USER MOD reduce.3.24.130724 H: found=0, std=0, add=933, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 932 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 96 SER OG : rot -73:sc= 0.31 USER MOD Set 1.2: A 97 HIS : no HD1:sc= -1.02 X(o=-0.71,f=-1.1) USER MOD Set 2.1: A 19 ASN : amide:sc= 1.02 K(o=0.25,f=-3.1!) USER MOD Set 2.2: A 90 TYR OH : rot -36:sc= -0.771 USER MOD Set 3.1: A 56 CYS SG : rot 120:sc= 0.433 USER MOD Set 3.2: A 58 CYS SG : rot 90:sc= 1.61 USER MOD Set 3.3: A 116 CYS SG : rot 126:sc= -6.05! USER MOD Set 3.4: A 118 HIS : no HD1:sc= 0.199 X(o=-3.8,f=-4.1) USER MOD Set 4.1: A 36 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 37 ASN : amide:sc= -2.13 X(o=-2.1,f=-2.3!) USER MOD Set 5.1: A 11 TYR OH : rot -11:sc= -0.015 USER MOD Set 5.2: A 45 THR OG1 : rot 140:sc= -0.297 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 TYR OH : rot 180:sc= -0.221 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -1.17 X(o=-1.2,f=-1.1) USER MOD Single : A 29 GLN : amide:sc= -1.84 K(o=-1.8,f=-3!) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 CYS SG : rot 36:sc= -3.27! USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 18:sc= 0.124! USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc=-0.00142 X(o=-0.0014,f=0) USER MOD Single : A 50 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.188 X(o=-0.19,f=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 30:sc= -0.492 USER MOD Single : A 71 HIS : no HD1:sc= -0.362 X(o=-0.36,f=0.063) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= -0.352 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= -0.0234 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot -50:sc= 0.135 USER MOD Single : A 95 GLN : amide:sc= -8.7! C(o=-8.7!,f=-16!) USER MOD Single : A 102 THR OG1 : rot 49:sc= 0.0294 USER MOD Single : A 125 THR OG1 : rot -58:sc= -5.09! USER MOD Single : A 126 MET CE :methyl -130:sc= -1.71 (180deg=-4.44!) USER MOD ----------------------------------------------------------------- ATOM 105 N ALA A 9 4.261 -1.152 5.953 1.00 0.00 N ATOM 106 CA ALA A 9 4.033 -2.349 5.152 1.00 0.00 C ATOM 107 C ALA A 9 2.749 -3.055 5.573 1.00 0.00 C ATOM 108 O ALA A 9 2.040 -2.594 6.467 1.00 0.00 O ATOM 109 CB ALA A 9 5.221 -3.294 5.267 1.00 0.00 C ATOM 0 HA ALA A 9 3.924 -2.045 4.111 1.00 0.00 H new ATOM 0 HB1 ALA A 9 5.038 -4.184 4.664 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.121 -2.793 4.910 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.356 -3.583 6.309 1.00 0.00 H new ATOM 115 N VAL A 10 2.454 -4.175 4.921 1.00 0.00 N ATOM 116 CA VAL A 10 1.254 -4.945 5.226 1.00 0.00 C ATOM 117 C VAL A 10 1.584 -6.421 5.427 1.00 0.00 C ATOM 118 O VAL A 10 1.925 -7.124 4.476 1.00 0.00 O ATOM 119 CB VAL A 10 0.204 -4.812 4.106 1.00 0.00 C ATOM 120 CG1 VAL A 10 -1.077 -5.545 4.475 1.00 0.00 C ATOM 121 CG2 VAL A 10 -0.079 -3.347 3.811 1.00 0.00 C ATOM 0 H VAL A 10 3.030 -4.570 4.178 1.00 0.00 H new ATOM 0 HA VAL A 10 0.843 -4.539 6.150 1.00 0.00 H new ATOM 0 HB VAL A 10 0.607 -5.272 3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.803 -5.437 3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.860 -6.602 4.629 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.487 -5.122 5.392 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -0.823 -3.273 3.018 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.458 -2.861 4.710 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.841 -2.856 3.493 1.00 0.00 H new ATOM 131 N TYR A 11 1.478 -6.888 6.668 1.00 0.00 N ATOM 132 CA TYR A 11 1.763 -8.283 6.980 1.00 0.00 C ATOM 133 C TYR A 11 0.476 -9.101 6.995 1.00 0.00 C ATOM 134 O TYR A 11 -0.406 -8.875 7.824 1.00 0.00 O ATOM 135 CB TYR A 11 2.459 -8.372 8.343 1.00 0.00 C ATOM 136 CG TYR A 11 2.755 -9.783 8.804 1.00 0.00 C ATOM 137 CD1 TYR A 11 1.732 -10.644 9.184 1.00 0.00 C ATOM 138 CD2 TYR A 11 4.062 -10.250 8.867 1.00 0.00 C ATOM 139 CE1 TYR A 11 2.004 -11.930 9.611 1.00 0.00 C ATOM 140 CE2 TYR A 11 4.340 -11.534 9.294 1.00 0.00 C ATOM 141 CZ TYR A 11 3.309 -12.370 9.664 1.00 0.00 C ATOM 142 OH TYR A 11 3.584 -13.648 10.089 1.00 0.00 O ATOM 0 H TYR A 11 1.198 -6.323 7.470 1.00 0.00 H new ATOM 0 HA TYR A 11 2.420 -8.690 6.211 1.00 0.00 H new ATOM 0 HB2 TYR A 11 3.394 -7.814 8.297 1.00 0.00 H new ATOM 0 HB3 TYR A 11 1.833 -7.883 9.089 1.00 0.00 H new ATOM 0 HD1 TYR A 11 0.708 -10.303 9.145 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.874 -9.599 8.578 1.00 0.00 H new ATOM 0 HE1 TYR A 11 1.198 -12.587 9.902 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.362 -11.881 9.338 1.00 0.00 H new ATOM 0 HH TYR A 11 2.778 -14.043 10.482 1.00 0.00 H new ATOM 152 N VAL A 12 0.375 -10.056 6.076 1.00 0.00 N ATOM 153 CA VAL A 12 -0.803 -10.912 5.990 1.00 0.00 C ATOM 154 C VAL A 12 -0.441 -12.387 6.157 1.00 0.00 C ATOM 155 O VAL A 12 0.162 -12.991 5.270 1.00 0.00 O ATOM 156 CB VAL A 12 -1.549 -10.708 4.657 1.00 0.00 C ATOM 157 CG1 VAL A 12 -2.869 -11.463 4.663 1.00 0.00 C ATOM 158 CG2 VAL A 12 -1.776 -9.225 4.399 1.00 0.00 C ATOM 0 H VAL A 12 1.094 -10.257 5.381 1.00 0.00 H new ATOM 0 HA VAL A 12 -1.462 -10.623 6.809 1.00 0.00 H new ATOM 0 HB VAL A 12 -0.934 -11.106 3.850 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -3.382 -11.307 3.714 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -2.679 -12.527 4.802 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -3.494 -11.097 5.477 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.304 -9.097 3.454 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.372 -8.802 5.208 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.815 -8.713 4.350 1.00 0.00 H new ATOM 168 N GLY A 13 -0.821 -12.962 7.294 1.00 0.00 N ATOM 169 CA GLY A 13 -0.537 -14.366 7.553 1.00 0.00 C ATOM 170 C GLY A 13 0.920 -14.735 7.335 1.00 0.00 C ATOM 171 O GLY A 13 1.817 -14.118 7.910 1.00 0.00 O ATOM 0 H GLY A 13 -1.321 -12.482 8.042 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -0.814 -14.602 8.580 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -1.161 -14.981 6.905 1.00 0.00 H new ATOM 175 N ASN A 14 1.153 -15.751 6.505 1.00 0.00 N ATOM 176 CA ASN A 14 2.508 -16.213 6.215 1.00 0.00 C ATOM 177 C ASN A 14 3.117 -15.467 5.026 1.00 0.00 C ATOM 178 O ASN A 14 4.137 -15.882 4.480 1.00 0.00 O ATOM 179 CB ASN A 14 2.503 -17.718 5.934 1.00 0.00 C ATOM 180 CG ASN A 14 2.036 -18.525 7.130 1.00 0.00 C ATOM 181 OD1 ASN A 14 0.864 -18.887 7.230 1.00 0.00 O ATOM 182 ND2 ASN A 14 2.954 -18.812 8.045 1.00 0.00 N ATOM 0 H ASN A 14 0.420 -16.270 6.022 1.00 0.00 H new ATOM 0 HA ASN A 14 3.121 -16.007 7.092 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.854 -17.924 5.083 1.00 0.00 H new ATOM 0 HB3 ASN A 14 3.507 -18.036 5.653 1.00 0.00 H new ATOM 0 HD21 ASN A 14 2.699 -19.353 8.871 1.00 0.00 H new ATOM 0 HD22 ASN A 14 3.915 -18.492 7.922 1.00 0.00 H new ATOM 189 N TYR A 15 2.490 -14.360 4.640 1.00 0.00 N ATOM 190 CA TYR A 15 2.970 -13.542 3.531 1.00 0.00 C ATOM 191 C TYR A 15 3.035 -12.081 3.964 1.00 0.00 C ATOM 192 O TYR A 15 2.215 -11.630 4.764 1.00 0.00 O ATOM 193 CB TYR A 15 2.033 -13.664 2.326 1.00 0.00 C ATOM 194 CG TYR A 15 2.196 -14.932 1.513 1.00 0.00 C ATOM 195 CD1 TYR A 15 3.403 -15.619 1.460 1.00 0.00 C ATOM 196 CD2 TYR A 15 1.126 -15.438 0.791 1.00 0.00 C ATOM 197 CE1 TYR A 15 3.531 -16.774 0.712 1.00 0.00 C ATOM 198 CE2 TYR A 15 1.245 -16.589 0.042 1.00 0.00 C ATOM 199 CZ TYR A 15 2.450 -17.255 0.005 1.00 0.00 C ATOM 200 OH TYR A 15 2.575 -18.405 -0.739 1.00 0.00 O ATOM 0 H TYR A 15 1.642 -14.007 5.083 1.00 0.00 H new ATOM 0 HA TYR A 15 3.962 -13.893 3.247 1.00 0.00 H new ATOM 0 HB2 TYR A 15 1.003 -13.606 2.678 1.00 0.00 H new ATOM 0 HB3 TYR A 15 2.194 -12.808 1.671 1.00 0.00 H new ATOM 0 HD1 TYR A 15 4.253 -15.245 2.011 1.00 0.00 H new ATOM 0 HD2 TYR A 15 0.179 -14.919 0.816 1.00 0.00 H new ATOM 0 HE1 TYR A 15 4.475 -17.298 0.682 1.00 0.00 H new ATOM 0 HE2 TYR A 15 0.398 -16.966 -0.512 1.00 0.00 H new ATOM 0 HH TYR A 15 1.721 -18.607 -1.175 1.00 0.00 H new ATOM 210 N LYS A 16 3.998 -11.340 3.435 1.00 0.00 N ATOM 211 CA LYS A 16 4.140 -9.929 3.777 1.00 0.00 C ATOM 212 C LYS A 16 4.445 -9.103 2.534 1.00 0.00 C ATOM 213 O LYS A 16 5.500 -9.265 1.919 1.00 0.00 O ATOM 214 CB LYS A 16 5.246 -9.741 4.815 1.00 0.00 C ATOM 215 CG LYS A 16 5.083 -8.487 5.658 1.00 0.00 C ATOM 216 CD LYS A 16 6.428 -7.872 6.009 1.00 0.00 C ATOM 217 CE LYS A 16 6.396 -6.357 5.891 1.00 0.00 C ATOM 218 NZ LYS A 16 7.701 -5.743 6.263 1.00 0.00 N ATOM 0 H LYS A 16 4.690 -11.688 2.771 1.00 0.00 H new ATOM 0 HA LYS A 16 3.197 -9.584 4.201 1.00 0.00 H new ATOM 0 HB2 LYS A 16 5.267 -10.610 5.472 1.00 0.00 H new ATOM 0 HB3 LYS A 16 6.209 -9.703 4.305 1.00 0.00 H new ATOM 0 HG2 LYS A 16 4.479 -7.759 5.116 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.543 -8.730 6.573 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.703 -8.153 7.025 1.00 0.00 H new ATOM 0 HD3 LYS A 16 7.196 -8.273 5.348 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.142 -6.078 4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.611 -5.959 6.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.638 -4.709 6.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 7.932 -5.988 7.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.446 -6.103 5.633 1.00 0.00 H new ATOM 232 N VAL A 17 3.524 -8.216 2.161 1.00 0.00 N ATOM 233 CA VAL A 17 3.727 -7.382 0.984 1.00 0.00 C ATOM 234 C VAL A 17 4.218 -5.988 1.374 1.00 0.00 C ATOM 235 O VAL A 17 3.556 -5.265 2.119 1.00 0.00 O ATOM 236 CB VAL A 17 2.441 -7.278 0.111 1.00 0.00 C ATOM 237 CG1 VAL A 17 1.507 -8.453 0.368 1.00 0.00 C ATOM 238 CG2 VAL A 17 1.699 -5.966 0.336 1.00 0.00 C ATOM 0 H VAL A 17 2.643 -8.059 2.650 1.00 0.00 H new ATOM 0 HA VAL A 17 4.496 -7.867 0.383 1.00 0.00 H new ATOM 0 HB VAL A 17 2.767 -7.305 -0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.618 -8.354 -0.255 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.019 -9.384 0.125 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.215 -8.463 1.418 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.810 -5.938 -0.294 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.405 -5.889 1.383 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.351 -5.131 0.080 1.00 0.00 H new ATOM 248 N VAL A 18 5.385 -5.621 0.855 1.00 0.00 N ATOM 249 CA VAL A 18 5.975 -4.318 1.129 1.00 0.00 C ATOM 250 C VAL A 18 6.545 -3.702 -0.146 1.00 0.00 C ATOM 251 O VAL A 18 6.800 -4.407 -1.123 1.00 0.00 O ATOM 252 CB VAL A 18 7.087 -4.412 2.195 1.00 0.00 C ATOM 253 CG1 VAL A 18 8.238 -5.275 1.703 1.00 0.00 C ATOM 254 CG2 VAL A 18 7.578 -3.025 2.581 1.00 0.00 C ATOM 0 H VAL A 18 5.943 -6.212 0.239 1.00 0.00 H new ATOM 0 HA VAL A 18 5.179 -3.680 1.513 1.00 0.00 H new ATOM 0 HB VAL A 18 6.668 -4.885 3.083 1.00 0.00 H new ATOM 0 HG11 VAL A 18 9.009 -5.326 2.472 1.00 0.00 H new ATOM 0 HG12 VAL A 18 7.873 -6.279 1.488 1.00 0.00 H new ATOM 0 HG13 VAL A 18 8.658 -4.839 0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 18 8.362 -3.113 3.334 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.976 -2.522 1.700 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.749 -2.445 2.987 1.00 0.00 H new ATOM 264 N ASN A 19 6.756 -2.391 -0.131 1.00 0.00 N ATOM 265 CA ASN A 19 7.314 -1.700 -1.287 1.00 0.00 C ATOM 266 C ASN A 19 8.692 -2.263 -1.623 1.00 0.00 C ATOM 267 O ASN A 19 9.474 -2.583 -0.728 1.00 0.00 O ATOM 268 CB ASN A 19 7.414 -0.198 -1.014 1.00 0.00 C ATOM 269 CG ASN A 19 7.264 0.631 -2.275 1.00 0.00 C ATOM 270 OD1 ASN A 19 7.880 0.339 -3.300 1.00 0.00 O ATOM 271 ND2 ASN A 19 6.443 1.672 -2.205 1.00 0.00 N ATOM 0 H ASN A 19 6.550 -1.787 0.665 1.00 0.00 H new ATOM 0 HA ASN A 19 6.651 -1.857 -2.138 1.00 0.00 H new ATOM 0 HB2 ASN A 19 6.643 0.091 -0.299 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.376 0.021 -0.551 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.303 2.267 -3.022 1.00 0.00 H new ATOM 0 HD22 ASN A 19 5.953 1.877 -1.334 1.00 0.00 H new ATOM 278 N ARG A 20 8.986 -2.390 -2.914 1.00 0.00 N ATOM 279 CA ARG A 20 10.272 -2.924 -3.352 1.00 0.00 C ATOM 280 C ARG A 20 11.424 -2.110 -2.771 1.00 0.00 C ATOM 281 O ARG A 20 12.384 -2.664 -2.237 1.00 0.00 O ATOM 282 CB ARG A 20 10.355 -2.928 -4.880 1.00 0.00 C ATOM 283 CG ARG A 20 9.533 -4.028 -5.533 1.00 0.00 C ATOM 284 CD ARG A 20 9.540 -3.903 -7.048 1.00 0.00 C ATOM 285 NE ARG A 20 10.509 -4.802 -7.672 1.00 0.00 N ATOM 286 CZ ARG A 20 11.095 -4.568 -8.845 1.00 0.00 C ATOM 287 NH1 ARG A 20 10.802 -3.472 -9.536 1.00 0.00 N ATOM 288 NH2 ARG A 20 11.972 -5.435 -9.331 1.00 0.00 N ATOM 0 H ARG A 20 8.354 -2.132 -3.672 1.00 0.00 H new ATOM 0 HA ARG A 20 10.354 -3.949 -2.989 1.00 0.00 H new ATOM 0 HB2 ARG A 20 10.017 -1.962 -5.256 1.00 0.00 H new ATOM 0 HB3 ARG A 20 11.397 -3.040 -5.178 1.00 0.00 H new ATOM 0 HG2 ARG A 20 9.931 -5.001 -5.245 1.00 0.00 H new ATOM 0 HG3 ARG A 20 8.507 -3.983 -5.168 1.00 0.00 H new ATOM 0 HD2 ARG A 20 8.544 -4.121 -7.433 1.00 0.00 H new ATOM 0 HD3 ARG A 20 9.771 -2.874 -7.325 1.00 0.00 H new ATOM 0 HE ARG A 20 10.751 -5.661 -7.179 1.00 0.00 H new ATOM 0 HH11 ARG A 20 10.125 -2.804 -9.169 1.00 0.00 H new ATOM 0 HH12 ARG A 20 11.254 -3.299 -10.434 1.00 0.00 H new ATOM 0 HH21 ARG A 20 12.198 -6.280 -8.807 1.00 0.00 H new ATOM 0 HH22 ARG A 20 12.421 -5.257 -10.229 1.00 0.00 H new ATOM 302 N HIS A 21 11.318 -0.792 -2.866 1.00 0.00 N ATOM 303 CA HIS A 21 12.350 0.090 -2.338 1.00 0.00 C ATOM 304 C HIS A 21 12.411 0.020 -0.811 1.00 0.00 C ATOM 305 O HIS A 21 13.313 0.588 -0.195 1.00 0.00 O ATOM 306 CB HIS A 21 12.093 1.531 -2.787 1.00 0.00 C ATOM 307 CG HIS A 21 13.134 2.058 -3.727 1.00 0.00 C ATOM 308 ND1 HIS A 21 13.320 1.560 -4.999 1.00 0.00 N ATOM 309 CD2 HIS A 21 14.047 3.046 -3.573 1.00 0.00 C ATOM 310 CE1 HIS A 21 14.303 2.218 -5.587 1.00 0.00 C ATOM 311 NE2 HIS A 21 14.761 3.124 -4.744 1.00 0.00 N ATOM 0 H HIS A 21 10.531 -0.311 -3.302 1.00 0.00 H new ATOM 0 HA HIS A 21 13.311 -0.243 -2.731 1.00 0.00 H new ATOM 0 HB2 HIS A 21 11.118 1.584 -3.271 1.00 0.00 H new ATOM 0 HB3 HIS A 21 12.049 2.175 -1.908 1.00 0.00 H new ATOM 0 HD2 HIS A 21 14.188 3.658 -2.694 1.00 0.00 H new ATOM 0 HE1 HIS A 21 14.670 2.044 -6.588 1.00 0.00 H new ATOM 0 HE2 HIS A 21 15.522 3.777 -4.932 1.00 0.00 H new ATOM 320 N LEU A 22 11.447 -0.670 -0.201 1.00 0.00 N ATOM 321 CA LEU A 22 11.403 -0.794 1.251 1.00 0.00 C ATOM 322 C LEU A 22 11.604 -2.238 1.714 1.00 0.00 C ATOM 323 O LEU A 22 11.636 -2.500 2.917 1.00 