USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 784 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 28 TYR OH : rot -140:sc= 0.27 USER MOD Set 1.2: A 48 THR OG1 : rot 180:sc= 0.204 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.972 K(o=-0.97,f=-3.5!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= -0.351 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 85:sc= 0.141 USER MOD Single : A 50 SER OG : rot -15:sc= 0.196 USER MOD Single : A 52 ASN : amide:sc= -0.204 K(o=-0.2,f=-1.4!) USER MOD Single : A 54 ASN : amide:sc= -0.522 X(o=-0.52,f=-0.15) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot -75:sc= 1.18 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.0201 X(o=-0.02,f=-0.075) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= -0.121 USER MOD Single : A 85 CYS SG : rot 35:sc= -1.51 USER MOD Single : A 87 SER OG : rot 180:sc= -0.033 USER MOD Single : A 92 LYS NZ :NH3+ -169:sc= -0.0045 (180deg=-0.143) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot -39:sc= 0.285 USER MOD Single : A 97 THR OG1 : rot -92:sc= 0.0608 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.152 K(o=-0.15,f=-0.69) USER MOD Single : A 101 ASN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 103 ASN : amide:sc= -0.0546 X(o=-0.055,f=-0.043) USER MOD Single : A 105 SER OG : rot 91:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 112 N ALA A 10 -9.190 3.310 12.053 1.00 0.00 N ATOM 113 CA ALA A 10 -8.181 3.904 11.185 1.00 0.00 C ATOM 114 C ALA A 10 -8.351 3.435 9.744 1.00 0.00 C ATOM 115 O ALA A 10 -9.089 2.488 9.472 1.00 0.00 O ATOM 116 CB ALA A 10 -6.787 3.566 11.691 1.00 0.00 C ATOM 0 HA ALA A 10 -8.311 4.986 11.204 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.042 4.016 11.034 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.662 3.956 12.701 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.656 2.484 11.701 1.00 0.00 H new ATOM 122 N LYS A 11 -7.664 4.104 8.824 1.00 0.00 N ATOM 123 CA LYS A 11 -7.739 3.755 7.410 1.00 0.00 C ATOM 124 C LYS A 11 -6.637 2.769 7.034 1.00 0.00 C ATOM 125 O LYS A 11 -5.453 3.100 7.075 1.00 0.00 O ATOM 126 CB LYS A 11 -7.633 5.015 6.547 1.00 0.00 C ATOM 127 CG LYS A 11 -8.950 5.423 5.903 1.00 0.00 C ATOM 128 CD LYS A 11 -9.515 6.685 6.536 1.00 0.00 C ATOM 129 CE LYS A 11 -9.083 7.929 5.777 1.00 0.00 C ATOM 130 NZ LYS A 11 -9.961 9.094 6.076 1.00 0.00 N ATOM 0 H LYS A 11 -7.049 4.891 9.032 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.703 3.279 7.228 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.269 5.838 7.162 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.892 4.849 5.765 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.799 5.587 4.836 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.671 4.611 6.002 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.603 6.628 6.555 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.182 6.755 7.571 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.053 8.174 6.037 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.101 7.726 4.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.633 9.922 5.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.940 8.870 5.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -9.924 9.304 7.094 1.00 0.00 H new ATOM 144 N LYS A 12 -7.037 1.555 6.667 1.00 0.00 N ATOM 145 CA LYS A 12 -6.083 0.521 6.284 1.00 0.00 C ATOM 146 C LYS A 12 -5.806 0.566 4.785 1.00 0.00 C ATOM 147 O LYS A 12 -6.708 0.810 3.984 1.00 0.00 O ATOM 148 CB LYS A 12 -6.613 -0.861 6.674 1.00 0.00 C ATOM 149 CG LYS A 12 -6.156 -1.322 8.049 1.00 0.00 C ATOM 150 CD LYS A 12 -6.216 -2.835 8.178 1.00 0.00 C ATOM 151 CE LYS A 12 -5.911 -3.286 9.596 1.00 0.00 C ATOM 152 NZ LYS A 12 -7.094 -3.143 10.490 1.00 0.00 N ATOM 0 H LYS A 12 -8.014 1.264 6.627 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.149 0.708 6.815 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -7.703 -0.843 6.649 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.289 -1.589 5.930 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -5.136 -0.981 8.228 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -6.784 -0.865 8.814 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -7.206 -3.187 7.888 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.503 -3.288 7.490 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -5.588 -4.327 9.585 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.082 -2.700 9.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -6.845 -3.461 11.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -7.387 -2.146 10.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -7.877 -3.722 10.125 1.00 0.00 H new ATOM 166 N VAL A 13 -4.552 0.332 4.414 1.00 0.00 N ATOM 167 CA VAL A 13 -4.155 0.347 3.010 1.00 0.00 C ATOM 168 C VAL A 13 -2.998 -0.611 2.755 1.00 0.00 C ATOM 169 O VAL A 13 -2.015 -0.625 3.497 1.00 0.00 O ATOM 170 CB VAL A 13 -3.745 1.761 2.559 1.00 0.00 C ATOM 171 CG1 VAL A 13 -4.957 2.678 2.506 1.00 0.00 C ATOM 172 CG2 VAL A 13 -2.678 2.328 3.482 1.00 0.00 C ATOM 0 H VAL A 13 -3.793 0.130 5.065 1.00 0.00 H new ATOM 0 HA VAL A 13 -5.022 0.026 2.433 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.326 1.694 1.555 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.647 3.673 2.185 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.684 2.279 1.799 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -5.409 2.741 3.496 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.401 3.328 3.147 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -3.067 2.381 4.499 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.800 1.683 3.463 1.00 0.00 H new ATOM 182 N ARG A 14 -3.120 -1.413 1.702 1.00 0.00 N ATOM 183 CA ARG A 14 -2.083 -2.375 1.349 1.00 0.00 C ATOM 184 C ARG A 14 -1.146 -1.801 0.290 1.00 0.00 C ATOM 185 O ARG A 14 -1.589 -1.163 -0.664 1.00 0.00 O ATOM 186 CB ARG A 14 -2.715 -3.673 0.840 1.00 0.00 C ATOM 187 CG ARG A 14 -2.020 -4.927 1.346 1.00 0.00 C ATOM 188 CD ARG A 14 -2.980 -6.102 1.427 1.00 0.00 C ATOM 189 NE ARG A 14 -2.600 -7.047 2.474 1.00 0.00 N ATOM 190 CZ ARG A 14 -3.412 -7.985 2.957 1.00 0.00 C ATOM 191 NH1 ARG A 14 -4.650 -8.106 2.492 1.00 0.00 N ATOM 192 NH2 ARG A 14 -2.986 -8.804 3.909 1.00 0.00 N ATOM 0 H ARG A 14 -3.927 -1.415 1.078 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.500 -2.590 2.245 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.762 -3.701 1.142 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.698 -3.673 -0.250 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.192 -5.178 0.683 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -1.594 -4.736 2.331 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.988 -5.734 1.619 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -3.006 -6.616 0.466 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.657 -6.985 2.858 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -4.984 -7.478 1.761 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -5.267 -8.827 2.866 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -2.037 -8.715 4.271 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -3.608 -9.523 4.279 1.00 0.00 H new ATOM 206 N PHE A 15 0.151 -2.034 0.466 1.00 0.00 N ATOM 207 CA PHE A 15 1.151 -1.540 -0.474 1.00 0.00 C ATOM 208 C PHE A 15 1.920 -2.695 -1.107 1.00 0.00 C ATOM 209 O PHE A 15 2.486 -3.536 -0.407 1.00 0.00 O ATOM 210 CB PHE A 15 2.122 -0.593 0.233 1.00 0.00 C ATOM 211 CG PHE A 15 1.542 0.766 0.506 1.00 0.00 C ATOM 212 CD1 PHE A 15 1.170 1.599 -0.537 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.370 1.211 1.807 1.00 0.00 C ATOM 214 CE1 PHE A 15 0.637 2.849 -0.288 1.00 0.00 C ATOM 215 CE2 PHE A 15 0.838 2.461 2.063 1.00 0.00 C ATOM 216 CZ PHE A 15 0.471 3.280 1.014 1.00 0.00 C ATOM 0 H PHE A 15 0.534 -2.562 1.251 1.00 0.00 H new ATOM 0 HA PHE A 15 0.633 -0.996 -1.264 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.434 -1.042 1.176 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.018 -0.481 -0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.298 1.267 -1.557 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.655 0.574 2.631 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.351 3.488 -1.110 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.710 2.796 3.082 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.054 4.257 1.211 1.00 0.00 H new ATOM 226 N TYR A 16 1.938 -2.730 -2.435 1.00 0.00 N ATOM 227 CA TYR A 16 2.639 -3.782 -3.162 1.00 0.00 C ATOM 228 C TYR A 16 3.941 -3.257 -3.760 1.00 0.00 C ATOM 229 O TYR A 16 4.210 -2.056 -3.725 1.00 0.00 O ATOM 230 CB TYR A 16 1.748 -4.347 -4.270 1.00 0.00 C ATOM 231 CG TYR A 16 0.427 -4.887 -3.769 1.00 0.00 C ATOM 232 CD1 TYR A 16 0.382 -5.828 -2.749 1.00 0.00 C ATOM 233 CD2 TYR A 16 -0.774 -4.453 -4.318 1.00 0.00 C ATOM 234 CE1 TYR A 16 -0.825 -6.323 -2.289 1.00 0.00 C ATOM 235 CE2 TYR A 16 -1.983 -4.944 -3.863 1.00 0.00 C ATOM 236 CZ TYR A 16 -2.003 -5.878 -2.849 1.00 0.00 C ATOM 237 OH TYR A 16 -3.205 -6.369 -2.394 1.00 0.00 O ATOM 0 H TYR A 16 1.475 -2.042 -3.030 1.00 0.00 H new ATOM 0 HA TYR A 16 2.879 -4.577 -2.456 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.556 -3.565 -5.005 1.00 0.00 H new ATOM 0 HB3 TYR A 16 2.285 -5.144 -4.785 1.00 0.00 H new ATOM 0 HD1 TYR A 16 1.303 -6.179 -2.308 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -0.762 -3.721 -5.112 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.844 -7.055 -1.495 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.908 -4.598 -4.300 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.938 -5.952 -2.893 1.00 0.00 H new ATOM 247 N ARG A 17 4.744 -4.162 -4.307 1.00 0.00 N ATOM 248 CA ARG A 17 6.018 -3.789 -4.912 1.00 0.00 C ATOM 249 C ARG A 17 5.914 -3.781 -6.434 1.00 0.00 C ATOM 250 O ARG A 17 5.426 -4.737 -7.038 1.00 0.00 O ATOM 251 CB ARG A 17 7.120 -4.752 -4.466 1.00 0.00 C ATOM 252 CG ARG A 17 8.418 -4.058 -4.089 1.00 0.00 C ATOM 253 CD ARG A 17 9.128 -4.782 -2.957 1.00 0.00 C ATOM 254 NE ARG A 17 9.650 -6.080 -3.381 1.00 0.00 N ATOM 255 CZ ARG A 17 10.100 -7.008 -2.540 1.00 0.00 C ATOM 256 NH1 ARG A 17 10.094 -6.787 -1.231 1.00 0.00 N ATOM 257 NH2 ARG A 17 10.557 -8.162 -3.008 1.00 0.00 N ATOM 0 H ARG A 17 4.536 -5.160 -4.344 1.00 0.00 H new ATOM 0 HA ARG A 17 6.271 -2.783 -4.579 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.764 -5.328 -3.612 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.317 -5.462 -5.269 1.00 0.00 H new ATOM 0 HG2 ARG A 17 9.073 -4.011 -4.959 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.209 -3.031 -3.791 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.947 -4.164 -2.589 1.00 0.00 H new ATOM 0 HD3 ARG A 17 8.436 -4.923 -2.126 1.00 0.00 H new ATOM 0 HE ARG A 17 9.671 -6.286 -4.380 1.00 0.00 H new ATOM 0 HH11 ARG A 17 9.743 -5.902 -0.865 1.00 0.00 H new ATOM 0 HH12 ARG A 17 10.440 -7.502 -0.591 1.00 0.00 H new ATOM 0 HH21 ARG A 17 10.564 -8.338 -4.013 1.00 0.00 H new ATOM 0 HH22 ARG A 17 10.902 -8.873 -2.363 1.00 0.00 H new ATOM 271 N ASN A 18 6.375 -2.696 -7.048 1.00 0.00 N ATOM 272 CA ASN A 18 6.335 -2.564 -8.500 1.00 0.00 C ATOM 273 C ASN A 18 7.151 -3.665 -9.171 1.00 0.00 C ATOM 274 O ASN A 18 8.372 -3.720 -9.029 1.00 0.00 O ATOM 275 CB ASN A 18 6.861 -1.191 -8.923 1.00 0.00 C ATOM 276 CG ASN A 18 6.041 -0.579 -10.041 1.00 0.00 C ATOM 277 OD1 ASN A 18 4.815 -0.683 -10.057 1.00 0.00 O ATOM 278 ND2 ASN A 18 6.718 0.065 -10.987 1.00 0.00 N ATOM 0 H ASN A 18 6.780 -1.896 -6.563 1.00 0.00 H new ATOM 0 HA ASN A 18 5.298 -2.662 -8.820 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.855 -0.522 -8.063 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.898 -1.286 -9.246 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.221 0.497 -11.766 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.735 0.127 -10.934 1.00 0.00 H new ATOM 285 