USER MOD reduce.3.24.130724 H: found=0, std=0, add=1192, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1192 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 123 LYS NZ :NH3+ 166:sc= 0.683 (180deg=0) USER MOD Set 1.2: A 145 THR OG1 : rot 75:sc= 1.32 USER MOD Set 2.1: A 81 SER OG : rot 15:sc= 0.179 USER MOD Set 2.2: A 83 SER OG : rot 180:sc= 0.173 USER MOD Set 3.1: A 66 TYR OH : rot 180:sc= 0.934 USER MOD Set 3.2: A 110 SER OG : rot 139:sc= 1.13 USER MOD Single : A 1 MET CE :methyl -155:sc= -4.89! (180deg=-6.89!) USER MOD Single : A 1 MET N :NH3+ -149:sc= 0.767 (180deg=0.265) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 106:sc= 2.2 USER MOD Single : A 11 CYS SG : rot 80:sc= 0.429 USER MOD Single : A 12 LYS NZ :NH3+ -168:sc= 1.27 (180deg=1.11) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.00726 USER MOD Single : A 14 THR OG1 : rot 78:sc= 1.25 USER MOD Single : A 15 TYR OH : rot 169:sc= -0.252! USER MOD Single : A 19 LYS NZ :NH3+ -134:sc= 0.294 (180deg=0.0811) USER MOD Single : A 20 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00352) USER MOD Single : A 22 LYS NZ :NH3+ -146:sc= 1.16 (180deg=-0.34) USER MOD Single : A 23 LYS NZ :NH3+ -139:sc= 1.08 (180deg=-0.626!) USER MOD Single : A 24 HIS : no HE2:sc= 0.469 K(o=0.47,f=-2.3!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 178:sc= 1.01 (180deg=1) USER MOD Single : A 36 GLN : amide:sc= -0.194 K(o=-0.19,f=-2.8!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 49 TYR OH : rot -17:sc= 1.73 USER MOD Single : A 51 GLN : amide:sc= 0.0723 K(o=0.072,f=-5.8!) USER MOD Single : A 57 GLN : amide:sc= 0.749 K(o=0.75,f=-1.6) USER MOD Single : A 58 LYS NZ :NH3+ -109:sc= 1.21 (180deg=-0.224) USER MOD Single : A 59 CYS SG : rot -20:sc= 0.00066 USER MOD Single : A 64 CYS SG : rot -29:sc= 0.454 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl -168:sc= -2.52! (180deg=-2.9!) USER MOD Single : A 75 HIS : no HD1:sc= -0.228 K(o=-0.23,f=-2.5!) USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 77 CYS SG : rot 180:sc= -0.615 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 173:sc= 1.3 (180deg=1.21) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0.782 K(o=0.78,f=-4.7!) USER MOD Single : A 88 LYS NZ :NH3+ 172:sc= 0.846 (180deg=0.588) USER MOD Single : A 92 MET CE :methyl -132:sc= -0.021 (180deg=-0.301) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 CYS SG : rot 180:sc= 0.273 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0234 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 159:sc= -0.0609 (180deg=-0.379) USER MOD Single : A 103 LYS NZ :NH3+ 174:sc= 0.585 (180deg=0.533) USER MOD Single : A 104 LYS NZ :NH3+ -177:sc= 1.21 (180deg=1.2) USER MOD Single : A 105 MET CE :methyl -175:sc= 0 (180deg=-0.0175) USER MOD Single : A 107 TYR OH : rot 52:sc= 0.0175 USER MOD Single : A 108 SER OG : rot 89:sc= 1.23 USER MOD Single : A 109 SER OG : rot -78:sc= 0.89 USER MOD Single : A 115 LYS NZ :NH3+ -151:sc= 1.12 (180deg=0.437) USER MOD Single : A 116 LYS NZ :NH3+ -173:sc=-0.00185 (180deg=-0.0584) USER MOD Single : A 117 SER OG : rot 80:sc= 0.63 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0.085 USER MOD Single : A 131 SER OG : rot 89:sc= 1.26 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -120:sc= 0.278 (180deg=-0.615) USER MOD Single : A 148 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.698 0.670 -0.411 1.00 13.44 N ATOM 2 CA MET A 1 2.582 0.045 -1.748 1.00 62.43 C ATOM 3 C MET A 1 3.916 -0.597 -2.122 1.00 14.20 C ATOM 4 O MET A 1 4.974 0.004 -1.930 1.00 64.25 O ATOM 5 CB MET A 1 2.168 1.100 -2.780 1.00 60.32 C ATOM 6 CG MET A 1 1.437 0.547 -3.993 1.00 21.21 C ATOM 7 SD MET A 1 2.474 -0.478 -5.048 1.00 21.44 S ATOM 8 CE MET A 1 1.425 -0.605 -6.486 1.00 15.45 C ATOM 0 H1 MET A 1 1.777 0.634 0.070 1.00 13.44 H new ATOM 0 H2 MET A 1 3.403 0.154 0.153 1.00 13.44 H new ATOM 0 H3 MET A 1 2.996 1.661 -0.516 1.00 13.44 H new ATOM 0 HA MET A 1 1.816 -0.730 -1.731 1.00 62.43 H new ATOM 0 HB2 MET A 1 1.529 1.836 -2.292 1.00 60.32 H new ATOM 0 HB3 MET A 1 3.060 1.627 -3.119 1.00 60.32 H new ATOM 0 HG2 MET A 1 0.582 -0.040 -3.656 1.00 21.21 H new ATOM 0 HG3 MET A 1 1.043 1.377 -4.580 1.00 21.21 H new ATOM 0 HE1 MET A 1 1.669 -1.515 -7.035 1.00 15.45 H new ATOM 0 HE2 MET A 1 0.381 -0.639 -6.173 1.00 15.45 H new ATOM 0 HE3 MET A 1 1.583 0.261 -7.129 1.00 15.45 H new ATOM 20 N ALA A 2 3.858 -1.812 -2.658 1.00 55.02 N ATOM 21 CA ALA A 2 5.053 -2.623 -2.894 1.00 52.24 C ATOM 22 C ALA A 2 5.911 -2.109 -4.053 1.00 25.41 C ATOM 23 O ALA A 2 7.037 -2.569 -4.234 1.00 30.12 O ATOM 24 CB ALA A 2 4.654 -4.068 -3.150 1.00 75.34 C ATOM 0 H ALA A 2 2.988 -2.263 -2.941 1.00 55.02 H new ATOM 0 HA ALA A 2 5.664 -2.552 -1.994 1.00 52.24 H new ATOM 0 HB1 ALA A 2 5.548 -4.667 -3.325 1.00 75.34 H new ATOM 0 HB2 ALA A 2 4.121 -4.457 -2.283 1.00 75.34 H new ATOM 0 HB3 ALA A 2 4.007 -4.117 -4.026 1.00 75.34 H new ATOM 30 N SER A 3 5.373 -1.175 -4.837 1.00 63.43 N ATOM 31 CA SER A 3 6.070 -0.620 -6.006 1.00 4.41 C ATOM 32 C SER A 3 6.199 -1.665 -7.117 1.00 35.33 C ATOM 33 O SER A 3 6.959 -1.496 -8.072 1.00 71.20 O ATOM 34 CB SER A 3 7.448 -0.072 -5.615 1.00 52.45 C ATOM 35 OG SER A 3 7.326 0.931 -4.617 1.00 21.21 O ATOM 0 H SER A 3 4.445 -0.780 -4.684 1.00 63.43 H new ATOM 0 HA SER A 3 5.472 0.207 -6.388 1.00 4.41 H new ATOM 0 HB2 SER A 3 8.076 -0.883 -5.247 1.00 52.45 H new ATOM 0 HB3 SER A 3 7.943 0.341 -6.494 1.00 52.45 H new ATOM 0 HG SER A 3 8.216 1.267 -4.380 1.00 21.21 H new ATOM 41 N GLY A 4 5.440 -2.740 -6.985 1.00 44.24 N ATOM 42 CA GLY A 4 5.375 -3.747 -8.018 1.00 64.43 C ATOM 43 C GLY A 4 3.965 -3.873 -8.534 1.00 2.04 C ATOM 44 O GLY A 4 3.156 -4.613 -7.979 1.00 3.51 O ATOM 0 H GLY A 4 4.860 -2.933 -6.168 1.00 44.24 H new ATOM 0 HA2 GLY A 4 6.047 -3.484 -8.835 1.00 64.43 H new ATOM 0 HA3 GLY A 4 5.713 -4.705 -7.624 1.00 64.43 H new ATOM 48 N VAL A 5 3.662 -3.126 -9.581 1.00 61.20 N ATOM 49 CA VAL A 5 2.295 -2.995 -10.053 1.00 40.41 C ATOM 50 C VAL A 5 1.986 -3.997 -11.158 1.00 22.12 C ATOM 51 O VAL A 5 2.820 -4.263 -12.027 1.00 23.35 O ATOM 52 CB VAL A 5 2.034 -1.569 -10.575 1.00 23.21 C ATOM 53 CG1 VAL A 5 0.544 -1.308 -10.723 1.00 31.20 C ATOM 54 CG2 VAL A 5 2.673 -0.538 -9.658 1.00 42.13 C ATOM 0 H VAL A 5 4.347 -2.599 -10.122 1.00 61.20 H new ATOM 0 HA VAL A 5 1.642 -3.199 -9.205 1.00 40.41 H new ATOM 0 HB VAL A 5 2.490 -1.481 -11.561 1.00 23.21 H new ATOM 0 HG11 VAL A 5 0.387 -0.295 -11.093 1.00 31.20 H new ATOM 0 HG12 VAL A 5 0.118 -2.022 -11.428 1.00 31.20 H new ATOM 0 HG13 VAL A 5 0.057 -1.420 -9.754 1.00 31.20 H new ATOM 0 HG21 VAL A 5 2.478 0.463 -10.044 1.00 42.13 H new ATOM 0 HG22 VAL A 5 2.251 -0.630 -8.657 1.00 42.13 H new ATOM 0 HG23 VAL A 5 3.749 -0.707 -9.615 1.00 42.13 H new ATOM 64 N THR A 6 0.787 -4.549 -11.116 1.00 43.42 N ATOM 65 CA THR A 6 0.327 -5.465 -12.141 1.00 12.52 C ATOM 66 C THR A 6 -0.572 -4.736 -13.138 1.00 12.21 C ATOM 67 O THR A 6 -1.418 -3.932 -12.749 1.00 32.42 O ATOM 68 CB THR A 6 -0.449 -6.638 -11.514 1.00 3.44 C ATOM 69 OG1 THR A 6 0.373 -7.315 -10.557 1.00 35.31 O ATOM 70 CG2 THR A 6 -0.906 -7.617 -12.579 1.00 20.02 C ATOM 0 H THR A 6 0.109 -4.376 -10.374 1.00 43.42 H new ATOM 0 HA THR A 6 1.201 -5.857 -12.662 1.00 12.52 H new ATOM 0 HB THR A 6 -1.330 -6.234 -11.014 1.00 3.44 H new ATOM 0 HG1 THR A 6 -0.129 -8.058 -10.162 1.00 35.31 H new ATOM 0 HG21 THR A 6 -1.452 -8.436 -12.110 1.00 20.02 H new ATOM 0 HG22 THR A 6 -1.557 -7.106 -13.288 1.00 20.02 H new ATOM 0 HG23 THR A 6 -0.038 -8.014 -13.105 1.00 20.02 H new ATOM 78 N VAL A 7 -0.370 -4.997 -14.420 1.00 64.23 N ATOM 79 CA VAL A 7 -1.186 -4.386 -15.457 1.00 71.04 C ATOM 80 C VAL A 7 -2.324 -5.321 -15.856 1.00 24.32 C ATOM 81 O VAL A 7 -2.085 -6.456 -16.268 1.00 51.35 O ATOM 82 CB VAL A 7 -0.347 -4.044 -16.711 1.00 74.44 C ATOM 83 CG1 VAL A 7 -1.192 -3.317 -17.748 1.00 74.45 C ATOM 84 CG2 VAL A 7 0.875 -3.218 -16.333 1.00 34.31 C ATOM 0 H VAL A 7 0.352 -5.628 -14.767 1.00 64.23 H new ATOM 0 HA VAL A 7 -1.593 -3.461 -15.048 1.00 71.04 H new ATOM 0 HB VAL A 7 -0.002 -4.979 -17.153 1.00 74.44 H new ATOM 0 HG11 VAL A 7 -0.580 -3.087 -18.620 1.00 74.45 H new ATOM 0 HG12 VAL A 7 -2.026 -3.951 -18.047 1.00 74.45 H new ATOM 0 HG13 VAL A 7 -1.576 -2.391 -17.320 1.00 74.45 H new ATOM 0 HG21 VAL A 7 1.451 -2.989 -17.230 1.00 34.31 H new ATOM 0 HG22 VAL A 7 0.555 -2.290 -15.860 1.00 34.31 H new ATOM 0 HG23 VAL A 7 1.496 -3.784 -15.638 1.00 34.31 H new ATOM 94 N SER A 8 -3.558 -4.855 -15.708 1.00 54.35 N ATOM 95 CA SER A 8 -4.713 -5.624 -16.148 1.00 61.13 C ATOM 96 C SER A 8 -4.907 -5.465 -17.654 1.00 52.24 C ATOM 97 O SER A 8 -4.526 -4.442 -18.229 1.00 41.13 O ATOM 98 CB SER A 8 -5.972 -5.180 -15.400 1.00 35.24 C ATOM 99 OG SER