601 -16.537 7.213 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -17.376 -16.560 5.960 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -17.881 -19.489 5.425 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -19.414 -19.485 4.547 1.00 0.00 H new ATOM 971 N ARG A 65 -16.560 -16.855 9.336 1.00 0.00 N ATOM 972 CA ARG A 65 -15.671 -16.109 10.218 1.00 0.00 C ATOM 973 C ARG A 65 -14.610 -17.026 10.827 1.00 0.00 C ATOM 974 O ARG A 65 -13.426 -16.690 10.848 1.00 0.00 O ATOM 975 CB ARG A 65 -16.475 -15.430 11.338 1.00 0.00 C ATOM 976 CG ARG A 65 -15.601 -14.762 12.394 1.00 0.00 C ATOM 977 CD ARG A 65 -16.414 -14.188 13.544 1.00 0.00 C ATOM 978 NE ARG A 65 -15.549 -13.667 14.603 1.00 0.00 N ATOM 979 CZ ARG A 65 -15.975 -13.289 15.806 1.00 0.00 C ATOM 980 NH1 ARG A 65 -17.264 -13.361 16.116 1.00 0.00 N ATOM 981 NH2 ARG A 65 -15.103 -12.845 16.700 1.00 0.00 N ATOM 0 H ARG A 65 -17.515 -16.943 9.683 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.170 -15.345 9.623 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.136 -14.683 10.899 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.110 -16.173 11.820 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.888 -15.489 12.784 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.021 -13.965 11.930 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -17.058 -13.391 13.173 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.066 -14.961 13.952 1.00 0.00 H new ATOM 0 HE ARG A 65 -14.551 -13.588 14.406 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.935 -13.708 15.430 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -17.583 -13.070 17.040 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -14.112 -12.794 16.464 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -15.423 -12.554 17.624 1.00 0.00 H new ATOM 995 N ALA A 66 -15.044 -18.194 11.295 1.00 0.00 N ATOM 996 CA ALA A 66 -14.180 -19.118 12.034 1.00 0.00 C ATOM 997 C ALA A 66 -12.856 -19.364 11.315 1.00 0.00 C ATOM 998 O ALA A 66 -11.801 -19.456 11.950 1.00 0.00 O ATOM 999 CB ALA A 66 -14.904 -20.438 12.265 1.00 0.00 C ATOM 0 H ALA A 66 -16.000 -18.528 11.175 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.950 -18.655 12.994 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.254 -21.118 12.815 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -15.812 -20.259 12.841 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.165 -20.883 11.305 1.00 0.00 H new ATOM 1005 N TRP A 67 -12.917 -19.451 9.992 1.00 0.00 N ATOM 1006 CA TRP A 67 -11.739 -19.740 9.182 1.00 0.00 C ATOM 1007 C TRP A 67 -10.655 -18.675 9.388 1.00 0.00 C ATOM 1008 O TRP A 67 -9.507 -19.000 9.696 1.00 0.00 O ATOM 1009 CB TRP A 67 -12.131 -19.830 7.699 1.00 0.00 C ATOM 1010 CG TRP A 67 -11.044 -20.376 6.817 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -9.946 -19.710 6.352 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -10.961 -21.705 6.286 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -9.182 -20.545 5.575 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -9.785 -21.775 5.517 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -11.767 -22.845 6.391 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -9.394 -22.937 4.857 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -11.379 -23.998 5.734 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -10.201 -24.037 4.976 1.00 0.00 C ATOM 0 H TRP A 67 -13.775 -19.325 9.454 1.00 0.00 H new ATOM 0 HA TRP A 67 -11.330 -20.699 9.499 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.015 -20.461 7.604 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -12.409 -18.837 7.345 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.713 -18.677 6.565 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -8.307 -20.291 5.115 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -12.675 -22.824 6.975 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -8.487 -22.970 4.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -11.994 -24.883 5.806 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -9.924 -24.953 4.476 1.00 0.00 H new ATOM 1029 N MET A 68 -11.030 -17.403 9.244 1.00 0.00 N ATOM 1030 CA MET A 68 -10.065 -16.297 9.325 1.00 0.00 C ATOM 1031 C MET A 68 -9.573 -16.090 10.758 1.00 0.00 C ATOM 1032 O MET A 68 -8.521 -15.489 10.982 1.00 0.00 O ATOM 1033 CB MET A 68 -10.677 -14.992 8.786 1.00 0.00 C ATOM 1034 CG MET A 68 -11.825 -14.440 9.621 1.00 0.00 C ATOM 1035 SD MET A 68 -12.562 -12.964 8.894 1.00 0.00 S ATOM 1036 CE MET A 68 -13.801 -12.559 10.122 1.00 0.00 C ATOM 0 H MET A 68 -11.992 -17.110 9.071 1.00 0.00 H new ATOM 0 HA MET A 68 -9.210 -16.567 8.705 1.00 0.00 H new ATOM 0 HB2 MET A 68 -9.894 -14.237 8.724 1.00 0.00 H new ATOM 0 HB3 MET A 68 -11.034 -15.165 7.771 1.00 0.00 H new ATOM 0 HG2 MET A 68 -12.591 -15.208 9.732 1.00 0.00 H new ATOM 0 HG3 MET A 68 -11.462 -14.205 10.622 1.00 0.00 H new ATOM 0 HE1 MET A 68 -14.026 -11.494 10.074 1.00 0.00 H new ATOM 0 HE2 MET A 68 -14.708 -13.131 9.926 1.00 0.00 H new ATOM 0 HE3 MET A 68 -13.424 -12.806 11.114 1.00 0.00 H new ATOM 1046 N GLU A 69 -10.335 -16.591 11.723 1.00 0.00 N ATOM 1047 CA GLU A 69 -9.988 -16.436 13.135 1.00 0.00 C ATOM 1048 C GLU A 69 -8.872 -17.403 13.528 1.00 0.00 C ATOM 1049 O GLU A 69 -8.113 -17.144 14.464 1.00 0.00 O ATOM 1050 CB GLU A 69 -11.224 -16.672 14.010 1.00 0.00 C ATOM 1051 CG GLU A 69 -12.419 -15.800 13.635 1.00 0.00 C ATOM 1052 CD GLU A 69 -12.185 -14.312 13.866 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -11.555 -13.660 13.009 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -12.639 -13.784 14.904 1.00 0.00 O ATOM 0 H GLU A 69 -11.198 -17.109 11.556 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.631 -15.418 13.292 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.514 -17.720 13.938 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.962 -16.485 15.051 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.661 -15.962 12.585 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.286 -16.117 14.215 1.00 0.00 H new ATOM 1061 N GLU A 70 -8.787 -18.526 12.818 1.00 0.00 N ATOM 1062 CA GLU A 70 -7.755 -19.534 13.084 1.00 0.00 C ATOM 1063 C GLU A 70 -6.664 -19.520 12.011 1.00 0.00 C ATOM 1064 O GLU A 70 -5.560 -20.018 12.233 1.00 0.00 O ATOM 1065 CB GLU A 70 -8.379 -20.933 13.179 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.153 -21.357 11.935 1.00 0.00 C ATOM 1067 CD GLU A 70 -9.677 -22.781 12.029 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -10.608 -23.028 12.822 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -9.145 -23.667 11.327 1.00 0.00 O ATOM 0 H GLU A 70 -9.419 -18.764 12.053 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.293 -19.284 14.039 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.588 -21.659 13.367 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -9.049 -20.962 14.038 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -9.990 -20.675 11.782 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.507 -21.269 11.062 1.00 0.00 H new ATOM 1076 N SER A 71 -6.974 -18.954 10.849 1.00 0.00 N ATOM 1077 CA SER A 71 -6.023 -18.910 9.740 1.00 0.00 C ATOM 1078 C SER A 71 -5.454 -17.502 9.570 1.00 0.00 C ATOM 1079 O SER A 71 -6.119 -16.614 9.029 1.00 0.00 O ATOM 1080 CB SER A 71 -6.705 -19.366 8.443 1.00 0.00 C ATOM 1081 OG SER A 71 -7.349 -20.618 8.619 1.00 0.00 O ATOM 0 H SER A 71 -7.875 -18.519 10.649 1.00 0.00 H new ATOM 0 HA SER A 71 -5.199 -19.587 9.965 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.434 -18.619 8.130 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.965 -19.443 7.646 1.00 0.00 H new ATOM 0 HG SER A 71 -8.233 -20.478 9.018 1.00 0.00 H new ATOM 1087 N ASP A 72 -4.235 -17.291 10.057 1.00 0.00 N ATOM 1088 CA ASP A 72 -3.558 -16.007 9.892 1.00 0.00 C ATOM 1089 C ASP A 72 -2.927 -15.926 8.505 1.00 0.00 C ATOM 1090 O ASP A 72 -1.814 -16.405 8.289 1.00 0.00 O ATOM 1091 CB ASP A 72 -2.494 -15.804 10.982 1.00 0.00 C