N GLY A 19 6.466 -4.540 -9.900 1.00 0.00 N ATOM 286 CA GLY A 19 7.143 -5.627 -10.581 1.00 0.00 C ATOM 287 C GLY A 19 7.512 -6.759 -9.643 1.00 0.00 C ATOM 288 O GLY A 19 8.603 -7.321 -9.736 1.00 0.00 O ATOM 0 H GLY A 19 5.455 -4.515 -10.031 1.00 0.00 H new ATOM 0 HA2 GLY A 19 6.501 -6.011 -11.374 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.046 -5.246 -11.059 1.00 0.00 H new ATOM 292 N ASP A 20 6.601 -7.092 -8.734 1.00 0.00 N ATOM 293 CA ASP A 20 6.836 -8.164 -7.774 1.00 0.00 C ATOM 294 C ASP A 20 5.533 -8.874 -7.421 1.00 0.00 C ATOM 295 O ASP A 20 4.906 -8.574 -6.405 1.00 0.00 O ATOM 296 CB ASP A 20 7.486 -7.606 -6.506 1.00 0.00 C ATOM 297 CG ASP A 20 8.500 -8.563 -5.908 1.00 0.00 C ATOM 298 OD1 ASP A 20 9.537 -8.811 -6.559 1.00 0.00 O ATOM 299 OD2 ASP A 20 8.256 -9.062 -4.790 1.00 0.00 O ATOM 0 H ASP A 20 5.694 -6.635 -8.642 1.00 0.00 H new ATOM 0 HA ASP A 20 7.510 -8.888 -8.232 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.976 -6.660 -6.738 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.713 -7.392 -5.768 1.00 0.00 H new ATOM 304 N ARG A 21 5.133 -9.818 -8.267 1.00 0.00 N ATOM 305 CA ARG A 21 3.905 -10.574 -8.044 1.00 0.00 C ATOM 306 C ARG A 21 4.051 -11.513 -6.852 1.00 0.00 C ATOM 307 O ARG A 21 3.076 -11.817 -6.165 1.00 0.00 O ATOM 308 CB ARG A 21 3.540 -11.373 -9.295 1.00 0.00 C ATOM 309 CG ARG A 21 4.566 -12.433 -9.661 1.00 0.00 C ATOM 310 CD ARG A 21 4.979 -12.334 -11.121 1.00 0.00 C ATOM 311 NE ARG A 21 5.673 -13.535 -11.577 1.00 0.00 N ATOM 312 CZ ARG A 21 6.439 -13.582 -12.665 1.00 0.00 C ATOM 313 NH1 ARG A 21 6.610 -12.498 -13.412 1.00 0.00 N ATOM 314 NH2 ARG A 21 7.035 -14.715 -13.008 1.00 0.00 N ATOM 0 H ARG A 21 5.641 -10.078 -9.113 1.00 0.00 H new ATOM 0 HA ARG A 21 3.106 -9.864 -7.828 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.574 -11.853 -9.140 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.424 -10.686 -10.134 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.445 -12.324 -9.026 1.00 0.00 H new ATOM 0 HG3 ARG A 21 4.153 -13.423 -9.466 1.00 0.00 H new ATOM 0 HD2 ARG A 21 4.095 -12.170 -11.737 1.00 0.00 H new ATOM 0 HD3 ARG A 21 5.627 -11.468 -11.256 1.00 0.00 H new ATOM 0 HE ARG A 21 5.565 -14.389 -11.029 1.00 0.00 H new ATOM 0 HH11 ARG A 21 6.153 -11.623 -13.153 1.00 0.00 H new ATOM 0 HH12 ARG A 21 7.198 -12.540 -14.244 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.907 -15.551 -12.438 1.00 0.00 H new ATOM 0 HH22 ARG A 21 7.622 -14.751 -13.842 1.00 0.00 H new ATOM 328 N TYR A 22 5.276 -11.971 -6.612 1.00 0.00 N ATOM 329 CA TYR A 22 5.551 -12.878 -5.502 1.00 0.00 C ATOM 330 C TYR A 22 5.148 -12.250 -4.172 1.00 0.00 C ATOM 331 O TYR A 22 4.751 -12.949 -3.240 1.00 0.00 O ATOM 332 CB TYR A 22 7.035 -13.248 -5.475 1.00 0.00 C ATOM 333 CG TYR A 22 7.448 -14.181 -6.591 1.00 0.00 C ATOM 334 CD1 TYR A 22 7.876 -13.682 -7.816 1.00 0.00 C ATOM 335 CD2 TYR A 22 7.411 -15.558 -6.421 1.00 0.00 C ATOM 336 CE1 TYR A 22 8.255 -14.531 -8.839 1.00 0.00 C ATOM 337 CE2 TYR A 22 7.789 -16.414 -7.438 1.00 0.00 C ATOM 338 CZ TYR A 22 8.209 -15.896 -8.645 1.00 0.00 C ATOM 339 OH TYR A 22 8.586 -16.745 -9.660 1.00 0.00 O ATOM 0 H TYR A 22 6.094 -11.729 -7.171 1.00 0.00 H new ATOM 0 HA TYR A 22 4.960 -13.782 -5.650 1.00 0.00 H new ATOM 0 HB2 TYR A 22 7.629 -12.336 -5.537 1.00 0.00 H new ATOM 0 HB3 TYR A 22 7.267 -13.715 -4.518 1.00 0.00 H new ATOM 0 HD1 TYR A 22 7.913 -12.614 -7.971 1.00 0.00 H new ATOM 0 HD2 TYR A 22 7.081 -15.968 -5.478 1.00 0.00 H new ATOM 0 HE1 TYR A 22 8.585 -14.128 -9.785 1.00 0.00 H new ATOM 0 HE2 TYR A 22 7.756 -17.483 -7.288 1.00 0.00 H new ATOM 0 HH TYR A 22 8.496 -17.674 -9.360 1.00 0.00 H new ATOM 349 N PHE A 23 5.251 -10.928 -4.092 1.00 0.00 N ATOM 350 CA PHE A 23 4.897 -10.206 -2.875 1.00 0.00 C ATOM 351 C PHE A 23 3.425 -10.411 -2.531 1.00 0.00 C ATOM 352 O PHE A 23 2.583 -10.552 -3.418 1.00 0.00 O ATOM 353 CB PHE A 23 5.192 -8.714 -3.037 1.00 0.00 C ATOM 354 CG PHE A 23 5.452 -8.010 -1.736 1.00 0.00 C ATOM 355 CD1 PHE A 23 6.693 -8.093 -1.124 1.00 0.00 C ATOM 356 CD2 PHE A 23 4.456 -7.264 -1.126 1.00 0.00 C ATOM 357 CE1 PHE A 23 6.935 -7.446 0.072 1.00 0.00 C ATOM 358 CE2 PHE A 23 4.692 -6.616 0.071 1.00 0.00 C ATOM 359 CZ PHE A 23 5.934 -6.707 0.671 1.00 0.00 C ATOM 0 H PHE A 23 5.577 -10.335 -4.855 1.00 0.00 H new ATOM 0 HA PHE A 23 5.502 -10.601 -2.059 1.00 0.00 H new ATOM 0 HB2 PHE A 23 6.059 -8.592 -3.687 1.00 0.00 H new ATOM 0 HB3 PHE A 23 4.349 -8.237 -3.537 1.00 0.00 H new ATOM 0 HD1 PHE A 23 7.479 -8.670 -1.588 1.00 0.00 H new ATOM 0 HD2 PHE A 23 3.484 -7.188 -1.592 1.00 0.00 H new ATOM 0 HE1 PHE A 23 7.906 -7.518 0.538 1.00 0.00 H new ATOM 0 HE2 PHE A 23 3.907 -6.039 0.537 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.121 -6.201 1.607 1.00 0.00 H new ATOM 369 N LYS A 24 3.122 -10.425 -1.237 1.00 0.00 N ATOM 370 CA LYS A 24 1.752 -10.612 -0.775 1.00 0.00 C ATOM 371 C LYS A 24 1.093 -9.271 -0.469 1.00 0.00 C ATOM 372 O LYS A 24 -0.092 -9.073 -0.741 1.00 0.00 O ATOM 373 CB LYS A 24 1.727 -11.500 0.470 1.00 0.00 C ATOM 374 CG LYS A 24 2.013 -12.965 0.178 1.00 0.00 C ATOM 375 CD LYS A 24 3.471 -13.309 0.431 1.00 0.00 C ATOM 376 CE LYS A 24 3.798 -14.721 -0.030 1.00 0.00 C ATOM 377 NZ LYS A 24 4.928 -15.309 0.741 1.00 0.00 N ATOM 0 H LYS A 24 3.807 -10.309 -0.490 1.00 0.00 H new ATOM 0 HA LYS A 24 1.191 -11.100 -1.572 1.00 0.00 H new ATOM 0 HB2 LYS A 24 2.462 -11.130 1.185 1.00 0.00 H new ATOM 0 HB3 LYS A 24 0.750 -11.417 0.946 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.377 -13.592 0.802 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.761 -13.186 -0.859 1.00 0.00 H new ATOM 0 HD2 LYS A 24 4.110 -12.597 -0.092 1.00 0.00 H new ATOM 0 HD3 LYS A 24 3.690 -13.212 1.494 1.00 0.00 H new ATOM 0 HE2 LYS A 24 2.916 -15.352 0.080 1.00 0.00 H new ATOM 0 HE3 LYS A 24 4.050 -14.707 -1.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 5.120 -16.271 0.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.777 -14.721 0.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.678 -15.346 1.750 1.00 0.00 H new ATOM 391 N GLY A 25 1.869 -8.351 0.096 1.00 0.00 N ATOM 392 CA GLY A 25 1.343 -7.040 0.430 1.00 0.00 C ATOM 393 C GLY A 25 1.569 -6.678 1.885 1.00 0.00 C ATOM 394 O GLY A 25 1.547 -7.545 2.758 1.00 0.00 O ATOM 0 H GLY A 25 2.852 -8.490 0.328 1.00 0.00 H new ATOM 0 HA2 GLY A 25 1.814 -6.290 -0.205 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.275 -7.015 0.214 1.00 0.00 H new ATOM 398 N ILE A 26 1.787 -5.392 2.145 1.00 0.00 N ATOM 399 CA ILE A 26 2.018 -4.917 3.505 1.00 0.00 C ATOM 400 C ILE A 26 0.846 -4.072 3.997 1.00 0.00 C ATOM 401 O ILE A 26 0.540 -3.025 3.424 1.00 0.00 O ATOM 402 CB ILE A 26 3.318 -4.093 3.599 1.00 0.00 C ATOM 403 CG1 ILE A 26 3.607 -3.720 5.055 1.00 0.00 C ATOM 404 CG2 ILE A 26 3.224 -2.842 2.736 1.00 0.00 C ATOM 405 CD1 ILE A 26 5.076 -3.489 5.339 1.00 0.00 C ATOM 0 H ILE A 26 1.808 -4.662 1.433 1.00 0.00 H new ATOM 0 HA ILE A 26 2.114 -5.798 4.139 1.00 0.00 H new ATOM 0 HB ILE A 26 4.141 -4.703 3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 26 3.050 -2.818 5.308 1.00 0.00 H new ATOM 0 HG13 ILE A 26 3.240 -4.514 5.705 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.151 -2.274 2.816 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.062 -3.128 1.697 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.391 -2.227 3.077 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.207 -3.229 6.389 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.637 -4.397 5.118 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.444 -2.675 4.715 1.00 0.00 H new ATOM 417 N VAL A 27 0.196 -4.532 5.059 1.00 0.00 N ATOM 418 CA VAL A 27 -0.941 -3.819 5.627 1.00 0.00 C ATOM 419 C VAL A 27 -0.479 -2.652 6.494 1.00 0.00 C ATOM 420 O VAL A 27 0.352 -2.820 7.388 1.00 0.00 O ATOM 421 CB VAL A 27 -1.827 -4.753 6.474 1.00 0.00 C ATOM 422 CG1 VAL A 27 -3.087 -4.033 6.927 1.00 0.00 C ATOM 423 CG2 VAL A 27 -2.177 -6.012 5.693 1.00 0.00 C ATOM 0 H VAL A 27 0.437 -5.396 5.544 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.526 -3.439 4.789 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.266 -5.046 7.361 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.698 -4.710 7.523 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.814 -3.166 7.528 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.653 -3.706 6.055 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.803 -6.659 6.307 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.717 -5.739 4.786 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.262 -6.540 5.425 1.00 0.00 H new ATOM 433 N TYR A 28 -1.023 -1.470 6.226 1.00 0.00 N ATOM 434 CA TYR A 28 -0.667 -0.274 6.981 1.00 0.00 C ATOM 435 C TYR A 28 -1.861 0.239 7.781 1.00 0.00 C ATOM 436 O TYR A 28 -2.991 -0.208 7.584 1.00 0.00 O ATOM 437 CB TYR A 28 -0.163 0.819 6.037 1.00 0.00 C ATOM 438 CG TYR A 28 1.340 0.828 5.867 1.00 0.00 C ATOM 439 CD1 TYR A 28 1.976 -0.141 5.102 1.00 0.00 C ATOM 440 CD2 TYR A 28 2.120 1.804 6.472 1.00 0.00 C ATOM 441 CE1 TYR A 28 3.349 -0.137 4.945 1.00 0.00 C ATOM 442 CE2 TYR A 28 3.494 1.816 6.319 1.00 0.00 C ATOM 443 CZ TYR A 28 4.104 0.843 5.555 1.00 0.00 C ATOM 444 OH TYR A 28 5.470 0.850 5.401 1.00 0.00 O ATOM 0 H TYR A 28 -1.713 -1.314 5.491 1.00 0.00 H new ATOM 0 HA TYR A 28 0.129 -0.537 7.678 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.630 0.688 5.061 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.483 1.790 6.415 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.388 -0.910 4.622 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.646 2.566 7.072 1.00 0.00 H new ATOM 0 HE1 TYR A 28 3.829 -0.898 4.347 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.087 2.583 6.795 1.00 0.00 H new ATOM 0 HH TYR A 28 5.894 1.092 6.251 1.00 0.00 H new ATOM 454 N ALA A 29 -1.602 1.178 8.684 1.00 0.00 N ATOM 455 CA ALA A 29 -2.655 1.752 9.513 1.00 0.00 C ATOM 456 C ALA A 29 -2.612 3.275 9.480 1.00 0.00 C ATOM 457 O ALA A 29 -1.917 3.905 10.277 1.00 0.00 O ATOM 458 CB ALA A 29 -2.530 1.251 10.944 1.00 0.00 C ATOM 0 H ALA A 29 -0.672 1.558 8.861 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.616 1.433 9.109 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.322 1.687 11.553 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -2.618 0.165 10.958 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.560 1.542 11.348 1.00 0.00 H new ATOM 464 N ILE A 30 -3.360 3.862 8.551 1.00 0.00 N ATOM 465 CA ILE A 30 -3.409 5.313 8.414 1.00 0.00 C ATOM 466 C ILE A 30 -4.394 5.927 9.404 1.00 0.00 C ATOM 467 O ILE A 30 -5.521 5.455 9.545 1.00 0.00 O ATOM 468 CB ILE A 30 -3.808 5.730 6.986 1.00 0.00 C ATOM 469 CG1 ILE A 30 -2.966 4.973 5.956 1.00 0.00 C ATOM 470 CG2 ILE A 30 -3.649 7.232 6.808 1.00 0.00 C ATOM 471 CD1 ILE A 30 -1.478 5.198 6.111 1.00 0.00 C ATOM 0 H ILE A 30 -3.940 3.355 7.882 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.406 5.683 8.626 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.856 5.475 6.829 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -3.175 3.907 6.041 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.269 5.279 4.955 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.935 7.510 5.794 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.288 7.753 7.521 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.610 7.511 6.981 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.943 4.632 5.349 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.257 6.259 5.997 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.161 4.866 7.099 1.00 0.00 H new ATOM 483 N SER A 31 -3.959 6.981 10.086 1.00 0.00 N ATOM 484 CA SER A 31 -4.803 7.659 11.063 1.00 0.00 C ATOM 485 C SER A 31 -4.232 9.031 11.416 1.00 0.00 C ATOM 486 O SER A 31 -3.022 9.247 11.343 1.00 0.00 O ATOM 487 CB SER A 31 -4.939 6.809 12.327 