0.00 O ATOM 324 CB LEU A 22 10.070 -0.266 1.784 1.00 0.00 C ATOM 325 CG LEU A 22 10.169 0.561 3.066 1.00 0.00 C ATOM 326 CD1 LEU A 22 10.318 2.039 2.738 1.00 0.00 C ATOM 327 CD2 LEU A 22 8.951 0.328 3.946 1.00 0.00 C ATOM 0 H LEU A 22 10.690 -1.149 -0.690 1.00 0.00 H new ATOM 0 HA LEU A 22 12.225 -0.199 1.650 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.603 0.344 1.011 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.408 -1.112 1.966 1.00 0.00 H new ATOM 0 HG LEU A 22 11.055 0.241 3.615 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.387 2.612 3.663 1.00 0.00 H new ATOM 0 HD12 LEU A 22 11.222 2.192 2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.452 2.374 2.167 1.00 0.00 H new ATOM 0 HD21 LEU A 22 9.039 0.925 4.854 1.00 0.00 H new ATOM 0 HD22 LEU A 22 8.050 0.620 3.406 1.00 0.00 H new ATOM 0 HD23 LEU A 22 8.890 -0.728 4.210 1.00 0.00 H new ATOM 339 N ALA A 23 11.738 -3.178 0.778 1.00 0.00 N ATOM 340 CA ALA A 23 11.930 -4.574 1.150 1.00 0.00 C ATOM 341 C ALA A 23 13.410 -4.896 1.329 1.00 0.00 C ATOM 342 O ALA A 23 14.228 -4.604 0.458 1.00 0.00 O ATOM 343 CB ALA A 23 11.302 -5.493 0.114 1.00 0.00 C ATOM 0 H ALA A 23 11.717 -3.000 -0.226 1.00 0.00 H new ATOM 0 HA ALA A 23 11.433 -4.740 2.106 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.455 -6.531 0.408 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.233 -5.289 0.047 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.767 -5.319 -0.856 1.00 0.00 H new ATOM 349 N THR A 24 13.744 -5.499 2.466 1.00 0.00 N ATOM 350 CA THR A 24 15.126 -5.861 2.761 1.00 0.00 C ATOM 351 C THR A 24 15.546 -7.077 1.946 1.00 0.00 C ATOM 352 O THR A 24 14.702 -7.801 1.420 1.00 0.00 O ATOM 353 CB THR A 24 15.293 -6.150 4.254 1.00 0.00 C ATOM 354 OG1 THR A 24 14.582 -7.318 4.622 1.00 0.00 O ATOM 355 CG2 THR A 24 14.810 -5.021 5.139 1.00 0.00 C ATOM 0 H THR A 24 13.077 -5.747 3.197 1.00 0.00 H new ATOM 0 HA THR A 24 15.765 -5.021 2.490 1.00 0.00 H new ATOM 0 HB THR A 24 16.365 -6.277 4.405 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.703 -7.486 5.580 1.00 0.00 H new ATOM 0 HG21 THR A 24 14.957 -5.290 6.185 1.00 0.00 H new ATOM 0 HG22 THR A 24 15.374 -4.116 4.915 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.750 -4.843 4.956 1.00 0.00 H new ATOM 363 N HIS A 25 16.853 -7.300 1.846 1.00 0.00 N ATOM 364 CA HIS A 25 17.377 -8.429 1.084 1.00 0.00 C ATOM 365 C HIS A 25 16.743 -9.736 1.544 1.00 0.00 C ATOM 366 O HIS A 25 16.591 -10.673 0.760 1.00 0.00 O ATOM 367 CB HIS A 25 18.897 -8.509 1.229 1.00 0.00 C ATOM 368 CG HIS A 25 19.361 -8.523 2.653 1.00 0.00 C ATOM 369 ND1 HIS A 25 19.400 -9.668 3.421 1.00 0.00 N ATOM 370 CD2 HIS A 25 19.806 -7.523 3.450 1.00 0.00 C ATOM 371 CE1 HIS A 25 19.848 -9.372 4.628 1.00 0.00 C ATOM 372 NE2 HIS A 25 20.102 -8.077 4.671 1.00 0.00 N ATOM 0 H HIS A 25 17.567 -6.716 2.282 1.00 0.00 H new ATOM 0 HA HIS A 25 17.127 -8.273 0.035 1.00 0.00 H new ATOM 0 HB2 HIS A 25 19.255 -9.409 0.730 1.00 0.00 H new ATOM 0 HB3 HIS A 25 19.348 -7.659 0.716 1.00 0.00 H new ATOM 0 HD2 HIS A 25 19.909 -6.483 3.176 1.00 0.00 H new ATOM 0 HE1 HIS A 25 19.983 -10.070 5.441 1.00 0.00 H new ATOM 0 HE2 HIS A 25 20.460 -7.570 5.480 1.00 0.00 H new ATOM 381 N VAL A 26 16.364 -9.788 2.814 1.00 0.00 N ATOM 382 CA VAL A 26 15.736 -10.976 3.370 1.00 0.00 C ATOM 383 C VAL A 26 14.332 -11.163 2.803 1.00 0.00 C ATOM 384 O VAL A 26 13.866 -12.291 2.636 1.00 0.00 O ATOM 385 CB VAL A 26 15.653 -10.903 4.906 1.00 0.00 C ATOM 386 CG1 VAL A 26 15.168 -12.226 5.478 1.00 0.00 C ATOM 387 CG2 VAL A 26 17.002 -10.521 5.496 1.00 0.00 C ATOM 0 H VAL A 26 16.481 -9.022 3.477 1.00 0.00 H new ATOM 0 HA VAL A 26 16.358 -11.827 3.091 1.00 0.00 H new ATOM 0 HB VAL A 26 14.933 -10.131 5.176 1.00 0.00 H new ATOM 0 HG11 VAL A 26 15.116 -12.155 6.564 1.00 0.00 H new ATOM 0 HG12 VAL A 26 14.179 -12.453 5.081 1.00 0.00 H new ATOM 0 HG13 VAL A 26 15.862 -13.019 5.199 1.00 0.00 H new ATOM 0 HG21 VAL A 26 16.924 -10.474 6.582 1.00 0.00 H new ATOM 0 HG22 VAL A 26 17.746 -11.268 5.217 1.00 0.00 H new ATOM 0 HG23 VAL A 26 17.304 -9.547 5.112 1.00 0.00 H new ATOM 397 N ASP A 27 13.665 -10.052 2.496 1.00 0.00 N ATOM 398 CA ASP A 27 12.326 -10.099 1.938 1.00 0.00 C ATOM 399 C ASP A 27 12.374 -10.676 0.536 1.00 0.00 C ATOM 400 O ASP A 27 11.555 -11.516 0.169 1.00 0.00 O ATOM 401 CB ASP A 27 11.708 -8.699 1.910 1.00 0.00 C ATOM 402 CG ASP A 27 10.857 -8.419 3.133 1.00 0.00 C ATOM 403 OD1 ASP A 27 11.102 -9.049 4.183 1.00 0.00 O ATOM 404 OD2 ASP A 27 9.947 -7.569 3.042 1.00 0.00 O ATOM 0 H ASP A 27 14.035 -9.110 2.626 1.00 0.00 H new ATOM 0 HA ASP A 27 11.706 -10.738 2.567 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.502 -7.955 1.845 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.097 -8.592 1.013 1.00 0.00 H new ATOM 409 N TRP A 28 13.351 -10.217 -0.239 1.00 0.00 N ATOM 410 CA TRP A 28 13.519 -10.686 -1.601 1.00 0.00 C ATOM 411 C TRP A 28 14.087 -12.103 -1.626 1.00 0.00 C ATOM 412 O TRP A 28 13.714 -12.918 -2.470 1.00 0.00 O ATOM 413 CB TRP A 28 14.421 -9.743 -2.400 1.00 0.00 C ATOM 414 CG TRP A 28 13.950 -8.321 -2.392 1.00 0.00 C ATOM 415 CD1 TRP A 28 13.944 -7.474 -1.327 1.00 0.00 C ATOM 416 CD2 TRP A 28 13.413 -7.578 -3.494 1.00 0.00 C ATOM 417 NE1 TRP A 28 13.446 -6.253 -1.691 1.00 0.00 N ATOM 418 CE2 TRP A 28 13.108 -6.290 -3.013 1.00 0.00 C ATOM 419 CE3 TRP A 28 13.159 -7.872 -4.837 1.00 0.00 C ATOM 420 CZ2 TRP A 28 12.565 -5.301 -3.821 1.00 0.00 C ATOM 421 CZ3 TRP A 28 12.619 -6.885 -5.641 1.00 0.00 C ATOM 422 CH2 TRP A 28 12.327 -5.613 -5.131 1.00 0.00 C ATOM 0 H TRP A 28 14.036 -9.521 0.057 1.00 0.00 H new ATOM 0 HA TRP A 28 12.534 -10.700 -2.068 1.00 0.00 H new ATOM 0 HB2 TRP A 28 15.431 -9.786 -1.992 1.00 0.00 H new ATOM 0 HB3 TRP A 28 14.478 -10.093 -3.431 1.00 0.00 H new ATOM 0 HD1 TRP A 28 14.284 -7.730 -0.334 1.00 0.00 H new ATOM 0 HE1 TRP A 28 13.344 -5.446 -1.075 1.00 0.00 H new ATOM 0 HE3 TRP A 28 13.380 -8.850 -5.238 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 12.339 -4.320 -3.429 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 12.419 -7.098 -6.681 1.00 0.00 H new ATOM 0 HH2 TRP A 28 11.906 -4.864 -5.785 1.00 0.00 H new ATOM 433 N GLN A 29 14.994 -12.387 -0.694 1.00 0.00 N ATOM 434 CA GLN A 29 15.621 -13.703 -0.606 1.00 0.00 C ATOM 435 C GLN A 29 14.570 -14.800 -0.466 1.00 0.00 C ATOM 436 O GLN A 29 14.648 -15.837 -1.126 1.00 0.00 O ATOM 437 CB GLN A 29 16.587 -13.750 0.581 1.00 0.00 C ATOM 438 CG GLN A 29 18.052 -13.745 0.175 1.00 0.00 C ATOM 439 CD GLN A 29 18.398 -12.593 -0.750 1.00 0.00 C ATOM 440 OE1 GLN A 29 18.731 -11.497 -0.298 1.00 0.00 O ATOM 441 NE2 GLN A 29 18.318 -12.836 -2.052 1.00 0.00 N ATOM 0 H GLN A 29 15.311 -11.722 0.012 1.00 0.00 H new ATOM 0 HA GLN A 29 16.177 -13.876 -1.527 1.00 0.00 H new ATOM 0 HB2 GLN A 29 16.395 -12.894 1.229 1.00 0.00 H new ATOM 0 HB3 GLN A 29 16.385 -14.646 1.168 1.00 0.00 H new ATOM 0 HG2 GLN A 29 18.673 -13.687 1.069 1.00 0.00 H new ATOM 0 HG3 GLN A 29 18.291 -14.687 -0.319 1.00 0.00 H new ATOM 0 HE21 GLN A 29 18.038 -13.759 -2.382 1.00 0.00 H new ATOM 0 HE22 GLN A 29 18.537 -12.099 -2.723 1.00 0.00 H new ATOM 450 N ASN A 30 13.583 -14.561 0.390 1.00 0.00 N ATOM 451 CA ASN A 30 12.511 -15.523 0.611 1.00 0.00 C ATOM 452 C ASN A 30 11.201 -14.996 0.035 1.00 0.00 C ATOM 453 O ASN A 30 10.123 -15.268 0.562 1.00 0.00 O ATOM 454 CB ASN A 30 12.355 -15.810 2.107 1.00 0.00 C ATOM 455 CG ASN A 30 12.858 -17.189 2.487 1.00 0.00 C ATOM 456 OD1 ASN A 30 12.105 -18.164 2.469 1.00 0.00 O ATOM 457 ND2 ASN A 30 14.136 -17.278 2.835 1.00 0.00 N ATOM 0 H ASN A 30 13.503 -13.708 0.943 1.00 0.00 H new ATOM 0 HA ASN A 30 12.767 -16.453 0.103 1.00 0.00 H new ATOM 0 HB2 ASN A 30 12.900 -15.058 2.677 1.00 0.00 H new ATOM 0 HB3 ASN A 30 11.305 -15.721 2.384 1.00 0.00 H new ATOM 0 HD21 ASN A 30 14.530 -18.180 3.102 1.00 0.00 H new ATOM 0 HD22 ASN A 30 14.724 -16.444 2.836 1.00 0.00 H new ATOM 464 N CYS A 31 11.309 -14.235 -1.049 1.00 0.00 N ATOM 465 CA CYS A 31 10.141 -13.656 -1.699 1.00 0.00 C ATOM 466 C CYS A 31 9.436 -14.671 -2.590 1.00 0.00 C ATOM 467 O CYS A 31 10.064 -15.563 -3.159 1.00 0.00 O ATOM 468 CB CYS A 31 10.538 -12.436 -2.525 1.00 0.00 C ATOM 469 SG CYS A 31 9.152 -11.637 -3.361 1.00 0.00 S ATOM 0 H CYS A 31 12.196 -14.005 -1.496 1.00 0.00 H new ATOM 0 HA CYS A 31 9.449 -13.351 -0.914 1.00 0.00 H new ATOM 0 HB2 CYS A 31 11.024 -11.710 -1.873 1.00 0.00 H new ATOM 0 HB3 CYS A 31 11.274 -12.738 -3.270 1.00 0.00 H new ATOM 0 HG CYS A 31 8.096 -11.699 -2.606 1.00 0.00 H new ATOM 475 N VAL A 32 8.123 -14.514 -2.710 1.00 0.00 N ATOM 476 CA VAL A 32 7.314 -15.398 -3.535 1.00 0.00 C ATOM 477 C VAL A 32 6.845 -14.688 -4.803 1.00 0.00 C ATOM 478 O VAL A 32 6.808 -15.287 -5.878 1.00 0.00 O ATOM 479 CB VAL A 32 6.084 -15.917 -2.766 1.00 0.00 C ATOM 480 CG1 VAL A 32 6.501 -16.891 -1.674 1.00 0.00 C ATOM 481 CG2 VAL A 32 5.296 -14.762 -2.171 1.00 0.00 C ATOM 0 H VAL A 32 7.595 -13.777 -2.242 1.00 0.00 H new ATOM 0 HA VAL A 32 7.946 -16.244 -3.806 1.00 0.00 H new ATOM 0 HB VAL A 32 5.443 -16.445 -3.472 1.00 0.00 H new ATOM 0 HG11 VAL A 32 5.616 -17.244 -1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.019 -17.739 -2.121 1.00 0.00 H new ATOM 0 HG13 VAL A 32 7.167 -16.388 -0.973 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.432 -15.150 -1.632 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.931 -14.204 -1.483 1.00 0.00 H new ATOM 0 HG23 VAL A 32 4.959 -14.102 -2.970 1.00 0.00 H new ATOM 491 N TRP A 33 6.479 -13.410 -4.676 1.00 0.00 N ATOM 492 CA TRP A 33 6.006 -12.643 -5.831 1.00 0.00 C ATOM 493 C TRP A 33 6.554 -11.213 -5.824 1.00 0.00 C ATOM 494 O TRP A 33 6.812 -10.639 -4.766 1.00 0.00 O ATOM 495 CB TRP A 33 4.469 -12.636 -5.861 1.00 0.00 C ATOM 496 CG TRP A 33 3.865 -11.400 -6.465 1.00 0.00 C ATOM 497 CD1 TRP A 33 3.488 -11.215 -7.764 1.00 0.00 C ATOM 498 CD2 TRP A 33 3.572 -10.178 -5.783 1.00 0.00 C ATOM 499 NE1 TRP A 33 2.976 -9.948 -7.930 1.00 0.00 N ATOM 500 CE2 TRP A 33 3.018 -9.293 -6.726 1.00 0.00 C ATOM 501 CE3 TRP A 33 3.724 -9.750 -4.466 1.00 0.00 C ATOM 502 CZ2 TRP A 33 2.617 -8.002 -6.384 1.00 0.00 C ATOM 503 CZ3 TRP A 33 3.328 -8.472 -4.130 1.00 0.00 C ATOM 504 CH2 TRP A 33 2.779 -7.613 -5.087 1.00 0.00 C ATOM 0 H TRP A 33 6.500 -12.891 -3.798 1.00 0.00 H new ATOM 0 HA TRP A 33 6.378 -13.127 -6.734 1.00 0.00 H new ATOM 0 HB2 TRP A 33 4.125 -13.505 -6.422 1.00 0.00 H new ATOM 0 HB3 TRP A 33 4.097 -12.747 -4.842 1.00 0.00 H new ATOM 0 HD1 TRP A 33 3.578 -11.954 -8.546 1.00 0.00 H new ATOM 0 HE1 TRP A 33 2.623 -9.560 -8.805 1.00 0.00 H new ATOM 0 HE3 TRP A 33 4.145 -10.408 -3.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 2.193 -7.334 -7.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 3.444 -8.130 -3.112 1.00 0.00 H new ATOM 0 HH2 TRP A 33 2.476 -6.619 -4.792 1.00 0.00 H new ATOM 515 N GLU A 34 6.713 -10.644 -7.020 1.00 0.00 N ATOM 516 CA GLU A 34 7.216 -9.279 -7.170 1.00 0.00 C ATOM 517 C GLU A 34 6.585 -8.599 -8.383 1.00 0.00 C ATOM 518 O GLU A 34 6.754 -9.050 -9.516 1.00 0.00 O ATOM 519 CB GLU A 34 8.741 -9.281 -7.321 1.00 0.00 C ATOM 520 CG GLU A 34 9.460 -10.065 -6.240 1.00 0.00 C ATOM 521 CD GLU A 34 9.725 -11.504 -6.637 1.00 0.00 C ATOM 522 OE1 GLU A 34 8.785 -12.172 -7.115 1.00 0.00 O ATOM 523 OE2 GLU A 34 10.875 -11.963 -6.469 1.00 0.00 O ATOM 0 H GLU A 34 6.499 -11.110 -7.902 1.00 0.00 H new ATOM 0 HA GLU A 34 6.946 -8.723 -6.272 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.000 -9.699 -8.294 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.100 -8.252 -7.310 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.407 -9.576 -6.011 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.864 -10.048 -5.328 1.00 0.00 H new ATOM 530 N ASP A 35 5.859 -7.511 -8.141 1.00 0.00 N ATOM 531 CA ASP A 35 5.208 -6.770 -9.218 1.00 0.00 C ATOM 532 C ASP A 35 5.925 -5.448 -9.480 1.00 0.00 C ATOM 533 O ASP A 35 5.807 -4.500 -8.704 1.00 0.00 O ATOM 534 CB ASP A 35 3.739 -6.512 -8.874 1.00 0.00 C ATOM 535 CG ASP A 35 3.014 -5.744 -9.963 1.00 0.00 C ATOM 536 OD1 ASP A 35 3.131 -6.135 -11.144 1.00 0.00 O ATOM 537 OD2 ASP A 35 2.330 -4.752 -9.635 1.00 0.00 O ATOM 0 H ASP A 35 5.707 -7.123 -7.210 1.00 0.00 H new ATOM 0 HA ASP A 35 5.259 -7.374 -10.124 1.00 0.00 H new ATOM 0 HB2 ASP A 35 3.235 -7.464 -8.708 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.681 -5.954 -7.940 1.00 0.00 H new ATOM 542 N TYR A 36 6.668 -5.396 -10.581 1.00 0.00 N ATOM 543 CA TYR A 36 7.412 -4.195 -10.950 1.00 0.00 C ATOM 544 C TYR A 36 6.474 -3.030 -11.253 1.00 0.00 C ATOM 545 O TYR A 36 6.830 -1.869 -11.051 1.00 0.00 O ATOM 546 CB TYR A 36 8.298 -4.478 -12.164 1.00 0.00 C ATOM 547 CG TYR A 36 7.522 -4.822 -13.415 1.00 0.00 C ATOM 548 CD1 TYR A 36 7.097 -6.122 -13.658 1.00 0.00 C ATOM 549 CD2 TYR A 36 7.213 -3.845 -14.354 1.00 0.00 C ATOM 550 CE1 TYR A 36 6.387 -6.440 -14.800 1.00 0.00 C ATOM 551 CE2 TYR A 36 6.504 -4.155 -15.498 1.00 0.00 C ATOM 552 CZ TYR A 36 6.093 -5.452 -15.716 1.00 0.00 C ATOM 553 OH TYR A 36 5.387 -5.765 -16.855 1.00 0.00 O ATOM 0 H TYR A 36 6.771 -6.172 -11.235 1.00 0.00 H new ATOM 0 HA TYR A 36 8.037 -3.915 -10.102 1.00 0.00 H new ATOM 0 HB2 TYR A 36 8.919 -3.604 -12.361 1.00 0.00 H new ATOM 0 HB3 TYR A 36 8.972 -5.301 -11.927 1.00 0.00 H new ATOM 0 HD1 TYR A 36 7.325 -6.898 -12.942 1.00 0.00 H new ATOM 0 HD2 TYR A 36 7.532 -2.827 -14.186 1.00 0.00 H new ATOM 0 HE1 TYR A 36 6.064 -7.456 -14.974 1.00 0.00 H new ATOM 0 HE2 TYR A 36 6.273 -3.384 -16.218 1.00 0.00 H new ATOM 0 HH TYR A 36 5.262 -4.957 -17.395 1.00 0.00 H new ATOM 563 N ASN A 37 5.277 -3.341 -11.740 1.00 0.00 N ATOM 564 CA ASN A 37 4.300 -2.316 -12.071 1.00 0.00 C ATOM 565 C ASN A 37 3.783 -1.632 -10.812 1.00 0.00 C ATOM 566 O ASN A 37 3.378 -0.475 -10.850 1.00 0.00 O ATOM 567 CB ASN A 37 3.135 -2.926 -12.852 1.00 0.00 C ATOM 568 CG ASN A 37 3.532 -3.339 -14.255 1.00 0.00 C ATOM 569 OD1 ASN A 37 3.776 -4.515 -14.523 1.00 0.00 O ATOM 570 ND2 ASN A 37 3.600 -2.370 -15.160 1.00 0.00 N ATOM 0 H ASN A 37 4.962 -4.296 -11.913 1.00 0.00 H new ATOM 0 HA ASN A 37 4.791 -1.567 -12.693 1.00 0.00 H new ATOM 0 HB2 ASN A 37 2.756 -3.795 -12.314 1.00 0.00 H new ATOM 0 HB3 ASN A 37 2.320 -2.204 -12.906 1.00 0.00 H new ATOM 0 HD21 ASN A 37 3.863 -2.587 -16.121 1.00 0.00 H new ATOM 0 HD22 ASN A 37 3.389 -1.408 -14.894 1.00 0.00 H new ATOM 577 N ARG A 38 3.797 -2.347 -9.695 1.00 0.00 N ATOM 578 CA ARG A 38 