ATOM 1092 CG ASP A 72 -1.736 -14.492 10.827 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -2.387 -13.438 10.673 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -0.484 -14.505 10.877 1.00 0.00 O ATOM 0 H ASP A 72 -3.696 -17.990 10.568 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.296 -15.211 9.992 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.973 -15.828 11.961 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -1.787 -16.633 10.953 1.00 0.00 H new ATOM 1099 N PHE A 73 -3.669 -15.355 7.560 1.00 0.00 N ATOM 1100 CA PHE A 73 -3.228 -15.266 6.170 1.00 0.00 C ATOM 1101 C PHE A 73 -1.942 -14.452 6.053 1.00 0.00 C ATOM 1102 O PHE A 73 -1.861 -13.324 6.545 1.00 0.00 O ATOM 1103 CB PHE A 73 -4.334 -14.656 5.300 1.00 0.00 C ATOM 1104 CG PHE A 73 -5.608 -15.465 5.310 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -5.735 -16.594 4.511 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -6.672 -15.105 6.126 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -6.897 -17.342 4.524 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -7.833 -15.852 6.143 1.00 0.00 C ATOM 1109 CZ PHE A 73 -7.946 -16.971 5.341 1.00 0.00 C ATOM 0 H PHE A 73 -4.586 -14.944 7.733 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.019 -16.275 5.814 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.549 -13.647 5.651 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -3.975 -14.568 4.275 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.916 -16.891 3.872 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.591 -14.231 6.755 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -6.984 -18.216 3.896 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -8.653 -15.561 6.783 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.854 -17.555 5.353 1.00 0.00 H new ATOM 1119 N LEU A 74 -0.945 -15.041 5.401 1.00 0.00 N ATOM 1120 CA LEU A 74 0.374 -14.430 5.262 1.00 0.00 C ATOM 1121 C LEU A 74 0.651 -14.051 3.810 1.00 0.00 C ATOM 1122 O LEU A 74 1.050 -12.922 3.515 1.00 0.00 O ATOM 1123 CB LEU A 74 1.457 -15.408 5.746 1.00 0.00 C ATOM 1124 CG LEU A 74 1.358 -15.825 7.222 1.00 0.00 C ATOM 1125 CD1 LEU A 74 2.445 -16.840 7.576 1.00 0.00 C ATOM 1126 CD2 LEU A 74 1.441 -14.602 8.131 1.00 0.00 C ATOM 0 H LEU A 74 -1.027 -15.954 4.954 1.00 0.00 H new ATOM 0 HA LEU A 74 0.393 -13.525 5.870 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.414 -16.306 5.129 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.434 -14.953 5.579 1.00 0.00 H new ATOM 0 HG LEU A 74 0.390 -16.302 7.377 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.354 -17.119 8.626 1.00 0.00 H new ATOM 0 HD12 LEU A 74 2.331 -17.727 6.953 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.426 -16.398 7.402 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.369 -14.917 9.172 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.392 -14.093 7.971 1.00 0.00 H new ATOM 0 HD23 LEU A 74 0.622 -13.921 7.901 1.00 0.00 H new ATOM 1138 N GLU A 75 0.426 -15.002 2.908 1.00 0.00 N ATOM 1139 CA GLU A 75 0.795 -14.843 1.505 1.00 0.00 C ATOM 1140 C GLU A 75 -0.175 -15.599 0.600 1.00 0.00 C ATOM 1141 O GLU A 75 -0.767 -16.600 1.006 1.00 0.00 O ATOM 1142 CB GLU A 75 2.231 -15.357 1.295 1.00 0.00 C ATOM 1143 CG GLU A 75 2.708 -15.352 -0.154 1.00 0.00 C ATOM 1144 CD GLU A 75 4.079 -15.992 -0.315 1.00 0.00 C ATOM 1145 OE1 GLU A 75 4.151 -17.231 -0.484 1.00 0.00 O ATOM 1146 OE2 GLU A 75 5.092 -15.264 -0.266 1.00 0.00 O ATOM 0 H GLU A 75 -0.013 -15.897 3.126 1.00 0.00 H new ATOM 0 HA GLU A 75 0.745 -13.786 1.243 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.911 -14.746 1.888 1.00 0.00 H new ATOM 0 HB3 GLU A 75 2.298 -16.374 1.681 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.986 -15.885 -0.773 1.00 0.00 H new ATOM 0 HG3 GLU A 75 2.744 -14.325 -0.518 1.00 0.00 H new ATOM 1153 N LEU A 76 -0.326 -15.111 -0.627 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.174 -15.752 -1.623 1.00 0.00 C ATOM 1155 C LEU A 76 -0.366 -15.950 -2.903 1.00 0.00 C ATOM 1156 O LEU A 76 0.203 -14.998 -3.440 1.00 0.00 O ATOM 1157 CB LEU A 76 -2.433 -14.899 -1.872 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.577 -15.572 -2.661 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -3.290 -15.593 -4.159 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -3.831 -16.987 -2.137 1.00 0.00 C ATOM 0 H LEU A 76 0.135 -14.263 -0.957 1.00 0.00 H new ATOM 0 HA LEU A 76 -1.506 -16.727 -1.266 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.826 -14.581 -0.906 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.134 -13.998 -2.407 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.478 -14.978 -2.509 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.117 -16.074 -4.681 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.177 -14.572 -4.522 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.371 -16.148 -4.346 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -4.640 -17.445 -2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -2.926 -17.584 -2.248 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.108 -16.941 -1.084 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.327 -17.185 -3.384 1.00 0.00 N ATOM 1173 CA ARG A 77 0.526 -17.565 -4.503 1.00 0.00 C ATOM 1174 C ARG A 77 -0.295 -18.278 -5.574 1.00 0.00 C ATOM 1175 O ARG A 77 -0.602 -19.462 -5.448 1.00 0.00 O ATOM 1176 CB ARG A 77 1.654 -18.471 -3.985 1.00 0.00 C ATOM 1177 CG ARG A 77 2.597 -19.004 -5.060 1.00 0.00 C ATOM 1178 CD ARG A 77 3.656 -19.918 -4.451 1.00 0.00 C ATOM 1179 NE ARG A 77 4.535 -20.512 -5.460 1.00 0.00 N ATOM 1180 CZ ARG A 77 5.496 -21.395 -5.185 1.00 0.00 C ATOM 1181 NH1 ARG A 77 5.711 -21.788 -3.936 1.00 0.00 N ATOM 1182 NH2 ARG A 77 6.240 -21.892 -6.162 1.00 0.00 N ATOM 0 H ARG A 77 -0.886 -17.952 -3.010 1.00 0.00 H new ATOM 0 HA ARG A 77 0.962 -16.674 -4.954 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.239 -17.915 -3.253 1.00 0.00 H new ATOM 0 HB3 ARG A 77 1.209 -19.317 -3.461 1.00 0.00 H new ATOM 0 HG2 ARG A 77 2.027 -19.551 -5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 77 3.080 -18.171 -5.571 1.00 0.00 H new ATOM 0 HD2 ARG A 77 4.256 -19.349 -3.741 1.00 0.00 H new ATOM 0 HD3 ARG A 77 3.165 -20.713 -3.889 1.00 0.00 H new ATOM 0 HE ARG A 77 4.404 -20.234 -6.433 1.00 0.00 H new ATOM 0 HH11 ARG A 77 5.139 -21.414 -3.178 1.00 0.00 H new ATOM 0 HH12 ARG A 77 6.448 -22.464 -3.734 1.00 0.00 H new ATOM 0 HH21 ARG A 77 6.078 -21.599 -7.126 1.00 0.00 H new ATOM 0 HH22 ARG A 77 6.975 -22.567 -5.951 1.00 0.00 H new ATOM 1196 N VAL A 78 -0.672 -17.543 -6.612 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.456 -18.102 -7.709 1.00 0.00 C ATOM 1198 C VAL A 78 -0.555 -18.910 -8.640 1.00 0.00 C ATOM 1199 O VAL A 78 0.485 -18.420 -9.082 1.00 0.00 O ATOM 1200 CB VAL A 78 -2.171 -16.988 -8.512 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -2.896 -17.563 -9.732 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -3.143 -16.218 -7.618 1.00 0.00 C ATOM 0 H VAL A 78 -0.447 -16.554 -6.719 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.215 -18.756 -7.279 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.411 -16.294 -8.872 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.389 -16.757 -10.276 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.175 -18.054 -10.386 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.641 -18.288 -9.404 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.635 -15.440 -8.201 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.892 -16.903 -7.221 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.595 -15.762 -6.793 1.00 0.00 H new ATOM 1212 N LEU A 79 -0.953 -20.146 -8.924 1.00 0.00 N ATOM 1213 CA LEU A 79 -0.165 -21.034 -9.775 1.00 0.00 C ATOM 1214 C LEU A 79 -0.656 -20.963 -11.220 1.00 0.00 C ATOM 1215 O LEU A 79 0.093 -20.584 -12.123 1.00 0.00 O ATOM 1216 CB LEU A 79 -0.242 -22.479 -9.256 1.00 0.00 C ATOM 1217 CG LEU A 79 0.250 -22.686 -7.811 