1.00 0.00 C ATOM 488 OG SER A 31 -6.259 6.866 12.840 1.00 0.00 O ATOM 0 H SER A 31 -3.028 7.384 9.980 1.00 0.00 H new ATOM 0 HA SER A 31 -5.789 7.799 10.620 1.00 0.00 H new ATOM 0 HB2 SER A 31 -4.677 5.775 12.104 1.00 0.00 H new ATOM 0 HB3 SER A 31 -4.236 7.160 13.083 1.00 0.00 H new ATOM 0 HG SER A 31 -6.321 6.313 13.647 1.00 0.00 H new ATOM 494 N PRO A 32 -5.100 9.980 11.808 1.00 0.00 N ATOM 495 CA PRO A 32 -4.675 11.335 12.174 1.00 0.00 C ATOM 496 C PRO A 32 -3.559 11.331 13.215 1.00 0.00 C ATOM 497 O PRO A 32 -2.753 12.260 13.277 1.00 0.00 O ATOM 498 CB PRO A 32 -5.945 11.962 12.755 1.00 0.00 C ATOM 499 CG PRO A 32 -7.063 11.211 12.120 1.00 0.00 C ATOM 500 CD PRO A 32 -6.560 9.807 11.926 1.00 0.00 C ATOM 0 HA PRO A 32 -4.267 11.878 11.321 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -5.972 11.868 13.841 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -6.002 13.026 12.525 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -7.951 11.224 12.752 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -7.344 11.660 11.167 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -6.822 9.166 12.768 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -6.984 9.348 11.033 1.00 0.00 H new ATOM 508 N ASP A 33 -3.519 10.282 14.029 1.00 0.00 N ATOM 509 CA ASP A 33 -2.501 10.158 15.066 1.00 0.00 C ATOM 510 C ASP A 33 -1.295 9.376 14.557 1.00 0.00 C ATOM 511 O ASP A 33 -0.149 9.739 14.824 1.00 0.00 O ATOM 512 CB ASP A 33 -3.084 9.472 16.303 1.00 0.00 C ATOM 513 CG ASP A 33 -3.639 10.462 17.308 1.00 0.00 C ATOM 514 OD1 ASP A 33 -2.853 11.283 17.827 1.00 0.00 O ATOM 515 OD2 ASP A 33 -4.858 10.417 17.575 1.00 0.00 O ATOM 0 H ASP A 33 -4.179 9.506 13.991 1.00 0.00 H new ATOM 0 HA ASP A 33 -2.171 11.161 15.337 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -3.875 8.788 15.996 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -2.310 8.870 16.780 1.00 0.00 H new ATOM 520 N ARG A 34 -1.561 8.302 13.821 1.00 0.00 N ATOM 521 CA ARG A 34 -0.497 7.468 13.273 1.00 0.00 C ATOM 522 C ARG A 34 0.401 8.276 12.340 1.00 0.00 C ATOM 523 O ARG A 34 1.528 8.622 12.694 1.00 0.00 O ATOM 524 CB ARG A 34 -1.090 6.272 12.524 1.00 0.00 C ATOM 525 CG ARG A 34 -1.064 4.980 13.326 1.00 0.00 C ATOM 526 CD ARG A 34 -2.452 4.597 13.817 1.00 0.00 C ATOM 527 NE ARG A 34 -2.446 4.208 15.226 1.00 0.00 N ATOM 528 CZ ARG A 34 -1.937 3.065 15.678 1.00 0.00 C ATOM 529 NH1 ARG A 34 -1.391 2.195 14.836 1.00 0.00 N ATOM 530 NH2 ARG A 34 -1.972 2.790 16.973 1.00 0.00 N ATOM 0 H ARG A 34 -2.504 7.989 13.590 1.00 0.00 H new ATOM 0 HA ARG A 34 0.108 7.102 14.103 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -2.120 6.500 12.250 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -0.538 6.125 11.595 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -0.661 4.177 12.709 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -0.394 5.094 14.179 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -3.131 5.438 13.676 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -2.835 3.773 13.215 1.00 0.00 H new ATOM 0 HE ARG A 34 -2.856 4.851 15.903 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -1.361 2.402 13.838 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -1.002 1.320 15.188 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -2.389 3.455 17.624 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -1.582 1.913 17.319 1.00 0.00 H new ATOM 544 N PHE A 35 -0.107 8.571 11.148 1.00 0.00 N ATOM 545 CA PHE A 35 0.648 9.337 10.163 1.00 0.00 C ATOM 546 C PHE A 35 0.042 10.724 9.972 1.00 0.00 C ATOM 547 O PHE A 35 -1.157 10.860 9.728 1.00 0.00 O ATOM 548 CB PHE A 35 0.684 8.594 8.827 1.00 0.00 C ATOM 549 CG PHE A 35 1.432 7.293 8.884 1.00 0.00 C ATOM 550 CD1 PHE A 35 2.793 7.250 8.626 1.00 0.00 C ATOM 551 CD2 PHE A 35 0.775 6.114 9.195 1.00 0.00 C ATOM 552 CE1 PHE A 35 3.484 6.054 8.677 1.00 0.00 C ATOM 553 CE2 PHE A 35 1.459 4.915 9.248 1.00 0.00 C ATOM 554 CZ PHE A 35 2.816 4.885 8.989 1.00 0.00 C ATOM 0 H PHE A 35 -1.038 8.291 10.841 1.00 0.00 H new ATOM 0 HA PHE A 35 1.667 9.454 10.533 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.338 8.402 8.500 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.144 9.236 8.076 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.319 8.161 8.382 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.285 6.132 9.399 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.544 6.033 8.473 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.934 4.003 9.491 1.00 0.00 H new ATOM 0 HZ PHE A 35 3.354 3.949 9.030 1.00 0.00 H new ATOM 564 N ARG A 36 0.878 11.750 10.085 1.00 0.00 N ATOM 565 CA ARG A 36 0.425 13.126 9.923 1.00 0.00 C ATOM 566 C ARG A 36 0.781 13.657 8.538 1.00 0.00 C ATOM 567 O ARG A 36 0.068 14.490 7.980 1.00 0.00 O ATOM 568 CB ARG A 36 1.043 14.019 11.004 1.00 0.00 C ATOM 569 CG ARG A 36 0.026 14.874 11.741 1.00 0.00 C ATOM 570 CD ARG A 36 0.090 16.327 11.298 1.00 0.00 C ATOM 571 NE ARG A 36 1.186 17.048 11.941 1.00 0.00 N ATOM 572 CZ ARG A 36 1.529 18.298 11.640 1.00 0.00 C ATOM 573 NH1 ARG A 36 0.864 18.971 10.708 1.00 0.00 N ATOM 574 NH2 ARG A 36 2.539 18.879 12.274 1.00 0.00 N ATOM 0 H ARG A 36 1.873 11.655 10.288 1.00 0.00 H new ATOM 0 HA ARG A 36 -0.660 13.141 10.028 1.00 0.00 H new ATOM 0 HB2 ARG A 36 1.569 13.392 11.724 1.00 0.00 H new ATOM 0 HB3 ARG A 36 1.787 14.669 10.545 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -0.976 14.483 11.564 1.00 0.00 H new ATOM 0 HG3 ARG A 36 0.207 14.812 12.814 1.00 0.00 H new ATOM 0 HD2 ARG A 36 0.213 16.371 10.216 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -0.854 16.819 11.532 1.00 0.00 H new ATOM 0 HE ARG A 36 1.720 16.565 12.663 1.00 0.00 H new ATOM 0 HH11 ARG A 36 0.085 18.530 10.218 1.00 0.00 H new ATOM 0 HH12 ARG A 36 1.132 19.929 10.482 1.00 0.00 H new ATOM 0 HH21 ARG A 36 3.052 18.368 12.992 1.00 0.00 H new ATOM 0 HH22 ARG A 36 2.802 19.837 12.044 1.00 0.00 H new ATOM 588 N SER A 37 1.890 13.170 7.991 1.00 0.00 N ATOM 589 CA SER A 37 2.340 13.595 6.671 1.00 0.00 C ATOM 590 C SER A 37 2.856 12.408 5.863 1.00 0.00 C ATOM 591 O SER A 37 3.072 11.323 6.404 1.00 0.00 O ATOM 592 CB SER A 37 3.437 14.653 6.800 1.00 0.00 C ATOM 593 OG SER A 37 2.945 15.825 7.425 1.00 0.00 O ATOM 0 H SER A 37 2.493 12.481 8.441 1.00 0.00 H new ATOM 0 HA SER A 37 1.488 14.026 6.146 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.268 14.250 7.379 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.826 14.900 5.812 1.00 0.00 H new ATOM 0 HG SER A 37 3.666 16.485 7.497 1.00 0.00 H new ATOM 599 N PHE A 38 3.048 12.620 4.566 1.00 0.00 N ATOM 600 CA PHE A 38 3.537 11.567 3.683 1.00 0.00 C ATOM 601 C PHE A 38 4.997 11.237 3.982 1.00 0.00 C ATOM 602 O PHE A 38 5.448 10.113 3.754 1.00 0.00 O ATOM 603 CB PHE A 38 3.385 11.989 2.219 1.00 0.00 C ATOM 604 CG PHE A 38 2.773 10.928 1.350 1.00 0.00 C ATOM 605 CD1 PHE A 38 1.526 10.403 1.650 1.00 0.00 C ATOM 606 CD2 PHE A 38 3.444 10.455 0.234 1.00 0.00 C ATOM 607 CE1 PHE A 38 0.961 9.426 0.853 1.00 0.00 C ATOM 608 CE2 PHE A 38 2.884 9.479 -0.567 1.00 0.00 C ATOM 609 CZ PHE A 38 1.640 8.963 -0.257 1.00 0.00 C ATOM 0 H PHE A 38 2.873 13.511 4.102 1.00 0.00 H new ATOM 0 HA PHE A 38 2.940 10.673 3.860 1.00 0.00 H new ATOM 0 HB2 PHE A 38 2.769 12.887 2.170 1.00 0.00 H new ATOM 0 HB3 PHE A 38 4.365 12.252 1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.990 10.762 2.516 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.417 10.854 -0.013 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.011 9.025 1.098 1.00 0.00 H new ATOM 0 HE2 PHE A 38 3.418 9.120 -1.434 1.00 0.00 H new ATOM 0 HZ PHE A 38 1.200 8.199 -0.881 1.00 0.00 H new ATOM 619 N GLU A 39 5.731 12.220 4.495 1.00 0.00 N ATOM 620 CA GLU A 39 7.139 12.031 4.825 1.00 0.00 C ATOM 621 C GLU A 39 7.320 10.883 5.813 1.00 0.00 C ATOM 622 O GLU A 39 8.188 10.028 5.634 1.00 0.00 O ATOM 623 CB GLU A 39 7.724 13.319 5.410 1.00 0.00 C ATOM 624 CG GLU A 39 8.357 14.227 4.369 1.00 0.00 C ATOM 625 CD GLU A 39 9.868 14.101 4.326 1.00 0.00 C ATOM 626 OE1 GLU A 39 10.363 12.975 4.109 1.00 0.00 O ATOM 627 OE2 GLU A 39 10.555 15.126 4.512 1.00 0.00 O ATOM 0 H GLU A 39 5.374 13.155 4.691 1.00 0.00 H new ATOM 0 HA GLU A 39 7.670 11.781 3.906 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.934 13.866 5.925 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.473 13.061 6.159 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.948 13.988 3.387 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.088 15.261 4.583 1.00 0.00 H new ATOM 634 N ALA A 40 6.494 10.868 6.854 1.00 0.00 N ATOM 635 CA ALA A 40 6.563 9.823 7.868 1.00 0.00 C ATOM 636 C ALA A 40 6.179 8.467 7.287 1.00 0.00 C ATOM 637 O ALA A 40 6.716 7.434 7.687 1.00 0.00 O ATOM 638 CB ALA A 40 5.662 10.169 9.044 1.00 0.00 C ATOM 0 H ALA A 40 5.770 11.567 7.017 1.00 0.00 H new ATOM 0 HA ALA A 40 7.593 9.760 8.219 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.723 9.380 9.794 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.984 11.113 9.484 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.632 10.262 8.698 1.00 0.00 H new ATOM 644 N LEU A 41 5.247 8.478 6.340 1.00 0.00 N ATOM 645 CA LEU A 41 4.791 7.249 5.702 1.00 0.00 C ATOM 646 C LEU A 41 5.819 6.743 4.696 1.00 0.00 C ATOM 647 O LEU A 41 6.075 5.543 4.606 1.00 0.00 O ATOM 648 CB LEU A 41 3.449 7.480 5.005 1.00 0.00 C ATOM 649 CG LEU A 41 2.783 6.220 4.449 1.00 0.00 C ATOM 650 CD1 LEU A 41 2.062 5.466 5.556 1.00 0.00 C ATOM 651 CD2 LEU A 41 1.817 6.578 3.329 1.00 0.00 C ATOM 0 H LEU A 41 4.793 9.325 5.997 1.00 0.00 H new ATOM 0 HA LEU A 41 4.666 6.492 6.477 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.766 7.952 5.712 1.00 0.00 H new ATOM 0 HB3 LEU A 41 3.598 8.185 4.187 1.00 0.00 H new ATOM 0 HG LEU A 41 3.558 5.572 4.040 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.594 4.573 5.143 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.778 5.178 6.326 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.297 6.107 5.994 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.352 5.670 2.945 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.046 7.246 3.713 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.360 7.075 2.525 1.00 0.00 H new ATOM 663 N LEU A 42 6.405 7.666 3.940 1.00 0.00 N ATOM 664 CA LEU A 42 7.406 7.313 2.940 1.00 0.00 C ATOM 665 C LEU A 42 8.637 6.698 3.596 1.00 0.00 C ATOM 666 O LEU A 42 9.217 5.743 3.079 1.00 0.00 O ATOM 667 CB LEU A 42 7.807 8.549 2.132 1.00 0.00 C ATOM 668 CG LEU A 42 6.823 8.951 1.032 1.00 0.00 C ATOM 669 CD1 LEU A 42 6.864 10.454 0.804 1.00 0.00 C ATOM 670 CD2 LEU A 42 7.131 8.204 -0.257 1.00 0.00 C ATOM 0 H LEU A 42 6.204 8.664 4.001 1.00 0.00 H new ATOM 0 HA LEU A 42 6.968 6.575 2.268 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.926 9.389 2.817 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.781 8.367 1.678 1.00 0.00 H new ATOM 0 HG LEU A 42 5.817 8.681 1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.158 10.722 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.594 10.969 1.726 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.870 10.749 0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.421 8.502 -1.029 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.143 8.443 -0.583 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.049 7.131 -0.084 1.00 0.00 H new ATOM 682 N ALA A 43 9.034 7.252 4.738 1.00 0.00 N ATOM 683 CA ALA A 43 10.197 6.758 5.463 1.00 0.00 C ATOM 684 C ALA A 43 10.015 5.297 5.863 1.00 0.00 C ATOM 685 O ALA A 43 10.869 4.456 5.585 1.00 0.00 O ATOM 686 CB ALA A 43 10.455 7.615 6.693 1.00 0.00 C ATOM 0 H ALA A 43 8.566 8.043 5.180 1.00 0.00 H new ATOM 0 HA ALA A 43 11.061 6.822 4.801 1.00 0.00 H new ATOM 0 HB1 ALA A 43 11.327 7.234 7.225 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.638 8.645 6.387 