USER MOD reduce.3.24.130724 H: found=0, std=0, add=574, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 574 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 Single : A 1 LYS NZ :NH3+ -170:sc= -0.0129 (180deg=-0.154) USER MOD Single : A 2 ASN : amide:sc=-0.00216 K(o=-0.0022,f=-1.4) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 160:sc= -0.0884 (180deg=-0.509) USER MOD Single : A -4 LYS NZ :NH3+ -163:sc= -0.0413 (180deg=-0.314) USER MOD Single : A -5 TYR OH : rot 180:sc= 0 USER MOD Single : A -7 MET CE :methyl -158:sc= -0.16 (180deg=-0.697) USER MOD Single : A -7 MET N :NH3+ -164:sc= 0.395 (180deg=-0.203) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0233 USER MOD Single : A 17 GLN : amide:sc= -0.634 X(o=-0.63,f=-0.3) USER MOD Single : A 19 ASN : amide:sc= 0.999 K(o=1,f=-0.4) USER MOD Single : A 20 SER OG : rot 115:sc= 0.0367 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -0.0154 X(o=-0.015,f=0.041!) USER MOD Single : A 28 LYS NZ :NH3+ 163:sc= -0.0465 (180deg=-0.385) USER MOD Single : A 31 THR OG1 : rot -13:sc= 0.696 USER MOD Single : A 32 SER OG : rot 180:sc= 0.0102 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=-0.00042) USER MOD Single : A 49 MET CE :methyl 161:sc= -0.159 (180deg=-0.701) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 MET CE :methyl 160:sc= -0.113 (180deg=-0.657) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 163:sc= -0.0669 (180deg=-0.384) USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -7 -51.108 3.290 3.633 1.00 20.00 N ATOM 2 CA MET A -7 -52.215 3.827 4.455 1.00 20.00 C ATOM 3 C MET A -7 -53.542 3.605 3.751 1.00 20.00 C ATOM 4 O MET A -7 -53.616 3.716 2.525 1.00 20.00 O ATOM 5 CB MET A -7 -52.006 5.321 4.710 1.00 20.00 C ATOM 6 CG MET A -7 -50.755 5.629 5.516 1.00 20.00 C ATOM 7 SD MET A -7 -50.461 7.398 5.707 1.00 20.00 S ATOM 8 CE MET A -7 -50.161 7.871 4.006 1.00 20.00 C ATOM 0 H1 MET A -7 -50.254 3.196 4.219 1.00 20.00 H new ATOM 0 H2 MET A -7 -51.375 2.357 3.258 1.00 20.00 H new ATOM 0 H3 MET A -7 -50.916 3.939 2.843 1.00 20.00 H new ATOM 0 HA MET A -7 -52.227 3.303 5.411 1.00 20.00 H new ATOM 0 HB2 MET A -7 -51.949 5.840 3.753 1.00 20.00 H new ATOM 0 HB3 MET A -7 -52.875 5.717 5.237 1.00 20.00 H new ATOM 0 HG2 MET A -7 -50.842 5.172 6.502 1.00 20.00 H new ATOM 0 HG3 MET A -7 -49.893 5.173 5.028 1.00 20.00 H new ATOM 0 HE1 MET A -7 -49.596 8.803 3.982 1.00 20.00 H new ATOM 0 HE2 MET A -7 -49.591 7.088 3.506 1.00 20.00 H new ATOM 0 HE3 MET A -7 -51.113 8.010 3.494 1.00 20.00 H new ATOM 20 N ASP A -6 -54.572 3.280 4.538 1.00 20.00 N ATOM 21 CA ASP A -6 -55.920 2.995 4.030 1.00 20.00 C ATOM 22 C ASP A -6 -55.956 1.684 3.248 1.00 20.00 C ATOM 23 O ASP A -6 -56.636 0.734 3.640 1.00 20.00 O ATOM 24 CB ASP A -6 -56.453 4.148 3.165 1.00 20.00 C ATOM 25 CG ASP A -6 -56.920 5.332 3.990 1.00 20.00 C ATOM 26 OD1 ASP A -6 -56.071 6.138 4.427 1.00 20.00 O ATOM 27 OD2 ASP A -6 -58.144 5.469 4.199 1.00 20.00 O ATOM 0 H ASP A -6 -54.495 3.206 5.552 1.00 20.00 H new ATOM 0 HA ASP A -6 -56.572 2.893 4.898 1.00 20.00 H new ATOM 0 HB2 ASP A -6 -55.671 4.474 2.480 1.00 20.00 H new ATOM 0 HB3 ASP A -6 -57.281 3.786 2.555 1.00 20.00 H new ATOM 32 N TYR A -5 -55.223 1.637 2.153 1.00 20.00 N ATOM 33 CA TYR A -5 -55.157 0.448 1.316 1.00 20.00 C ATOM 34 C TYR A -5 -53.706 0.019 1.141 1.00 20.00 C ATOM 35 O TYR A -5 -52.785 0.792 1.417 1.00 20.00 O ATOM 36 CB TYR A -5 -55.777 0.723 -0.059 1.00 20.00 C ATOM 37 CG TYR A -5 -57.225 1.158 -0.008 1.00 20.00 C ATOM 38 CD1 TYR A -5 -58.245 0.226 0.131 1.00 20.00 C ATOM 39 CD2 TYR A -5 -57.573 2.501 -0.105 1.00 20.00 C ATOM 40 CE1 TYR A -5 -59.568 0.619 0.174 1.00 20.00 C ATOM 41 CE2 TYR A -5 -58.894 2.900 -0.062 1.00 20.00 C ATOM 42 CZ TYR A -5 -59.886 1.955 0.077 1.00 20.00 C ATOM 43 OH TYR A -5 -61.203 2.349 0.120 1.00 20.00 O ATOM 0 H TYR A -5 -54.658 2.416 1.817 1.00 20.00 H new ATOM 0 HA TYR A -5 -55.718 -0.349 1.803 1.00 20.00 H new ATOM 0 HB2 TYR A -5 -55.194 1.496 -0.560 1.00 20.00 H new ATOM 0 HB3 TYR A -5 -55.701 -0.179 -0.667 1.00 20.00 H new ATOM 0 HD1 TYR A -5 -58.000 -0.823 0.207 1.00 20.00 H new ATOM 0 HD2 TYR A -5 -56.797 3.244 -0.216 1.00 20.00 H new ATOM 0 HE1 TYR A -5 -60.350 -0.118 0.283 1.00 20.00 H new ATOM 0 HE2 TYR A -5 -59.148 3.947 -0.137 1.00 20.00 H new ATOM 0 HH TYR A -5 -61.255 3.324 0.040 1.00 20.00 H new ATOM 53 N LYS A -4 -53.507 -1.205 0.671 1.00 20.00 N ATOM 54 CA LYS A -4 -52.167 -1.716 0.398 1.00 20.00 C ATOM 55 C LYS A -4 -51.716 -1.289 -0.994 1.00 20.00 C ATOM 56 O LYS A -4 -51.194 -2.088 -1.774 1.00 20.00 O ATOM 57 CB LYS A -4 -52.128 -3.240 0.528 1.00 20.00 C ATOM 58 CG LYS A -4 -52.146 -3.739 1.967 1.00 20.00 C ATOM 59 CD LYS A -4 -52.141 -5.260 2.030 1.00 20.00 C ATOM 60 CE LYS A -4 -53.469 -5.849 1.572 1.00 20.00 C ATOM 61 NZ LYS A -4 -54.589 -5.468 2.476 1.00 20.00 N ATOM 0 H LYS A -4 -54.258 -1.866 0.470 1.00 20.00 H new ATOM 0 HA LYS A -4 -51.482 -1.296 1.134 1.00 20.00 H new ATOM 0 HB2 LYS A -4 -52.982 -3.662 -0.003 1.00 20.00 H new ATOM 0 HB3 LYS A -4 -51.230 -3.614 0.036 1.00 20.00 H new ATOM 0 HG2 LYS A -4 -51.279 -3.349 2.499 1.00 20.00 H new ATOM 0 HG3 LYS A -4 -53.031 -3.356 2.475 1.00 20.00 H new ATOM 0 HD2 LYS A -4 -51.337 -5.647 1.405 1.00 20.00 H new ATOM 0 HD3 LYS A -4 -51.934 -5.581 3.051 1.00 20.00 H new ATOM 0 HE2 LYS A -4 -53.687 -5.507 0.560 1.00 20.00 H new ATOM 0 HE3 LYS A -4 -53.389 -6.935 1.531 1.00 20.00 H new ATOM 0 HZ1 LYS A -4 -55.398 -6.101 2.312 1.00 20.00 H new ATOM 0 HZ2 LYS A -4 -54.280 -5.551 3.466 1.00 20.00 H new ATOM 0 HZ3 LYS A -4 -54.872 -4.486 2.283 1.00 20.00 H new ATOM 75 N ASP A -3 -51.940 -0.021 -1.290 1.00 20.00 N ATOM 76 CA ASP A -3 -51.561 0.571 -2.560 1.00 20.00 C ATOM 77 C ASP A -3 -51.035 1.974 -2.300 1.00 20.00 C ATOM 78 O ASP A -3 -51.287 2.915 -3.050 1.00 20.00 O ATOM 79 CB ASP A -3 -52.767 0.603 -3.507 1.00 20.00 C ATOM 80 CG ASP A -3 -52.415 1.077 -4.905 1.00 20.00 C ATOM 81 OD1 ASP A -3 -51.560 0.443 -5.554 1.00 20.00 O ATOM 82 OD2 ASP A -3 -53.006 2.078 -5.368 1.00 20.00 O ATOM 0 H ASP A -3 -52.394 0.632 -0.651 1.00 20.00 H new ATOM 0 HA ASP A -3 -50.782 -0.024 -3.036 1.00 20.00 H new ATOM 0 HB2 ASP A -3 -53.201 -0.395 -3.567 1.00 20.00 H new ATOM 0 HB3 ASP A -3 -53.532 1.258 -3.090 1.00 20.00 H new ATOM 87 N ASP A -2 -50.324 2.104 -1.194 1.00 20.00 N ATOM 88 CA ASP A -2 -49.766 3.383 -0.789 1.00 20.00 C ATOM 89 C ASP A -2 -48.495 3.639 -1.574 1.00 20.00 C ATOM 90 O ASP A -2 -48.275 4.730 -2.104 1.00 20.00 O ATOM 91 CB ASP A -2 -49.462 3.368 0.706 1.00 20.00 C ATOM 92 CG ASP A -2 -49.335 4.754 1.295 1.00 20.00 C ATOM 93 OD1 ASP A -2 -48.223 5.321 1.280 1.00 20.00 O ATOM 94 OD2 ASP A -2 -50.353 5.272 1.798 1.00 20.00 O ATOM 0 H ASP A -2 -50.118 1.335 -0.557 1.00 20.00 H new ATOM 0 HA ASP A -2 -50.485 4.177 -0.991 1.00 20.00 H new ATOM 0 HB2 ASP A -2 -50.253 2.829 1.227 1.00 20.00 H new ATOM 0 HB3 ASP A -2 -48.536 2.820 0.878 1.00 20.00 H new ATOM 99 N ASP A -1 -47.674 2.607 -1.654 1.00 20.00 N ATOM 100 CA ASP A -1 -46.436 2.653 -2.412 1.00 20.00 C ATOM 101 C ASP A -1 -46.469 1.601 -3.510 1.00 20.00 C ATOM 102 O ASP A -1 -47.086 0.546 -3.354 1.00 20.00 O ATOM 103 CB ASP A -1 -45.237 2.406 -1.493 1.00 20.00 C ATOM 104 CG ASP A -1 -45.219 1.001 -0.923 1.00 20.00 C ATOM 105 OD1 ASP A -1 -46.063 0.696 -0.052 1.00 20.00 O ATOM 106 OD2 ASP A -1 -44.351 0.200 -1.333 1.00 20.00 O ATOM 0 H ASP A -1 -47.847 1.713 -1.195 1.00 20.00 H new ATOM 0 HA ASP A -1 -46.334 3.642 -2.859 1.00 20.00 H new ATOM 0 HB2 ASP A -1 -44.316 2.580 -2.049 1.00 20.00 H new ATOM 0 HB3 ASP A -1 -45.257 3.126 -0.675 1.00 20.00 H new ATOM 111 N ASP A 0 -45.805 1.888 -4.616 1.00 20.00 N ATOM 112 CA ASP A 0 -45.802 0.982 -5.759 1.00 20.00 C ATOM 113 C ASP A 0 -44.710 -0.064 -5.621 1.00 20.00 C ATOM 114 O ASP A 0 -44.526 -0.904 -6.501 1.00 20.00 O ATOM 115 CB ASP A 0 -45.634 1.746 -7.072 1.00 20.00 C ATOM 116 CG ASP A 0 -46.870 2.542 -7.439 1.00 20.00 C ATOM 117 OD1 ASP A 0 -47.933 1.925 -7.664 1.00 20.00 O ATOM 118 OD2 ASP A 0 -46.785 3.786 -7.507 1.00 20.00 O ATOM 0 H ASP A 0 -45.260 2.740 -4.750 1.00 20.00 H new ATOM 0 HA ASP A 0 -46.768 0.477 -5.777 1.00 20.00 H new ATOM 0 HB2 ASP A 0 -44.782 2.421 -6.990 1.00 20.00 H new ATOM 0 HB3 ASP A 0 -45.408 1.042 -7.873 1.00 20.00 H new ATOM 123 N LYS A 1 -43.988 -0.004 -4.512 1.00 20.00 N ATOM 124 CA LYS A 1 -42.911 -0.944 -4.249 1.00 20.00 C ATOM 125 C LYS A 1 -43.454 -2.200 -3.579 1.00 20.00 C ATOM 126 O LYS A 1 -42.753 -3.204 -3.454 1.00 20.00 O ATOM 127 CB LYS A 1 -41.847 -0.298 -3.357 1.00 20.00 C ATOM 128 CG LYS A 1 -41.238 0.962 -3.949 1.00 