A 8 -5.810 -5.323 -13.998 1.00 44.15 O ATOM 0 H SER A 8 -3.783 -3.953 -15.289 1.00 54.35 H new ATOM 0 HA SER A 8 -4.535 -6.676 -15.925 1.00 61.13 H new ATOM 0 HB2 SER A 8 -6.193 -4.140 -15.639 1.00 35.24 H new ATOM 0 HB3 SER A 8 -6.824 -5.772 -15.733 1.00 35.24 H new ATOM 0 HG SER A 8 -5.694 -4.439 -13.590 1.00 44.15 H new ATOM 105 N ASP A 9 -5.514 -6.469 -18.279 1.00 4.15 N ATOM 106 CA ASP A 9 -5.701 -6.490 -19.733 1.00 60.43 C ATOM 107 C ASP A 9 -6.509 -5.286 -20.203 1.00 14.41 C ATOM 108 O ASP A 9 -6.291 -4.776 -21.302 1.00 11.41 O ATOM 109 CB ASP A 9 -6.401 -7.780 -20.178 1.00 25.14 C ATOM 110 CG ASP A 9 -5.609 -9.030 -19.845 1.00 2.02 C ATOM 111 OD1 ASP A 9 -4.630 -9.332 -20.556 1.00 54.30 O ATOM 112 OD2 ASP A 9 -5.978 -9.732 -18.876 1.00 70.42 O ATOM 0 H ASP A 9 -5.889 -7.287 -17.800 1.00 4.15 H new ATOM 0 HA ASP A 9 -4.711 -6.447 -20.186 1.00 60.43 H new ATOM 0 HB2 ASP A 9 -7.379 -7.839 -19.701 1.00 25.14 H new ATOM 0 HB3 ASP A 9 -6.572 -7.741 -21.254 1.00 25.14 H new ATOM 117 N VAL A 10 -7.429 -4.828 -19.351 1.00 75.04 N ATOM 118 CA VAL A 10 -8.285 -3.684 -19.670 1.00 41.42 C ATOM 119 C VAL A 10 -7.449 -2.425 -19.908 1.00 40.41 C ATOM 120 O VAL A 10 -7.846 -1.529 -20.653 1.00 23.14 O ATOM 121 CB VAL A 10 -9.320 -3.406 -18.550 1.00 34.41 C ATOM 122 CG1 VAL A 10 -10.407 -2.461 -19.045 1.00 71.32 C ATOM 123 CG2 VAL A 10 -9.929 -4.706 -18.042 1.00 3.12 C ATOM 0 H VAL A 10 -7.600 -5.234 -18.431 1.00 75.04 H new ATOM 0 HA VAL A 10 -8.824 -3.941 -20.582 1.00 41.42 H new ATOM 0 HB VAL A 10 -8.801 -2.926 -17.720 1.00 34.41 H new ATOM 0 HG11 VAL A 10 -11.123 -2.279 -18.244 1.00 71.32 H new ATOM 0 HG12 VAL A 10 -9.957 -1.517 -19.351 1.00 71.32 H new ATOM 0 HG13 VAL A 10 -10.920 -2.910 -19.895 1.00 71.32 H new ATOM 0 HG21 VAL A 10 -10.652 -4.486 -17.257 1.00 3.12 H new ATOM 0 HG22 VAL A 10 -10.430 -5.219 -18.863 1.00 3.12 H new ATOM 0 HG23 VAL A 10 -9.142 -5.345 -17.642 1.00 3.12 H new ATOM 133 N CYS A 11 -6.281 -2.369 -19.283 1.00 14.22 N ATOM 134 CA CYS A 11 -5.386 -1.239 -19.455 1.00 24.02 C ATOM 135 C CYS A 11 -4.698 -1.318 -20.811 1.00 52.51 C ATOM 136 O CYS A 11 -4.587 -0.320 -21.520 1.00 60.32 O ATOM 137 CB CYS A 11 -4.344 -1.201 -18.334 1.00 54.13 C ATOM 138 SG CYS A 11 -3.166 0.163 -18.461 1.00 41.14 S ATOM 0 H CYS A 11 -5.934 -3.093 -18.654 1.00 14.22 H new ATOM 0 HA CYS A 11 -5.973 -0.322 -19.410 1.00 24.02 H new ATOM 0 HB2 CYS A 11 -4.860 -1.132 -17.376 1.00 54.13 H new ATOM 0 HB3 CYS A 11 -3.794 -2.142 -18.333 1.00 54.13 H new ATOM 0 HG CYS A 11 -3.717 1.255 -18.019 1.00 41.14 H new ATOM 144 N LYS A 12 -4.268 -2.520 -21.176 1.00 11.42 N ATOM 145 CA LYS A 12 -3.539 -2.728 -22.421 1.00 22.02 C ATOM 146 C LYS A 12 -4.440 -2.455 -23.621 1.00 51.23 C ATOM 147 O LYS A 12 -4.034 -1.791 -24.577 1.00 52.24 O ATOM 148 CB LYS A 12 -2.997 -4.160 -22.488 1.00 43.31 C ATOM 149 CG LYS A 12 -1.986 -4.383 -23.606 1.00 42.42 C ATOM 150 CD LYS A 12 -2.408 -5.507 -24.542 1.00 14.24 C ATOM 151 CE LYS A 12 -3.611 -5.112 -25.385 1.00 21.32 C ATOM 152 NZ LYS A 12 -4.012 -6.179 -26.340 1.00 30.11 N ATOM 0 H LYS A 12 -4.412 -3.367 -20.626 1.00 11.42 H new ATOM 0 HA LYS A 12 -2.701 -2.032 -22.448 1.00 22.02 H new ATOM 0 HB2 LYS A 12 -2.531 -4.407 -21.534 1.00 43.31 H new ATOM 0 HB3 LYS A 12 -3.831 -4.848 -22.623 1.00 43.31 H new ATOM 0 HG2 LYS A 12 -1.867 -3.462 -24.176 1.00 42.42 H new ATOM 0 HG3 LYS A 12 -1.013 -4.618 -23.174 1.00 42.42 H new ATOM 0 HD2 LYS A 12 -1.576 -5.769 -25.195 1.00 14.24 H new ATOM 0 HD3 LYS A 12 -2.648 -6.396 -23.959 1.00 14.24 H new ATOM 0 HE2 LYS A 12 -4.450 -4.882 -24.729 1.00 21.32 H new ATOM 0 HE3 LYS A 12 -3.380 -4.202 -25.938 1.00 21.32 H new ATOM 0 HZ1 LYS A 12 -4.695 -5.794 -27.024 1.00 30.11 H new ATOM 0 HZ2 LYS A 12 -3.172 -6.525 -26.847 1.00 30.11 H new ATOM 0 HZ3 LYS A 12 -4.450 -6.965 -25.818 1.00 30.11 H new ATOM 166 N THR A 13 -5.666 -2.963 -23.559 1.00 60.01 N ATOM 167 CA THR A 13 -6.616 -2.816 -24.652 1.00 10.44 C ATOM 168 C THR A 13 -6.955 -1.349 -24.898 1.00 44.30 C ATOM 169 O THR A 13 -7.085 -0.915 -26.039 1.00 74.24 O ATOM 170 CB THR A 13 -7.905 -3.610 -24.368 1.00 73.01 C ATOM 171 OG1 THR A 13 -8.337 -3.370 -23.022 1.00 24.32 O ATOM 172 CG2 THR A 13 -7.680 -5.103 -24.577 1.00 5.43 C ATOM 0 H THR A 13 -6.025 -3.483 -22.758 1.00 60.01 H new ATOM 0 HA THR A 13 -6.145 -3.216 -25.550 1.00 10.44 H new ATOM 0 HB THR A 13 -8.675 -3.276 -25.064 1.00 73.01 H new ATOM 0 HG1 THR A 13 -9.158 -3.876 -22.847 1.00 24.32 H new ATOM 0 HG21 THR A 13 -8.604 -5.643 -24.370 1.00 5.43 H new ATOM 0 HG22 THR A 13 -7.377 -5.284 -25.608 1.00 5.43 H new ATOM 0 HG23 THR A 13 -6.898 -5.451 -23.902 1.00 5.43 H new ATOM 180 N THR A 14 -7.071 -0.583 -23.826 1.00 35.33 N ATOM 181 CA THR A 14 -7.364 0.834 -23.944 1.00 3.32 C ATOM 182 C THR A 14 -6.238 1.572 -24.676 1.00 44.32 C ATOM 183 O THR A 14 -6.493 2.468 -25.486 1.00 4.14 O ATOM 184 CB THR A 14 -7.603 1.466 -22.561 1.00 35.34 C ATOM 185 OG1 THR A 14 -8.657 0.763 -21.887 1.00 22.22 O ATOM 186 CG2 THR A 14 -7.976 2.935 -22.693 1.00 15.31 C ATOM 0 H THR A 14 -6.967 -0.918 -22.868 1.00 35.33 H new ATOM 0 HA THR A 14 -8.277 0.932 -24.531 1.00 3.32 H new ATOM 0 HB THR A 14 -6.681 1.393 -21.984 1.00 35.34 H new ATOM 0 HG1 THR A 14 -8.309 -0.079 -21.525 1.00 22.22 H new ATOM 0 HG21 THR A 14 -8.140 3.359 -21.702 1.00 15.31 H new ATOM 0 HG22 THR A 14 -7.168 3.473 -23.189 1.00 15.31 H new ATOM 0 HG23 THR A 14 -8.888 3.027 -23.283 1.00 15.31 H new ATOM 194 N TYR A 15 -4.994 1.173 -24.420 1.00 44.04 N ATOM 195 CA TYR A 15 -3.851 1.807 -25.068 1.00 73.31 C ATOM 196 C TYR A 15 -3.763 1.434 -26.541 1.00 11.51 C ATOM 197 O TYR A 15 -3.375 2.259 -27.367 1.00 72.44 O ATOM 198 CB TYR A 15 -2.538 1.458 -24.365 1.00 54.02 C ATOM 199 CG TYR A 15 -2.261 2.309 -23.146 1.00 63.33 C ATOM 200 CD1 TYR A 15 -1.692 3.574 -23.268 1.00 45.15 C ATOM 201 CD2 TYR A 15 -2.569 1.850 -21.873 1.00 4.43 C ATOM 202 CE1 TYR A 15 -1.444 4.351 -22.156 1.00 21.15 C ATOM 203 CE2 TYR A 15 -2.321 2.623 -20.757 1.00 50.42 C ATOM 204 CZ TYR A 15 -1.760 3.871 -20.904 1.00 42.21 C ATOM 205 OH TYR A 15 -1.506 4.642 -19.793 1.00 71.34 O ATOM 0 H TYR A 15 -4.754 0.421 -23.774 1.00 44.04 H new ATOM 0 HA TYR A 15 -4.008 2.883 -24.992 1.00 73.31 H new ATOM 0 HB2 TYR A 15 -2.562 0.409 -24.068 1.00 54.02 H new ATOM 0 HB3 TYR A 15 -1.716 1.571 -25.072 1.00 54.02 H new ATOM 0 HD1 TYR A 15 -1.441 3.952 -24.248 1.00 45.15 H new ATOM 0 HD2 TYR A 15 -3.010 0.871 -21.754 1.00 4.43 H new ATOM 0 HE1 TYR A 15 -1.004 5.331 -22.266 1.00 21.15 H new ATOM 0 HE2 TYR A 15 -2.566 2.250 -19.773 1.00 50.42 H new ATOM 0 HH TYR A 15 -1.938 4.240 -19.010 1.00 71.34 H new ATOM 215 N GLU A 16 -4.121 0.204 -26.883 1.00 12.51 N ATOM 216 CA GLU A 16 -4.079 -0.202 -28.278 1.00 24.14 C ATOM 217 C GLU A 16 -5.186 0.509 -29.051 1.00 72.11 C ATOM 218 O GLU A 16 -4.992 0.906 -30.196 1.00 24.41 O ATOM 219 CB GLU A 16 -4.177 -1.727 -28.438 1.00 62.21 C ATOM 220 CG GLU A 16 -5.561 -2.305 -28.207 1.00 40.22 C ATOM 221 CD GLU A 16 -5.607 -3.799 -28.437 1.00 22.12 C ATOM 222 OE1 GLU A 16 -5.394 -4.235 -29.588 1.00 44.41 O ATOM 223 OE2 GLU A 16 -5.838 -4.551 -27.470 1.00 53.01 O ATOM 0 H GLU A 16 -4.436 -0.514 -26.231 1.00 12.51 H new ATOM 0 HA GLU A 16 -3.113 0.090 -28.690 1.00 24.14 H new ATOM 0 HB2 GLU A 16 -3.850 -1.994 -29.443 1.00 62.21 H new ATOM 0 HB3 GLU A 16 -3.482 -2.196 -27.742 1.00 62.21 H new ATOM 0 HG2 GLU A 16 -5.877 -2.087 -27.187 1.00 40.22 H new ATOM 0 HG3 GLU A 16 -6.272 -1.816 -28.873 1.00 40.22 H new ATOM 230 N GLU A 17 -6.334 0.709 -28.404 1.00 72.43 N ATOM 231 CA GLU A 17 -7.442 1.424 -29.028 1.00 70.15 C ATOM 232 C GLU A 17 -7.050 2.852 -29.375 1.00 15.23 C ATOM 233 O GLU A 17 -7.293 3.315 -30.485 1.00 62.11 O ATOM 234 CB GLU A 17 -8.675 1.453 -28.122 1.00 12.21 C ATOM 235 CG GLU A 17 -9.372 0.115 -27.985 1.00 54.53 C ATOM 236 CD GLU A 17 -10.746 0.249 -27.364 1.00 2.14 C ATOM 237 OE1 GLU A 17 -11.687 0.644 -28.087 1.00 74.31 O ATOM 238 OE2 GLU A 17 -10.893 -0.022 -26.153 1.00 3.11 O ATOM 0 H GLU A 17 -6.519 0.387 -27.454 1.00 72.43 H new ATOM 0 HA GLU A 17 -7.686 0.884 -29.943 1.00 70.15 H new ATOM 0 HB2 GLU A 17 -8.377 1.799 -27.132 1.00 12.21 H new ATOM 0 HB3 GLU A 17 -9.384 2.182 -28.514 1.00 12.21 H new ATOM 0 HG2 GLU A 17 -9.462 -0.348 -28.967 1.00 54.53 H new ATOM 0 HG3 GLU A 17 -8.762 -0.550 -27.374 1.00 54.53 H new ATOM 245 N ILE A 18 -6.433 3.542 -28.429 1.00 51.34 N ATOM 246 CA ILE A 18 -6.107 4.951 -28.610 1.00 32.53 C ATOM 247 C ILE A 18 -4.958 5.141 -29.607 1.00 70.13 C ATOM 248 O ILE A 18 -4.901 6.138 -30.320 1.00 65.35 O ATOM 249 CB ILE A 18 -5.783 5.633 -27.258 1.00 70.11 C ATOM 250 CG1 ILE A 18 -5.627 7.144 -27.434 1.00 62.51 C ATOM 251 CG2 ILE A 18 -4.532 5.042 -26.625 1.00 51.30 C