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.586 7.580 7.349 1.00 0.00 H new ATOM 692 N ASP A 44 8.895 5.004 6.518 1.00 0.00 N ATOM 693 CA ASP A 44 8.601 3.644 6.955 1.00 0.00 C ATOM 694 C ASP A 44 8.534 2.691 5.766 1.00 0.00 C ATOM 695 O ASP A 44 8.971 1.543 5.853 1.00 0.00 O ATOM 696 CB ASP A 44 7.281 3.609 7.726 1.00 0.00 C ATOM 697 CG ASP A 44 7.098 2.320 8.503 1.00 0.00 C ATOM 698 OD1 ASP A 44 7.980 1.991 9.324 1.00 0.00 O ATOM 699 OD2 ASP A 44 6.074 1.638 8.289 1.00 0.00 O ATOM 0 H ASP A 44 8.178 5.689 6.757 1.00 0.00 H new ATOM 0 HA ASP A 44 9.407 3.318 7.612 1.00 0.00 H new ATOM 0 HB2 ASP A 44 7.243 4.453 8.414 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.453 3.730 7.028 1.00 0.00 H new ATOM 704 N LEU A 45 7.984 3.175 4.657 1.00 0.00 N ATOM 705 CA LEU A 45 7.859 2.366 3.450 1.00 0.00 C ATOM 706 C LEU A 45 9.229 2.076 2.845 1.00 0.00 C ATOM 707 O LEU A 45 9.466 0.993 2.311 1.00 0.00 O ATOM 708 CB LEU A 45 6.976 3.077 2.424 1.00 0.00 C ATOM 709 CG LEU A 45 5.478 3.052 2.730 1.00 0.00 C ATOM 710 CD1 LEU A 45 4.772 4.208 2.040 1.00 0.00 C ATOM 711 CD2 LEU A 45 4.871 1.724 2.304 1.00 0.00 C ATOM 0 H LEU A 45 7.618 4.123 4.569 1.00 0.00 H new ATOM 0 HA LEU A 45 7.395 1.419 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.298 4.115 2.348 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.139 2.620 1.448 1.00 0.00 H new ATOM 0 HG LEU A 45 5.344 3.163 3.806 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.707 4.173 2.270 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.189 5.151 2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 45 4.913 4.129 0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.804 1.723 2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.016 1.585 1.233 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.357 0.912 2.845 1.00 0.00 H new ATOM 723 N THR A 46 10.128 3.052 2.933 1.00 0.00 N ATOM 724 CA THR A 46 11.474 2.901 2.394 1.00 0.00 C ATOM 725 C THR A 46 12.254 1.839 3.164 1.00 0.00 C ATOM 726 O THR A 46 13.120 1.165 2.607 1.00 0.00 O ATOM 727 CB THR A 46 12.220 4.235 2.449 1.00 0.00 C ATOM 728 OG1 THR A 46 11.443 5.268 1.869 1.00 0.00 O ATOM 729 CG2 THR A 46 13.553 4.206 1.733 1.00 0.00 C ATOM 0 H THR A 46 9.948 3.955 3.372 1.00 0.00 H new ATOM 0 HA THR A 46 11.388 2.582 1.355 1.00 0.00 H new ATOM 0 HB THR A 46 12.399 4.422 3.508 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.823 5.626 2.538 1.00 0.00 H new ATOM 0 HG21 THR A 46 14.029 5.183 1.811 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.195 3.452 2.189 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.396 3.961 0.682 1.00 0.00 H new ATOM 737 N ARG A 47 11.939 1.694 4.448 1.00 0.00 N ATOM 738 CA ARG A 47 12.611 0.714 5.292 1.00 0.00 C ATOM 739 C ARG A 47 12.061 -0.687 5.044 1.00 0.00 C ATOM 740 O ARG A 47 12.778 -1.679 5.178 1.00 0.00 O ATOM 741 CB ARG A 47 12.447 1.085 6.768 1.00 0.00 C ATOM 742 CG ARG A 47 13.641 0.703 7.627 1.00 0.00 C ATOM 743 CD ARG A 47 13.305 0.765 9.109 1.00 0.00 C ATOM 744 NE ARG A 47 12.249 -0.178 9.470 1.00 0.00 N ATOM 745 CZ ARG A 47 11.770 -0.317 10.704 1.00 0.00 C ATOM 746 NH1 ARG A 47 12.248 0.423 11.696 1.00 0.00 N ATOM 747 NH2 ARG A 47 10.810 -1.198 10.946 1.00 0.00 N ATOM 0 H ARG A 47 11.223 2.242 4.925 1.00 0.00 H new ATOM 0 HA ARG A 47 13.671 0.718 5.038 1.00 0.00 H new ATOM 0 HB2 ARG A 47 12.281 2.159 6.848 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.556 0.595 7.160 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.969 -0.304 7.369 1.00 0.00 H new ATOM 0 HG3 ARG A 47 14.473 1.373 7.413 1.00 0.00 H new ATOM 0 HD2 ARG A 47 14.200 0.549 9.693 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.992 1.776 9.368 1.00 0.00 H new ATOM 0 HE ARG A 47 11.856 -0.764 8.733 1.00 0.00 H new ATOM 0 HH11 ARG A 47 12.986 1.103 11.515 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.877 0.312 12.640 1.00 0.00 H new ATOM 0 HH21 ARG A 47 10.439 -1.769 10.187 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.443 -1.305 11.891 1.00 0.00 H new ATOM 761 N THR A 48 10.784 -0.762 4.684 1.00 0.00 N ATOM 762 CA THR A 48 10.139 -2.042 4.419 1.00 0.00 C ATOM 763 C THR A 48 10.252 -2.415 2.944 1.00 0.00 C ATOM 764 O THR A 48 11.044 -3.279 2.570 1.00 0.00 O ATOM 765 CB THR A 48 8.667 -1.991 4.833 1.00 0.00 C ATOM 766 OG1 THR A 48 7.978 -0.986 4.110 1.00 0.00 O ATOM 767 CG2 THR A 48 8.470 -1.714 6.308 1.00 0.00 C ATOM 0 H THR A 48 10.176 0.049 4.569 1.00 0.00 H new ATOM 0 HA THR A 48 10.649 -2.805 5.007 1.00 0.00 H new ATOM 0 HB THR A 48 8.269 -2.981 4.610 1.00 0.00 H new ATOM 0 HG1 THR A 48 7.038 -0.969 4.388 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.404 -1.691 6.535 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.948 -2.500 6.893 1.00 0.00 H new ATOM 0 HG23 THR A 48 8.915 -0.752 6.560 1.00 0.00 H new ATOM 775 N LEU A 49 9.454 -1.756 2.109 1.00 0.00 N ATOM 776 CA LEU A 49 9.465 -2.018 0.675 1.00 0.00 C ATOM 777 C LEU A 49 10.635 -1.308 0.000 1.00 0.00 C ATOM 778 O LEU A 49 10.464 -0.256 -0.616 1.00 0.00 O ATOM 779 CB LEU A 49 8.147 -1.567 0.043 1.00 0.00 C ATOM 780 CG LEU A 49 6.885 -2.091 0.731 1.00 0.00 C ATOM 781 CD1 LEU A 49 5.655 -1.357 0.222 1.00 0.00 C ATOM 782 CD2 LEU A 49 6.742 -3.590 0.511 1.00 0.00 C ATOM 0 H LEU A 49 8.792 -1.037 2.401 1.00 0.00 H new ATOM 0 HA LEU A 49 9.582 -3.092 0.529 1.00 0.00 H new ATOM 0 HB2 LEU A 49 8.116 -0.477 0.043 1.00 0.00 H new ATOM 0 HB3 LEU A 49 8.133 -1.887 -0.999 1.00 0.00 H new ATOM 0 HG LEU A 49 6.975 -1.907 1.802 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.767 -1.744 0.723 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.755 -0.292 0.431 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.560 -1.509 -0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.839 -3.946 1.007 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.674 -3.796 -0.557 1.00 0.00 H new ATOM 0 HD23 LEU A 49 7.610 -4.103 0.925 1.00 0.00 H new ATOM 794 N SER A 50 11.822 -1.892 0.120 1.00 0.00 N ATOM 795 CA SER A 50 13.022 -1.316 -0.478 1.00 0.00 C ATOM 796 C SER A 50 14.234 -2.209 -0.238 1.00 0.00 C ATOM 797 O SER A 50 14.589 -2.497 0.905 1.00 0.00 O ATOM 798 CB SER A 50 13.282 0.080 0.091 1.00 0.00 C ATOM 799 OG SER A 50 13.787 0.952 -0.906 1.00 0.00 O ATOM 0 H SER A 50 11.980 -2.764 0.626 1.00 0.00 H new ATOM 0 HA SER A 50 12.859 -1.238 -1.553 1.00 0.00 H new ATOM 0 HB2 SER A 50 12.357 0.487 0.500 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.993 0.014 0.915 1.00 0.00 H new ATOM 0 HG SER A 50 14.092 0.427 -1.676 1.00 0.00 H new ATOM 805 N ASP A 51 14.865 -2.647 -1.323 1.00 0.00 N ATOM 806 CA ASP A 51 16.039 -3.508 -1.229 1.00 0.00 C ATOM 807 C ASP A 51 17.191 -2.948 -2.057 1.00 0.00 C ATOM 808 O ASP A 51 18.149 -2.398 -1.514 1.00 0.00 O ATOM 809 CB ASP A 51 15.698 -4.923 -1.699 1.00 0.00 C ATOM 810 CG ASP A 51 14.717 -5.618 -0.774 1.00 0.00 C ATOM 811 OD1 ASP A 51 15.057 -5.818 0.411 1.00 0.00 O ATOM 812 OD2 ASP A 51 13.609 -5.964 -1.237 1.00 0.00 O ATOM 0 H ASP A 51 14.583 -2.420 -2.277 1.00 0.00 H new ATOM 0 HA ASP A 51 16.350 -3.545 -0.185 1.00 0.00 H new ATOM 0 HB2 ASP A 51 15.277 -4.878 -2.703 1.00 0.00 H new ATOM 0 HB3 ASP A 51 16.613 -5.512 -1.763 1.00 0.00 H new ATOM 817 N ASN A 52 17.092 -3.093 -3.375 1.00 0.00 N ATOM 818 CA ASN A 52 18.126 -2.602 -4.278 1.00 0.00 C ATOM 819 C ASN A 52 17.725 -2.817 -5.733 1.00 0.00 C ATOM 820 O ASN A 52 17.912 -1.939 -6.576 1.00 0.00 O ATOM 821 CB ASN A 52 19.455 -3.304 -3.994 1.00 0.00 C ATOM 822 CG ASN A 52 20.637 -2.573 -4.602 1.00 0.00 C ATOM 823 OD1 ASN A 52 20.507 -1.905 -5.629 1.00 0.00 O ATOM 824 ND2 ASN A 52 21.797 -2.696 -3.970 1.00 0.00 N ATOM 0 H ASN A 52 16.306 -3.547 -3.841 1.00 0.00 H new ATOM 0 HA ASN A 52 18.244 -1.532 -4.107 1.00 0.00 H new ATOM 0 HB2 ASN A 52 19.597 -3.385 -2.916 1.00 0.00 H new ATOM 0 HB3 ASN A 52 19.418 -4.320 -4.388 1.00 0.00 H new ATOM 0 HD21 ASN A 52 22.627 -2.227 -4.332 1.00 0.00 H new ATOM 0 HD22 ASN A 52 21.859 -3.260 -3.122 1.00 0.00 H new ATOM 831 N VAL A 53 17.171 -3.990 -6.022 1.00 0.00 N ATOM 832 CA VAL A 53 16.743 -4.320 -7.376 1.00 0.00 C ATOM 833 C VAL A 53 15.449 -3.597 -7.735 1.00 0.00 C ATOM 834 O VAL A 53 15.379 -2.893 -8.743 1.00 0.00 O ATOM 835 CB VAL A 53 16.533 -5.837 -7.546 1.00 0.00 C ATOM 836 CG1 VAL A 53 16.285 -6.182 -9.005 1.00 0.00 C ATOM 837 CG2 VAL A 53 17.730 -6.605 -7.005 1.00 0.00 C ATOM 0 H VAL A 53 17.008 -4.728 -5.337 1.00 0.00 H new ATOM 0 HA VAL A 53 17.538 -3.993 -8.047 1.00 0.00 H new ATOM 0 HB VAL A 53 15.653 -6.130 -6.973 1.00 0.00 H new ATOM 0 HG11 VAL A 53 16.139 -7.258 -9.105 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.394 -5.661 -9.356 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.144 -5.875 -9.602 1.00 0.00 H new ATOM 0 HG21 VAL A 53 17.564 -7.675 -7.133 1.00 0.00 H new ATOM 0 HG22 VAL A 53 18.628 -6.309 -7.548 1.00 0.00 H new ATOM 0 HG23 VAL A 53 17.857 -6.382 -5.946 1.00 0.00 H new ATOM 847 N ASN A 54 14.428 -3.774 -6.904 1.00 0.00 N ATOM 848 CA ASN A 54 13.136 -3.137 -7.134 1.00 0.00 C ATOM 849 C ASN A 54 13.240 -1.624 -6.980 1.00 0.00 C ATOM 850 O ASN A 54 13.076 -0.879 -7.945 1.00 0.00 O ATOM 851 CB ASN A 54 12.091 -3.691 -6.163 1.00 0.00 C ATOM 852 CG ASN A 54 11.627 -5.083 -6.544 1.00 0.00 C ATOM 853 OD1 ASN A 54 11.259 -5.335 -7.690 1.00 0.00 O ATOM 854 ND2 ASN A 54 11.643 -5.996 -5.580 1.00 0.00 N ATOM 0 H ASN A 54 14.470 -4.353 -6.065 1.00 0.00 H new ATOM 0 HA ASN A 54 12.826 -3.359 -8.155 1.00 0.00 H new ATOM 0 HB2 ASN A 54 12.510 -3.714 -5.157 1.00 0.00 H new ATOM 0 HB3 ASN A 54 11.233 -3.020 -6.136 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.342 -6.951 -5.777 1.00 0.00 H new ATOM 0 HD22 ASN A 54 11.956 -5.743 -4.643 1.00 0.00 H new ATOM 861 N LEU A 55 13.512 -1.176 -5.758 1.00 0.00 N ATOM 862 CA LEU A 55 13.639 0.250 -5.477 1.00 0.00 C ATOM 863 C LEU A 55 14.846 0.524 -4.583 1.00 0.00 C ATOM 864 O LEU A 55 14.732 0.537 -3.358 1.00 0.00 O ATOM 865 CB LEU A 55 12.365 0.774 -4.809 1.00 0.00 C ATOM 866 CG LEU A 55 11.057 0.322 -5.464 1.00 0.00 C ATOM 867 CD1 LEU A 55 10.430 -0.816 -4.674 1.00 0.00 C ATOM 868 CD2 LEU A 55 10.088 1.488 -5.583 1.00 0.00 C ATOM 0 H LEU A 55 13.649 -1.779 -4.947 1.00 0.00 H new ATOM 0 HA LEU A 55 13.786 0.770 -6.424 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.361 0.454 -3.767 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.395 1.864 -4.808 1.00 0.00 H new ATOM 0 HG LEU A 55 11.282 -0.040 -6.467 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.501 -1.124 -5.154 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.119 -1.660 -4.642 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.219 -0.481 -3.658 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.164 1.147 -6.051 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.868 1.881 -4.590 1.00 0.00 H new ATOM 0 HD23 LEU A 55 10.536 2.272 -6.193 1.00 0.00 H new ATOM 880 N PRO A 56 16.025 0.750 -5.189 1.00 0.00 N ATOM 881 CA PRO A 56 17.256 1.025 -4.440 1.00 0.00 C ATOM 882 C PRO A 56 17.226 2.388 -3.757 1.00 0.00 C ATOM 883 O PRO A 56 17.574 2.513 -2.583 1.00 0.00 O ATOM 884 CB PRO A 56 18.344 0.991 -5.516 1.00 0.00 C ATOM 885 CG PRO A 56 17.634 1.326 -6.783 1.00 0.00 C ATOM 886 CD PRO A 56 16.250 0.754 -6.646 1.00 0.00 C ATOM 0 HA PRO A 56 17.411 0.306 -3.636 1.00 0.00 H new ATOM 0 HB2 PRO A 56 19.134 1.711 -5.303 1.00 0.00 H new ATOM 0 HB3 PRO A 56 18.814 0.009 -5.573 1.00 0.00 H new ATOM 0 HG2 PRO A 56 17.597 2.405 -6.936 1.00 0.00 H new ATOM 0 HG3 PRO A 56 18.149 0.899 -7.644 1.00 0.00 H new ATOM 0 HD2 PRO A 56 15.510 1.363 -7.165 1.00 0.00 H new ATOM 0 HD3 PRO A 56 16.187 -0.250 -7.065 1.00 0.00 H new ATOM 894 N GLN A 57 16.806 3.407 -4.500 1.00 0.00 N ATOM 895 CA GLN A 57 16.730 4.763 -3.965 1.00 0.00 C ATOM 896 C GLN A 57 15.677 4.853 -2.865 1.00 0.00 C ATOM 897 O GLN A 57 15.819 5.628 -1.918 1.00 0.00 O