1.00 0.00 C ATOM 1218 CD1 LEU A 79 0.109 -24.148 -7.396 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.697 -22.219 -7.656 1.00 0.00 C ATOM 0 H LEU A 79 -1.819 -20.557 -8.577 1.00 0.00 H new ATOM 0 HA LEU A 79 0.875 -20.708 -9.746 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.276 -22.817 -9.322 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.345 -23.117 -9.917 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.374 -22.082 -7.152 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.462 -24.271 -6.372 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.938 -24.444 -7.457 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.702 -24.774 -8.062 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.022 -22.375 -6.627 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.337 -22.789 -8.329 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.765 -21.159 -7.901 1.00 0.00 H new ATOM 1231 N GLY A 80 -1.923 -21.307 -11.424 1.00 0.00 N ATOM 1232 CA GLY A 80 -2.490 -21.321 -12.760 1.00 0.00 C ATOM 1233 C GLY A 80 -3.973 -21.016 -12.750 1.00 0.00 C ATOM 1234 O GLY A 80 -4.630 -21.150 -11.717 1.00 0.00 O ATOM 0 H GLY A 80 -2.570 -21.578 -10.684 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.973 -20.589 -13.381 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.324 -22.298 -13.214 1.00 0.00 H new ATOM 1238 N SER A 81 -4.501 -20.612 -13.898 1.00 0.00 N ATOM 1239 CA SER A 81 -5.907 -20.244 -14.021 1.00 0.00 C ATOM 1240 C SER A 81 -6.495 -20.800 -15.317 1.00 0.00 C ATOM 1241 O SER A 81 -5.783 -20.964 -16.314 1.00 0.00 O ATOM 1242 CB SER A 81 -6.046 -18.718 -13.980 1.00 0.00 C ATOM 1243 OG SER A 81 -5.161 -18.104 -14.904 1.00 0.00 O ATOM 0 H SER A 81 -3.971 -20.530 -14.766 1.00 0.00 H new ATOM 0 HA SER A 81 -6.460 -20.674 -13.186 1.00 0.00 H new ATOM 0 HB2 SER A 81 -7.073 -18.436 -14.212 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.836 -18.357 -12.973 1.00 0.00 H new ATOM 0 HG SER A 81 -5.392 -17.156 -14.998 1.00 0.00 H new ATOM 1249 N SER A 82 -7.788 -21.106 -15.295 1.00 0.00 N ATOM 1250 CA SER A 82 -8.476 -21.644 -16.460 1.00 0.00 C ATOM 1251 C SER A 82 -9.946 -21.217 -16.462 1.00 0.00 C ATOM 1252 O SER A 82 -10.695 -21.532 -15.535 1.00 0.00 O ATOM 1253 CB SER A 82 -8.367 -23.175 -16.461 1.00 0.00 C ATOM 1254 OG SER A 82 -7.011 -23.588 -16.380 1.00 0.00 O ATOM 0 H SER A 82 -8.383 -20.989 -14.475 1.00 0.00 H new ATOM 0 HA SER A 82 -8.006 -21.250 -17.361 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.926 -23.584 -15.619 1.00 0.00 H new ATOM 0 HB3 SER A 82 -8.819 -23.575 -17.369 1.00 0.00 H new ATOM 0 HG SER A 82 -6.967 -24.567 -16.381 1.00 0.00 H new ATOM 1260 N GLU A 83 -10.343 -20.485 -17.498 1.00 0.00 N ATOM 1261 CA GLU A 83 -11.736 -20.096 -17.694 1.00 0.00 C ATOM 1262 C GLU A 83 -12.297 -20.838 -18.906 1.00 0.00 C ATOM 1263 O GLU A 83 -11.844 -20.633 -20.035 1.00 0.00 O ATOM 1264 CB GLU A 83 -11.839 -18.574 -17.892 1.00 0.00 C ATOM 1265 CG GLU A 83 -13.258 -18.068 -18.146 1.00 0.00 C ATOM 1266 CD GLU A 83 -13.326 -16.554 -18.303 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -12.638 -16.019 -19.196 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -14.074 -15.891 -17.547 1.00 0.00 O ATOM 0 H GLU A 83 -9.711 -20.146 -18.223 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.319 -20.362 -16.812 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.441 -18.077 -17.007 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -11.207 -18.285 -18.732 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.651 -18.540 -19.046 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.901 -18.372 -17.320 1.00 0.00 H new ATOM 1275 N LYS A 84 -13.266 -21.713 -18.664 1.00 0.00 N ATOM 1276 CA LYS A 84 -13.848 -22.545 -19.715 1.00 0.00 C ATOM 1277 C LYS A 84 -15.317 -22.184 -19.921 1.00 0.00 C ATOM 1278 O LYS A 84 -16.203 -22.735 -19.262 1.00 0.00 O ATOM 1279 CB LYS A 84 -13.709 -24.035 -19.353 1.00 0.00 C ATOM 1280 CG LYS A 84 -12.287 -24.457 -19.004 1.00 0.00 C ATOM 1281 CD LYS A 84 -11.318 -24.189 -20.150 1.00 0.00 C ATOM 1282 CE LYS A 84 -9.904 -24.617 -19.793 1.00 0.00 C ATOM 1283 NZ LYS A 84 -8.937 -24.285 -20.870 1.00 0.00 N ATOM 0 H LYS A 84 -13.670 -21.867 -17.740 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.310 -22.361 -20.645 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -14.361 -24.255 -18.507 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -14.060 -24.637 -20.191 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -11.956 -23.919 -18.115 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -12.273 -25.519 -18.758 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -11.648 -24.725 -21.040 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -11.327 -23.127 -20.395 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -9.599 -24.128 -18.868 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.886 -25.691 -19.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -7.984 -24.593 -20.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.213 -24.772 -21.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.935 -23.257 -21.030 1.00 0.00 H new ATOM 1297 N GLY A 85 -15.563 -21.237 -20.821 1.00 0.00 N ATOM 1298 CA GLY A 85 -16.915 -20.784 -21.088 1.00 0.00 C ATOM 1299 C GLY A 85 -17.550 -20.118 -19.881 1.00 0.00 C ATOM 1300 O GLY A 85 -17.385 -18.914 -19.668 1.00 0.00 O ATOM 0 H GLY A 85 -14.843 -20.772 -21.374 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.902 -20.082 -21.922 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.526 -21.633 -21.395 1.00 0.00 H new ATOM 1304 N SER A 86 -18.263 -20.906 -19.081 1.00 0.00 N ATOM 1305 CA SER A 86 -18.949 -20.397 -17.897 1.00 0.00 C ATOM 1306 C SER A 86 -18.484 -21.131 -16.635 1.00 0.00 C ATOM 1307 O SER A 86 -18.892 -20.792 -15.522 1.00 0.00 O ATOM 1308 CB SER A 86 -20.463 -20.538 -18.081 1.00 0.00 C ATOM 1309 OG SER A 86 -20.885 -19.897 -19.279 1.00 0.00 O ATOM 0 H SER A 86 -18.381 -21.908 -19.233 1.00 0.00 H new ATOM 0 HA SER A 86 -18.702 -19.342 -17.774 1.00 0.00 H new ATOM 0 HB2 SER A 86 -20.734 -21.593 -18.112 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.981 -20.101 -17.227 1.00 0.00 H new ATOM 0 HG SER A 86 -21.854 -19.999 -19.381 1.00 0.00 H new ATOM 1315 N ARG A 87 -17.634 -22.142 -16.812 1.00 0.00 N ATOM 1316 CA ARG A 87 -17.030 -22.849 -15.685 1.00 0.00 C ATOM 1317 C ARG A 87 -15.578 -22.413 -15.558 1.00 0.00 C ATOM 1318 O ARG A 87 -14.847 -22.382 -16.545 1.00 0.00 O ATOM 1319 CB ARG A 87 -17.134 -24.376 -15.889 1.00 0.00 C ATOM 1320 CG ARG A 87 -16.692 -25.226 -14.687 1.00 0.00 C ATOM 1321 CD ARG A 87 -15.178 -25.441 -14.634 1.00 0.00 C ATOM 1322 NE ARG A 87 -14.687 -26.180 -15.801 1.00 0.00 N ATOM 1323 CZ ARG A 87 -13.417 -26.557 -15.979 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -12.495 -26.289 -15.063 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -13.074 -27.221 -17.075 1.00 0.00 N ATOM 0 H ARG A 87 -17.348 -22.490 -17.727 1.00 0.00 H new ATOM 0 HA ARG A 87 -17.561 -22.604 -14.765 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -18.167 -24.625 -16.130 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -16.529 -24.654 -16.752 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -17.017 -24.741 -13.767 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -17.190 -26.195 -14.731 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -14.676 -24.475 -14.579 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -14.921 -25.986 -13.726 1.00 0.00 H new ATOM 0 HE ARG A 87 -15.361 -26.423 -16.527 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -12.752 -25.790 -14.211 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -11.529 -26.582 -15.211 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -13.778 -27.442 -17.779 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -12.106 -27.510 -17.214 1.00 0.00 H new ATOM 1339 N GLY A 88 -15.162 -22.081 -14.347 1.00 0.00 N ATOM 1340 CA GLY A 88 -13.810 -21.608 -14.127 1.00 0.00 C ATOM 1341 C GLY A 88 -13.088 -22.423 -13.088 1.00 0.00 C ATOM 1342 O GLY A 88 -13.716 -23.115 -12.284 1.00 0.00 O ATOM 0 H GLY A 88 -15.739 -22.131 -13.507 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.256 -21.645 -15.065 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.838 -20.564 -13.814 1.00 0.00 H new ATOM 1346 N THR A 89 -11.771 -22.350 -13.110 1.00 0.00 N ATOM 1347 CA THR A 89 -10.939 -23.076 -12.172 1.00 0.00 C ATOM 1348 C THR A 89 -9.579 -22.395 -12.053 1.00 0.00 C ATOM 1349 O THR A 89 -8.929 -22.116 -13.060 1.00 0.00 O ATOM 1350 CB THR A 89 -10.753 -24.547 -12.620 1.00 0.00 C ATOM 1351 OG1 THR A 89 -12.033 -25.193 -12.721 1.00 0.00 O ATOM 1352 CG2 THR A 89 -9.868 -25.317 -11.648 1.00 0.00 C ATOM 0 H THR A 89 -11.248 -21.785 -13.779 1.00 0.00 H new ATOM 0 HA THR A 89 -11.434 -23.073 -11.201 1.00 0.00 H new ATOM 0 HB THR A 89 -10.264 -24.541 -13.594 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.917 -26.163 -12.640 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.758 -26.345 -11.992 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.887 -24.845 -11.597 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.325 -25.313 -10.658 1.00 0.00 H new ATOM 1360 N VAL A 90 -9.167 -22.105 -10.826 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.865 -21.499 -10.578 1.00 0.00 C ATOM 1362 C VAL A 90 -7.142 -22.251 -9.465 1.00 0.00 C ATOM 1363 O VAL A 90 -7.712 -22.526 -8.405 1.00 0.00 O ATOM 1364 CB VAL A 90 -7.981 -19.984 -10.238 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -8.921 -19.744 -9.061 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.603 -19.374 -9.966 1.00 0.00 C ATOM 0 H VAL A 90 -9.717 -22.280 -9.985 1.00 0.00 H new ATOM 0 HA VAL A 90 -7.282 -21.575 -11.496 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.408 -19.487 -11.109 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.977 -18.676 -8.852 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.915 -20.119 -9.307 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.544 -20.266 -8.182 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.714 -18.315 -9.731 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.138 -19.886 -9.123 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.975 -19.486 -10.850 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.901 -22.620 -9.742 1.00 0.00 N ATOM 1377 CA GLU A 91 -5.067 -23.346 -8.798 1.00 0.00 C ATOM 1378 C GLU A 91 -4.102 -22.384 -8.117 1.00 0.00 C ATOM 1379 O GLU A 91 -3.473 -21.551 -8.778 1.00 0.00 O ATOM 1380 CB GLU A 91 -4.299 -24.451 -9.530 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.297 -25.191 -8.655 1.00 0.00 C ATOM 1382 CD GLU A 91 -2.629 -26.343 -9.380 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -1.808 -26.092 -10.282 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -2.930 -27.506 -9.048 1.00 0.00 O ATOM 0 H GLU A 91 -5.443 -22.423 -10.632 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.696 -23.805 -8.036 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.013 -25.169 -9.935 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.772 -24.013 -10.378 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.535 -24.492 -8.311 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.805 -25.570 -7.768 1.00 0.00 H new ATOM 1391 N PHE A 92 -3.982 -22.501 -6.801 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.162 -21.584 -6.025 1.00 0.00 C ATOM 1393 C PHE A 92 -2.682 -22.229 -4.730 1.00 0.00 C ATOM 1394 O PHE A 92 -3.103 -23.334 -4.369 1.00 0.00 O ATOM 1395 CB PHE A 92 -3.952 -20.302 -5.712 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.257 -20.549 -4.995 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -5.305 -20.619 -3.608 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -6.435 -20.713 -5.711 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -6.499 -20.846 -2.954 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -7.631 -20.940 -5.060 1.00 0.00 C ATOM 1401 CZ PHE A 92 -7.664 -21.006 -3.681 1.00 0.00 C ATOM 0 H PHE A 92 -4.444 -23.224 -6.249 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.286 -21.331 -6.622 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.332 -19.645 -5.102 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.155 -19.775 -6.644 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.398 -20.494 -3.035 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.416 -20.662 -6.790 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.523 -20.899 -1.876 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.540 -21.066 -5.629 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.599 -21.183 -3.171 1.00 0.00 H new ATOM 1411 N ILE A 93 -1.790 -21.522 -4.050 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.283 -21.915 -2.746 1.00 0.00 C ATOM 1413 C ILE A 93 -1.489 -20.766 -1.762 1.00 0.00 C ATOM 1414 O ILE A 93 -0.911 -19.688 -1.925 1.00 0.00 O ATOM 1415 CB ILE A 93 0.225 -22.281 -2.806 1.00 0.00 C ATOM 1416 CG1 ILE A 93 0.445 -23.526 -3.684 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.784 -22.509 -1.402 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.899 -23.929 -3.831 1.00 0.00 C ATOM 0 H ILE A 93 -1.394 -20.648 -4.395 1.00 0.00 H new ATOM 0 HA ILE A 93 -1.830 -22.799 -2.419 1.00 0.00 H new ATOM 0 HB ILE A 93 0.761 -21.444 -3.254 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.111 -24.361 -3.258 1.00 0.00 H new ATOM 0 HG13 ILE A 93 0.029 -23.338 -4.674 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.842 -22.764 -1.468 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.666 -21.600 -0.812 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.243 -23.325 -0.923 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.969 -24.814 -4.464 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.459 -23.112 -4.286 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.316 -24.151 -2.849 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.342 -20.985 -0.770 1.00 0.00 N ATOM 1431 CA ALA A 94 -2.604 -19.985 0.258 1.00 0.00 C ATOM 1432 C ALA A 94 -1.704 -20.228 1.465 1.00 0.00 C ATOM 1433 O ALA A 94 -1.806 -21.266 2.121 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.076 -20.020 0.666 1.00 0.00 C ATOM 0 H ALA A 94 -2.867 -21.852 -0.655 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.384 -18.996 -0.144 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.259 -19.269 1.434 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.700 -19.810 -0.203 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.321 -21.007 1.058 1.00 0.00 H new ATOM 1440 N ARG A 95 -0.817 -19.282 1.748 1.00 0.00 N ATOM 1441 CA ARG A 95 0.093 -19.398 2.881 1.00 0.00 C ATOM 1442 C ARG A 95 -0.492 -18.686 4.089 1.00 0.00 C ATOM 1443 O ARG A 95 -0.789 -17.491 4.034 1.00 0.00 O ATOM 1444 CB ARG A 95 1.462 -18.790 2.554 1.00 0.00 C ATOM 1445 CG ARG A 95 2.468 -18.911 3.700 1.00 0.00 C ATOM 1446 CD ARG A 95 3.690 -18.024 3.494 1.00 0.00 C ATOM 1447 NE ARG A 95 4.339 -18.265 2.204 1.00 0.00 N ATOM 1448 CZ ARG A 95 5.575 -18.739 2.062 1.00 0.00 C ATOM 1449 NH1 ARG A 95 6.303 -19.054 3.128 1.00 0.00 N ATOM 1450 NH2 ARG A 95 6.078 -18.889 0.847 1.00 0.00 N ATOM 0 H ARG A 95 -0.708 -18.424 1.207 1.00 0.00 H new ATOM 0 HA ARG A 95 0.224 -20.458 3.100 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.868 -19.282 1.670 1.00 0.00 H new ATOM 0 HB3 ARG A 95 1.333 -17.737 2.302 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.981 -18.643 4.638 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.787 -19.949 3.792 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.392 -16.978 3.559 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.405 -18.202 4.297 1.00 0.00 H new ATOM 0 HE ARG A 95 3.809 -18.056 1.358 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.916 -18.933 4.064 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.249 -19.417 3.010 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.520 -18.642 0.030 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.024 -19.251 0.728 1.00 0.00 H new ATOM 1464 N PHE A 96 -0.653 -19.421 5.174 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.175 -18.869 6.414 1.00 0.00 C ATOM 1466 C PHE A 96 -0.485 -19.513 7.608 1.00 0.00 C ATOM 1467 O PHE A 96 0.132 -20.571 7.485 1.00 0.00 O ATOM 1468 CB PHE A 96 -2.701 -19.069 6.496 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.176 -20.430 6.035 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -2.760 -21.591 6.676 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.041 -20.545 4.955 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -3.194 -22.830 6.248 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -4.479 -21.783 4.526 1.00 0.00 C ATOM 1474 CZ PHE A 96 -4.054 -22.927 5.174 1.00 0.00 C ATOM 0 H PHE A 96 -0.427 -20.414 5.222 1.00 0.00 H new ATOM 0 HA PHE A 96 -0.971 -17.798 6.431 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.021 -18.915 7.527 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -3.189 -18.303 5.893 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.089 -21.523 7.519 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.376 -19.655 4.443 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -2.860 -23.724 6.754 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.153 -21.857 3.685 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.395 -23.896 4.840 1.00 0.00 H new ATOM 1484 N ARG A 97 -0.581 -18.864 8.755 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.065 -19.415 9.994 1.00 0.00 C ATOM 1486 C ARG A 97 -1.174 -20.232 10.649 1.00 0.00 C ATOM 1487 O ARG A 97 -2.190 -19.682 11.082 1.00 0.00 O ATOM 1488 CB ARG A 97 0.414 -18.285 10.914 1.00 0.00 C ATOM 1489 CG ARG A 97 1.278 -18.746 12.082 1.00 0.00 C ATOM 1490 CD ARG A 97 1.769 -17.558 12.900 1.00 0.00 C ATOM 1491 NE ARG A 97 2.634 -17.953 14.012 1.00 0.00 N ATOM 1492 CZ ARG A 97 2.992 -17.131 15.004 1.00 0.00 C ATOM 1493 NH1 ARG A 97 2.545 -15.880 15.032 1.00 0.00 N ATOM 1494 NH2 ARG A 97 3.796 -17.557 15.969 1.00 0.00 N ATOM 0 H ARG A 97 -1.016 -17.947 8.853 1.00 0.00 H new ATOM 0 HA ARG A 97 0.791 -20.061 9.799 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.980 -17.566 10.321 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.456 -17.760 11.307 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.705 -19.419 12.720 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.131 -19.311 11.707 1.00 0.00 H new ATOM 0 HD2 ARG A 97 2.313 -16.874 12.248 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.910 -17.012 13.290 1.00 0.00 H new ATOM 0 HE ARG A 97 2.984 -18.911 14.032 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.926 -15.543 14.295 1.00 0.00 H new ATOM 0 HH12 ARG A 97 2.821 -15.257 15.791 1.00 0.00 H new ATOM 0 HH21 ARG A 97 4.144 -18.516 15.957 1.00 0.00 H new ATOM 0 HH22 ARG A 97 4.066 -16.926 16.723 1.00 0.00 H new ATOM 1508 N ARG A 98 -0.980 -21.543 10.687 1.00 0.00 N ATOM 1509 CA ARG A 98 -2.022 -22.479 11.091 1.00 0.00 C ATOM 1510 C ARG A 98 -2.301 -22.359 12.590 1.00 0.00 C ATOM 1511 O ARG A 98 -1.417 -22.603 13.416 1.00 0.00 O ATOM 1512 CB ARG A 98 -1.591 -23.913 10.721 1.00 0.00 C ATOM 1513 CG ARG A 98 -2.743 -24.851 10.357 1.00 0.00 C ATOM 1514 CD ARG A 98 -3.608 -25.222 11.557 1.00 0.00 C ATOM 1515 NE ARG A 98 -4.755 -26.038 11.153 1.00 0.00 N ATOM 1516 CZ ARG A 98 -4.932 -27.316 11.491 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -4.055 -27.932 12.275 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -5.990 -27.978 11.039 1.00 0.00 N ATOM 0 H ARG A 98 -0.097 -21.988 10.439 1.00 0.00 H new ATOM 0 HA ARG A 98 -2.946 -22.241 10.564 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -0.900 -23.865 9.880 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -1.043 -24.341 11.560 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -3.366 -24.376 9.599 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.338 -25.760 9.912 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -3.009 -25.768 12.285 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -3.959 -24.315 12.049 1.00 0.00 H new ATOM 0 HE ARG A 98 -5.469 -25.598 10.572 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -3.240 -27.428 12.623 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -4.197 -28.910 12.529 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -6.665 -27.509 10.435 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -6.128 -28.955 11.296 1.00 0.00 H new ATOM 1553 N PRO A 102 2.652 -22.730 13.854 1.00 0.00 N ATOM 1554 CA PRO A 102 3.303 -23.192 12.624 1.00 0.00 C ATOM 1555 C PRO A 102 2.700 -22.557 11.372 1.00 0.00 C ATOM 1556 O PRO A 102 1.530 -22.171 11.362 1.00 0.00 O ATOM 1557 CB PRO A 102 3.039 -24.704 12.640 1.00 0.00 C ATOM 1558 CG PRO A 102 1.759 -24.851 13.392 1.00 0.00 C ATOM 1559 CD PRO A 102 1.771 -23.766 14.439 1.00 0.00 C ATOM 0 HA PRO A 102 4.360 -22.926 12.593 1.00 0.00 H new ATOM 0 HB2 PRO A 102 2.954 -25.103 11.629 1.00 0.00 H new ATOM 0 HB3 PRO A 102 3.851 -25.244 13.128 1.00 0.00 H new ATOM 0 HG2 PRO A 102 0.901 -24.744 12.728 1.00 0.00 H new ATOM 0 HG3 PRO A 102 1.686 -25.837 13.851 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.769 -23.380 14.629 1.00 0.00 H new ATOM 0 HD3 PRO A 102 2.158 -24.131 15.391 1.00 0.00 H new ATOM 1567 N GLU A 103 3.509 -22.432 10.325 1.00 0.00 N ATOM 1568 CA GLU A 103 3.016 -22.007 9.022 1.00 0.00 C ATOM 1569 C GLU A 103 2.460 -23.208 8.270 1.00 0.00 C ATOM 1570 O GLU A 103 2.804 -24.354 8.571 1.00 0.00 O ATOM 1571 CB GLU A 103 4.124 -21.362 8.176 1.00 0.00 C ATOM 1572 CG GLU A 103 4.541 -19.966 8.617 1.00 0.00 C ATOM 1573 CD GLU A 103 5.584 -19.364 7.683 1.00 0.00 C ATOM 1574 OE1 GLU A 103 5.219 -18.947 6.561 1.00 0.00 O ATOM 1575 OE2 GLU A 103 6.778 -19.336 8.051 1.00 0.00 O ATOM 0 H GLU A 103 4.511 -22.620 10.355 1.00 0.00 H new ATOM 0 HA GLU A 103 2.236 -21.265 9.191 1.00 0.00 H new ATOM 0 HB2 GLU A 103 5.000 -22.010 8.197 1.00 0.00 H new ATOM 0 HB3 GLU A 103 3.788 -21.314 7.140 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.665 -19.318 8.649 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.942 -20.010 9.630 1.00 0.00 H new ATOM 1582 N GLN A 104 1.604 -22.939 7.300 1.00 0.00 N ATOM 1583 CA GLN A 104 1.080 -23.968 6.421 1.00 0.00 C ATOM 1584 C GLN A 104 0.665 -23.337 5.101 1.00 0.00 C ATOM 1585 O GLN A 104 0.178 -22.203 5.068 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.113 -24.690 7.065 1.00 0.00 C ATOM 1587 CG GLN A 104 -0.674 -25.827 6.215 1.00 0.00 C ATOM 1588 CD GLN A 104 -1.886 -26.490 6.845 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -3.022 -26.077 6.618 1.00 0.00 O ATOM 1590 NE2 GLN A 104 -1.656 -27.527 7.634 1.00 0.00 N ATOM 0 H GLN A 104 1.253 -22.002 7.100 1.00 0.00 H new ATOM 0 HA GLN A 104 1.860 -24.709 6.243 1.00 0.00 H new ATOM 0 HB2 GLN A 104 0.194 -25.088 8.032 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -0.905 -23.966 7.255 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -0.947 -25.440 5.233 1.00 0.00 H new ATOM 0 HG3 GLN A 104 0.103 -26.575 6.058 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -0.699 -27.840 7.798 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -2.435 -28.013 8.078 1.00 0.00 H new ATOM 1599 N SER A 105 0.868 -24.065 4.021 1.00 0.00 N ATOM 1600 CA SER A 105 0.513 -23.591 2.698 1.00 0.00 C ATOM 1601 C SER A 105 -0.496 -24.543 2.065 1.00 0.00 C ATOM 1602 O SER A 105 -0.177 -25.693 1.758 1.00 0.00 O ATOM 1603 CB SER A 105 1.775 -23.451 1.835 1.00 0.00 C ATOM 1604 OG SER A 105 2.600 -24.603 1.932 1.00 0.00 O ATOM 0 H SER A 105 1.282 -24.997 4.035 1.00 0.00 H new ATOM 0 HA SER A 105 0.050 -22.607 2.772 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.490 -23.292 0.795 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.337 -22.572 2.150 1.00 0.00 H new ATOM 0 HG SER A 105 2.048 -25.409 1.853 1.00 0.00 H new ATOM 1610 N HIS A 106 -1.718 -24.060 1.895 1.00 0.00 N