20.00 C ATOM 129 CD LYS A 1 -40.291 1.628 -2.967 1.00 20.00 C ATOM 130 CE LYS A 1 -39.731 2.927 -3.523 1.00 20.00 C ATOM 131 NZ LYS A 1 -38.960 2.714 -4.775 1.00 20.00 N ATOM 0 H LYS A 1 -44.130 0.689 -3.777 1.00 20.00 H new ATOM 0 HA LYS A 1 -42.456 -1.220 -5.200 1.00 20.00 H new ATOM 0 HB2 LYS A 1 -42.292 -0.057 -2.392 1.00 20.00 H new ATOM 0 HB3 LYS A 1 -41.054 -1.022 -3.170 1.00 20.00 H new ATOM 0 HG2 LYS A 1 -40.701 0.714 -4.865 1.00 20.00 H new ATOM 0 HG3 LYS A 1 -42.031 1.658 -4.223 1.00 20.00 H new ATOM 0 HD2 LYS A 1 -40.816 1.828 -2.033 1.00 20.00 H new ATOM 0 HD3 LYS A 1 -39.471 0.948 -2.733 1.00 20.00 H new ATOM 0 HE2 LYS A 1 -40.549 3.621 -3.716 1.00 20.00 H new ATOM 0 HE3 LYS A 1 -39.087 3.393 -2.776 1.00 20.00 H new ATOM 0 HZ1 LYS A 1 -38.458 3.589 -5.026 1.00 20.00 H new ATOM 0 HZ2 LYS A 1 -38.271 1.948 -4.632 1.00 20.00 H new ATOM 0 HZ3 LYS A 1 -39.611 2.455 -5.544 1.00 20.00 H new ATOM 145 N ASN A 2 -44.717 -2.121 -3.152 1.00 20.00 N ATOM 146 CA ASN A 2 -45.402 -3.226 -2.476 1.00 20.00 C ATOM 147 C ASN A 2 -44.740 -3.529 -1.145 1.00 20.00 C ATOM 148 O ASN A 2 -44.753 -4.667 -0.670 1.00 20.00 O ATOM 149 CB ASN A 2 -45.432 -4.492 -3.345 1.00 20.00 C ATOM 150 CG ASN A 2 -46.388 -4.384 -4.515 1.00 20.00 C ATOM 151 OD1 ASN A 2 -46.612 -3.300 -5.056 1.00 20.00 O ATOM 152 ND2 ASN A 2 -46.969 -5.504 -4.911 1.00 20.00 N ATOM 0 H ASN A 2 -45.294 -1.288 -3.265 1.00 20.00 H new ATOM 0 HA ASN A 2 -46.431 -2.912 -2.302 1.00 20.00 H new ATOM 0 HB2 ASN A 2 -44.428 -4.692 -3.720 1.00 20.00 H new ATOM 0 HB3 ASN A 2 -45.717 -5.343 -2.727 1.00 20.00 H new ATOM 0 HD21 ASN A 2 -47.628 -5.489 -5.689 1.00 20.00 H new ATOM 0 HD22 ASN A 2 -46.758 -6.383 -4.438 1.00 20.00 H new ATOM 159 N ARG A 3 -44.168 -2.505 -0.538 1.00 20.00 N ATOM 160 CA ARG A 3 -43.455 -2.671 0.708 1.00 20.00 C ATOM 161 C ARG A 3 -44.078 -1.794 1.787 1.00 20.00 C ATOM 162 O ARG A 3 -43.511 -0.779 2.195 1.00 20.00 O ATOM 163 CB ARG A 3 -41.974 -2.334 0.517 1.00 20.00 C ATOM 164 CG ARG A 3 -41.110 -2.643 1.728 1.00 20.00 C ATOM 165 CD ARG A 3 -39.647 -2.332 1.459 1.00 20.00 C ATOM 166 NE ARG A 3 -39.103 -3.133 0.362 1.00 20.00 N ATOM 167 CZ ARG A 3 -37.824 -3.112 -0.008 1.00 20.00 C ATOM 168 NH1 ARG A 3 -36.964 -2.328 0.626 1.00 20.00 N ATOM 169 NH2 ARG A 3 -37.408 -3.876 -1.012 1.00 20.00 N ATOM 0 H ARG A 3 -44.185 -1.548 -0.892 1.00 20.00 H new ATOM 0 HA ARG A 3 -43.529 -3.711 1.026 1.00 20.00 H new ATOM 0 HB2 ARG A 3 -41.593 -2.889 -0.340 1.00 20.00 H new ATOM 0 HB3 ARG A 3 -41.881 -1.275 0.277 1.00 20.00 H new ATOM 0 HG2 ARG A 3 -41.456 -2.061 2.582 1.00 20.00 H new ATOM 0 HG3 ARG A 3 -41.217 -3.694 1.995 1.00 20.00 H new ATOM 0 HD2 ARG A 3 -39.540 -1.274 1.221 1.00 20.00 H new ATOM 0 HD3 ARG A 3 -39.066 -2.516 2.363 1.00 20.00 H new ATOM 0 HE ARG A 3 -39.741 -3.743 -0.149 1.00 20.00 H new ATOM 0 HH11 ARG A 3 -37.282 -1.741 1.397 1.00 20.00 H new ATOM 0 HH12 ARG A 3 -35.984 -2.312 0.343 1.00 20.00 H new ATOM 0 HH21 ARG A 3 -38.069 -4.480 -1.501 1.00 20.00 H new ATOM 0 HH22 ARG A 3 -36.428 -3.859 -1.294 1.00 20.00 H new ATOM 183 N ALA A 4 -45.252 -2.202 2.245 1.00 20.00 N ATOM 184 CA ALA A 4 -45.957 -1.496 3.303 1.00 20.00 C ATOM 185 C ALA A 4 -45.495 -1.991 4.668 1.00 20.00 C ATOM 186 O ALA A 4 -46.260 -2.016 5.632 1.00 20.00 O ATOM 187 CB ALA A 4 -47.460 -1.681 3.148 1.00 20.00 C ATOM 0 H ALA A 4 -45.740 -3.027 1.896 1.00 20.00 H new ATOM 0 HA ALA A 4 -45.730 -0.433 3.227 1.00 20.00 H new ATOM 0 HB1 ALA A 4 -47.976 -1.148 3.946 1.00 20.00 H new ATOM 0 HB2 ALA A 4 -47.778 -1.286 2.183 1.00 20.00 H new ATOM 0 HB3 ALA A 4 -47.704 -2.742 3.204 1.00 20.00 H new ATOM 193 N LEU A 5 -44.234 -2.382 4.741 1.00 20.00 N ATOM 194 CA LEU A 5 -43.674 -2.941 5.958 1.00 20.00 C ATOM 195 C LEU A 5 -42.995 -1.853 6.778 1.00 20.00 C ATOM 196 O LEU A 5 -41.806 -1.942 7.096 1.00 20.00 O ATOM 197 CB LEU A 5 -42.671 -4.050 5.621 1.00 20.00 C ATOM 198 CG LEU A 5 -43.210 -5.185 4.741 1.00 20.00 C ATOM 199 CD1 LEU A 5 -42.127 -6.220 4.493 1.00 20.00 C ATOM 200 CD2 LEU A 5 -44.429 -5.842 5.375 1.00 20.00 C ATOM 0 H LEU A 5 -43.575 -2.321 3.965 1.00 20.00 H new ATOM 0 HA LEU A 5 -44.485 -3.368 6.548 1.00 20.00 H new ATOM 0 HB2 LEU A 5 -41.814 -3.600 5.119 1.00 20.00 H new ATOM 0 HB3 LEU A 5 -42.305 -4.480 6.553 1.00 20.00 H new ATOM 0 HG LEU A 5 -43.515 -4.754 3.787 1.00 20.00 H new ATOM 0 HD11 LEU A 5 -42.524 -7.019 3.867 1.00 20.00 H new ATOM 0 HD12 LEU A 5 -41.283 -5.750 3.989 1.00 20.00 H new ATOM 0 HD13 LEU A 5 -41.796 -6.635 5.445 1.00 20.00 H new ATOM 0 HD21 LEU A 5 -44.788 -6.642 4.728 1.00 20.00 H new ATOM 0 HD22 LEU A 5 -44.156 -6.255 6.346 1.00 20.00 H new ATOM 0 HD23 LEU A 5 -45.216 -5.099 5.505 1.00 20.00 H new ATOM 212 N SER A 6 -43.750 -0.818 7.104 1.00 20.00 N ATOM 213 CA SER A 6 -43.237 0.273 7.913 1.00 20.00 C ATOM 214 C SER A 6 -44.242 0.635 9.004 1.00 20.00 C ATOM 215 O SER A 6 -44.937 1.646 8.913 1.00 20.00 O ATOM 216 CB SER A 6 -42.947 1.491 7.035 1.00 20.00 C ATOM 217 OG SER A 6 -42.256 1.113 5.853 1.00 20.00 O ATOM 0 H SER A 6 -44.724 -0.711 6.819 1.00 20.00 H new ATOM 0 HA SER A 6 -42.307 -0.046 8.384 1.00 20.00 H new ATOM 0 HB2 SER A 6 -43.882 1.985 6.772 1.00 20.00 H new ATOM 0 HB3 SER A 6 -42.351 2.213 7.594 1.00 20.00 H new ATOM 0 HG SER A 6 -42.083 1.908 5.307 1.00 20.00 H new ATOM 223 N PRO A 7 -44.337 -0.190 10.055 1.00 20.00 N ATOM 224 CA PRO A 7 -45.287 0.026 11.137 1.00 20.00 C ATOM 225 C PRO A 7 -44.734 0.939 12.229 1.00 20.00 C ATOM 226 O PRO A 7 -45.152 0.860 13.386 1.00 20.00 O ATOM 227 CB PRO A 7 -45.503 -1.386 11.675 1.00 20.00 C ATOM 228 CG PRO A 7 -44.201 -2.084 11.449 1.00 20.00 C ATOM 229 CD PRO A 7 -43.535 -1.408 10.270 1.00 20.00 C ATOM 0 HA PRO A 7 -46.197 0.522 10.799 1.00 20.00 H new ATOM 0 HB2 PRO A 7 -45.765 -1.370 12.733 1.00 20.00 H new ATOM 0 HB3 PRO A 7 -46.317 -1.888 11.152 1.00 20.00 H new ATOM 0 HG2 PRO A 7 -43.571 -2.021 12.336 1.00 20.00 H new ATOM 0 HG3 PRO A 7 -44.361 -3.143 11.246 1.00 20.00 H new ATOM 0 HD2 PRO A 7 -42.494 -1.167 10.484 1.00 20.00 H new ATOM 0 HD3 PRO A 7 -43.539 -2.049 9.388 1.00 20.00 H new ATOM 237 N MET A 8 -43.800 1.807 11.836 1.00 20.00 N ATOM 238 CA MET A 8 -43.115 2.707 12.758 1.00 20.00 C ATOM 239 C MET A 8 -42.424 1.912 13.860 1.00 20.00 C ATOM 240 O MET A 8 -42.910 1.831 14.984 1.00 20.00 O ATOM 241 CB MET A 8 -44.093 3.717 13.366 1.00 20.00 C ATOM 242 CG MET A 8 -43.409 4.805 14.177 1.00 20.00 C ATOM 243 SD MET A 8 -44.573 5.912 14.997 1.00 20.00 S ATOM 244 CE MET A 8 -45.329 4.794 16.176 1.00 20.00 C ATOM 0 H MET A 8 -43.498 1.904 10.866 1.00 20.00 H new ATOM 0 HA MET A 8 -42.361 3.258 12.196 1.00 20.00 H new ATOM 0 HB2 MET A 8 -44.671 4.179 12.566 1.00 20.00 H new ATOM 0 HB3 MET A 8 -44.800 3.188 14.005 1.00 20.00 H new ATOM 0 HG2 MET A 8 -42.767 4.342 14.927 1.00 20.00 H new ATOM 0 HG3 MET A 8 -42.763 5.388 13.520 1.00 20.00 H new ATOM 0 HE1 MET A 8 -45.793 5.369 16.977 1.00 20.00 H new ATOM 0 HE2 MET A 8 -46.088 4.194 15.674 1.00 20.00 H new ATOM 0 HE3 MET A 8 -44.567 4.137 16.595 1.00 20.00 H new ATOM 254 N VAL A 9 -41.276 1.341 13.537 1.00 20.00 N ATOM 255 CA VAL A 9 -40.577 0.460 14.465 1.00 20.00 C ATOM 256 C VAL A 9 -39.652 1.237 15.398 1.00 20.00 C ATOM 257 O VAL A 9 -38.591 0.746 15.787 1.00 20.00 O ATOM 258 CB VAL A 9 -39.766 -0.622 13.720 1.00 20.00 C ATOM 259 CG1 VAL A 9 -40.696 -1.574 12.982 1.00 20.00 C ATOM 260 CG2 VAL A 9 -38.768 0.007 12.756 1.00 20.00 C ATOM 0 H VAL A 9 -40.806 1.470 12.641 1.00 20.00 H new ATOM 0 HA VAL A 9 -41.346 -0.027 15.064 1.00 20.00 H new ATOM 0 HB VAL A 9 -39.205 -1.191 14.461 1.00 20.00 H new ATOM 0 HG11 VAL A 9 -40.106 -2.329 12.463 1.00 20.00 H new ATOM 0 HG12 VAL A 9 -41.361 -2.060 13.696 1.00 20.00 H new ATOM 0 HG13 VAL A 9 -41.288 -1.015 12.257 1.00 20.00 H new ATOM 0 HG21 VAL A 9 -38.211 -0.778 12.245 1.00 20.00 H new ATOM 0 HG22 VAL A 9 -39.302 0.610 12.021 1.00 20.00 H new ATOM 0 HG23 VAL A 9 -38.076 0.641 13.311 1.00 20.00 H new ATOM 270 N SER A 10 -40.080 2.441 15.767 1.00 20.00 N ATOM 271 CA SER A 10 -39.299 3.321 16.635 1.00 20.00 C ATOM 272 C SER A 10 -37.914 3.575 16.046 1.00 20.00 C ATOM 273 O SER A 10 -36.900 3.383 16.721 1.00 20.00 O ATOM 274 CB SER A 10 -39.167 2.711 18.033 1.00 20.00 C ATOM 275 OG SER A 10 -40.438 2.377 18.570 1.00 20.00 O ATOM 0 H SER A 10 -40.975 2.834 15.475 1.00 20.00 H new ATOM 0 HA SER A 10 -39.824 4.273 16.711 1.00 20.00 H new ATOM 0 HB2 SER A 10 -38.543 1.818 17.986 1.00 20.00 H new ATOM 0 HB3 SER A 10 -38.664 3.416 18.694 1.00 20.00 H new ATOM 0 HG SER A 10 -40.324 1.988 19.462 1.00 20.00 H new ATOM 281 N GLU A 11 -37.893 