ATOM 898 CB GLN A 57 16.406 5.756 -5.083 1.00 0.00 C ATOM 899 CG GLN A 57 17.633 6.443 -5.660 1.00 0.00 C ATOM 900 CD GLN A 57 18.649 5.460 -6.207 1.00 0.00 C ATOM 901 OE1 GLN A 57 19.623 5.118 -5.537 1.00 0.00 O ATOM 902 NE2 GLN A 57 18.426 5.001 -7.434 1.00 0.00 N ATOM 0 H GLN A 57 16.513 3.320 -5.473 1.00 0.00 H new ATOM 0 HA GLN A 57 17.700 5.015 -3.536 1.00 0.00 H new ATOM 0 HB2 GLN A 57 15.883 5.232 -5.883 1.00 0.00 H new ATOM 0 HB3 GLN A 57 15.723 6.513 -4.698 1.00 0.00 H new ATOM 0 HG2 GLN A 57 17.325 7.121 -6.456 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.102 7.051 -4.886 1.00 0.00 H new ATOM 0 HE21 GLN A 57 17.605 5.312 -7.953 1.00 0.00 H new ATOM 0 HE22 GLN A 57 19.076 4.338 -7.856 1.00 0.00 H new ATOM 911 N GLY A 58 14.621 4.056 -2.996 1.00 0.00 N ATOM 912 CA GLY A 58 13.559 4.063 -2.006 1.00 0.00 C ATOM 913 C GLY A 58 12.210 4.408 -2.605 1.00 0.00 C ATOM 914 O GLY A 58 12.096 4.621 -3.812 1.00 0.00 O ATOM 0 H GLY A 58 14.482 3.406 -3.769 1.00 0.00 H new ATOM 0 HA2 GLY A 58 13.502 3.083 -1.531 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.800 4.783 -1.224 1.00 0.00 H new ATOM 918 N VAL A 59 11.186 4.465 -1.759 1.00 0.00 N ATOM 919 CA VAL A 59 9.839 4.787 -2.213 1.00 0.00 C ATOM 920 C VAL A 59 9.626 6.296 -2.274 1.00 0.00 C ATOM 921 O VAL A 59 9.940 7.017 -1.327 1.00 0.00 O ATOM 922 CB VAL A 59 8.772 4.161 -1.290 1.00 0.00 C ATOM 923 CG1 VAL A 59 8.898 4.707 0.125 1.00 0.00 C ATOM 924 CG2 VAL A 59 7.376 4.406 -1.843 1.00 0.00 C ATOM 0 H VAL A 59 11.264 4.293 -0.757 1.00 0.00 H new ATOM 0 HA VAL A 59 9.732 4.369 -3.214 1.00 0.00 H new ATOM 0 HB VAL A 59 8.939 3.084 -1.253 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.137 4.253 0.759 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.887 4.471 0.519 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.761 5.788 0.111 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.638 3.957 -1.179 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.196 5.479 -1.914 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.293 3.958 -2.833 1.00 0.00 H new ATOM 934 N ARG A 60 9.093 6.769 -3.397 1.00 0.00 N ATOM 935 CA ARG A 60 8.839 8.191 -3.583 1.00 0.00 C ATOM 936 C ARG A 60 7.443 8.426 -4.151 1.00 0.00 C ATOM 937 O ARG A 60 6.700 9.280 -3.668 1.00 0.00 O ATOM 938 CB ARG A 60 9.889 8.801 -4.513 1.00 0.00 C ATOM 939 CG ARG A 60 11.176 9.190 -3.807 1.00 0.00 C ATOM 940 CD ARG A 60 12.169 9.827 -4.766 1.00 0.00 C ATOM 941 NE ARG A 60 13.503 9.936 -4.182 1.00 0.00 N ATOM 942 CZ ARG A 60 14.451 10.746 -4.646 1.00 0.00 C ATOM 943 NH1 ARG A 60 14.217 11.520 -5.700 1.00 0.00 N ATOM 944 NH2 ARG A 60 15.637 10.785 -4.055 1.00 0.00 N ATOM 0 H ARG A 60 8.829 6.186 -4.192 1.00 0.00 H new ATOM 0 HA ARG A 60 8.901 8.675 -2.608 1.00 0.00 H new ATOM 0 HB2 ARG A 60 10.120 8.087 -5.304 1.00 0.00 H new ATOM 0 HB3 ARG A 60 9.467 9.684 -4.994 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.952 9.886 -2.998 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.624 8.306 -3.352 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.221 9.235 -5.680 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.815 10.819 -5.048 1.00 0.00 H new ATOM 0 HE ARG A 60 13.721 9.357 -3.371 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.306 11.496 -6.159 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.948 12.139 -6.051 1.00 0.00 H new ATOM 0 HH21 ARG A 60 15.823 10.194 -3.245 1.00 0.00 H new ATOM 0 HH22 ARG A 60 16.364 11.406 -4.411 1.00 0.00 H new ATOM 958 N THR A 61 7.092 7.661 -5.180 1.00 0.00 N ATOM 959 CA THR A 61 5.786 7.785 -5.816 1.00 0.00 C ATOM 960 C THR A 61 5.032 6.460 -5.772 1.00 0.00 C ATOM 961 O THR A 61 5.546 5.426 -6.202 1.00 0.00 O ATOM 962 CB THR A 61 5.943 8.246 -7.266 1.00 0.00 C ATOM 963 OG1 THR A 61 6.807 9.367 -7.344 1.00 0.00 O ATOM 964 CG2 THR A 61 4.632 8.632 -7.917 1.00 0.00 C ATOM 0 H THR A 61 7.695 6.948 -5.591 1.00 0.00 H new ATOM 0 HA THR A 61 5.211 8.529 -5.265 1.00 0.00 H new ATOM 0 HB THR A 61 6.356 7.389 -7.799 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.897 9.647 -8.279 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.815 8.949 -8.944 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.959 7.774 -7.917 1.00 0.00 H new ATOM 0 HG23 THR A 61 4.176 9.451 -7.360 1.00 0.00 H new ATOM 972 N ILE A 62 3.810 6.496 -5.251 1.00 0.00 N ATOM 973 CA ILE A 62 2.985 5.298 -5.151 1.00 0.00 C ATOM 974 C ILE A 62 1.759 5.400 -6.054 1.00 0.00 C ATOM 975 O ILE A 62 0.988 6.356 -5.965 1.00 0.00 O ATOM 976 CB ILE A 62 2.521 5.051 -3.702 1.00 0.00 C ATOM 977 CG1 ILE A 62 3.716 5.095 -2.745 1.00 0.00 C ATOM 978 CG2 ILE A 62 1.802 3.714 -3.596 1.00 0.00 C ATOM 979 CD1 ILE A 62 3.421 5.815 -1.447 1.00 0.00 C ATOM 0 H ILE A 62 3.369 7.343 -4.891 1.00 0.00 H new ATOM 0 HA ILE A 62 3.604 4.461 -5.473 1.00 0.00 H new ATOM 0 HB ILE A 62 1.824 5.841 -3.421 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.032 4.076 -2.523 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.552 5.586 -3.242 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.481 3.554 -2.567 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.931 3.716 -4.252 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.478 2.913 -3.893 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.310 5.808 -0.817 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.134 6.845 -1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.605 5.311 -0.928 1.00 0.00 H new ATOM 991 N TYR A 63 1.585 4.408 -6.922 1.00 0.00 N ATOM 992 CA TYR A 63 0.453 4.387 -7.840 1.00 0.00 C ATOM 993 C TYR A 63 -0.664 3.497 -7.303 1.00 0.00 C ATOM 994 O TYR A 63 -0.485 2.786 -6.315 1.00 0.00 O ATOM 995 CB TYR A 63 0.896 3.892 -9.217 1.00 0.00 C ATOM 996 CG TYR A 63 2.005 4.718 -9.831 1.00 0.00 C ATOM 997 CD1 TYR A 63 1.724 5.901 -10.505 1.00 0.00 C ATOM 998 CD2 TYR A 63 3.331 4.317 -9.735 1.00 0.00 C ATOM 999 CE1 TYR A 63 2.734 6.658 -11.067 1.00 0.00 C ATOM 1000 CE2 TYR A 63 4.347 5.070 -10.293 1.00 0.00 C ATOM 1001 CZ TYR A 63 4.044 6.239 -10.958 1.00 0.00 C ATOM 1002 OH TYR A 63 5.052 6.990 -11.515 1.00 0.00 O ATOM 0 H TYR A 63 2.213 3.609 -7.008 1.00 0.00 H new ATOM 0 HA TYR A 63 0.072 5.404 -7.932 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.229 2.858 -9.132 1.00 0.00 H new ATOM 0 HB3 TYR A 63 0.037 3.896 -9.888 1.00 0.00 H new ATOM 0 HD1 TYR A 63 0.700 6.234 -10.591 1.00 0.00 H new ATOM 0 HD2 TYR A 63 3.573 3.401 -9.216 1.00 0.00 H new ATOM 0 HE1 TYR A 63 2.499 7.574 -11.589 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.373 4.744 -10.208 1.00 0.00 H new ATOM 0 HH TYR A 63 5.914 6.556 -11.347 1.00 0.00 H new ATOM 1012 N THR A 64 -1.817 3.543 -7.962 1.00 0.00 N ATOM 1013 CA THR A 64 -2.965 2.742 -7.551 1.00 0.00 C ATOM 1014 C THR A 64 -2.737 1.265 -7.865 1.00 0.00 C ATOM 1015 O THR A 64 -1.671 0.880 -8.346 1.00 0.00 O ATOM 1016 CB THR A 64 -4.236 3.236 -8.246 1.00 0.00 C ATOM 1017 OG1 THR A 64 -3.916 3.978 -9.409 1.00 0.00 O ATOM 1018 CG2 THR A 64 -5.096 4.114 -7.364 1.00 0.00 C ATOM 0 H THR A 64 -1.982 4.126 -8.783 1.00 0.00 H new ATOM 0 HA THR A 64 -3.086 2.851 -6.473 1.00 0.00 H new ATOM 0 HB THR A 64 -4.798 2.336 -8.495 1.00 0.00 H new ATOM 0 HG1 THR A 64 -3.584 4.863 -9.151 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.981 4.430 -7.917 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.401 3.554 -6.480 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.526 4.992 -7.058 1.00 0.00 H new ATOM 1026 N ILE A 65 -3.745 0.444 -7.589 1.00 0.00 N ATOM 1027 CA ILE A 65 -3.655 -0.989 -7.842 1.00 0.00 C ATOM 1028 C ILE A 65 -3.664 -1.287 -9.340 1.00 0.00 C ATOM 1029 O ILE A 65 -3.107 -2.290 -9.785 1.00 0.00 O ATOM 1030 CB ILE A 65 -4.813 -1.753 -7.165 1.00 0.00 C ATOM 1031 CG1 ILE A 65 -4.638 -3.262 -7.349 1.00 0.00 C ATOM 1032 CG2 ILE A 65 -6.155 -1.295 -7.720 1.00 0.00 C ATOM 1033 CD1 ILE A 65 -3.368 -3.803 -6.727 1.00 0.00 C ATOM 0 H ILE A 65 -4.634 0.747 -7.190 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.710 -1.327 -7.416 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.794 -1.533 -6.098 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.494 -3.775 -6.912 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.638 -3.493 -8.414 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.958 -1.845 -7.230 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -6.280 -0.228 -7.535 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.188 -1.483 -8.793 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.310 -4.878 -6.896 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.505 -3.317 -7.181 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -3.374 -3.604 -5.655 1.00 0.00 H new ATOM 1045 N ASP A 66 -4.299 -0.410 -10.110 1.00 0.00 N ATOM 1046 CA ASP A 66 -4.380 -0.583 -11.557 1.00 0.00 C ATOM 1047 C ASP A 66 -3.358 0.299 -12.267 1.00 0.00 C ATOM 1048 O ASP A 66 -2.852 -0.053 -13.334 1.00 0.00 O ATOM 1049 CB ASP A 66 -5.791 -0.256 -12.052 1.00 0.00 C ATOM 1050 CG ASP A 66 -6.458 -1.442 -12.723 1.00 0.00 C ATOM 1051 OD1 ASP A 66 -6.095 -2.591 -12.394 1.00 0.00 O ATOM 1052 OD2 ASP A 66 -7.341 -1.221 -13.577 1.00 0.00 O ATOM 0 H ASP A 66 -4.764 0.426 -9.758 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.156 -1.624 -11.789 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.401 0.072 -11.211 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.743 0.576 -12.755 1.00 0.00 H new ATOM 1057 N GLY A 67 -3.057 1.447 -11.669 1.00 0.00 N ATOM 1058 CA GLY A 67 -2.097 2.362 -12.259 1.00 0.00 C ATOM 1059 C GLY A 67 -2.763 3.529 -12.961 1.00 0.00 C ATOM 1060 O GLY A 67 -2.214 4.085 -13.911 1.00 0.00 O ATOM 0 H GLY A 67 -3.461 1.760 -10.786 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.435 2.741 -11.480 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.475 1.821 -12.972 1.00 0.00 H new ATOM 1064 N LEU A 68 -3.950 3.901 -12.491 1.00 0.00 N ATOM 1065 CA LEU A 68 -4.692 5.009 -13.081 1.00 0.00 C ATOM 1066 C LEU A 68 -4.215 6.344 -12.517 1.00 0.00 C ATOM 1067 O LEU A 68 -3.728 7.201 -13.253 1.00 0.00 O ATOM 1068 CB LEU A 68 -6.191 4.839 -12.825 1.00 0.00 C ATOM 1069 CG LEU A 68 -6.929 3.980 -13.851 1.00 0.00 C ATOM 1070 CD1 LEU A 68 -8.382 3.790 -13.442 1.00 0.00 C ATOM 1071 CD2 LEU A 68 -6.840 4.607 -15.234 1.00 0.00 C ATOM 0 H LEU A 68 -4.418 3.451 -11.704 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.511 5.004 -14.156 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.328 4.397 -11.838 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.654 5.825 -12.799 1.00 0.00 H new ATOM 0 HG LEU A 68 -6.452 3.001 -13.887 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -8.892 3.176 -14.184 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -8.425 3.296 -12.471 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -8.872 4.762 -13.377 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -7.371 3.982 -15.952 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.291 5.599 -15.213 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.794 4.690 -15.529 1.00 0.00 H new ATOM 1083 N LYS A 69 -4.361 6.513 -11.207 1.00 0.00 N ATOM 1084 CA LYS A 69 -3.945 7.744 -10.543 1.00 0.00 C ATOM 1085 C LYS A 69 -2.798 7.478 -9.573 1.00 0.00 C ATOM 1086 O LYS A 69 -2.607 6.352 -9.116 1.00 0.00 O ATOM 1087 CB LYS A 69 -5.128 8.371 -9.801 1.00 0.00 C ATOM 1088 CG LYS A 69 -5.523 9.739 -10.333 1.00 0.00 C ATOM 1089 CD LYS A 69 -6.446 10.467 -9.370 1.00 0.00 C ATOM 1090 CE LYS A 69 -6.669 11.909 -9.796 1.00 0.00 C ATOM 1091 NZ LYS A 69 -7.151 12.753 -8.667 1.00 0.00 N ATOM 0 H LYS A 69 -4.764 5.813 -10.584 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.595 8.440 -11.305 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.986 7.702 -9.870 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.877 8.460 -8.744 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.628 10.337 -10.502 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.018 9.626 -11.298 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.404 9.949 -9.320 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.019 10.444 -8.367 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.738 12.321 -10.185 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -7.395 11.940 -10.