3.323 -1.787 -8.435 1.00 0.00 C ATOM 579 C ARG A 38 4.457 -1.651 -7.422 1.00 0.00 C ATOM 580 O ARG A 38 4.222 -1.294 -6.268 1.00 0.00 O ATOM 581 CB ARG A 38 2.207 -2.656 -7.856 1.00 0.00 C ATOM 582 CG ARG A 38 1.617 -2.107 -6.567 1.00 0.00 C ATOM 583 CD ARG A 38 0.179 -2.558 -6.372 1.00 0.00 C ATOM 584 NE ARG A 38 0.099 -3.876 -5.747 1.00 0.00 N ATOM 585 CZ ARG A 38 0.065 -5.023 -6.424 1.00 0.00 C ATOM 586 NH1 ARG A 38 0.089 -5.025 -7.751 1.00 0.00 N ATOM 587 NH2 ARG A 38 0.005 -6.174 -5.769 1.00 0.00 N ATOM 0 H ARG A 38 4.129 -3.310 -9.635 1.00 0.00 H new ATOM 0 HA ARG A 38 2.933 -0.790 -8.641 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.413 -2.755 -8.596 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.596 -3.657 -7.671 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.220 -2.437 -5.721 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.658 -1.018 -6.582 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -0.348 -1.831 -5.754 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -0.327 -2.583 -7.337 1.00 0.00 H new ATOM 0 HE ARG A 38 0.067 -3.921 -4.728 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.134 -4.143 -8.262 1.00 0.00 H new ATOM 0 HH12 ARG A 38 0.063 -5.908 -8.260 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -0.015 -6.180 -4.749 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -0.021 -7.054 -6.285 1.00 0.00 H new ATOM 601 N ASP A 39 5.685 -1.937 -7.854 1.00 0.00 N ATOM 602 CA ASP A 39 6.847 -1.845 -6.972 1.00 0.00 C ATOM 603 C ASP A 39 6.559 -2.516 -5.632 1.00 0.00 C ATOM 604 O ASP A 39 6.958 -2.023 -4.578 1.00 0.00 O ATOM 605 CB ASP A 39 7.231 -0.381 -6.752 1.00 0.00 C ATOM 606 CG ASP A 39 8.079 0.170 -7.883 1.00 0.00 C ATOM 607 OD1 ASP A 39 7.672 0.024 -9.054 1.00 0.00 O ATOM 608 OD2 ASP A 39 9.148 0.748 -7.595 1.00 0.00 O ATOM 0 H ASP A 39 5.900 -2.233 -8.806 1.00 0.00 H new ATOM 0 HA ASP A 39 7.680 -2.362 -7.448 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.326 0.219 -6.655 1.00 0.00 H new ATOM 0 HB3 ASP A 39 7.777 -0.288 -5.813 1.00 0.00 H new ATOM 613 N LEU A 40 5.852 -3.639 -5.688 1.00 0.00 N ATOM 614 CA LEU A 40 5.491 -4.380 -4.486 1.00 0.00 C ATOM 615 C LEU A 40 5.862 -5.854 -4.622 1.00 0.00 C ATOM 616 O LEU A 40 5.859 -6.407 -5.722 1.00 0.00 O ATOM 617 CB LEU A 40 3.989 -4.237 -4.228 1.00 0.00 C ATOM 618 CG LEU A 40 3.457 -4.983 -3.004 1.00 0.00 C ATOM 619 CD1 LEU A 40 3.877 -4.272 -1.727 1.00 0.00 C ATOM 620 CD2 LEU A 40 1.942 -5.105 -3.077 1.00 0.00 C ATOM 0 H LEU A 40 5.517 -4.057 -6.556 1.00 0.00 H new ATOM 0 HA LEU A 40 6.046 -3.968 -3.643 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.757 -3.178 -4.116 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.452 -4.590 -5.108 1.00 0.00 H new ATOM 0 HG LEU A 40 3.883 -5.986 -2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.491 -4.815 -0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.965 -4.232 -1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.477 -3.258 -1.727 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.577 -5.638 -2.199 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.498 -4.110 -3.108 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.664 -5.654 -3.977 1.00 0.00 H new ATOM 632 N LEU A 41 6.172 -6.489 -3.495 1.00 0.00 N ATOM 633 CA LEU A 41 6.534 -7.906 -3.492 1.00 0.00 C ATOM 634 C LEU A 41 6.028 -8.604 -2.237 1.00 0.00 C ATOM 635 O LEU A 41 5.810 -7.971 -1.207 1.00 0.00 O ATOM 636 CB LEU A 41 8.056 -8.109 -3.648 1.00 0.00 C ATOM 637 CG LEU A 41 8.994 -7.565 -2.541 1.00 0.00 C ATOM 638 CD1 LEU A 41 9.876 -6.460 -3.100 1.00 0.00 C ATOM 639 CD2 LEU A 41 8.242 -7.059 -1.318 1.00 0.00 C ATOM 0 H LEU A 41 6.180 -6.048 -2.575 1.00 0.00 H new ATOM 0 HA LEU A 41 6.048 -8.360 -4.355 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.239 -9.179 -3.741 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.356 -7.651 -4.591 1.00 0.00 H new ATOM 0 HG LEU A 41 9.608 -8.403 -2.211 1.00 0.00 H new ATOM 0 HD11 LEU A 41 10.531 -6.085 -2.314 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.479 -6.855 -3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.251 -5.647 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.954 -6.691 -0.579 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.573 -6.250 -1.611 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.659 -7.873 -0.887 1.00 0.00 H new ATOM 651 N VAL A 42 5.840 -9.915 -2.330 1.00 0.00 N ATOM 652 CA VAL A 42 5.366 -10.690 -1.194 1.00 0.00 C ATOM 653 C VAL A 42 6.425 -11.689 -0.759 1.00 0.00 C ATOM 654 O VAL A 42 6.958 -12.441 -1.578 1.00 0.00 O ATOM 655 CB VAL A 42 4.042 -11.443 -1.499 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.766 -12.539 -0.469 1.00 0.00 C ATOM 657 CG2 VAL A 42 2.870 -10.473 -1.552 1.00 0.00 C ATOM 0 H VAL A 42 6.008 -10.460 -3.176 1.00 0.00 H new ATOM 0 HA VAL A 42 5.168 -9.981 -0.390 1.00 0.00 H new ATOM 0 HB VAL A 42 4.157 -11.916 -2.474 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.832 -13.043 -0.716 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.582 -13.262 -0.479 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.687 -12.094 0.523 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.953 -11.022 -1.767 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.773 -9.966 -0.592 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.043 -9.735 -2.335 1.00 0.00 H new ATOM 667 N SER A 43 6.707 -11.689 0.538 1.00 0.00 N ATOM 668 CA SER A 43 7.684 -12.593 1.120 1.00 0.00 C ATOM 669 C SER A 43 7.012 -13.456 2.177 1.00 0.00 C ATOM 670 O SER A 43 5.964 -13.092 2.710 1.00 0.00 O ATOM 671 CB SER A 43 8.845 -11.809 1.733 1.00 0.00 C ATOM 672 OG SER A 43 8.525 -11.354 3.037 1.00 0.00 O ATOM 0 H SER A 43 6.265 -11.064 1.212 1.00 0.00 H new ATOM 0 HA SER A 43 8.085 -13.234 0.335 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.733 -12.440 1.773 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.088 -10.958 1.097 1.00 0.00 H new ATOM 0 HG SER A 43 9.285 -10.857 3.406 1.00 0.00 H new ATOM 678 N THR A 44 7.600 -14.606 2.468 1.00 0.00 N ATOM 679 CA THR A 44 7.027 -15.514 3.450 1.00 0.00 C ATOM 680 C THR A 44 7.680 -15.350 4.815 1.00 0.00 C ATOM 681 O THR A 44 8.904 -15.329 4.938 1.00 0.00 O ATOM 682 CB THR A 44 7.149 -16.953 2.963 1.00 0.00 C ATOM 683 OG1 THR A 44 8.483 -17.417 3.076 1.00 0.00 O ATOM 684 CG2 THR A 44 6.723 -17.105 1.523 1.00 0.00 C ATOM 0 H THR A 44 8.468 -14.931 2.042 1.00 0.00 H new ATOM 0 HA THR A 44 5.972 -15.266 3.564 1.00 0.00 H new ATOM 0 HB THR A 44 6.487 -17.543 3.597 1.00 0.00 H new ATOM 0 HG1 THR A 44 8.981 -16.836 3.689 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.827 -18.147 1.221 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.682 -16.799 1.417 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.351 -16.479 0.890 1.00 0.00 H new ATOM 692 N THR A 45 6.839 -15.218 5.834 1.00 0.00 N ATOM 693 CA THR A 45 7.302 -15.037 7.202 1.00 0.00 C ATOM 694 C THR A 45 6.673 -16.073 8.130 1.00 0.00 C ATOM 695 O THR A 45 5.647 -16.671 7.803 1.00 0.00 O ATOM 696 CB THR A 45 6.965 -13.620 7.684 1.00 0.00 C ATOM 697 OG1 THR A 45 6.866 -13.577 9.097 1.00 0.00 O ATOM 698 CG2 THR A 45 5.665 -13.080 7.114 1.00 0.00 C ATOM 0 H THR A 45 5.824 -15.233 5.735 1.00 0.00 H new ATOM 0 HA THR A 45 8.383 -15.174 7.222 1.00 0.00 H new ATOM 0 HB THR A 45 7.784 -12.996 7.327 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.276 -12.751 9.429 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.490 -12.075 7.497 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.730 -13.048 6.026 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.841 -13.729 7.409 1.00 0.00 H new ATOM 706 N THR A 46 7.293 -16.279 9.288 1.00 0.00 N ATOM 707 CA THR A 46 6.791 -17.241 10.263 1.00 0.00 C ATOM 708 C THR A 46 6.421 -16.545 11.570 1.00 0.00 C ATOM 709 O THR A 46 6.947 -16.876 12.633 1.00 0.00 O ATOM 710 CB THR A 46 7.835 -18.328 10.525 1.00 0.00 C ATOM 711 OG1 THR A 46 8.613 -18.567 9.365 1.00 0.00 O ATOM 712 CG2 THR A 46 7.228 -19.648 10.950 1.00 0.00 C ATOM 0 H THR A 46 8.143 -15.793 9.574 1.00 0.00 H new ATOM 0 HA THR A 46 5.894 -17.704 9.852 1.00 0.00 H new ATOM 0 HB THR A 46 8.450 -17.948 11.341 1.00 0.00 H new ATOM 0 HG1 THR A 46 9.276 -19.264 9.553 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.022 -20.376 11.120 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.661 -19.508 11.870 1.00 0.00 H new ATOM 0 HG23 THR A 46 6.564 -20.012 10.166 1.00 0.00 H new ATOM 720 N ALA A 47 5.513 -15.580 11.483 1.00 0.00 N ATOM 721 CA ALA A 47 5.072 -14.837 12.658 1.00 0.00 C ATOM 722 C ALA A 47 3.555 -14.687 12.676 1.00 0.00 C ATOM 723 O ALA A 47 2.854 -15.259 11.841 1.00 0.00 O ATOM 724 CB ALA A 47 5.739 -13.470 12.698 1.00 0.00 C ATOM 0 H ALA A 47 5.068 -15.294 10.611 1.00 0.00 H new ATOM 0 HA ALA A 47 5.366 -15.400 13.544 1.00 0.00 H new ATOM 0 HB1 ALA A 47 5.401 -12.926 13.580 1.00 0.00 H new ATOM 0 HB2 ALA A 47 6.821 -13.594 12.741 1.00 0.00 H new ATOM 0 HB3 ALA A 47 5.473 -12.909 11.802 1.00 0.00 H new ATOM 730 N HIS A 48 3.053 -13.915 13.634 1.00 0.00 N ATOM 731 CA HIS A 48 1.618 -13.688 13.761 1.00 0.00 C ATOM 732 C HIS A 48 1.231 -12.327 13.193 1.00 0.00 C ATOM 733 O HIS A 48 1.720 -11.291 13.647 1.00 0.00 O ATOM 734 CB HIS A 48 1.194 -13.781 15.227 1.00 0.00 C ATOM 735 CG HIS A 48 -0.140 -14.432 15.424 1.00 0.00 C ATOM 736 ND1 HIS A 48 -0.416 -15.278 16.477 1.00 0.00 N ATOM 737 CD2 HIS A 48 -1.279 -14.358 14.694 1.00 0.00 C ATOM 738 CE1 HIS A 48 -1.667 -15.696 16.387 1.00 0.00 C ATOM 739 NE2 HIS A 48 -2.211 -15.152 15.314 1.00 0.00 N ATOM 0 H HIS A 48 3.619 -13.436 14.334 1.00 0.00 H new ATOM 0 HA HIS A 48 1.101 -14.460 13.191 1.00 0.00 H new ATOM 0 HB2 HIS A 48 1.948 -14.341 15.780 1.00 0.00 H new ATOM 0 HB3 HIS A 48 1.166 -12.778 15.653 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -1.426 -13.782 13.792 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -2.160 -16.368 17.074 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -3.169 -15.298 14.997 1.00 0.00 H new ATOM 748 N GLY A 49 0.353 -12.335 12.196 1.00 0.00 N ATOM 749 CA GLY A 49 -0.083 -11.095 11.581 1.00 0.00 C ATOM 750 C GLY A 49 -1.150 -10.388 12.393 1.00 0.00 C ATOM 751 O GLY A 49 -1.431 -10.769 13.529 1.00 0.00 O ATOM 0 H GLY A 49 -0.065 -13.178 11.803 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.774 -10.433 11.459 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.469 -11.304 10.583 1.00 0.00 H new ATOM 755 N CYS A 50 -1.745 -9.353 11.808 1.00 0.00 N ATOM 756 CA CYS A 50 -2.786 -8.587 12.483 1.00 0.00 C ATOM 757 C CYS A 50 -3.696 -7.898 11.471 1.00 0.00 C ATOM 758 O CYS A 50 -4.920 -7.939 11.593 1.00 0.00 O ATOM 759 CB CYS A 50 -2.161 -7.551 13.418 1.00 0.00 C ATOM 760 SG CYS A 50 -3.032 -7.356 14.991 1.00 0.00 S ATOM 0 H CYS A 50 -1.524 -9.026 10.868 1.00 0.00 H new ATOM 0 HA CYS A 50 -3.388 -9.278 13.072 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -1.128 -7.835 13.620 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -2.133 -6.588 12.909 1.00 0.00 H new ATOM 0 HG CYS A 50 -2.427 -6.461 15.714 1.00 0.00 H new ATOM 766 N ASP A 51 -3.089 -7.264 10.473 1.00 0.00 N ATOM 767 CA ASP A 51 -3.843 -6.566 9.439 1.00 0.00 C ATOM 768 C ASP A 51 -4.685 -7.544 8.626 1.00 0.00 C ATOM 769 O ASP A 51 -4.251 -8.658 8.335 1.00 0.00 O ATOM 770 CB ASP A 51 -2.896 -5.800 8.515 1.00 0.00 C ATOM 771 CG ASP A 51 -2.039 -4.800 9.266 1.00 0.00 C ATOM 772 OD1 ASP A 51 -1.192 -5.233 10.074 1.00 0.00 O ATOM 773 OD2 ASP A 51 -2.217 -3.583 9.046 1.00 0.00 O ATOM 0 H ASP A 51 -2.076 -7.219 10.359 1.00 0.00 H new ATOM 0 HA ASP A 51 -4.512 -5.858 9.929 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.251 -6.507 7.993 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -3.478 -5.278 7.755 1.00 0.00 H new ATOM 778 N THR A 52 -5.890 -7.118 8.260 1.00 0.00 N ATOM 779 CA THR A 52 -6.793 -7.958 7.481 1.00 0.00 C ATOM 780 C THR A 52 -7.240 -7.244 6.209 1.00 0.00 C ATOM 781 O THR A 52 -7.882 -6.196 6.267 1.00 0.00 O ATOM 782 CB THR A 52 -8.013 -8.346 8.317 1.00 0.00 C ATOM 783 OG1 THR A 52 -7.618 -9.011 9.504 1.00 0.00 O ATOM 784 CG2 THR A 52 -8.979 -9.251 7.584 1.00 0.00 C ATOM 0 H THR A 52 -6.263 -6.197 8.490 1.00 0.00 H new ATOM 0 HA THR A 52 -6.253 -8.862 7.198 1.00 0.00 H new ATOM 0 HB THR A 52 -8.519 -7.407 8.540 1.00 0.00 H new ATOM 0 HG1 THR A 52 -8.413 -9.249 10.025 1.00 0.00 H new ATOM 0 HG21 THR A 52 -9.821 -9.487 8.234 1.00 0.00 H new ATOM 0 HG22 THR A 52 -9.342 -8.746 6.689 1.00 0.00 H new ATOM 0 HG23 THR A 52 -8.470 -10.172 7.300 1.00 0.00 H new ATOM 792 N ILE A 53 -6.899 -7.822 5.062 1.00 0.00 N ATOM 793 CA ILE A 53 -7.269 -7.242 3.773 1.00 0.00 C ATOM 794 C ILE A 53 -8.718 -7.560 3.430 1.00 0.00 C ATOM 795 O ILE A 53 -9.193 -8.669 3.667 1.00 0.00 O ATOM 796 CB ILE A 53 -6.369 -7.742 2.626 1.00 0.00 C ATOM 797 CG1 ILE A 53 -4.976 -8.127 3.153 1.00 0.00 C ATOM 798 CG2 ILE A 53 -6.286 -6.684 1.532 1.00 0.00 C ATOM 799 CD1 ILE A 53 -3.829 -7.800 2.216 1.00 0.00 C ATOM 0 H ILE A 53 -6.368 -8.690 4.997 1.00 0.00 H new ATOM 0 HA ILE A 53 -7.136 -6.165 3.874 1.00 0.00 H new ATOM 0 HB ILE A 53 -6.809 -8.641 2.194 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.808 -7.617 4.102 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.964 -9.197 3.360 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -5.648 -7.044 0.725 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -7.284 -6.483 1.144 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -5.866 -5.767 1.944 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.888 -8.107 2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -3.966 -8.331 1.274 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -3.808 -6.727 2.028 1.00 0.00 H new ATOM 811 N ALA A 54 -9.415 -6.576 2.877 1.00 0.00 N ATOM 812 CA ALA A 54 -10.812 -6.747 2.509 1.00 0.00 C ATOM 813 C ALA A 54 -10.974 -7.054 1.024 1.00 0.00 C ATOM 814 O ALA A 54 -10.359 -6.408 0.174 1.00 0.00 O ATOM 815 CB ALA A 54 -11.600 -5.497 2.870 1.00 0.00 C ATOM 0 H ALA A 54 -9.035 -5.652 2.674 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.200 -7.599 3.067 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.645 -5.633 2.591 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -11.531 -5.320 3.943 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.190 -4.641 2.334 1.00 0.00 H new ATOM 821 N ARG A 55 -11.830 -8.026 0.716 1.00 0.00 N ATOM 822 CA ARG A 55 -12.102 -8.401 -0.668 1.00 0.00 C ATOM 823 C ARG A 55 -13.305 -7.617 -1.178 1.00 0.00 C ATOM 824 O ARG A 55 -14.195 -8.160 -1.834 1.00 0.00 O ATOM 825 CB ARG A 55 -12.362 -9.907 -0.777 1.00 0.00 C ATOM 826 CG ARG A 55 -11.430 -10.615 -1.747 1.00 0.00 C ATOM 827 CD ARG A 55 -11.969 -11.981 -2.140 1.00 0.00 C ATOM 828 NE ARG A 55 -11.258 -12.540 -3.289 1.00 0.00 N ATOM 829 CZ ARG A 55 -11.351 -12.055 -4.525 1.00 0.00 C ATOM 830 NH1 ARG A 55 -12.121 -11.004 -4.778 1.00 0.00 N ATOM 831 NH2 ARG A 55 -10.670 -12.622 -5.512 1.00 0.00 N ATOM 0 H ARG A 55 -12.347 -8.568 1.408 1.00 0.00 H new ATOM 0 HA ARG A 55 -11.231 -8.163 -1.279 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.257 -10.358 0.210 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.393 -10.068 -1.093 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -11.299 -10.004 -2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -10.446 -10.728 -1.291 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -11.882 -12.662 -1.294 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -13.030 -11.898 -2.375 1.00 0.00 H new ATOM 0 HE ARG A 55 -10.656 -13.349 -3.134 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -12.646 -10.563 -4.023 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -12.188 -10.637 -5.728 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.076 -13.429 -5.324 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -10.741 -12.251 -6.459 1.00 0.00 H new ATOM 845 N CYS A 56 -13.324 -6.333 -0.846 1.00 0.00 N ATOM 846 CA CYS A 56 -14.411 -5.441 -1.230 1.00 0.00 C ATOM 847 C CYS A 56 -14.044 -4.603 -2.448 1.00 0.00 C ATOM 848 O CYS A 56 -12.879 -4.526 -2.838 1.00 0.00 O ATOM 849 CB CYS A 56 -14.738 -4.507 -0.066 1.00 0.00 C ATOM 850 SG CYS A 56 -13.287 -3.585 0.541 1.00 0.00 S ATOM 0 H CYS A 56 -12.588 -5.881 -0.304 1.00 0.00 H new ATOM 0 HA CYS A 56 -15.275 -6.056 -1.482 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -15.505 -3.799 -0.380 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -15.159 -5.090 0.753 1.00 0.00 H new ATOM 0 HG CYS A 56 -13.503 -2.309 0.422 1.00 0.00 H new ATOM 855 N GLN A 57 -15.050 -3.962 -3.027 1.00 0.00 N ATOM 856 CA GLN A 57 -14.851 -3.103 -4.186 1.00 0.00 C ATOM 857 C GLN A 57 -15.298 -1.678 -3.869 1.00 0.00 C ATOM 858 O GLN A 57 -15.654 -0.913 -4.765 1.00 0.00 O ATOM 859 CB GLN A 57 -15.631 -3.642 -5.388 1.00 0.00 C ATOM 860 CG GLN A 57 -14.879 -3.524 -6.704 1.00 0.00 C ATOM 861 CD GLN A 57 -15.653 -4.103 -7.871 1.00 0.00 C ATOM 862 OE1 GLN A 57 -15.832 -3.447 -8.898 1.00 0.00 O ATOM 863 NE2 GLN A 57 -16.117 -5.338 -7.720 1.00 0.00 N ATOM 0 H GLN A 57 -16.018 -4.021 -2.711 1.00 0.00 H new ATOM 0 HA GLN A 57 -13.789 -3.093 -4.433 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -15.876 -4.689 -5.212 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -16.575 -3.103 -5.469 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -14.662 -2.474 -6.902 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -13.921 -4.037 -6.618 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -15.945 -5.845 -6.852 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -16.645 -5.780 -8.472 1.00 0.00 H new ATOM 872 N CYS A 58 -15.280 -1.331 -2.582 1.00 0.00 N ATOM 873 CA CYS A 58 -15.686 -0.004 -2.136 1.00 0.00 C ATOM 874 C CYS A 58 -14.749 1.069 -2.684 1.00 0.00 C ATOM 875 O CYS A 58 -13.533 0.880 -2.733 1.00 0.00 O ATOM 876 CB CYS A 58 -15.726 0.052 -0.603 1.00 0.00 C ATOM 877 SG CYS A 58 -14.086 0.077 0.198 1.00 0.00 S ATOM 0 H CYS A 58 -14.987 -1.955 -1.830 1.00 0.00 H new ATOM 0 HA CYS A 58 -16.686 0.193 -2.522 1.00 0.00 H new ATOM 0 HB2 CYS A 58 -16.278 0.941 -0.299 1.00 0.00 H new ATOM 0 HB3 CYS A 58 -16.283 -0.810 -0.235 1.00 0.00 H new ATOM 0 HG CYS A 58 -13.697 1.308 0.352 1.00 0.00 H new ATOM 882 N THR A 59 -15.324 2.194 -3.098 1.00 0.00 N ATOM 883 CA THR A 59 -14.543 3.297 -3.646 1.00 0.00 C ATOM 884 C THR A 59 -14.135 4.287 -2.555 1.00 0.00 C ATOM 885 O THR A 59 -13.684 5.393 -2.850 1.00 0.00 O ATOM 886 CB THR A 59 -15.341 4.020 -4.732 1.00 0.00 C ATOM 887 OG1 THR A 59 -16.116 3.101 -5.481 1.00 0.00 O ATOM 888 CG2 THR A 59 -14.471 4.786 -5.704 1.00 0.00 C ATOM 0 H THR A 59 -16.329 2.366 -3.064 1.00 0.00 H new ATOM 0 HA THR A 59 -13.635 2.879 -4.082 1.00 0.00 H new ATOM 0 HB THR A 59 -15.975 4.729 -4.200 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.620 3.583 -6.169 1.00 0.00 H new ATOM 0 HG21 THR A 59 -15.100 5.275 -6.448 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.897 5.538 -5.163 1.00 0.00 H new ATOM 0 HG23 THR A 59 -13.789 4.097 -6.202 1.00 0.00 H new ATOM 896 N THR A 60 -14.297 3.886 -1.296 1.00 0.00 N ATOM 897 CA THR A 60 -13.943 4.744 -0.172 1.00 0.00 C ATOM 898 C THR A 60 -12.987 4.029 0.778 1.00 0.00 C ATOM 899 O THR A 60 -12.882 2.803 0.762 1.00 0.00 O ATOM 900 CB THR A 60 -15.202 5.175 0.584 1.00 0.00 C ATOM 901 OG1 THR A 60 -15.796 4.068 1.237 1.00 0.00 O ATOM 902 CG2 THR A 60 -16.251 5.800 -0.309 1.00 0.00 C ATOM 0 H THR A 60 -14.670 2.975 -1.031 1.00 0.00 H new ATOM 0 HA THR A 60 -13.443 5.629 -0.566 1.00 0.00 H new ATOM 0 HB THR A 60 -14.868 5.924 1.302 1.00 0.00 H new ATOM 0 HG1 THR A 60 -16.598 4.363 1.716 1.00 0.00 H new ATOM 0 HG21 THR A 60 -17.117 6.083 0.290 1.00 0.00 H new ATOM 0 HG22 THR A 60 -15.838 6.686 -0.790 1.00 0.00 H new ATOM 0 HG23 THR A 60 -16.555 5.082 -1.071 1.00 0.00 H new ATOM 910 N GLY A 61 -12.292 4.804 1.603 1.00 0.00 N ATOM 911 CA GLY A 61 -11.353 4.228 2.548 1.00 0.00 C ATOM 912 C GLY A 61 -10.597 5.284 3.329 1.00 0.00 C ATOM 913 O GLY A 61 -10.402 6.400 2.849 1.00 0.00 O ATOM 0 H GLY A 61 -12.362 5.821 1.634 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -11.891 3.582 3.242 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -10.643 3.598 2.012 1.00 0.00 H new ATOM 917 N VAL A 62 -10.167 4.930 4.536 1.00 0.00 N ATOM 918 CA VAL A 62 -9.428 5.855 5.386 1.00 0.00 C ATOM 919 C VAL A 62 -7.937 5.523 5.391 1.00 0.00 C ATOM 920 O VAL A 62 -7.551 4.355 5.453 1.00 0.00 O ATOM 921 CB VAL A 62 -9.965 5.830 6.833 1.00 0.00 C ATOM 922 CG1 VAL A 62 -9.873 4.426 7.412 1.00 0.00 C ATOM 923 CG2 VAL A 62 -9.219 6.828 7.706 1.00 0.00 C ATOM 0 H VAL A 62 -10.318 4.009 4.947 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.568 6.855 4.974 1.00 0.00 H new ATOM 0 HB VAL A 62 -11.015 6.123 6.813 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.256 4.427 8.433 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -10.465 3.742 6.803 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -8.832 4.101 7.415 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.616 6.792 8.721 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.159 6.576 7.722 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -9.348 7.832 7.302 1.00 0.00 H new ATOM 933 N TYR A 63 -7.100 6.558 5.318 1.00 0.00 N ATOM 934 CA TYR A 63 -5.652 6.370 5.308 1.00 0.00 C ATOM 935 C TYR A 63 -4.967 7.270 6.335 1.00 0.00 C ATOM 936 O TYR A 63 -5.627 7.907 7.157 1.00 0.00 O ATOM 937 CB TYR A 63 -5.092 6.645 3.906 1.00 0.00 C ATOM 938 CG TYR A 63 -5.250 8.080 3.441 1.00 0.00 C ATOM 939 CD1 TYR A 63 -4.503 9.105 4.008 1.00 0.00 C ATOM 940 CD2 TYR A 63 -6.142 8.405 2.426 1.00 0.00 C ATOM 941 CE1 TYR A 63 -4.641 10.411 3.579 1.00 0.00 C ATOM 942 CE2 TYR A 63 -6.285 9.709 1.993 1.00 0.00 C ATOM 943 CZ TYR A 63 -5.533 10.708 2.572 1.00 0.00 C ATOM 944 OH TYR A 63 -5.673 12.008 2.142 1.00 0.00 O ATOM 0 H TYR A 63 -7.400 7.531 5.265 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.446 5.334 5.579 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -4.033 6.386 3.893 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -5.590 5.988 3.193 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -3.802 8.877 4.798 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.733 7.625 1.968 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -4.052 11.196 4.031 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.984 9.945 1.204 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.824 12.484 2.258 1.00 0.00 H new ATOM 954 N PHE A 64 -3.636 7.314 6.277 1.00 0.00 N ATOM 955 CA PHE A 64 -2.834 8.131 7.189 1.00 0.00 C ATOM 956 C PHE A 64 -2.788 7.516 8.589 1.00 0.00 C ATOM 957 O PHE A 64 -1.908 6.705 8.881 1.00 0.00 O ATOM 958 CB PHE A 64 -3.362 9.574 7.243 1.00 0.00 C ATOM 959 CG PHE A 64 -2.523 10.560 6.472 1.00 0.00 C ATOM 960 CD1 PHE A 64 -1.775 10.157 5.375 1.00 0.00 C ATOM 961 CD2 PHE A 64 -2.483 11.893 6.847 1.00 0.00 C ATOM 962 CE1 PHE A 64 -1.007 11.063 4.670 1.00 0.00 C ATOM 963 CE2 PHE A 64 -1.717 12.804 6.146 1.00 0.00 C ATOM 964 CZ PHE A 64 -0.977 12.389 5.056 1.00 0.00 C ATOM 0 H PHE A 64 -3.085 6.787 5.600 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.815 8.157 6.802 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.379 9.593 6.852 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.415 9.893 8.284 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.794 9.122 5.068 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -3.058 12.224 7.699 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.430 10.735 3.818 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.697 13.840 6.450 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.377 13.099 4.507 1.00 0.00 H new ATOM 1061 N HIS A 71 -7.414 9.046 11.860 1.00 0.00 N ATOM 1062 CA HIS A 71 -7.888 8.331 10.679 1.00 0.00 C ATOM 1063 C HIS A 71 -8.584 9.287 9.716 1.00 0.00 C ATOM 1064 O HIS A 71 -9.612 9.876 10.048 1.00 0.00 O ATOM 1065 CB HIS A 71 -8.845 7.197 11.072 1.00 0.00 C ATOM 1066 CG HIS A 71 -9.679 7.487 12.285 1.00 0.00 C ATOM 1067 ND1 HIS A 71 -9.813 6.602 13.334 1.00 0.00 N ATOM 1068 CD2 HIS A 71 -10.423 8.571 12.612 1.00 0.00 C ATOM 1069 CE1 HIS A 71 -10.602 7.128 14.253 1.00 0.00 C ATOM 1070 NE2 HIS A 71 -10.985 8.321 13.840 1.00 0.00 N ATOM 0 HA HIS A 71 -7.021 7.897 10.181 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -9.507 6.988 10.232 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -8.264 6.293 11.253 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -10.550 9.464 12.018 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.886 6.661 15.185 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -11.599 8.955 14.350 1.00 0.00 H new ATOM 1079 N TYR A 72 -8.019 9.439 8.521 1.00 0.00 N ATOM 1080 CA TYR A 72 -8.600 10.327 7.520 1.00 0.00 C ATOM 1081 C TYR A 72 -9.354 9.527 6.458 1.00 0.00 C ATOM 1082 O TYR A 72 -8.744 8.793 5.681 1.00 0.00 O ATOM 1083 CB TYR A 72 -7.495 11.148 6.846 1.00 0.00 C ATOM 1084 CG TYR A 72 -7.433 12.589 7.300 1.00 0.00 C ATOM 1085 CD1 TYR A 72 -6.918 12.920 8.548 1.00 0.00 C ATOM 1086 CD2 TYR A 72 -7.884 13.619 6.481 1.00 0.00 C ATOM 1087 CE1 TYR A 72 -6.854 14.235 8.968 1.00 0.00 C ATOM 1088 CE2 TYR A 72 -7.823 14.937 6.894 1.00 0.00 C ATOM 1089 CZ TYR A 72 -7.308 15.239 8.138 1.00 0.00 C ATOM 1090 OH TYR A 72 -7.245 16.549 8.553 1.00 0.00 O ATOM 0 H TYR A 72 -7.167 8.963 8.225 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.300 10.995 8.022 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.533 10.674 7.043 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -7.646 11.124 5.767 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.562 12.136 9.200 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.288 13.385 5.507 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -6.451 14.475 9.941 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -8.176 15.726 6.247 1.00 0.00 H new ATOM 0 HH TYR A 72 -7.603 17.132 7.851 1.00 0.00 H new ATOM 1100 N PRO A 73 -10.690 9.665 6.396 1.00 0.00 N ATOM 1101 CA PRO A 73 -11.510 8.960 5.416 1.00 0.00 C ATOM 1102 C PRO A 73 -11.478 9.661 4.064 1.00 0.00 C ATOM 1103 O PRO A 73 -11.829 10.835 3.957 1.00 0.00 O ATOM 1104 CB PRO A 73 -12.924 9.002 6.020 1.00 0.00 C ATOM 1105 CG PRO A 73 -12.792 9.713 7.332 1.00 0.00 C ATOM 1106 CD PRO A 73 -11.519 10.506 7.260 1.00 0.00 C ATOM 0 HA PRO A 73 -11.158 7.945 5.231 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -13.615 9.527 5.360 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -13.319 7.996 6.160 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -13.647 10.366 7.507 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -12.760 9.002 8.157 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -11.678 11.497 6.835 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.071 10.649 8.243 1.00 0.00 H new ATOM 1114 N VAL A 74 -11.034 8.943 3.040 1.00 0.00 N ATOM 1115 CA VAL A 74 -10.933 9.515 1.705 1.00 0.00 C ATOM 1116 C VAL A 74 -11.497 8.580 0.637 1.00 0.00 C ATOM 1117 O VAL A 74 -11.398 7.358 0.746 1.00 0.00 O ATOM 1118 CB VAL A 74 -9.461 9.843 1.368 1.00 0.00 C ATOM 1119 CG1 VAL A 74 -9.292 10.153 -0.104 1.00 0.00 C ATOM 1120 CG2 VAL A 74 -8.962 11.000 2.215 1.00 0.00 C ATOM 0 H VAL A 74 -10.740 7.969 3.108 1.00 0.00 H new ATOM 0 HA VAL A 74 -11.526 10.430 1.705 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.863 8.961 1.598 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.246 10.380 -0.310 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -9.600 9.290 -0.695 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -9.908 11.012 -0.368 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -7.924 11.215 1.962 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -9.572 11.882 2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -9.031 10.735 3.270 1.00 0.00 H new ATOM 1130 N SER A 75 -12.064 9.176 -0.408 1.00 0.00 N ATOM 1131 CA SER A 75 -12.621 8.419 -1.523 1.00 0.00 C ATOM 1132 C SER A 75 -11.634 8.424 -2.683 1.00 0.00 C ATOM 1133 O SER A 75 -11.138 9.479 -3.078 1.00 0.00 O ATOM 1134 CB SER A 75 -13.959 9.017 -1.964 1.00 0.00 C ATOM 1135 OG SER A 75 -14.941 8.875 -0.952 1.00 0.00 O ATOM 0 H SER A 75 -12.150 10.188 -0.505 1.00 0.00 H new ATOM 0 HA SER A 75 -12.796 7.392 -1.202 1.00 0.00 H new ATOM 0 HB2 SER A 75 -13.828 10.073 -2.202 1.00 0.00 H new ATOM 0 HB3 SER A 75 -14.298 8.524 -2.875 1.00 0.00 H new ATOM 0 HG SER A 75 -15.785 9.267 -1.258 1.00 0.00 H new ATOM 1141 N PHE A 76 -11.325 7.245 -3.210 1.00 0.00 N ATOM 1142 CA PHE A 76 -10.366 7.137 -4.305 1.00 0.00 C ATOM 1143 C PHE A 76 -10.882 6.254 -5.431 1.00 0.00 C ATOM 1144 O PHE A 76 -11.877 5.546 -5.285 1.00 0.00 O ATOM 1145 CB PHE A 76 -9.034 6.572 -3.792 1.00 0.00 C ATOM 1146 CG PHE A 76 -9.091 6.098 -2.370 1.00 0.00 C ATOM 1147 CD1 PHE A 76 -9.868 5.005 -2.021 1.00 0.00 C ATOM 1148 CD2 PHE A 76 -8.380 6.753 -1.382 1.00 0.00 C ATOM 1149 