ATOM 252 CD1 ILE A 18 -5.426 7.883 -26.128 1.00 50.20 C ATOM 0 H ILE A 18 -6.148 3.153 -27.530 1.00 51.34 H new ATOM 0 HA ILE A 18 -6.990 5.435 -29.027 1.00 32.53 H new ATOM 0 HB ILE A 18 -6.621 5.446 -26.587 1.00 70.11 H new ATOM 0 HG12 ILE A 18 -4.778 7.340 -28.089 1.00 62.51 H new ATOM 0 HG13 ILE A 18 -6.512 7.538 -27.933 1.00 62.51 H new ATOM 0 HG21 ILE A 18 -4.332 5.543 -25.678 1.00 51.30 H new ATOM 0 HG22 ILE A 18 -4.682 3.977 -26.448 1.00 51.30 H new ATOM 0 HG23 ILE A 18 -3.684 5.182 -27.295 1.00 51.30 H new ATOM 0 HD11 ILE A 18 -5.322 8.950 -26.326 1.00 50.20 H new ATOM 0 HD12 ILE A 18 -6.286 7.716 -25.479 1.00 50.20 H new ATOM 0 HD13 ILE A 18 -4.525 7.516 -25.637 1.00 50.20 H new ATOM 264 N LYS A 19 -4.057 4.176 -29.679 1.00 53.10 N ATOM 265 CA LYS A 19 -2.944 4.265 -30.614 1.00 74.55 C ATOM 266 C LYS A 19 -3.360 3.860 -32.030 1.00 11.44 C ATOM 267 O LYS A 19 -2.746 4.282 -33.010 1.00 71.43 O ATOM 268 CB LYS A 19 -1.771 3.416 -30.123 1.00 65.35 C ATOM 269 CG LYS A 19 -1.135 3.961 -28.852 1.00 43.13 C ATOM 270 CD LYS A 19 0.018 3.095 -28.371 1.00 4.32 C ATOM 271 CE LYS A 19 0.682 3.702 -27.145 1.00 4.20 C ATOM 272 NZ LYS A 19 1.829 2.888 -26.669 1.00 64.24 N ATOM 0 H LYS A 19 -4.071 3.330 -29.109 1.00 53.10 H new ATOM 0 HA LYS A 19 -2.626 5.307 -30.659 1.00 74.55 H new ATOM 0 HB2 LYS A 19 -2.117 2.398 -29.942 1.00 65.35 H new ATOM 0 HB3 LYS A 19 -1.015 3.362 -30.907 1.00 65.35 H new ATOM 0 HG2 LYS A 19 -0.776 4.974 -29.033 1.00 43.13 H new ATOM 0 HG3 LYS A 19 -1.890 4.026 -28.069 1.00 43.13 H new ATOM 0 HD2 LYS A 19 -0.347 2.096 -28.134 1.00 4.32 H new ATOM 0 HD3 LYS A 19 0.752 2.985 -29.169 1.00 4.32 H new ATOM 0 HE2 LYS A 19 1.026 4.709 -27.381 1.00 4.20 H new ATOM 0 HE3 LYS A 19 -0.052 3.796 -26.345 1.00 4.20 H new ATOM 0 HZ1 LYS A 19 1.770 2.775 -25.637 1.00 64.24 H new ATOM 0 HZ2 LYS A 19 1.802 1.952 -27.121 1.00 64.24 H new ATOM 0 HZ3 LYS A 19 2.719 3.366 -26.915 1.00 64.24 H new ATOM 286 N LYS A 20 -4.399 3.041 -32.139 1.00 71.54 N ATOM 287 CA LYS A 20 -4.876 2.586 -33.442 1.00 40.30 C ATOM 288 C LYS A 20 -6.048 3.433 -33.941 1.00 63.33 C ATOM 289 O LYS A 20 -5.983 4.030 -35.016 1.00 35.23 O ATOM 290 CB LYS A 20 -5.299 1.117 -33.369 1.00 62.33 C ATOM 291 CG LYS A 20 -4.168 0.169 -33.002 1.00 41.04 C ATOM 292 CD LYS A 20 -4.687 -1.232 -32.721 1.00 13.30 C ATOM 293 CE LYS A 20 -3.583 -2.148 -32.213 1.00 43.11 C ATOM 294 NZ LYS A 20 -2.560 -2.427 -33.254 1.00 11.22 N ATOM 0 H LYS A 20 -4.927 2.679 -31.345 1.00 71.54 H new ATOM 0 HA LYS A 20 -4.053 2.695 -34.148 1.00 40.30 H new ATOM 0 HB2 LYS A 20 -6.098 1.015 -32.635 1.00 62.33 H new ATOM 0 HB3 LYS A 20 -5.712 0.819 -34.333 1.00 62.33 H new ATOM 0 HG2 LYS A 20 -3.443 0.134 -33.815 1.00 41.04 H new ATOM 0 HG3 LYS A 20 -3.644 0.548 -32.124 1.00 41.04 H new ATOM 0 HD2 LYS A 20 -5.488 -1.183 -31.983 1.00 13.30 H new ATOM 0 HD3 LYS A 20 -5.117 -1.650 -33.631 1.00 13.30 H new ATOM 0 HE2 LYS A 20 -3.103 -1.690 -31.348 1.00 43.11 H new ATOM 0 HE3 LYS A 20 -4.020 -3.088 -31.875 1.00 43.11 H new ATOM 0 HZ1 LYS A 20 -1.838 -3.068 -32.868 1.00 11.22 H new ATOM 0 HZ2 LYS A 20 -3.014 -2.873 -34.077 1.00 11.22 H new ATOM 0 HZ3 LYS A 20 -2.111 -1.536 -33.547 1.00 11.22 H new ATOM 308 N ASP A 21 -7.112 3.484 -33.149 1.00 74.44 N ATOM 309 CA ASP A 21 -8.353 4.146 -33.554 1.00 1.04 C ATOM 310 C ASP A 21 -8.438 5.552 -32.957 1.00 4.11 C ATOM 311 O ASP A 21 -9.123 6.423 -33.489 1.00 23.11 O ATOM 312 CB ASP A 21 -9.549 3.296 -33.107 1.00 2.13 C ATOM 313 CG ASP A 21 -10.870 3.778 -33.671 1.00 14.41 C ATOM 314 OD1 ASP A 21 -10.959 3.995 -34.897 1.00 61.24 O ATOM 315 OD2 ASP A 21 -11.839 3.910 -32.897 1.00 13.22 O ATOM 0 H ASP A 21 -7.143 3.073 -32.216 1.00 74.44 H new ATOM 0 HA ASP A 21 -8.367 4.245 -34.639 1.00 1.04 H new ATOM 0 HB2 ASP A 21 -9.386 2.263 -33.413 1.00 2.13 H new ATOM 0 HB3 ASP A 21 -9.603 3.301 -32.018 1.00 2.13 H new ATOM 320 N LYS A 22 -7.732 5.731 -31.838 1.00 65.55 N ATOM 321 CA LYS A 22 -7.582 7.007 -31.120 1.00 51.53 C ATOM 322 C LYS A 22 -8.917 7.634 -30.709 1.00 33.13 C ATOM 323 O LYS A 22 -8.969 8.801 -30.318 1.00 51.02 O ATOM 324 CB LYS A 22 -6.762 8.011 -31.939 1.00 74.44 C ATOM 325 CG LYS A 22 -7.591 8.824 -32.906 1.00 75.33 C ATOM 326 CD LYS A 22 -6.913 10.121 -33.257 1.00 64.51 C ATOM 327 CE LYS A 22 -7.945 11.148 -33.639 1.00 23.52 C ATOM 328 NZ LYS A 22 -7.324 12.438 -34.029 1.00 3.15 N ATOM 0 H LYS A 22 -7.229 4.966 -31.388 1.00 65.55 H new ATOM 0 HA LYS A 22 -7.047 6.766 -30.201 1.00 51.53 H new ATOM 0 HB2 LYS A 22 -6.246 8.688 -31.258 1.00 74.44 H new ATOM 0 HB3 LYS A 22 -5.995 7.473 -32.495 1.00 74.44 H new ATOM 0 HG2 LYS A 22 -7.765 8.246 -33.813 1.00 75.33 H new ATOM 0 HG3 LYS A 22 -8.567 9.029 -32.467 1.00 75.33 H new ATOM 0 HD2 LYS A 22 -6.328 10.477 -32.409 1.00 64.51 H new ATOM 0 HD3 LYS A 22 -6.217 9.967 -34.082 1.00 64.51 H new ATOM 0 HE2 LYS A 22 -8.545 10.769 -34.466 1.00 23.52 H new ATOM 0 HE3 LYS A 22 -8.623 11.310 -32.801 1.00 23.52 H new ATOM 0 HZ1 LYS A 22 -7.940 13.223 -33.736 1.00 3.15 H new ATOM 0 HZ2 LYS A 22 -6.398 12.532 -33.564 1.00 3.15 H new ATOM 0 HZ3 LYS A 22 -7.197 12.464 -35.061 1.00 3.15 H new ATOM 342 N LYS A 23 -9.989 6.864 -30.743 1.00 4.23 N ATOM 343 CA LYS A 23 -11.296 7.407 -30.417 1.00 34.04 C ATOM 344 C LYS A 23 -11.562 7.357 -28.918 1.00 72.41 C ATOM 345 O LYS A 23 -12.698 7.459 -28.465 1.00 1.35 O ATOM 346 CB LYS A 23 -12.391 6.721 -31.225 1.00 50.22 C ATOM 347 CG LYS A 23 -12.283 7.043 -32.709 1.00 41.21 C ATOM 348 CD LYS A 23 -13.640 7.276 -33.343 1.00 54.45 C ATOM 349 CE LYS A 23 -14.433 5.988 -33.474 1.00 60.34 C ATOM 350 NZ LYS A 23 -13.760 5.031 -34.389 1.00 11.10 N ATOM 0 H LYS A 23 -9.983 5.874 -30.989 1.00 4.23 H new ATOM 0 HA LYS A 23 -11.304 8.460 -30.699 1.00 34.04 H new ATOM 0 HB2 LYS A 23 -12.327 5.642 -31.081 1.00 50.22 H new ATOM 0 HB3 LYS A 23 -13.367 7.035 -30.855 1.00 50.22 H new ATOM 0 HG2 LYS A 23 -11.664 7.930 -32.843 1.00 41.21 H new ATOM 0 HG3 LYS A 23 -11.780 6.223 -33.222 1.00 41.21 H new ATOM 0 HD2 LYS A 23 -14.204 7.990 -32.742 1.00 54.45 H new ATOM 0 HD3 LYS A 23 -13.508 7.723 -34.328 1.00 54.45 H new ATOM 0 HE2 LYS A 23 -14.554 5.531 -32.492 1.00 60.34 H new ATOM 0 HE3 LYS A 23 -15.433 6.210 -33.848 1.00 60.34 H new ATOM 0 HZ1 LYS A 23 -14.470 4.569 -34.991 1.00 11.10 H new ATOM 0 HZ2 LYS A 23 -13.079 5.542 -34.986 1.00 11.10 H new ATOM 0 HZ3 LYS A 23 -13.258 4.311 -33.831 1.00 11.10 H new ATOM 364 N HIS A 24 -10.497 7.180 -28.156 1.00 31.24 N ATOM 365 CA HIS A 24 -10.515 7.449 -26.727 1.00 41.05 C ATOM 366 C HIS A 24 -9.515 8.559 -26.443 1.00 52.31 C ATOM 367 O HIS A 24 -8.389 8.501 -26.913 1.00 61.02 O ATOM 368 CB HIS A 24 -10.182 6.195 -25.914 1.00 44.24 C ATOM 369 CG HIS A 24 -11.295 5.189 -25.874 1.00 5.15 C ATOM 370 ND1 HIS A 24 -12.540 5.414 -26.424 1.00 23.14 N ATOM 371 CD2 HIS A 24 -11.347 3.951 -25.331 1.00 4.31 C ATOM 372 CE1 HIS A 24 -13.306 4.360 -26.215 1.00 34.31 C ATOM 373 NE2 HIS A 24 -12.606 3.459 -25.554 1.00 15.35 N ATOM 0 H HIS A 24 -9.599 6.847 -28.507 1.00 31.24 H new ATOM 0 HA HIS A 24 -11.517 7.758 -26.428 1.00 41.05 H new ATOM 0 HB2 HIS A 24 -9.294 5.725 -26.336 1.00 44.24 H new ATOM 0 HB3 HIS A 24 -9.933 6.489 -24.894 1.00 44.24 H new ATOM 0 HD1 HIS A 24 -12.824 6.262 -26.915 1.00 23.14 H new ATOM 0 HD2 HIS A 24 -10.544 3.444 -24.817 1.00 4.31 H new ATOM 0 HE1 HIS A 24 -14.333 4.253 -26.532 1.00 34.31 H new ATOM 382 N ARG A 25 -9.933 9.578 -25.709 1.00 32.32 N ATOM 383 CA ARG A 25 -9.096 10.755 -25.502 1.00 25.41 C ATOM 384 C ARG A 25 -8.423 10.708 -24.138 1.00 23.22 C ATOM 385 O ARG A 25 -7.253 11.061 -23.997 1.00 42.33 O ATOM 386 CB ARG A 25 -9.940 12.026 -25.638 1.00 24.21 C ATOM 387 CG ARG A 25 -9.133 13.315 -25.654 1.00 43.44 C ATOM 388 CD ARG A 25 -10.025 14.515 -25.934 1.00 23.13 C ATOM 389 NE ARG A 25 -9.255 15.744 -26.140 1.00 74.21 N ATOM 390 CZ ARG A 25 -9.338 16.493 -27.243 1.00 22.22 C ATOM 391 NH1 ARG A 25 -10.149 16.132 -28.230 1.00 55.12 N ATOM 392 NH2 ARG A 25 -8.621 17.605 -27.357 1.00 62.43 N ATOM 0 H ARG A 25 -10.842 9.617 -25.248 1.00 32.32 H new ATOM 0 HA ARG A 25 -8.316 10.764 -26.263 1.00 25.41 H new ATOM 0 HB2 ARG A 25 -10.523 11.964 -26.557 1.00 24.21 H new ATOM 0 HB3 ARG A 25 -10.651 12.066 -24.812 1.00 24.21 H new ATOM 0 HG2 ARG A 25 -8.632 13.446 -24.695 1.00 43.44 H new ATOM 0 HG3 ARG A 25 -8.355 13.251 -26.414 1.00 43.44 H new ATOM 0 HD2 ARG A 25 -10.631 14.316 -26.818 1.00 23.13 H new ATOM 0 HD3 ARG A 25 -10.713 14.656 -25.101 1.00 23.13 H new ATOM 0 HE ARG A 25 -8.620 16.045 -25.400 1.00 74.21 H new ATOM 0 HH11 ARG A 25 -10.708 15.283 -28.146 1.00 55.12 H new ATOM 0 HH12 ARG A 25 -10.213 16.703 -29.072 1.00 55.12 H new ATOM 0 HH21 ARG A 25 -8.002 17.892 -26.599 1.00 62.43 H new