4.000 14.780 1.00 20.00 N ATOM 282 CA GLU A 11 -36.651 4.276 14.052 1.00 20.00 C ATOM 283 C GLU A 11 -35.871 2.988 13.800 1.00 20.00 C ATOM 284 O GLU A 11 -35.262 2.424 14.709 1.00 20.00 O ATOM 285 CB GLU A 11 -35.765 5.270 14.814 1.00 20.00 C ATOM 286 CG GLU A 11 -36.439 6.593 15.131 1.00 20.00 C ATOM 287 CD GLU A 11 -35.628 7.440 16.088 1.00 20.00 C ATOM 288 OE1 GLU A 11 -35.681 7.178 17.306 1.00 20.00 O ATOM 289 OE2 GLU A 11 -34.938 8.376 15.633 1.00 20.00 O ATOM 0 H GLU A 11 -38.737 4.163 14.230 1.00 20.00 H new ATOM 0 HA GLU A 11 -36.929 4.719 13.096 1.00 20.00 H new ATOM 0 HB2 GLU A 11 -35.441 4.808 15.747 1.00 20.00 H new ATOM 0 HB3 GLU A 11 -34.868 5.464 14.226 1.00 20.00 H new ATOM 0 HG2 GLU A 11 -36.599 7.147 14.206 1.00 20.00 H new ATOM 0 HG3 GLU A 11 -37.422 6.403 15.562 1.00 20.00 H new ATOM 296 N PHE A 12 -35.893 2.523 12.562 1.00 20.00 N ATOM 297 CA PHE A 12 -35.131 1.341 12.197 1.00 20.00 C ATOM 298 C PHE A 12 -33.645 1.672 12.158 1.00 20.00 C ATOM 299 O PHE A 12 -32.813 0.877 12.594 1.00 20.00 O ATOM 300 CB PHE A 12 -35.613 0.757 10.857 1.00 20.00 C ATOM 301 CG PHE A 12 -35.695 1.747 9.720 1.00 20.00 C ATOM 302 CD1 PHE A 12 -36.813 2.554 9.561 1.00 20.00 C ATOM 303 CD2 PHE A 12 -34.659 1.863 8.803 1.00 20.00 C ATOM 304 CE1 PHE A 12 -36.895 3.454 8.515 1.00 20.00 C ATOM 305 CE2 PHE A 12 -34.739 2.760 7.755 1.00 20.00 C ATOM 306 CZ PHE A 12 -35.856 3.558 7.613 1.00 20.00 C ATOM 0 H PHE A 12 -36.425 2.942 11.799 1.00 20.00 H new ATOM 0 HA PHE A 12 -35.293 0.575 12.955 1.00 20.00 H new ATOM 0 HB2 PHE A 12 -34.941 -0.051 10.567 1.00 20.00 H new ATOM 0 HB3 PHE A 12 -36.598 0.314 11.005 1.00 20.00 H new ATOM 0 HD1 PHE A 12 -37.630 2.478 10.264 1.00 20.00 H new ATOM 0 HD2 PHE A 12 -33.780 1.245 8.910 1.00 20.00 H new ATOM 0 HE1 PHE A 12 -37.771 4.075 8.404 1.00 20.00 H new ATOM 0 HE2 PHE A 12 -33.927 2.837 7.047 1.00 20.00 H new ATOM 0 HZ PHE A 12 -35.917 4.263 6.797 1.00 20.00 H new ATOM 316 N GLU A 13 -33.336 2.861 11.641 1.00 20.00 N ATOM 317 CA GLU A 13 -31.980 3.432 11.644 1.00 20.00 C ATOM 318 C GLU A 13 -30.998 2.667 10.759 1.00 20.00 C ATOM 319 O GLU A 13 -29.938 3.189 10.412 1.00 20.00 O ATOM 320 CB GLU A 13 -31.436 3.553 13.068 1.00 20.00 C ATOM 321 CG GLU A 13 -32.182 4.582 13.903 1.00 20.00 C ATOM 322 CD GLU A 13 -32.258 5.934 13.218 1.00 20.00 C ATOM 323 OE1 GLU A 13 -33.201 6.154 12.431 1.00 20.00 O ATOM 324 OE2 GLU A 13 -31.368 6.777 13.447 1.00 20.00 O ATOM 0 H GLU A 13 -34.028 3.467 11.201 1.00 20.00 H new ATOM 0 HA GLU A 13 -32.075 4.429 11.213 1.00 20.00 H new ATOM 0 HB2 GLU A 13 -31.497 2.581 13.558 1.00 20.00 H new ATOM 0 HB3 GLU A 13 -30.381 3.823 13.026 1.00 20.00 H new ATOM 0 HG2 GLU A 13 -33.191 4.222 14.103 1.00 20.00 H new ATOM 0 HG3 GLU A 13 -31.686 4.693 14.867 1.00 20.00 H new ATOM 331 N THR A 14 -31.345 1.446 10.399 1.00 20.00 N ATOM 332 CA THR A 14 -30.543 0.665 9.485 1.00 20.00 C ATOM 333 C THR A 14 -30.558 1.307 8.106 1.00 20.00 C ATOM 334 O THR A 14 -31.600 1.764 7.636 1.00 20.00 O ATOM 335 CB THR A 14 -31.063 -0.784 9.402 1.00 20.00 C ATOM 336 OG1 THR A 14 -32.498 -0.785 9.351 1.00 20.00 O ATOM 337 CG2 THR A 14 -30.593 -1.603 10.595 1.00 20.00 C ATOM 0 H THR A 14 -32.185 0.973 10.731 1.00 20.00 H new ATOM 0 HA THR A 14 -29.519 0.639 9.857 1.00 20.00 H new ATOM 0 HB THR A 14 -30.664 -1.237 8.495 1.00 20.00 H new ATOM 0 HG1 THR A 14 -32.823 -1.708 9.297 1.00 20.00 H new ATOM 0 HG21 THR A 14 -30.974 -2.621 10.511 1.00 20.00 H new ATOM 0 HG22 THR A 14 -29.503 -1.624 10.615 1.00 20.00 H new ATOM 0 HG23 THR A 14 -30.964 -1.152 11.515 1.00 20.00 H new ATOM 345 N ILE A 15 -29.403 1.364 7.473 1.00 20.00 N ATOM 346 CA ILE A 15 -29.288 1.987 6.169 1.00 20.00 C ATOM 347 C ILE A 15 -29.785 1.022 5.104 1.00 20.00 C ATOM 348 O ILE A 15 -29.354 -0.121 5.044 1.00 20.00 O ATOM 349 CB ILE A 15 -27.828 2.398 5.874 1.00 20.00 C ATOM 350 CG1 ILE A 15 -27.333 3.418 6.909 1.00 20.00 C ATOM 351 CG2 ILE A 15 -27.696 2.965 4.468 1.00 20.00 C ATOM 352 CD1 ILE A 15 -28.153 4.691 6.967 1.00 20.00 C ATOM 0 H ILE A 15 -28.530 0.986 7.841 1.00 20.00 H new ATOM 0 HA ILE A 15 -29.898 2.890 6.160 1.00 20.00 H new ATOM 0 HB ILE A 15 -27.207 1.505 5.942 1.00 20.00 H new ATOM 0 HG12 ILE A 15 -27.337 2.951 7.894 1.00 20.00 H new ATOM 0 HG13 ILE A 15 -26.298 3.675 6.683 1.00 20.00 H new ATOM 0 HG21 ILE A 15 -26.659 3.247 4.285 1.00 20.00 H new ATOM 0 HG22 ILE A 15 -28.001 2.212 3.742 1.00 20.00 H new ATOM 0 HG23 ILE A 15 -28.334 3.844 4.369 1.00 20.00 H new ATOM 0 HD11 ILE A 15 -27.737 5.358 7.723 1.00 20.00 H new ATOM 0 HD12 ILE A 15 -28.129 5.184 5.995 1.00 20.00 H new ATOM 0 HD13 ILE A 15 -29.184 4.448 7.225 1.00 20.00 H new ATOM 364 N GLU A 16 -30.709 1.492 4.277 1.00 20.00 N ATOM 365 CA GLU A 16 -31.348 0.655 3.261 1.00 20.00 C ATOM 366 C GLU A 16 -30.331 -0.037 2.356 1.00 20.00 C ATOM 367 O GLU A 16 -30.598 -1.107 1.821 1.00 20.00 O ATOM 368 CB GLU A 16 -32.303 1.500 2.423 1.00 20.00 C ATOM 369 CG GLU A 16 -33.566 1.913 3.164 1.00 20.00 C ATOM 370 CD GLU A 16 -34.464 0.735 3.478 1.00 20.00 C ATOM 371 OE1 GLU A 16 -35.212 0.299 2.576 1.00 20.00 O ATOM 372 OE2 GLU A 16 -34.429 0.237 4.620 1.00 20.00 O ATOM 0 H GLU A 16 -31.038 2.458 4.288 1.00 20.00 H new ATOM 0 HA GLU A 16 -31.902 -0.127 3.781 1.00 20.00 H new ATOM 0 HB2 GLU A 16 -31.781 2.396 2.086 1.00 20.00 H new ATOM 0 HB3 GLU A 16 -32.583 0.939 1.531 1.00 20.00 H new ATOM 0 HG2 GLU A 16 -33.292 2.414 4.092 1.00 20.00 H new ATOM 0 HG3 GLU A 16 -34.117 2.636 2.562 1.00 20.00 H new ATOM 379 N GLN A 17 -29.164 0.568 2.198 1.00 20.00 N ATOM 380 CA GLN A 17 -28.120 0.002 1.351 1.00 20.00 C ATOM 381 C GLN A 17 -27.382 -1.154 2.027 1.00 20.00 C ATOM 382 O GLN A 17 -26.705 -1.929 1.357 1.00 20.00 O ATOM 383 CB GLN A 17 -27.125 1.083 0.933 1.00 20.00 C ATOM 384 CG GLN A 17 -27.697 2.081 -0.058 1.00 20.00 C ATOM 385 CD GLN A 17 -28.148 1.424 -1.350 1.00 20.00 C ATOM 386 OE1 GLN A 17 -27.368 1.278 -2.289 1.00 20.00 O ATOM 387 NE2 GLN A 17 -29.410 1.028 -1.411 1.00 20.00 N ATOM 0 H GLN A 17 -28.914 1.451 2.644 1.00 20.00 H new ATOM 0 HA GLN A 17 -28.614 -0.399 0.466 1.00 20.00 H new ATOM 0 HB2 GLN A 17 -26.787 1.617 1.821 1.00 20.00 H new ATOM 0 HB3 GLN A 17 -26.248 0.608 0.493 1.00 20.00 H new ATOM 0 HG2 GLN A 17 -28.542 2.597 0.398 1.00 20.00 H new ATOM 0 HG3 GLN A 17 -26.945 2.837 -0.282 1.00 20.00 H new ATOM 0 HE21 GLN A 17 -30.027 1.166 -0.611 1.00 20.00 H new ATOM 0 HE22 GLN A 17 -29.765 0.585 -2.258 1.00 20.00 H new ATOM 396 N GLU A 18 -27.524 -1.289 3.343 1.00 20.00 N ATOM 397 CA GLU A 18 -26.821 -2.348 4.066 1.00 20.00 C ATOM 398 C GLU A 18 -27.613 -3.652 4.012 1.00 20.00 C ATOM 399 O GLU A 18 -27.187 -4.669 4.559 1.00 20.00 O ATOM 400 CB GLU A 18 -26.545 -1.950 5.529 1.00 20.00 C ATOM 401 CG GLU A 18 -27.759 -2.033 6.445 1.00 20.00 C ATOM 402 CD GLU A 18 -27.451 -1.641 7.876 1.00 20.00 C ATOM 403 OE1 GLU A 18 -27.370 -0.427 8.166 1.00 20.00 O ATOM 404 OE2 GLU A 18 -27.296 -2.547 8.721 1.00 20.00 O ATOM 0 H GLU A 18 -28.110 -0.689 3.924 1.00 20.00 H new ATOM 0 HA GLU A 18 -25.860 -2.498 3.574 1.00 20.00 H new ATOM 0 HB2 GLU A 18 -25.761 -2.595 5.926 1.00 20.00 H new ATOM 0 HB3 GLU A 18 -26.160 -0.931 5.549 1.00 20.00 H new ATOM 0 HG2 GLU A 18 -28.544 -1.384 6.058 1.00 20.00 H new ATOM 0 HG3 GLU A 18 -28.150 -3.050 6.429 1.00 20.00 H new ATOM 411 N ASN A 19 -28.759 -3.620 3.334 1.00 20.00 N ATOM 412 CA ASN A 19 -29.619 -4.798 3.228 1.00 20.00 C ATOM 413 C ASN A 19 -28.876 -5.932 2.530 1.00 20.00 C ATOM 414 O ASN A 19 -29.077 -7.106 2.844 1.00 20.00 O ATOM 415 CB ASN A 19 -30.927 -4.479 2.473 1.00 20.00 C ATOM 416 CG ASN A 19 -30.779 -4.505 0.954 1.00 20.00 C ATOM 417 OD1 ASN A 19 -30.931 -5.554 0.325 1.00 20.00 O ATOM 418 ND2 ASN A 19 -30.512 -3.355 0.351 1.00 20.00 N ATOM 0 H ASN A 19 -29.113 -2.794 2.851 1.00 20.00 H new ATOM 0 HA ASN A 19 -29.883 -5.109 4.239 1.00 20.00 H new ATOM 0 HB2 ASN A 19 -31.691 -5.198 2.767 1.00 20.00 H new ATOM 0 HB3 ASN A 19 -31.282 -3.495 2.778 1.00 20.00 H new ATOM 0 HD21 ASN A 19 -30.426 -3.320 -0.665 1.00 20.00 H new ATOM 0 HD22 ASN A 19 -30.392 -2.506 0.903 1.00 20.00 H new ATOM 425 N SER A 20 -27.992 -5.565 1.607 1.00 20.00 N ATOM 426 CA SER A 20 -27.250 -6.535 0.819 1.00 20.00 C ATOM 427 C SER A 20 -26.181 -7.226 1.656 1.00 20.00 C ATOM 428 O SER A 20 -25.814 -8.369 1.390 1.00 20.00 O ATOM 429 CB SER A 20 -26.611 -5.837 -0.381 1.00 20.00 C ATOM 430 OG SER A 20 -25.955 -4.644 0.024 1.00 20.00 O ATOM 0 H SER A 20 -27.773 -4.593 1.388 1.00 20.00 H new ATOM 0 HA SER A 20 -27.944 -7.299 0.470 1.00 20.00 H new ATOM 0 HB2 SER A 20 -25.896 -6.507 -0.860 