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -7.291 13.729 -8.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -8.052 12.375 -8.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.446 12.745 -7.902 1.00 0.00 H new ATOM 1105 N LYS A 70 -2.037 8.523 -9.263 1.00 0.00 N ATOM 1106 CA LYS A 70 -0.909 8.404 -8.347 1.00 0.00 C ATOM 1107 C LYS A 70 -1.221 9.067 -7.010 1.00 0.00 C ATOM 1108 O LYS A 70 -1.648 10.221 -6.964 1.00 0.00 O ATOM 1109 CB LYS A 70 0.342 9.033 -8.963 1.00 0.00 C ATOM 1110 CG LYS A 70 0.146 10.475 -9.398 1.00 0.00 C ATOM 1111 CD LYS A 70 1.463 11.117 -9.807 1.00 0.00 C ATOM 1112 CE LYS A 70 1.642 11.111 -11.316 1.00 0.00 C ATOM 1113 NZ LYS A 70 0.947 12.259 -11.962 1.00 0.00 N ATOM 0 H LYS A 70 -2.182 9.462 -9.633 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.726 7.344 -8.171 1.00 0.00 H new ATOM 0 HB2 LYS A 70 1.155 8.988 -8.239 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.650 8.441 -9.825 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.553 10.512 -10.233 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.300 11.045 -8.583 1.00 0.00 H new ATOM 0 HD2 LYS A 70 1.498 12.143 -9.440 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.290 10.582 -9.340 1.00 0.00 H new ATOM 0 HE2 LYS A 70 2.705 11.148 -11.556 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.256 10.177 -11.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 1.093 12.219 -12.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.071 12.210 -11.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 1.333 13.151 -11.592 1.00 0.00 H new ATOM 1127 N ILE A 71 -1.003 8.332 -5.925 1.00 0.00 N ATOM 1128 CA ILE A 71 -1.261 8.849 -4.586 1.00 0.00 C ATOM 1129 C ILE A 71 -0.201 9.867 -4.178 1.00 0.00 C ATOM 1130 O ILE A 71 0.990 9.663 -4.409 1.00 0.00 O ATOM 1131 CB ILE A 71 -1.299 7.717 -3.543 1.00 0.00 C ATOM 1132 CG1 ILE A 71 -2.205 6.581 -4.022 1.00 0.00 C ATOM 1133 CG2 ILE A 71 -1.774 8.250 -2.199 1.00 0.00 C ATOM 1134 CD1 ILE A 71 -3.626 7.018 -4.301 1.00 0.00 C ATOM 0 H ILE A 71 -0.648 7.376 -5.947 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.236 9.335 -4.617 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.290 7.324 -3.420 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.782 6.148 -4.928 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.217 5.794 -3.268 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.795 7.438 -1.472 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.092 9.027 -1.854 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.775 8.667 -2.306 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.211 6.162 -4.636 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -4.067 7.424 -3.391 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -3.626 7.783 -5.077 1.00 0.00 H new ATOM 1146 N SER A 72 -0.642 10.962 -3.569 1.00 0.00 N ATOM 1147 CA SER A 72 0.269 12.011 -3.127 1.00 0.00 C ATOM 1148 C SER A 72 0.058 12.329 -1.650 1.00 0.00 C ATOM 1149 O SER A 72 1.018 12.459 -0.890 1.00 0.00 O ATOM 1150 CB SER A 72 0.070 13.275 -3.965 1.00 0.00 C ATOM 1151 OG SER A 72 1.210 14.114 -3.904 1.00 0.00 O ATOM 0 H SER A 72 -1.625 11.146 -3.370 1.00 0.00 H new ATOM 0 HA SER A 72 1.289 11.651 -3.261 1.00 0.00 H new ATOM 0 HB2 SER A 72 -0.128 13.000 -5.001 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.804 13.818 -3.607 1.00 0.00 H new ATOM 0 HG SER A 72 1.057 14.914 -4.449 1.00 0.00 H new ATOM 1157 N SER A 73 -1.204 12.453 -1.251 1.00 0.00 N ATOM 1158 CA SER A 73 -1.540 12.756 0.135 1.00 0.00 C ATOM 1159 C SER A 73 -2.148 11.539 0.826 1.00 0.00 C ATOM 1160 O SER A 73 -2.464 10.541 0.180 1.00 0.00 O ATOM 1161 CB SER A 73 -2.516 13.933 0.199 1.00 0.00 C ATOM 1162 OG SER A 73 -1.855 15.158 -0.067 1.00 0.00 O ATOM 0 H SER A 73 -2.010 12.348 -1.868 1.00 0.00 H new ATOM 0 HA SER A 73 -0.621 13.026 0.655 1.00 0.00 H new ATOM 0 HB2 SER A 73 -3.318 13.784 -0.524 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.979 13.972 1.185 1.00 0.00 H new ATOM 0 HG SER A 73 -2.500 15.894 -0.022 1.00 0.00 H new ATOM 1168 N LEU A 74 -2.307 11.630 2.142 1.00 0.00 N ATOM 1169 CA LEU A 74 -2.876 10.536 2.920 1.00 0.00 C ATOM 1170 C LEU A 74 -4.399 10.546 2.842 1.00 0.00 C ATOM 1171 O LEU A 74 -5.041 9.499 2.913 1.00 0.00 O ATOM 1172 CB LEU A 74 -2.427 10.634 4.379 1.00 0.00 C ATOM 1173 CG LEU A 74 -0.929 10.866 4.583 1.00 0.00 C ATOM 1174 CD1 LEU A 74 -0.684 11.715 5.820 1.00 0.00 C ATOM 1175 CD2 LEU A 74 -0.196 9.538 4.692 1.00 0.00 C ATOM 0 H LEU A 74 -2.050 12.450 2.692 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.516 9.598 2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.973 11.447 4.857 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.710 9.715 4.892 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.542 11.403 3.717 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.387 11.869 5.949 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.178 12.679 5.703 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.085 11.206 6.696 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.869 9.721 4.837 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.586 8.976 5.540 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.344 8.964 3.777 1.00 0.00 H new ATOM 1187 N ASP A 75 -4.972 11.737 2.698 1.00 0.00 N ATOM 1188 CA ASP A 75 -6.420 11.884 2.610 1.00 0.00 C ATOM 1189 C ASP A 75 -6.976 11.106 1.422 1.00 0.00 C ATOM 1190 O ASP A 75 -8.082 10.570 1.480 1.00 0.00 O ATOM 1191 CB ASP A 75 -6.796 13.362 2.490 1.00 0.00 C ATOM 1192 CG ASP A 75 -8.021 13.715 3.311 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -7.898 13.806 4.550 1.00 0.00 O ATOM 1194 OD2 ASP A 75 -9.102 13.901 2.714 1.00 0.00 O ATOM 0 H ASP A 75 -4.455 12.614 2.640 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.858 11.478 3.522 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.955 13.975 2.814 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.982 13.603 1.443 1.00 0.00 H new ATOM 1199 N GLN A 76 -6.199 11.047 0.344 1.00 0.00 N ATOM 1200 CA GLN A 76 -6.614 10.334 -0.859 1.00 0.00 C ATOM 1201 C GLN A 76 -6.778 8.843 -0.578 1.00 0.00 C ATOM 1202 O GLN A 76 -7.595 8.170 -1.208 1.00 0.00 O ATOM 1203 CB GLN A 76 -5.594 10.544 -1.978 1.00 0.00 C ATOM 1204 CG GLN A 76 -5.195 11.998 -2.172 1.00 0.00 C ATOM 1205 CD GLN A 76 -5.073 12.381 -3.634 1.00 0.00 C ATOM 1206 OE1 GLN A 76 -6.032 12.269 -4.398 1.00 0.00 O ATOM 1207 NE2 GLN A 76 -3.891 12.835 -4.031 1.00 0.00 N ATOM 0 H GLN A 76 -5.280 11.484 0.279 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.577 10.734 -1.175 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.702 9.957 -1.760 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -6.007 10.162 -2.911 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.934 12.640 -1.693 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.243 12.179 -1.672 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.124 12.911 -3.363 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.750 13.108 -5.004 1.00 0.00 H new ATOM 1216 N LEU A 77 -5.998 8.334 0.369 1.00 0.00 N ATOM 1217 CA LEU A 77 -6.057 6.922 0.733 1.00 0.00 C ATOM 1218 C LEU A 77 -7.457 6.538 1.202 1.00 0.00 C ATOM 1219 O LEU A 77 -8.243 7.393 1.607 1.00 0.00 O ATOM 1220 CB LEU A 77 -5.038 6.614 1.830 1.00 0.00 C ATOM 1221 CG LEU A 77 -3.573 6.769 1.414 1.00 0.00 C ATOM 1222 CD1 LEU A 77 -2.691 6.974 2.637 1.00 0.00 C ATOM 1223 CD2 LEU A 77 -3.114 5.556 0.619 1.00 0.00 C ATOM 0 H LEU A 77 -5.317 8.878 0.899 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.816 6.334 -0.153 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.231 7.271 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.196 5.592 2.175 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.486 7.649 0.777 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.653 7.082 2.323 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.006 7.874 3.166 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.782 6.113 3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.070 5.683 0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.215 4.660 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.727 5.454 -0.276 1.00 0.00 H new ATOM 1235 N VAL A 78 -7.762 5.246 1.143 1.00 0.00 N ATOM 1236 CA VAL A 78 -9.066 4.748 1.562 1.00 0.00 C ATOM 1237 C VAL A 78 -8.928 3.474 2.390 1.00 0.00 C ATOM 1238 O VAL A 78 -7.912 2.781 2.317 1.00 0.00 O ATOM 1239 CB VAL A 78 -9.975 4.464 0.351 1.00 0.00 C ATOM 1240 CG1 VAL A 78 -11.388 4.141 0.808 1.00 0.00 C ATOM 1241 CG2 VAL A 78 -9.972 5.646 -0.606 1.00 0.00 C ATOM 0 H VAL A 78 -7.123 4.525 0.809 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.521 5.528 2.173 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.584 3.596 -0.179 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -12.015 3.943 -0.061 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.370 3.261 1.450 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.793 4.987 1.363 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -10.619 5.428 -1.455 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.338 6.533 -0.089 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -8.957 5.825 -0.960 1.00 0.00 H new ATOM 1251 N GLU A 79 -9.955 3.172 3.176 1.00 0.00 N ATOM 1252 CA GLU A 79 -9.948 1.981 4.018 1.00 0.00 C ATOM 1253 C GLU A 79 -10.228 0.729 3.194 1.00 0.00 C ATOM 1254 O GLU A 79 -11.332 0.544 2.681 1.00 0.00 O ATOM 1255 CB GLU A 79 -10.988 2.114 5.133 1.00 0.00 C ATOM 1256 CG GLU A 79 -10.684 1.259 6.353 1.00 0.00 C ATOM 1257 CD GLU A 79 -11.932 0.883 7.127 1.00 0.00 C ATOM 1258 OE1 GLU A 79 -12.794 0.181 6.557 1.00 0.00 O ATOM 1259 OE2 GLU A 79 -12.049 1.291 8.301 1.00 0.00 O ATOM 0 H GLU A 79 -10.803 3.735 3.248 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.957 1.887 4.462 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.050 3.159 5.438 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -11.967 1.838 4.741 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.170 0.351 6.037 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.002 1.799 7.010 1.00 0.00 H new ATOM 1266 N GLY A 80 -9.221 -0.129 3.069 1.00 0.00 N ATOM 1267 CA GLY A 80 -9.379 -1.353 2.307 1.00 0.00 C ATOM 1268 C GLY A 80 -8.980 -1.186 0.854 1.00 0.00 C ATOM 1269 O GLY A 80 -9.508 -1.869 -0.024 1.00 0.00 O ATOM 0 H GLY A 80 -8.298 0.002 3.482 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.774 -2.139 2.759 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.418 -1.679 2.360 1.00 0.00 H new ATOM 1273 N GLU A 81 -8.045 -0.276 0.600 1.00 0.00 N ATOM 1274 CA GLU A 81 -7.576 -0.021 -0.757 1.00 0.00 C ATOM 1275 C GLU A 81 -6.227 -0.692 -1.000 1.00 0.00 C ATOM 1276 O GLU A 81 -5.579 -1.163 -0.065 1.00 0.00 O ATOM 1277 CB GLU A 81 -7.467 1.485 -1.006 1.00 0.00 C ATOM 1278 CG GLU A 81 -8.575 2.037 -1.887 1.00 0.00 C ATOM 1279 CD GLU A 81 -8.418 1.638 -3.341 1.00 0.00 C ATOM 1280 OE1 GLU A 81 -7.731 2.367 -4.085 1.00 0.00 O ATOM 1281 OE2 GLU A 81 -8.983 0.596 -3.735 1.00 0.00 O ATOM 0 H GLU A 81 -7.598 0.297 1.316 1.00 0.00 H new ATOM 0 HA GLU A 81 -8.301 -0.444 -1.453 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.482 2.005 -0.048 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.504 1.699 -1.470 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.538 1.682 -1.519 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -8.586 3.124 -1.812 1.00 0.00 H new ATOM 1288 N SER A 82 -5.809 -0.730 -2.261 1.00 