ATOM 0 HH22 ARG A 25 -8.690 18.172 -28.202 1.00 62.43 H new ATOM 406 N TYR A 26 -9.166 10.272 -23.134 1.00 41.31 N ATOM 407 CA TYR A 26 -8.628 10.167 -21.790 1.00 51.50 C ATOM 408 C TYR A 26 -9.089 8.875 -21.133 1.00 54.11 C ATOM 409 O TYR A 26 -10.284 8.562 -21.114 1.00 63.22 O ATOM 410 CB TYR A 26 -9.042 11.378 -20.947 1.00 42.25 C ATOM 411 CG TYR A 26 -8.431 11.401 -19.560 1.00 2.14 C ATOM 412 CD1 TYR A 26 -7.064 11.227 -19.376 1.00 15.01 C ATOM 413 CD2 TYR A 26 -9.221 11.606 -18.435 1.00 70.55 C ATOM 414 CE1 TYR A 26 -6.503 11.254 -18.113 1.00 44.11 C ATOM 415 CE2 TYR A 26 -8.667 11.634 -17.169 1.00 2.15 C ATOM 416 CZ TYR A 26 -7.309 11.458 -17.012 1.00 11.20 C ATOM 417 OH TYR A 26 -6.754 11.489 -15.751 1.00 34.35 O ATOM 0 H TYR A 26 -10.141 9.986 -23.225 1.00 41.31 H new ATOM 0 HA TYR A 26 -7.540 10.152 -21.855 1.00 51.50 H new ATOM 0 HB2 TYR A 26 -8.757 12.289 -21.474 1.00 42.25 H new ATOM 0 HB3 TYR A 26 -10.128 11.389 -20.855 1.00 42.25 H new ATOM 0 HD1 TYR A 26 -6.429 11.068 -20.235 1.00 15.01 H new ATOM 0 HD2 TYR A 26 -10.286 11.746 -18.552 1.00 70.55 H new ATOM 0 HE1 TYR A 26 -5.439 11.116 -17.989 1.00 44.11 H new ATOM 0 HE2 TYR A 26 -9.296 11.793 -16.306 1.00 2.15 H new ATOM 0 HH TYR A 26 -7.458 11.643 -15.087 1.00 34.35 H new ATOM 427 N VAL A 27 -8.132 8.121 -20.622 1.00 54.14 N ATOM 428 CA VAL A 27 -8.423 6.888 -19.914 1.00 3.14 C ATOM 429 C VAL A 27 -8.313 7.108 -18.409 1.00 3.24 C ATOM 430 O VAL A 27 -7.362 7.723 -17.934 1.00 55.11 O ATOM 431 CB VAL A 27 -7.479 5.743 -20.356 1.00 62.32 C ATOM 432 CG1 VAL A 27 -6.021 6.169 -20.273 1.00 63.32 C ATOM 433 CG2 VAL A 27 -7.722 4.489 -19.526 1.00 64.10 C ATOM 0 H VAL A 27 -7.139 8.344 -20.685 1.00 54.14 H new ATOM 0 HA VAL A 27 -9.443 6.594 -20.161 1.00 3.14 H new ATOM 0 HB VAL A 27 -7.702 5.512 -21.398 1.00 62.32 H new ATOM 0 HG11 VAL A 27 -5.382 5.344 -20.589 1.00 63.32 H new ATOM 0 HG12 VAL A 27 -5.855 7.027 -20.924 1.00 63.32 H new ATOM 0 HG13 VAL A 27 -5.779 6.441 -19.246 1.00 63.32 H new ATOM 0 HG21 VAL A 27 -7.047 3.699 -19.855 1.00 64.10 H new ATOM 0 HG22 VAL A 27 -7.539 4.708 -18.474 1.00 64.10 H new ATOM 0 HG23 VAL A 27 -8.754 4.162 -19.654 1.00 64.10 H new ATOM 443 N ILE A 28 -9.304 6.637 -17.672 1.00 62.31 N ATOM 444 CA ILE A 28 -9.312 6.771 -16.227 1.00 75.15 C ATOM 445 C ILE A 28 -8.987 5.428 -15.580 1.00 43.34 C ATOM 446 O ILE A 28 -9.760 4.466 -15.687 1.00 3.33 O ATOM 447 CB ILE A 28 -10.675 7.292 -15.698 1.00 54.43 C ATOM 448 CG1 ILE A 28 -10.943 8.734 -16.153 1.00 30.42 C ATOM 449 CG2 ILE A 28 -10.729 7.209 -14.181 1.00 43.34 C ATOM 450 CD1 ILE A 28 -11.370 8.867 -17.599 1.00 42.13 C ATOM 0 H ILE A 28 -10.118 6.156 -18.054 1.00 62.31 H new ATOM 0 HA ILE A 28 -8.552 7.505 -15.961 1.00 75.15 H new ATOM 0 HB ILE A 28 -11.452 6.654 -16.118 1.00 54.43 H new ATOM 0 HG12 ILE A 28 -11.717 9.164 -15.518 1.00 30.42 H new ATOM 0 HG13 ILE A 28 -10.040 9.324 -15.998 1.00 30.42 H new ATOM 0 HG21 ILE A 28 -11.693 7.579 -13.830 1.00 43.34 H new ATOM 0 HG22 ILE A 28 -10.603 6.172 -13.869 1.00 43.34 H new ATOM 0 HG23 ILE A 28 -9.930 7.816 -13.755 1.00 43.34 H new ATOM 0 HD11 ILE A 28 -11.538 9.918 -17.834 1.00 42.13 H new ATOM 0 HD12 ILE A 28 -10.588 8.471 -18.247 1.00 42.13 H new ATOM 0 HD13 ILE A 28 -12.292 8.308 -17.759 1.00 42.13 H new ATOM 462 N PHE A 29 -7.834 5.362 -14.929 1.00 31.30 N ATOM 463 CA PHE A 29 -7.392 4.142 -14.277 1.00 34.31 C ATOM 464 C PHE A 29 -7.896 4.077 -12.851 1.00 13.14 C ATOM 465 O PHE A 29 -7.790 5.044 -12.095 1.00 2.21 O ATOM 466 CB PHE A 29 -5.867 4.044 -14.246 1.00 64.22 C ATOM 467 CG PHE A 29 -5.216 4.097 -15.587 1.00 21.12 C ATOM 468 CD1 PHE A 29 -5.432 3.102 -16.521 1.00 24.05 C ATOM 469 CD2 PHE A 29 -4.370 5.139 -15.903 1.00 63.00 C ATOM 470 CE1 PHE A 29 -4.816 3.151 -17.755 1.00 71.23 C ATOM 471 CE2 PHE A 29 -3.752 5.198 -17.130 1.00 22.20 C ATOM 472 CZ PHE A 29 -3.974 4.202 -18.059 1.00 53.45 C ATOM 0 H PHE A 29 -7.186 6.145 -14.839 1.00 31.30 H new ATOM 0 HA PHE A 29 -7.799 3.314 -14.857 1.00 34.31 H new ATOM 0 HB2 PHE A 29 -5.476 4.857 -13.634 1.00 64.22 H new ATOM 0 HB3 PHE A 29 -5.585 3.112 -13.756 1.00 64.22 H new ATOM 0 HD1 PHE A 29 -6.089 2.278 -16.283 1.00 24.05 H new ATOM 0 HD2 PHE A 29 -4.190 5.919 -15.178 1.00 63.00 H new ATOM 0 HE1 PHE A 29 -4.992 2.370 -18.480 1.00 71.23 H new ATOM 0 HE2 PHE A 29 -3.095 6.022 -17.366 1.00 22.20 H new ATOM 0 HZ PHE A 29 -3.489 4.245 -19.023 1.00 53.45 H new ATOM 482 N TYR A 30 -8.428 2.934 -12.494 1.00 42.44 N ATOM 483 CA TYR A 30 -8.777 2.653 -11.124 1.00 34.42 C ATOM 484 C TYR A 30 -7.710 1.750 -10.537 1.00 25.21 C ATOM 485 O TYR A 30 -7.247 0.820 -11.198 1.00 55.32 O ATOM 486 CB TYR A 30 -10.153 2.001 -11.045 1.00 45.33 C ATOM 487 CG TYR A 30 -10.515 1.507 -9.662 1.00 0.00 C ATOM 488 CD1 TYR A 30 -10.772 2.400 -8.632 1.00 63.32 C ATOM 489 CD2 TYR A 30 -10.593 0.146 -9.387 1.00 4.11 C ATOM 490 CE1 TYR A 30 -11.099 1.955 -7.368 1.00 32.02 C ATOM 491 CE2 TYR A 30 -10.920 -0.308 -8.124 1.00 12.31 C ATOM 492 CZ TYR A 30 -11.172 0.602 -7.118 1.00 3.54 C ATOM 493 OH TYR A 30 -11.500 0.159 -5.855 1.00 23.15 O ATOM 0 H TYR A 30 -8.631 2.174 -13.144 1.00 42.44 H new ATOM 0 HA TYR A 30 -8.826 3.580 -10.552 1.00 34.42 H new ATOM 0 HB2 TYR A 30 -10.905 2.719 -11.373 1.00 45.33 H new ATOM 0 HB3 TYR A 30 -10.188 1.163 -11.741 1.00 45.33 H new ATOM 0 HD1 TYR A 30 -10.715 3.461 -8.823 1.00 63.32 H new ATOM 0 HD2 TYR A 30 -10.395 -0.567 -10.173 1.00 4.11 H new ATOM 0 HE1 TYR A 30 -11.297 2.664 -6.578 1.00 32.02 H new ATOM 0 HE2 TYR A 30 -10.978 -1.368 -7.925 1.00 12.31 H new ATOM 0 HH TYR A 30 -11.510 -0.821 -5.844 1.00 23.15 H new ATOM 503 N ILE A 31 -7.285 2.034 -9.322 1.00 55.52 N ATOM 504 CA ILE A 31 -6.247 1.237 -8.711 1.00 2.14 C ATOM 505 C ILE A 31 -6.851 -0.080 -8.203 1.00 54.01 C ATOM 506 O ILE A 31 -7.507 -0.152 -7.163 1.00 1.53 O ATOM 507 CB ILE A 31 -5.500 2.046 -7.610 1.00 70.10 C ATOM 508 CG1 ILE A 31 -4.185 1.368 -7.205 1.00 1.54 C ATOM 509 CG2 ILE A 31 -6.372 2.302 -6.388 1.00 34.21 C ATOM 510 CD1 ILE A 31 -3.177 1.284 -8.329 1.00 51.12 C ATOM 0 H ILE A 31 -7.638 2.800 -8.748 1.00 55.52 H new ATOM 0 HA ILE A 31 -5.487 0.980 -9.450 1.00 2.14 H new ATOM 0 HB ILE A 31 -5.262 3.015 -8.049 1.00 70.10 H new ATOM 0 HG12 ILE A 31 -3.744 1.917 -6.373 1.00 1.54 H new ATOM 0 HG13 ILE A 31 -4.400 0.362 -6.845 1.00 1.54 H new ATOM 0 HG21 ILE A 31 -5.806 2.869 -5.649 1.00 34.21 H new ATOM 0 HG22 ILE A 31 -7.254 2.870 -6.683 1.00 34.21 H new ATOM 0 HG23 ILE A 31 -6.681 1.350 -5.956 1.00 34.21 H new ATOM 0 HD11 ILE A 31 -2.272 0.793 -7.970 1.00 51.12 H new ATOM 0 HD12 ILE A 31 -3.599 0.710 -9.154 1.00 51.12 H new ATOM 0 HD13 ILE A 31 -2.932 2.289 -8.674 1.00 51.12 H new ATOM 522 N ARG A 32 -6.649 -1.119 -8.995 1.00 34.12 N ATOM 523 CA ARG A 32 -7.233 -2.427 -8.744 1.00 2.14 C ATOM 524 C ARG A 32 -6.632 -3.036 -7.490 1.00 63.51 C ATOM 525 O ARG A 32 -5.410 -3.179 -7.385 1.00 4.43 O ATOM 526 CB ARG A 32 -6.991 -3.332 -9.952 1.00 45.50 C ATOM 527 CG ARG A 32 -7.542 -4.736 -9.803 1.00 3.32 C ATOM 528 CD ARG A 32 -7.168 -5.595 -10.999 1.00 35.33 C ATOM 529 NE ARG A 32 -7.544 -6.991 -10.804 1.00 24.22 N ATOM 530 CZ ARG A 32 -7.379 -7.947 -11.718 1.00 41.24 C ATOM 531 NH1 ARG A 32 -6.865 -7.665 -12.909 1.00 0.12 N ATOM 532 NH2 ARG A 32 -7.723 -9.193 -11.431 1.00 52.25 N ATOM 0 H ARG A 32 -6.072 -1.079 -9.835 1.00 34.12 H new ATOM 0 HA ARG A 32 -8.307 -2.322 -8.590 1.00 2.14 H new ATOM 0 HB2 ARG A 32 -7.439 -2.870 -10.832 1.00 45.50 H new ATOM 0 HB3 ARG A 32 -5.918 -3.393 -10.136 1.00 45.50 H new ATOM 0 HG2 ARG A 32 -7.154 -5.188 -8.890 1.00 3.32 H new ATOM 0 HG3 ARG A 32 -8.627 -4.697 -9.703 1.00 3.32 H new ATOM 0 HD2 ARG A 32 -7.659 -5.208 -11.892 1.00 35.33 H new ATOM 0 HD3 ARG A 32 -6.094 -5.529 -11.172 1.00 35.33 H new ATOM 0 HE ARG A 32 -7.960 -7.252 -9.910 1.00 24.22 H new ATOM 0 HH11 ARG A 32 -6.591 -6.708 -13.133 1.00 0.12 H new ATOM 0 HH12 ARG A 32 -6.744 -8.405 -13.600 1.00 0.12 H new ATOM 0 HH21 ARG A 32 -8.112 -9.417 -10.515 1.00 52.25 H new ATOM 0 HH22 ARG A 32 -7.599 -9.929 -12.126 1.00 52.25 H new ATOM 546 N ASP A 33 -7.495 -3.339 -6.521 1.00 62.25 N ATOM 547 CA ASP A 33 -7.071 -3.888 -5.230 1.00 4.21 C ATOM 548 C ASP A 33 -6.126 -2.929 -4.519 1.00 31.43 C ATOM 549 O ASP A 33 -5.505 -3.283 -3.516 1.00 42.55 O ATOM 550 CB ASP A 33 -6.401 -5.257 -5.397 1.00 53.23 C ATOM 551 CG ASP A 33 -7.381 -6.346 -5.768 1.00 10.03 C ATOM 552 OD1 ASP A 33 -7.982 -6.952 -4.852 1.00 63.13 O ATOM 553 OD2 ASP A 33 -7.560 -6.605 -6.975 1.00 13.13 O ATOM 0 H ASP A 33 -8.504 -3.212 -6.606 1.00 62.25 H new ATOM 0 HA ASP A 33 -7.966 -4.018 -4.621 1.00 4.21 H new ATOM 0 HB2 ASP A 33 -5.632 -5.189 -6.166 1.00 53.23 H new ATOM 0 HB3 ASP A 33 -5.899 -5.527 -4.468 1.00 53.23 