USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=25 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 30:sc= 0.0896 USER MOD Set 1.2: A 48 THR OG1 : rot -161:sc= -0.344 USER MOD Single : A 11 LYS NZ :NH3+ 162:sc= 0.0594 (180deg=-0.07) USER MOD Single : A 12 LYS NZ :NH3+ -152:sc= 0.112 (180deg=0.0266) USER MOD Single : A 16 TYR OH : rot 50:sc= -2.01! USER MOD Single : A 18 ASN : amide:sc= -0.389 K(o=-0.39,f=-4.3!) 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= -0.0235 USER MOD Single : A 37 SER OG : rot 35:sc= 0.106 USER MOD Single : A 46 THR OG1 : rot 101:sc= 0.436 USER MOD Single : A 50 SER OG : rot -51:sc= 0.577 USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 ASN : amide:sc= -0.473 K(o=-0.47,f=-1.8!) USER MOD Single : A 57 GLN : amide:sc= -0.342 X(o=-0.34,f=-0.091) 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 180:sc= 0.0963 USER MOD Single : A 69 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.377) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot -52:sc= 0.392 USER MOD Single : A 73 SER OG : rot -39:sc= 0.478 USER MOD Single : A 76 GLN : amide:sc= -0.0517 X(o=-0.052,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 CYS SG : rot -170:sc= -2.49! USER MOD Single : A 87 SER OG : rot -70:sc= -0.481 USER MOD Single : A 92 LYS NZ :NH3+ 150:sc= -1.01 (180deg=-1.1) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot -35:sc= 0.0873 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 158:sc=-0.00795 (180deg=-0.368) USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 ASN : amide:sc= -0.913 K(o=-0.91,f=-3.4!) USER MOD Single : A 103 ASN : amide:sc= 0.171 X(o=0.17,f=0) USER MOD Single : A 105 SER OG : rot -50:sc= -0.552 USER MOD ----------------------------------------------------------------- ATOM 112 N ALA A 10 -8.109 3.818 11.874 1.00 0.00 N ATOM 113 CA ALA A 10 -6.988 3.980 10.957 1.00 0.00 C ATOM 114 C ALA A 10 -7.325 3.428 9.575 1.00 0.00 C ATOM 115 O ALA A 10 -7.818 2.308 9.447 1.00 0.00 O ATOM 116 CB ALA A 10 -5.749 3.293 11.515 1.00 0.00 C ATOM 0 HA ALA A 10 -6.785 5.046 10.853 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -4.918 3.421 10.821 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.490 3.735 12.477 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -5.951 2.230 11.647 1.00 0.00 H new ATOM 122 N LYS A 11 -7.055 4.224 8.545 1.00 0.00 N ATOM 123 CA LYS A 11 -7.330 3.815 7.173 1.00 0.00 C ATOM 124 C LYS A 11 -6.462 2.625 6.774 1.00 0.00 C ATOM 125 O LYS A 11 -5.246 2.750 6.635 1.00 0.00 O ATOM 126 CB LYS A 11 -7.091 4.985 6.213 1.00 0.00 C ATOM 127 CG LYS A 11 -8.359 5.494 5.547 1.00 0.00 C ATOM 128 CD LYS A 11 -8.439 7.012 5.583 1.00 0.00 C ATOM 129 CE LYS A 11 -7.318 7.647 4.778 1.00 0.00 C ATOM 130 NZ LYS A 11 -7.397 9.135 4.792 1.00 0.00 N ATOM 0 H LYS A 11 -6.647 5.154 8.635 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.375 3.512 7.112 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.624 5.804 6.760 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.386 4.674 5.443 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.390 5.152 4.513 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.229 5.071 6.049 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.401 7.336 5.187 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.387 7.356 6.616 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.357 7.331 5.183 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.363 7.291 3.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.480 9.534 4.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -8.133 9.450 4.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.633 9.461 5.751 1.00 0.00 H new ATOM 144 N LYS A 12 -7.097 1.471 6.595 1.00 0.00 N ATOM 145 CA LYS A 12 -6.383 0.257 6.213 1.00 0.00 C ATOM 146 C LYS A 12 -6.002 0.291 4.737 1.00 0.00 C ATOM 147 O LYS A 12 -6.803 -0.058 3.869 1.00 0.00 O ATOM 148 CB LYS A 12 -7.241 -0.976 6.502 1.00 0.00 C ATOM 149 CG LYS A 12 -7.154 -1.453 7.943 1.00 0.00 C ATOM 150 CD LYS A 12 -5.763 -1.967 8.276 1.00 0.00 C ATOM 151 CE LYS A 12 -5.752 -2.737 9.586 1.00 0.00 C ATOM 152 NZ LYS A 12 -6.237 -4.134 9.414 1.00 0.00 N ATOM 0 H LYS A 12 -8.104 1.351 6.708 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.469 0.202 6.804 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -8.280 -0.749 6.265 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.933 -1.786 5.841 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -7.411 -0.634 8.615 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -7.885 -2.244 8.110 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -5.410 -2.612 7.471 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.070 -1.128 8.340 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.740 -2.752 9.990 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -6.379 -2.222 10.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -6.660 -4.467 10.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -6.951 -4.163 8.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -5.439 -4.750 9.159 1.00 0.00 H new ATOM 166 N VAL A 13 -4.773 0.712 4.458 1.00 0.00 N ATOM 167 CA VAL A 13 -4.284 0.791 3.086 1.00 0.00 C ATOM 168 C VAL A 13 -3.200 -0.250 2.829 1.00 0.00 C ATOM 169 O VAL A 13 -2.382 -0.539 3.702 1.00 0.00 O ATOM 170 CB VAL A 13 -3.720 2.189 2.771 1.00 0.00 C ATOM 171 CG1 VAL A 13 -4.849 3.193 2.593 1.00 0.00 C ATOM 172 CG2 VAL A 13 -2.763 2.639 3.864 1.00 0.00 C ATOM 0 H VAL A 13 -4.097 1.004 5.164 1.00 0.00 H new ATOM 0 HA VAL A 13 -5.136 0.595 2.435 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.164 2.133 1.835 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.431 4.175 2.371 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.490 2.877 1.770 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -5.436 3.247 3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.375 3.629 3.623 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -3.291 2.678 4.817 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.936 1.933 3.937 1.00 0.00 H new ATOM 182 N ARG A 14 -3.199 -0.810 1.623 1.00 0.00 N ATOM 183 CA ARG A 14 -2.215 -1.819 1.250 1.00 0.00 C ATOM 184 C ARG A 14 -1.171 -1.236 0.304 1.00 0.00 C ATOM 185 O ARG A 14 -1.468 -0.348 -0.494 1.00 0.00 O ATOM 186 CB ARG A 14 -2.905 -3.016 0.593 1.00 0.00 C ATOM 187 CG ARG A 14 -2.292 -4.354 0.970 1.00 0.00 C ATOM 188 CD ARG A 14 -3.356 -5.428 1.141 1.00 0.00 C ATOM 189 NE ARG A 14 -2.771 -6.754 1.330 1.00 0.00 N ATOM 190 CZ ARG A 14 -3.432 -7.789 1.843 1.00 0.00 C ATOM 191 NH1 ARG A 14 -4.697 -7.655 2.222 1.00 0.00 N ATOM 192 NH2 ARG A 14 -2.826 -8.960 1.978 1.00 0.00 N ATOM 0 H ARG A 14 -3.869 -0.582 0.888 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.711 -2.153 2.157 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.958 -3.016 0.874 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.864 -2.899 -0.490 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.585 -4.661 0.200 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -1.728 -4.249 1.897 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.984 -5.183 1.998 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -4.004 -5.439 0.264 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.800 -6.894 1.053 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -5.167 -6.756 2.121 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -5.199 -8.452 2.615 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -1.854 -9.067 1.689 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -3.332 -9.754 2.371 1.00 0.00 H new ATOM 206 N PHE A 15 0.055 -1.742 0.400 1.00 0.00 N ATOM 207 CA PHE A 15 1.143 -1.271 -0.448 1.00 0.00 C ATOM 208 C PHE A 15 1.962 -2.443 -0.981 1.00 0.00 C ATOM 209 O PHE A 15 2.535 -3.214 -0.212 1.00 0.00 O ATOM 210 CB PHE A 15 2.047 -0.314 0.332 1.00 0.00 C ATOM 211 CG PHE A 15 1.434 1.037 0.562 1.00 0.00 C ATOM 212 CD1 PHE A 15 1.241 1.913 -0.495 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.050 1.431 1.833 1.00 0.00 C ATOM 214 CE1 PHE A 15 0.676 3.158 -0.286 1.00 0.00 C ATOM 215 CE2 PHE A 15 0.485 2.675 2.048 1.00 0.00 C ATOM 216 CZ PHE A 15 0.298 3.539 0.986 1.00 0.00 C ATOM 0 H PHE A 15 0.319 -2.477 1.056 1.00 0.00 H new ATOM 0 HA PHE A 15 0.708 -0.740 -1.295 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.291 -0.762 1.295 1.00 0.00 H new ATOM 0 HB3 PHE A 15 2.985 -0.191 -0.209 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.535 1.620 -1.492 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.193 0.759 2.666 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.531 3.832 -1.117 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.191 2.971 3.044 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.143 4.511 1.151 1.00 0.00 H new ATOM 226 N TYR A 16 2.014 -2.568 -2.303 1.00 0.00 N ATOM 227 CA TYR A 16 2.762 -3.643 -2.941 1.00 0.00 C ATOM 228 C TYR A 16 4.065 -3.120 -3.538 1.00 0.00 C ATOM 229 O TYR A 16 4.310 -1.914 -3.557 1.00 0.00 O ATOM 230 CB TYR A 16 1.918 -4.307 -4.031 1.00 0.00 C ATOM 231 CG TYR A 16 0.713 -5.050 -3.498 1.00 0.00 C ATOM 232 CD1 TYR A 16 -0.493 -4.395 -3.288 1.00 0.00 C ATOM 233 CD2 TYR A 16 0.784 -6.406 -3.207 1.00 0.00 C ATOM 234 CE1 TYR A 16 -1.597 -5.070 -2.802 1.00 0.00 C ATOM 235 CE2 TYR A 16 -0.315 -7.089 -2.721 1.00 0.00 C ATOM 236 CZ TYR A 16 -1.502 -6.417 -2.520 1.00 0.00 C ATOM 237 OH TYR A 16 -2.598 -7.093 -2.037 1.00 0.00 O ATOM 0 H TYR A 16 1.546 -1.937 -2.953 1.00 0.00 H new ATOM 0 HA TYR A 16 3.004 -4.384 -2.179 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.582 -3.544 -4.733 1.00 0.00 H new ATOM 0 HB3 TYR A 16 2.544 -5.002 -4.590 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -0.570 -3.340 -3.508 1.00 0.00 H new ATOM 0 HD2 TYR A 16 1.712 -6.935 -3.363 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.528 -4.546 -2.644 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -0.244 -8.144 -2.500 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.375 -6.905 -2.604 1.00 0.00 H new ATOM 247 N ARG A 17 4.896 -4.034 -4.026 1.00 0.00 N ATOM 248 CA ARG A 17 6.173 -3.665 -4.623 1.00 0.00 C ATOM 249 C ARG A 17 6.111 -3.766 -6.144 1.00 0.00 C ATOM 250 O ARG A 17 5.548 -4.713 -6.692 1.00 0.00 O ATOM 251 CB ARG A 17 7.291 -4.558 -4.083 1.00 0.00 C ATOM 252 CG ARG A 17 8.484 -3.783 -3.549 1.00 0.00 C ATOM 253 CD ARG A 17 9.734 -4.647 -3.501 1.00 0.00 C ATOM 254 NE ARG A 17 9.628 -5.706 -2.500 1.00 0.00 N ATOM 255 CZ ARG A 17 10.674 -6.359 -2.000 1.00 0.00 C ATOM 256 NH1 ARG A 17 11.905 -6.065 -2.403 1.00 0.00 N ATOM 257 NH2 ARG A 17 10.490 -7.310 -1.094 1.00 0.00 N ATOM 0 H ARG A 17 4.708 -5.036 -4.020 1.00 0.00 H new ATOM 0 HA ARG A 17 6.386 -2.630 -4.355 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.891 -5.186 -3.287 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.627 -5.225 -4.877 1.00 0.00 H new ATOM 0 HG2 ARG A 17 8.666 -2.913 -4.180 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.259 -3.411 -2.550 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.906 -5.091 -4.482 1.00 0.00 H new ATOM 0 HD3 ARG A 17 10.599 -4.022 -3.278 1.00 0.00 H new ATOM 0 HE ARG A 17 8.698 -5.959 -2.165 1.00 0.00 H new ATOM 0 HH11 ARG A 17 12.053 -5.335 -3.100 1.00 0.00 H new ATOM 0 HH12 ARG A 17 12.703 -6.569 -2.016 1.00 0.00 H new ATOM 0 HH21 ARG A 17 9.547 -7.540 -0.781 1.00 0.00 H new ATOM 0 HH22 ARG A 17 11.291 -7.811 -0.710 1.00 0.00 H new ATOM 271 N ASN A 18 6.695 -2.782 -6.822 1.00 0.00 N ATOM 272 CA ASN A 18 6.707 -2.760 -8.280 1.00 0.00 C ATOM 273 C ASN A 18 7.624 -3.847 -8.833 1.00 0.00 C ATOM 274 O ASN A 18 8.839 -3.806 -8.636 1.00 0.00 O ATOM 275 CB ASN A 18 7.157 -1.388 -8.786 1.00 0.00 C ATOM 276 CG ASN A 18 6.322 -0.899 -9.952 1.00 0.00 C ATOM 277 OD1 ASN A 18 5.520 -1.646 -10.512 1.00 0.00 O ATOM 278 ND2 ASN A 18 6.507 0.362 -10.325 1.00 0.00 N ATOM 0 H ASN A 18 7.166 -1.990 -6.385 1.00 0.00 H new ATOM 