ATOM 1611 CA HIS A 106 -2.804 -24.868 1.358 1.00 0.00 C ATOM 1612 C HIS A 106 -2.853 -24.755 -0.162 1.00 0.00 C ATOM 1613 O HIS A 106 -3.286 -23.739 -0.709 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.136 -24.429 1.983 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.347 -25.102 1.407 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -5.679 -26.417 1.655 1.00 0.00 N ATOM 1617 CD2 HIS A 106 -6.319 -24.620 0.602 1.00 0.00 C ATOM 1618 CE1 HIS A 106 -6.802 -26.711 1.027 1.00 0.00 C ATOM 1619 NE2 HIS A 106 -7.211 -25.637 0.383 1.00 0.00 N ATOM 0 H HIS A 106 -1.984 -23.102 2.124 1.00 0.00 H new ATOM 0 HA HIS A 106 -2.628 -25.914 1.611 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.102 -24.626 3.055 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.242 -23.351 1.860 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -6.382 -23.618 0.204 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -7.301 -27.669 1.039 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -8.055 -25.573 -0.186 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.385 -25.802 -0.831 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.417 -25.886 -2.286 1.00 0.00 C ATOM 1630 C HIS A 107 -3.711 -26.549 -2.733 1.00 0.00 C ATOM 1631 O HIS A 107 -3.904 -27.748 -2.531 1.00 0.00 O ATOM 1632 CB HIS A 107 -1.201 -26.681 -2.797 1.00 0.00 C ATOM 1633 CG HIS A 107 -1.273 -27.083 -4.248 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -0.744 -28.263 -4.721 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.795 -26.452 -5.330 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -0.932 -28.342 -6.022 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -1.568 -27.258 -6.419 1.00 0.00 N ATOM 0 H HIS A 107 -1.972 -26.618 -0.379 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.373 -24.881 -2.705 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.303 -26.082 -2.645 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.091 -27.580 -2.190 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -0.278 -28.968 -4.151 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.295 -25.495 -5.334 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -0.618 -29.157 -6.657 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.600 -25.770 -3.332 1.00 0.00 N ATOM 1647 CA GLU A 108 -5.863 -26.302 -3.816 1.00 0.00 C ATOM 1648 C GLU A 108 -6.135 -25.849 -5.240 1.00 0.00 C ATOM 1649 O GLU A 108 -5.397 -25.036 -5.806 1.00 0.00 O ATOM 1650 CB GLU A 108 -7.032 -25.886 -2.913 1.00 0.00 C ATOM 1651 CG GLU A 108 -7.353 -24.396 -2.939 1.00 0.00 C ATOM 1652 CD GLU A 108 -8.721 -24.086 -2.343 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -8.840 -24.058 -1.101 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -9.679 -23.877 -3.118 1.00 0.00 O ATOM 0 H GLU A 108 -4.470 -24.771 -3.494 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.780 -27.389 -3.797 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.921 -26.441 -3.212 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -6.804 -26.178 -1.888 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.587 -23.852 -2.386 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -7.318 -24.037 -3.968 1.00 0.00 H new ATOM 1661 N ARG A 109 -7.199 -26.393 -5.803 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.656 -26.040 -7.135 1.00 0.00 C ATOM 1663 C ARG A 109 -9.152 -25.753 -7.063 1.00 0.00 C ATOM 1664 O ARG A 109 -9.962 -26.675 -6.958 1.00 0.00 O ATOM 1665 CB ARG A 109 -7.345 -27.187 -8.107 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.665 -26.882 -9.565 1.00 0.00 C ATOM 1667 CD ARG A 109 -7.195 -28.003 -10.489 1.00 0.00 C ATOM 1668 NE ARG A 109 -5.738 -28.178 -10.450 1.00 0.00 N ATOM 1669 CZ ARG A 109 -5.076 -29.130 -11.114 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -5.733 -30.028 -11.839 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -3.754 -29.187 -11.040 1.00 0.00 N ATOM 0 H ARG A 109 -7.775 -27.099 -5.344 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.142 -25.152 -7.502 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.288 -27.440 -8.025 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.908 -28.069 -7.801 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.740 -26.741 -9.681 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.187 -25.946 -9.855 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.679 -28.936 -10.201 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.506 -27.784 -11.511 1.00 0.00 H new ATOM 0 HE ARG A 109 -5.195 -27.530 -9.879 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -6.751 -29.994 -11.892 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -5.220 -30.751 -12.343 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -3.245 -28.505 -10.477 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -3.246 -29.913 -11.546 1.00 0.00 H new ATOM 1685 N SER A 110 -9.506 -24.473 -7.080 1.00 0.00 N ATOM 1686 CA SER A 110 -10.876 -24.041 -6.812 1.00 0.00 C ATOM 1687 C SER A 110 -11.688 -23.903 -8.103 1.00 0.00 C ATOM 1688 O SER A 110 -11.202 -23.363 -9.102 1.00 0.00 O ATOM 1689 CB SER A 110 -10.848 -22.707 -6.054 1.00 0.00 C ATOM 1690 OG SER A 110 -12.143 -22.320 -5.631 1.00 0.00 O ATOM 0 H SER A 110 -8.859 -23.710 -7.278 1.00 0.00 H new ATOM 0 HA SER A 110 -11.364 -24.801 -6.202 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.193 -22.794 -5.187 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.427 -21.932 -6.695 1.00 0.00 H new ATOM 0 HG SER A 110 -12.422 -21.519 -6.122 1.00 0.00 H new ATOM 1696 N GLN A 111 -12.918 -24.419 -8.075 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.863 -24.275 -9.181 1.00 0.00 C ATOM 1698 C GLN A 111 -14.814 -23.107 -8.912 1.00 0.00 C ATOM 1699 O GLN A 111 -15.288 -22.923 -7.786 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.686 -25.562 -9.394 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.904 -26.737 -9.980 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.922 -27.357 -9.001 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -11.696 -26.870 -9.003 1.00 0.00 O flip ATOM 1704 NE2 GLN A 111 -13.262 -28.276 -8.258 1.00 0.00 N flip ATOM 0 H GLN A 111 -13.286 -24.948 -7.284 1.00 0.00 H new ATOM 0 HA GLN A 111 -13.284 -24.082 -10.084 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -15.109 -25.867 -8.437 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.523 -25.336 -10.055 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -14.606 -27.502 -10.312 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -13.361 -26.398 -10.862 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -14.220 -28.626 -8.285 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -12.586 -28.688 -7.615 1.00 0.00 H new ATOM 1713 N PHE A 112 -15.091 -22.331 -9.953 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.986 -21.182 -9.864 1.00 0.00 C ATOM 1715 C PHE A 112 -17.075 -21.278 -10.935 1.00 0.00 C ATOM 1716 O PHE A 112 -16.836 -21.795 -12.031 1.00 0.00 O ATOM 1717 CB PHE A 112 -15.199 -19.872 -10.037 1.00 0.00 C ATOM 1718 CG PHE A 112 -14.250 -19.559 -8.904 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -12.994 -20.145 -8.846 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.616 -18.673 -7.900 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -12.126 -19.855 -7.810 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -13.750 -18.380 -6.863 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.504 -18.972 -6.819 1.00 0.00 C ATOM 0 H PHE A 112 -14.701 -22.480 -10.884 1.00 0.00 H new ATOM 0 HA PHE A 112 -16.452 -21.184 -8.879 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -14.632 -19.923 -10.966 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.906 -19.049 -10.140 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.691 -20.836 -9.619 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -15.590 -18.207 -7.929 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -11.152 -20.320 -7.776 