1.00 20.00 H new ATOM 0 HB3 SER A 20 -27.375 -5.604 -1.122 1.00 20.00 H new ATOM 0 HG SER A 20 -24.990 -4.735 -0.123 1.00 20.00 H new ATOM 436 N TYR A 21 -25.699 -6.534 2.681 1.00 20.00 N ATOM 437 CA TYR A 21 -24.650 -7.069 3.538 1.00 20.00 C ATOM 438 C TYR A 21 -25.129 -8.330 4.249 1.00 20.00 C ATOM 439 O TYR A 21 -24.409 -9.327 4.324 1.00 20.00 O ATOM 440 CB TYR A 21 -24.202 -6.016 4.554 1.00 20.00 C ATOM 441 CG TYR A 21 -23.115 -6.496 5.486 1.00 20.00 C ATOM 442 CD1 TYR A 21 -21.827 -6.728 5.019 1.00 20.00 C ATOM 443 CD2 TYR A 21 -23.376 -6.727 6.829 1.00 20.00 C ATOM 444 CE1 TYR A 21 -20.832 -7.171 5.866 1.00 20.00 C ATOM 445 CE2 TYR A 21 -22.386 -7.170 7.681 1.00 20.00 C ATOM 446 CZ TYR A 21 -21.118 -7.391 7.196 1.00 20.00 C ATOM 447 OH TYR A 21 -20.131 -7.836 8.043 1.00 20.00 O ATOM 0 H TYR A 21 -26.019 -5.600 2.939 1.00 20.00 H new ATOM 0 HA TYR A 21 -23.796 -7.332 2.914 1.00 20.00 H new ATOM 0 HB2 TYR A 21 -23.847 -5.135 4.019 1.00 20.00 H new ATOM 0 HB3 TYR A 21 -25.063 -5.704 5.145 1.00 20.00 H new ATOM 0 HD1 TYR A 21 -21.601 -6.559 3.977 1.00 20.00 H new ATOM 0 HD2 TYR A 21 -24.371 -6.557 7.214 1.00 20.00 H new ATOM 0 HE1 TYR A 21 -19.835 -7.344 5.489 1.00 20.00 H new ATOM 0 HE2 TYR A 21 -22.605 -7.343 8.724 1.00 20.00 H new ATOM 0 HH TYR A 21 -20.497 -7.939 8.946 1.00 20.00 H new ATOM 457 N ASN A 22 -26.357 -8.289 4.749 1.00 20.00 N ATOM 458 CA ASN A 22 -26.937 -9.441 5.429 1.00 20.00 C ATOM 459 C ASN A 22 -27.209 -10.548 4.411 1.00 20.00 C ATOM 460 O ASN A 22 -27.100 -11.736 4.717 1.00 20.00 O ATOM 461 CB ASN A 22 -28.230 -9.043 6.155 1.00 20.00 C ATOM 462 CG ASN A 22 -28.631 -10.028 7.245 1.00 20.00 C ATOM 463 OD1 ASN A 22 -28.312 -11.215 7.186 1.00 20.00 O ATOM 464 ND2 ASN A 22 -29.345 -9.541 8.249 1.00 20.00 N ATOM 0 H ASN A 22 -26.969 -7.475 4.697 1.00 20.00 H new ATOM 0 HA ASN A 22 -26.233 -9.809 6.175 1.00 20.00 H new ATOM 0 HB2 ASN A 22 -28.102 -8.054 6.596 1.00 20.00 H new ATOM 0 HB3 ASN A 22 -29.039 -8.966 5.428 1.00 20.00 H new ATOM 0 HD21 ASN A 22 -29.648 -10.156 9.005 1.00 20.00 H new ATOM 0 HD22 ASN A 22 -29.592 -8.551 8.266 1.00 20.00 H new ATOM 471 N GLU A 23 -27.524 -10.142 3.184 1.00 20.00 N ATOM 472 CA GLU A 23 -27.757 -11.084 2.094 1.00 20.00 C ATOM 473 C GLU A 23 -26.486 -11.871 1.787 1.00 20.00 C ATOM 474 O GLU A 23 -26.527 -13.087 1.580 1.00 20.00 O ATOM 475 CB GLU A 23 -28.218 -10.347 0.832 1.00 20.00 C ATOM 476 CG GLU A 23 -29.544 -9.620 0.978 1.00 20.00 C ATOM 477 CD GLU A 23 -30.699 -10.558 1.242 1.00 20.00 C ATOM 478 OE1 GLU A 23 -31.164 -11.214 0.288 1.00 20.00 O ATOM 479 OE2 GLU A 23 -31.159 -10.633 2.399 1.00 20.00 O ATOM 0 H GLU A 23 -27.624 -9.162 2.919 1.00 20.00 H new ATOM 0 HA GLU A 23 -28.539 -11.775 2.408 1.00 20.00 H new ATOM 0 HB2 GLU A 23 -27.452 -9.626 0.547 1.00 20.00 H new ATOM 0 HB3 GLU A 23 -28.299 -11.065 0.016 1.00 20.00 H new ATOM 0 HG2 GLU A 23 -29.471 -8.901 1.794 1.00 20.00 H new ATOM 0 HG3 GLU A 23 -29.744 -9.052 0.070 1.00 20.00 H new ATOM 486 N TRP A 24 -25.356 -11.171 1.763 1.00 20.00 N ATOM 487 CA TRP A 24 -24.072 -11.806 1.501 1.00 20.00 C ATOM 488 C TRP A 24 -23.703 -12.757 2.629 1.00 20.00 C ATOM 489 O TRP A 24 -23.112 -13.810 2.392 1.00 20.00 O ATOM 490 CB TRP A 24 -22.967 -10.765 1.313 1.00 20.00 C ATOM 491 CG TRP A 24 -23.154 -9.906 0.101 1.00 20.00 C ATOM 492 CD1 TRP A 24 -23.589 -10.306 -1.128 1.00 20.00 C ATOM 493 CD2 TRP A 24 -22.891 -8.504 -0.001 1.00 20.00 C ATOM 494 NE1 TRP A 24 -23.623 -9.235 -1.985 1.00 20.00 N ATOM 495 CE2 TRP A 24 -23.200 -8.117 -1.317 1.00 20.00 C ATOM 496 CE3 TRP A 24 -22.429 -7.537 0.894 1.00 20.00 C ATOM 497 CZ2 TRP A 24 -23.061 -6.803 -1.760 1.00 20.00 C ATOM 498 CZ3 TRP A 24 -22.292 -6.234 0.455 1.00 20.00 C ATOM 499 CH2 TRP A 24 -22.608 -5.878 -0.861 1.00 20.00 C ATOM 0 H TRP A 24 -25.305 -10.165 1.922 1.00 20.00 H new ATOM 0 HA TRP A 24 -24.168 -12.375 0.576 1.00 20.00 H new ATOM 0 HB2 TRP A 24 -22.925 -10.128 2.197 1.00 20.00 H new ATOM 0 HB3 TRP A 24 -22.007 -11.275 1.242 1.00 20.00 H new ATOM 0 HD1 TRP A 24 -23.866 -11.317 -1.388 1.00 20.00 H new ATOM 0 HE1 TRP A 24 -23.916 -9.267 -2.962 1.00 20.00 H new ATOM 0 HE3 TRP A 24 -22.183 -7.803 1.911 1.00 20.00 H new ATOM 0 HZ2 TRP A 24 -23.302 -6.526 -2.776 1.00 20.00 H new ATOM 0 HZ3 TRP A 24 -21.935 -5.478 1.139 1.00 20.00 H new ATOM 0 HH2 TRP A 24 -22.492 -4.851 -1.173 1.00 20.00 H new ATOM 510 N LEU A 25 -24.061 -12.388 3.854 1.00 20.00 N ATOM 511 CA LEU A 25 -23.799 -13.234 5.011 1.00 20.00 C ATOM 512 C LEU A 25 -24.662 -14.490 4.956 1.00 20.00 C ATOM 513 O LEU A 25 -24.206 -15.588 5.285 1.00 20.00 O ATOM 514 CB LEU A 25 -24.058 -12.469 6.311 1.00 20.00 C ATOM 515 CG LEU A 25 -23.124 -11.281 6.569 1.00 20.00 C ATOM 516 CD1 LEU A 25 -23.510 -10.571 7.855 1.00 20.00 C ATOM 517 CD2 LEU A 25 -21.672 -11.735 6.636 1.00 20.00 C ATOM 0 H LEU A 25 -24.533 -11.510 4.071 1.00 20.00 H new ATOM 0 HA LEU A 25 -22.750 -13.528 4.989 1.00 20.00 H new ATOM 0 HB2 LEU A 25 -25.086 -12.106 6.301 1.00 20.00 H new ATOM 0 HB3 LEU A 25 -23.973 -13.165 7.146 1.00 20.00 H new ATOM 0 HG LEU A 25 -23.228 -10.584 5.737 1.00 20.00 H new ATOM 0 HD11 LEU A 25 -22.837 -9.730 8.023 1.00 20.00 H new ATOM 0 HD12 LEU A 25 -24.534 -10.206 7.776 1.00 20.00 H new ATOM 0 HD13 LEU A 25 -23.437 -11.267 8.691 1.00 20.00 H new ATOM 0 HD21 LEU A 25 -21.030 -10.874 6.820 1.00 20.00 H new ATOM 0 HD22 LEU A 25 -21.553 -12.456 7.445 1.00 20.00 H new ATOM 0 HD23 LEU A 25 -21.393 -12.201 5.691 1.00 20.00 H new ATOM 529 N ARG A 26 -25.902 -14.322 4.512 1.00 20.00 N ATOM 530 CA ARG A 26 -26.841 -15.431 4.387 1.00 20.00 C ATOM 531 C ARG A 26 -26.336 -16.458 3.374 1.00 20.00 C ATOM 532 O ARG A 26 -26.654 -17.644 3.460 1.00 20.00 O ATOM 533 CB ARG A 26 -28.217 -14.909 3.959 1.00 20.00 C ATOM 534 CG ARG A 26 -29.337 -15.944 4.024 1.00 20.00 C ATOM 535 CD ARG A 26 -29.815 -16.194 5.452 1.00 20.00 C ATOM 536 NE ARG A 26 -28.807 -16.858 6.282 1.00 20.00 N ATOM 537 CZ ARG A 26 -28.311 -16.348 7.411 1.00 20.00 C ATOM 538 NH1 ARG A 26 -28.687 -15.143 7.831 1.00 20.00 N ATOM 539 NH2 ARG A 26 -27.433 -17.045 8.120 1.00 20.00 N ATOM 0 H ARG A 26 -26.284 -13.419 4.230 1.00 20.00 H new ATOM 0 HA ARG A 26 -26.928 -15.918 5.358 1.00 20.00 H new ATOM 0 HB2 ARG A 26 -28.484 -14.064 4.593 1.00 20.00 H new ATOM 0 HB3 ARG A 26 -28.147 -14.532 2.939 1.00 20.00 H new ATOM 0 HG2 ARG A 26 -30.176 -15.606 3.417 1.00 20.00 H new ATOM 0 HG3 ARG A 26 -28.988 -16.881 3.591 1.00 20.00 H new ATOM 0 HD2 ARG A 26 -30.087 -15.243 5.910 1.00 20.00 H new ATOM 0 HD3 ARG A 26 -30.717 -16.805 5.426 1.00 20.00 H new ATOM 0 HE ARG A 26 -28.462 -17.768 5.978 1.00 20.00 H new ATOM 0 HH11 ARG A 26 -29.360 -14.601 7.289 1.00 20.00 H new ATOM 0 HH12 ARG A 26 -28.303 -14.761 8.695 1.00 20.00 H new ATOM 0 HH21 ARG A 26 -27.139 -17.968 7.802 1.00 20.00 H new ATOM 0 HH22 ARG A 26 -27.052 -16.658 8.983 1.00 20.00 H new ATOM 553 N ALA A 27 -25.548 -15.991 2.415 1.00 20.00 N ATOM 554 CA ALA A 27 -24.981 -16.863 1.395 1.00 20.00 C ATOM 555 C ALA A 27 -23.626 -17.413 1.829 1.00 20.00 C ATOM 556 O ALA A 27 -23.250 -18.528 1.462 1.00 20.00 O ATOM 557 CB ALA A 27 -24.845 -16.110 0.083 1.00 20.00 C ATOM 0 H ALA A 27 -25.286 -15.010 2.322 1.00 20.00 H new ATOM 0 HA ALA A 27 -25.657 -17.706 1.256 1.00 20.00 H new ATOM 0 HB1 ALA A 27 -24.420 -16.770 -0.673 1.00 20.00 H new ATOM 0 HB2 ALA A 27 -25.827 -15.768 -0.244 1.00 20.00 H new ATOM 0 HB3 ALA A 27 -24.190 -15.250 0.223 1.00 20.00 H new ATOM 563 N LYS A 28 -22.909 -16.627 2.625 1.00 20.00 N ATOM 564 CA LYS A 28 -21.558 -16.981 3.056 1.00 20.00 C ATOM 565 C LYS A 28 -21.570 -18.195 3.978 1.00 20.00 C ATOM 566 O LYS A 28 -20.588 -18.935 4.053 1.00 20.00 O ATOM 567 CB LYS A 28 -20.895 -15.799 3.769 1.00 20.00 C ATOM 568 CG LYS A 28 -19.468 -16.079 4.217 1.00 20.00 C ATOM 569 CD LYS A 28 -18.860 -14.883 4.928 1.00 20.00 C ATOM 570 CE LYS A 28 -17.400 -15.128 5.285 1.00 20.00 C ATOM 571 NZ LYS A 28 -16.565 -15.372 4.079 1.00 20.00 N ATOM 0 H LYS A 28 -23.243 -15.734 2.988 1.00 20.00 H new ATOM 0 HA LYS A 28 -20.984 -17.231 2.164 1.00 20.00 H new ATOM 0 HB2 LYS A 28 -20.895 -14.937 3.102 1.00 20.00 H new ATOM 0 HB3 LYS A 28 -21.493 -15.528 4.639 1.00 20.00 H new ATOM 0 HG2 LYS A 28 -19.458 -16.942 4.882 1.00 20.00 H new ATOM 0 HG3 LYS A 28 -18.858 -16.337 3.351 1.00 20.00 H new ATOM 0 HD2 LYS A 28 -18.937 -14.002 4.291 1.00 20.00 H new ATOM 0 HD3 LYS A 28 -19.427 -14.671 5.835 1.00 20.00 H new ATOM 0 HE2 LYS A 28 -17.010 -14.267 5.828 1.00 20.00 H new ATOM 0 HE3 LYS A 28 -17.329 -15.985 5.954 1.00 20.00 H new ATOM 0 HZ1 LYS A 28 -15.561 -15.248 4.321 