0 HA ASN A 18 5.693 -2.953 -8.631 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.097 -0.666 -7.972 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.203 -1.441 -9.089 1.00 0.00 H new ATOM 0 HD21 ASN A 18 5.973 0.747 -11.104 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.183 0.946 -9.832 1.00 0.00 H new ATOM 285 N GLY A 19 7.035 -4.815 -9.526 1.00 0.00 N ATOM 286 CA GLY A 19 7.814 -5.898 -10.096 1.00 0.00 C ATOM 287 C GLY A 19 7.965 -7.069 -9.146 1.00 0.00 C ATOM 288 O GLY A 19 8.948 -7.808 -9.211 1.00 0.00 O ATOM 0 H GLY A 19 6.032 -4.869 -9.703 1.00 0.00 H new ATOM 0 HA2 GLY A 19 7.337 -6.239 -11.015 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.802 -5.526 -10.369 1.00 0.00 H new ATOM 292 N ASP A 20 6.989 -7.240 -8.260 1.00 0.00 N ATOM 293 CA ASP A 20 7.018 -8.330 -7.291 1.00 0.00 C ATOM 294 C ASP A 20 5.613 -8.865 -7.033 1.00 0.00 C ATOM 295 O ASP A 20 4.939 -8.442 -6.094 1.00 0.00 O ATOM 296 CB ASP A 20 7.650 -7.859 -5.979 1.00 0.00 C ATOM 297 CG ASP A 20 8.634 -8.865 -5.418 1.00 0.00 C ATOM 298 OD1 ASP A 20 9.678 -9.099 -6.063 1.00 0.00 O ATOM 299 OD2 ASP A 20 8.362 -9.419 -4.332 1.00 0.00 O ATOM 0 H ASP A 20 6.168 -6.638 -8.193 1.00 0.00 H new ATOM 0 HA ASP A 20 7.623 -9.137 -7.706 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.160 -6.910 -6.145 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.865 -7.675 -5.246 1.00 0.00 H new ATOM 304 N ARG A 21 5.178 -9.799 -7.872 1.00 0.00 N ATOM 305 CA ARG A 21 3.854 -10.394 -7.735 1.00 0.00 C ATOM 306 C ARG A 21 3.827 -11.411 -6.599 1.00 0.00 C ATOM 307 O ARG A 21 2.794 -11.617 -5.961 1.00 0.00 O ATOM 308 CB ARG A 21 3.434 -11.063 -9.045 1.00 0.00 C ATOM 309 CG ARG A 21 4.349 -12.201 -9.468 1.00 0.00 C ATOM 310 CD ARG A 21 3.567 -13.475 -9.748 1.00 0.00 C ATOM 311 NE ARG A 21 2.874 -13.419 -11.033 1.00 0.00 N ATOM 312 CZ ARG A 21 3.470 -13.629 -12.206 1.00 0.00 C ATOM 313 NH1 ARG A 21 4.767 -13.903 -12.260 1.00 0.00 N ATOM 314 NH2 ARG A 21 2.765 -13.563 -13.328 1.00 0.00 N ATOM 0 H ARG A 21 5.724 -10.160 -8.654 1.00 0.00 H new ATOM 0 HA ARG A 21 3.149 -9.597 -7.500 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.419 -11.445 -8.939 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.412 -10.313 -9.835 1.00 0.00 H new ATOM 0 HG2 ARG A 21 4.903 -11.910 -10.360 1.00 0.00 H new ATOM 0 HG3 ARG A 21 5.083 -12.389 -8.684 1.00 0.00 H new ATOM 0 HD2 ARG A 21 4.247 -14.327 -9.739 1.00 0.00 H new ATOM 0 HD3 ARG A 21 2.841 -13.638 -8.951 1.00 0.00 H new ATOM 0 HE ARG A 21 1.876 -13.207 -11.032 1.00 0.00 H new ATOM 0 HH11 ARG A 21 5.314 -13.954 -11.400 1.00 0.00 H new ATOM 0 HH12 ARG A 21 5.217 -14.063 -13.161 1.00 0.00 H new ATOM 0 HH21 ARG A 21 1.768 -13.352 -13.292 1.00 0.00 H new ATOM 0 HH22 ARG A 21 3.220 -13.724 -14.227 1.00 0.00 H new ATOM 328 N TYR A 22 4.970 -12.045 -6.351 1.00 0.00 N ATOM 329 CA TYR A 22 5.076 -13.041 -5.291 1.00 0.00 C ATOM 330 C TYR A 22 4.835 -12.411 -3.923 1.00 0.00 C ATOM 331 O TYR A 22 4.341 -13.064 -3.006 1.00 0.00 O ATOM 332 CB TYR A 22 6.454 -13.706 -5.325 1.00 0.00 C ATOM 333 CG TYR A 22 6.731 -14.461 -6.605 1.00 0.00 C ATOM 334 CD1 TYR A 22 7.266 -13.816 -7.712 1.00 0.00 C ATOM 335 CD2 TYR A 22 6.456 -15.819 -6.705 1.00 0.00 C ATOM 336 CE1 TYR A 22 7.521 -14.503 -8.884 1.00 0.00 C ATOM 337 CE2 TYR A 22 6.709 -16.514 -7.873 1.00 0.00 C ATOM 338 CZ TYR A 22 7.240 -15.851 -8.960 1.00 0.00 C ATOM 339 OH TYR A 22 7.493 -16.539 -10.125 1.00 0.00 O ATOM 0 H TYR A 22 5.834 -11.886 -6.869 1.00 0.00 H new ATOM 0 HA TYR A 22 4.310 -13.798 -5.460 1.00 0.00 H new ATOM 0 HB2 TYR A 22 7.220 -12.942 -5.191 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.537 -14.393 -4.483 1.00 0.00 H new ATOM 0 HD1 TYR A 22 7.487 -12.760 -7.656 1.00 0.00 H new ATOM 0 HD2 TYR A 22 6.038 -16.340 -5.857 1.00 0.00 H new ATOM 0 HE1 TYR A 22 7.938 -13.987 -9.736 1.00 0.00 H new ATOM 0 HE2 TYR A 22 6.492 -17.570 -7.934 1.00 0.00 H new ATOM 0 HH TYR A 22 7.240 -17.479 -10.011 1.00 0.00 H new ATOM 349 N PHE A 23 5.190 -11.136 -3.795 1.00 0.00 N ATOM 350 CA PHE A 23 5.012 -10.416 -2.538 1.00 0.00 C ATOM 351 C PHE A 23 3.545 -10.397 -2.123 1.00 0.00 C ATOM 352 O PHE A 23 2.657 -10.201 -2.954 1.00 0.00 O ATOM 353 CB PHE A 23 5.536 -8.985 -2.668 1.00 0.00 C ATOM 354 CG PHE A 23 5.677 -8.276 -1.351 1.00 0.00 C ATOM 355 CD1 PHE A 23 6.470 -8.805 -0.345 1.00 0.00 C ATOM 356 CD2 PHE A 23 5.016 -7.081 -1.119 1.00 0.00 C ATOM 357 CE1 PHE A 23 6.602 -8.155 0.867 1.00 0.00 C ATOM 358 CE2 PHE A 23 5.143 -6.427 0.091 1.00 0.00 C ATOM 359 CZ PHE A 23 5.936 -6.964 1.086 1.00 0.00 C ATOM 0 H PHE A 23 5.602 -10.581 -4.545 1.00 0.00 H new ATOM 0 HA PHE A 23 5.581 -10.936 -1.767 1.00 0.00 H new ATOM 0 HB2 PHE A 23 6.505 -9.005 -3.166 1.00 0.00 H new ATOM 0 HB3 PHE A 23 4.861 -8.416 -3.307 1.00 0.00 H new ATOM 0 HD1 PHE A 23 6.991 -9.736 -0.510 1.00 0.00 H new ATOM 0 HD2 PHE A 23 4.394 -6.656 -1.893 1.00 0.00 H new ATOM 0 HE1 PHE A 23 7.225 -8.577 1.642 1.00 0.00 H new ATOM 0 HE2 PHE A 23 4.622 -5.496 0.259 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.035 -6.454 2.033 1.00 0.00 H new ATOM 369 N LYS A 24 3.298 -10.602 -0.833 1.00 0.00 N ATOM 370 CA LYS A 24 1.937 -10.608 -0.308 1.00 0.00 C ATOM 371 C LYS A 24 1.443 -9.186 -0.060 1.00 0.00 C ATOM 372 O LYS A 24 0.257 -8.895 -0.209 1.00 0.00 O ATOM 373 CB LYS A 24 1.873 -11.418 0.989 1.00 0.00 C ATOM 374 CG LYS A 24 0.696 -12.378 1.049 1.00 0.00 C ATOM 375 CD LYS A 24 0.954 -13.522 2.019 1.00 0.00 C ATOM 376 CE LYS A 24 1.033 -14.861 1.300 1.00 0.00 C ATOM 377 NZ LYS A 24 -0.139 -15.726 1.608 1.00 0.00 N ATOM 0 H LYS A 24 4.021 -10.766 -0.133 1.00 0.00 H new ATOM 0 HA LYS A 24 1.289 -11.073 -1.051 1.00 0.00 H new ATOM 0 HB2 LYS A 24 2.798 -11.983 1.101 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.815 -10.732 1.834 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -0.200 -11.837 1.354 1.00 0.00 H new ATOM 0 HG3 LYS A 24 0.503 -12.780 0.054 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.885 -13.341 2.556 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.158 -13.555 2.763 1.00 0.00 H new ATOM 0 HE2 LYS A 24 1.088 -14.693 0.224 1.00 0.00 H new ATOM 0 HE3 LYS A 24 1.950 -15.375 1.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.048 -16.628 1.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.177 -15.908 2.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.012 -15.247 1.309 1.00 0.00 H new ATOM 391 N GLY A 25 2.363 -8.302 0.318 1.00 0.00 N ATOM 392 CA GLY A 25 2.001 -6.921 0.579 1.00 0.00 C ATOM 393 C GLY A 25 2.199 -6.535 2.032 1.00 0.00 C ATOM 394 O GLY A 25 2.553 -7.372 2.862 1.00 0.00 O ATOM 0 H GLY A 25 3.351 -8.518 0.448 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.600 -6.266 -0.053 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.958 -6.763 0.303 1.00 0.00 H new ATOM 398 N ILE A 26 1.969 -5.262 2.340 1.00 0.00 N ATOM 399 CA ILE A 26 2.124 -4.766 3.703 1.00 0.00 C ATOM 400 C ILE A 26 0.910 -3.946 4.129 1.00 0.00 C ATOM 401 O ILE A 26 0.564 -2.951 3.489 1.00 0.00 O ATOM 402 CB ILE A 26 3.395 -3.905 3.846 1.00 0.00 C ATOM 403 CG1 ILE A 26 3.595 -3.484 5.303 1.00 0.00 C ATOM 404 CG2 ILE A 26 3.315 -2.683 2.941 1.00 0.00 C ATOM 405 CD1 ILE A 26 5.021 -3.095 5.630 1.00 0.00 C ATOM 0 H ILE A 26 1.675 -4.556 1.665 1.00 0.00 H new ATOM 0 HA ILE A 26 2.214 -5.638 4.351 1.00 0.00 H new ATOM 0 HB ILE A 26 4.254 -4.503 3.541 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.938 -2.643 5.523 1.00 0.00 H new ATOM 0 HG13 ILE A 26 3.292 -4.304 5.954 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.220 -2.086 3.054 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.220 -3.004 1.904 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.448 -2.083 3.216 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.088 -2.808 6.679 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.681 -3.942 5.442 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.322 -2.255 5.004 1.00 0.00 H new ATOM 417 N VAL A 27 0.266 -4.367 5.212 1.00 0.00 N ATOM 418 CA VAL A 27 -0.908 -3.671 5.724 1.00 0.00 C ATOM 419 C VAL A 27 -0.507 -2.521 6.642 1.00 0.00 C ATOM 420 O VAL A 27 0.184 -2.724 7.641 1.00 0.00 O ATOM 421 CB VAL A 27 -1.838 -4.627 6.493 1.00 0.00 C ATOM 422 CG1 VAL A 27 -3.144 -3.933 6.847 1.00 0.00 C ATOM 423 CG2 VAL A 27 -2.098 -5.887 5.682 1.00 0.00 C ATOM 0 H VAL A 27 0.538 -5.188 5.753 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.442 -3.275 4.861 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.344 -4.916 7.421 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.788 -4.625 7.390 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.937 -3.064 7.471 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.645 -3.612 5.934 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.757 -6.550 6.242 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.570 -5.620 4.736 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.154 -6.395 5.486 1.00 0.00 H new ATOM 433 N TYR A 28 -0.943 -1.314 6.298 1.00 0.00 N ATOM 434 CA TYR A 28 -0.629 -0.132 7.092 1.00 0.00 C ATOM 435 C TYR A 28 -1.902 0.577 7.540 1.00 0.00 C ATOM 436 O TYR A 28 -2.821 0.785 6.749 1.00 0.00 O ATOM 437 CB TYR A 28 0.249 0.829 6.288 1.00 0.00 C ATOM 438 CG TYR A 28 1.731 0.596 6.477 1.00 0.00 C ATOM 439 CD1 TYR A 28 2.295 0.579 7.746 1.00 0.00 C ATOM 440 CD2 TYR A 28 2.566 0.395 5.384 1.00 0.00 C ATOM 441 CE1 TYR A 28 3.650 0.366 7.922 1.00 0.00 C ATOM 442 CE2 TYR A 28 3.921 0.181 5.552 1.00 0.00 C ATOM 443 CZ TYR A 28 4.457 0.169 6.822 1.00 0.00 C ATOM 444 OH TYR A 28 5.806 -0.044 6.994 1.00 0.00 O ATOM 0 H TYR A 28 -1.515 -1.129 5.474 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.084 -0.455 7.979 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.006 0.731 5.230 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.011 1.853 6.576 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.665 0.735 8.609 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.149 0.406 4.388 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.073 0.354 8.915 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.556 0.024 4.693 1.00 0.00 H new ATOM 0 HH TYR A 28 5.960 -0.488 7.854 1.00 0.00 H new ATOM 454 N ALA A 29 -1.948 0.950 8.815 1.00 0.00 N ATOM 455 CA ALA A 29 -3.107 1.638 9.370 1.00 0.00 C ATOM 456 C ALA A 29 -2.808 3.116 9.599 1.00 0.00 C ATOM 457 O ALA A 29 -2.179 3.486 10.590 1.00 0.00 O ATOM 458 CB ALA A 29 -3.540 0.978 10.669 1.00 0.00 C ATOM 0 H ALA A 29 -1.195 0.787 9.483 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.922 1.565 8.650 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -4.406 1.502 11.072 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.802 -0.063 10.479 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.723 1.021 11.389 1.00 0.00 H new ATOM 464 N ILE A 30 -3.264 3.956 8.676 1.00 0.00 N ATOM 465 CA ILE A 30 -3.046 5.394 8.778 1.00 0.00 C ATOM 466 C ILE A 30 -3.804 5.981 9.964 1.00 0.00 C ATOM 467 O ILE A 30 -5.017 6.185 9.899 1.00 0.00 O ATOM 468 CB ILE A 30 -3.483 6.122 7.492 1.00 0.00 C ATOM 469 CG1 ILE A 30 -2.869 5.449 6.263 1.00 0.00 C ATOM 470 CG2 ILE A 30 -3.087 7.590 7.551 1.00 0.00 C ATOM 471 CD1 ILE A 30 -1.357 5.377 6.305 1.00 0.00 C ATOM 0 H ILE A 30 -3.786 3.666 7.849 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.976 5.542 8.924 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.568 6.062 7.412 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -3.270 4.440 6.173 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.174 5.994 5.370 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.403 8.089 6.635 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.569 8.063 8.407 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.005 7.671 7.654 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.991 4.888 5.402 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -0.946 6.385 