CE1 PHE A 76 -9.933 4.576 -0.711 1.00 0.00 C ATOM 1150 CE2 PHE A 76 -8.439 6.328 -0.072 1.00 0.00 C ATOM 1151 CZ PHE A 76 -9.218 5.238 0.265 1.00 0.00 C ATOM 0 H PHE A 76 -11.720 6.357 -2.901 1.00 0.00 H new ATOM 0 HA PHE A 76 -10.218 8.142 -4.700 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.731 5.743 -4.431 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -8.265 7.340 -3.880 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.429 4.483 -2.782 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.771 7.607 -1.639 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.543 3.723 -0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -7.877 6.847 0.690 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.267 4.905 1.291 1.00 0.00 H new ATOM 1161 N GLU A 77 -10.165 6.291 -6.546 1.00 0.00 N ATOM 1162 CA GLU A 77 -10.497 5.488 -7.709 1.00 0.00 C ATOM 1163 C GLU A 77 -9.422 4.431 -7.909 1.00 0.00 C ATOM 1164 O GLU A 77 -8.305 4.581 -7.410 1.00 0.00 O ATOM 1165 CB GLU A 77 -10.613 6.369 -8.955 1.00 0.00 C ATOM 1166 CG GLU A 77 -11.310 5.685 -10.120 1.00 0.00 C ATOM 1167 CD GLU A 77 -11.304 6.531 -11.379 1.00 0.00 C ATOM 1168 OE1 GLU A 77 -10.206 6.796 -11.911 1.00 0.00 O ATOM 1169 OE2 GLU A 77 -12.398 6.927 -11.832 1.00 0.00 O ATOM 0 H GLU A 77 -9.339 6.878 -6.667 1.00 0.00 H new ATOM 0 HA GLU A 77 -11.459 5.002 -7.547 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -11.158 7.277 -8.698 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -9.615 6.675 -9.268 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -10.820 4.733 -10.324 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.340 5.461 -9.842 1.00 0.00 H new ATOM 1176 N GLY A 78 -9.757 3.360 -8.618 1.00 0.00 N ATOM 1177 CA GLY A 78 -8.795 2.297 -8.845 1.00 0.00 C ATOM 1178 C GLY A 78 -8.239 2.286 -10.258 1.00 0.00 C ATOM 1179 O GLY A 78 -8.482 1.341 -11.008 1.00 0.00 O ATOM 0 H GLY A 78 -10.674 3.208 -9.039 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -7.972 2.403 -8.138 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.269 1.337 -8.640 1.00 0.00 H new ATOM 1183 N PRO A 79 -7.477 3.321 -10.654 1.00 0.00 N ATOM 1184 CA PRO A 79 -6.893 3.394 -11.993 1.00 0.00 C ATOM 1185 C PRO A 79 -5.816 2.337 -12.211 1.00 0.00 C ATOM 1186 O PRO A 79 -4.945 2.123 -11.356 1.00 0.00 O ATOM 1187 CB PRO A 79 -6.284 4.797 -12.050 1.00 0.00 C ATOM 1188 CG PRO A 79 -6.040 5.166 -10.629 1.00 0.00 C ATOM 1189 CD PRO A 79 -7.125 4.495 -9.834 1.00 0.00 C ATOM 0 HA PRO A 79 -7.637 3.211 -12.769 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -5.358 4.803 -12.624 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -6.961 5.503 -12.531 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -5.055 4.833 -10.303 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -6.071 6.247 -10.496 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -6.775 4.203 -8.844 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -7.981 5.154 -9.688 1.00 0.00 H new ATOM 1197 N GLY A 80 -5.884 1.677 -13.363 1.00 0.00 N ATOM 1198 CA GLY A 80 -4.917 0.651 -13.689 1.00 0.00 C ATOM 1199 C GLY A 80 -3.502 1.182 -13.698 1.00 0.00 C ATOM 1200 O GLY A 80 -2.808 1.131 -12.686 1.00 0.00 O ATOM 0 H GLY A 80 -6.595 1.837 -14.077 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.994 -0.161 -12.966 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -5.152 0.231 -14.667 1.00 0.00 H new ATOM 1204 N LEU A 81 -3.069 1.698 -14.843 1.00 0.00 N ATOM 1205 CA LEU A 81 -1.722 2.237 -14.961 1.00 0.00 C ATOM 1206 C LEU A 81 -1.690 3.740 -14.716 1.00 0.00 C ATOM 1207 O LEU A 81 -2.312 4.515 -15.443 1.00 0.00 O ATOM 1208 CB LEU A 81 -1.138 1.928 -16.337 1.00 0.00 C ATOM 1209 CG LEU A 81 0.351 1.577 -16.334 1.00 0.00 C ATOM 1210 CD1 LEU A 81 1.119 2.435 -15.338 1.00 0.00 C ATOM 1211 CD2 LEU A 81 0.551 0.099 -16.032 1.00 0.00 C ATOM 0 H LEU A 81 -3.627 1.754 -15.695 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.115 1.756 -14.194 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.692 1.098 -16.774 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.293 2.791 -16.985 1.00 0.00 H new ATOM 0 HG LEU A 81 0.746 1.785 -17.328 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.174 2.161 -15.360 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.011 3.486 -15.604 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.722 2.272 -14.336 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.616 -0.132 -16.034 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.132 -0.132 -15.053 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.049 -0.499 -16.792 1.00 0.00 H new ATOM 1223 N VAL A 82 -0.934 4.143 -13.702 1.00 0.00 N ATOM 1224 CA VAL A 82 -0.781 5.552 -13.366 1.00 0.00 C ATOM 1225 C VAL A 82 0.694 5.929 -13.395 1.00 0.00 C ATOM 1226 O VAL A 82 1.511 5.321 -12.703 1.00 0.00 O ATOM 1227 CB VAL A 82 -1.378 5.885 -11.978 1.00 0.00 C ATOM 1228 CG1 VAL A 82 -1.259 7.375 -11.686 1.00 0.00 C ATOM 1229 CG2 VAL A 82 -2.831 5.443 -11.910 1.00 0.00 C ATOM 0 H VAL A 82 -0.415 3.509 -13.095 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.329 6.131 -14.109 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.813 5.343 -11.220 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.684 7.589 -10.705 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.208 7.665 -11.697 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.799 7.939 -12.447 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.239 5.683 -10.928 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -3.405 5.961 -12.678 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.892 4.367 -12.075 1.00 0.00 H new ATOM 1239 N GLU A 83 1.035 6.920 -14.209 1.00 0.00 N ATOM 1240 CA GLU A 83 2.420 7.350 -14.330 1.00 0.00 C ATOM 1241 C GLU A 83 2.866 8.095 -13.080 1.00 0.00 C ATOM 1242 O GLU A 83 2.456 9.231 -12.839 1.00 0.00 O ATOM 1243 CB GLU A 83 2.595 8.243 -15.560 1.00 0.00 C ATOM 1244 CG GLU A 83 3.922 8.040 -16.274 1.00 0.00 C ATOM 1245 CD GLU A 83 4.219 9.140 -17.274 1.00 0.00 C ATOM 1246 OE1 GLU A 83 4.021 10.324 -16.930 1.00 0.00 O ATOM 1247 OE2 GLU A 83 4.650 8.817 -18.401 1.00 0.00 O ATOM 0 H GLU A 83 0.376 7.437 -14.791 1.00 0.00 H new ATOM 0 HA GLU A 83 3.042 6.462 -14.445 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.782 8.048 -16.259 1.00 0.00 H new ATOM 0 HB3 GLU A 83 2.511 9.286 -15.256 1.00 0.00 H new ATOM 0 HG2 GLU A 83 4.724 7.997 -15.537 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.910 7.079 -16.789 1.00 0.00 H new ATOM 1254 N VAL A 84 3.709 7.442 -12.288 1.00 0.00 N ATOM 1255 CA VAL A 84 4.214 8.035 -11.061 1.00 0.00 C ATOM 1256 C VAL A 84 5.250 9.109 -11.367 1.00 0.00 C ATOM 1257 O VAL A 84 6.329 8.813 -11.877 1.00 0.00 O ATOM 1258 CB VAL A 84 4.843 6.965 -10.138 1.00 0.00 C ATOM 1259 CG1 VAL A 84 5.623 7.610 -8.999 1.00 0.00 C ATOM 1260 CG2 VAL A 84 3.773 6.036 -9.590 1.00 0.00 C ATOM 0 H VAL A 84 4.056 6.501 -12.476 1.00 0.00 H new ATOM 0 HA VAL A 84 3.366 8.488 -10.547 1.00 0.00 H new ATOM 0 HB VAL A 84 5.541 6.378 -10.734 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.053 6.833 -8.367 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.422 8.228 -9.409 1.00 0.00 H new ATOM 0 HG13 VAL A 84 4.953 8.231 -8.405 1.00 0.00 H new ATOM 0 HG21 VAL A 84 4.235 5.290 -8.943 1.00 0.00 H new ATOM 0 HG22 VAL A 84 3.048 6.614 -9.017 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.267 5.536 -10.416 1.00 0.00 H new ATOM 1270 N GLN A 85 4.915 10.351 -11.034 1.00 0.00 N ATOM 1271 CA GLN A 85 5.815 11.476 -11.251 1.00 0.00 C ATOM 1272 C GLN A 85 6.957 11.422 -10.247 1.00 0.00 C ATOM 1273 O GLN A 85 6.786 10.915 -9.138 1.00 0.00 O ATOM 1274 CB GLN A 85 5.060 12.800 -11.118 1.00 0.00 C ATOM 1275 CG GLN A 85 3.747 12.832 -11.883 1.00 0.00 C ATOM 1276 CD GLN A 85 3.559 14.116 -12.668 1.00 0.00 C ATOM 1277 OE1 GLN A 85 3.927 14.199 -13.840 1.00 0.00 O ATOM 1278 NE2 GLN A 85 2.985 15.125 -12.024 1.00 0.00 N ATOM 0 H GLN A 85 4.022 10.604 -10.611 1.00 0.00 H new ATOM 0 HA GLN A 85 6.221 11.411 -12.260 1.00 0.00 H new ATOM 0 HB2 GLN A 85 4.861 12.991 -10.063 1.00 0.00 H new ATOM 0 HB3 GLN A 85 5.698 13.609 -11.473 1.00 0.00 H new ATOM 0 HG2 GLN A 85 3.709 11.984 -12.567 1.00 0.00 H new ATOM 0 HG3 GLN A 85 2.920 12.715 -11.183 1.00 0.00 H new ATOM 0 HE21 GLN A 85 2.696 15.011 -11.052 1.00 0.00 H new ATOM 0 HE22 GLN A 85 2.833 16.014 -12.501 1.00 0.00 H new ATOM 1287 N GLU A 86 8.124 11.927 -10.628 1.00 0.00 N ATOM 1288 CA GLU A 86 9.266 11.899 -9.727 1.00 0.00 C ATOM 1289 C GLU A 86 9.024 12.822 -8.542 1.00 0.00 C ATOM 1290 O GLU A 86 9.178 14.039 -8.639 1.00 0.00 O ATOM 1291 CB GLU A 86 10.540 12.317 -10.463 1.00 0.00 C ATOM 1292 CG GLU A 86 11.805 11.702 -9.886 1.00 0.00 C ATOM 1293 CD GLU A 86 12.855 12.741 -9.539 1.00 0.00 C ATOM 1294 OE1 GLU A 86 12.474 13.884 -9.213 1.00 0.00 O ATOM 1295 OE2 GLU A 86 14.058 12.410 -9.593 1.00 0.00 O ATOM 0 H GLU A 86 8.302 12.353 -11.538 1.00 0.00 H new ATOM 0 HA GLU A 86 9.392 10.880 -9.362 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.454 12.033 -11.512 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.627 13.403 -10.433 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.552 11.134 -8.991 1.00 0.00 H new ATOM 0 HG3 GLU A 86 12.222 10.996 -10.605 1.00 0.00 H new ATOM 1302 N SER A 87 8.646 12.221 -7.420 1.00 0.00 N ATOM 1303 CA SER A 87 8.379 12.965 -6.196 1.00 0.00 C ATOM 1304 C SER A 87 8.811 12.162 -4.976 1.00 0.00 C ATOM 1305 O SER A 87 9.113 10.975 -5.086 1.00 0.00 O ATOM 1306 CB SER A 87 6.891 13.307 -6.096 1.00 0.00 C ATOM 1307 OG SER A 87 6.385 13.753 -7.342 1.00 0.00 O ATOM 0 H SER A 87 8.517 11.213 -7.333 1.00 0.00 H new ATOM 0 HA SER A 87 8.954 13.891 -6.226 1.00 0.00 H new ATOM 0 HB2 SER A 87 6.334 12.429 -5.767 1.00 0.00 H new ATOM 0 HB3 SER A 87 6.742 14.080 -5.342 1.00 0.00 H new ATOM 0 HG SER A 87 5.432 13.964 -7.252 1.00 0.00 H new ATOM 1313 N GLU A 88 8.820 12.812 -3.815 1.00 0.00 N ATOM 1314 CA GLU A 88 9.196 12.158 -2.562 1.00 0.00 C ATOM 1315 C GLU A 88 10.467 11.314 -2.723 1.00 0.00 C ATOM 1316 O GLU A 88 11.570 11.784 -2.443 1.00 0.00 O ATOM 1317 CB GLU A 88 8.034 11.295 -2.055 1.00 0.00 C ATOM 1318 CG GLU A 88 7.993 11.160 -0.542 1.00 0.00 C ATOM 1319 CD GLU A 88 6.583 11.012 -0.006 1.00 0.00 C ATOM 1320 OE1 GLU A 88 5.720 11.839 -0.369 1.00 0.00 O ATOM 1321 OE2 GLU A 88 6.340 10.069 0.777 1.00 0.00 O ATOM 0 H GLU A 88 8.570 13.796 -3.715 1.00 0.00 H new ATOM 0 HA GLU A 88 9.413 12.933 -1.827 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.094 11.727 -2.399 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.109 10.302 -2.498 1.00 0.00 H new ATOM 0 HG2 GLU A 88 8.584 10.294 -0.242 1.00 0.00 H new ATOM 0 HG3 GLU A 88 8.459 12.036 -0.090 1.00 0.00 H new ATOM 1328 N TYR A 89 10.306 10.075 -3.181 1.00 0.00 N ATOM 1329 CA TYR A 89 11.436 9.176 -3.385 1.00 0.00 C ATOM 1330 C TYR A 89 11.105 8.141 -4.457 1.00 0.00 C ATOM 1331 O TYR A 89 11.678 7.051 -4.480 1.00 0.00 O ATOM 1332 CB TYR A 89 11.803 8.476 -2.074 1.00 0.00 C ATOM 1333 CG TYR A 89 10.605 8.011 -1.278 1.00 0.00 C ATOM 1334 CD1 TYR A 89 9.682 7.129 -1.825 1.00 0.00 C ATOM 1335 CD2 TYR A 89 10.396 8.455 0.022 1.00 0.00 C ATOM 1336 CE1 TYR A 89 8.585 6.704 -1.102 1.00 0.00 C ATOM 1337 CE2 TYR A 89 9.301 8.033 0.752 1.00 0.00 C ATOM 1338 CZ TYR A 89 8.398 7.158 0.186 1.00 0.00 C ATOM 1339 OH TYR A 89 7.307 6.737 0.910 1.00 0.00 O ATOM 0 H TYR A 89 9.400 9.671 -3.418 1.00 0.00 H new ATOM 0 HA TYR A 89 12.290 9.765 -3.719 1.00 0.00 H new ATOM 0 HB2 TYR A 89 12.436 7.617 -2.296 1.00 0.00 H new ATOM 0 HB3 TYR A 89 12.393 9.157 -1.461 1.00 0.00 H new ATOM 0 HD1 TYR A 89 9.825 6.769 -2.833 1.00 0.00 H new ATOM 0 HD2 TYR A 89 11.100 9.141 0.469 1.00 0.00 H new ATOM 0 HE1 TYR A 89 7.877 6.019 -1.544 1.00 0.00 H new ATOM 0 HE2 TYR A 89 9.153 8.387 1.762 1.00 0.00 H new ATOM 0 HH TYR A 89 7.325 7.150 1.799 1.00 0.00 H new ATOM 1349 N TYR A 90 10.174 8.491 -5.341 1.00 0.00 N ATOM 1350 CA TYR A 90 9.760 7.598 -6.417 1.00 0.00 C ATOM 1351 C TYR A 90 10.079 8.213 -7.780 1.00 0.00 C ATOM 1352 O TYR A 90 9.531 9.256 -8.135 1.00 0.00 O ATOM 1353 CB TYR A 90 8.258 7.315 -6.318 1.00 0.00 C ATOM 1354 CG TYR A 90 7.925 5.868 -6.035 1.00 0.00 C ATOM 1355 CD1 TYR A 90 8.089 5.332 -4.764 1.00 0.00 C ATOM 1356 CD2 TYR A 90 7.442 5.039 -7.039 1.00 0.00 C ATOM 1357 CE1 TYR A 90 7.783 4.011 -4.502 1.00 0.00 C ATOM 1358 CE2 TYR A 90 7.131 3.718 -6.785 1.00 0.00 C ATOM 1359 CZ TYR A 90 7.303 3.208 -5.516 1.00 0.00 C ATOM 1360 OH TYR A 90 6.995 1.892 -5.257 1.00 0.00 O ATOM 0 H TYR A 90 9.692 9.390 -5.332 1.00 0.00 H new ATOM 0 HA TYR A 90 10.310 6.662 -6.317 1.00 0.00 H new ATOM 0 HB2 TYR A 90 7.832 7.936 -5.530 1.00 0.00 H new ATOM 0 HB3 TYR A 90 7.780 7.612 -7.252 1.00 0.00 H new ATOM 0 HD1 TYR A 90 8.462 5.959 -3.967 1.00 0.00 H new ATOM 0 HD2 TYR A 90 7.307 5.434 -8.035 1.00 0.00 H new ATOM 0 HE1 TYR A 90 7.919 3.609 -3.509 1.00 0.00 H new ATOM 0 HE2 TYR A 90 6.755 3.087 -7.577 1.00 0.00 H new ATOM 0 HH TYR A 90 7.636 1.527 -4.612 1.00 0.00 H new ATOM 1370 N PRO A 91 10.967 7.574 -8.564 1.00 0.00 N ATOM 1371 CA PRO A 91 11.351 8.067 -9.894 1.00 0.00 C ATOM 1372 C PRO A 91 10.164 8.129 -10.850 1.00 0.00 C ATOM 1373 O PRO A 91 9.238 7.326 -10.752 1.00 0.00 O ATOM 1374 CB PRO A 91 12.375 7.037 -10.387 1.00 0.00 C ATOM 1375 CG PRO A 91 12.836 6.324 -9.162 1.00 0.00 C ATOM 1376 CD PRO A 91 11.666 6.325 -8.221 1.00 0.00 C ATOM 0 HA PRO A 91 11.742 9.083 -9.849 1.00 0.00 H new ATOM 0 HB2 PRO A 91 11.925 6.345 -11.099 1.00 0.00 H new ATOM 0 HB3 PRO A 91 13.207 7.523 -10.896 1.00 0.00 H new ATOM 0 HG2 PRO A 91 13.148 5.306 -9.396 1.00 0.00 H new ATOM 0 HG3 PRO A 91 13.695 6.826 -8.718 1.00 0.00 H new ATOM 0 HD2 PRO A 91 11.029 5.453 -8.368 1.00 0.00 H new ATOM 0 HD3 PRO A 91 11.986 6.314 -7.179 1.00 0.00 H new ATOM 1384 N LYS A 92 10.199 9.090 -11.772 1.00 0.00 N ATOM 1385 CA LYS A 92 9.124 9.257 -12.749 1.00 0.00 C ATOM 1386 C LYS A 92 8.948 7.992 -13.585 1.00 0.00 C ATOM 1387 O LYS A 92 9.422 7.916 -14.719 1.00 0.00 O ATOM 1388 CB LYS A 92 9.421 10.448 -13.664 1.00 0.00 C ATOM 1389 CG LYS A 92 8.353 10.685 -14.722 1.00 0.00 C ATOM 1390 CD LYS A 92 7.525 11.926 -14.418 1.00 0.00 C ATOM 1391 CE LYS A 92 7.669 12.975 -15.510 1.00 0.00 C ATOM 1392 NZ LYS A 92 9.018 13.604 -15.502 1.00 0.00 N ATOM 0 H LYS A 92 10.959 9.764 -11.863 1.00 0.00 H new ATOM 0 HA LYS A 92 8.198 9.445 -12.206 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.523 11.346 -13.055 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.380 10.286 -14.157 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.826 10.793 -15.698 1.00 0.00 H new ATOM 0 HG3 LYS A 92 7.698 9.816 -14.779 1.00 0.00 H new ATOM 0 HD2 LYS A 92 6.476 11.648 -14.315 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.838 12.348 -13.463 1.00 0.00 H new ATOM 0 HE2 LYS A 92 7.489 12.515 -16.481 1.00 0.00 H new ATOM 0 HE3 LYS A 92 6.909 13.745 -15.