1.00 20.00 H new ATOM 0 HZ2 LYS A 28 -16.722 -16.342 3.738 1.00 20.00 H new ATOM 0 HZ3 LYS A 28 -16.827 -14.696 3.333 1.00 20.00 H new ATOM 585 N VAL A 29 -22.689 -18.403 4.665 1.00 20.00 N ATOM 586 CA VAL A 29 -22.827 -19.533 5.580 1.00 20.00 C ATOM 587 C VAL A 29 -22.699 -20.859 4.825 1.00 20.00 C ATOM 588 O VAL A 29 -22.474 -21.913 5.418 1.00 20.00 O ATOM 589 CB VAL A 29 -24.175 -19.485 6.343 1.00 20.00 C ATOM 590 CG1 VAL A 29 -25.342 -19.777 5.413 1.00 20.00 C ATOM 591 CG2 VAL A 29 -24.170 -20.444 7.523 1.00 20.00 C ATOM 0 H VAL A 29 -23.513 -17.805 4.606 1.00 20.00 H new ATOM 0 HA VAL A 29 -22.021 -19.462 6.311 1.00 20.00 H new ATOM 0 HB VAL A 29 -24.300 -18.474 6.731 1.00 20.00 H new ATOM 0 HG11 VAL A 29 -26.275 -19.737 5.976 1.00 20.00 H new ATOM 0 HG12 VAL A 29 -25.367 -19.034 4.616 1.00 20.00 H new ATOM 0 HG13 VAL A 29 -25.222 -20.770 4.980 1.00 20.00 H new ATOM 0 HG21 VAL A 29 -25.128 -20.390 8.040 1.00 20.00 H new ATOM 0 HG22 VAL A 29 -24.008 -21.461 7.165 1.00 20.00 H new ATOM 0 HG23 VAL A 29 -23.370 -20.170 8.211 1.00 20.00 H new ATOM 601 N ALA A 30 -22.832 -20.792 3.508 1.00 20.00 N ATOM 602 CA ALA A 30 -22.650 -21.955 2.663 1.00 20.00 C ATOM 603 C ALA A 30 -21.268 -21.920 2.020 1.00 20.00 C ATOM 604 O ALA A 30 -21.131 -21.732 0.809 1.00 20.00 O ATOM 605 CB ALA A 30 -23.742 -22.013 1.609 1.00 20.00 C ATOM 0 H ALA A 30 -23.067 -19.938 3.003 1.00 20.00 H new ATOM 0 HA ALA A 30 -22.721 -22.856 3.272 1.00 20.00 H new ATOM 0 HB1 ALA A 30 -23.595 -22.891 0.980 1.00 20.00 H new ATOM 0 HB2 ALA A 30 -24.715 -22.075 2.096 1.00 20.00 H new ATOM 0 HB3 ALA A 30 -23.701 -21.115 0.993 1.00 20.00 H new ATOM 611 N THR A 31 -20.247 -22.080 2.848 1.00 20.00 N ATOM 612 CA THR A 31 -18.868 -22.044 2.390 1.00 20.00 C ATOM 613 C THR A 31 -18.468 -23.386 1.777 1.00 20.00 C ATOM 614 O THR A 31 -18.799 -24.441 2.315 1.00 20.00 O ATOM 615 CB THR A 31 -17.925 -21.717 3.561 1.00 20.00 C ATOM 616 OG1 THR A 31 -18.446 -20.611 4.310 1.00 20.00 O ATOM 617 CG2 THR A 31 -16.529 -21.374 3.063 1.00 20.00 C ATOM 0 H THR A 31 -20.350 -22.238 3.850 1.00 20.00 H new ATOM 0 HA THR A 31 -18.784 -21.267 1.630 1.00 20.00 H new ATOM 0 HB THR A 31 -17.859 -22.599 4.198 1.00 20.00 H new ATOM 0 HG1 THR A 31 -19.164 -20.181 3.801 1.00 20.00 H new ATOM 0 HG21 THR A 31 -15.885 -21.147 3.913 1.00 20.00 H new ATOM 0 HG22 THR A 31 -16.120 -22.222 2.514 1.00 20.00 H new ATOM 0 HG23 THR A 31 -16.580 -20.506 2.405 1.00 20.00 H new ATOM 625 N SER A 32 -17.764 -23.342 0.654 1.00 20.00 N ATOM 626 CA SER A 32 -17.325 -24.554 -0.020 1.00 20.00 C ATOM 627 C SER A 32 -15.905 -24.927 0.406 1.00 20.00 C ATOM 628 O SER A 32 -15.080 -24.044 0.664 1.00 20.00 O ATOM 629 CB SER A 32 -17.398 -24.352 -1.534 1.00 20.00 C ATOM 630 OG SER A 32 -16.851 -23.096 -1.905 1.00 20.00 O ATOM 0 H SER A 32 -17.485 -22.477 0.191 1.00 20.00 H new ATOM 0 HA SER A 32 -17.984 -25.375 0.262 1.00 20.00 H new ATOM 0 HB2 SER A 32 -16.856 -25.152 -2.038 1.00 20.00 H new ATOM 0 HB3 SER A 32 -18.435 -24.413 -1.863 1.00 20.00 H new ATOM 0 HG SER A 32 -16.907 -22.989 -2.878 1.00 20.00 H new ATOM 636 N LEU A 33 -15.637 -26.234 0.491 1.00 20.00 N ATOM 637 CA LEU A 33 -14.321 -26.752 0.879 1.00 20.00 C ATOM 638 C LEU A 33 -13.962 -26.338 2.304 1.00 20.00 C ATOM 639 O LEU A 33 -12.783 -26.228 2.656 1.00 20.00 O ATOM 640 CB LEU A 33 -13.235 -26.273 -0.094 1.00 20.00 C ATOM 641 CG LEU A 33 -13.319 -26.834 -1.518 1.00 20.00 C ATOM 642 CD1 LEU A 33 -12.261 -26.192 -2.402 1.00 20.00 C ATOM 643 CD2 LEU A 33 -13.153 -28.347 -1.514 1.00 20.00 C ATOM 0 H LEU A 33 -16.324 -26.961 0.293 1.00 20.00 H new ATOM 0 HA LEU A 33 -14.374 -27.840 0.839 1.00 20.00 H new ATOM 0 HB2 LEU A 33 -13.278 -25.185 -0.149 1.00 20.00 H new ATOM 0 HB3 LEU A 33 -12.261 -26.533 0.322 1.00 20.00 H new ATOM 0 HG LEU A 33 -14.304 -26.598 -1.920 1.00 20.00 H new ATOM 0 HD11 LEU A 33 -12.333 -26.600 -3.410 1.00 20.00 H new ATOM 0 HD12 LEU A 33 -12.419 -25.114 -2.435 1.00 20.00 H new ATOM 0 HD13 LEU A 33 -11.271 -26.401 -1.995 1.00 20.00 H new ATOM 0 HD21 LEU A 33 -13.216 -28.723 -2.535 1.00 20.00 H new ATOM 0 HD22 LEU A 33 -12.182 -28.605 -1.092 1.00 20.00 H new ATOM 0 HD23 LEU A 33 -13.942 -28.798 -0.912 1.00 20.00 H new ATOM 655 N ALA A 34 -14.982 -26.116 3.118 1.00 20.00 N ATOM 656 CA ALA A 34 -14.794 -25.714 4.503 1.00 20.00 C ATOM 657 C ALA A 34 -16.066 -25.944 5.304 1.00 20.00 C ATOM 658 O ALA A 34 -17.169 -25.696 4.813 1.00 20.00 O ATOM 659 CB ALA A 34 -14.388 -24.250 4.581 1.00 20.00 C ATOM 0 H ALA A 34 -15.959 -26.209 2.839 1.00 20.00 H new ATOM 0 HA ALA A 34 -13.997 -26.324 4.930 1.00 20.00 H new ATOM 0 HB1 ALA A 34 -14.251 -23.965 5.624 1.00 20.00 H new ATOM 0 HB2 ALA A 34 -13.454 -24.102 4.039 1.00 20.00 H new ATOM 0 HB3 ALA A 34 -15.168 -23.632 4.135 1.00 20.00 H new ATOM 665 N ASP A 35 -15.909 -26.434 6.526 1.00 20.00 N ATOM 666 CA ASP A 35 -17.037 -26.600 7.433 1.00 20.00 C ATOM 667 C ASP A 35 -17.363 -25.267 8.090 1.00 20.00 C ATOM 668 O ASP A 35 -16.525 -24.707 8.801 1.00 20.00 O ATOM 669 CB ASP A 35 -16.733 -27.642 8.518 1.00 20.00 C ATOM 670 CG ASP A 35 -16.629 -29.054 7.979 1.00 20.00 C ATOM 671 OD1 ASP A 35 -17.681 -29.677 7.728 1.00 20.00 O ATOM 672 OD2 ASP A 35 -15.495 -29.553 7.810 1.00 20.00 O ATOM 0 H ASP A 35 -15.011 -26.724 6.913 1.00 20.00 H new ATOM 0 HA ASP A 35 -17.890 -26.950 6.852 1.00 20.00 H new ATOM 0 HB2 ASP A 35 -15.798 -27.379 9.013 1.00 20.00 H new ATOM 0 HB3 ASP A 35 -17.516 -27.606 9.276 1.00 20.00 H new ATOM 677 N PRO A 36 -18.568 -24.726 7.851 1.00 20.00 N ATOM 678 CA PRO A 36 -19.004 -23.462 8.451 1.00 20.00 C ATOM 679 C PRO A 36 -19.320 -23.617 9.936 1.00 20.00 C ATOM 680 O PRO A 36 -20.486 -23.598 10.341 1.00 20.00 O ATOM 681 CB PRO A 36 -20.275 -23.097 7.668 1.00 20.00 C ATOM 682 CG PRO A 36 -20.335 -24.056 6.524 1.00 20.00 C ATOM 683 CD PRO A 36 -19.600 -25.283 6.973 1.00 20.00 C ATOM 0 HA PRO A 36 -18.229 -22.698 8.394 1.00 20.00 H new ATOM 0 HB2 PRO A 36 -21.161 -23.183 8.297 1.00 20.00 H new ATOM 0 HB3 PRO A 36 -20.234 -22.067 7.314 1.00 20.00 H new ATOM 0 HG2 PRO A 36 -21.368 -24.292 6.267 1.00 20.00 H new ATOM 0 HG3 PRO A 36 -19.874 -23.630 5.633 1.00 20.00 H new ATOM 0 HD2 PRO A 36 -20.253 -25.977 7.502 1.00 20.00 H new ATOM 0 HD3 PRO A 36 -19.169 -25.828 6.134 1.00 20.00 H new ATOM 691 N ARG A 37 -18.264 -23.774 10.728 1.00 20.00 N ATOM 692 CA ARG A 37 -18.372 -23.998 12.167 1.00 20.00 C ATOM 693 C ARG A 37 -19.294 -25.185 12.458 1.00 20.00 C ATOM 694 O ARG A 37 -20.472 -25.009 12.770 1.00 20.00 O ATOM 695 CB ARG A 37 -18.872 -22.736 12.878 1.00 20.00 C ATOM 696 CG ARG A 37 -18.800 -22.823 14.393 1.00 20.00 C ATOM 697 CD ARG A 37 -19.269 -21.539 15.051 1.00 20.00 C ATOM 698 NE ARG A 37 -19.186 -21.616 16.507 1.00 20.00 N ATOM 699 CZ ARG A 37 -19.463 -20.605 17.327 1.00 20.00 C ATOM 700 NH1 ARG A 37 -19.871 -19.439 16.839 1.00 20.00 N ATOM 701 NH2 ARG A 37 -19.338 -20.761 18.636 1.00 20.00 N ATOM 0 H ARG A 37 -17.303 -23.749 10.388 1.00 20.00 H new ATOM 0 HA ARG A 37 -17.379 -24.232 12.552 1.00 20.00 H new ATOM 0 HB2 ARG A 37 -18.283 -21.883 12.543 1.00 20.00 H new ATOM 0 HB3 ARG A 37 -19.904 -22.547 12.582 1.00 20.00 H new ATOM 0 HG2 ARG A 37 -19.413 -23.655 14.739 1.00 20.00 H new ATOM 0 HG3 ARG A 37 -17.775 -23.035 14.697 1.00 20.00 H new ATOM 0 HD2 ARG A 37 -18.663 -20.706 14.696 1.00 20.00 H new ATOM 0 HD3 ARG A 37 -20.298 -21.334 14.756 1.00 20.00 H new ATOM 0 HE ARG A 37 -18.897 -22.502 16.922 1.00 20.00 H new ATOM 0 HH11 ARG A 37 -19.973 -19.315 15.832 1.00 20.00 H new ATOM 0 HH12 ARG A 37 -20.082 -18.667 17.472 1.00 20.00 H new ATOM 0 HH21 ARG A 37 -19.029 -21.656 19.016 1.00 20.00 H new ATOM 0 HH22 ARG A 37 -19.550 -19.986 19.265 1.00 20.00 H new ATOM 715 N PRO A 38 -18.767 -26.415 12.347 1.00 20.00 N ATOM 716 CA PRO A 38 -19.558 -27.631 12.537 1.00 20.00 C ATOM 717 C PRO A 38 -20.003 -27.808 13.985 1.00 20.00 C ATOM 718 O PRO A 38 -19.196 -28.106 14.871 1.00 20.00 O ATOM 719 CB PRO A 38 -18.606 -28.756 12.121 1.00 20.00 C ATOM 720 CG PRO A 38 -17.240 -28.191 12.306 1.00 20.00 C ATOM 721 CD PRO A 38 -17.355 -26.713 12.042 1.00 20.00 C ATOM 0 HA PRO A 38 -20.480 -27.610 11.957 1.00 20.00 H new ATOM 0 HB2 PRO A 38 -18.752 -29.645 12.735 1.00 20.00 H new ATOM 0 HB3 PRO A 38 -18.774 -29.053 11.086 1.00 20.00 H new ATOM 0 HG2 PRO A 38 -16.875 -28.378 13.316 1.00 20.00 H new ATOM 0 HG3 PRO A 38 -16.531 -28.655 11.620 1.00 20.00 H new ATOM 0 HD2 PRO A 38 -16.678 -26.139 12.675 1.00 20.00 H new ATOM 0 HD3 PRO A 38 -17.108 -26.470 11.009 1.00 20.00 H new ATOM 729 N ALA A 39 -21.289 -27.608 14.222 1.00 20.00 N ATOM 