6.364 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.044 4.806 7.179 1.00 0.00 H new ATOM 483 N SER A 31 -3.082 6.252 11.046 1.00 0.00 N ATOM 484 CA SER A 31 -3.685 6.816 12.248 1.00 0.00 C ATOM 485 C SER A 31 -3.046 8.157 12.601 1.00 0.00 C ATOM 486 O SER A 31 -1.854 8.364 12.370 1.00 0.00 O ATOM 487 CB SER A 31 -3.541 5.843 13.421 1.00 0.00 C ATOM 488 OG SER A 31 -4.709 5.837 14.224 1.00 0.00 O ATOM 0 H SER A 31 -2.077 6.090 11.115 1.00 0.00 H new ATOM 0 HA SER A 31 -4.744 6.981 12.050 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.350 4.839 13.043 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.680 6.124 14.028 1.00 0.00 H new ATOM 0 HG SER A 31 -4.593 5.207 14.965 1.00 0.00 H new ATOM 494 N PRO A 32 -3.831 9.089 13.169 1.00 0.00 N ATOM 495 CA PRO A 32 -3.333 10.414 13.553 1.00 0.00 C ATOM 496 C PRO A 32 -2.099 10.332 14.446 1.00 0.00 C ATOM 497 O PRO A 32 -1.220 11.191 14.388 1.00 0.00 O ATOM 498 CB PRO A 32 -4.506 11.031 14.317 1.00 0.00 C ATOM 499 CG PRO A 32 -5.711 10.325 13.800 1.00 0.00 C ATOM 500 CD PRO A 32 -5.264 8.926 13.480 1.00 0.00 C ATOM 0 HA PRO A 32 -3.020 10.997 12.687 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.396 10.890 15.392 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.571 12.105 14.142 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -6.509 10.320 14.542 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -6.104 10.822 12.913 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.418 8.252 14.323 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.814 8.511 12.635 1.00 0.00 H new ATOM 508 N ASP A 33 -2.043 9.293 15.275 1.00 0.00 N ATOM 509 CA ASP A 33 -0.918 9.099 16.181 1.00 0.00 C ATOM 510 C ASP A 33 0.233 8.389 15.478 1.00 0.00 C ATOM 511 O ASP A 33 1.399 8.724 15.681 1.00 0.00 O ATOM 512 CB ASP A 33 -1.357 8.296 17.406 1.00 0.00 C ATOM 513 CG ASP A 33 -2.155 9.128 18.390 1.00 0.00 C ATOM 514 OD1 ASP A 33 -1.718 10.255 18.705 1.00 0.00 O ATOM 515 OD2 ASP A 33 -3.217 8.653 18.844 1.00 0.00 O ATOM 0 H ASP A 33 -2.764 8.574 15.337 1.00 0.00 H new ATOM 0 HA ASP A 33 -0.570 10.080 16.503 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -1.958 7.446 17.083 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -0.477 7.892 17.906 1.00 0.00 H new ATOM 520 N ARG A 34 -0.103 7.406 14.649 1.00 0.00 N ATOM 521 CA ARG A 34 0.903 6.648 13.915 1.00 0.00 C ATOM 522 C ARG A 34 1.681 7.552 12.964 1.00 0.00 C ATOM 523 O ARG A 34 2.852 7.852 13.196 1.00 0.00 O ATOM 524 CB ARG A 34 0.245 5.510 13.131 1.00 0.00 C ATOM 525 CG ARG A 34 0.174 4.202 13.902 1.00 0.00 C ATOM 526 CD ARG A 34 0.156 3.005 12.966 1.00 0.00 C ATOM 527 NE ARG A 34 -0.682 1.922 13.479 1.00 0.00 N ATOM 528 CZ ARG A 34 -0.604 0.662 13.057 1.00 0.00 C ATOM 529 NH1 ARG A 34 0.270 0.321 12.119 1.00 0.00 N ATOM 530 NH2 ARG A 34 -1.403 -0.260 13.577 1.00 0.00 N ATOM 0 H ARG A 34 -1.064 7.116 14.469 1.00 0.00 H new ATOM 0 HA ARG A 34 1.601 6.226 14.638 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -0.764 5.811 12.848 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.800 5.348 12.207 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.029 4.127 14.574 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -0.721 4.193 14.524 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -0.211 3.315 11.988 1.00 0.00 H new ATOM 0 HD3 ARG A 34 1.173 2.640 12.824 1.00 0.00 H new ATOM 0 HE ARG A 34 -1.366 2.145 14.202 1.00 0.00 H new ATOM 0 HH11 ARG A 34 0.887 1.026 11.717 1.00 0.00 H new ATOM 0 HH12 ARG A 34 0.325 -0.646 11.800 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -2.076 -0.003 14.299 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -1.345 -1.226 13.255 1.00 0.00 H new ATOM 544 N PHE A 35 1.023 7.983 11.894 1.00 0.00 N ATOM 545 CA PHE A 35 1.653 8.853 10.908 1.00 0.00 C ATOM 546 C PHE A 35 1.118 10.277 11.017 1.00 0.00 C ATOM 547 O PHE A 35 -0.059 10.489 11.304 1.00 0.00 O ATOM 548 CB PHE A 35 1.416 8.314 9.496 1.00 0.00 C ATOM 549 CG PHE A 35 1.775 6.864 9.341 1.00 0.00 C ATOM 550 CD1 PHE A 35 3.072 6.487 9.028 1.00 0.00 C ATOM 551 CD2 PHE A 35 0.816 5.877 9.505 1.00 0.00 C ATOM 552 CE1 PHE A 35 3.405 5.153 8.885 1.00 0.00 C ATOM 553 CE2 PHE A 35 1.143 4.542 9.363 1.00 0.00 C ATOM 554 CZ PHE A 35 2.439 4.180 9.052 1.00 0.00 C ATOM 0 H PHE A 35 0.053 7.744 11.687 1.00 0.00 H new ATOM 0 HA PHE A 35 2.724 8.870 11.108 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.367 8.450 9.235 1.00 0.00 H new ATOM 0 HB3 PHE A 35 2.000 8.902 8.788 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.831 7.244 8.894 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.199 6.155 9.747 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.419 4.872 8.643 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.386 3.783 9.495 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.697 3.137 8.940 1.00 0.00 H new ATOM 564 N ARG A 36 1.993 11.251 10.785 1.00 0.00 N ATOM 565 CA ARG A 36 1.610 12.655 10.857 1.00 0.00 C ATOM 566 C ARG A 36 1.613 13.291 9.470 1.00 0.00 C ATOM 567 O ARG A 36 0.814 14.183 9.183 1.00 0.00 O ATOM 568 CB ARG A 36 2.561 13.419 11.781 1.00 0.00 C ATOM 569 CG ARG A 36 2.520 12.942 13.223 1.00 0.00 C ATOM 570 CD ARG A 36 1.441 13.660 14.018 1.00 0.00 C ATOM 571 NE ARG A 36 1.915 14.930 14.561 1.00 0.00 N ATOM 572 CZ ARG A 36 2.678 15.034 15.648 1.00 0.00 C ATOM 573 NH1 ARG A 36 3.055 13.946 16.307 1.00 0.00 N ATOM 574 NH2 ARG A 36 3.065 16.229 16.074 1.00 0.00 N ATOM 0 H ARG A 36 2.972 11.093 10.546 1.00 0.00 H new ATOM 0 HA ARG A 36 0.599 12.709 11.261 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.579 13.321 11.403 1.00 0.00 H new ATOM 0 HB3 ARG A 36 2.311 14.479 11.750 1.00 0.00 H new ATOM 0 HG2 ARG A 36 2.337 11.868 13.247 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.490 13.110 13.690 1.00 0.00 H new ATOM 0 HD2 ARG A 36 0.578 13.839 13.377 1.00 0.00 H new ATOM 0 HD3 ARG A 36 1.105 13.020 14.834 1.00 0.00 H new ATOM 0 HE ARG A 36 1.646 15.788 14.080 1.00 0.00 H new ATOM 0 HH11 ARG A 36 2.761 13.025 15.982 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.639 14.030 17.139 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.778 17.068 15.569 1.00 0.00 H new ATOM 0 HH22 ARG A 36 3.649 16.309 16.906 1.00 0.00 H new ATOM 588 N SER A 37 2.514 12.825 8.613 1.00 0.00 N ATOM 589 CA SER A 37 2.621 13.347 7.255 1.00 0.00 C ATOM 590 C SER A 37 3.192 12.295 6.310 1.00 0.00 C ATOM 591 O SER A 37 3.541 11.191 6.732 1.00 0.00 O ATOM 592 CB SER A 37 3.500 14.600 7.236 1.00 0.00 C ATOM 593 OG SER A 37 2.714 15.775 7.324 1.00 0.00 O ATOM 0 H SER A 37 3.182 12.086 8.834 1.00 0.00 H new ATOM 0 HA SER A 37 1.620 13.609 6.913 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.204 14.567 8.067 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.089 14.621 6.319 1.00 0.00 H new ATOM 0 HG SER A 37 1.939 15.608 7.901 1.00 0.00 H new ATOM 599 N PHE A 38 3.285 12.643 5.032 1.00 0.00 N ATOM 600 CA PHE A 38 3.815 11.728 4.027 1.00 0.00 C ATOM 601 C PHE A 38 5.262 11.358 4.335 1.00 0.00 C ATOM 602 O PHE A 38 5.719 10.266 3.998 1.00 0.00 O ATOM 603 CB PHE A 38 3.720 12.357 2.636 1.00 0.00 C ATOM 604 CG PHE A 38 3.267 11.396 1.573 1.00 0.00 C ATOM 605 CD1 PHE A 38 2.114 10.647 1.743 1.00 0.00 C ATOM 606 CD2 PHE A 38 3.995 11.244 0.403 1.00 0.00 C ATOM 607 CE1 PHE A 38 1.695 9.763 0.767 1.00 0.00 C ATOM 608 CE2 PHE A 38 3.581 10.361 -0.576 1.00 0.00 C ATOM 609 CZ PHE A 38 2.430 9.620 -0.394 1.00 0.00 C ATOM 0 H PHE A 38 3.000 13.552 4.667 1.00 0.00 H new ATOM 0 HA PHE A 38 3.216 10.818 4.048 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.028 13.198 2.673 1.00 0.00 H new ATOM 0 HB3 PHE A 38 4.695 12.758 2.360 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.536 10.755 2.649 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.895 11.822 0.255 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.794 9.185 0.912 1.00 0.00 H new ATOM 0 HE2 PHE A 38 4.157 10.250 -1.483 1.00 0.00 H new ATOM 0 HZ PHE A 38 2.105 8.930 -1.158 1.00 0.00 H new ATOM 619 N GLU A 39 5.979 12.274 4.977 1.00 0.00 N ATOM 620 CA GLU A 39 7.376 12.044 5.329 1.00 0.00 C ATOM 621 C GLU A 39 7.517 10.816 6.223 1.00 0.00 C ATOM 622 O GLU A 39 8.500 10.080 6.133 1.00 0.00 O ATOM 623 CB GLU A 39 7.955 13.271 6.036 1.00 0.00 C ATOM 624 CG GLU A 39 8.064 14.494 5.140 1.00 0.00 C ATOM 625 CD GLU A 39 8.998 15.547 5.703 1.00 0.00 C ATOM 626 OE1 GLU A 39 10.105 15.182 6.149 1.00 0.00 O ATOM 627 OE2 GLU A 39 8.623 16.738 5.697 1.00 0.00 O ATOM 0 H GLU A 39 5.616 13.183 5.264 1.00 0.00 H new ATOM 0 HA GLU A 39 7.932 11.867 4.408 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.329 13.514 6.895 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.944 13.025 6.422 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.418 14.188 4.156 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.074 14.928 5.002 1.00 0.00 H new ATOM 634 N ALA A 40 6.528 10.600 7.085 1.00 0.00 N ATOM 635 CA ALA A 40 6.543 9.460 7.994 1.00 0.00 C ATOM 636 C ALA A 40 6.129 8.180 7.276 1.00 0.00 C ATOM 637 O ALA A 40 6.658 7.103 7.552 1.00 0.00 O ATOM 638 CB ALA A 40 5.629 9.721 9.182 1.00 0.00 C ATOM 0 H ALA A 40 5.707 11.199 7.173 1.00 0.00 H new ATOM 0 HA ALA A 40 7.563 9.328 8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.650 8.862 9.853 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.971 10.607 9.717 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.610 9.881 8.829 1.00 0.00 H new ATOM 644 N LEU A 41 5.179 8.304 6.355 1.00 0.00 N ATOM 645 CA LEU A 41 4.693 7.157 5.598 1.00 0.00 C ATOM 646 C LEU A 41 5.713 6.725 4.550 1.00 0.00 C ATOM 647 O LEU A 41 5.927 5.532 4.331 1.00 0.00 O ATOM 648 CB LEU A 41 3.361 7.491 4.922 1.00 0.00 C ATOM 649 CG LEU A 41 2.661 6.309 4.251 1.00 0.00 C ATOM 650 CD1 LEU A 41 2.124 5.344 5.297 1.00 0.00 C ATOM 651 CD2 LEU A 41 1.538 6.798 3.348 1.00 0.00 C ATOM 0 H LEU A 41 4.730 9.188 6.115 1.00 0.00 H new ATOM 0 HA LEU A 41 4.542 6.332 6.295 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.689 7.916 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 41 3.535 8.263 4.173 1.00 0.00 H new ATOM 0 HG LEU A 41 3.390 5.779 3.637 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.629 4.509 4.801 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.948 4.969 5.903 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.409 5.862 5.937 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.051 5.944 2.878 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.809 7.351 3.941 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.949 7.450 2.577 1.00 0.00 H new ATOM 663 N LEU A 42 6.341 7.702 3.905 1.00 0.00 N ATOM 664 CA LEU A 42 7.340 7.422 2.879 1.00 0.00 C ATOM 665 C LEU A 42 8.596 6.816 3.494 1.00 0.00 C ATOM 666 O LEU A 42 9.283 6.013 2.862 1.00 0.00 O ATOM 667 CB LEU A 42 7.696 8.703 2.122 1.00 0.00 C ATOM 668 CG LEU A 42 6.645 9.171 1.112 1.00 0.00 C ATOM 669 CD1 LEU A 42 7.074 10.479 0.465 1.00 0.00 C ATOM 670 CD2 LEU A 42 6.411 8.103 0.055 1.00 0.00 C ATOM 0 H LEU A 42 6.176 8.694 4.074 1.00 0.00 H new ATOM 0 HA LEU A 42 6.915 6.701 2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.863 9.501 2.846 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.638 8.547 1.597 1.00 0.00 H new ATOM 0 HG LEU A 42 5.708 9.341 1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.315 10.797 -0.250 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.192 11.243 1.233 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.023 10.335 -0.052 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.661 8.452 -0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.344 7.902 -0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.060 7.189 0.533 1.00 0.00 H new ATOM 682 N ALA A 43 8.893 7.206 4.729 1.00 0.00 N ATOM 683 CA ALA A 43 10.067 6.701 5.429 1.00 0.00 C ATOM 684 C ALA A 43 9.900 5.230 5.791 1.00 0.00 C ATOM 685 O ALA A 