H new ATOM 558 N GLU A 34 -6.040 -1.711 -5.053 1.00 14.54 N ATOM 559 CA GLU A 34 -5.182 -0.662 -4.524 1.00 63.22 C ATOM 560 C GLU A 34 -3.698 -1.054 -4.576 1.00 61.33 C ATOM 561 O GLU A 34 -2.922 -0.690 -3.692 1.00 33.40 O ATOM 562 CB GLU A 34 -5.621 -0.290 -3.104 1.00 32.35 C ATOM 563 CG GLU A 34 -7.074 0.170 -3.039 1.00 73.44 C ATOM 564 CD GLU A 34 -7.517 0.557 -1.644 1.00 4.53 C ATOM 565 OE1 GLU A 34 -7.326 -0.250 -0.711 1.00 73.51 O ATOM 566 OE2 GLU A 34 -8.063 1.671 -1.472 1.00 5.33 O ATOM 0 H GLU A 34 -6.572 -1.426 -5.875 1.00 14.54 H new ATOM 0 HA GLU A 34 -5.290 0.218 -5.159 1.00 63.22 H new ATOM 0 HB2 GLU A 34 -5.487 -1.151 -2.449 1.00 32.35 H new ATOM 0 HB3 GLU A 34 -4.976 0.502 -2.724 1.00 32.35 H new ATOM 0 HG2 GLU A 34 -7.208 1.022 -3.705 1.00 73.44 H new ATOM 0 HG3 GLU A 34 -7.718 -0.628 -3.409 1.00 73.44 H new ATOM 573 N LYS A 35 -3.307 -1.796 -5.623 1.00 60.52 N ATOM 574 CA LYS A 35 -1.882 -2.047 -5.886 1.00 42.13 C ATOM 575 C LYS A 35 -1.611 -2.421 -7.351 1.00 15.13 C ATOM 576 O LYS A 35 -0.459 -2.580 -7.746 1.00 72.10 O ATOM 577 CB LYS A 35 -1.307 -3.138 -4.968 1.00 1.22 C ATOM 578 CG LYS A 35 -1.741 -4.557 -5.317 1.00 50.51 C ATOM 579 CD LYS A 35 -3.029 -4.948 -4.621 1.00 13.14 C ATOM 580 CE LYS A 35 -2.868 -4.922 -3.111 1.00 42.42 C ATOM 581 NZ LYS A 35 -4.086 -5.407 -2.416 1.00 2.13 N ATOM 0 H LYS A 35 -3.946 -2.227 -6.292 1.00 60.52 H new ATOM 0 HA LYS A 35 -1.378 -1.105 -5.672 1.00 42.13 H new ATOM 0 HB2 LYS A 35 -0.219 -3.086 -5.002 1.00 1.22 H new ATOM 0 HB3 LYS A 35 -1.604 -2.924 -3.941 1.00 1.22 H new ATOM 0 HG2 LYS A 35 -1.873 -4.640 -6.396 1.00 50.51 H new ATOM 0 HG3 LYS A 35 -0.952 -5.256 -5.038 1.00 50.51 H new ATOM 0 HD2 LYS A 35 -3.826 -4.266 -4.916 1.00 13.14 H new ATOM 0 HD3 LYS A 35 -3.329 -5.946 -4.940 1.00 13.14 H new ATOM 0 HE2 LYS A 35 -2.017 -5.540 -2.826 1.00 42.42 H new ATOM 0 HE3 LYS A 35 -2.646 -3.905 -2.787 1.00 42.42 H new ATOM 0 HZ1 LYS A 35 -3.923 -5.406 -1.389 1.00 2.13 H new ATOM 0 HZ2 LYS A 35 -4.886 -4.782 -2.641 1.00 2.13 H new ATOM 0 HZ3 LYS A 35 -4.303 -6.374 -2.731 1.00 2.13 H new ATOM 595 N GLN A 36 -2.650 -2.576 -8.158 1.00 54.34 N ATOM 596 CA GLN A 36 -2.455 -2.920 -9.565 1.00 74.14 C ATOM 597 C GLN A 36 -3.340 -2.063 -10.466 1.00 14.43 C ATOM 598 O GLN A 36 -4.299 -1.462 -10.004 1.00 43.42 O ATOM 599 CB GLN A 36 -2.678 -4.418 -9.806 1.00 42.14 C ATOM 600 CG GLN A 36 -4.016 -4.939 -9.324 1.00 34.32 C ATOM 601 CD GLN A 36 -4.124 -6.446 -9.422 1.00 62.10 C ATOM 602 OE1 GLN A 36 -3.511 -7.069 -10.286 1.00 54.43 O ATOM 603 NE2 GLN A 36 -4.915 -7.040 -8.544 1.00 10.44 N ATOM 0 H GLN A 36 -3.624 -2.472 -7.872 1.00 54.34 H new ATOM 0 HA GLN A 36 -1.419 -2.703 -9.825 1.00 74.14 H new ATOM 0 HB2 GLN A 36 -2.587 -4.619 -10.873 1.00 42.14 H new ATOM 0 HB3 GLN A 36 -1.885 -4.975 -9.308 1.00 42.14 H new ATOM 0 HG2 GLN A 36 -4.169 -4.634 -8.289 1.00 34.32 H new ATOM 0 HG3 GLN A 36 -4.812 -4.482 -9.912 1.00 34.32 H new ATOM 0 HE21 GLN A 36 -5.406 -6.485 -7.843 1.00 10.44 H new ATOM 0 HE22 GLN A 36 -5.034 -8.053 -8.568 1.00 10.44 H new ATOM 612 N ILE A 37 -2.989 -1.977 -11.739 1.00 55.00 N ATOM 613 CA ILE A 37 -3.678 -1.085 -12.671 1.00 63.40 C ATOM 614 C ILE A 37 -4.986 -1.693 -13.162 1.00 52.32 C ATOM 615 O ILE A 37 -5.065 -2.896 -13.397 1.00 62.45 O ATOM 616 CB ILE A 37 -2.806 -0.782 -13.905 1.00 30.10 C ATOM 617 CG1 ILE A 37 -1.345 -0.609 -13.492 1.00 4.11 C ATOM 618 CG2 ILE A 37 -3.314 0.462 -14.627 1.00 42.23 C ATOM 619 CD1 ILE A 37 -0.426 -0.241 -14.634 1.00 10.14 C ATOM 0 H ILE A 37 -2.229 -2.514 -12.156 1.00 55.00 H new ATOM 0 HA ILE A 37 -3.880 -0.166 -12.121 1.00 63.40 H new ATOM 0 HB ILE A 37 -2.872 -1.625 -14.593 1.00 30.10 H new ATOM 0 HG12 ILE A 37 -1.283 0.163 -12.725 1.00 4.11 H new ATOM 0 HG13 ILE A 37 -0.993 -1.536 -13.040 1.00 4.11 H new ATOM 0 HG21 ILE A 37 -2.686 0.660 -15.496 1.00 42.23 H new ATOM 0 HG22 ILE A 37 -4.342 0.300 -14.952 1.00 42.23 H new ATOM 0 HG23 ILE A 37 -3.278 1.316 -13.950 1.00 42.23 H new ATOM 0 HD11 ILE A 37 0.593 -0.136 -14.262 1.00 10.14 H new ATOM 0 HD12 ILE A 37 -0.456 -1.024 -15.392 1.00 10.14 H new ATOM 0 HD13 ILE A 37 -0.751 0.702 -15.073 1.00 10.14 H new ATOM 631 N ASP A 38 -6.003 -0.855 -13.322 1.00 51.23 N ATOM 632 CA ASP A 38 -7.274 -1.279 -13.899 1.00 53.32 C ATOM 633 C ASP A 38 -7.941 -0.103 -14.608 1.00 3.32 C ATOM 634 O ASP A 38 -7.630 1.051 -14.324 1.00 32.15 O ATOM 635 CB ASP A 38 -8.201 -1.843 -12.819 1.00 73.01 C ATOM 636 CG ASP A 38 -9.476 -2.427 -13.400 1.00 72.44 C ATOM 637 OD1 ASP A 38 -9.416 -3.011 -14.503 1.00 1.14 O ATOM 638 OD2 ASP A 38 -10.540 -2.306 -12.762 1.00 13.24 O ATOM 0 H ASP A 38 -5.972 0.130 -13.058 1.00 51.23 H new ATOM 0 HA ASP A 38 -7.079 -2.069 -14.625 1.00 53.32 H new ATOM 0 HB2 ASP A 38 -7.674 -2.614 -12.258 1.00 73.01 H new ATOM 0 HB3 ASP A 38 -8.455 -1.053 -12.113 1.00 73.01 H new ATOM 643 N VAL A 39 -8.839 -0.396 -15.539 1.00 24.25 N ATOM 644 CA VAL A 39 -9.536 0.644 -16.290 1.00 51.21 C ATOM 645 C VAL A 39 -11.044 0.488 -16.143 1.00 23.11 C ATOM 646 O VAL A 39 -11.595 -0.578 -16.426 1.00 52.15 O ATOM 647 CB VAL A 39 -9.170 0.615 -17.790 1.00 64.24 C ATOM 648 CG1 VAL A 39 -9.970 1.656 -18.560 1.00 30.24 C ATOM 649 CG2 VAL A 39 -7.681 0.839 -17.983 1.00 35.43 C ATOM 0 H VAL A 39 -9.104 -1.347 -15.794 1.00 24.25 H new ATOM 0 HA VAL A 39 -9.219 1.601 -15.876 1.00 51.21 H new ATOM 0 HB VAL A 39 -9.423 -0.370 -18.182 1.00 64.24 H new ATOM 0 HG11 VAL A 39 -9.696 1.618 -19.614 1.00 30.24 H new ATOM 0 HG12 VAL A 39 -11.035 1.448 -18.454 1.00 30.24 H new ATOM 0 HG13 VAL A 39 -9.753 2.648 -18.164 1.00 30.24 H new ATOM 0 HG21 VAL A 39 -7.444 0.815 -19.047 1.00 35.43 H new ATOM 0 HG22 VAL A 39 -7.403 1.809 -17.571 1.00 35.43 H new ATOM 0 HG23 VAL A 39 -7.125 0.054 -17.470 1.00 35.43 H new ATOM 659 N GLU A 40 -11.710 1.544 -15.698 1.00 52.53 N ATOM 660 CA GLU A 40 -13.154 1.493 -15.511 1.00 14.03 C ATOM 661 C GLU A 40 -13.862 2.609 -16.270 1.00 41.33 C ATOM 662 O GLU A 40 -15.010 2.455 -16.683 1.00 41.14 O ATOM 663 CB GLU A 40 -13.505 1.579 -14.031 1.00 14.22 C ATOM 664 CG GLU A 40 -12.851 0.506 -13.182 1.00 61.20 C ATOM 665 CD GLU A 40 -13.471 0.425 -11.807 1.00 24.02 C ATOM 666 OE1 GLU A 40 -13.377 1.406 -11.044 1.00 62.15 O ATOM 667 OE2 GLU A 40 -14.083 -0.616 -11.495 1.00 3.42 O ATOM 0 H GLU A 40 -11.280 2.438 -15.462 1.00 52.53 H new ATOM 0 HA GLU A 40 -13.497 0.539 -15.911 1.00 14.03 H new ATOM 0 HB2 GLU A 40 -13.209 2.558 -13.654 1.00 14.22 H new ATOM 0 HB3 GLU A 40 -14.587 1.508 -13.919 1.00 14.22 H new ATOM 0 HG2 GLU A 40 -12.944 -0.459 -13.680 1.00 61.20 H new ATOM 0 HG3 GLU A 40 -11.785 0.715 -13.089 1.00 61.20 H new ATOM 674 N THR A 41 -13.181 3.729 -16.449 1.00 71.11 N ATOM 675 CA THR A 41 -13.775 4.880 -17.108 1.00 54.12 C ATOM 676 C THR A 41 -12.915 5.336 -18.283 1.00 4.11 C ATOM 677 O THR A 41 -11.712 5.545 -18.143 1.00 75.43 O ATOM 678 CB THR A 41 -13.960 6.044 -16.107 1.00 24.54 C ATOM 679 OG1 THR A 41 -14.700 5.582 -14.969 1.00 54.13 O ATOM 680 CG2 THR A 41 -14.690 7.221 -16.747 1.00 33.04 C ATOM 0 H THR A 41 -12.216 3.865 -16.147 1.00 71.11 H new ATOM 0 HA THR A 41 -14.753 4.582 -17.487 1.00 54.12 H new ATOM 0 HB THR A 41 -12.972 6.387 -15.799 1.00 24.54 H new ATOM 0 HG1 THR A 41 -14.816 6.319 -14.333 1.00 54.13 H new ATOM 0 HG21 THR A 41 -14.803 8.021 -16.015 1.00 33.04 H new ATOM 0 HG22 THR A 41 -14.115 7.586 -17.598 1.00 33.04 H new ATOM 0 HG23 THR A 41 -15.674 6.898 -17.086 1.00 33.04 H new ATOM 688 N VAL A 42 -13.533 5.459 -19.445 1.00 3.15 N ATOM 689 CA VAL A 42 -12.849 5.946 -20.630 1.00 40.23 C ATOM 690 C VAL A 42 -13.695 7.004 -21.324 1.00 71.10 C ATOM 691 O VAL A 42 -14.898 6.818 -21.524 1.00 44.44 O ATOM 692 CB VAL A 42 -12.518 4.811 -21.629 1.00 22.24 C ATOM 693 CG1 VAL A 42 -11.422 3.913 -21.079 1.00 30.22 C ATOM 694 CG2 VAL A 42 -13.758 3.990 -21.958 1.00 31.24 C ATOM 0 H VAL A 42 -14.515 5.226 -19.593 1.00 3.15 H new ATOM 0 HA VAL A 42 -11.905 6.380 -20.299 1.00 40.23 H new ATOM 0 HB VAL A 42 -12.161 5.272 -22.550 1.00 22.24 H new ATOM 0 HG11 VAL A 42 -11.205 3.122 -21.797 1.00 30.22 H new ATOM 0 HG12 VAL A 42 -10.522 4.502 -20.905 1.00 30.22 H new ATOM 0 HG13 VAL A 42 -11.752 3.470 -20.140 1.00 30.22 H new ATOM 0 HG21 VAL A 42 -13.495 3.200 -22.662 1.00 31.24 H new ATOM 0 HG22 VAL A 42 -14.153 3.545 -21.045 1.00 31.24 H new ATOM 0 HG23 VAL A 42 -14.514 4.636 -22.403 1.00 31.24 H new ATOM 704 N ALA A 43 -13.072 8.117 -21.673 1.00 63.21 N ATOM 705 CA ALA A 43 -13.770 9.204 -22.337 1.00 62.25 C ATOM 706 C ALA A 43 -13.133 9.493 -23.688 1.00 32.40 C ATOM 707 O ALA A 43 -11.913 9.402 -23.840 1.00 64.13 O ATOM 708 CB ALA A 43 -13.765 10.445 -21.460 1.00 72.44 C ATOM 0 H ALA A 43 -12.081 8.291 -21.507 1.00 63.21 H new ATOM 0 HA ALA A 