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -14.048 -17.689 -6.088 1.00 0.00 H new ATOM 0 HZ PHE A 112 -11.826 -18.745 -6.010 1.00 0.00 H new ATOM 1733 N ARG A 113 -18.267 -20.791 -10.607 1.00 0.00 N ATOM 1734 CA ARG A 113 -19.390 -20.744 -11.540 1.00 0.00 C ATOM 1735 C ARG A 113 -19.589 -19.314 -12.039 1.00 0.00 C ATOM 1736 O ARG A 113 -19.697 -18.385 -11.238 1.00 0.00 O ATOM 1737 CB ARG A 113 -20.670 -21.227 -10.841 1.00 0.00 C ATOM 1738 CG ARG A 113 -21.883 -21.358 -11.761 1.00 0.00 C ATOM 1739 CD ARG A 113 -21.699 -22.474 -12.784 1.00 0.00 C ATOM 1740 NE ARG A 113 -22.918 -22.725 -13.555 1.00 0.00 N ATOM 1741 CZ ARG A 113 -23.853 -23.616 -13.211 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -23.743 -24.302 -12.078 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -24.902 -23.810 -13.996 1.00 0.00 N ATOM 0 H ARG A 113 -18.483 -20.416 -9.683 1.00 0.00 H new ATOM 0 HA ARG A 113 -19.175 -21.395 -12.387 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -20.474 -22.195 -10.379 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.913 -20.533 -10.036 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -22.773 -21.556 -11.163 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -22.050 -20.414 -12.279 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -20.889 -22.211 -13.464 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -21.401 -23.389 -12.272 1.00 0.00 H new ATOM 0 HE ARG A 113 -23.063 -22.186 -14.409 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -22.942 -24.150 -11.465 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -24.460 -24.981 -11.821 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -24.996 -23.280 -14.862 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -25.616 -24.490 -13.734 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.619 -19.136 -13.356 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.880 -17.826 -13.945 1.00 0.00 C ATOM 1759 C LYS A 114 -21.373 -17.671 -14.199 1.00 0.00 C ATOM 1760 O LYS A 114 -21.943 -18.357 -15.057 1.00 0.00 O ATOM 1761 CB LYS A 114 -19.098 -17.649 -15.248 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.956 -16.191 -15.668 1.00 0.00 C ATOM 1763 CD LYS A 114 -17.978 -16.028 -16.826 1.00 0.00 C ATOM 1764 CE LYS A 114 -17.499 -14.591 -16.946 1.00 0.00 C ATOM 1765 NZ LYS A 114 -16.480 -14.436 -18.022 1.00 0.00 N ATOM 0 H LYS A 114 -19.466 -19.881 -14.035 1.00 0.00 H new ATOM 0 HA LYS A 114 -19.550 -17.056 -13.248 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -18.106 -18.085 -15.131 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -19.598 -18.203 -16.043 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.931 -15.800 -15.958 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -18.615 -15.600 -14.818 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -17.123 -16.687 -16.678 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -18.458 -16.332 -17.756 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -18.349 -13.941 -17.154 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -17.075 -14.268 -15.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -16.215 -13.434 -18.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.637 -14.998 -17.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -16.875 -14.768 -18.925 1.00 0.00 H new ATOM 1779 N ALA A 115 -22.007 -16.791 -13.439 1.00 0.00 N ATOM 1780 CA ALA A 115 -23.441 -16.572 -13.544 1.00 0.00 C ATOM 1781 C ALA A 115 -23.766 -15.089 -13.418 1.00 0.00 C ATOM 1782 O ALA A 115 -23.204 -14.390 -12.571 1.00 0.00 O ATOM 1783 CB ALA A 115 -24.175 -17.375 -12.479 1.00 0.00 C ATOM 0 H ALA A 115 -21.546 -16.212 -12.737 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.774 -16.911 -14.525 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -25.248 -17.203 -12.568 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.966 -18.436 -12.615 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -23.838 -17.062 -11.491 1.00 0.00 H new ATOM 1789 N ARG A 116 -24.652 -14.613 -14.291 1.00 0.00 N ATOM 1790 CA ARG A 116 -25.128 -13.232 -14.255 1.00 0.00 C ATOM 1791 C ARG A 116 -23.969 -12.254 -14.508 1.00 0.00 C ATOM 1792 O ARG A 116 -24.055 -11.066 -14.187 1.00 0.00 O ATOM 1793 CB ARG A 116 -25.807 -12.946 -12.901 1.00 0.00 C ATOM 1794 CG ARG A 116 -26.869 -11.854 -12.952 1.00 0.00 C ATOM 1795 CD ARG A 116 -28.069 -12.271 -13.796 1.00 0.00 C ATOM 1796 NE ARG A 116 -29.099 -11.232 -13.835 1.00 0.00 N ATOM 1797 CZ ARG A 116 -30.394 -11.466 -14.055 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -30.831 -12.708 -14.238 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -31.251 -10.454 -14.085 1.00 0.00 N ATOM 0 H ARG A 116 -25.059 -15.172 -15.041 1.00 0.00 H new ATOM 0 HA ARG A 116 -25.863 -13.090 -15.047 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -26.265 -13.865 -12.536 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -25.043 -12.661 -12.178 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -27.200 -11.621 -11.940 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -26.434 -10.943 -13.363 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -27.739 -12.493 -14.811 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -28.495 -13.189 -13.392 1.00 0.00 H new ATOM 0 HE ARG A 116 -28.808 -10.266 -13.684 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -30.175 -13.489 -14.211 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -31.822 -12.880 -14.406 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -30.919 -9.500 -13.940 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -32.242 -10.629 -14.253 1.00 0.00 H new ATOM 1813 N GLY A 117 -22.892 -12.772 -15.102 1.00 0.00 N ATOM 1814 CA GLY A 117 -21.715 -11.967 -15.401 1.00 0.00 C ATOM 1815 C GLY A 117 -20.671 -12.014 -14.299 1.00 0.00 C ATOM 1816 O GLY A 117 -19.518 -11.636 -14.512 1.00 0.00 O ATOM 0 H GLY A 117 -22.815 -13.749 -15.385 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -21.269 -12.317 -16.332 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -22.020 -10.933 -15.562 1.00 0.00 H new ATOM 1820 N ARG A 118 -21.070 -12.482 -13.120 1.00 0.00 N ATOM 1821 CA ARG A 118 -20.170 -12.558 -11.971 1.00 0.00 C ATOM 1822 C ARG A 118 -19.642 -13.979 -11.794 1.00 0.00 C ATOM 1823 O ARG A 118 -20.255 -14.941 -12.257 1.00 0.00 O ATOM 1824 CB ARG A 118 -20.888 -12.126 -10.679 1.00 0.00 C ATOM 1825 CG ARG A 118 -21.271 -10.646 -10.601 1.00 0.00 C ATOM 1826 CD ARG A 118 -22.334 -10.250 -11.620 1.00 0.00 C ATOM 1827 NE ARG A 118 -22.942 -8.954 -11.300 1.00 0.00 N ATOM 1828 CZ ARG A 118 -22.477 -7.771 -11.711 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -21.378 -7.692 -12.451 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -23.118 -6.660 -11.378 1.00 0.00 N ATOM 0 H ARG A 118 -22.016 -12.816 -12.934 1.00 0.00 H new ATOM 0 HA ARG A 118 -19.337 -11.881 -12.162 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -21.793 -12.724 -10.570 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -20.246 -12.362 -9.831 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -21.636 -10.423 -9.598 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -20.381 -10.037 -10.758 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -21.887 -10.206 -12.613 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -23.109 -11.016 -11.653 1.00 0.00 H new ATOM 0 HE ARG A 118 -23.782 -8.956 -10.721 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -20.877 -8.541 -12.713 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -21.034 -6.782 -12.758 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -23.964 -6.710 -10.810 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -22.766 -5.755 -11.690 1.00 0.00 H new ATOM 1844 N TRP A 119 -18.496 -14.100 -11.130 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.952 -15.400 -10.753 1.00 0.00 C ATOM 1846 C TRP A 119 -18.306 -15.724 -9.307 1.00 0.00 C ATOM 1847 O TRP A 119 -18.293 -14.844 -8.444 1.00 0.00 O ATOM 