43 10.815 4.427 5.607 1.00 0.00 O ATOM 686 CB ALA A 43 10.332 7.527 6.679 1.00 0.00 C ATOM 0 H ALA A 43 8.336 7.871 5.266 1.00 0.00 H new ATOM 0 HA ALA A 43 10.923 6.789 4.760 1.00 0.00 H new ATOM 0 HB1 ALA A 43 11.212 7.139 7.192 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.505 8.566 6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.470 7.469 7.343 1.00 0.00 H new ATOM 692 N ASP A 44 8.727 4.883 6.310 1.00 0.00 N ATOM 693 CA ASP A 44 8.439 3.507 6.699 1.00 0.00 C ATOM 694 C ASP A 44 8.387 2.596 5.477 1.00 0.00 C ATOM 695 O ASP A 44 8.920 1.486 5.496 1.00 0.00 O ATOM 696 CB ASP A 44 7.114 3.435 7.459 1.00 0.00 C ATOM 697 CG ASP A 44 7.145 2.418 8.582 1.00 0.00 C ATOM 698 OD1 ASP A 44 7.973 1.485 8.515 1.00 0.00 O ATOM 699 OD2 ASP A 44 6.341 2.552 9.528 1.00 0.00 O ATOM 0 H ASP A 44 7.960 5.536 6.471 1.00 0.00 H new ATOM 0 HA ASP A 44 9.243 3.165 7.351 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.880 4.417 7.869 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.314 3.180 6.764 1.00 0.00 H new ATOM 704 N LEU A 45 7.741 3.071 4.418 1.00 0.00 N ATOM 705 CA LEU A 45 7.619 2.298 3.187 1.00 0.00 C ATOM 706 C LEU A 45 8.993 1.980 2.605 1.00 0.00 C ATOM 707 O LEU A 45 9.186 0.940 1.976 1.00 0.00 O ATOM 708 CB LEU A 45 6.781 3.063 2.161 1.00 0.00 C ATOM 709 CG LEU A 45 5.272 3.032 2.404 1.00 0.00 C ATOM 710 CD1 LEU A 45 4.569 4.051 1.521 1.00 0.00 C ATOM 711 CD2 LEU A 45 4.722 1.637 2.153 1.00 0.00 C ATOM 0 H LEU A 45 7.294 3.987 4.387 1.00 0.00 H new ATOM 0 HA LEU A 45 7.120 1.359 3.425 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.110 4.102 2.148 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.983 2.653 1.172 1.00 0.00 H new ATOM 0 HG LEU A 45 5.084 3.293 3.445 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.496 4.015 1.707 1.00 0.00 H new ATOM 0 HD12 LEU A 45 4.943 5.049 1.748 1.00 0.00 H new ATOM 0 HD13 LEU A 45 4.763 3.820 0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.647 1.633 2.331 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.921 1.348 1.121 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.204 0.929 2.827 1.00 0.00 H new ATOM 723 N THR A 46 9.943 2.883 2.820 1.00 0.00 N ATOM 724 CA THR A 46 11.301 2.699 2.316 1.00 0.00 C ATOM 725 C THR A 46 12.072 1.708 3.181 1.00 0.00 C ATOM 726 O THR A 46 12.941 0.987 2.692 1.00 0.00 O ATOM 727 CB THR A 46 12.037 4.038 2.277 1.00 0.00 C ATOM 728 OG1 THR A 46 11.325 4.981 1.495 1.00 0.00 O ATOM 729 CG2 THR A 46 13.437 3.935 1.708 1.00 0.00 C ATOM 0 H THR A 46 9.799 3.749 3.339 1.00 0.00 H new ATOM 0 HA THR A 46 11.236 2.298 1.305 1.00 0.00 H new ATOM 0 HB THR A 46 12.106 4.359 3.316 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.828 5.586 2.084 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.903 4.920 1.709 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.029 3.253 2.319 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.388 3.558 0.687 1.00 0.00 H new ATOM 737 N ARG A 47 11.747 1.676 4.469 1.00 0.00 N ATOM 738 CA ARG A 47 12.410 0.773 5.403 1.00 0.00 C ATOM 739 C ARG A 47 11.966 -0.668 5.177 1.00 0.00 C ATOM 740 O ARG A 47 12.731 -1.606 5.404 1.00 0.00 O ATOM 741 CB ARG A 47 12.112 1.190 6.845 1.00 0.00 C ATOM 742 CG ARG A 47 13.272 0.953 7.798 1.00 0.00 C ATOM 743 CD ARG A 47 12.809 0.947 9.246 1.00 0.00 C ATOM 744 NE ARG A 47 13.845 1.436 10.154 1.00 0.00 N ATOM 745 CZ ARG A 47 14.232 2.708 10.220 1.00 0.00 C ATOM 746 NH1 ARG A 47 13.675 3.620 9.434 1.00 0.00 N ATOM 747 NH2 ARG A 47 15.180 3.067 11.075 1.00 0.00 N ATOM 0 H ARG A 47 11.028 2.265 4.890 1.00 0.00 H new ATOM 0 HA ARG A 47 13.484 0.834 5.228 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.849 2.248 6.862 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.241 0.639 7.201 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.749 0.001 7.563 1.00 0.00 H new ATOM 0 HG3 ARG A 47 14.024 1.730 7.658 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.918 1.568 9.344 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.525 -0.066 9.532 1.00 0.00 H new ATOM 0 HE ARG A 47 14.298 0.763 10.773 1.00 0.00 H new ATOM 0 HH11 ARG A 47 12.946 3.348 8.774 1.00 0.00 H new ATOM 0 HH12 ARG A 47 13.976 4.593 9.489 1.00 0.00 H new ATOM 0 HH21 ARG A 47 15.611 2.369 11.681 1.00 0.00 H new ATOM 0 HH22 ARG A 47 15.478 4.041 11.127 1.00 0.00 H new ATOM 761 N THR A 48 10.727 -0.838 4.728 1.00 0.00 N ATOM 762 CA THR A 48 10.181 -2.166 4.473 1.00 0.00 C ATOM 763 C THR A 48 10.188 -2.479 2.979 1.00 0.00 C ATOM 764 O THR A 48 10.924 -3.352 2.520 1.00 0.00 O ATOM 765 CB THR A 48 8.758 -2.274 5.025 1.00 0.00 C ATOM 766 OG1 THR A 48 8.216 -0.989 5.272 1.00 0.00 O ATOM 767 CG2 THR A 48 8.675 -3.062 6.315 1.00 0.00 C ATOM 0 H THR A 48 10.082 -0.072 4.533 1.00 0.00 H new ATOM 0 HA THR A 48 10.813 -2.894 4.981 1.00 0.00 H new ATOM 0 HB THR A 48 8.191 -2.801 4.258 1.00 0.00 H new ATOM 0 HG1 THR A 48 7.455 -1.067 5.884 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.639 -3.100 6.652 1.00 0.00 H new ATOM 0 HG22 THR A 48 9.039 -4.075 6.146 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.287 -2.578 7.077 1.00 0.00 H new ATOM 775 N LEU A 49 9.361 -1.761 2.225 1.00 0.00 N ATOM 776 CA LEU A 49 9.271 -1.963 0.785 1.00 0.00 C ATOM 777 C LEU A 49 10.462 -1.332 0.070 1.00 0.00 C ATOM 778 O LEU A 49 10.313 -0.366 -0.679 1.00 0.00 O ATOM 779 CB LEU A 49 7.965 -1.371 0.248 1.00 0.00 C ATOM 780 CG LEU A 49 6.690 -1.997 0.815 1.00 0.00 C ATOM 781 CD1 LEU A 49 5.465 -1.214 0.367 1.00 0.00 C ATOM 782 CD2 LEU A 49 6.578 -3.453 0.388 1.00 0.00 C ATOM 0 H LEU A 49 8.744 -1.034 2.588 1.00 0.00 H new ATOM 0 HA LEU A 49 9.283 -3.036 0.592 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.953 -0.302 0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.954 -1.479 -0.837 1.00 0.00 H new ATOM 0 HG LEU A 49 6.742 -1.959 1.903 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.568 -1.674 0.780 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.541 -0.186 0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.407 -1.220 -0.721 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.665 -3.884 0.800 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.548 -3.512 -0.700 1.00 0.00 H new ATOM 0 HD23 LEU A 49 7.440 -4.008 0.758 1.00 0.00 H new ATOM 794 N SER A 50 11.648 -1.887 0.306 1.00 0.00 N ATOM 795 CA SER A 50 12.866 -1.381 -0.316 1.00 0.00 C ATOM 796 C SER A 50 14.071 -2.231 0.079 1.00 0.00 C ATOM 797 O SER A 50 14.694 -1.999 1.114 1.00 0.00 O ATOM 798 CB SER A 50 13.100 0.079 0.085 1.00 0.00 C ATOM 799 OG SER A 50 13.306 0.894 -1.054 1.00 0.00 O ATOM 0 H SER A 50 11.790 -2.687 0.923 1.00 0.00 H new ATOM 0 HA SER A 50 12.744 -1.437 -1.398 1.00 0.00 H new ATOM 0 HB2 SER A 50 12.242 0.446 0.649 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.966 0.144 0.744 1.00 0.00 H new ATOM 0 HG SER A 50 13.995 0.492 -1.624 1.00 0.00 H new ATOM 805 N ASP A 51 14.391 -3.215 -0.756 1.00 0.00 N ATOM 806 CA ASP A 51 15.520 -4.100 -0.494 1.00 0.00 C ATOM 807 C ASP A 51 16.835 -3.441 -0.902 1.00 0.00 C ATOM 808 O ASP A 51 17.601 -2.985 -0.054 1.00 0.00 O ATOM 809 CB ASP A 51 15.344 -5.421 -1.244 1.00 0.00 C ATOM 810 CG ASP A 51 14.630 -6.468 -0.411 1.00 0.00 C ATOM 811 OD1 ASP A 51 13.411 -6.316 -0.185 1.00 0.00 O ATOM 812 OD2 ASP A 51 15.289 -7.439 0.015 1.00 0.00 O ATOM 0 H ASP A 51 13.885 -3.419 -1.618 1.00 0.00 H new ATOM 0 HA ASP A 51 15.552 -4.300 0.577 1.00 0.00 H new ATOM 0 HB2 ASP A 51 14.781 -5.243 -2.160 1.00 0.00 H new ATOM 0 HB3 ASP A 51 16.322 -5.801 -1.540 1.00 0.00 H new ATOM 817 N ASN A 52 17.088 -3.394 -2.206 1.00 0.00 N ATOM 818 CA ASN A 52 18.310 -2.791 -2.727 1.00 0.00 C ATOM 819 C ASN A 52 18.320 -2.811 -4.252 1.00 0.00 C ATOM 820 O ASN A 52 18.670 -1.821 -4.893 1.00 0.00 O ATOM 821 CB ASN A 52 19.537 -3.528 -2.187 1.00 0.00 C ATOM 822 CG ASN A 52 20.732 -2.611 -2.014 1.00 0.00 C ATOM 823 OD1 ASN A 52 21.613 -2.551 -2.873 1.00 0.00 O ATOM 824 ND2 ASN A 52 20.769 -1.890 -0.900 1.00 0.00 N ATOM 0 H ASN A 52 16.463 -3.766 -2.921 1.00 0.00 H new ATOM 0 HA ASN A 52 18.343 -1.753 -2.396 1.00 0.00 H new ATOM 0 HB2 ASN A 52 19.291 -3.984 -1.228 1.00 0.00 H new ATOM 0 HB3 ASN A 52 19.800 -4.338 -2.867 1.00 0.00 H new ATOM 0 HD21 ASN A 52 21.549 -1.255 -0.729 1.00 0.00 H new ATOM 0 HD22 ASN A 52 20.018 -1.971 -0.215 1.00 0.00 H new ATOM 831 N VAL A 53 17.932 -3.945 -4.825 1.00 0.00 N ATOM 832 CA VAL A 53 17.897 -4.094 -6.276 1.00 0.00 C ATOM 833 C VAL A 53 16.596 -3.547 -6.852 1.00 0.00 C ATOM 834 O VAL A 53 16.606 -2.762 -7.801 1.00 0.00 O ATOM 835 CB VAL A 53 18.050 -5.568 -6.694 1.00 0.00 C ATOM 836 CG1 VAL A 53 18.211 -5.682 -8.202 1.00 0.00 C ATOM 837 CG2 VAL A 53 19.227 -6.207 -5.974 1.00 0.00 C ATOM 0 H VAL A 53 17.638 -4.774 -4.308 1.00 0.00 H new ATOM 0 HA VAL A 53 18.737 -3.523 -6.673 1.00 0.00 H new ATOM 0 HB VAL A 53 17.145 -6.104 -6.408 1.00 0.00 H new ATOM 0 HG11 VAL A 53 18.318 -6.731 -8.478 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.333 -5.265 -8.694 1.00 0.00 H new ATOM 0 HG13 VAL A 53 19.098 -5.132 -8.516 1.00 0.00 H new ATOM 0 HG21 VAL A 53 19.320 -7.249 -6.282 1.00 0.00 H new ATOM 0 HG22 VAL A 53 20.142 -5.671 -6.226 1.00 0.00 H new ATOM 0 HG23 VAL A 53 19.064 -6.160 -4.897 1.00 0.00 H new ATOM 847 N ASN A 54 15.475 -3.967 -6.274 1.00 0.00 N ATOM 848 CA ASN A 54 14.164 -3.519 -6.731 1.00 0.00 C ATOM 849 C ASN A 54 14.020 -2.010 -6.577 1.00 0.00 C ATOM 850 O ASN A 54 13.881 -1.285 -7.562 1.00 0.00 O ATOM 851 CB ASN A 54 13.059 -4.232 -5.950 1.00 0.00 C ATOM 852 CG ASN A 54 12.806 -5.639 -6.458 1.00 0.00 C ATOM 853 OD1 ASN A 54 13.337 -6.042 -7.493 1.00 0.00 O ATOM 854 ND2 ASN A 54 11.992 -6.394 -5.729 1.00 0.00 N ATOM 0 H ASN A 54 15.448 -4.617 -5.488 1.00 0.00 H new ATOM 0 HA ASN A 54 14.071 -3.767 -7.788 1.00 0.00 H new ATOM 0 HB2 ASN A 54 13.332 -4.273 -4.896 1.00 0.00 H new ATOM 0 HB3 ASN A 54 12.138 -3.653 -6.019 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.785 -7.349 -6.020 1.00 0.00 H new ATOM 0 HD22 ASN A 54 11.574 -6.019 -4.878 1.00 0.00 H new ATOM 861 N LEU A 55 14.051 -1.541 -5.334 1.00 0.00 N ATOM 862 CA LEU A 55 13.924 -0.116 -5.049 1.00 0.00 C ATOM 863 C LEU A 55 15.081 0.374 -4.183 1.00 0.00 C ATOM 864 O LEU A 55 14.975 0.419 -2.958 1.00 0.00 O ATOM 865 CB LEU A 55 12.592 0.169 -4.350 1.00 0.00 C ATOM 866 CG LEU A 55 11.346 -0.160 -5.177 1.00 0.00 C ATOM 867 CD1 LEU A 55 10.460 -1.156 -4.441 1.00 0.00 C ATOM 868 CD2 LEU A 55 10.567 1.108 -5.500 1.00 0.00 C ATOM 0 H LEU A 55 14.163 -2.127 -4.507 1.00 0.00 H new ATOM 0 HA LEU A 55 13.952 0.421 -5.997 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.556 -0.402 -3.422 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.560 1.224 -4.076 1.00 0.00 H new ATOM 0 HG LEU A 55 11.669 -0.614 -6.114 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.580 -1.376 -5.046 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.017 -2.076 -4.262 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.148 -0.730 -3.488 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.685 0.853 -6.088 1.00 0.00 H new ATOM 0 HD22 LEU A 55 10.258 1.591 -4.573 1.00 0.00 H new ATOM 0 HD23 LEU A 55 11.200 1.788 -6.070 1.00 0.00 H new ATOM 880 N PRO A 56 16.209 0.749 -4.812 1.00 0.00 N ATOM 881 CA PRO A 56 17.389 1.237 -4.092 1.00 0.00 C ATOM 882 C PRO A 56 17.167 2.619 -3.487 1.00 0.00 C ATOM 883 O PRO A 56 17.540 2.873 -2.341 1.00 0.00 O ATOM 884 CB PRO A 56 18.467 1.296 -5.176 1.00 0.00 C ATOM 885 CG PRO A 56 17.715 1.473 -6.448 1.00 0.00 C ATOM 886 CD PRO A 56 16.421 0.726 -6.272 1.00 0.00 C ATOM 0 HA PRO A 56 17.647 0.595 -3.250 1.00 0.00 H new ATOM 0 HB2 PRO A 56 19.156 2.123 -5.005 1.00 0.00 H new ATOM 0 HB3 PRO A 56 19.063 0.383 -5.192 1.00 0.00 H new ATOM 0 HG2 PRO A 56 17.532 2.528 -6.649 1.00 0.00 H new ATOM 0 HG3 PRO A 56 18.280 1.081 -7.293 1.00 0.00 H new ATOM 0 HD2 PRO A 56 15.602 1.210 -6.805 1.00 0.00 H new