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.075 14.313 -16.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.180 14.066 -14.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.742 12.874 -15.655 1.00 0.00 H new ATOM 1406 N ARG A 93 8.273 6.996 -13.017 1.00 0.00 N ATOM 1407 CA ARG A 93 8.049 5.731 -13.714 1.00 0.00 C ATOM 1408 C ARG A 93 6.564 5.388 -13.804 1.00 0.00 C ATOM 1409 O ARG A 93 5.708 6.129 -13.319 1.00 0.00 O ATOM 1410 CB ARG A 93 8.799 4.601 -13.008 1.00 0.00 C ATOM 1411 CG ARG A 93 9.363 3.559 -13.960 1.00 0.00 C ATOM 1412 CD ARG A 93 10.755 3.113 -13.541 1.00 0.00 C ATOM 1413 NE ARG A 93 11.800 3.797 -14.297 1.00 0.00 N ATOM 1414 CZ ARG A 93 13.055 3.361 -14.389 1.00 0.00 C ATOM 1415 NH1 ARG A 93 13.423 2.244 -13.774 1.00 0.00 N ATOM 1416 NH2 ARG A 93 13.943 4.044 -15.098 1.00 0.00 N ATOM 0 H ARG A 93 7.873 7.039 -12.080 1.00 0.00 H new ATOM 0 HA ARG A 93 8.429 5.844 -14.729 1.00 0.00 H new ATOM 0 HB2 ARG A 93 9.615 5.027 -12.424 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.125 4.112 -12.305 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.698 2.696 -13.991 1.00 0.00 H new ATOM 0 HG3 ARG A 93 9.400 3.969 -14.969 1.00 0.00 H new ATOM 0 HD2 ARG A 93 10.892 3.306 -12.477 1.00 0.00 H new ATOM 0 HD3 ARG A 93 10.849 2.037 -13.685 1.00 0.00 H new ATOM 0 HE ARG A 93 11.554 4.659 -14.783 1.00 0.00 H new ATOM 0 HH11 ARG A 93 12.743 1.715 -13.228 1.00 0.00 H new ATOM 0 HH12 ARG A 93 14.386 1.915 -13.848 1.00 0.00 H new ATOM 0 HH21 ARG A 93 13.665 4.903 -15.573 1.00 0.00 H new ATOM 0 HH22 ARG A 93 14.904 3.711 -15.169 1.00 0.00 H new ATOM 1430 N TYR A 94 6.275 4.248 -14.427 1.00 0.00 N ATOM 1431 CA TYR A 94 4.904 3.774 -14.590 1.00 0.00 C ATOM 1432 C TYR A 94 4.523 2.819 -13.461 1.00 0.00 C ATOM 1433 O TYR A 94 5.280 1.906 -13.130 1.00 0.00 O ATOM 1434 CB TYR A 94 4.746 3.078 -15.941 1.00 0.00 C ATOM 1435 CG TYR A 94 4.386 4.022 -17.063 1.00 0.00 C ATOM 1436 CD1 TYR A 94 5.325 4.906 -17.577 1.00 0.00 C ATOM 1437 CD2 TYR A 94 3.108 4.034 -17.603 1.00 0.00 C ATOM 1438 CE1 TYR A 94 5.000 5.775 -18.599 1.00 0.00 C ATOM 1439 CE2 TYR A 94 2.774 4.898 -18.625 1.00 0.00 C ATOM 1440 CZ TYR A 94 3.723 5.769 -19.120 1.00 0.00 C ATOM 1441 OH TYR A 94 3.394 6.633 -20.139 1.00 0.00 O ATOM 0 H TYR A 94 6.980 3.631 -14.830 1.00 0.00 H new ATOM 0 HA TYR A 94 4.237 4.635 -14.552 1.00 0.00 H new ATOM 0 HB2 TYR A 94 5.677 2.568 -16.190 1.00 0.00 H new ATOM 0 HB3 TYR A 94 3.975 2.312 -15.859 1.00 0.00 H new ATOM 0 HD1 TYR A 94 6.326 4.914 -17.171 1.00 0.00 H new ATOM 0 HD2 TYR A 94 2.362 3.355 -17.217 1.00 0.00 H new ATOM 0 HE1 TYR A 94 5.742 6.456 -18.989 1.00 0.00 H new ATOM 0 HE2 TYR A 94 1.775 4.893 -19.036 1.00 0.00 H new ATOM 0 HH TYR A 94 3.665 7.543 -19.897 1.00 0.00 H new ATOM 1451 N GLN A 95 3.352 3.036 -12.869 1.00 0.00 N ATOM 1452 CA GLN A 95 2.885 2.192 -11.772 1.00 0.00 C ATOM 1453 C GLN A 95 1.452 1.719 -12.010 1.00 0.00 C ATOM 1454 O GLN A 95 0.546 2.531 -12.189 1.00 0.00 O ATOM 1455 CB GLN A 95 2.969 2.955 -10.449 1.00 0.00 C ATOM 1456 CG GLN A 95 2.787 2.073 -9.225 1.00 0.00 C ATOM 1457 CD GLN A 95 1.712 2.587 -8.289 1.00 0.00 C ATOM 1458 OE1 GLN A 95 1.351 3.763 -8.327 1.00 0.00 O ATOM 1459 NE2 GLN A 95 1.193 1.704 -7.444 1.00 0.00 N ATOM 0 H GLN A 95 2.711 3.786 -13.129 1.00 0.00 H new ATOM 0 HA GLN A 95 3.530 1.314 -11.724 1.00 0.00 H new ATOM 0 HB2 GLN A 95 3.937 3.453 -10.387 1.00 0.00 H new ATOM 0 HB3 GLN A 95 2.208 3.735 -10.440 1.00 0.00 H new ATOM 0 HG2 GLN A 95 2.532 1.063 -9.545 1.00 0.00 H new ATOM 0 HG3 GLN A 95 3.732 2.008 -8.686 1.00 0.00 H new ATOM 0 HE21 GLN A 95 1.523 0.739 -7.448 1.00 0.00 H new ATOM 0 HE22 GLN A 95 0.464 1.991 -6.791 1.00 0.00 H new ATOM 1468 N SER A 96 1.250 0.399 -12.013 1.00 0.00 N ATOM 1469 CA SER A 96 -0.080 -0.166 -12.237 1.00 0.00 C ATOM 1470 C SER A 96 -0.777 -0.528 -10.926 1.00 0.00 C ATOM 1471 O SER A 96 -0.137 -0.673 -9.884 1.00 0.00 O ATOM 1472 CB SER A 96 0.017 -1.403 -13.132 1.00 0.00 C ATOM 1473 OG SER A 96 -1.234 -1.704 -13.724 1.00 0.00 O ATOM 0 H SER A 96 1.985 -0.293 -11.864 1.00 0.00 H new ATOM 0 HA SER A 96 -0.680 0.598 -12.731 1.00 0.00 H new ATOM 0 HB2 SER A 96 0.760 -1.234 -13.911 1.00 0.00 H new ATOM 0 HB3 SER A 96 0.359 -2.255 -12.544 1.00 0.00 H new ATOM 0 HG SER A 96 -1.833 -2.082 -13.047 1.00 0.00 H new ATOM 1479 N HIS A 97 -2.100 -0.681 -10.997 1.00 0.00 N ATOM 1480 CA HIS A 97 -2.912 -1.036 -9.834 1.00 0.00 C ATOM 1481 C HIS A 97 -2.711 -0.049 -8.686 1.00 0.00 C ATOM 1482 O HIS A 97 -2.354 -0.444 -7.573 1.00 0.00 O ATOM 1483 CB HIS A 97 -2.573 -2.454 -9.369 1.00 0.00 C ATOM 1484 CG HIS A 97 -2.618 -3.472 -10.467 1.00 0.00 C ATOM 1485 ND1 HIS A 97 -3.185 -3.225 -11.700 1.00 0.00 N ATOM 1486 CD2 HIS A 97 -2.163 -4.747 -10.513 1.00 0.00 C ATOM 1487 CE1 HIS A 97 -3.077 -4.303 -12.456 1.00 0.00 C ATOM 1488 NE2 HIS A 97 -2.460 -5.240 -11.759 1.00 0.00 N ATOM 0 H HIS A 97 -2.636 -0.563 -11.857 1.00 0.00 H new ATOM 0 HA HIS A 97 -3.959 -0.993 -10.134 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -1.577 -2.454 -8.926 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.271 -2.747 -8.585 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -1.660 -5.277 -9.717 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -3.433 -4.401 -13.471 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -2.240 -6.178 -12.093 1.00 0.00 H new ATOM 1497 N VAL A 98 -2.945 1.234 -8.951 1.00 0.00 N ATOM 1498 CA VAL A 98 -2.785 2.254 -7.918 1.00 0.00 C ATOM 1499 C VAL A 98 -4.067 3.060 -7.722 1.00 0.00 C ATOM 1500 O VAL A 98 -4.746 3.406 -8.685 1.00 0.00 O ATOM 1501 CB VAL A 98 -1.610 3.204 -8.239 1.00 0.00 C ATOM 1502 CG1 VAL A 98 -1.897 4.046 -9.467 1.00 0.00 C ATOM 1503 CG2 VAL A 98 -1.293 4.103 -7.059 1.00 0.00 C ATOM 0 H VAL A 98 -3.242 1.589 -9.860 1.00 0.00 H new ATOM 0 HA VAL A 98 -2.562 1.729 -6.989 1.00 0.00 H new ATOM 0 HB VAL A 98 -0.741 2.579 -8.445 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -1.050 4.703 -9.664 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.058 3.394 -10.326 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -2.790 4.647 -9.295 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -0.462 4.760 -7.315 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.169 4.704 -6.814 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -1.020 3.492 -6.199 1.00 0.00 H new ATOM 1513 N LEU A 99 -4.387 3.358 -6.466 1.00 0.00 N ATOM 1514 CA LEU A 99 -5.580 4.131 -6.140 1.00 0.00 C ATOM 1515 C LEU A 99 -5.202 5.573 -5.826 1.00 0.00 C ATOM 1516 O LEU A 99 -4.180 5.825 -5.187 1.00 0.00 O ATOM 1517 CB LEU A 99 -6.314 3.509 -4.950 1.00 0.00 C ATOM 1518 CG LEU A 99 -7.296 2.393 -5.308 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -6.563 1.218 -5.936 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -8.067 1.946 -4.075 1.00 0.00 C ATOM 0 H LEU A 99 -3.835 3.075 -5.656 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.246 4.120 -7.003 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.575 3.113 -4.253 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.857 4.296 -4.426 1.00 0.00 H new ATOM 0 HG LEU A 99 -8.008 2.781 -6.036 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -7.278 0.434 -6.184 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.057 1.548 -6.843 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.828 0.829 -5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -8.761 1.151 -4.348 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.369 1.576 -3.324 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.624 2.790 -3.668 1.00 0.00 H new ATOM 1532 N LEU A 100 -6.012 6.522 -6.285 1.00 0.00 N ATOM 1533 CA LEU A 100 -5.718 7.933 -6.045 1.00 0.00 C ATOM 1534 C LEU A 100 -6.939 8.709 -5.555 1.00 0.00 C ATOM 1535 O LEU A 100 -8.062 8.483 -6.007 1.00 0.00 O ATOM 1536 CB LEU A 100 -5.155 8.576 -7.315 1.00 0.00 C ATOM 1537 CG LEU A 100 -3.636 8.766 -7.315 1.00 0.00 C ATOM 1538 CD1 LEU A 100 -3.167 9.355 -8.634 1.00 0.00 C ATOM 1539 CD2 LEU A 100 -3.213 9.659 -6.157 1.00 0.00 C ATOM 0 H LEU A 100 -6.864 6.346 -6.817 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.972 7.977 -5.252 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.431 7.960 -8.171 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.629 9.547 -7.455 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.170 7.789 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.085 9.481 -8.612 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.437 8.683 -9.449 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.642 10.324 -8.789 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.130 9.784 -6.171 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.692 10.633 -6.255 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.513 9.200 -5.215 1.00 0.00 H new ATOM 1551 N ALA A 101 -6.695 9.639 -4.632 1.00 0.00 N ATOM 1552 CA ALA A 101 -7.748 10.478 -4.071 1.00 0.00 C ATOM 1553 C ALA A 101 -7.185 11.818 -3.619 1.00 0.00 C ATOM 1554 O ALA A 101 -6.044 11.898 -3.174 1.00 0.00 O ATOM 1555 CB ALA A 101 -8.423 9.789 -2.898 1.00 0.00 C ATOM 0 H ALA A 101 -5.766 9.830 -4.255 1.00 0.00 H new ATOM 0 HA ALA A 101 -8.488 10.648 -4.853 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -9.204 10.435 -2.497 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -8.864 8.850 -3.232 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -7.685 9.587 -2.121 1.00 0.00 H new ATOM 1561 N THR A 102 -7.988 12.870 -3.728 1.00 0.00 N ATOM 1562 CA THR A 102 -7.549 14.199 -3.321 1.00 0.00 C ATOM 1563 C THR A 102 -8.096 14.561 -1.944 1.00 0.00 C ATOM 1564 O THR A 102 -9.309 14.638 -1.742 1.00 0.00 O ATOM 1565 CB THR A 102 -7.973 15.243 -4.355 1.00 0.00 C ATOM 1566 OG1 THR A 102 -7.866 16.551 -3.821 1.00 0.00 O ATOM 1567 CG2 THR A 102 -9.393 15.062 -4.847 1.00 0.00 C ATOM 0 H THR A 102 -8.940 12.829 -4.092 1.00 0.00 H new ATOM 0 HA THR A 102 -6.461 14.189 -3.260 1.00 0.00 H new ATOM 0 HB THR A 102 -7.296 15.103 -5.197 1.00 0.00 H new ATOM 0 HG1 THR A 102 -6.989 16.661 -3.398 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.626 15.836 -5.578 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.495 14.082 -5.312 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.082 15.137 -4.006 1.00 0.00 H new ATOM 1575 N GLY A 103 -7.187 14.780 -0.997 1.00 0.00 N ATOM 1576 CA GLY A 103 -7.582 15.131 0.357 1.00 0.00 C ATOM 1577 C GLY A 103 -7.797 16.623 0.541 1.00 0.00 C ATOM 1578 O GLY A 103 -8.236 17.063 1.603 1.00 0.00 O ATOM 0 H GLY A 103 -6.179 14.720 -1.144 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.501 14.602 0.611 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.816 14.791 1.054 1.00 0.00 H new ATOM 1678 N GLY A 112 1.803 4.961 5.322 1.00 0.00 N ATOM 1679 CA GLY A 112 0.935 3.986 5.957 1.00 0.00 C ATOM 1680 C GLY A 112 0.109 3.203 4.955 1.00 0.00 C ATOM 1681 O GLY A 112 0.165 3.465 3.753 1.00 0.00 O ATOM 0 HA2 GLY A 112 1.539 3.294 6.544 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.269 4.496 6.652 1.00 0.00 H new ATOM 1685 N ILE A 113 -0.662 2.240 5.452 1.00 0.00 N ATOM 1686 CA ILE A 113 -1.505 1.415 4.595 1.00 0.00 C ATOM 1687 C ILE A 113 -2.939 1.933 4.574 1.00 0.00 C ATOM 1688 O ILE A 113 -3.434 2.456 5.573 1.00 0.00 O ATOM 1689 CB ILE A 113 -1.503 -0.059 5.052 1.00 0.00 C ATOM 1690 CG1 ILE A 113 -2.115 -0.192 6.449 1.00 0.00 C ATOM 1691 CG2 ILE A 113 -0.087 -0.615 5.035 1.00 0.00 C ATOM 1692 CD1 ILE A 113 -3.584 -0.558 6.433 1.00 0.00 C ATOM 0 H ILE A 113 -0.720 2.012 6.445 1.00 0.00 H new ATOM 0 HA ILE A 113 -1.088 1.472 3.590 1.00 0.00 H new ATOM 0 HB ILE A 113 -2.112 -0.637 4.357 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -1.566 -0.951 7.007 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -1.989 0.750 6.983 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -0.101 -1.655 5.360 1.00 0.00 H new ATOM 0 HG22 ILE A 113 0.315 -0.556 4.024 1.00 0.00 H new ATOM 0 HG23 ILE A 113 0.541 -0.033 5.710 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -3.951 -0.635 7.456 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -4.145 0.212 5.903 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -3.715 -1.515 5.927 1.00 0.00 H new ATOM 1704 N LEU A 114 -3.605 1.788 3.432 1.00 0.00 N ATOM 1705 CA LEU A 114 -4.982 2.247 3.296 1.00 0.00 C ATOM 1706 C LEU A 114 -5.960 1.165 3.736 1.00 0.00 C ATOM 1707 O LEU A 114 -6.075 0.118 3.094 1.00 0.00 O ATOM 1708 CB LEU A 114 -5.273 2.645 1.848 1.00 0.00 C ATOM 1709 CG LEU A 114 -6.745 2.935 1.547 1.00 0.00 C ATOM 1710 CD1 LEU A 114 -7.222 4.140 2.342 1.00 0.00 C ATOM 1711 CD2 LEU A 114 -6.953 3.155 0.056 1.00 0.00 C ATOM 0 H LEU A 114 -3.216 1.359 2.593 1.00 0.00 H new ATOM 0 HA LEU A 114 -5.110 3.118 3.939 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -4.685 3.530 1.604 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -4.933 1.845 1.190 1.00 0.00 H new ATOM 0 HG LEU A 114 -7.337 2.070 1.848 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -8.271 4.333 2.116 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -7.111 3.940 3.408 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -6.627 5.012 2.073 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -8.006 3.360 -0.138 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -6.352 4.002 -0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -6.651 2.261 -0.489 1.00 0.00 H new ATOM 1723 N ARG A 115 -6.664 1.432 4.834 1.00 0.00 N ATOM 1724 CA ARG A 115 -7.643 0.494 5.370 1.00 0.00 C ATOM 1725 C ARG A 115 -9.043 1.108 5.398 1.00 0.00 C ATOM 1726 O ARG A 115 -9.215 2.265 5.778 1.00 0.00 O ATOM 1727 CB ARG A 115 -7.238 0.056 6.779 1.00 0.00 C ATOM 1728 CG ARG A 115 -6.954 1.217 7.718 1.00 0.00 C ATOM 1729 CD ARG A 115 -7.090 0.804 9.175 1.00 0.00 C ATOM 1730 NE ARG A 115 -5.791 0.650 9.824 1.00 0.00 N ATOM 1731 CZ ARG A 115 -5.634 0.418 11.126 1.00 0.00 C ATOM 1732 NH1 ARG A 115 -6.693 0.311 11.919 1.00 0.00 N ATOM 1733 NH2 ARG A 115 -4.417 0.292 11.637 1.00 0.00 N ATOM 0 H ARG A 115 -6.573 2.295 5.371 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.667 -0.376 4.714 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -8.033 -0.557 7.203 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -6.351 -0.574 6.714 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.947 1.593 7.538 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -7.642 2.035 7.505 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -7.676 1.551 9.710 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -7.639 -0.136 9.236 1.00 0.00 H new ATOM 0 HE ARG A 115 -4.954 0.725 9.246 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -7.632 0.406 11.532 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.568 0.133 12.916 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -3.599 0.373 11.033 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -4.299 0.114 12.634 1.00 0.00 H new ATOM 1747 N CYS A 116 -10.039 0.315 5.019 1.00 0.00 N ATOM 1748 CA CYS A 116 -11.426 0.766 5.025 1.00 0.00 C ATOM 1749 C CYS A 116 -12.204 0.024 6.105 1.00 0.00 C ATOM 1750 O CYS A 116 -11.664 -0.858 6.774 1.00 0.00 O ATOM 1751 CB CYS A 116 -12.080 0.534 3.659 1.00 0.00 C ATOM 1752 SG CYS A 116 -12.125 -1.213 3.145 1.00 0.00 S ATOM 0 H CYS A 116 -9.911 -0.646 4.703 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.441 1.835 5.236 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.099 0.920 3.685 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -11.540 1.109 2.907 1.00 0.00 H new ATOM 0 HG CYS A 116 -13.348 -1.551 2.862 1.00 0.00 H new ATOM 1757 N GLU A 117 -13.473 0.375 6.271 1.00 0.00 N ATOM 1758 CA GLU A 117 -14.315 -0.271 7.272 1.00 0.00 C ATOM 1759 C GLU A 117 -14.362 -1.785 7.062 1.00 0.00 C ATOM 1760 O GLU A 117 -14.708 -2.535 7.974 1.00 0.00 O ATOM 1761 CB GLU A 117 -15.732 0.303 7.222 1.00 0.00 C ATOM 1762 CG GLU A 117 -15.805 1.775 7.593 1.00 0.00 C ATOM 1763 CD GLU A 117 -16.501 2.010 8.920 1.00 0.00 C ATOM 1764 OE1 GLU A 117 -15.899 1.697 9.969 1.00 0.00 O ATOM 1765 OE2 GLU A 117 -17.647 2.505 8.910 1.00 0.00 O ATOM 0 H GLU A 117 -13.941 1.101 5.728 1.00 0.00 H new ATOM 0 HA GLU A 117 -13.880 -0.074 8.252 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -16.134 0.170 6.218 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -16.370 -0.266 7.899 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -14.796 2.184 7.639 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -16.334 2.317 6.809 1.00 0.00 H new ATOM 1772 N HIS A 118 -14.023 -2.226 5.854 1.00 0.00 N ATOM 1773 CA HIS A 118 -14.038 -3.647 5.523 1.00 0.00 C ATOM 1774 C HIS A 118 -12.685 -4.313 5.796 1.00 0.00 C ATOM 1775 O HIS A 118 -12.632 -5.483 6.174 1.00 0.00 O ATOM 1776 CB HIS A 118 -14.429 -3.838 4.056 1.00 0.00 C ATOM 1777 CG HIS A 118 -15.645 -3.056 3.656 1.00 0.00 C ATOM 1778 ND1 HIS A 118 -15.605 -2.003 2.764 1.00 0.00 N ATOM 1779 CD2 HIS A 118 -16.941 -3.179 4.028 1.00 0.00 C ATOM 1780 CE1 HIS A 118 -16.821 -1.513 2.606 1.00 0.00 C ATOM 1781 NE2 HIS A 118 -17.650 -2.209 3.361 1.00 0.00 N ATOM 0 H HIS A 118 -13.734 -1.619 5.087 1.00 0.00 H new ATOM 0 HA HIS A 118 -14.777 -4.127 6.165 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -13.592 -3.543 3.423 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -14.610 -4.897 3.871 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -17.343 -3.904 4.720 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -17.091 -0.684 1.968 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -18.655 -2.052 3.437 1.00 0.00 H new ATOM 1789 N GLY A 119 -11.594 -3.570 5.603 1.00 0.00 N ATOM 1790 CA GLY A 119 -10.270 -4.129 5.838 1.00 0.00 C ATOM 1791 C GLY A 119 -9.165 -3.363 5.132 1.00 0.00 C ATOM 1792 O GLY A 119 -9.272 -2.160 4.918 1.00 0.00 O ATOM 0 H GLY A 119 -11.603 -2.599 5.291 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -10.071 -4.137 6.910 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.256 -5.166 5.503 1.00 0.00 H new ATOM 1796 N VAL A 120 -8.094 -4.070 4.779 1.00 0.00 N ATOM 1797 CA VAL A 120 -6.951 -3.461 4.100 1.00 0.00 C ATOM 1798 C VAL A 120 -7.176 -3.368 2.592 1.00 0.00 C ATOM 1799 O VAL A 120 -7.635 -4.320 1.965 1.00 0.00 O ATOM 1800 CB VAL A 120 -5.649 -4.251 4.347 1.00 0.00 C ATOM 1801 CG1 VAL A 120 -4.443 -3.441 3.906 1.00 0.00 C ATOM 1802 CG2 VAL A 120 -5.521 -4.658 5.807 1.00 0.00 C ATOM 0 H VAL A 120 -7.993 -5.070 4.953 1.00 0.00 H new ATOM 0 HA VAL A 120 -6.853 -2.459 4.519 1.00 0.00 H new ATOM 0 HB VAL A 120 -5.690 -5.162 3.750 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.534 -4.014 4.088 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -4.524 -3.217 2.842 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -4.404 -2.510 4.471 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.594 -5.213 5.950 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.510 -3.766 6.434 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.367 -5.287 6.085 1.00 0.00 H new ATOM 1812 N ILE A 121 -6.840 -2.216 2.015 1.00 0.00 N ATOM 1813 CA ILE A 121 -6.995 -2.006 0.580 1.00 0.00 C ATOM 1814 C ILE A 121 -5.641 -1.955 -0.114 1.00 0.00 C ATOM 1815 O ILE A 121 -5.437 -2.607 -1.136 1.00 0.00 O ATOM 1816 CB ILE A 121 -7.767 -0.707 0.270 1.00 0.00 C ATOM 1817 CG1 ILE A 121 -9.169 -0.779 0.866 1.00 0.00 C ATOM 1818 CG2 ILE A 121 -7.836 -0.459 -1.230 1.00 0.00 C ATOM 1819 CD1 ILE A 121 -9.176 -0.675 2.368 1.00 0.00 C ATOM 0 H ILE A 121 -6.459 -1.416 2.520 1.00 0.00 H new ATOM 0 HA ILE A 121 -7.568 -2.853 0.202 1.00 0.00 H new ATOM 0 HB ILE A 121 -7.233 0.128 0.723 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -9.777 0.024 0.449 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -9.636 -1.719 0.570 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.385 0.463 -1.421 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -6.826 -0.370 -1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.346 -1.292 -1.713 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -10.202 -0.733 2.732 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -8.594 -1.493 2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -8.737 0.276 2.669 1.00 0.00 H new ATOM 1831 N GLY A 122 -4.718 -1.173 0.440 1.00 0.00 N ATOM 1832 CA GLY A 122 -3.402 -1.061 -0.163 1.00 0.00 C ATOM 1833 C GLY A 122 -2.393 -0.363 0.729 1.00 0.00 C ATOM 1834 O GLY A 122 -2.670 -0.084 1.895 1.00 0.00 O ATOM 0 H GLY A 122 -4.856 -0.621 1.286 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -3.034 -2.058 -0.405 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.485 -0.515 -1.103 1.00 0.00 H new ATOM 1838 N LEU A 123 -1.218 -0.081 0.172 1.00 0.00 N ATOM 1839 CA LEU A 123 -0.155 0.587 0.913 1.00 0.00 C ATOM 1840 C LEU A 123 0.202 1.922 0.265 1.00 0.00 C ATOM 1841 O LEU A 123 -0.161 2.183 -0.881 1.00 0.00 O ATOM 1842 CB LEU A 123 1.085 -0.304 0.987 1.00 0.00 C ATOM 1843 CG LEU A 123 1.508 -0.937 -0.338 1.00 0.00 C ATOM 1844 CD1 LEU A 123 3.017 -1.114 -0.388 1.00 0.00 C ATOM 1845 CD2 LEU A 123 0.806 -2.273 -0.538 1.00 0.00 C ATOM 0 H LEU A 123 -0.979 -0.306 -0.794 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.516 0.777 1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 123 1.916 0.288 1.371 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.899 -1.099 1.709 1.00 0.00 H new ATOM 0 HG LEU A 123 1.214 -0.269 -1.148 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.299 -1.566 -1.339 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.501 -0.142 -0.291 1.00 0.00 H new ATOM 0 HD13 LEU A 123 3.335 -1.761 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.119 -2.710 -1.486 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.069 -2.948 0.277 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.273 -2.119 -0.548 1.00 0.00 H new ATOM 1857 N VAL A 124 0.909 2.766 1.009 1.00 0.00 N ATOM 1858 CA VAL A 124 1.309 4.076 0.507 1.00 0.00 C ATOM 1859 C VAL A 124 2.195 3.954 -0.731 1.00 0.00 C ATOM 1860 O VAL A 124 3.261 3.342 -0.684 1.00 0.00 O ATOM 1861 CB VAL A 124 2.058 4.881 1.587 1.00 0.00 C ATOM 1862 CG1 VAL A 124 3.333 4.164 2.005 1.00 0.00 C ATOM 1863 CG2 VAL A 124 2.366 6.286 1.092 1.00 0.00 C ATOM 0 H VAL A 124 1.217 2.567 1.961 1.00 0.00 H new ATOM 0 HA VAL A 124 0.394 4.603 0.236 1.00 0.00 H new ATOM 0 HB VAL A 124 1.413 4.962 2.462 1.00 0.00 H new ATOM 0 HG11 VAL A 124 3.846 4.749 2.768 1.00 0.00 H new ATOM 0 HG12 VAL A 124 3.083 3.182 2.408 1.00 0.00 H new ATOM 0 HG13 VAL A 124 3.985 4.046 1.139 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.895 6.838 1.869 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.989 6.229 0.200 1.00 0.00 H new ATOM 0 HG23 VAL A 124 1.435 6.800 0.852 1.00 0.00 H new ATOM 1873 N THR A 125 1.749 4.551 -1.835 1.00 0.00 N ATOM 1874 CA THR A 125 2.507 4.518 -3.082 1.00 0.00 C ATOM 1875 C THR A 125 2.944 5.932 -3.479 1.00 0.00 C ATOM 1876 O THR A 125 3.939 6.438 -2.960 1.00 0.00 O ATOM 1877 CB THR A 125 1.681 3.852 -4.190 1.00 0.00 C ATOM 1878 OG1 THR A 125 1.552 2.466 -3.943 1.00 0.00 O ATOM 1879 CG2 THR A 125 2.274 4.013 -5.575 1.00 0.00 C ATOM 0 H THR A 125 0.868 5.062 -1.890 1.00 0.00 H new ATOM 0 HA THR A 125 3.408 3.922 -2.934 1.00 0.00 H new ATOM 0 HB THR A 125 0.716 4.358 -4.170 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.442 2.060 -3.887 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.635 3.516 -6.305 1.00 0.00 H new ATOM 0 HG22 THR A 125 2.347 5.073 -5.819 1.00 0.00 H new ATOM 0 HG23 THR A 125 3.268 3.566 -5.599 1.00 0.00 H new ATOM 1887 N MET A 126 2.209 6.578 -4.388 1.00 0.00 N ATOM 1888 CA MET A 126 2.562 7.930 -4.808 1.00 0.00 C ATOM 1889 C MET A 126 1.934 8.964 -3.877 1.00 0.00 C ATOM 1890 O MET A 126 0.996 8.660 -3.142 1.00 0.00 O ATOM 1891 CB MET A 126 2.122 8.180 -6.253 1.00 0.00 C ATOM 1892 CG MET A 126 3.281 8.454 -7.200 1.00 0.00 C ATOM 1893 SD MET A 126 4.008 10.089 -6.963 1.00 0.00 S ATOM 1894 CE MET A 126 5.648 9.654 -6.382 1.00 0.00 C ATOM 0 H MET A 126 1.380 6.192 -4.839 1.00 0.00 H new ATOM 0 HA MET A 126 3.646 8.029 -4.755 1.00 0.00 H new ATOM 0 HB2 MET A 126 1.567 7.313 -6.611 1.00 0.00 H new ATOM 0 HB3 MET A 126 1.437 9.028 -6.275 1.00 0.00 H new ATOM 0 HG2 MET A 126 4.050 7.695 -7.055 1.00 0.00 H new ATOM 0 HG3 MET A 126 2.933 8.362 -8.229 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.873 10.215 -5.475 1.00 0.00 H new ATOM 0 HE2 MET A 126 5.687 8.586 -6.167 1.00 0.00 H new ATOM 0 HE3 MET A 126 6.382 9.897 -7.150 1.00 0.00 H new ATOM 1904 N GLY A 127 2.459 10.183 -3.908 1.00 0.00 N ATOM 1905 CA GLY A 127 1.936 11.239 -3.062 1.00 0.00 C ATOM 1906 C GLY A 127 2.022 12.603 -3.718 1.00 0.00 C ATOM 1907 O GLY A 127 3.046 13.279 -3.625 1.00 0.00 O ATOM 0 H GLY A 127 3.239 10.459 -4.505 1.00 0.00 H new ATOM 0 HA2 GLY A 127 0.896 11.022 -2.816 1.00 0.00 H new ATOM 0 HA3 GLY A 127 2.489 11.255 -2.123 1.00 0.00 H new ATOM 1911 N GLY A 128 0.944 13.007 -4.383 1.00 0.00 N ATOM 1912 CA GLY A 128 0.924 14.297 -5.048 1.00 0.00 C ATOM 1913 C GLY A 128 0.775 15.447 -4.072 1.00 0.00 C ATOM 1914 O GLY A 128 0.724 15.239 -2.860 1.00 0.00 O ATOM 0 H GLY A 128 0.085 12.465 -4.473 1.00 0.00 H new ATOM 0 HA2 GLY A 128 1.845 14.424 -5.617 1.00 0.00 H new ATOM 0 HA3 GLY A 128 0.102 14.322 -5.763 1.00 0.00 H new ATOM 1918 N GLU A 129 0.705 16.666 -4.600 1.00 0.00 N ATOM 1919 CA GLU A 129 0.560 17.849 -3.763 1.00 0.00 C ATOM 1920 C GLU A 129 -0.843 17.929 -3.165 1.00 0.00 C ATOM 1921 O GLU A 129 -1.066 18.628 -2.177 1.00 0.00 O ATOM 1922 CB GLU A 129 0.851 19.113 -4.575 1.00 0.00 C ATOM 1923 CG GLU A 129 2.126 19.030 -5.399 1.00 0.00 C ATOM 1924 CD GLU A 129 2.365 20.278 -6.228 1.00 0.00 C ATOM 1925 OE1 GLU A 129 1.388 20.808 -6.797 1.00 0.00 O ATOM 1926 OE2 GLU A 129 3.529 20.724 -6.307 1.00 0.00 O ATOM 0 H GLU A 129 0.746 16.858 -5.601 1.00 0.00 H new ATOM 0 HA GLU A 129 1.279 17.773 -2.947 1.00 0.00 H new ATOM 0 HB2 GLU A 129 0.010 19.308 -5.241 1.00 0.00 H new ATOM 0 HB3 GLU A 129 0.923 19.962 -3.895 1.00 0.00 H new ATOM 0 HG2 GLU A 129 2.975 18.872 -4.734 1.00 0.00 H new ATOM 0 HG3 GLU A 129 2.072 18.164 -6.059 1.00 0.00 H new ATOM 1933 N GLY A 130 -1.786 17.211 -3.770 1.00 0.00 N ATOM 1934 CA GLY A 130 -3.152 17.223 -3.279 1.00 0.00 C ATOM 1935 C GLY A 130 -3.844 15.870 -3.375 1.00 0.00 C ATOM 1936 O GLY A 130 -4.956 15.708 -2.872 1.00 0.00 O ATOM 0 H GLY A 130 -1.629 16.623 -4.589 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -3.153 17.550 -2.239 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.726 17.957 -3.844 1.00 0.00 H new ATOM 1940 N VAL A 131 -3.197 14.898 -4.018 1.00 0.00 N ATOM 1941 CA VAL A 131 -3.779 13.567 -4.166 1.00 0.00 C ATOM 1942 C VAL A 131 -2.947 12.517 -3.435 1.00 0.00 C ATOM 1943 O VAL A 131 -1.760 12.721 -3.175 1.00 0.00 O ATOM 1944 CB VAL A 131 -3.919 13.158 -5.650 1.00 0.00 C ATOM 1945 CG1 VAL A 131 -5.140 12.273 -5.845 1.00 0.00 C ATOM 1946 CG2 VAL A 131 -3.996 14.381 -6.553 1.00 0.00 C ATOM 0 H VAL A 131 -2.276 15.007 -4.442 1.00 0.00 H new ATOM 0 HA VAL A 131 -4.774 13.615 -3.723 1.00 0.00 H new ATOM 0 HB VAL A 131 -3.030 12.592 -5.928 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -5.223 11.994 -6.895 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -5.038 11.373 -5.238 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -6.035 12.816 -5.542 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -4.094 14.062 -7.591 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -4.861 14.984 -6.276 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -3.089 14.974 -6.440 1.00 0.00 H new ATOM 1956 N VAL A 132 -3.582 11.399 -3.093 1.00 0.00 N ATOM 1957 CA VAL A 132 -2.910 10.321 -2.379 1.00 0.00 C ATOM 1958 C VAL A 132 -2.789 9.065 -3.241 1.00 0.00 C ATOM 1959 O VAL A 132 -3.791 8.480 -3.644 1.00 0.00 O ATOM 1960 CB VAL A 132 -3.663 9.971 -1.076 1.00 0.00 C ATOM 1961 CG1 VAL A 132 -3.855 11.212 -0.220 1.00 0.00 C ATOM 1962 CG2 VAL A 132 -5.009 9.326 -1.381 1.00 0.00 C ATOM 0 H VAL A 132 -4.564 11.217 -3.300 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.909 10.677 -2.136 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.058 9.254 -0.520 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -4.387 10.945 0.693 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -2.882 11.631 0.036 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -4.434 11.951 -0.775 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.519 9.089 -0.447 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.620 