43 -14.805 8.908 -22.505 1.00 62.25 H new ATOM 0 HB1 ALA A 43 -14.291 11.252 -21.969 1.00 72.44 H new ATOM 0 HB2 ALA A 43 -14.264 10.225 -20.516 1.00 72.44 H new ATOM 0 HB3 ALA A 43 -12.736 10.749 -21.265 1.00 72.44 H new ATOM 714 N ASP A 44 -13.955 9.823 -24.670 1.00 45.13 N ATOM 715 CA ASP A 44 -13.470 10.051 -26.026 1.00 0.34 C ATOM 716 C ASP A 44 -13.347 11.545 -26.323 1.00 50.15 C ATOM 717 O ASP A 44 -13.384 12.372 -25.413 1.00 74.12 O ATOM 718 CB ASP A 44 -14.399 9.378 -27.043 1.00 50.20 C ATOM 719 CG ASP A 44 -15.690 10.131 -27.266 1.00 21.40 C ATOM 720 OD1 ASP A 44 -16.606 10.017 -26.429 1.00 73.15 O ATOM 721 OD2 ASP A 44 -15.785 10.844 -28.283 1.00 53.44 O ATOM 0 H ASP A 44 -14.962 9.940 -24.556 1.00 45.13 H new ATOM 0 HA ASP A 44 -12.477 9.609 -26.110 1.00 0.34 H new ATOM 0 HB2 ASP A 44 -13.875 9.280 -27.994 1.00 50.20 H new ATOM 0 HB3 ASP A 44 -14.630 8.369 -26.701 1.00 50.20 H new ATOM 726 N ARG A 45 -13.198 11.881 -27.603 1.00 34.31 N ATOM 727 CA ARG A 45 -12.974 13.260 -28.020 1.00 21.32 C ATOM 728 C ARG A 45 -14.243 14.108 -27.918 1.00 13.24 C ATOM 729 O ARG A 45 -14.172 15.337 -27.981 1.00 3.33 O ATOM 730 CB ARG A 45 -12.416 13.313 -29.449 1.00 40.40 C ATOM 731 CG ARG A 45 -13.171 12.445 -30.443 1.00 73.43 C ATOM 732 CD ARG A 45 -12.745 12.737 -31.874 1.00 2.41 C ATOM 733 NE ARG A 45 -13.242 14.035 -32.331 1.00 11.25 N ATOM 734 CZ ARG A 45 -12.666 14.783 -33.273 1.00 21.12 C ATOM 735 NH1 ARG A 45 -11.543 14.387 -33.860 1.00 54.55 N ATOM 736 NH2 ARG A 45 -13.230 15.929 -33.636 1.00 60.45 N ATOM 0 H ARG A 45 -13.229 11.211 -28.372 1.00 34.31 H new ATOM 0 HA ARG A 45 -12.240 13.683 -27.335 1.00 21.32 H new ATOM 0 HB2 ARG A 45 -12.435 14.346 -29.797 1.00 40.40 H new ATOM 0 HB3 ARG A 45 -11.371 13.002 -29.431 1.00 40.40 H new ATOM 0 HG2 ARG A 45 -12.994 11.393 -30.217 1.00 73.43 H new ATOM 0 HG3 ARG A 45 -14.242 12.618 -30.339 1.00 73.43 H new ATOM 0 HD2 ARG A 45 -11.657 12.719 -31.941 1.00 2.41 H new ATOM 0 HD3 ARG A 45 -13.118 11.952 -32.532 1.00 2.41 H new ATOM 0 HE ARG A 45 -14.092 14.395 -31.897 1.00 11.25 H new ATOM 0 HH11 ARG A 45 -11.112 13.502 -33.592 1.00 54.55 H new ATOM 0 HH12 ARG A 45 -11.111 14.967 -34.579 1.00 54.55 H new ATOM 0 HH21 ARG A 45 -14.098 16.232 -33.195 1.00 60.45 H new ATOM 0 HH22 ARG A 45 -12.795 16.506 -34.356 1.00 60.45 H new ATOM 750 N ASN A 46 -15.396 13.457 -27.775 1.00 63.12 N ATOM 751 CA ASN A 46 -16.665 14.164 -27.603 1.00 30.44 C ATOM 752 C ASN A 46 -16.648 14.998 -26.327 1.00 55.20 C ATOM 753 O ASN A 46 -17.199 16.102 -26.283 1.00 73.10 O ATOM 754 CB ASN A 46 -17.836 13.176 -27.559 1.00 43.02 C ATOM 755 CG ASN A 46 -19.166 13.858 -27.290 1.00 32.22 C ATOM 756 OD1 ASN A 46 -19.584 14.004 -26.141 1.00 52.52 O ATOM 757 ND2 ASN A 46 -19.843 14.277 -28.348 1.00 3.21 N ATOM 0 H ASN A 46 -15.478 12.440 -27.775 1.00 63.12 H new ATOM 0 HA ASN A 46 -16.796 14.828 -28.458 1.00 30.44 H new ATOM 0 HB2 ASN A 46 -17.891 12.641 -28.507 1.00 43.02 H new ATOM 0 HB3 ASN A 46 -17.650 12.432 -26.784 1.00 43.02 H new ATOM 0 HD21 ASN A 46 -20.744 14.739 -28.227 1.00 3.21 H new ATOM 0 HD22 ASN A 46 -19.463 14.138 -29.284 1.00 3.21 H new ATOM 764 N ALA A 47 -16.003 14.468 -25.299 1.00 43.43 N ATOM 765 CA ALA A 47 -15.908 15.153 -24.023 1.00 11.35 C ATOM 766 C ALA A 47 -14.741 16.130 -24.027 1.00 41.01 C ATOM 767 O ALA A 47 -13.719 15.895 -24.678 1.00 31.14 O ATOM 768 CB ALA A 47 -15.764 14.147 -22.891 1.00 1.14 C ATOM 0 H ALA A 47 -15.536 13.561 -25.326 1.00 43.43 H new ATOM 0 HA ALA A 47 -16.826 15.719 -23.864 1.00 11.35 H new ATOM 0 HB1 ALA A 47 -15.694 14.676 -21.941 1.00 1.14 H new ATOM 0 HB2 ALA A 47 -16.633 13.489 -22.877 1.00 1.14 H new ATOM 0 HB3 ALA A 47 -14.862 13.554 -23.044 1.00 1.14 H new ATOM 774 N GLU A 48 -14.896 17.228 -23.307 1.00 24.21 N ATOM 775 CA GLU A 48 -13.859 18.244 -23.239 1.00 63.41 C ATOM 776 C GLU A 48 -13.267 18.328 -21.833 1.00 32.41 C ATOM 777 O GLU A 48 -13.715 17.623 -20.925 1.00 34.00 O ATOM 778 CB GLU A 48 -14.412 19.589 -23.700 1.00 73.41 C ATOM 779 CG GLU A 48 -15.697 19.998 -23.006 1.00 73.42 C ATOM 780 CD GLU A 48 -16.314 21.218 -23.646 1.00 74.24 C ATOM 781 OE1 GLU A 48 -15.726 22.312 -23.527 1.00 74.03 O ATOM 782 OE2 GLU A 48 -17.380 21.087 -24.279 1.00 51.53 O ATOM 0 H GLU A 48 -15.731 17.439 -22.761 1.00 24.21 H new ATOM 0 HA GLU A 48 -13.048 17.964 -23.912 1.00 63.41 H new ATOM 0 HB2 GLU A 48 -13.658 20.358 -23.529 1.00 73.41 H new ATOM 0 HB3 GLU A 48 -14.589 19.549 -24.775 1.00 73.41 H new ATOM 0 HG2 GLU A 48 -16.407 19.172 -23.039 1.00 73.42 H new ATOM 0 HG3 GLU A 48 -15.494 20.202 -21.955 1.00 73.42 H new ATOM 789 N TYR A 49 -12.287 19.212 -21.648 1.00 43.12 N ATOM 790 CA TYR A 49 -11.431 19.182 -20.465 1.00 11.22 C ATOM 791 C TYR A 49 -12.208 19.498 -19.195 1.00 21.45 C ATOM 792 O TYR A 49 -11.908 18.964 -18.127 1.00 25.54 O ATOM 793 CB TYR A 49 -10.263 20.152 -20.646 1.00 61.24 C ATOM 794 CG TYR A 49 -9.488 19.900 -21.920 1.00 1.53 C ATOM 795 CD1 TYR A 49 -8.642 18.805 -22.034 1.00 31.42 C ATOM 796 CD2 TYR A 49 -9.615 20.747 -23.014 1.00 33.21 C ATOM 797 CE1 TYR A 49 -7.945 18.560 -23.202 1.00 2.54 C ATOM 798 CE2 TYR A 49 -8.919 20.510 -24.184 1.00 1.32 C ATOM 799 CZ TYR A 49 -8.087 19.416 -24.273 1.00 0.31 C ATOM 800 OH TYR A 49 -7.398 19.171 -25.440 1.00 30.34 O ATOM 0 H TYR A 49 -12.067 19.960 -22.306 1.00 43.12 H new ATOM 0 HA TYR A 49 -11.041 18.170 -20.355 1.00 11.22 H new ATOM 0 HB2 TYR A 49 -10.642 21.174 -20.652 1.00 61.24 H new ATOM 0 HB3 TYR A 49 -9.590 20.067 -19.793 1.00 61.24 H new ATOM 0 HD1 TYR A 49 -8.527 18.134 -21.196 1.00 31.42 H new ATOM 0 HD2 TYR A 49 -10.268 21.605 -22.949 1.00 33.21 H new ATOM 0 HE1 TYR A 49 -7.293 17.702 -23.275 1.00 2.54 H new ATOM 0 HE2 TYR A 49 -9.027 21.179 -25.025 1.00 1.32 H new ATOM 0 HH TYR A 49 -6.670 18.540 -25.263 1.00 30.34 H new ATOM 810 N ASP A 50 -13.212 20.350 -19.323 1.00 75.25 N ATOM 811 CA ASP A 50 -14.082 20.691 -18.202 1.00 73.23 C ATOM 812 C ASP A 50 -14.775 19.451 -17.657 1.00 22.04 C ATOM 813 O ASP A 50 -14.894 19.266 -16.448 1.00 21.34 O ATOM 814 CB ASP A 50 -15.144 21.698 -18.642 1.00 23.02 C ATOM 815 CG ASP A 50 -14.578 23.069 -18.931 1.00 5.12 C ATOM 816 OD1 ASP A 50 -13.957 23.253 -19.998 1.00 3.32 O ATOM 817 OD2 ASP A 50 -14.760 23.974 -18.095 1.00 44.01 O ATOM 0 H ASP A 50 -13.448 20.822 -20.196 1.00 75.25 H new ATOM 0 HA ASP A 50 -13.461 21.128 -17.420 1.00 73.23 H new ATOM 0 HB2 ASP A 50 -15.644 21.323 -19.535 1.00 23.02 H new ATOM 0 HB3 ASP A 50 -15.902 21.781 -17.863 1.00 23.02 H new ATOM 822 N GLN A 51 -15.209 18.595 -18.569 1.00 21.52 N ATOM 823 CA GLN A 51 -16.021 17.438 -18.226 1.00 52.15 C ATOM 824 C GLN A 51 -15.175 16.296 -17.676 1.00 41.43 C ATOM 825 O GLN A 51 -15.632 15.546 -16.815 1.00 73.11 O ATOM 826 CB GLN A 51 -16.799 16.987 -19.456 1.00 73.13 C ATOM 827 CG GLN A 51 -17.779 18.037 -19.946 1.00 72.44 C ATOM 828 CD GLN A 51 -18.304 17.748 -21.333 1.00 10.02 C ATOM 829 OE1 GLN A 51 -17.607 17.162 -22.161 1.00 41.45 O ATOM 830 NE2 GLN A 51 -19.535 18.152 -21.595 1.00 12.24 N ATOM 0 H GLN A 51 -15.009 18.682 -19.565 1.00 21.52 H new ATOM 0 HA GLN A 51 -16.717 17.727 -17.438 1.00 52.15 H new ATOM 0 HB2 GLN A 51 -16.099 16.748 -20.256 1.00 73.13 H new ATOM 0 HB3 GLN A 51 -17.341 16.071 -19.222 1.00 73.13 H new ATOM 0 HG2 GLN A 51 -18.617 18.098 -19.251 1.00 72.44 H new ATOM 0 HG3 GLN A 51 -17.291 19.012 -19.943 1.00 72.44 H new ATOM 0 HE21 GLN A 51 -20.077 18.634 -20.878 1.00 12.24 H new ATOM 0 HE22 GLN A 51 -19.943 17.981 -22.514 1.00 12.24 H new ATOM 839 N PHE A 52 -13.943 16.169 -18.168 1.00 35.22 N ATOM 840 CA PHE A 52 -13.032 15.133 -17.680 1.00 13.02 C ATOM 841 C PHE A 52 -12.796 15.298 -16.184 1.00 34.50 C ATOM 842 O PHE A 52 -12.983 14.368 -15.400 1.00 30.14 O ATOM 843 CB PHE A 52 -11.682 15.192 -18.405 1.00 20.54 C ATOM 844 CG PHE A 52 -11.746 14.891 -19.876 1.00 43.41 C ATOM 845 CD1 PHE A 52 -12.324 13.721 -20.338 1.00 21.13 C ATOM 846 CD2 PHE A 52 -11.208 15.774 -20.798 1.00 4.53 C ATOM 847 CE1 PHE A 52 -12.366 13.439 -21.690 1.00 13.13 C ATOM 848 CE2 PHE A 52 -11.249 15.498 -22.152 1.00 12.32 C ATOM 849 CZ PHE A 52 -11.829 14.329 -22.598 1.00 61.00 C ATOM 0 H PHE A 52 -13.554 16.765 -18.899 1.00 35.22 H new ATOM 0 HA PHE A 52 -13.498 14.168 -17.878 1.00 13.02 H new ATOM 0 HB2 PHE A 52 -11.255 16.186 -18.269 1.00 20.54 H new ATOM 0 HB3 PHE A 52 -11.000 14.485 -17.933 1.00 20.54 H new ATOM 0 HD1 PHE A 52 -12.747 13.020 -19.633 1.00 21.13 H new ATOM 0 HD2 PHE A 52 -10.751 16.690 -20.454 1.00 4.53 H new ATOM 0 HE1 PHE A 52 -12.819 12.522 -22.036 1.00 13.13 H new ATOM 0 HE2 PHE A 52 -10.827 16.197 -22.859 1.00 12.32 H new ATOM 0 HZ PHE A 52 -11.863 14.110 -23.655 1.00 61.00 H new ATOM 859 N LEU A 53 -12.394 16.500 -15.801 1.00 12.53 N ATOM 860 CA LEU A 53 -12.077 16.803 -14.415 1.00 43.32 C ATOM 861 C LEU A 53 -13.338 16.791 -13.558 1.00 12.40 C ATOM 862 O LEU A 53 -13.330 16.292 -12.430 1.00 12.23 O ATOM 863 CB LEU A 53 -11.393 18.167 -14.340 1.00 34.45 C ATOM 864 CG LEU A 53 -10.142 18.298 -15.212 1.00 53.24 C ATOM 865 CD1 LEU A 53 -9.659 19.734 -15.234 1.00 65.12 C ATOM 866 CD2 LEU A 53 -9.043 17.373 -14.710 1.00 12.42 C ATOM 0 H LEU A 53 -12.279 17.288 -16.438 1.00 12.53 H new ATOM 0 HA LEU A 53 -11.402 16.039 -14.029 1.00 43.32 H new ATOM 0 HB2 LEU A 53 -12.108 18.935 -14.635 1.00 34.45 H new ATOM 0 HB3 LEU A 53 -11.121 18.366 -13.304 1.00 34.45 H new ATOM 0 HG LEU A 53 -10.399 18.006 -16.230 1.00 53.24 H new ATOM 0 HD11 LEU A 53 -8.769 19.809 -15.859 1.00 65.12 H new ATOM 0 HD12 LEU A 53 -10.442 20.375 -15.639 1.00 65.12 H new ATOM 0 HD13 LEU A 53 -9.418 20.053 -14.220 1.00 65.12 H new ATOM 0 HD21 LEU A 53 -8.161 17.479 -15.342 1.00 12.42 H new ATOM 0 HD22 LEU A 53 -8.788 17.635 -13.683 1.00 12.42 H new ATOM 0 HD23 LEU A 53 -9.392 16.341 -14.745 1.00 12.42 H new ATOM 878 N GLU A 54 -14.421 17.320 -14.118 1.00 24.13 N ATOM 879 CA GLU A 54 -15.698 17.406 -13.419 1.00 52.15 C ATOM 880 C GLU A 54 -16.186 16.022 -12.992 1.00 22.44 C ATOM 881 O GLU A 54 -16.711 15.855 -11.892 1.00 44.23 O ATOM 882 CB GLU A 54 -16.743 18.064 -14.326 1.00 32.20 C ATOM 883 CG GLU A 54 -18.054 18.404 -13.631 1.00 10.11 C ATOM 884 CD GLU A 54 -17.897 19.488 -12.585 1.00 22.52 C ATOM 885 OE1 GLU A 54 -17.581 20.640 -12.957 1.00 23.43 O ATOM 886 OE2 GLU A 54 -18.101 19.199 -11.387 1.00 54.42 O ATOM 0 H GLU A 54 -14.439 17.699 -15.065 1.00 24.13 H new ATOM 0 HA GLU A 54 -15.556 18.011 -12.524 1.00 52.15 H new ATOM 0 HB2 GLU A 54 -16.320 18.977 -14.744 1.00 32.20 H new ATOM 0 HB3 GLU A 54 -16.952 17.397 -15.163 1.00 32.20 H new ATOM 0 HG2 GLU A 54 -18.782 18.726 -14.375 1.00 10.11 H new ATOM 0 HG3 GLU A 54 -18.455 17.506 -13.161 1.00 10.11 H new ATOM 893 N ASP A 55 -15.991 15.029 -13.854 1.00 15.04 N ATOM 894 CA ASP A 55 -16.502 13.690 -13.593 1.00 54.33 C ATOM 895 C ASP A 55 -15.738 13.033 -12.451 1.00 53.42 C ATOM 896 O ASP A 55 -16.326 12.392 -11.581 1.00 43.31 O ATOM 897 CB ASP A 55 -16.400 12.820 -14.847 1.00 3.42 C ATOM 898 CG ASP A 55 -17.383 11.662 -14.827 1.00 4.13 C ATOM 899 OD1 ASP A 55 -17.263 10.780 -13.954 1.00 33.23 O ATOM 900 OD2 ASP A 55 -18.303 11.650 -15.676 1.00 61.34 O ATOM 0 H ASP A 55 -15.485 15.126 -14.735 1.00 15.04 H new ATOM 0 HA ASP A 55 -17.550 13.782 -13.309 1.00 54.33 H new ATOM 0 HB2 ASP A 55 -16.584 13.434 -15.729 1.00 3.42 H new ATOM 0 HB3 ASP A 55 -15.386 12.431 -14.935 1.00 3.42 H new ATOM 905 N ILE A 56 -14.428 13.218 -12.435 1.00 32.15 N ATOM 906 CA ILE A 56 -13.592 12.554 -11.447 1.00 55.54 C ATOM 907 C ILE A 56 -13.742 13.192 -10.065 1.00 31.34 C ATOM 908 O ILE A 56 -13.752 12.491 -9.053 1.00 72.33 O ATOM 909 CB ILE A 56 -12.107 12.557 -11.862 1.00 5.21 C ATOM 910 CG1 ILE A 56 -11.943 11.991 -13.278 1.00 50.32 C ATOM 911 CG2 ILE A 56 -11.276 11.753 -10.869 1.00 41.31 C ATOM 912 CD1 ILE A 56 -12.457 10.574 -13.433 1.00 3.24 C ATOM 0 H ILE A 56 -13.923 13.817 -13.089 1.00 32.15 H new ATOM 0 HA ILE A 56 -13.935 11.521 -11.394 1.00 55.54 H new ATOM 0 HB ILE A 56 -11.751 13.587 -11.859 1.00 5.21 H new ATOM 0 HG12 ILE A 56 -12.469 12.637 -13.981 1.00 50.32 H new ATOM 0 HG13 ILE A 56 -10.888 12.017 -13.550 1.00 50.32 H new ATOM 0 HG21 ILE A 56 -10.230 11.765 -11.176 1.00 41.31 H new ATOM 0 HG22 ILE A 56 -11.368 12.194 -9.877 1.00 41.31 H new ATOM 0 HG23 ILE A 56 -11.635 10.724 -10.843 1.00 41.31 H new ATOM 0 HD11 ILE A 56 -12.307 10.243 -14.461 1.00 3.24 H new ATOM 0 HD12 ILE A 56 -11.914 9.914 -12.756 1.00 3.24 H new ATOM 0 HD13 ILE A 56 -13.520 10.544 -13.194 1.00 3.24 H new ATOM 924 N GLN A 57 -13.891 14.512 -10.017 1.00 2.40 N ATOM 925 CA GLN A 57 -13.952 15.210 -8.735 1.00 70.42 C ATOM 926 C GLN A 57 -15.235 14.887 -7.969 1.00 11.43 C ATOM 927 O GLN A 57 -15.230 14.850 -6.741 1.00 52.23 O ATOM 928 CB GLN A 57 -13.795 16.724 -8.911 1.00 3.20 C ATOM 929 CG GLN A 57 -14.846 17.372 -9.796 1.00 73.14 C ATOM 930 CD GLN A 57 -14.653 18.871 -9.907 1.00 12.53 C ATOM 931 OE1 GLN A 57 -13.538 19.374 -9.797 1.00 71.43 O ATOM 932 NE2 GLN A 57 -15.730 19.595 -10.142 1.00 74.40 N ATOM 0 H GLN A 57 -13.971 15.114 -10.837 1.00 2.40 H new ATOM 0 HA GLN A 57 -13.112 14.849 -8.141 1.00 70.42 H new ATOM 0 HB2 GLN A 57 -13.826 17.195 -7.929 1.00 3.20 H new ATOM 0 HB3 GLN A 57 -12.810 16.927 -9.331 1.00 3.20 H new ATOM 0 HG2 GLN A 57 -14.806 16.927 -10.790 1.00 73.14 H new ATOM 0 HG3 GLN A 57 -15.837 17.163 -9.393 1.00 73.14 H new ATOM 0 HE21 GLN A 57 -16.640 19.142 -10.227 1.00 74.40 H new ATOM 0 HE22 GLN A 57 -15.653 20.607 -10.238 1.00 74.40 H new ATOM 941 N LYS A 58 -16.338 14.653 -8.681 1.00 44.41 N ATOM 942 CA LYS A 58 -17.581 14.262 -8.014 1.00 75.20 C ATOM 943 C LYS A 58 -17.588 12.768 -7.709 1.00 43.05 C ATOM 944 O LYS A 58 -18.496 12.262 -7.050 1.00 41.22 O ATOM 945 CB LYS A 58 -18.826 14.682 -8.818 1.00 70.13 C ATOM 946 CG LYS A 58 -18.844 14.263 -10.285 1.00 12.20 C ATOM 947 CD LYS A 58 -19.169 12.789 -10.480 1.00 51.11 C ATOM 948 CE LYS A 58 -19.470 12.490 -11.941 1.00 30.10 C ATOM 949 NZ LYS A 58 -19.449 11.033 -12.239 1.00 53.53 N ATOM 0 H LYS A 58 -16.398 14.725 -9.697 1.00 44.41 H new ATOM 0 HA LYS A 58 -17.625 14.798 -7.066 1.00 75.20 H new ATOM 0 HB2 LYS A 58 -19.707 14.265 -8.330 1.00 70.13 H new ATOM 0 HB3 LYS A 58 -18.918 15.767 -8.769 1.00 70.13 H new ATOM 0 HG2 LYS A 58 -19.579 14.865 -10.820 1.00 12.20 H new ATOM 0 HG3 LYS A 58 -17.872 14.477 -10.730 1.00 12.20 H new ATOM 0 HD2 LYS A 58 -18.330 12.180 -10.145 1.00 51.11 H new ATOM 0 HD3 LYS A 58 -20.026 12.517 -9.864 1.00 51.11 H new ATOM 0 HE2 LYS A 58 -20.448 12.896 -12.198 1.00 30.10 H new ATOM 0 HE3 LYS A 58 -18.739 12.997 -12.571 1.00 30.10 H new ATOM 0 HZ1 LYS A 58 -18.610 10.808 -12.811 1.00 53.53 H new ATOM 0 HZ2 LYS A 58 -19.415 10.497 -11.348 1.00 53.53 H new ATOM 0 HZ3 LYS A 58 -20.307 10.774 -12.766 1.00 53.53 H new ATOM 963 N CYS A 59 -16.567 12.071 -8.184 1.00 33.10 N ATOM 964 CA CYS A 59 -16.419 10.652 -7.911 1.00 34.13 C ATOM 965 C CYS A 59 -15.630 10.448 -6.621 1.00 54.52 C ATOM 966 O CYS A 59 -15.908 9.530 -5.849 1.00 43.35 O ATOM 967 CB CYS A 59 -15.724 9.952 -9.084 1.00 62.44 C ATOM 968 SG CYS A 59 -15.431 8.183 -8.831 1.00 41.24 S ATOM 0 H CYS A 59 -15.827 12.468 -8.762 1.00 33.10 H new ATOM 0 HA CYS A 59 -17.409 10.212 -7.788 1.00 34.13 H new ATOM 0 HB2 CYS A 59 -16.330 10.083 -9.980 1.00 62.44 H new ATOM 0 HB3 CYS A 59 -14.769 10.443 -9.270 1.00 62.44 H new ATOM 0 HG CYS A 59 -15.483 7.912 -7.561 1.00 41.24 H new ATOM 974 N GLY A 60 -14.652 11.315 -6.387 1.00 71.24 N ATOM 975 CA GLY A 60 -13.854 11.221 -5.183 1.00 74.03 C ATOM 976 C GLY A 60 -13.130 12.514 -4.862 1.00 63.32 C ATOM 977 O GLY A 60 -12.213 12.905 -5.582 1.00 70.33 O ATOM 0 H GLY A 60 -14.399 12.081 -7.011 1.00 71.24 H new ATOM 0 HA2 GLY A 60 -14.497 10.951 -4.345 1.00 74.03 H new ATOM 0 HA3 GLY A 60 -13.125 10.419 -5.296 1.00 74.03 H new ATOM 981 N PRO A 61 -13.545 13.220 -3.801 1.00 31.50 N ATOM 982 CA PRO A 61 -12.886 14.445 -3.348 1.00 13.44 C ATOM 983 C PRO A 61 -11.630 14.166 -2.519 1.00 45.24 C ATOM 984 O PRO A 61 -10.682 14.951 -2.525 1.00 60.31 O ATOM 985 CB PRO A 61 -13.950 15.135 -2.477 1.00 24.02 C ATOM 986 CG PRO A 61 -15.175 14.276 -2.553 1.00 22.20 C ATOM 987 CD PRO A 61 -14.715 12.912 -2.977 1.00 41.15 C ATOM 0 HA PRO A 61 -12.547 15.048 -4.190 1.00 13.44 H new ATOM 0 HB2 PRO A 61 -13.606 15.232 -1.447 1.00 24.02 H new ATOM 0 HB3 PRO A 61 -14.157 16.141 -2.840 1.00 24.02 H new ATOM 0 HG2 PRO A 61 -15.678 14.232 -1.587 1.00 22.20 H new ATOM 0 HG3 PRO A 61 -15.890 14.683 -3.267 1.00 22.20 H new ATOM 0 HD2 PRO A 61 -14.457 12.286 -2.123 1.00 41.15 H new ATOM 0 HD3 PRO A 61 -15.482 12.381 -3.541 1.00 41.15 H new ATOM 995 N GLY A 62 -11.626 13.040 -1.812 1.00 73.44 N ATOM 996 CA GLY A 62 -10.505 12.699 -0.955 1.00 64.10 C ATOM 997 C GLY A 62 -9.498 11.822 -1.665 1.00 61.12 C ATOM 998 O GLY A 62 -8.415 11.548 -1.145 1.00 13.15 O ATOM 0 H GLY A 62 -12.382 12.355 -1.818 1.00 73.44 H new ATOM 0 HA2 GLY A 62 -10.016 13.612 -0.617 1.00 64.10 H new ATOM 0 HA3 GLY A 62 -10.871 12.185 -0.066 1.00 64.10 H new ATOM 1002 N GLU A 63 -9.873 11.380 -2.855 1.00 1.32 N ATOM 1003 CA GLU A 63 -9.025 10.552 -3.692 1.00 65.34 C ATOM 1004 C GLU A 63 -9.576 10.554 -5.109 1.00 33.21 C ATOM 1005 O GLU A 63 -10.785 10.477 -5.315 1.00 23.33 O ATOM 1006 CB GLU A 63 -8.943 9.117 -3.156 1.00 61.11 C ATOM 1007 CG GLU A 63 -10.282 8.396 -3.097 1.00 54.52 C ATOM 1008 CD GLU A 63 -10.135 6.931 -2.749 1.00 54.45 C ATOM 1009 OE1 GLU A 63 -9.716 6.149 -3.629 1.00 63.21 