ATOM 0 HD3 PRO A 56 16.490 -0.293 -6.652 1.00 0.00 H new ATOM 894 N GLN A 57 16.558 3.510 -4.262 1.00 0.00 N ATOM 895 CA GLN A 57 16.286 4.866 -3.802 1.00 0.00 C ATOM 896 C GLN A 57 15.227 4.866 -2.704 1.00 0.00 C ATOM 897 O GLN A 57 15.398 5.500 -1.663 1.00 0.00 O ATOM 898 CB GLN A 57 15.828 5.741 -4.970 1.00 0.00 C ATOM 899 CG GLN A 57 16.371 7.159 -4.917 1.00 0.00 C ATOM 900 CD GLN A 57 16.862 7.648 -6.266 1.00 0.00 C ATOM 901 OE1 GLN A 57 16.505 8.739 -6.712 1.00 0.00 O ATOM 902 NE2 GLN A 57 17.685 6.840 -6.924 1.00 0.00 N ATOM 0 H GLN A 57 16.243 3.317 -5.213 1.00 0.00 H new ATOM 0 HA GLN A 57 17.209 5.276 -3.391 1.00 0.00 H new ATOM 0 HB2 GLN A 57 16.140 5.276 -5.905 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.739 5.778 -4.980 1.00 0.00 H new ATOM 0 HG2 GLN A 57 15.592 7.829 -4.554 1.00 0.00 H new ATOM 0 HG3 GLN A 57 17.190 7.204 -4.199 1.00 0.00 H new ATOM 0 HE21 GLN A 57 17.955 5.945 -6.517 1.00 0.00 H new ATOM 0 HE22 GLN A 57 18.048 7.115 -7.837 1.00 0.00 H new ATOM 911 N GLY A 58 14.134 4.150 -2.943 1.00 0.00 N ATOM 912 CA GLY A 58 13.063 4.081 -1.966 1.00 0.00 C ATOM 913 C GLY A 58 11.690 4.152 -2.602 1.00 0.00 C ATOM 914 O GLY A 58 11.460 3.574 -3.665 1.00 0.00 O ATOM 0 H GLY A 58 13.970 3.616 -3.796 1.00 0.00 H new ATOM 0 HA2 GLY A 58 13.150 3.153 -1.401 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.172 4.899 -1.254 1.00 0.00 H new ATOM 918 N VAL A 59 10.774 4.862 -1.952 1.00 0.00 N ATOM 919 CA VAL A 59 9.416 5.007 -2.460 1.00 0.00 C ATOM 920 C VAL A 59 9.047 6.478 -2.633 1.00 0.00 C ATOM 921 O VAL A 59 9.098 7.256 -1.682 1.00 0.00 O ATOM 922 CB VAL A 59 8.392 4.334 -1.524 1.00 0.00 C ATOM 923 CG1 VAL A 59 8.414 4.984 -0.148 1.00 0.00 C ATOM 924 CG2 VAL A 59 6.996 4.391 -2.127 1.00 0.00 C ATOM 0 H VAL A 59 10.948 5.346 -1.071 1.00 0.00 H new ATOM 0 HA VAL A 59 9.386 4.514 -3.432 1.00 0.00 H new ATOM 0 HB VAL A 59 8.670 3.286 -1.409 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.684 4.495 0.497 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.408 4.882 0.286 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.165 6.041 -0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.288 3.911 -1.451 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.707 5.431 -2.277 1.00 0.00 H new ATOM 0 HG23 VAL A 59 6.992 3.872 -3.085 1.00 0.00 H new ATOM 934 N ARG A 60 8.678 6.849 -3.855 1.00 0.00 N ATOM 935 CA ARG A 60 8.301 8.226 -4.154 1.00 0.00 C ATOM 936 C ARG A 60 6.844 8.305 -4.600 1.00 0.00 C ATOM 937 O ARG A 60 5.995 8.845 -3.890 1.00 0.00 O ATOM 938 CB ARG A 60 9.214 8.803 -5.240 1.00 0.00 C ATOM 939 CG ARG A 60 10.278 9.746 -4.703 1.00 0.00 C ATOM 940 CD ARG A 60 10.327 11.045 -5.493 1.00 0.00 C ATOM 941 NE ARG A 60 11.698 11.470 -5.764 1.00 0.00 N ATOM 942 CZ ARG A 60 12.013 12.509 -6.534 1.00 0.00 C ATOM 943 NH1 ARG A 60 11.060 13.230 -7.111 1.00 0.00 N ATOM 944 NH2 ARG A 60 13.286 12.827 -6.729 1.00 0.00 N ATOM 0 H ARG A 60 8.632 6.216 -4.653 1.00 0.00 H new ATOM 0 HA ARG A 60 8.416 8.815 -3.244 1.00 0.00 H new ATOM 0 HB2 ARG A 60 9.700 7.983 -5.768 1.00 0.00 H new ATOM 0 HB3 ARG A 60 8.604 9.335 -5.971 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.075 9.965 -3.655 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.252 9.258 -4.744 1.00 0.00 H new ATOM 0 HD2 ARG A 60 9.794 10.916 -6.435 1.00 0.00 H new ATOM 0 HD3 ARG A 60 9.808 11.827 -4.938 1.00 0.00 H new ATOM 0 HE ARG A 60 12.458 10.940 -5.338 1.00 0.00 H new ATOM 0 HH11 ARG A 60 10.080 12.989 -6.966 1.00 0.00 H new ATOM 0 HH12 ARG A 60 11.308 14.025 -7.700 1.00 0.00 H new ATOM 0 HH21 ARG A 60 14.023 12.275 -6.289 1.00 0.00 H new ATOM 0 HH22 ARG A 60 13.528 13.623 -7.319 1.00 0.00 H new ATOM 958 N THR A 61 6.562 7.763 -5.779 1.00 0.00 N ATOM 959 CA THR A 61 5.208 7.771 -6.320 1.00 0.00 C ATOM 960 C THR A 61 4.536 6.415 -6.127 1.00 0.00 C ATOM 961 O THR A 61 5.022 5.396 -6.617 1.00 0.00 O ATOM 962 CB THR A 61 5.231 8.135 -7.806 1.00 0.00 C ATOM 963 OG1 THR A 61 6.002 9.303 -8.024 1.00 0.00 O ATOM 964 CG2 THR A 61 3.854 8.379 -8.384 1.00 0.00 C ATOM 0 H THR A 61 7.253 7.312 -6.379 1.00 0.00 H new ATOM 0 HA THR A 61 4.633 8.522 -5.778 1.00 0.00 H new ATOM 0 HB THR A 61 5.670 7.273 -8.308 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.006 9.519 -8.980 1.00 0.00 H new ATOM 0 HG21 THR A 61 3.943 8.632 -9.440 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.249 7.478 -8.276 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.377 9.202 -7.852 1.00 0.00 H new ATOM 972 N ILE A 62 3.418 6.412 -5.410 1.00 0.00 N ATOM 973 CA ILE A 62 2.679 5.181 -5.152 1.00 0.00 C ATOM 974 C ILE A 62 1.411 5.117 -5.997 1.00 0.00 C ATOM 975 O ILE A 62 0.401 5.739 -5.666 1.00 0.00 O ATOM 976 CB ILE A 62 2.301 5.053 -3.664 1.00 0.00 C ATOM 977 CG1 ILE A 62 3.532 5.263 -2.780 1.00 0.00 C ATOM 978 CG2 ILE A 62 1.672 3.695 -3.391 1.00 0.00 C ATOM 979 CD1 ILE A 62 3.250 6.071 -1.532 1.00 0.00 C ATOM 0 H ILE A 62 3.003 7.247 -4.997 1.00 0.00 H new ATOM 0 HA ILE A 62 3.335 4.354 -5.422 1.00 0.00 H new ATOM 0 HB ILE A 62 1.570 5.825 -3.424 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.932 4.291 -2.491 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.305 5.765 -3.361 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.411 3.621 -2.335 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.773 3.582 -3.996 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.381 2.908 -3.646 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.168 6.180 -0.954 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.879 7.057 -1.813 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.500 5.559 -0.929 1.00 0.00 H new ATOM 991 N TYR A 63 1.470 4.362 -7.088 1.00 0.00 N ATOM 992 CA TYR A 63 0.326 4.217 -7.981 1.00 0.00 C ATOM 993 C TYR A 63 -0.710 3.269 -7.388 1.00 0.00 C ATOM 994 O TYR A 63 -0.403 2.474 -6.500 1.00 0.00 O ATOM 995 CB TYR A 63 0.780 3.705 -9.349 1.00 0.00 C ATOM 996 CG TYR A 63 1.877 4.538 -9.973 1.00 0.00 C ATOM 997 CD1 TYR A 63 3.214 4.278 -9.700 1.00 0.00 C ATOM 998 CD2 TYR A 63 1.575 5.584 -10.836 1.00 0.00 C ATOM 999 CE1 TYR A 63 4.219 5.037 -10.268 1.00 0.00 C ATOM 1000 CE2 TYR A 63 2.575 6.348 -11.409 1.00 0.00 C ATOM 1001 CZ TYR A 63 3.895 6.070 -11.121 1.00 0.00 C ATOM 1002 OH TYR A 63 4.893 6.829 -11.689 1.00 0.00 O ATOM 0 H TYR A 63 2.298 3.841 -7.376 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.133 5.198 -8.103 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.129 2.678 -9.246 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -0.077 3.684 -10.023 1.00 0.00 H new ATOM 0 HD1 TYR A 63 3.472 3.469 -9.033 1.00 0.00 H new ATOM 0 HD2 TYR A 63 0.542 5.804 -11.063 1.00 0.00 H new ATOM 0 HE1 TYR A 63 5.254 4.822 -10.045 1.00 0.00 H new ATOM 0 HE2 TYR A 63 2.324 7.158 -12.078 1.00 0.00 H new ATOM 0 HH TYR A 63 4.495 7.515 -12.265 1.00 0.00 H new ATOM 1012 N THR A 64 -1.940 3.357 -7.886 1.00 0.00 N ATOM 1013 CA THR A 64 -3.022 2.506 -7.406 1.00 0.00 C ATOM 1014 C THR A 64 -2.805 1.058 -7.834 1.00 0.00 C ATOM 1015 O THR A 64 -1.819 0.738 -8.497 1.00 0.00 O ATOM 1016 CB THR A 64 -4.366 3.010 -7.934 1.00 0.00 C ATOM 1017 OG1 THR A 64 -4.415 2.924 -9.346 1.00 0.00 O ATOM 1018 CG2 THR A 64 -4.659 4.445 -7.551 1.00 0.00 C ATOM 0 H THR A 64 -2.211 4.009 -8.622 1.00 0.00 H new ATOM 0 HA THR A 64 -3.028 2.547 -6.317 1.00 0.00 H new ATOM 0 HB THR A 64 -5.116 2.367 -7.474 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.283 3.249 -9.664 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.627 4.740 -7.957 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.678 4.535 -6.465 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.883 5.095 -7.955 1.00 0.00 H new ATOM 1026 N ILE A 65 -3.732 0.188 -7.449 1.00 0.00 N ATOM 1027 CA ILE A 65 -3.642 -1.226 -7.794 1.00 0.00 C ATOM 1028 C ILE A 65 -3.725 -1.432 -9.304 1.00 0.00 C ATOM 1029 O ILE A 65 -3.186 -2.400 -9.839 1.00 0.00 O ATOM 1030 CB ILE A 65 -4.754 -2.045 -7.107 1.00 0.00 C ATOM 1031 CG1 ILE A 65 -4.573 -3.540 -7.391 1.00 0.00 C ATOM 1032 CG2 ILE A 65 -6.128 -1.570 -7.564 1.00 0.00 C ATOM 1033 CD1 ILE A 65 -4.468 -4.384 -6.139 1.00 0.00 C ATOM 0 H ILE A 65 -4.554 0.437 -6.898 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.673 -1.577 -7.438 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.682 -1.891 -6.030 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.414 -3.893 -7.988 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.674 -3.681 -7.991 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.900 -2.159 -7.069 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -6.253 -0.518 -7.307 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.215 -1.692 -8.644 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.341 -5.431 -6.415 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -3.610 -4.058 -5.551 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.377 -4.272 -5.548 1.00 0.00 H new ATOM 1045 N ASP A 66 -4.405 -0.515 -9.986 1.00 0.00 N ATOM 1046 CA ASP A 66 -4.558 -0.598 -11.434 1.00 0.00 C ATOM 1047 C ASP A 66 -3.363 0.029 -12.144 1.00 0.00 C ATOM 1048 O ASP A 66 -2.814 -0.547 -13.085 1.00 0.00 O ATOM 1049 CB ASP A 66 -5.852 0.093 -11.871 1.00 0.00 C ATOM 1050 CG ASP A 66 -6.698 -0.783 -12.773 1.00 0.00 C ATOM 1051 OD1 ASP A 66 -6.856 -1.982 -12.458 1.00 0.00 O ATOM 1052 OD2 ASP A 66 -7.205 -0.271 -13.794 1.00 0.00 O ATOM 0 H ASP A 66 -4.858 0.293 -9.559 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.607 -1.651 -11.711 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.430 0.367 -10.989 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.608 1.019 -12.392 1.00 0.00 H new ATOM 1057 N GLY A 67 -2.962 1.211 -11.688 1.00 0.00 N ATOM 1058 CA GLY A 67 -1.834 1.896 -12.291 1.00 0.00 C ATOM 1059 C GLY A 67 -2.251 3.127 -13.072 1.00 0.00 C ATOM 1060 O GLY A 67 -1.701 3.411 -14.136 1.00 0.00 O ATOM 0 H GLY A 67 -3.399 1.707 -10.911 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.130 2.186 -11.511 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.309 1.209 -12.955 1.00 0.00 H new ATOM 1064 N LEU A 68 -3.227 3.860 -12.544 1.00 0.00 N ATOM 1065 CA LEU A 68 -3.718 5.066 -13.199 1.00 0.00 C ATOM 1066 C LEU A 68 -3.504 6.291 -12.314 1.00 0.00 C ATOM 1067 O LEU A 68 -2.973 7.307 -12.761 1.00 0.00 O ATOM 1068 CB LEU A 68 -5.203 4.921 -13.538 1.00 0.00 C ATOM 1069 CG LEU A 68 -5.543 3.754 -14.467 1.00 0.00 C ATOM 1070 CD1 LEU A 68 -7.047 3.641 -14.653 1.00 0.00 C ATOM 1071 CD2 LEU A 68 -4.849 3.924 -15.810 1.00 0.00 C ATOM 0 H LEU A 68 -3.693 3.639 -11.664 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.154 5.203 -14.122 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -5.762 4.802 -12.610 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.547 5.846 -14.001 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.185 2.832 -14.009 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -7.270 2.806 -15.317 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -7.522 3.473 -13.686 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -7.430 4.563 -15.090 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -5.102 3.085 -16.459 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.178 4.854 -16.274 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -3.770 3.955 -15.661 1.00 0.00 H new ATOM 1083 N LYS A 69 -3.918 6.184 -11.056 1.00 0.00 N ATOM 1084 CA LYS A 69 -3.773 7.282 -10.107 1.00 0.00 C ATOM 1085 C LYS A 69 -2.519 7.102 -9.257 1.00 0.00 C ATOM 1086 O LYS A 69 -2.118 5.978 -8.954 1.00 0.00 O ATOM 1087 CB LYS A 69 -5.006 7.372 -9.206 1.00 0.00 C ATOM 1088 CG LYS A 69 -6.011 8.421 -9.655 1.00 0.00 C ATOM 1089 CD LYS A 69 -5.569 9.821 -9.260 1.00 0.00 C ATOM 1090 CE LYS A 69 -4.943 10.561 -10.432 1.00 0.00 C ATOM 1091 NZ LYS A 69 -3.719 11.307 -10.028 1.00 0.00 N ATOM 0 H LYS A 69 -4.357 5.348 -10.670 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.678 8.209 -10.673 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.497 6.399 -9.177 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.687 7.598 -8.189 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.134 8.369 -10.737 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.984 8.207 -9.213 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.426 10.383 -8.890 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.851 9.760 -8.442 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.691 9.849 -11.218 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.670 11.256 -10.