1848 CB TRP A 119 -16.431 -15.428 -10.939 1.00 0.00 C ATOM 1849 CG TRP A 119 -16.012 -15.624 -12.361 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -15.610 -14.671 -13.247 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.971 -16.866 -13.063 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -15.297 -15.253 -14.453 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -15.517 -16.599 -14.363 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -16.270 -18.180 -12.712 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -15.356 -17.601 -15.313 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -16.112 -19.172 -13.656 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -15.657 -18.877 -14.945 1.00 0.00 C ATOM 0 H TRP A 119 -17.923 -13.307 -10.840 1.00 0.00 H new ATOM 0 HA TRP A 119 -18.394 -16.154 -11.404 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -16.010 -14.493 -10.569 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -16.012 -16.230 -10.330 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -15.546 -13.614 -13.034 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -14.957 -14.761 -15.279 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -16.619 -18.418 -11.718 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -15.004 -17.375 -16.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -16.344 -20.194 -13.396 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -15.542 -19.676 -15.662 1.00 0.00 H new ATOM 1868 N TYR A 120 -18.629 -16.988 -9.056 1.00 0.00 N ATOM 1869 CA TYR A 120 -19.001 -17.451 -7.724 1.00 0.00 C ATOM 1870 C TYR A 120 -18.218 -18.714 -7.367 1.00 0.00 C ATOM 1871 O TYR A 120 -18.011 -19.578 -8.210 1.00 0.00 O ATOM 1872 CB TYR A 120 -20.509 -17.734 -7.665 1.00 0.00 C ATOM 1873 CG TYR A 120 -21.377 -16.526 -7.976 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -21.751 -15.634 -6.974 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.820 -16.276 -9.271 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -22.538 -14.534 -7.255 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -22.607 -15.178 -9.557 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.963 -14.311 -8.547 1.00 0.00 C ATOM 1879 OH TYR A 120 -23.747 -13.212 -8.832 1.00 0.00 O ATOM 0 H TYR A 120 -18.640 -17.719 -9.768 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.759 -16.671 -7.002 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.747 -18.531 -8.370 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.760 -18.103 -6.671 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -21.420 -15.805 -5.960 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -21.544 -16.952 -10.066 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -22.819 -13.852 -6.466 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.942 -15.000 -10.568 1.00 0.00 H new ATOM 0 HH TYR A 120 -23.959 -13.201 -9.789 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.775 -18.805 -6.121 1.00 0.00 N ATOM 1890 CA PHE A 121 -17.032 -19.967 -5.639 1.00 0.00 C ATOM 1891 C PHE A 121 -17.940 -21.190 -5.538 1.00 0.00 C ATOM 1892 O PHE A 121 -18.843 -21.228 -4.702 1.00 0.00 O ATOM 1893 CB PHE A 121 -16.404 -19.648 -4.276 1.00 0.00 C ATOM 1894 CG PHE A 121 -15.905 -20.859 -3.527 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -14.725 -21.481 -3.894 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -16.624 -21.374 -2.454 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -14.269 -22.590 -3.210 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -16.173 -22.483 -1.767 1.00 0.00 C ATOM 1899 CZ PHE A 121 -14.993 -23.093 -2.145 1.00 0.00 C ATOM 0 H PHE A 121 -17.918 -18.081 -5.417 1.00 0.00 H new ATOM 0 HA PHE A 121 -16.240 -20.198 -6.352 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.573 -18.958 -4.424 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -17.141 -19.132 -3.661 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -14.154 -21.094 -4.725 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -17.547 -20.900 -2.154 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -13.346 -23.065 -3.507 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -16.742 -22.873 -0.936 1.00 0.00 H new ATOM 0 HZ PHE A 121 -14.637 -23.961 -1.610 1.00 0.00 H new ATOM 1909 N SER A 122 -17.683 -22.190 -6.377 1.00 0.00 N ATOM 1910 CA SER A 122 -18.506 -23.394 -6.418 1.00 0.00 C ATOM 1911 C SER A 122 -17.993 -24.446 -5.438 1.00 0.00 C ATOM 1912 O SER A 122 -18.776 -25.042 -4.704 1.00 0.00 O ATOM 1913 CB SER A 122 -18.547 -23.963 -7.840 1.00 0.00 C ATOM 1914 OG SER A 122 -19.114 -23.030 -8.745 1.00 0.00 O ATOM 0 H SER A 122 -16.908 -22.189 -7.040 1.00 0.00 H new ATOM 0 HA SER A 122 -19.518 -23.121 -6.119 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.538 -24.220 -8.162 1.00 0.00 H new ATOM 0 HB3 SER A 122 -19.129 -24.885 -7.850 1.00 0.00 H new ATOM 0 HG SER A 122 -20.019 -22.798 -8.451 1.00 0.00 H new ATOM 1920 N GLU A 123 -16.682 -24.673 -5.431 1.00 0.00 N ATOM 1921 CA GLU A 123 -16.074 -25.644 -4.521 1.00 0.00 C ATOM 1922 C GLU A 123 -14.560 -25.666 -4.691 1.00 0.00 C ATOM 1923 O GLU A 123 -14.048 -25.438 -5.785 1.00 0.00 O ATOM 1924 CB GLU A 123 -16.651 -27.050 -4.752 1.00 0.00 C ATOM 1925 CG GLU A 123 -16.481 -27.572 -6.174 1.00 0.00 C ATOM 1926 CD GLU A 123 -17.201 -28.890 -6.393 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -18.401 -28.867 -6.741 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -16.578 -29.957 -6.202 1.00 0.00 O ATOM 0 H GLU A 123 -16.019 -24.199 -6.044 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.308 -25.338 -3.501 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.171 -27.745 -4.063 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -17.713 -27.039 -4.506 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -16.860 -26.832 -6.878 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.420 -27.700 -6.387 1.00 0.00 H new ATOM 1935 N GLY A 124 -13.856 -25.929 -3.598 1.00 0.00 N ATOM 1936 CA GLY A 124 -12.406 -26.008 -3.628 1.00 0.00 C ATOM 1937 C GLY A 124 -11.910 -27.253 -2.926 1.00 0.00 C ATOM 1938 O GLY A 124 -12.498 -27.681 -1.927 1.00 0.00 O ATOM 0 H GLY A 124 -14.269 -26.091 -2.679 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.061 -26.009 -4.662 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -11.981 -25.125 -3.151 1.00 0.00 H new ATOM 1942 N GLU A 125 -10.846 -27.847 -3.446 1.00 0.00 N ATOM 1943 CA GLU A 125 -10.288 -29.068 -2.876 1.00 0.00 C ATOM 1944 C GLU A 125 -8.767 -29.048 -2.972 1.00 0.00 C ATOM 1945 O GLU A 125 -8.204 -28.530 -3.943 1.00 0.00 O ATOM 1946 CB GLU A 125 -10.852 -30.300 -3.596 1.00 0.00 C ATOM 1947 CG GLU A 125 -10.544 -30.339 -5.088 1.00 0.00 C ATOM 1948 CD GLU A 125 -11.137 -31.557 -5.775 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -10.503 -32.631 -5.748 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -12.246 -31.448 -6.339 1.00 0.00 O ATOM 0 H GLU A 125 -10.348 -27.502 -4.267 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.570 -29.122 -1.825 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -10.449 -31.198 -3.128 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -11.933 -30.326 -3.457 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.932 -29.436 -5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.464 -30.335 -5.232 1.00 0.00 H new ATOM 1957 N ALA A 126 -8.108 -29.599 -1.958 1.00 0.00 N ATOM 1958 CA ALA A 126 -6.654 -29.640 -1.915 1.00 0.00 C ATOM 1959 C ALA A 126 -6.114 -30.597 -2.972 1.00 0.00 C ATOM 1960 O ALA A 126 -6.182 -31.818 -2.819 1.00 0.00 O ATOM 1961 CB ALA A 126 -6.174 -30.046 -0.525 1.00 0.00 C ATOM 0 H ALA A 126 -8.563 -30.025 -1.151 1.00 0.00 H new ATOM 0 HA ALA A 126 -6.273 -28.642 -2.132 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.084 -30.072 -0.510 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.530 -29.323 0.209 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.564 -31.034 -0.280 1.00 0.00 H new