730 CA ALA A 39 -21.849 -27.758 15.552 1.00 20.00 C ATOM 731 C ALA A 39 -22.080 -29.228 15.866 1.00 20.00 C ATOM 732 O ALA A 39 -22.935 -29.875 15.259 1.00 20.00 O ATOM 733 CB ALA A 39 -23.146 -26.976 15.674 1.00 20.00 C ATOM 0 H ALA A 39 -21.966 -27.341 13.507 1.00 20.00 H new ATOM 0 HA ALA A 39 -21.138 -27.358 16.275 1.00 20.00 H new ATOM 0 HB1 ALA A 39 -23.552 -27.100 16.678 1.00 20.00 H new ATOM 0 HB2 ALA A 39 -22.953 -25.919 15.488 1.00 20.00 H new ATOM 0 HB3 ALA A 39 -23.865 -27.347 14.943 1.00 20.00 H new ATOM 739 N ILE A 40 -21.300 -29.754 16.794 1.00 20.00 N ATOM 740 CA ILE A 40 -21.426 -31.144 17.198 1.00 20.00 C ATOM 741 C ILE A 40 -22.013 -31.239 18.600 1.00 20.00 C ATOM 742 O ILE A 40 -21.463 -30.690 19.555 1.00 20.00 O ATOM 743 CB ILE A 40 -20.082 -31.902 17.132 1.00 20.00 C ATOM 744 CG1 ILE A 40 -18.949 -31.081 17.757 1.00 20.00 C ATOM 745 CG2 ILE A 40 -19.757 -32.258 15.691 1.00 20.00 C ATOM 746 CD1 ILE A 40 -17.635 -31.824 17.836 1.00 20.00 C ATOM 0 H ILE A 40 -20.570 -29.237 17.284 1.00 20.00 H new ATOM 0 HA ILE A 40 -22.102 -31.621 16.488 1.00 20.00 H new ATOM 0 HB ILE A 40 -20.178 -32.821 17.710 1.00 20.00 H new ATOM 0 HG12 ILE A 40 -18.807 -30.171 17.175 1.00 20.00 H new ATOM 0 HG13 ILE A 40 -19.244 -30.775 18.761 1.00 20.00 H new ATOM 0 HG21 ILE A 40 -18.808 -32.792 15.653 1.00 20.00 H new ATOM 0 HG22 ILE A 40 -20.546 -32.891 15.286 1.00 20.00 H new ATOM 0 HG23 ILE A 40 -19.684 -31.346 15.099 1.00 20.00 H new ATOM 0 HD11 ILE A 40 -16.880 -31.181 18.289 1.00 20.00 H new ATOM 0 HD12 ILE A 40 -17.760 -32.720 18.443 1.00 20.00 H new ATOM 0 HD13 ILE A 40 -17.316 -32.107 16.833 1.00 20.00 H new ATOM 758 N PRO A 41 -23.158 -31.918 18.732 1.00 20.00 N ATOM 759 CA PRO A 41 -23.863 -32.027 20.009 1.00 20.00 C ATOM 760 C PRO A 41 -23.146 -32.940 21.002 1.00 20.00 C ATOM 761 O PRO A 41 -22.966 -34.132 20.747 1.00 20.00 O ATOM 762 CB PRO A 41 -25.217 -32.628 19.616 1.00 20.00 C ATOM 763 CG PRO A 41 -24.953 -33.374 18.352 1.00 20.00 C ATOM 764 CD PRO A 41 -23.853 -32.631 17.645 1.00 20.00 C ATOM 0 HA PRO A 41 -23.934 -31.064 20.514 1.00 20.00 H new ATOM 0 HB2 PRO A 41 -25.596 -33.291 20.394 1.00 20.00 H new ATOM 0 HB3 PRO A 41 -25.966 -31.850 19.467 1.00 20.00 H new ATOM 0 HG2 PRO A 41 -24.656 -34.401 18.562 1.00 20.00 H new ATOM 0 HG3 PRO A 41 -25.850 -33.422 17.734 1.00 20.00 H new ATOM 0 HD2 PRO A 41 -23.183 -33.312 17.120 1.00 20.00 H new ATOM 0 HD3 PRO A 41 -24.250 -31.939 16.902 1.00 20.00 H new ATOM 772 N HIS A 42 -22.753 -32.387 22.148 1.00 20.00 N ATOM 773 CA HIS A 42 -22.102 -33.184 23.183 1.00 20.00 C ATOM 774 C HIS A 42 -23.152 -33.951 23.979 1.00 20.00 C ATOM 775 O HIS A 42 -22.823 -34.739 24.867 1.00 20.00 O ATOM 776 CB HIS A 42 -21.236 -32.314 24.118 1.00 20.00 C ATOM 777 CG HIS A 42 -22.004 -31.475 25.106 1.00 20.00 C ATOM 778 ND1 HIS A 42 -22.153 -31.829 26.431 1.00 20.00 N ATOM 779 CD2 HIS A 42 -22.635 -30.284 24.968 1.00 20.00 C ATOM 780 CE1 HIS A 42 -22.845 -30.897 27.059 1.00 20.00 C ATOM 781 NE2 HIS A 42 -23.150 -29.946 26.195 1.00 20.00 N ATOM 0 H HIS A 42 -22.873 -31.401 22.381 1.00 20.00 H new ATOM 0 HA HIS A 42 -21.433 -33.892 22.694 1.00 20.00 H new ATOM 0 HB2 HIS A 42 -20.557 -32.965 24.669 1.00 20.00 H new ATOM 0 HB3 HIS A 42 -20.620 -31.654 23.507 1.00 20.00 H new ATOM 0 HD2 HIS A 42 -22.718 -29.706 24.059 1.00 20.00 H new ATOM 0 HE1 HIS A 42 -23.116 -30.910 28.104 1.00 20.00 H new ATOM 0 HE2 HIS A 42 -23.680 -29.100 26.405 1.00 20.00 H new ATOM 790 N ASP A 43 -24.420 -33.719 23.639 1.00 20.00 N ATOM 791 CA ASP A 43 -25.530 -34.425 24.276 1.00 20.00 C ATOM 792 C ASP A 43 -25.426 -35.922 24.042 1.00 20.00 C ATOM 793 O ASP A 43 -25.958 -36.713 24.819 1.00 20.00 O ATOM 794 CB ASP A 43 -26.884 -33.923 23.765 1.00 20.00 C ATOM 795 CG ASP A 43 -27.229 -32.534 24.261 1.00 20.00 C ATOM 796 OD1 ASP A 43 -27.546 -32.386 25.461 1.00 20.00 O ATOM 797 OD2 ASP A 43 -27.198 -31.585 23.453 1.00 20.00 O ATOM 0 H ASP A 43 -24.703 -33.047 22.926 1.00 20.00 H new ATOM 0 HA ASP A 43 -25.465 -34.222 25.345 1.00 20.00 H new ATOM 0 HB2 ASP A 43 -26.876 -33.921 22.675 1.00 20.00 H new ATOM 0 HB3 ASP A 43 -27.664 -34.618 24.077 1.00 20.00 H new ATOM 802 N GLU A 44 -24.734 -36.302 22.973 1.00 20.00 N ATOM 803 CA GLU A 44 -24.522 -37.706 22.646 1.00 20.00 C ATOM 804 C GLU A 44 -23.828 -38.432 23.796 1.00 20.00 C ATOM 805 O GLU A 44 -24.220 -39.539 24.175 1.00 20.00 O ATOM 806 CB GLU A 44 -23.690 -37.827 21.365 1.00 20.00 C ATOM 807 CG GLU A 44 -23.345 -39.258 20.995 1.00 20.00 C ATOM 808 CD GLU A 44 -22.540 -39.356 19.719 1.00 20.00 C ATOM 809 OE1 GLU A 44 -21.309 -39.167 19.770 1.00 20.00 O ATOM 810 OE2 GLU A 44 -23.135 -39.631 18.656 1.00 20.00 O ATOM 0 H GLU A 44 -24.308 -35.651 22.314 1.00 20.00 H new ATOM 0 HA GLU A 44 -25.494 -38.173 22.485 1.00 20.00 H new ATOM 0 HB2 GLU A 44 -24.239 -37.370 20.541 1.00 20.00 H new ATOM 0 HB3 GLU A 44 -22.767 -37.260 21.487 1.00 20.00 H new ATOM 0 HG2 GLU A 44 -22.782 -39.713 21.810 1.00 20.00 H new ATOM 0 HG3 GLU A 44 -24.265 -39.831 20.883 1.00 20.00 H new ATOM 817 N VAL A 45 -22.810 -37.794 24.360 1.00 20.00 N ATOM 818 CA VAL A 45 -22.053 -38.376 25.457 1.00 20.00 C ATOM 819 C VAL A 45 -22.909 -38.457 26.712 1.00 20.00 C ATOM 820 O VAL A 45 -22.942 -39.482 27.393 1.00 20.00 O ATOM 821 CB VAL A 45 -20.785 -37.558 25.767 1.00 20.00 C ATOM 822 CG1 VAL A 45 -19.991 -38.200 26.895 1.00 20.00 C ATOM 823 CG2 VAL A 45 -19.930 -37.409 24.521 1.00 20.00 C ATOM 0 H VAL A 45 -22.490 -36.869 24.073 1.00 20.00 H new ATOM 0 HA VAL A 45 -21.756 -39.378 25.147 1.00 20.00 H new ATOM 0 HB VAL A 45 -21.090 -36.564 26.093 1.00 20.00 H new ATOM 0 HG11 VAL A 45 -19.100 -37.606 27.097 1.00 20.00 H new ATOM 0 HG12 VAL A 45 -20.607 -38.247 27.793 1.00 20.00 H new ATOM 0 HG13 VAL A 45 -19.696 -39.208 26.604 1.00 20.00 H new ATOM 0 HG21 VAL A 45 -19.039 -36.828 24.759 1.00 20.00 H new ATOM 0 HG22 VAL A 45 -19.636 -38.395 24.162 1.00 20.00 H new ATOM 0 HG23 VAL A 45 -20.501 -36.896 23.747 1.00 20.00 H new ATOM 833 N GLU A 46 -23.618 -37.375 26.995 1.00 20.00 N ATOM 834 CA GLU A 46 -24.457 -37.298 28.181 1.00 20.00 C ATOM 835 C GLU A 46 -25.574 -38.334 28.110 1.00 20.00 C ATOM 836 O GLU A 46 -25.863 -39.009 29.092 1.00 20.00 O ATOM 837 CB GLU A 46 -25.028 -35.884 28.335 1.00 20.00 C ATOM 838 CG GLU A 46 -25.796 -35.659 29.626 1.00 20.00 C ATOM 839 CD GLU A 46 -26.068 -34.190 29.878 1.00 20.00 C ATOM 840 OE1 GLU A 46 -26.985 -33.627 29.243 1.00 20.00 O ATOM 841 OE2 GLU A 46 -25.358 -33.589 30.711 1.00 20.00 O ATOM 0 H GLU A 46 -23.629 -36.535 26.417 1.00 20.00 H new ATOM 0 HA GLU A 46 -23.848 -37.517 29.058 1.00 20.00 H new ATOM 0 HB2 GLU A 46 -24.209 -35.166 28.283 1.00 20.00 H new ATOM 0 HB3 GLU A 46 -25.688 -35.677 27.492 1.00 20.00 H new ATOM 0 HG2 GLU A 46 -26.741 -36.200 29.584 1.00 20.00 H new ATOM 0 HG3 GLU A 46 -25.229 -36.071 30.461 1.00 20.00 H new ATOM 848 N ARG A 47 -26.165 -38.480 26.931 1.00 20.00 N ATOM 849 CA ARG A 47 -27.226 -39.461 26.713 1.00 20.00 C ATOM 850 C ARG A 47 -26.687 -40.877 26.889 1.00 20.00 C ATOM 851 O ARG A 47 -27.373 -41.762 27.401 1.00 20.00 O ATOM 852 CB ARG A 47 -27.809 -39.295 25.305 1.00 20.00 C ATOM 853 CG ARG A 47 -28.941 -40.258 24.984 1.00 20.00 C ATOM 854 CD ARG A 47 -29.431 -40.077 23.557 1.00 20.00 C ATOM 855 NE ARG A 47 -28.376 -40.345 22.579 1.00 20.00 N ATOM 856 CZ ARG A 47 -28.437 -39.993 21.295 1.00 20.00 C ATOM 857 NH1 ARG A 47 -29.491 -39.331 20.831 1.00 20.00 N ATOM 858 NH2 ARG A 47 -27.440 -40.299 20.475 1.00 20.00 N ATOM 0 H ARG A 47 -25.928 -37.930 26.106 1.00 20.00 H new ATOM 0 HA ARG A 47 -28.013 -39.294 27.449 1.00 20.00 H new ATOM 0 HB2 ARG A 47 -28.172 -38.274 25.192 1.00 20.00 H new ATOM 0 HB3 ARG A 47 -27.012 -39.432 24.575 1.00 20.00 H new ATOM 0 HG2 ARG A 47 -28.600 -41.284 25.127 1.00 20.00 H new ATOM 0 HG3 ARG A 47 -29.766 -40.097 25.678 1.00 20.00 H new ATOM 0 HD2 ARG A 47 -30.273 -40.745 23.375 1.00 20.00 H new ATOM 0 HD3 ARG A 47 -29.798 -39.059 23.426 1.00 20.00 H new ATOM 0 HE ARG A 47 -27.540 -40.833 22.901 1.00 20.00 H new ATOM 0 HH11 ARG A 47 -30.258 -39.090 21.458 1.00 20.00 H new ATOM 0 HH12 ARG A 47 -29.533 -39.064 19.848 1.00 20.00 H new ATOM 0 HH21 ARG A 47 -26.627 -40.804 20.827 1.00 20.00 H new ATOM 0 HH22 ARG A 47 -27.487 -40.030 19.492 1.00 20.00 H new ATOM 872 N ARG A 48 -25.446 -41.070 26.471 1.00 20.00 N ATOM 873 CA ARG A 48 -24.786 -42.363 26.565 1.00 20.00 C ATOM 874 C ARG A 48 -24.429 -42.684 28.015 1.00 20.00 C ATOM 875 O ARG A 48 -24.558 -43.822 28.462 1.00 20.00 O ATOM 876 CB ARG A 48 -23.526 -42.354 25.697 1.00 20.00 C ATOM 877 