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.639 12.175 -10.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.781 11.556 -9.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -2.881 10.711 -10.187 1.00 0.00 H new ATOM 1105 N LYS A 70 -1.903 8.217 -8.877 1.00 0.00 N ATOM 1106 CA LYS A 70 -0.695 8.182 -8.061 1.00 0.00 C ATOM 1107 C LYS A 70 -0.912 8.905 -6.736 1.00 0.00 C ATOM 1108 O LYS A 70 -1.033 10.130 -6.697 1.00 0.00 O ATOM 1109 CB LYS A 70 0.474 8.817 -8.815 1.00 0.00 C ATOM 1110 CG LYS A 70 0.156 10.189 -9.388 1.00 0.00 C ATOM 1111 CD LYS A 70 1.324 11.150 -9.220 1.00 0.00 C ATOM 1112 CE LYS A 70 1.583 11.942 -10.491 1.00 0.00 C ATOM 1113 NZ LYS A 70 2.992 12.420 -10.570 1.00 0.00 N ATOM 0 H LYS A 70 -2.220 9.155 -9.121 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.459 7.139 -7.851 1.00 0.00 H new ATOM 0 HB2 LYS A 70 1.326 8.903 -8.141 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.775 8.154 -9.627 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.089 10.094 -10.446 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.725 10.596 -8.892 1.00 0.00 H new ATOM 0 HD2 LYS A 70 1.116 11.836 -8.399 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.220 10.591 -8.950 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.362 11.320 -11.358 1.00 0.00 H new ATOM 0 HE3 LYS A 70 0.907 12.796 -10.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.128 12.956 -11.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 3.196 13.034 -9.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 3.637 11.604 -10.558 1.00 0.00 H new ATOM 1127 N ILE A 71 -0.963 8.139 -5.651 1.00 0.00 N ATOM 1128 CA ILE A 71 -1.167 8.706 -4.324 1.00 0.00 C ATOM 1129 C ILE A 71 0.043 9.525 -3.884 1.00 0.00 C ATOM 1130 O ILE A 71 1.167 9.026 -3.858 1.00 0.00 O ATOM 1131 CB ILE A 71 -1.436 7.608 -3.277 1.00 0.00 C ATOM 1132 CG1 ILE A 71 -2.529 6.658 -3.770 1.00 0.00 C ATOM 1133 CG2 ILE A 71 -1.829 8.230 -1.944 1.00 0.00 C ATOM 1134 CD1 ILE A 71 -3.833 7.353 -4.096 1.00 0.00 C ATOM 0 H ILE A 71 -0.866 7.124 -5.665 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.040 9.356 -4.390 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.521 7.034 -3.132 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.172 6.137 -4.659 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.711 5.900 -3.008 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -2.016 7.441 -1.215 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.021 8.869 -1.588 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.732 8.826 -2.073 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.561 6.618 -4.439 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -4.213 7.851 -3.204 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -3.666 8.091 -4.880 1.00 0.00 H new ATOM 1146 N SER A 72 -0.197 10.786 -3.540 1.00 0.00 N ATOM 1147 CA SER A 72 0.872 11.675 -3.101 1.00 0.00 C ATOM 1148 C SER A 72 0.494 12.380 -1.801 1.00 0.00 C ATOM 1149 O SER A 72 0.930 13.502 -1.543 1.00 0.00 O ATOM 1150 CB SER A 72 1.181 12.710 -4.184 1.00 0.00 C ATOM 1151 OG SER A 72 2.387 13.398 -3.904 1.00 0.00 O ATOM 0 H SER A 72 -1.122 11.215 -3.557 1.00 0.00 H new ATOM 0 HA SER A 72 1.761 11.071 -2.921 1.00 0.00 H new ATOM 0 HB2 SER A 72 1.257 12.216 -5.152 1.00 0.00 H new ATOM 0 HB3 SER A 72 0.360 13.423 -4.254 1.00 0.00 H new ATOM 0 HG SER A 72 2.355 13.756 -2.992 1.00 0.00 H new ATOM 1157 N SER A 73 -0.318 11.713 -0.986 1.00 0.00 N ATOM 1158 CA SER A 73 -0.754 12.276 0.287 1.00 0.00 C ATOM 1159 C SER A 73 -1.345 11.194 1.185 1.00 0.00 C ATOM 1160 O SER A 73 -1.302 10.008 0.856 1.00 0.00 O ATOM 1161 CB SER A 73 -1.786 13.381 0.054 1.00 0.00 C ATOM 1162 OG SER A 73 -1.376 14.251 -0.988 1.00 0.00 O ATOM 0 H SER A 73 -0.687 10.783 -1.184 1.00 0.00 H new ATOM 0 HA SER A 73 0.117 12.702 0.785 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.749 12.936 -0.197 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.928 13.950 0.973 1.00 0.00 H new ATOM 0 HG SER A 73 -0.409 14.398 -0.930 1.00 0.00 H new ATOM 1168 N LEU A 74 -1.900 11.610 2.318 1.00 0.00 N ATOM 1169 CA LEU A 74 -2.502 10.677 3.262 1.00 0.00 C ATOM 1170 C LEU A 74 -4.021 10.667 3.124 1.00 0.00 C ATOM 1171 O LEU A 74 -4.655 9.615 3.207 1.00 0.00 O ATOM 1172 CB LEU A 74 -2.111 11.045 4.696 1.00 0.00 C ATOM 1173 CG LEU A 74 -0.611 11.006 4.988 1.00 0.00 C ATOM 1174 CD1 LEU A 74 -0.321 11.584 6.365 1.00 0.00 C ATOM 1175 CD2 LEU A 74 -0.086 9.582 4.884 1.00 0.00 C ATOM 0 H LEU A 74 -1.945 12.588 2.605 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.128 9.679 3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.482 12.047 4.912 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.617 10.364 5.380 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.098 11.617 4.245 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.752 11.548 6.556 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.662 12.618 6.405 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.844 11.000 7.122 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.983 9.572 5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.604 8.950 5.605 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.261 9.202 3.877 1.00 0.00 H new ATOM 1187 N ASP A 75 -4.597 11.846 2.910 1.00 0.00 N ATOM 1188 CA ASP A 75 -6.042 11.973 2.759 1.00 0.00 C ATOM 1189 C ASP A 75 -6.506 11.361 1.440 1.00 0.00 C ATOM 1190 O ASP A 75 -7.621 10.847 1.342 1.00 0.00 O ATOM 1191 CB ASP A 75 -6.455 13.446 2.828 1.00 0.00 C ATOM 1192 CG ASP A 75 -7.048 13.818 4.172 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -7.712 12.957 4.787 1.00 0.00 O ATOM 1194 OD2 ASP A 75 -6.848 14.970 4.610 1.00 0.00 O ATOM 0 H ASP A 75 -4.086 12.726 2.837 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.518 11.432 3.576 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.586 14.074 2.631 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.182 13.654 2.043 1.00 0.00 H new ATOM 1199 N GLN A 76 -5.645 11.420 0.431 1.00 0.00 N ATOM 1200 CA GLN A 76 -5.966 10.873 -0.882 1.00 0.00 C ATOM 1201 C GLN A 76 -6.259 9.378 -0.791 1.00 0.00 C ATOM 1202 O GLN A 76 -7.093 8.853 -1.529 1.00 0.00 O ATOM 1203 CB GLN A 76 -4.814 11.119 -1.857 1.00 0.00 C ATOM 1204 CG GLN A 76 -4.710 12.562 -2.325 1.00 0.00 C ATOM 1205 CD GLN A 76 -4.781 12.694 -3.834 1.00 0.00 C ATOM 1206 OE1 GLN A 76 -5.630 13.409 -4.367 1.00 0.00 O ATOM 1207 NE2 GLN A 76 -3.888 12.003 -4.531 1.00 0.00 N ATOM 0 H GLN A 76 -4.718 11.841 0.497 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.858 11.379 -1.250 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.877 10.832 -1.379 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -4.940 10.472 -2.725 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.514 13.144 -1.875 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.771 12.988 -1.971 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.202 11.423 -4.048 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.887 12.052 -5.550 1.00 0.00 H new ATOM 1216 N LEU A 77 -5.569 8.700 0.120 1.00 0.00 N ATOM 1217 CA LEU A 77 -5.756 7.265 0.307 1.00 0.00 C ATOM 1218 C LEU A 77 -7.192 6.952 0.713 1.00 0.00 C ATOM 1219 O LEU A 77 -7.966 7.852 1.039 1.00 0.00 O ATOM 1220 CB LEU A 77 -4.787 6.738 1.368 1.00 0.00 C ATOM 1221 CG LEU A 77 -3.319 6.698 0.940 1.00 0.00 C ATOM 1222 CD1 LEU A 77 -2.416 6.509 2.149 1.00 0.00 C ATOM 1223 CD2 LEU A 77 -3.091 5.589 -0.077 1.00 0.00 C ATOM 0 H LEU A 77 -4.876 9.120 0.740 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.550 6.770 -0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.873 7.361 2.259 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.095 5.732 1.652 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.070 7.650 0.472 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.375 6.483 1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.559 7.337 2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.665 5.571 2.646 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.041 5.575 -0.371 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.357 4.629 0.366 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.711 5.768 -0.955 1.00 0.00 H new ATOM 1235 N VAL A 78 -7.542 5.670 0.689 1.00 0.00 N ATOM 1236 CA VAL A 78 -8.885 5.238 1.055 1.00 0.00 C ATOM 1237 C VAL A 78 -8.843 3.977 1.912 1.00 0.00 C ATOM 1238 O VAL A 78 -8.026 3.085 1.681 1.00 0.00 O ATOM 1239 CB VAL A 78 -9.748 4.968 -0.192 1.00 0.00 C ATOM 1240 CG1 VAL A 78 -11.194 4.714 0.202 1.00 0.00 C ATOM 1241 CG2 VAL A 78 -9.650 6.128 -1.171 1.00 0.00 C ATOM 0 H VAL A 78 -6.914 4.913 0.420 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.332 6.050 1.629 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.369 4.073 -0.686 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.787 4.525 -0.693 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.245 3.847 0.860 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.588 5.587 0.721 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -10.266 5.919 -2.045 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.001 7.041 -0.690 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -8.613 6.256 -1.480 1.00 0.00 H new ATOM 1251 N GLU A 79 -9.729 3.909 2.899 1.00 0.00 N ATOM 1252 CA GLU A 79 -9.793 2.756 3.790 1.00 0.00 C ATOM 1253 C GLU A 79 -10.108 1.484 3.010 1.00 0.00 C ATOM 1254 O GLU A 79 -11.132 1.398 2.331 1.00 0.00 O ATOM 1255 CB GLU A 79 -10.849 2.980 4.874 1.00 0.00 C ATOM 1256 CG GLU A 79 -10.656 2.104 6.101 1.00 0.00 C ATOM 1257 CD GLU A 79 -11.955 1.496 6.595 1.00 0.00 C ATOM 1258 OE1 GLU A 79 -12.579 0.730 5.831 1.00 0.00 O ATOM 1259 OE2 GLU A 79 -12.347 1.787 7.744 1.00 0.00 O ATOM 0 H GLU A 79 -10.413 4.638 3.103 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.818 2.638 4.263 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.829 4.027 5.178 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -11.836 2.789 4.453 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.952 1.306 5.866 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.210 2.697 6.900 1.00 0.00 H new ATOM 1266 N GLY A 80 -9.223 0.498 3.112 1.00 0.00 N ATOM 1267 CA GLY A 80 -9.426 -0.756 2.411 1.00 0.00 C ATOM 1268 C GLY A 80 -9.140 -0.643 0.927 1.00 0.00 C ATOM 1269 O GLY A 80 -10.041 -0.796 0.101 1.00 0.00 O ATOM 0 H GLY A 80 -8.369 0.545 3.668 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.781 -1.520 2.845 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.454 -1.087 2.556 1.00 0.00 H new ATOM 1273 N GLU A 81 -7.884 -0.374 0.588 1.00 0.00 N ATOM 1274 CA GLU A 81 -7.481 -0.240 -0.808 1.00 0.00 C ATOM 1275 C GLU A 81 -6.109 -0.867 -1.041 1.00 0.00 C ATOM 1276 O GLU A 81 -5.514 -1.437 -0.127 1.00 0.00 O ATOM 1277 CB GLU A 81 -7.458 1.235 -1.215 1.00 0.00 C ATOM 1278 CG GLU A 81 -8.732 1.695 -1.904 1.00 0.00 C ATOM 1279 CD GLU A 81 -8.917 1.064 -3.270 1.00 0.00 C ATOM 1280 OE1 GLU A 81 -9.407 -0.084 -3.332 1.00 0.00 O ATOM 1281 OE2 GLU A 81 -8.570 1.716 -4.278 1.00 0.00 O ATOM 0 H GLU A 81 -7.128 -0.244 1.260 1.00 0.00 H new ATOM 0 HA GLU A 81 -8.210 -0.767 -1.423 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.294 1.846 -0.327 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.612 1.407 -1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.589 