0.00 N ATOM 1289 CA SER A 82 -4.537 -1.341 -2.628 1.00 0.00 C ATOM 1290 C SER A 82 -3.745 -0.431 -3.559 1.00 0.00 C ATOM 1291 O SER A 82 -4.268 0.057 -4.562 1.00 0.00 O ATOM 1292 CB SER A 82 -4.773 -2.695 -3.297 1.00 0.00 C ATOM 1293 OG SER A 82 -5.996 -3.269 -2.873 1.00 0.00 O ATOM 0 H SER A 82 -6.333 -0.344 -3.046 1.00 0.00 H new ATOM 0 HA SER A 82 -3.957 -1.490 -1.717 1.00 0.00 H new ATOM 0 HB2 SER A 82 -4.782 -2.572 -4.380 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.950 -3.369 -3.060 1.00 0.00 H new ATOM 0 HG SER A 82 -6.123 -4.133 -3.317 1.00 0.00 H new ATOM 1299 N TYR A 83 -2.479 -0.206 -3.223 1.00 0.00 N ATOM 1300 CA TYR A 83 -1.613 0.647 -4.030 1.00 0.00 C ATOM 1301 C TYR A 83 -0.259 -0.016 -4.261 1.00 0.00 C ATOM 1302 O TYR A 83 0.185 -0.838 -3.460 1.00 0.00 O ATOM 1303 CB TYR A 83 -1.422 2.005 -3.353 1.00 0.00 C ATOM 1304 CG TYR A 83 -2.709 2.615 -2.845 1.00 0.00 C ATOM 1305 CD1 TYR A 83 -3.164 2.355 -1.559 1.00 0.00 C ATOM 1306 CD2 TYR A 83 -3.469 3.452 -3.653 1.00 0.00 C ATOM 1307 CE1 TYR A 83 -4.339 2.912 -1.092 1.00 0.00 C ATOM 1308 CE2 TYR A 83 -4.645 4.012 -3.193 1.00 0.00 C ATOM 1309 CZ TYR A 83 -5.076 3.739 -1.912 1.00 0.00 C ATOM 1310 OH TYR A 83 -6.247 4.295 -1.450 1.00 0.00 O ATOM 0 H TYR A 83 -2.030 -0.602 -2.398 1.00 0.00 H new ATOM 0 HA TYR A 83 -2.093 0.797 -4.997 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.730 1.891 -2.519 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.959 2.692 -4.061 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -2.590 1.707 -0.913 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -3.135 3.668 -4.657 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -4.678 2.700 -0.089 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -5.224 4.661 -3.834 1.00 0.00 H new ATOM 0 HH TYR A 83 -6.643 4.853 -2.151 1.00 0.00 H new ATOM 1320 N VAL A 84 0.392 0.350 -5.361 1.00 0.00 N ATOM 1321 CA VAL A 84 1.697 -0.208 -5.696 1.00 0.00 C ATOM 1322 C VAL A 84 2.801 0.828 -5.514 1.00 0.00 C ATOM 1323 O VAL A 84 2.914 1.772 -6.296 1.00 0.00 O ATOM 1324 CB VAL A 84 1.728 -0.726 -7.146 1.00 0.00 C ATOM 1325 CG1 VAL A 84 3.021 -1.480 -7.417 1.00 0.00 C ATOM 1326 CG2 VAL A 84 0.520 -1.606 -7.425 1.00 0.00 C ATOM 0 H VAL A 84 0.038 1.029 -6.034 1.00 0.00 H new ATOM 0 HA VAL A 84 1.870 -1.042 -5.015 1.00 0.00 H new ATOM 0 HB VAL A 84 1.687 0.131 -7.819 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.024 -1.838 -8.446 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.870 -0.814 -7.262 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.097 -2.329 -6.737 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.559 -1.962 -8.454 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.526 -2.458 -6.745 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.393 -1.029 -7.276 1.00 0.00 H new ATOM 1336 N CYS A 85 3.612 0.644 -4.478 1.00 0.00 N ATOM 1337 CA CYS A 85 4.707 1.564 -4.193 1.00 0.00 C ATOM 1338 C CYS A 85 5.755 1.522 -5.300 1.00 0.00 C ATOM 1339 O CYS A 85 6.207 0.449 -5.700 1.00 0.00 O ATOM 1340 CB CYS A 85 5.353 1.221 -2.850 1.00 0.00 C ATOM 1341 SG CYS A 85 4.342 1.650 -1.414 1.00 0.00 S ATOM 0 H CYS A 85 3.532 -0.133 -3.822 1.00 0.00 H new ATOM 0 HA CYS A 85 4.297 2.573 -4.144 1.00 0.00 H new ATOM 0 HB2 CYS A 85 5.567 0.153 -2.824 1.00 0.00 H new ATOM 0 HB3 CYS A 85 6.309 1.739 -2.776 1.00 0.00 H new ATOM 0 HG CYS A 85 3.086 1.480 -1.701 1.00 0.00 H new ATOM 1347 N GLY A 86 6.137 2.697 -5.792 1.00 0.00 N ATOM 1348 CA GLY A 86 7.129 2.772 -6.849 1.00 0.00 C ATOM 1349 C GLY A 86 8.237 3.758 -6.534 1.00 0.00 C ATOM 1350 O GLY A 86 8.534 4.016 -5.368 1.00 0.00 O ATOM 0 H GLY A 86 5.777 3.598 -5.477 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.561 1.784 -7.009 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.642 3.062 -7.780 1.00 0.00 H new ATOM 1354 N SER A 87 8.849 4.309 -7.576 1.00 0.00 N ATOM 1355 CA SER A 87 9.931 5.272 -7.405 1.00 0.00 C ATOM 1356 C SER A 87 10.272 5.951 -8.727 1.00 0.00 C ATOM 1357 O SER A 87 9.913 7.107 -8.954 1.00 0.00 O ATOM 1358 CB SER A 87 11.173 4.580 -6.838 1.00 0.00 C ATOM 1359 OG SER A 87 12.309 5.423 -6.921 1.00 0.00 O ATOM 0 H SER A 87 8.615 4.106 -8.548 1.00 0.00 H new ATOM 0 HA SER A 87 9.596 6.035 -6.703 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.996 4.304 -5.798 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.361 3.657 -7.386 1.00 0.00 H new ATOM 0 HG SER A 87 13.089 4.959 -6.551 1.00 0.00 H new ATOM 1365 N ILE A 88 10.967 5.226 -9.598 1.00 0.00 N ATOM 1366 CA ILE A 88 11.356 5.760 -10.899 1.00 0.00 C ATOM 1367 C ILE A 88 10.893 4.850 -12.032 1.00 0.00 C ATOM 1368 O ILE A 88 10.439 5.323 -13.074 1.00 0.00 O ATOM 1369 CB ILE A 88 12.882 5.950 -10.997 1.00 0.00 C ATOM 1370 CG1 ILE A 88 13.603 4.616 -10.791 1.00 0.00 C ATOM 1371 CG2 ILE A 88 13.354 6.975 -9.976 1.00 0.00 C ATOM 1372 CD1 ILE A 88 13.832 3.850 -12.074 1.00 0.00 C ATOM 0 H ILE A 88 11.272 4.268 -9.427 1.00 0.00 H new ATOM 0 HA ILE A 88 10.870 6.731 -10.997 1.00 0.00 H new ATOM 0 HB ILE A 88 13.122 6.319 -11.994 1.00 0.00 H new ATOM 0 HG12 ILE A 88 14.564 4.802 -10.312 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.020 3.999 -10.108 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.434 7.099 -10.057 1.00 0.00 H new ATOM 0 HG22 ILE A 88 12.864 7.930 -10.166 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.102 6.632 -8.973 1.00 0.00 H new ATOM 0 HD11 ILE A 88 14.347 2.915 -11.853 1.00 0.00 H new ATOM 0 HD12 ILE A 88 12.873 3.633 -12.544 1.00 0.00 H new ATOM 0 HD13 ILE A 88 14.441 4.449 -12.751 1.00 0.00 H new ATOM 1384 N GLU A 89 11.012 3.542 -11.824 1.00 0.00 N ATOM 1385 CA GLU A 89 10.606 2.567 -12.832 1.00 0.00 C ATOM 1386 C GLU A 89 9.143 2.760 -13.224 1.00 0.00 C ATOM 1387 O GLU A 89 8.348 3.286 -12.444 1.00 0.00 O ATOM 1388 CB GLU A 89 10.822 1.145 -12.309 1.00 0.00 C ATOM 1389 CG GLU A 89 10.077 0.853 -11.017 1.00 0.00 C ATOM 1390 CD GLU A 89 10.967 0.960 -9.794 1.00 0.00 C ATOM 1391 OE1 GLU A 89 12.182 0.692 -9.918 1.00 0.00 O ATOM 1392 OE2 GLU A 89 10.452 1.311 -8.713 1.00 0.00 O ATOM 0 H GLU A 89 11.386 3.133 -10.968 1.00 0.00 H new ATOM 0 HA GLU A 89 11.222 2.721 -13.718 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.503 0.434 -13.071 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.888 0.984 -12.149 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.244 1.548 -10.917 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.652 -0.149 -11.066 1.00 0.00 H new ATOM 1399 N PRO A 90 8.768 2.337 -14.443 1.00 0.00 N ATOM 1400 CA PRO A 90 7.393 2.466 -14.934 1.00 0.00 C ATOM 1401 C PRO A 90 6.422 1.559 -14.186 1.00 0.00 C ATOM 1402 O PRO A 90 6.833 0.607 -13.523 1.00 0.00 O ATOM 1403 CB PRO A 90 7.496 2.043 -16.403 1.00 0.00 C ATOM 1404 CG PRO A 90 8.694 1.162 -16.460 1.00 0.00 C ATOM 1405 CD PRO A 90 9.652 1.699 -15.435 1.00 0.00 C ATOM 0 HA PRO A 90 7.005 3.475 -14.794 1.00 0.00 H new ATOM 0 HB2 PRO A 90 6.600 1.514 -16.726 1.00 0.00 H new ATOM 0 HB3 PRO A 90 7.609 2.908 -17.057 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.428 0.128 -16.242 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.140 1.174 -17.455 1.00 0.00 H new ATOM 0 HD2 PRO A 90 10.250 0.904 -14.988 1.00 0.00 H new ATOM 0 HD3 PRO A 90 10.348 2.415 -15.872 1.00 0.00 H new ATOM 1413 N PHE A 91 5.133 1.861 -14.295 1.00 0.00 N ATOM 1414 CA PHE A 91 4.103 1.074 -13.629 1.00 0.00 C ATOM 1415 C PHE A 91 3.856 -0.237 -14.367 1.00 0.00 C ATOM 1416 O PHE A 91 3.514 -0.241 -15.550 1.00 0.00 O ATOM 1417 CB PHE A 91 2.802 1.872 -13.535 1.00 0.00 C ATOM 1418 CG PHE A 91 1.716 1.165 -12.777 1.00 0.00 C ATOM 1419 CD1 PHE A 91 1.038 0.098 -13.344 1.00 0.00 C ATOM 1420 CD2 PHE A 91 1.373 1.565 -11.495 1.00 0.00 C ATOM 1421 CE1 PHE A 91 0.038 -0.555 -12.649 1.00 0.00 C ATOM 1422 CE2 PHE A 91 0.374 0.917 -10.795 1.00 0.00 C ATOM 1423 CZ PHE A 91 -0.295 -0.145 -11.373 1.00 0.00 C ATOM 0 H PHE A 91 4.777 2.647 -14.839 1.00 0.00 H new ATOM 0 HA PHE A 91 4.453 0.843 -12.623 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.006 2.828 -13.053 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.447 2.092 -14.542 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.294 -0.227 -14.341 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.893 2.394 -11.038 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.483 -1.385 -13.103 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.116 1.240 -9.797 1.00 0.00 H new ATOM 0 HZ PHE A 91 -1.077 -0.653 -10.828 1.00 0.00 H new ATOM 1433 N LYS A 92 4.031 -1.350 -13.662 1.00 0.00 N ATOM 1434 CA LYS A 92 3.826 -2.668 -14.250 1.00 0.00 C ATOM 1435 C LYS A 92 2.489 -3.257 -13.813 1.00 0.00 C ATOM 1436 O LYS A 92 2.232 -3.421 -12.620 1.00 0.00 O ATOM 1437 CB LYS A 92 4.965 -3.610 -13.853 1.00 0.00 C ATOM 1438 CG LYS A 92 6.132 -3.596 -14.827 1.00 0.00 C ATOM 1439 CD LYS A 92 7.458 -3.780 -14.109 1.00 0.00 C ATOM 1440 CE LYS A 92 8.633 -3.460 -15.018 1.00 0.00 C ATOM 1441 NZ LYS A 92 8.571 -4.222 -16.296 1.00 0.00 N ATOM 0 H LYS A 92 4.314 -1.365 -12.682 1.00 0.00 H new ATOM 0 HA LYS A 92 3.817 -2.557 -15.334 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.326 -3.333 -12.862 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.576 -4.626 -13.779 1.00 0.00 H new ATOM 0 HG2 LYS A 92 6.002 -4.389 -15.563 1.00 0.00 H new ATOM 0 HG3 LYS A 92 6.140 -2.653 -15.373 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.490 -3.135 -13.231 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.541 -4.807 -13.753 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.645 -2.391 -15.233 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.565 -3.692 -14.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.473 -4.122 -16.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.398 -5.227 -16.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 7.799 -3.850 -16.885 1.00 0.00 H new ATOM 1455 N LYS A 93 1.640 -3.572 -14.785 1.00 0.00 N ATOM 1456 CA LYS A 93 0.328 -4.142 -14.500 1.00 0.00 C ATOM 1457 C LYS A 93 0.436 -5.636 -14.213 1.00 0.00 C ATOM 1458 O LYS A 93 0.633 -6.441 -15.123 1.00 0.00 O ATOM 1459 CB LYS A 93 -0.624 -3.899 -15.675 1.00 0.00 C ATOM 1460 CG LYS A 93 -1.837 -3.059 -15.310 1.00 0.00 C ATOM 1461 CD LYS A 93 -2.699 -2.767 -16.527 1.00 0.00 C ATOM 1462 CE LYS A 93 -3.932 -3.655 -16.564 1.00 0.00 C ATOM 1463 NZ LYS A 93 -5.021 -3.062 -17.386 1.00 0.00 N ATOM 0 H LYS A 93 1.837 -3.442 -15.777 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.071 -3.650 -13.613 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.078 -3.404 -16.478 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.961 -4.860 -16.064 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.430 -3.582 -14.560 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.510 -2.121 -14.861 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -3.004 -1.720 -16.515 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.113 -2.919 -17.434 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.664 -4.631 -16.968 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.292 -3.818 -15.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.843 -3.699 -17.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.296 -2.142 -16.