10.016 -1.963 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.853 8.410 -1.951 1.00 0.00 H new ATOM 1972 N GLY A 133 -1.555 8.650 -3.509 1.00 0.00 N ATOM 1973 CA GLY A 133 -1.326 7.459 -4.311 1.00 0.00 C ATOM 1974 C GLY A 133 -1.108 6.226 -3.455 1.00 0.00 C ATOM 1975 O GLY A 133 -0.173 6.177 -2.657 1.00 0.00 O ATOM 0 H GLY A 133 -0.708 9.117 -3.185 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -2.180 7.296 -4.969 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -0.456 7.614 -4.950 1.00 0.00 H new ATOM 1979 N PHE A 134 -1.977 5.232 -3.611 1.00 0.00 N ATOM 1980 CA PHE A 134 -1.873 4.000 -2.836 1.00 0.00 C ATOM 1981 C PHE A 134 -1.817 2.772 -3.740 1.00 0.00 C ATOM 1982 O PHE A 134 -2.475 2.722 -4.778 1.00 0.00 O ATOM 1983 CB PHE A 134 -3.062 3.874 -1.880 1.00 0.00 C ATOM 1984 CG PHE A 134 -3.235 5.049 -0.956 1.00 0.00 C ATOM 1985 CD1 PHE A 134 -2.133 5.680 -0.402 1.00 0.00 C ATOM 1986 CD2 PHE A 134 -4.500 5.516 -0.638 1.00 0.00 C ATOM 1987 CE1 PHE A 134 -2.291 6.756 0.453 1.00 0.00 C ATOM 1988 CE2 PHE A 134 -4.663 6.590 0.215 1.00 0.00 C ATOM 1989 CZ PHE A 134 -3.557 7.210 0.761 1.00 0.00 C ATOM 0 H PHE A 134 -2.759 5.255 -4.265 1.00 0.00 H new ATOM 0 HA PHE A 134 -0.946 4.049 -2.265 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -3.973 3.748 -2.465 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -2.940 2.971 -1.283 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -1.140 5.328 -0.640 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -5.369 5.035 -1.062 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -1.425 7.240 0.879 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -5.655 6.944 0.455 1.00 0.00 H new ATOM 0 HZ PHE A 134 -3.683 8.050 1.429 1.00 0.00 H new ATOM 1999 N ALA A 135 -1.037 1.777 -3.330 1.00 0.00 N ATOM 2000 CA ALA A 135 -0.908 0.540 -4.090 1.00 0.00 C ATOM 2001 C ALA A 135 -1.909 -0.493 -3.584 1.00 0.00 C ATOM 2002 O ALA A 135 -1.823 -0.946 -2.444 1.00 0.00 O ATOM 2003 CB ALA A 135 0.512 0.004 -3.993 1.00 0.00 C ATOM 0 H ALA A 135 -0.484 1.804 -2.474 1.00 0.00 H new ATOM 0 HA ALA A 135 -1.124 0.747 -5.138 1.00 0.00 H new ATOM 0 HB1 ALA A 135 0.592 -0.920 -4.566 1.00 0.00 H new ATOM 0 HB2 ALA A 135 1.207 0.741 -4.394 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.756 -0.194 -2.949 1.00 0.00 H new ATOM 2009 N ASP A 136 -2.873 -0.841 -4.429 1.00 0.00 N ATOM 2010 CA ASP A 136 -3.911 -1.798 -4.056 1.00 0.00 C ATOM 2011 C ASP A 136 -3.360 -3.210 -3.874 1.00 0.00 C ATOM 2012 O ASP A 136 -2.610 -3.713 -4.711 1.00 0.00 O ATOM 2013 CB ASP A 136 -5.018 -1.808 -5.112 1.00 0.00 C ATOM 2014 CG ASP A 136 -6.402 -1.866 -4.497 1.00 0.00 C ATOM 2015 OD1 ASP A 136 -6.534 -2.414 -3.382 1.00 0.00 O ATOM 2016 OD2 ASP A 136 -7.354 -1.362 -5.129 1.00 0.00 O ATOM 0 H ASP A 136 -2.958 -0.475 -5.377 1.00 0.00 H new ATOM 0 HA ASP A 136 -4.315 -1.477 -3.096 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -4.935 -0.914 -5.730 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -4.880 -2.665 -5.771 1.00 0.00 H new ATOM 2021 N VAL A 137 -3.765 -3.851 -2.778 1.00 0.00 N ATOM 2022 CA VAL A 137 -3.350 -5.217 -2.479 1.00 0.00 C ATOM 2023 C VAL A 137 -4.421 -6.212 -2.926 1.00 0.00 C ATOM 2024 O VAL A 137 -4.289 -7.419 -2.726 1.00 0.00 O ATOM 2025 CB VAL A 137 -3.084 -5.415 -0.972 1.00 0.00 C ATOM 2026 CG1 VAL A 137 -2.592 -6.828 -0.690 1.00 0.00 C ATOM 2027 CG2 VAL A 137 -2.084 -4.389 -0.463 1.00 0.00 C ATOM 0 H VAL A 137 -4.385 -3.441 -2.079 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.424 -5.396 -3.025 1.00 0.00 H new ATOM 0 HB VAL A 137 -4.025 -5.270 -0.441 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -2.411 -6.944 0.379 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.346 -7.547 -1.010 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.666 -7.006 -1.236 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -1.911 -4.547 0.602 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.144 -4.498 -1.004 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -2.479 -3.386 -0.622 1.00 0.00 H new ATOM 2037 N ARG A 138 -5.484 -5.695 -3.533 1.00 0.00 N ATOM 2038 CA ARG A 138 -6.576 -6.529 -4.008 1.00 0.00 C ATOM 2039 C ARG A 138 -6.169 -7.323 -5.251 1.00 0.00 C ATOM 2040 O ARG A 138 -6.924 -8.168 -5.729 1.00 0.00 O ATOM 2041 CB ARG A 138 -7.806 -5.667 -4.306 1.00 0.00 C ATOM 2042 CG ARG A 138 -8.420 -5.025 -3.067 1.00 0.00 C ATOM 2043 CD ARG A 138 -9.937 -4.991 -3.148 1.00 0.00 C ATOM 2044 NE ARG A 138 -10.422 -3.824 -3.885 1.00 0.00 N ATOM 2045 CZ ARG A 138 -10.735 -3.833 -5.180 1.00 0.00 C ATOM 2046 NH1 ARG A 138 -10.619 -4.945 -5.897 1.00 0.00 N ATOM 2047 NH2 ARG A 138 -11.167 -2.723 -5.762 1.00 0.00 N ATOM 0 H ARG A 138 -5.610 -4.698 -3.707 1.00 0.00 H new ATOM 0 HA ARG A 138 -6.823 -7.243 -3.222 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -7.527 -4.883 -5.010 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -8.560 -6.283 -4.797 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.115 -5.580 -2.180 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.038 -4.010 -2.955 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.294 -5.900 -3.633 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -10.353 -4.982 -2.141 1.00 0.00 H new ATOM 0 HE ARG A 138 -10.527 -2.947 -3.375 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.288 -5.803 -5.457 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -10.861 -4.941 -6.888 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -11.259 -1.865 -5.219 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -11.407 -2.727 -6.753 1.00 0.00 H new ATOM 2061 N ASP A 139 -4.972 -7.049 -5.775 1.00 0.00 N ATOM 2062 CA ASP A 139 -4.481 -7.743 -6.963 1.00 0.00 C ATOM 2063 C ASP A 139 -3.605 -8.939 -6.585 1.00 0.00 C ATOM 2064 O ASP A 139 -3.049 -9.610 -7.455 1.00 0.00 O ATOM 2065 CB ASP A 139 -3.690 -6.777 -7.850 1.00 0.00 C ATOM 2066 CG ASP A 139 -4.241 -6.707 -9.261 1.00 0.00 C ATOM 2067 OD1 ASP A 139 -3.963 -7.633 -10.053 1.00 0.00 O ATOM 2068 OD2 ASP A 139 -4.949 -5.728 -9.574 1.00 0.00 O ATOM 0 H ASP A 139 -4.329 -6.354 -5.396 1.00 0.00 H new ATOM 0 HA ASP A 139 -5.344 -8.115 -7.515 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -3.708 -5.782 -7.406 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -2.647 -7.091 -7.885 1.00 0.00 H new ATOM 2073 N LEU A 140 -3.492 -9.203 -5.287 1.00 0.00 N ATOM 2074 CA LEU A 140 -2.690 -10.317 -4.795 1.00 0.00 C ATOM 2075 C LEU A 140 -3.056 -10.622 -3.349 1.00 0.00 C ATOM 2076 O LEU A 140 -2.211 -10.588 -2.457 1.00 0.00 O ATOM 2077 CB LEU A 140 -1.186 -10.017 -4.934 1.00 0.00 C ATOM 2078 CG LEU A 140 -0.638 -8.792 -4.174 1.00 0.00 C ATOM 2079 CD1 LEU A 140 -1.718 -7.758 -3.904 1.00 0.00 C ATOM 2080 CD2 LEU A 140 0.010 -9.218 -2.869 1.00 0.00 C ATOM 0 H LEU A 140 -3.948 -8.658 -4.555 1.00 0.00 H new ATOM 0 HA LEU A 140 -2.906 -11.197 -5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -0.634 -10.896 -4.601 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -0.965 -9.884 -5.993 1.00 0.00 H new ATOM 0 HG LEU A 140 0.113 -8.329 -4.814 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -1.287 -6.913 -3.367 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -2.135 -7.412 -4.850 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -2.508 -8.206 -3.301 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.390 -8.339 -2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.728 -9.720 -2.243 1.00 0.00 H new ATOM 0 HD23 LEU A 140 0.834 -9.901 -3.078 1.00 0.00 H new ATOM 2092 N LEU A 141 -4.334 -10.904 -3.129 1.00 0.00 N ATOM 2093 CA LEU A 141 -4.844 -11.197 -1.798 1.00 0.00 C ATOM 2094 C LEU A 141 -4.409 -12.570 -1.292 1.00 0.00 C ATOM 2095 O LEU A 141 -4.541 -12.861 -0.106 1.00 0.00 O ATOM 2096 CB LEU A 141 -6.367 -11.090 -1.772 1.00 0.00 C ATOM 2097 CG LEU A 141 -6.928 -10.132 -0.717 1.00 0.00 C ATOM 2098 CD1 LEU A 141 -6.154 -10.242 0.589 1.00 0.00 C ATOM 2099 CD2 LEU A 141 -6.909 -8.701 -1.233 1.00 0.00 C ATOM 0 H LEU A 141 -5.041 -10.936 -3.864 1.00 0.00 H new ATOM 0 HA LEU A 141 -4.415 -10.453 -1.127 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -6.711 -10.767 -2.755 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -6.784 -12.082 -1.599 1.00 0.00 H new ATOM 0 HG LEU A 141 -7.962 -10.415 -0.519 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -6.574 -9.551 1.320 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -6.226 -11.261 0.970 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -5.107 -9.993 0.414 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -7.311 -8.034 -0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -5.884 -8.411 -1.465 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -7.518 -8.631 -2.134 1.00 0.00 H new ATOM 2111 N TRP A 142 -3.906 -13.422 -2.185 1.00 0.00 N ATOM 2112 CA TRP A 142 -3.473 -14.761 -1.787 1.00 0.00 C ATOM 2113 C TRP A 142 -2.491 -14.700 -0.616 1.00 0.00 C ATOM 2114 O TRP A 142 -1.278 -14.780 -0.802 1.00 0.00 O ATOM 2115 CB TRP A 142 -2.842 -15.510 -2.966 1.00 0.00 C ATOM 2116 CG TRP A 142 -1.685 -14.799 -3.596 1.00 0.00 C ATOM 2117 CD1 TRP A 142 -1.728 -13.680 -4.378 1.00 0.00 C ATOM 2118 CD2 TRP A 142 -0.305 -15.171 -3.505 1.00 0.00 C ATOM 2119 NE1 TRP A 142 -0.459 -13.333 -4.774 1.00 0.00 N ATOM 2120 CE2 TRP A 142 0.431 -14.232 -4.248 1.00 0.00 C ATOM 2121 CE3 TRP A 142 0.377 -16.206 -2.862 1.00 0.00 C ATOM 2122 CZ2 TRP A 142 1.818 -14.299 -4.366 1.00 0.00 C ATOM 2123 CZ3 TRP A 142 1.752 -16.272 -2.979 1.00 0.00 C ATOM 2124 CH2 TRP A 142 2.460 -15.322 -3.725 1.00 0.00 C ATOM 0 H TRP A 142 -3.789 -13.213 -3.176 1.00 0.00 H new ATOM 0 HA TRP A 142 -4.359 -15.307 -1.464 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -2.509 -16.490 -2.623 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -3.606 -15.680 -3.725 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -2.628 -13.146 -4.646 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -0.219 -12.536 -5.363 1.00 0.00 H new ATOM 0 HE3 TRP A 142 -0.161 -16.942 -2.283 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 2.366 -13.569 -4.943 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 2.289 -17.069 -2.487 1.00 0.00 H new ATOM 0 HH2 TRP A 142 3.535 -15.399 -3.796 1.00 0.00 H new ATOM 2135 N LEU A 143 -3.038 -14.559 0.589 1.00 0.00 N ATOM 2136 CA LEU A 143 -2.239 -14.488 1.808 1.00 0.00 C ATOM 2137 C LEU A 143 -3.031 -15.031 2.993 1.00 0.00 C ATOM 2138 O LEU A 143 -2.519 -15.816 3.790 1.00 0.00 O ATOM 2139 CB LEU A 143 -1.803 -13.044 2.094 1.00 0.00 C ATOM 2140 CG LEU A 143 -0.977 -12.364 0.994 1.00 0.00 C ATOM 2141 CD1 LEU A 143 -1.889 -11.665 0.001 1.00 0.00 C ATOM 2142 CD2 LEU A 143 0.002 -11.369 1.601 1.00 0.00 C ATOM 0 H LEU A 143 -4.043 -14.491 0.747 1.00 0.00 H new ATOM 0 HA LEU A 143 -1.348 -15.098 1.662 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -2.695 -12.444 2.275 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -1.221 -13.036 3.016 1.00 0.00 H new ATOM 0 HG LEU A 143 -0.410 -13.131 0.466 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.287 -11.188 -0.772 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -2.556 -12.395 -0.457 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -2.480 -10.909 0.519 1.00 0.00 H new ATOM 0 HD21 LEU A 143 0.580 -10.896 0.807 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.549 -10.607 2.152 1.00 0.00 H new ATOM 0 HD23 LEU A 143 0.677 -11.891 2.279 1.00 0.00 H new ATOM 2154 N GLU A 144 -4.289 -14.607 3.099 1.00 0.00 N ATOM 2155 CA GLU A 144 -5.159 -15.051 4.182 1.00 0.00 C ATOM 2156 C GLU A 144 -6.626 -14.895 3.792 1.00 0.00 C ATOM 2157 O GLU A 144 -6.946 -14.623 2.635 1.00 0.00 O ATOM 2158 CB GLU A 144 -4.866 -14.259 5.459 1.00 0.00 C ATOM 2159 CG GLU A 144 -4.102 -15.055 6.504 1.00 0.00 C ATOM 2160 CD GLU A 144 -4.999 -15.989 7.294 1.00 0.00 C ATOM 2161 OE1 GLU A 144 -5.232 -17.124 6.829 1.00 0.00 O ATOM 2162 OE2 GLU A 144 -5.468 -15.583 8.379 1.00 0.00 O ATOM 0 H GLU A 144 -4.727 -13.956 2.447 1.00 0.00 H new ATOM 0 HA GLU A 144 -4.961 -16.106 4.369 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -4.293 -13.368 5.201 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -5.807 -13.918 5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -3.320 -15.636 6.014 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -3.606 -14.367 7.189 1.00 0.00 H new ATOM 2169 N ASP A 145 -7.516 -15.074 4.763 1.00 0.00 N ATOM 2170 CA ASP A 145 -8.948 -14.957 4.519 1.00 0.00 C ATOM 2171 C ASP A 145 -9.304 -13.567 3.998 1.00 0.00 C ATOM 2172 O ASP A 145 -8.701 -12.569 4.395 1.00 0.00 O ATOM 2173 CB ASP A 145 -9.731 -15.252 5.799 1.00 0.00 C ATOM 2174 CG ASP A 145 -9.684 -16.719 6.178 1.00 0.00 C ATOM 2175 OD1 ASP A 145 -9.804 -17.571 5.272 1.00 0.00 O ATOM 2176 OD2 ASP A 145 -9.528 -17.017 7.381 1.00 0.00 O ATOM 0 H ASP A 145 -7.270 -15.301 5.727 1.00 0.00 H new ATOM 0 HA ASP A 145 -9.220 -15.688 3.758 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -9.325 -14.655 6.616 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -10.769 -14.947 5.666 1.00 0.00 H new ATOM 2181 N ASP A 146 -10.290 -13.512 3.109 1.00 0.00 N ATOM 2182 CA ASP A 146 -10.735 -12.249 2.529 1.00 0.00 C ATOM 2183 C ASP A 146 -12.042 -11.793 3.171 1.00 0.00 C ATOM 2184 O ASP A 146 -12.811 -12.612 3.676 1.00 0.00 O ATOM 2185 CB ASP A 146 -10.915 -12.383 1.012 1.00 0.00 C ATOM 2186 CG ASP A 146 -10.014 -13.444 0.403 1.00 0.00 C ATOM 2187 OD1 ASP A 146 -8.815 -13.476 0.750 1.00 0.00 O ATOM 2188 OD2 ASP A 146 -10.510 -14.243 -0.420 1.00 0.00 O ATOM 0 H ASP A 146 -10.798 -14.330 2.773 1.00 0.00 H new ATOM 0 HA ASP A 146 -9.968 -11.499 2.725 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -11.955 -12.627 0.794 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -10.708 -11.423 0.540 1.00 0.00 H new ATOM 2193 N ALA A 147 -12.290 -10.486 3.154 1.00 0.00 N ATOM 2194 CA ALA A 147 -13.506 -9.936 3.745 1.00 0.00 C ATOM 2195 C ALA A 147 -14.727 -10.238 2.883 1.00 0.00 C ATOM 2196 O ALA A 147 -14.724 -9.998 1.675 1.00 0.00 O ATOM 2197 CB ALA A 147 -13.362 -8.436 3.953 1.00 0.00 C ATOM 0 H ALA A 147 -11.669 -9.791 2.740 1.00 0.00 H new ATOM 0 HA ALA A 147 -13.654 -10.414 4.714 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -14.277 -8.040 4.394 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -12.523 -8.240 4.621 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -13.183 -7.951 2.993 1.00 0.00 H new