1.451 -1.276 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -8.713 2.780 -2.009 1.00 0.00 H new ATOM 1288 N SER A 82 -5.615 -0.756 -2.269 1.00 0.00 N ATOM 1289 CA SER A 82 -4.314 -1.311 -2.621 1.00 0.00 C ATOM 1290 C SER A 82 -3.566 -0.382 -3.572 1.00 0.00 C ATOM 1291 O SER A 82 -4.159 0.208 -4.474 1.00 0.00 O ATOM 1292 CB SER A 82 -4.480 -2.690 -3.263 1.00 0.00 C ATOM 1293 OG SER A 82 -5.066 -3.608 -2.356 1.00 0.00 O ATOM 0 H SER A 82 -6.096 -0.287 -3.037 1.00 0.00 H new ATOM 0 HA SER A 82 -3.731 -1.412 -1.706 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.102 -2.607 -4.154 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.508 -3.063 -3.586 1.00 0.00 H new ATOM 0 HG SER A 82 -5.163 -4.481 -2.791 1.00 0.00 H new ATOM 1299 N TYR A 83 -2.258 -0.259 -3.363 1.00 0.00 N ATOM 1300 CA TYR A 83 -1.429 0.598 -4.201 1.00 0.00 C ATOM 1301 C TYR A 83 -0.042 -0.009 -4.393 1.00 0.00 C ATOM 1302 O TYR A 83 0.463 -0.717 -3.522 1.00 0.00 O ATOM 1303 CB TYR A 83 -1.308 1.991 -3.581 1.00 0.00 C ATOM 1304 CG TYR A 83 -2.639 2.613 -3.224 1.00 0.00 C ATOM 1305 CD1 TYR A 83 -3.330 2.215 -2.087 1.00 0.00 C ATOM 1306 CD2 TYR A 83 -3.204 3.598 -4.024 1.00 0.00 C ATOM 1307 CE1 TYR A 83 -4.547 2.781 -1.758 1.00 0.00 C ATOM 1308 CE2 TYR A 83 -4.420 4.168 -3.702 1.00 0.00 C ATOM 1309 CZ TYR A 83 -5.088 3.757 -2.567 1.00 0.00 C ATOM 1310 OH TYR A 83 -6.300 4.322 -2.243 1.00 0.00 O ATOM 0 H TYR A 83 -1.751 -0.742 -2.621 1.00 0.00 H new ATOM 0 HA TYR A 83 -1.907 0.684 -5.177 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.694 1.928 -2.683 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.786 2.646 -4.279 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -2.910 1.451 -1.450 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -2.684 3.924 -4.913 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.072 2.460 -0.871 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -4.846 4.932 -4.336 1.00 0.00 H new ATOM 0 HH TYR A 83 -6.538 4.994 -2.916 1.00 0.00 H new ATOM 1320 N VAL A 84 0.568 0.273 -5.539 1.00 0.00 N ATOM 1321 CA VAL A 84 1.896 -0.244 -5.846 1.00 0.00 C ATOM 1322 C VAL A 84 2.962 0.831 -5.657 1.00 0.00 C ATOM 1323 O VAL A 84 2.916 1.882 -6.295 1.00 0.00 O ATOM 1324 CB VAL A 84 1.972 -0.780 -7.289 1.00 0.00 C ATOM 1325 CG1 VAL A 84 3.313 -1.455 -7.540 1.00 0.00 C ATOM 1326 CG2 VAL A 84 0.824 -1.739 -7.565 1.00 0.00 C ATOM 0 H VAL A 84 0.164 0.857 -6.271 1.00 0.00 H new ATOM 0 HA VAL A 84 2.084 -1.064 -5.153 1.00 0.00 H new ATOM 0 HB VAL A 84 1.883 0.063 -7.974 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.347 -1.827 -8.564 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.117 -0.735 -7.388 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.437 -2.288 -6.847 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.895 -2.107 -8.589 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.878 -2.580 -6.873 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.125 -1.219 -7.431 1.00 0.00 H new ATOM 1336 N CYS A 85 3.920 0.559 -4.778 1.00 0.00 N ATOM 1337 CA CYS A 85 4.998 1.503 -4.505 1.00 0.00 C ATOM 1338 C CYS A 85 5.915 1.647 -5.716 1.00 0.00 C ATOM 1339 O CYS A 85 6.147 0.685 -6.449 1.00 0.00 O ATOM 1340 CB CYS A 85 5.807 1.047 -3.289 1.00 0.00 C ATOM 1341 SG CYS A 85 5.200 1.693 -1.714 1.00 0.00 S ATOM 0 H CYS A 85 3.972 -0.307 -4.242 1.00 0.00 H new ATOM 0 HA CYS A 85 4.552 2.475 -4.293 1.00 0.00 H new ATOM 0 HB2 CYS A 85 5.800 -0.042 -3.249 1.00 0.00 H new ATOM 0 HB3 CYS A 85 6.844 1.355 -3.420 1.00 0.00 H new ATOM 0 HG CYS A 85 6.060 1.429 -0.776 1.00 0.00 H new ATOM 1347 N GLY A 86 6.433 2.853 -5.919 1.00 0.00 N ATOM 1348 CA GLY A 86 7.318 3.101 -7.042 1.00 0.00 C ATOM 1349 C GLY A 86 8.325 4.198 -6.755 1.00 0.00 C ATOM 1350 O GLY A 86 8.018 5.164 -6.055 1.00 0.00 O ATOM 0 H GLY A 86 6.256 3.664 -5.326 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.848 2.182 -7.293 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.725 3.375 -7.914 1.00 0.00 H new ATOM 1354 N SER A 87 9.530 4.050 -7.296 1.00 0.00 N ATOM 1355 CA SER A 87 10.584 5.036 -7.094 1.00 0.00 C ATOM 1356 C SER A 87 10.905 5.766 -8.395 1.00 0.00 C ATOM 1357 O SER A 87 10.651 6.963 -8.524 1.00 0.00 O ATOM 1358 CB SER A 87 11.845 4.361 -6.551 1.00 0.00 C ATOM 1359 OG SER A 87 12.589 5.250 -5.735 1.00 0.00 O ATOM 0 H SER A 87 9.800 3.257 -7.877 1.00 0.00 H new ATOM 0 HA SER A 87 10.228 5.766 -6.367 1.00 0.00 H new ATOM 0 HB2 SER A 87 11.569 3.478 -5.974 1.00 0.00 H new ATOM 0 HB3 SER A 87 12.464 4.019 -7.380 1.00 0.00 H new ATOM 0 HG SER A 87 12.990 5.948 -6.293 1.00 0.00 H new ATOM 1365 N ILE A 88 11.462 5.036 -9.356 1.00 0.00 N ATOM 1366 CA ILE A 88 11.816 5.614 -10.646 1.00 0.00 C ATOM 1367 C ILE A 88 11.713 4.576 -11.759 1.00 0.00 C ATOM 1368 O ILE A 88 12.450 4.634 -12.745 1.00 0.00 O ATOM 1369 CB ILE A 88 13.243 6.193 -10.631 1.00 0.00 C ATOM 1370 CG1 ILE A 88 14.237 5.149 -10.120 1.00 0.00 C ATOM 1371 CG2 ILE A 88 13.296 7.448 -9.772 1.00 0.00 C ATOM 1372 CD1 ILE A 88 15.557 5.159 -10.859 1.00 0.00 C ATOM 0 H ILE A 88 11.678 4.043 -9.265 1.00 0.00 H new ATOM 0 HA ILE A 88 11.108 6.420 -10.836 1.00 0.00 H new ATOM 0 HB ILE A 88 13.520 6.461 -11.650 1.00 0.00 H new ATOM 0 HG12 ILE A 88 14.422 5.323 -9.060 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.789 4.159 -10.207 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.311 7.846 -9.771 1.00 0.00 H new ATOM 0 HG22 ILE A 88 12.614 8.195 -10.177 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.001 7.203 -8.752 1.00 0.00 H new ATOM 0 HD11 ILE A 88 16.212 4.393 -10.444 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.384 4.954 -11.916 1.00 0.00 H new ATOM 0 HD13 ILE A 88 16.027 6.136 -10.751 1.00 0.00 H new ATOM 1384 N GLU A 89 10.797 3.629 -11.596 1.00 0.00 N ATOM 1385 CA GLU A 89 10.597 2.578 -12.587 1.00 0.00 C ATOM 1386 C GLU A 89 9.169 2.601 -13.126 1.00 0.00 C ATOM 1387 O GLU A 89 8.250 3.068 -12.453 1.00 0.00 O ATOM 1388 CB GLU A 89 10.901 1.208 -11.976 1.00 0.00 C ATOM 1389 CG GLU A 89 10.034 0.873 -10.774 1.00 0.00 C ATOM 1390 CD GLU A 89 10.818 0.216 -9.655 1.00 0.00 C ATOM 1391 OE1 GLU A 89 11.788 -0.512 -9.957 1.00 0.00 O ATOM 1392 OE2 GLU A 89 10.464 0.430 -8.476 1.00 0.00 O ATOM 0 H GLU A 89 10.180 3.567 -10.786 1.00 0.00 H new ATOM 0 HA GLU A 89 11.282 2.760 -13.415 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.763 0.441 -12.738 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.949 1.177 -11.678 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.569 1.785 -10.400 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.228 0.209 -11.086 1.00 0.00 H new ATOM 1399 N PRO A 90 8.964 2.094 -14.355 1.00 0.00 N ATOM 1400 CA PRO A 90 7.639 2.060 -14.983 1.00 0.00 C ATOM 1401 C PRO A 90 6.701 1.069 -14.301 1.00 0.00 C ATOM 1402 O PRO A 90 7.129 0.013 -13.836 1.00 0.00 O ATOM 1403 CB PRO A 90 7.936 1.616 -16.418 1.00 0.00 C ATOM 1404 CG PRO A 90 9.215 0.859 -16.323 1.00 0.00 C ATOM 1405 CD PRO A 90 10.005 1.516 -15.226 1.00 0.00 C ATOM 0 HA PRO A 90 7.132 3.023 -14.918 1.00 0.00 H new ATOM 0 HB2 PRO A 90 7.135 0.991 -16.813 1.00 0.00 H new ATOM 0 HB3 PRO A 90 8.031 2.472 -17.086 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.031 -0.191 -16.096 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.758 0.891 -17.268 1.00 0.00 H new ATOM 0 HD2 PRO A 90 10.624 0.796 -14.690 1.00 0.00 H new ATOM 0 HD3 PRO A 90 10.674 2.283 -15.616 1.00 0.00 H new ATOM 1413 N PHE A 91 5.420 1.417 -14.247 1.00 0.00 N ATOM 1414 CA PHE A 91 4.420 0.559 -13.623 1.00 0.00 C ATOM 1415 C PHE A 91 4.345 -0.792 -14.327 1.00 0.00 C ATOM 1416 O PHE A 91 4.054 -0.866 -15.521 1.00 0.00 O ATOM 1417 CB PHE A 91 3.049 1.236 -13.646 1.00 0.00 C ATOM 1418 CG PHE A 91 2.026 0.553 -12.784 1.00 0.00 C ATOM 1419 CD1 PHE A 91 1.514 -0.684 -13.141 1.00 0.00 C ATOM 1420 CD2 PHE A 91 1.576 1.149 -11.616 1.00 0.00 C ATOM 1421 CE1 PHE A 91 0.573 -1.315 -12.350 1.00 0.00 C ATOM 1422 CE2 PHE A 91 0.636 0.523 -10.821 1.00 0.00 C ATOM 1423 CZ PHE A 91 0.133 -0.711 -11.188 1.00 0.00 C ATOM 0 H PHE A 91 5.050 2.288 -14.628 1.00 0.00 H new ATOM 0 HA PHE A 91 4.717 0.393 -12.588 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.158 2.269 -13.316 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.685 1.266 -14.673 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.854 -1.161 -14.048 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.965 2.114 -11.325 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.182 -2.279 -12.640 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.294 0.997 -9.913 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.602 -1.202 -10.568 1.00 0.00 H new ATOM 1433 N LYS A 92 4.609 -1.860 -13.581 1.00 0.00 N ATOM 1434 CA LYS A 92 4.572 -3.208 -14.133 1.00 0.00 C ATOM 1435 C LYS A 92 3.216 -3.862 -13.882 1.00 0.00 C ATOM 1436 O LYS A 92 2.753 -3.935 -12.743 1.00 0.00 O ATOM 1437 CB LYS A 92 5.684 -4.063 -13.524 1.00 0.00 C ATOM 1438 CG LYS A 92 7.081 -3.548 -13.826 1.00 0.00 C ATOM 1439 CD LYS A 92 8.100 -4.086 -12.833 1.00 0.00 C ATOM 1440 CE LYS A 92 9.356 -3.231 -12.805 1.00 0.00 C ATOM 1441 NZ LYS A 92 9.167 -1.989 -12.004 1.00 0.00 N ATOM 0 H LYS A 92 4.851 -1.817 -12.591 1.00 0.00 H new ATOM 0 HA LYS A 92 4.727 -3.137 -15.210 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.547 -4.106 -12.443 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.593 -5.083 -13.898 1.00 0.00 H new ATOM 0 HG2 LYS A 92 7.367 -3.840 -14.837 1.00 0.00 H new ATOM 0 HG3 LYS A 92 7.083 -2.458 -13.796 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.658 -4.117 -11.837 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.362 -5.110 -13.098 1.00 0.00 H new ATOM 0 HE2 LYS A 92 10.180 -3.810 -12.387 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.637 -2.966 -13.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.075 -1.706 -11.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.819 -1.227 -12.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.475 -2.165 -11.248 1.00 0.00 H new ATOM 1455 N LYS A 93 2.586 -4.336 -14.952 1.00 0.00 N ATOM 1456 CA LYS A 93 1.284 -4.985 -14.847 1.00 0.00 C ATOM 1457 C LYS A 93 1.433 -6.431 -14.386 1.00 0.00 C ATOM 1458 O LYS A 93 1.868 -7.294 -15.148 1.00 0.00 O ATOM 1459 CB LYS A 93 0.556 -4.934 -16.193 1.00 0.00 C ATOM 1460 CG LYS A 93 -0.612 -3.962 -16.215 1.00 0.00 C ATOM 1461 CD LYS A 93 -1.552 -4.248 -17.375 1.00 0.00 C ATOM 1462 CE LYS A 93 -2.735 -5.100 -16.942 1.00 0.00 C ATOM 1463 NZ LYS A 93 -4.028 -4.383 -17.112 1.00 0.00 N ATOM 0 H LYS A 93 2.956 -4.283 -15.901 1.00 0.00 H new ATOM 0 HA LYS A 93 0.695 -4.447 -14.104 1.00 0.00 H new ATOM 0 HB2 LYS A 93 1.266 -4.653 -16.971 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.192 -5.932 -16.438 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.161 -4.029 -15.276 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.236 -2.942 -16.293 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.913 -3.308 -17.791 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.006 -4.759 -18.168 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -2.751 -6.021 -17.525 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.613 -5.386 -15.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.809 -4.998 -16.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.023 -3.517 -16.