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.687 -2.930 -18.362 1.00 0.00 H new ATOM 1477 N LEU A 94 0.306 -6.000 -12.941 1.00 0.00 N ATOM 1478 CA LEU A 94 0.389 -7.398 -12.534 1.00 0.00 C ATOM 1479 C LEU A 94 -0.742 -7.753 -11.574 1.00 0.00 C ATOM 1480 O LEU A 94 -1.134 -6.943 -10.733 1.00 0.00 O ATOM 1481 CB LEU A 94 1.740 -7.680 -11.875 1.00 0.00 C ATOM 1482 CG LEU A 94 2.938 -7.673 -12.827 1.00 0.00 C ATOM 1483 CD1 LEU A 94 4.220 -7.992 -12.073 1.00 0.00 C ATOM 1484 CD2 LEU A 94 2.722 -8.664 -13.961 1.00 0.00 C ATOM 0 H LEU A 94 0.143 -5.347 -12.175 1.00 0.00 H new ATOM 0 HA LEU A 94 0.292 -8.016 -13.426 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.910 -6.936 -11.096 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.692 -8.651 -11.383 1.00 0.00 H new ATOM 0 HG LEU A 94 3.033 -6.676 -13.256 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.061 -7.983 -12.766 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.381 -7.244 -11.296 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.137 -8.978 -11.616 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.583 -8.646 -14.629 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.602 -9.666 -13.550 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.826 -8.390 -14.518 1.00 0.00 H new ATOM 1496 N GLU A 95 -1.263 -8.968 -11.705 1.00 0.00 N ATOM 1497 CA GLU A 95 -2.349 -9.430 -10.849 1.00 0.00 C ATOM 1498 C GLU A 95 -1.837 -9.768 -9.453 1.00 0.00 C ATOM 1499 O GLU A 95 -1.355 -10.874 -9.208 1.00 0.00 O ATOM 1500 CB GLU A 95 -3.027 -10.655 -11.466 1.00 0.00 C ATOM 1501 CG GLU A 95 -4.515 -10.740 -11.170 1.00 0.00 C ATOM 1502 CD GLU A 95 -5.331 -9.768 -12.001 1.00 0.00 C ATOM 1503 OE1 GLU A 95 -4.975 -8.570 -12.030 1.00 0.00 O ATOM 1504 OE2 GLU A 95 -6.325 -10.203 -12.619 1.00 0.00 O ATOM 0 H GLU A 95 -0.951 -9.651 -12.396 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.078 -8.624 -10.763 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.880 -10.636 -12.546 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.539 -11.556 -11.094 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.862 -11.756 -11.360 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.683 -10.538 -10.112 1.00 0.00 H new ATOM 1511 N TYR A 96 -1.947 -8.809 -8.540 1.00 0.00 N ATOM 1512 CA TYR A 96 -1.496 -9.004 -7.167 1.00 0.00 C ATOM 1513 C TYR A 96 -2.601 -9.620 -6.315 1.00 0.00 C ATOM 1514 O TYR A 96 -2.355 -10.533 -5.527 1.00 0.00 O ATOM 1515 CB TYR A 96 -1.050 -7.673 -6.559 1.00 0.00 C ATOM 1516 CG TYR A 96 0.124 -7.043 -7.275 1.00 0.00 C ATOM 1517 CD1 TYR A 96 1.430 -7.361 -6.923 1.00 0.00 C ATOM 1518 CD2 TYR A 96 -0.073 -6.130 -8.304 1.00 0.00 C ATOM 1519 CE1 TYR A 96 2.505 -6.787 -7.575 1.00 0.00 C ATOM 1520 CE2 TYR A 96 0.996 -5.552 -8.960 1.00 0.00 C ATOM 1521 CZ TYR A 96 2.283 -5.883 -8.592 1.00 0.00 C ATOM 1522 OH TYR A 96 3.351 -5.310 -9.244 1.00 0.00 O ATOM 0 H TYR A 96 -2.345 -7.888 -8.726 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.648 -9.689 -7.184 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -1.889 -6.977 -6.573 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -0.785 -7.831 -5.514 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.608 -8.068 -6.127 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -1.079 -5.868 -8.596 1.00 0.00 H new ATOM 0 HE1 TYR A 96 3.514 -7.045 -7.289 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.825 -4.844 -9.757 1.00 0.00 H new ATOM 0 HH TYR A 96 4.061 -5.113 -8.598 1.00 0.00 H new ATOM 1532 N THR A 97 -3.818 -9.114 -6.480 1.00 0.00 N ATOM 1533 CA THR A 97 -4.964 -9.612 -5.727 1.00 0.00 C ATOM 1534 C THR A 97 -5.192 -11.099 -5.995 1.00 0.00 C ATOM 1535 O THR A 97 -5.819 -11.792 -5.194 1.00 0.00 O ATOM 1536 CB THR A 97 -6.221 -8.820 -6.088 1.00 0.00 C ATOM 1537 OG1 THR A 97 -6.153 -8.352 -7.423 1.00 0.00 O ATOM 1538 CG2 THR A 97 -6.449 -7.620 -5.192 1.00 0.00 C ATOM 0 H THR A 97 -4.037 -8.358 -7.129 1.00 0.00 H new ATOM 0 HA THR A 97 -4.751 -9.482 -4.666 1.00 0.00 H new ATOM 0 HB THR A 97 -7.049 -9.516 -5.956 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.763 -7.453 -7.435 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.357 -7.102 -5.502 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.555 -7.952 -4.159 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.600 -6.941 -5.270 1.00 0.00 H new ATOM 1546 N LYS A 98 -4.682 -11.582 -7.125 1.00 0.00 N ATOM 1547 CA LYS A 98 -4.834 -12.985 -7.496 1.00 0.00 C ATOM 1548 C LYS A 98 -4.347 -13.904 -6.378 1.00 0.00 C ATOM 1549 O LYS A 98 -4.970 -14.925 -6.085 1.00 0.00 O ATOM 1550 CB LYS A 98 -4.065 -13.278 -8.786 1.00 0.00 C ATOM 1551 CG LYS A 98 -4.811 -14.193 -9.745 1.00 0.00 C ATOM 1552 CD LYS A 98 -4.364 -15.638 -9.598 1.00 0.00 C ATOM 1553 CE LYS A 98 -5.532 -16.600 -9.750 1.00 0.00 C ATOM 1554 NZ LYS A 98 -5.321 -17.856 -8.977 1.00 0.00 N ATOM 0 H LYS A 98 -4.160 -11.022 -7.799 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.894 -13.178 -7.660 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.847 -12.337 -9.291 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -3.108 -13.734 -8.533 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.882 -14.122 -9.558 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.644 -13.862 -10.770 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -3.605 -15.864 -10.348 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -3.900 -15.779 -8.622 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -6.448 -16.115 -9.412 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -5.669 -16.841 -10.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -6.139 -18.485 -9.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -4.461 -18.332 -9.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -5.216 -17.629 -7.968 1.00 0.00 H new ATOM 1568 N ASN A 99 -3.231 -13.535 -5.758 1.00 0.00 N ATOM 1569 CA ASN A 99 -2.662 -14.325 -4.673 1.00 0.00 C ATOM 1570 C ASN A 99 -2.888 -13.644 -3.327 1.00 0.00 C ATOM 1571 O ASN A 99 -2.083 -13.784 -2.406 1.00 0.00 O ATOM 1572 CB ASN A 99 -1.166 -14.544 -4.902 1.00 0.00 C ATOM 1573 CG ASN A 99 -0.440 -13.260 -5.253 1.00 0.00 C ATOM 1574 OD1 ASN A 99 -0.323 -12.355 -4.426 1.00 0.00 O ATOM 1575 ND2 ASN A 99 0.051 -13.173 -6.484 1.00 0.00 N ATOM 0 H ASN A 99 -2.703 -12.693 -5.989 1.00 0.00 H new ATOM 0 HA ASN A 99 -3.165 -15.292 -4.660 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.723 -14.975 -4.004 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -1.026 -15.268 -5.705 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.548 -12.332 -6.776 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -0.069 -13.947 -7.137 1.00 0.00 H new ATOM 1582 N VAL A 100 -3.989 -12.907 -3.219 1.00 0.00 N ATOM 1583 CA VAL A 100 -4.322 -12.205 -1.986 1.00 0.00 C ATOM 1584 C VAL A 100 -5.819 -12.274 -1.702 1.00 0.00 C ATOM 1585 O VAL A 100 -6.626 -11.706 -2.437 1.00 0.00 O ATOM 1586 CB VAL A 100 -3.890 -10.727 -2.046 1.00 0.00 C ATOM 1587 CG1 VAL A 100 -4.072 -10.060 -0.691 1.00 0.00 C ATOM 1588 CG2 VAL A 100 -2.448 -10.611 -2.517 1.00 0.00 C ATOM 0 H VAL A 100 -4.666 -12.781 -3.972 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.778 -12.702 -1.182 1.00 0.00 H new ATOM 0 HB VAL A 100 -4.526 -10.211 -2.766 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.761 -9.017 -0.754 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -5.121 -10.109 -0.399 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.464 -10.575 0.053 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -2.160 -9.560 -2.553 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.795 -11.142 -1.824 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.354 -11.047 -3.511 1.00 0.00 H new ATOM 1598 N ASN A 101 -6.181 -12.974 -0.632 1.00 0.00 N ATOM 1599 CA ASN A 101 -7.581 -13.121 -0.250 1.00 0.00 C ATOM 1600 C ASN A 101 -8.156 -11.794 0.245 1.00 0.00 C ATOM 1601 O ASN A 101 -7.774 -11.305 1.308 1.00 0.00 O ATOM 1602 CB ASN A 101 -7.722 -14.184 0.841 1.00 0.00 C ATOM 1603 CG ASN A 101 -9.111 -14.789 0.884 1.00 0.00 C ATOM 1604 OD1 ASN A 101 -9.336 -15.893 0.388 1.00 0.00 O ATOM 1605 ND2 ASN A 101 -10.053 -14.066 1.478 1.00 0.00 N ATOM 0 H ASN A 101 -5.524 -13.449 -0.013 1.00 0.00 H new ATOM 0 HA ASN A 101 -8.140 -13.433 -1.132 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -6.990 -14.974 0.671 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -7.493 -13.739 1.809 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -11.007 -14.421 1.536 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -9.822 -13.156 1.876 1.00 0.00 H new ATOM 1612 N PRO A 102 -9.084 -11.187 -0.521 1.00 0.00 N ATOM 1613 CA PRO A 102 -9.704 -9.911 -0.145 1.00 0.00 C ATOM 1614 C PRO A 102 -10.519 -10.022 1.140 1.00 0.00 C ATOM 1615 O PRO A 102 -11.749 -10.075 1.106 1.00 0.00 O ATOM 1616 CB PRO A 102 -10.619 -9.580 -1.334 1.00 0.00 C ATOM 1617 CG PRO A 102 -10.144 -10.448 -2.449 1.00 0.00 C ATOM 1618 CD PRO A 102 -9.602 -11.688 -1.803 1.00 0.00 C ATOM 0 HA PRO A 102 -8.956 -9.143 0.054 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.663 -9.782 -1.095 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -10.552 -8.525 -1.600 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.959 -10.688 -3.132 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -9.375 -9.945 -3.035 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -10.377 -12.441 -1.660 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -8.818 -12.148 -2.404 1.00 0.00 H new ATOM 1626 N ASN A 103 -9.827 -10.057 2.274 1.00 0.00 N ATOM 1627 CA ASN A 103 -10.487 -10.162 3.570 1.00 0.00 C ATOM 1628 C ASN A 103 -9.562 -9.701 4.693 1.00 0.00 C ATOM 1629 O ASN A 103 -9.184 -10.484 5.563 1.00 0.00 O ATOM 1630 CB ASN A 103 -10.939 -11.602 3.821 1.00 0.00 C ATOM 1631 CG ASN A 103 -11.834 -11.724 5.039 1.00 0.00 C ATOM 1632 OD1 ASN A 103 -11.486 -12.389 6.014 1.00 0.00 O ATOM 1633 ND2 ASN A 103 -12.995 -11.081 4.987 1.00 0.00 N ATOM 0 H ASN A 103 -8.809 -10.014 2.322 1.00 0.00 H new ATOM 0 HA ASN A 103 -11.362 -9.512 3.557 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -11.471 -11.971 2.944 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -10.063 -12.237 3.952 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -13.639 -11.127 5.776 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -13.242 -10.541 4.158 1.00 0.00 H new ATOM 1640 N TRP A 104 -9.201 -8.422 4.665 1.00 0.00 N ATOM 1641 CA TRP A 104 -8.320 -7.854 5.679 1.00 0.00 C ATOM 1642 C TRP A 104 -8.914 -6.574 6.261 1.00 0.00 C ATOM 1643 O TRP A 104 -8.905 -6.372 7.476 1.00 0.00 O ATOM 1644 CB TRP A 104 -6.941 -7.564 5.083 1.00 0.00 C ATOM 1645 CG TRP A 104 -7.000 -6.812 3.789 1.00 0.00 C ATOM 1646 CD1 TRP A 104 -7.508 -7.258 2.603 1.00 0.00 C ATOM 1647 CD2 TRP A 104 -6.533 -5.479 3.550 1.00 0.00 C ATOM 1648 NE1 TRP A 104 -7.385 -6.284 1.642 1.00 0.00 N ATOM 1649 CE2 TRP A 104 -6.790 -5.183 2.199 1.00 0.00 C ATOM 1650 CE3 TRP A 104 -5.922 -4.507 4.350 1.00 0.00 C ATOM 1651 CZ2 TRP A 104 -6.458 -3.956 1.629 1.00 0.00 C ATOM 1652 CZ3 TRP A 104 -5.594 -3.291 3.783 1.00 0.00 C ATOM 1653 CH2 TRP A 104 -5.862 -3.024 2.434 1.00 0.00 C ATOM 0 H TRP A 104 -9.505 -7.760 3.951 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.215 -8.583 6.482 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -6.356 -6.991 5.802 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -6.416 -8.506 4.924 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.943 -8.234 2.444 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -7.688 -6.367 0.671 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -5.711 -4.704 5.391 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -6.664 -3.748 0.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -5.123 -2.533 4.390 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -5.593 -2.063 2.021 1.00 0.00 H new ATOM 1664 N SER A 105 -9.429 -5.716 5.388 1.00 0.00 N ATOM 1665 CA SER A 105 -10.028 -4.457 5.816 1.00 0.00 C ATOM 1666 C SER A 105 -11.547 -4.576 5.899 1.00 0.00 C ATOM 1667 O SER A 105 -12.267 -3.600 5.692 1.00 0.00 O ATOM 1668 CB SER A 105 -9.646 -3.333 4.851 1.00 0.00 C ATOM 1669 OG SER A 105 -8.266 -3.025 4.947 1.00 0.00 O ATOM 0 H SER A 105 -9.444 -5.869 4.380 1.00 0.00 H new ATOM 0 HA SER A 105 -9.645 -4.221 6.809 1.00 0.00 H new ATOM 0 HB2 SER A 105 -9.885 -3.629 3.830 1.00 0.00 H new ATOM 0 HB3 SER A 105 -10.236 -2.444 5.072 1.00 0.00 H new ATOM 0 HG SER A 105 -7.764 -3.567 4.303 1.00 0.00 H new