CG ARG A 48 -22.719 -43.638 25.755 1.00 20.00 C ATOM 878 CD ARG A 48 -21.457 -43.530 24.916 1.00 20.00 C ATOM 879 NE ARG A 48 -20.655 -44.749 24.973 1.00 20.00 N ATOM 880 CZ ARG A 48 -19.542 -44.940 24.270 1.00 20.00 C ATOM 881 NH1 ARG A 48 -19.090 -43.988 23.460 1.00 20.00 N ATOM 882 NH2 ARG A 48 -18.873 -46.079 24.385 1.00 20.00 N ATOM 0 H ARG A 48 -24.869 -40.337 26.058 1.00 20.00 H new ATOM 0 HA ARG A 48 -25.467 -43.135 26.207 1.00 20.00 H new ATOM 0 HB2 ARG A 48 -23.813 -42.165 24.663 1.00 20.00 H new ATOM 0 HB3 ARG A 48 -22.891 -41.525 26.008 1.00 20.00 H new ATOM 0 HG2 ARG A 48 -22.454 -43.858 26.789 1.00 20.00 H new ATOM 0 HG3 ARG A 48 -23.327 -44.469 25.398 1.00 20.00 H new ATOM 0 HD2 ARG A 48 -21.727 -43.322 23.881 1.00 20.00 H new ATOM 0 HD3 ARG A 48 -20.861 -42.687 25.265 1.00 20.00 H new ATOM 0 HE ARG A 48 -20.967 -45.499 25.589 1.00 20.00 H new ATOM 0 HH11 ARG A 48 -19.597 -43.107 23.376 1.00 20.00 H new ATOM 0 HH12 ARG A 48 -18.236 -44.138 22.923 1.00 20.00 H new ATOM 0 HH21 ARG A 48 -19.212 -46.808 25.012 1.00 20.00 H new ATOM 0 HH22 ARG A 48 -18.020 -46.226 23.846 1.00 20.00 H new ATOM 896 N MET A 49 -23.990 -41.669 28.744 1.00 20.00 N ATOM 897 CA MET A 49 -23.562 -41.843 30.125 1.00 20.00 C ATOM 898 C MET A 49 -24.765 -41.978 31.053 1.00 20.00 C ATOM 899 O MET A 49 -24.776 -42.813 31.962 1.00 20.00 O ATOM 900 CB MET A 49 -22.699 -40.655 30.554 1.00 20.00 C ATOM 901 CG MET A 49 -21.928 -40.892 31.841 1.00 20.00 C ATOM 902 SD MET A 49 -20.737 -42.242 31.701 1.00 20.00 S ATOM 903 CE MET A 49 -19.674 -41.628 30.393 1.00 20.00 C ATOM 0 H MET A 49 -23.920 -40.711 28.400 1.00 20.00 H new ATOM 0 HA MET A 49 -22.974 -42.758 30.192 1.00 20.00 H new ATOM 0 HB2 MET A 49 -21.994 -40.423 29.756 1.00 20.00 H new ATOM 0 HB3 MET A 49 -23.337 -39.780 30.679 1.00 20.00 H new ATOM 0 HG2 MET A 49 -21.404 -39.978 32.119 1.00 20.00 H new ATOM 0 HG3 MET A 49 -22.630 -41.114 32.645 1.00 20.00 H new ATOM 0 HE1 MET A 49 -18.723 -42.160 30.417 1.00 20.00 H new ATOM 0 HE2 MET A 49 -20.155 -41.788 29.428 1.00 20.00 H new ATOM 0 HE3 MET A 49 -19.497 -40.562 30.538 1.00 20.00 H new ATOM 913 N ALA A 50 -25.789 -41.167 30.800 1.00 20.00 N ATOM 914 CA ALA A 50 -26.986 -41.139 31.632 1.00 20.00 C ATOM 915 C ALA A 50 -27.815 -42.405 31.469 1.00 20.00 C ATOM 916 O ALA A 50 -28.709 -42.672 32.266 1.00 20.00 O ATOM 917 CB ALA A 50 -27.833 -39.926 31.292 1.00 20.00 C ATOM 0 H ALA A 50 -25.812 -40.514 30.016 1.00 20.00 H new ATOM 0 HA ALA A 50 -26.662 -41.079 32.671 1.00 20.00 H new ATOM 0 HB1 ALA A 50 -28.724 -39.917 31.920 1.00 20.00 H new ATOM 0 HB2 ALA A 50 -27.256 -39.018 31.468 1.00 20.00 H new ATOM 0 HB3 ALA A 50 -28.129 -39.971 30.244 1.00 20.00 H new ATOM 923 N GLU A 51 -27.502 -43.179 30.440 1.00 20.00 N ATOM 924 CA GLU A 51 -28.229 -44.407 30.133 1.00 20.00 C ATOM 925 C GLU A 51 -28.275 -45.348 31.339 1.00 20.00 C ATOM 926 O GLU A 51 -29.272 -46.027 31.572 1.00 20.00 O ATOM 927 CB GLU A 51 -27.571 -45.103 28.938 1.00 20.00 C ATOM 928 CG GLU A 51 -28.246 -46.400 28.523 1.00 20.00 C ATOM 929 CD GLU A 51 -29.698 -46.211 28.136 1.00 20.00 C ATOM 930 OE1 GLU A 51 -29.965 -45.508 27.134 1.00 20.00 O ATOM 931 OE2 GLU A 51 -30.576 -46.764 28.830 1.00 20.00 O ATOM 0 H GLU A 51 -26.739 -42.976 29.794 1.00 20.00 H new ATOM 0 HA GLU A 51 -29.257 -44.146 29.883 1.00 20.00 H new ATOM 0 HB2 GLU A 51 -27.570 -44.419 28.089 1.00 20.00 H new ATOM 0 HB3 GLU A 51 -26.529 -45.311 29.181 1.00 20.00 H new ATOM 0 HG2 GLU A 51 -27.704 -46.833 27.682 1.00 20.00 H new ATOM 0 HG3 GLU A 51 -28.184 -47.115 29.344 1.00 20.00 H new ATOM 938 N ARG A 52 -27.204 -45.364 32.116 1.00 20.00 N ATOM 939 CA ARG A 52 -27.117 -46.257 33.263 1.00 20.00 C ATOM 940 C ARG A 52 -27.778 -45.643 34.494 1.00 20.00 C ATOM 941 O ARG A 52 -28.256 -46.355 35.374 1.00 20.00 O ATOM 942 CB ARG A 52 -25.657 -46.593 33.569 1.00 20.00 C ATOM 943 CG ARG A 52 -24.930 -47.285 32.424 1.00 20.00 C ATOM 944 CD ARG A 52 -25.626 -48.573 32.014 1.00 20.00 C ATOM 945 NE ARG A 52 -24.951 -49.228 30.896 1.00 20.00 N ATOM 946 CZ ARG A 52 -25.532 -50.123 30.095 1.00 20.00 C ATOM 947 NH1 ARG A 52 -26.795 -50.479 30.291 1.00 20.00 N ATOM 948 NH2 ARG A 52 -24.850 -50.664 29.098 1.00 20.00 N ATOM 0 H ARG A 52 -26.385 -44.772 31.975 1.00 20.00 H new ATOM 0 HA ARG A 52 -27.649 -47.174 33.011 1.00 20.00 H new ATOM 0 HB2 ARG A 52 -25.128 -45.674 33.820 1.00 20.00 H new ATOM 0 HB3 ARG A 52 -25.619 -47.233 34.450 1.00 20.00 H new ATOM 0 HG2 ARG A 52 -24.875 -46.612 31.568 1.00 20.00 H new ATOM 0 HG3 ARG A 52 -23.905 -47.504 32.723 1.00 20.00 H new ATOM 0 HD2 ARG A 52 -25.661 -49.253 32.865 1.00 20.00 H new ATOM 0 HD3 ARG A 52 -26.658 -48.355 31.737 1.00 20.00 H new ATOM 0 HE ARG A 52 -23.976 -48.986 30.717 1.00 20.00 H new ATOM 0 HH11 ARG A 52 -27.328 -50.068 31.058 1.00 20.00 H new ATOM 0 HH12 ARG A 52 -27.233 -51.164 29.675 1.00 20.00 H new ATOM 0 HH21 ARG A 52 -23.878 -50.397 28.941 1.00 20.00 H new ATOM 0 HH22 ARG A 52 -25.296 -51.348 28.487 1.00 20.00 H new ATOM 962 N PHE A 53 -27.812 -44.319 34.548 1.00 20.00 N ATOM 963 CA PHE A 53 -28.356 -43.614 35.704 1.00 20.00 C ATOM 964 C PHE A 53 -29.865 -43.455 35.593 1.00 20.00 C ATOM 965 O PHE A 53 -30.590 -43.660 36.566 1.00 20.00 O ATOM 966 CB PHE A 53 -27.705 -42.238 35.852 1.00 20.00 C ATOM 967 CG PHE A 53 -26.240 -42.291 36.181 1.00 20.00 C ATOM 968 CD1 PHE A 53 -25.813 -42.551 37.474 1.00 20.00 C ATOM 969 CD2 PHE A 53 -25.288 -42.075 35.197 1.00 20.00 C ATOM 970 CE1 PHE A 53 -24.467 -42.598 37.776 1.00 20.00 C ATOM 971 CE2 PHE A 53 -23.942 -42.121 35.495 1.00 20.00 C ATOM 972 CZ PHE A 53 -23.531 -42.382 36.786 1.00 20.00 C ATOM 0 H PHE A 53 -27.470 -43.710 33.805 1.00 20.00 H new ATOM 0 HA PHE A 53 -28.134 -44.213 36.587 1.00 20.00 H new ATOM 0 HB2 PHE A 53 -27.839 -41.681 34.924 1.00 20.00 H new ATOM 0 HB3 PHE A 53 -28.223 -41.684 36.634 1.00 20.00 H new ATOM 0 HD1 PHE A 53 -26.541 -42.719 38.254 1.00 20.00 H new ATOM 0 HD2 PHE A 53 -25.604 -41.868 34.185 1.00 20.00 H new ATOM 0 HE1 PHE A 53 -24.147 -42.804 38.787 1.00 20.00 H new ATOM 0 HE2 PHE A 53 -23.210 -41.953 34.718 1.00 20.00 H new ATOM 0 HZ PHE A 53 -22.478 -42.417 37.021 1.00 20.00 H new ATOM 982 N ALA A 54 -30.327 -43.105 34.400 1.00 20.00 N ATOM 983 CA ALA A 54 -31.736 -42.815 34.169 1.00 20.00 C ATOM 984 C ALA A 54 -32.618 -44.007 34.511 1.00 20.00 C ATOM 985 O ALA A 54 -33.602 -43.870 35.237 1.00 20.00 O ATOM 986 CB ALA A 54 -31.953 -42.392 32.726 1.00 20.00 C ATOM 0 H ALA A 54 -29.740 -43.014 33.570 1.00 20.00 H new ATOM 0 HA ALA A 54 -32.021 -41.995 34.829 1.00 20.00 H new ATOM 0 HB1 ALA A 54 -33.009 -42.178 32.565 1.00 20.00 H new ATOM 0 HB2 ALA A 54 -31.365 -41.498 32.517 1.00 20.00 H new ATOM 0 HB3 ALA A 54 -31.640 -43.196 32.060 1.00 20.00 H new ATOM 992 N LYS A 55 -32.252 -45.175 34.005 1.00 20.00 N ATOM 993 CA LYS A 55 -33.038 -46.378 34.231 1.00 20.00 C ATOM 994 C LYS A 55 -32.971 -46.817 35.691 1.00 20.00 C ATOM 995 O LYS A 55 -33.947 -47.327 36.235 1.00 20.00 O ATOM 996 CB LYS A 55 -32.564 -47.503 33.310 1.00 20.00 C ATOM 997 CG LYS A 55 -31.115 -47.904 33.527 1.00 20.00 C ATOM 998 CD LYS A 55 -30.646 -48.898 32.482 1.00 20.00 C ATOM 999 CE LYS A 55 -31.534 -50.130 32.430 1.00 20.00 C ATOM 1000 NZ LYS A 55 -31.047 -51.124 31.441 1.00 20.00 N ATOM 0 H LYS A 55 -31.417 -45.315 33.436 1.00 20.00 H new ATOM 0 HA LYS A 55 -34.078 -46.150 33.999 1.00 20.00 H new ATOM 0 HB2 LYS A 55 -33.199 -48.376 33.461 1.00 20.00 H new ATOM 0 HB3 LYS A 55 -32.693 -47.190 32.274 1.00 20.00 H new ATOM 0 HG2 LYS A 55 -30.483 -47.017 33.495 1.00 20.00 H new ATOM 0 HG3 LYS A 55 -31.003 -48.339 34.520 1.00 20.00 H new ATOM 0 HD2 LYS A 55 -30.635 -48.417 31.504 1.00 20.00 H new ATOM 0 HD3 LYS A 55 -29.621 -49.198 32.701 1.00 20.00 H new ATOM 0 HE2 LYS A 55 -31.574 -50.590 33.417 1.00 20.00 H new ATOM 0 HE3 LYS A 55 -32.551 -49.833 32.175 1.00 20.00 H new ATOM 0 HZ1 LYS A 55 -31.681 -51.949 31.437 1.00 20.00 H new ATOM 0 HZ2 LYS A 55 -31.033 -50.694 30.494 1.00 20.00 H new ATOM 0 HZ3 LYS A 55 -30.086 -51.427 31.698 1.00 20.00 H new ATOM 1014 N MET A 56 -31.826 -46.593 36.326 1.00 20.00 N ATOM 1015 CA MET A 56 -31.643 -46.972 37.722 1.00 20.00 C ATOM 1016 C MET A 56 -32.478 -46.074 38.630 1.00 20.00 C ATOM 1017 O MET A 56 -33.013 -46.519 39.645 1.00 20.00 O ATOM 1018 CB MET A 56 -30.163 -46.888 38.115 1.00 20.00 C ATOM 1019 CG MET A 56 -29.892 -47.264 39.565 1.00 20.00 C ATOM 1020 SD MET A 56 -28.159 -47.074 40.028 1.00 20.00 S ATOM 1021 CE MET A 56 -27.935 -45.307 39.825 1.00 20.00 C ATOM 0 H MET A 56 -31.012 -46.152 35.897 1.00 20.00 