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.157 -4.132 -18.113 1.00 0.00 H new ATOM 1477 N LEU A 94 1.072 -6.688 -13.133 1.00 0.00 N ATOM 1478 CA LEU A 94 1.165 -8.030 -12.570 1.00 0.00 C ATOM 1479 C LEU A 94 -0.076 -8.364 -11.749 1.00 0.00 C ATOM 1480 O LEU A 94 -0.804 -7.472 -11.314 1.00 0.00 O ATOM 1481 CB LEU A 94 2.417 -8.154 -11.699 1.00 0.00 C ATOM 1482 CG LEU A 94 3.742 -7.945 -12.437 1.00 0.00 C ATOM 1483 CD1 LEU A 94 4.735 -7.206 -11.554 1.00 0.00 C ATOM 1484 CD2 LEU A 94 4.316 -9.280 -12.886 1.00 0.00 C ATOM 0 H LEU A 94 0.712 -5.984 -12.488 1.00 0.00 H new ATOM 0 HA LEU A 94 1.233 -8.739 -13.395 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.351 -7.428 -10.889 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.426 -9.143 -11.241 1.00 0.00 H new ATOM 0 HG LEU A 94 3.552 -7.337 -13.321 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.670 -7.067 -12.096 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.326 -6.233 -11.281 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.922 -7.787 -10.651 1.00 0.00 H new ATOM 0 HD21 LEU A 94 5.258 -9.114 -13.409 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.491 -9.912 -12.015 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.611 -9.772 -13.556 1.00 0.00 H new ATOM 1496 N GLU A 95 -0.311 -9.656 -11.538 1.00 0.00 N ATOM 1497 CA GLU A 95 -1.465 -10.108 -10.769 1.00 0.00 C ATOM 1498 C GLU A 95 -1.142 -10.157 -9.279 1.00 0.00 C ATOM 1499 O GLU A 95 -0.552 -11.123 -8.794 1.00 0.00 O ATOM 1500 CB GLU A 95 -1.916 -11.488 -11.250 1.00 0.00 C ATOM 1501 CG GLU A 95 -2.732 -11.448 -12.533 1.00 0.00 C ATOM 1502 CD GLU A 95 -2.327 -12.530 -13.515 1.00 0.00 C ATOM 1503 OE1 GLU A 95 -2.427 -13.723 -13.159 1.00 0.00 O ATOM 1504 OE2 GLU A 95 -1.908 -12.183 -14.640 1.00 0.00 O ATOM 0 H GLU A 95 0.282 -10.408 -11.889 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.274 -9.394 -10.923 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.038 -12.114 -11.407 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.508 -11.961 -10.467 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.789 -11.559 -12.291 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.614 -10.472 -13.004 1.00 0.00 H new ATOM 1511 N TYR A 96 -1.531 -9.110 -8.560 1.00 0.00 N ATOM 1512 CA TYR A 96 -1.282 -9.034 -7.124 1.00 0.00 C ATOM 1513 C TYR A 96 -2.440 -9.641 -6.337 1.00 0.00 C ATOM 1514 O TYR A 96 -2.234 -10.469 -5.451 1.00 0.00 O ATOM 1515 CB TYR A 96 -1.071 -7.580 -6.699 1.00 0.00 C ATOM 1516 CG TYR A 96 0.137 -6.931 -7.337 1.00 0.00 C ATOM 1517 CD1 TYR A 96 1.420 -7.220 -6.893 1.00 0.00 C ATOM 1518 CD2 TYR A 96 -0.007 -6.030 -8.385 1.00 0.00 C ATOM 1519 CE1 TYR A 96 2.526 -6.629 -7.473 1.00 0.00 C ATOM 1520 CE2 TYR A 96 1.094 -5.434 -8.970 1.00 0.00 C ATOM 1521 CZ TYR A 96 2.358 -5.737 -8.511 1.00 0.00 C ATOM 1522 OH TYR A 96 3.457 -5.148 -9.091 1.00 0.00 O ATOM 0 H TYR A 96 -2.020 -8.303 -8.947 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.379 -9.605 -6.907 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -1.960 -7.003 -6.954 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -0.965 -7.539 -5.615 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.556 -7.919 -6.081 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -0.996 -5.792 -8.748 1.00 0.00 H new ATOM 0 HE1 TYR A 96 3.517 -6.865 -7.115 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.965 -4.734 -9.783 1.00 0.00 H new ATOM 0 HH TYR A 96 4.140 -4.985 -8.407 1.00 0.00 H new ATOM 1532 N THR A 97 -3.658 -9.222 -6.668 1.00 0.00 N ATOM 1533 CA THR A 97 -4.850 -9.723 -5.993 1.00 0.00 C ATOM 1534 C THR A 97 -4.961 -11.239 -6.127 1.00 0.00 C ATOM 1535 O THR A 97 -5.552 -11.905 -5.276 1.00 0.00 O ATOM 1536 CB THR A 97 -6.102 -9.056 -6.564 1.00 0.00 C ATOM 1537 OG1 THR A 97 -6.222 -9.320 -7.951 1.00 0.00 O ATOM 1538 CG2 THR A 97 -6.118 -7.554 -6.380 1.00 0.00 C ATOM 0 H THR A 97 -3.845 -8.537 -7.400 1.00 0.00 H new ATOM 0 HA THR A 97 -4.765 -9.478 -4.934 1.00 0.00 H new ATOM 0 HB THR A 97 -6.936 -9.482 -6.006 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.030 -8.887 -8.298 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.033 -7.145 -6.808 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.077 -7.317 -5.317 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.256 -7.117 -6.883 1.00 0.00 H new ATOM 1546 N LYS A 98 -4.391 -11.780 -7.200 1.00 0.00 N ATOM 1547 CA LYS A 98 -4.430 -13.218 -7.444 1.00 0.00 C ATOM 1548 C LYS A 98 -3.844 -13.990 -6.264 1.00 0.00 C ATOM 1549 O LYS A 98 -4.234 -15.126 -6.000 1.00 0.00 O ATOM 1550 CB LYS A 98 -3.662 -13.560 -8.723 1.00 0.00 C ATOM 1551 CG LYS A 98 -3.867 -14.992 -9.190 1.00 0.00 C ATOM 1552 CD LYS A 98 -2.543 -15.720 -9.361 1.00 0.00 C ATOM 1553 CE LYS A 98 -2.644 -17.172 -8.919 1.00 0.00 C ATOM 1554 NZ LYS A 98 -3.829 -17.852 -9.512 1.00 0.00 N ATOM 0 H LYS A 98 -3.897 -11.244 -7.914 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.473 -13.511 -7.563 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.972 -12.880 -9.516 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.599 -13.390 -8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.486 -15.526 -8.468 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.408 -14.993 -10.136 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -2.235 -15.677 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.771 -15.215 -8.780 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.738 -17.704 -9.209 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.706 -17.217 -7.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -3.677 -18.881 -9.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -4.676 -17.626 -8.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -3.963 -17.525 -10.490 1.00 0.00 H new ATOM 1568 N ASN A 99 -2.904 -13.366 -5.561 1.00 0.00 N ATOM 1569 CA ASN A 99 -2.266 -13.995 -4.411 1.00 0.00 C ATOM 1570 C ASN A 99 -2.628 -13.267 -3.121 1.00 0.00 C ATOM 1571 O ASN A 99 -1.835 -13.218 -2.180 1.00 0.00 O ATOM 1572 CB ASN A 99 -0.747 -14.012 -4.591 1.00 0.00 C ATOM 1573 CG ASN A 99 -0.331 -14.534 -5.952 1.00 0.00 C ATOM 1574 OD1 ASN A 99 -0.494 -15.716 -6.254 1.00 0.00 O ATOM 1575 ND2 ASN A 99 0.211 -13.651 -6.784 1.00 0.00 N ATOM 0 H ASN A 99 -2.568 -12.426 -5.768 1.00 0.00 H new ATOM 0 HA ASN A 99 -2.629 -15.020 -4.342 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.357 -13.003 -4.457 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -0.299 -14.632 -3.815 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.510 -13.944 -7.714 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.328 -12.680 -6.493 1.00 0.00 H new ATOM 1582 N VAL A 100 -3.831 -12.702 -3.083 1.00 0.00 N ATOM 1583 CA VAL A 100 -4.298 -11.978 -1.906 1.00 0.00 C ATOM 1584 C VAL A 100 -5.669 -12.476 -1.463 1.00 0.00 C ATOM 1585 O VAL A 100 -6.429 -13.024 -2.262 1.00 0.00 O ATOM 1586 CB VAL A 100 -4.376 -10.462 -2.174 1.00 0.00 C ATOM 1587 CG1 VAL A 100 -4.718 -9.710 -0.896 1.00 0.00 C ATOM 1588 CG2 VAL A 100 -3.070 -9.953 -2.765 1.00 0.00 C ATOM 0 H VAL A 100 -4.499 -12.732 -3.853 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.574 -12.162 -1.112 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.170 -10.283 -2.899 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -4.769 -8.641 -1.105 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -5.682 -10.052 -0.519 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.949 -9.897 -0.147 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -3.146 -8.881 -2.947 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.255 -10.146 -2.067 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.871 -10.467 -3.705 1.00 0.00 H new ATOM 1598 N ASN A 101 -5.979 -12.283 -0.185 1.00 0.00 N ATOM 1599 CA ASN A 101 -7.259 -12.712 0.366 1.00 0.00 C ATOM 1600 C ASN A 101 -8.015 -11.530 0.972 1.00 0.00 C ATOM 1601 O ASN A 101 -7.488 -10.827 1.835 1.00 0.00 O ATOM 1602 CB ASN A 101 -7.042 -13.791 1.428 1.00 0.00 C ATOM 1603 CG ASN A 101 -8.206 -14.758 1.516 1.00 0.00 C ATOM 1604 OD1 ASN A 101 -9.368 -14.352 1.530 1.00 0.00 O ATOM 1605 ND2 ASN A 101 -7.899 -16.050 1.576 1.00 0.00 N ATOM 0 H ASN A 101 -5.360 -11.832 0.489 1.00 0.00 H new ATOM 0 HA ASN A 101 -7.857 -13.125 -0.446 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -6.131 -14.344 1.200 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -6.893 -13.317 2.398 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -8.640 -16.748 1.636 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -6.922 -16.343 1.562 1.00 0.00 H new ATOM 1612 N PRO A 102 -9.264 -11.291 0.530 1.00 0.00 N ATOM 1613 CA PRO A 102 -10.081 -10.186 1.041 1.00 0.00 C ATOM 1614 C PRO A 102 -10.609 -10.456 2.445 1.00 0.00 C ATOM 1615 O PRO A 102 -11.660 -11.074 2.616 1.00 0.00 O ATOM 1616 CB PRO A 102 -11.235 -10.112 0.041 1.00 0.00 C ATOM 1617 CG PRO A 102 -11.368 -11.500 -0.481 1.00 0.00 C ATOM 1618 CD PRO A 102 -9.977 -12.075 -0.498 1.00 0.00 C ATOM 0 HA PRO A 102 -9.511 -9.261 1.126 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.155 -9.779 0.521 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -11.020 -9.406 -0.761 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -12.027 -12.093 0.153 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -11.802 -11.500 -1.481 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.980 -13.139 -0.260 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -9.511 -11.969 -1.478 1.00 0.00 H new ATOM 1626 N ASN A 103 -9.874 -9.989 3.448 1.00 0.00 N ATOM 1627 CA ASN A 103 -10.268 -10.179 4.840 1.00 0.00 C ATOM 1628 C ASN A 103 -9.290 -9.485 5.782 1.00 0.00 C ATOM 1629 O ASN A 103 -8.974 -10.000 6.854 1.00 0.00 O ATOM 1630 CB ASN A 103 -10.342 -11.671 5.171 1.00 0.00 C ATOM 1631 CG ASN A 103 -11.469 -11.994 6.132 1.00 0.00 C ATOM 1632 OD1 ASN A 103 -12.559 -12.391 5.719 1.00 0.00 O ATOM 1633 ND2 ASN A 103 -11.212 -11.825 7.424 1.00 0.00 N ATOM 0 H ASN A 103 -9.001 -9.476 3.324 1.00 0.00 H new ATOM 0 HA ASN A 103 -11.253 -9.734 4.977 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.479 -12.238 4.250 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.395 -11.992 5.605 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -11.932 -12.026 8.118 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -10.295 -11.494 7.722 1.00 0.00 H new ATOM 1640 N TRP A 104 -8.814 -8.313 5.374 1.00 0.00 N ATOM 1641 CA TRP A 104 -7.872 -7.547 6.182 1.00 0.00 C ATOM 1642 C TRP A 104 -8.494 -6.236 6.654 1.00 0.00 C ATOM 1643 O TRP A 104 -8.196 -5.755 7.747 1.00 0.00 O ATOM 1644 CB TRP A 104 -6.595 -7.265 5.386 1.00 0.00 C ATOM 1645 CG TRP A 104 -6.826 -6.425 4.166 1.00 0.00 C ATOM 1646 CD1 TRP A 104 -7.490 -6.793 3.031 1.00 0.00 C ATOM 1647 CD2 TRP A 104 -6.389 -5.078 3.958 1.00 0.00 C ATOM 1648 NE1 TRP A 104 -7.494 -5.756 2.130 1.00 0.00 N ATOM 1649 CE2 TRP A 104 -6.825 -4.691 2.676 1.00 0.00 C ATOM 1650 CE3 TRP A 104 -5.674 -4.159 4.732 1.00 0.00 C ATOM 1651 CZ2 TRP A 104 -6.567 -3.427 2.151 1.00 0.00 C ATOM 1652 CZ3 TRP A 104 -5.419 -2.904 4.209 1.00 0.00 C ATOM 1653 CH2 TRP A 104 -5.866 -2.548 2.930 1.00 0.00 C ATOM 0 H TRP A 104 -9.065 -7.873 4.489 1.00 0.00 H new ATOM 0 HA TRP A 104 -7.620 -8.142 7.060 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -5.876 -6.762 6.033 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -6.146 -8.212 5.086 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.945 -7.758 2.866 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -7.924 -5.775 1.205 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -5.327 -4.424 5.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -6.908 -3.151 1.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -4.866 -2.186 4.797 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -5.653 -1.559 2.551 1.00 0.00 H new ATOM 1664 N SER A 105 -9.357 -5.662 5.822 1.00 0.00 N ATOM 1665 CA SER A 105 -10.020 -4.406 6.157 1.00 0.00 C ATOM 1666 C SER A 105 -11.536 -4.555 6.086 1.00 0.00 C ATOM 1667 O SER A 105 -12.242 -3.632 5.678 1.00 0.00 O ATOM 1668 CB SER A 105 -9.559 -3.295 5.213 1.00 0.00 C ATOM 1669 OG SER A 105 -10.005 -2.026 5.661 1.00 0.00 O ATOM 0 H SER A 105 -9.614 -6.045 4.912 1.00 0.00 H new ATOM 0 HA SER A 105 -9.748 -4.141 7.179 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.471 -3.299 5.146 1.00 0.00 H new ATOM 0 HB3 SER A 105 -9.941 -3.485 4.210 1.00 0.00 H new ATOM 0 HG SER A 105 -10.966 -2.065 5.849 1.00 0.00 H new