H new ATOM 0 HA MET A 56 -31.977 -48.003 37.843 1.00 20.00 H new ATOM 0 HB2 MET A 56 -29.586 -47.545 37.465 1.00 20.00 H new ATOM 0 HB3 MET A 56 -29.807 -45.873 37.940 1.00 20.00 H new ATOM 0 HG2 MET A 56 -30.507 -46.644 40.217 1.00 20.00 H new ATOM 0 HG3 MET A 56 -30.195 -48.298 39.730 1.00 20.00 H new ATOM 0 HE1 MET A 56 -27.063 -44.983 40.393 1.00 20.00 H new ATOM 0 HE2 MET A 56 -27.787 -45.078 38.770 1.00 20.00 H new ATOM 0 HE3 MET A 56 -28.819 -44.784 40.189 1.00 20.00 H new ATOM 1031 N ARG A 57 -32.598 -44.810 38.246 1.00 20.00 N ATOM 1032 CA ARG A 57 -33.377 -43.850 39.013 1.00 20.00 C ATOM 1033 C ARG A 57 -34.849 -43.921 38.633 1.00 20.00 C ATOM 1034 O ARG A 57 -35.688 -43.249 39.232 1.00 20.00 O ATOM 1035 CB ARG A 57 -32.849 -42.431 38.799 1.00 20.00 C ATOM 1036 CG ARG A 57 -31.464 -42.203 39.378 1.00 20.00 C ATOM 1037 CD ARG A 57 -30.955 -40.805 39.069 1.00 20.00 C ATOM 1038 NE ARG A 57 -29.653 -40.544 39.680 1.00 20.00 N ATOM 1039 CZ ARG A 57 -28.742 -39.716 39.166 1.00 20.00 C ATOM 1040 NH1 ARG A 57 -28.978 -39.094 38.015 1.00 20.00 N ATOM 1041 NH2 ARG A 57 -27.594 -39.517 39.801 1.00 20.00 N ATOM 0 H ARG A 57 -32.165 -44.426 37.406 1.00 20.00 H new ATOM 0 HA ARG A 57 -33.277 -44.105 40.068 1.00 20.00 H new ATOM 0 HB2 ARG A 57 -32.826 -42.218 37.730 1.00 20.00 H new ATOM 0 HB3 ARG A 57 -33.543 -41.722 39.250 1.00 20.00 H new ATOM 0 HG2 ARG A 57 -31.491 -42.351 40.458 1.00 20.00 H new ATOM 0 HG3 ARG A 57 -30.773 -42.941 38.972 1.00 20.00 H new ATOM 0 HD2 ARG A 57 -30.880 -40.678 37.989 1.00 20.00 H new ATOM 0 HD3 ARG A 57 -31.676 -40.070 39.427 1.00 20.00 H new ATOM 0 HE ARG A 57 -29.428 -41.024 40.551 1.00 20.00 H new ATOM 0 HH11 ARG A 57 -29.858 -39.249 37.522 1.00 20.00 H new ATOM 0 HH12 ARG A 57 -28.280 -38.461 37.625 1.00 20.00 H new ATOM 0 HH21 ARG A 57 -27.408 -39.997 40.682 1.00 20.00 H new ATOM 0 HH22 ARG A 57 -26.897 -38.884 39.408 1.00 20.00 H new ATOM 1055 N LYS A 58 -35.160 -44.738 37.637 1.00 20.00 N ATOM 1056 CA LYS A 58 -36.534 -44.905 37.194 1.00 20.00 C ATOM 1057 C LYS A 58 -37.299 -45.758 38.199 1.00 20.00 C ATOM 1058 O LYS A 58 -38.429 -45.434 38.570 1.00 20.00 O ATOM 1059 CB LYS A 58 -36.578 -45.542 35.801 1.00 20.00 C ATOM 1060 CG LYS A 58 -37.966 -45.565 35.175 1.00 20.00 C ATOM 1061 CD LYS A 58 -38.545 -44.163 35.020 1.00 20.00 C ATOM 1062 CE LYS A 58 -37.661 -43.272 34.158 1.00 20.00 C ATOM 1063 NZ LYS A 58 -38.221 -41.901 34.024 1.00 20.00 N ATOM 0 H LYS A 58 -34.479 -45.295 37.121 1.00 20.00 H new ATOM 0 HA LYS A 58 -37.007 -43.925 37.131 1.00 20.00 H new ATOM 0 HB2 LYS A 58 -35.902 -44.997 35.142 1.00 20.00 H new ATOM 0 HB3 LYS A 58 -36.204 -46.563 35.868 1.00 20.00 H new ATOM 0 HG2 LYS A 58 -37.916 -46.047 34.198 1.00 20.00 H new ATOM 0 HG3 LYS A 58 -38.633 -46.166 35.793 1.00 20.00 H new ATOM 0 HD2 LYS A 58 -39.538 -44.228 34.575 1.00 20.00 H new ATOM 0 HD3 LYS A 58 -38.666 -43.710 36.004 1.00 20.00 H new ATOM 0 HE2 LYS A 58 -36.664 -43.216 34.596 1.00 20.00 H new ATOM 0 HE3 LYS A 58 -37.550 -43.717 33.169 1.00 20.00 H new ATOM 0 HZ1 LYS A 58 -37.591 -41.325 33.430 1.00 20.00 H new ATOM 0 HZ2 LYS A 58 -39.161 -41.952 33.583 1.00 20.00 H new ATOM 0 HZ3 LYS A 58 -38.303 -41.466 34.965 1.00 20.00 H new ATOM 1077 N GLU A 59 -36.669 -46.837 38.649 1.00 20.00 N ATOM 1078 CA GLU A 59 -37.243 -47.674 39.689 1.00 20.00 C ATOM 1079 C GLU A 59 -37.037 -47.026 41.051 1.00 20.00 C ATOM 1080 O GLU A 59 -35.904 -46.825 41.489 1.00 20.00 O ATOM 1081 CB GLU A 59 -36.616 -49.073 39.696 1.00 20.00 C ATOM 1082 CG GLU A 59 -37.080 -49.984 38.569 1.00 20.00 C ATOM 1083 CD GLU A 59 -36.497 -49.624 37.218 1.00 20.00 C ATOM 1084 OE1 GLU A 59 -35.289 -49.864 37.006 1.00 20.00 O ATOM 1085 OE2 GLU A 59 -37.251 -49.143 36.349 1.00 20.00 O ATOM 0 H GLU A 59 -35.760 -47.151 38.308 1.00 20.00 H new ATOM 0 HA GLU A 59 -38.308 -47.775 39.481 1.00 20.00 H new ATOM 0 HB2 GLU A 59 -35.532 -48.971 39.639 1.00 20.00 H new ATOM 0 HB3 GLU A 59 -36.841 -49.552 40.649 1.00 20.00 H new ATOM 0 HG2 GLU A 59 -36.809 -51.012 38.810 1.00 20.00 H new ATOM 0 HG3 GLU A 59 -38.168 -49.947 38.507 1.00 20.00 H new ATOM 1092 N ARG A 60 -38.128 -46.677 41.711 1.00 20.00 N ATOM 1093 CA ARG A 60 -38.058 -46.102 43.046 1.00 20.00 C ATOM 1094 C ARG A 60 -38.461 -47.144 44.080 1.00 20.00 C ATOM 1095 O ARG A 60 -39.312 -46.896 44.935 1.00 20.00 O ATOM 1096 CB ARG A 60 -38.953 -44.863 43.149 1.00 20.00 C ATOM 1097 CG ARG A 60 -38.573 -43.740 42.188 1.00 20.00 C ATOM 1098 CD ARG A 60 -37.201 -43.145 42.502 1.00 20.00 C ATOM 1099 NE ARG A 60 -36.108 -44.080 42.229 1.00 20.00 N ATOM 1100 CZ ARG A 60 -34.827 -43.838 42.498 1.00 20.00 C ATOM 1101 NH1 ARG A 60 -34.453 -42.663 42.989 1.00 20.00 N ATOM 1102 NH2 ARG A 60 -33.913 -44.770 42.249 1.00 20.00 N ATOM 0 H ARG A 60 -39.074 -46.781 41.345 1.00 20.00 H new ATOM 0 HA ARG A 60 -37.031 -45.792 43.242 1.00 20.00 H new ATOM 0 HB2 ARG A 60 -39.985 -45.156 42.958 1.00 20.00 H new ATOM 0 HB3 ARG A 60 -38.913 -44.483 44.170 1.00 20.00 H new ATOM 0 HG2 ARG A 60 -38.575 -44.122 41.167 1.00 20.00 H new ATOM 0 HG3 ARG A 60 -39.327 -42.954 42.236 1.00 20.00 H new ATOM 0 HD2 ARG A 60 -37.057 -42.241 41.911 1.00 20.00 H new ATOM 0 HD3 ARG A 60 -37.168 -42.849 43.551 1.00 20.00 H new ATOM 0 HE ARG A 60 -36.344 -44.977 41.804 1.00 20.00 H new ATOM 0 HH11 ARG A 60 -35.149 -41.938 43.163 1.00 20.00 H new ATOM 0 HH12 ARG A 60 -33.469 -42.485 43.193 1.00 20.00 H new ATOM 0 HH21 ARG A 60 -34.194 -45.667 41.853 1.00 20.00 H new ATOM 0 HH22 ARG A 60 -32.930 -44.588 42.454 1.00 20.00 H new ATOM 1116 N SER A 61 -37.838 -48.311 43.988 1.00 20.00 N ATOM 1117 CA SER A 61 -38.165 -49.426 44.857 1.00 20.00 C ATOM 1118 C SER A 61 -37.804 -49.104 46.303 1.00 20.00 C ATOM 1119 O SER A 61 -36.693 -48.635 46.584 1.00 20.00 O ATOM 1120 CB SER A 61 -37.429 -50.688 44.395 1.00 20.00 C ATOM 1121 OG SER A 61 -37.820 -51.822 45.154 1.00 20.00 O ATOM 0 H SER A 61 -37.098 -48.508 43.314 1.00 20.00 H new ATOM 0 HA SER A 61 -39.239 -49.604 44.802 1.00 20.00 H new ATOM 0 HB2 SER A 61 -37.635 -50.866 43.340 1.00 20.00 H new ATOM 0 HB3 SER A 61 -36.353 -50.539 44.489 1.00 20.00 H new ATOM 0 HG SER A 61 -37.335 -52.612 44.835 1.00 20.00 H new ATOM 1127 N LYS A 62 -38.760 -49.333 47.207 1.00 20.00 N ATOM 1128 CA LYS A 62 -38.548 -49.147 48.639 1.00 20.00 C ATOM 1129 C LYS A 62 -38.163 -47.697 48.939 1.00 20.00 C ATOM 1130 O LYS A 62 -37.264 -47.422 49.739 1.00 20.00 O ATOM 1131 CB LYS A 62 -37.470 -50.119 49.138 1.00 20.00 C ATOM 1132 CG LYS A 62 -37.466 -50.324 50.644 1.00 20.00 C ATOM 1133 CD LYS A 62 -36.431 -51.354 51.057 1.00 20.00 C ATOM 1134 CE LYS A 62 -36.525 -51.681 52.539 1.00 20.00 C ATOM 1135 NZ LYS A 62 -37.844 -52.268 52.894 1.00 20.00 N ATOM 0 H LYS A 62 -39.698 -49.651 46.965 1.00 20.00 H new ATOM 0 HA LYS A 62 -39.477 -49.362 49.167 1.00 20.00 H new ATOM 0 HB2 LYS A 62 -37.613 -51.084 48.651 1.00 20.00 H new ATOM 0 HB3 LYS A 62 -36.492 -49.749 48.830 1.00 20.00 H new ATOM 0 HG2 LYS A 62 -37.258 -49.377 51.142 1.00 20.00 H new ATOM 0 HG3 LYS A 62 -38.454 -50.646 50.972 1.00 20.00 H new ATOM 0 HD2 LYS A 62 -36.570 -52.264 50.474 1.00 20.00 H new ATOM 0 HD3 LYS A 62 -35.433 -50.979 50.829 1.00 20.00 H new ATOM 0 HE2 LYS A 62 -35.733 -52.379 52.808 1.00 20.00 H new ATOM 0 HE3 LYS A 62 -36.362 -50.774 53.122 1.00 20.00 H new ATOM 0 HZ1 LYS A 62 -37.778 -52.736 53.820 1.00 20.00 H new ATOM 0 HZ2 LYS A 62 -38.559 -51.514 52.938 1.00 20.00 H new ATOM 0 HZ3 LYS A 62 -38.119 -52.965 52.173 1.00 20.00 H new ATOM 1149 N GLN A 63 -38.843 -46.771 48.279 1.00 20.00 N ATOM 1150 CA GLN A 63 -38.559 -45.354 48.441 1.00 20.00 C ATOM 1151 C GLN A 63 -39.840 -44.539 48.310 1.00 20.00 C ATOM 1152 O GLN A 63 -40.222 -44.201 47.171 1.00 20.00 O ATOM 1153 CB GLN A 63 -37.535 -44.901 47.399 1.00 20.00 C ATOM 1154 CG GLN A 63 -37.043 -43.478 47.597 1.00 20.00 C ATOM 1155 CD GLN A 63 -36.059 -43.050 46.526 1.00 20.00 C ATOM 1156 OE1 GLN A 63 -35.335 -43.874 45.968 1.00 20.00 O ATOM 1157 NE2 GLN A 63 -36.027 -41.760 46.234 1.00 20.00 N ATOM 1158 OXT GLN A 63 -40.476 -44.258 49.347 1.00 20.00 O ATOM 0 H GLN A 63 -39.598 -46.977 47.624 1.00 20.00 H new ATOM 0 HA GLN A 63 -38.144 -45.192 49.436 1.00 20.00 H new ATOM 0 HB2 GLN A 63 -36.681 -45.577 47.426 1.00 20.00 H new ATOM 0 HB3 GLN A 63 -37.978 -44.987 46.407 1.00 20.00 H new ATOM 0 HG2 GLN A 63 -37.895 -42.799 47.595 1.00 20.00 H new ATOM 0 HG3 GLN A 63 -36.570 -43.393 48.575 1.00 20.00 H new ATOM 0 HE21 GLN A 63 -36.645 -41.111 46.721 1.00 20.00 H new ATOM 0 HE22 GLN A 63 -35.384 -41.414 45.521 1.00 20.00 H new TER 1167 GLN A 63