O ATOM 1010 OE2 GLU A 63 -10.422 6.552 -1.596 1.00 64.04 O ATOM 0 H GLU A 63 -10.782 11.588 -3.269 1.00 1.32 H new ATOM 0 HA GLU A 63 -8.015 10.963 -3.686 1.00 65.34 H new ATOM 0 HB2 GLU A 63 -8.262 8.544 -3.786 1.00 61.11 H new ATOM 0 HB3 GLU A 63 -8.510 9.139 -2.156 1.00 61.11 H new ATOM 0 HG2 GLU A 63 -10.920 8.880 -2.357 1.00 54.52 H new ATOM 0 HG3 GLU A 63 -10.784 8.489 -4.060 1.00 54.52 H new ATOM 1017 N CYS A 64 -8.697 10.636 -6.082 1.00 22.33 N ATOM 1018 CA CYS A 64 -9.116 10.743 -7.465 1.00 1.33 C ATOM 1019 C CYS A 64 -8.442 9.669 -8.307 1.00 3.42 C ATOM 1020 O CYS A 64 -7.627 8.899 -7.801 1.00 73.21 O ATOM 1021 CB CYS A 64 -8.812 12.141 -8.004 1.00 33.21 C ATOM 1022 SG CYS A 64 -9.645 13.475 -7.109 1.00 41.53 S ATOM 0 H CYS A 64 -7.686 10.631 -5.943 1.00 22.33 H new ATOM 0 HA CYS A 64 -10.193 10.587 -7.521 1.00 1.33 H new ATOM 0 HB2 CYS A 64 -7.736 12.308 -7.964 1.00 33.21 H new ATOM 0 HB3 CYS A 64 -9.103 12.185 -9.054 1.00 33.21 H new ATOM 0 HG CYS A 64 -10.758 13.031 -6.605 1.00 41.53 H new ATOM 1028 N ARG A 65 -8.810 9.596 -9.576 1.00 63.52 N ATOM 1029 CA ARG A 65 -8.276 8.582 -10.474 1.00 43.40 C ATOM 1030 C ARG A 65 -7.450 9.242 -11.569 1.00 34.55 C ATOM 1031 O ARG A 65 -7.723 10.373 -11.964 1.00 34.11 O ATOM 1032 CB ARG A 65 -9.404 7.762 -11.100 1.00 21.23 C ATOM 1033 CG ARG A 65 -10.020 6.700 -10.188 1.00 43.03 C ATOM 1034 CD ARG A 65 -10.702 7.298 -8.966 1.00 62.35 C ATOM 1035 NE ARG A 65 -11.368 6.279 -8.155 1.00 32.30 N ATOM 1036 CZ ARG A 65 -11.140 6.083 -6.856 1.00 53.24 C ATOM 1037 NH1 ARG A 65 -10.219 6.793 -6.217 1.00 33.32 N ATOM 1038 NH2 ARG A 65 -11.830 5.160 -6.198 1.00 55.45 N ATOM 0 H ARG A 65 -9.480 10.230 -10.010 1.00 63.52 H new ATOM 0 HA ARG A 65 -7.641 7.911 -9.895 1.00 43.40 H new ATOM 0 HB2 ARG A 65 -10.192 8.443 -11.421 1.00 21.23 H new ATOM 0 HB3 ARG A 65 -9.022 7.272 -11.995 1.00 21.23 H new ATOM 0 HG2 ARG A 65 -10.746 6.117 -10.755 1.00 43.03 H new ATOM 0 HG3 ARG A 65 -9.241 6.010 -9.863 1.00 43.03 H new ATOM 0 HD2 ARG A 65 -9.963 7.819 -8.358 1.00 62.35 H new ATOM 0 HD3 ARG A 65 -11.433 8.041 -9.286 1.00 62.35 H new ATOM 0 HE ARG A 65 -12.053 5.678 -8.614 1.00 32.30 H new ATOM 0 HH11 ARG A 65 -9.678 7.496 -6.720 1.00 33.32 H new ATOM 0 HH12 ARG A 65 -10.052 6.635 -5.223 1.00 33.32 H new ATOM 0 HH21 ARG A 65 -12.532 4.604 -6.686 1.00 55.45 H new ATOM 0 HH22 ARG A 65 -11.659 5.007 -5.204 1.00 55.45 H new ATOM 1052 N TYR A 66 -6.466 8.519 -12.076 1.00 70.05 N ATOM 1053 CA TYR A 66 -5.474 9.094 -12.976 1.00 13.52 C ATOM 1054 C TYR A 66 -5.557 8.446 -14.346 1.00 12.54 C ATOM 1055 O TYR A 66 -6.319 7.502 -14.536 1.00 71.24 O ATOM 1056 CB TYR A 66 -4.071 8.912 -12.386 1.00 74.22 C ATOM 1057 CG TYR A 66 -3.749 7.483 -12.001 1.00 4.14 C ATOM 1058 CD1 TYR A 66 -4.151 6.968 -10.775 1.00 55.34 C ATOM 1059 CD2 TYR A 66 -3.044 6.652 -12.861 1.00 31.35 C ATOM 1060 CE1 TYR A 66 -3.862 5.667 -10.419 1.00 55.51 C ATOM 1061 CE2 TYR A 66 -2.752 5.349 -12.509 1.00 50.12 C ATOM 1062 CZ TYR A 66 -3.163 4.862 -11.287 1.00 11.22 C ATOM 1063 OH TYR A 66 -2.874 3.566 -10.932 1.00 14.05 O ATOM 0 H TYR A 66 -6.330 7.527 -11.880 1.00 70.05 H new ATOM 0 HA TYR A 66 -5.678 10.159 -13.089 1.00 13.52 H new ATOM 0 HB2 TYR A 66 -3.335 9.257 -13.112 1.00 74.22 H new ATOM 0 HB3 TYR A 66 -3.973 9.546 -11.505 1.00 74.22 H new ATOM 0 HD1 TYR A 66 -4.699 7.597 -10.089 1.00 55.34 H new ATOM 0 HD2 TYR A 66 -2.719 7.030 -13.819 1.00 31.35 H new ATOM 0 HE1 TYR A 66 -4.184 5.282 -9.462 1.00 55.51 H new ATOM 0 HE2 TYR A 66 -2.204 4.714 -13.189 1.00 50.12 H new ATOM 0 HH TYR A 66 -2.376 3.132 -11.656 1.00 14.05 H new ATOM 1073 N GLY A 67 -4.782 8.943 -15.301 1.00 1.34 N ATOM 1074 CA GLY A 67 -4.810 8.357 -16.620 1.00 11.23 C ATOM 1075 C GLY A 67 -3.791 8.942 -17.571 1.00 31.54 C ATOM 1076 O GLY A 67 -3.081 9.896 -17.240 1.00 13.01 O ATOM 0 H GLY A 67 -4.144 9.730 -15.186 1.00 1.34 H new ATOM 0 HA2 GLY A 67 -4.638 7.284 -16.534 1.00 11.23 H new ATOM 0 HA3 GLY A 67 -5.806 8.488 -17.044 1.00 11.23 H new ATOM 1080 N LEU A 68 -3.723 8.351 -18.756 1.00 0.24 N ATOM 1081 CA LEU A 68 -2.860 8.833 -19.818 1.00 24.14 C ATOM 1082 C LEU A 68 -3.703 9.627 -20.803 1.00 25.14 C ATOM 1083 O LEU A 68 -4.744 9.157 -21.268 1.00 52.05 O ATOM 1084 CB LEU A 68 -2.141 7.644 -20.497 1.00 5.21 C ATOM 1085 CG LEU A 68 -1.146 7.976 -21.623 1.00 24.40 C ATOM 1086 CD1 LEU A 68 -1.865 8.248 -22.938 1.00 62.51 C ATOM 1087 CD2 LEU A 68 -0.276 9.161 -21.240 1.00 75.31 C ATOM 0 H LEU A 68 -4.266 7.524 -19.005 1.00 0.24 H new ATOM 0 HA LEU A 68 -2.086 9.487 -19.417 1.00 24.14 H new ATOM 0 HB2 LEU A 68 -1.607 7.087 -19.727 1.00 5.21 H new ATOM 0 HB3 LEU A 68 -2.901 6.977 -20.903 1.00 5.21 H new ATOM 0 HG LEU A 68 -0.506 7.105 -21.764 1.00 24.40 H new ATOM 0 HD11 LEU A 68 -1.133 8.479 -23.712 1.00 62.51 H new ATOM 0 HD12 LEU A 68 -2.436 7.366 -23.230 1.00 62.51 H new ATOM 0 HD13 LEU A 68 -2.542 9.094 -22.815 1.00 62.51 H new ATOM 0 HD21 LEU A 68 0.420 9.378 -22.050 1.00 75.31 H new ATOM 0 HD22 LEU A 68 -0.906 10.032 -21.060 1.00 75.31 H new ATOM 0 HD23 LEU A 68 0.283 8.924 -20.335 1.00 75.31 H new ATOM 1099 N PHE A 69 -3.262 10.837 -21.093 1.00 70.24 N ATOM 1100 CA PHE A 69 -4.009 11.744 -21.942 1.00 23.21 C ATOM 1101 C PHE A 69 -3.320 11.903 -23.289 1.00 25.12 C ATOM 1102 O PHE A 69 -2.331 12.624 -23.397 1.00 74.43 O ATOM 1103 CB PHE A 69 -4.098 13.107 -21.258 1.00 0.45 C ATOM 1104 CG PHE A 69 -5.450 13.760 -21.328 1.00 44.40 C ATOM 1105 CD1 PHE A 69 -6.230 13.664 -22.468 1.00 30.14 C ATOM 1106 CD2 PHE A 69 -5.938 14.476 -20.246 1.00 62.10 C ATOM 1107 CE1 PHE A 69 -7.468 14.270 -22.530 1.00 75.45 C ATOM 1108 CE2 PHE A 69 -7.176 15.085 -20.303 1.00 64.11 C ATOM 1109 CZ PHE A 69 -7.941 14.980 -21.447 1.00 35.52 C ATOM 0 H PHE A 69 -2.380 11.217 -20.748 1.00 70.24 H new ATOM 0 HA PHE A 69 -5.007 11.337 -22.104 1.00 23.21 H new ATOM 0 HB2 PHE A 69 -3.820 12.991 -20.210 1.00 0.45 H new ATOM 0 HB3 PHE A 69 -3.364 13.774 -21.711 1.00 0.45 H new ATOM 0 HD1 PHE A 69 -5.865 13.108 -23.319 1.00 30.14 H new ATOM 0 HD2 PHE A 69 -5.343 14.558 -19.348 1.00 62.10 H new ATOM 0 HE1 PHE A 69 -8.066 14.188 -23.426 1.00 75.45 H new ATOM 0 HE2 PHE A 69 -7.545 15.642 -19.454 1.00 64.11 H new ATOM 0 HZ PHE A 69 -8.910 15.454 -21.494 1.00 35.52 H new ATOM 1119 N ASP A 70 -3.831 11.232 -24.303 1.00 4.23 N ATOM 1120 CA ASP A 70 -3.313 11.399 -25.653 1.00 52.44 C ATOM 1121 C ASP A 70 -4.367 12.090 -26.488 1.00 41.04 C ATOM 1122 O ASP A 70 -5.385 11.498 -26.852 1.00 32.15 O ATOM 1123 CB ASP A 70 -2.917 10.061 -26.277 1.00 4.13 C ATOM 1124 CG ASP A 70 -2.337 10.217 -27.674 1.00 74.11 C ATOM 1125 OD1 ASP A 70 -1.732 11.271 -27.958 1.00 25.44 O ATOM 1126 OD2 ASP A 70 -2.477 9.277 -28.488 1.00 21.44 O ATOM 0 H ASP A 70 -4.601 10.568 -24.222 1.00 4.23 H new ATOM 0 HA ASP A 70 -2.409 12.006 -25.615 1.00 52.44 H new ATOM 0 HB2 ASP A 70 -2.186 9.568 -25.637 1.00 4.13 H new ATOM 0 HB3 ASP A 70 -3.791 9.412 -26.321 1.00 4.13 H new ATOM 1131 N PHE A 71 -4.144 13.360 -26.748 1.00 1.31 N ATOM 1132 CA PHE A 71 -5.164 14.182 -27.368 1.00 44.51 C ATOM 1133 C PHE A 71 -4.582 15.097 -28.426 1.00 53.43 C ATOM 1134 O PHE A 71 -3.400 15.447 -28.390 1.00 11.01 O ATOM 1135 CB PHE A 71 -5.906 15.002 -26.312 1.00 72.20 C ATOM 1136 CG PHE A 71 -5.023 15.923 -25.515 1.00 70.24 C ATOM 1137 CD1 PHE A 71 -4.332 15.457 -24.409 1.00 13.34 C ATOM 1138 CD2 PHE A 71 -4.888 17.254 -25.871 1.00 44.31 C ATOM 1139 CE1 PHE A 71 -3.524 16.298 -23.675 1.00 41.43 C ATOM 1140 CE2 PHE A 71 -4.081 18.099 -25.141 1.00 3.04 C ATOM 1141 CZ PHE A 71 -3.398 17.621 -24.040 1.00 43.44 C ATOM 0 H PHE A 71 -3.271 13.845 -26.542 1.00 1.31 H new ATOM 0 HA PHE A 71 -5.869 13.512 -27.859 1.00 44.51 H new ATOM 0 HB2 PHE A 71 -6.679 15.593 -26.804 1.00 72.20 H new ATOM 0 HB3 PHE A 71 -6.412 14.321 -25.628 1.00 72.20 H new ATOM 0 HD1 PHE A 71 -4.428 14.421 -24.118 1.00 13.34 H new ATOM 0 HD2 PHE A 71 -5.421 17.634 -26.730 1.00 44.31 H new ATOM 0 HE1 PHE A 71 -2.990 15.921 -22.815 1.00 41.43 H new ATOM 0 HE2 PHE A 71 -3.983 19.135 -25.430 1.00 3.04 H new ATOM 0 HZ PHE A 71 -2.766 18.283 -23.466 1.00 43.44 H new ATOM 1151 N GLU A 72 -5.442 15.502 -29.345 1.00 71.53 N ATOM 1152 CA GLU A 72 -5.049 16.330 -30.467 1.00 33.23 C ATOM 1153 C GLU A 72 -5.139 17.810 -30.106 1.00 31.32 C ATOM 1154 O GLU A 72 -6.191 18.300 -29.693 1.00 65.22 O ATOM 1155 CB GLU A 72 -5.950 16.019 -31.666 1.00 33.24 C ATOM 1156 CG GLU A 72 -7.427 15.934 -31.303 1.00 71.01 C ATOM 1157 CD GLU A 72 -8.326 15.728 -32.504 1.00 32.15 C ATOM 1158 OE1 GLU A 72 -8.365 14.599 -33.034 1.00 22.32 O ATOM 1159 OE2 GLU A 72 -8.999 16.698 -32.918 1.00 42.53 O ATOM 0 H GLU A 72 -6.434 15.264 -29.332 1.00 71.53 H new ATOM 0 HA GLU A 72 -4.013 16.110 -30.724 1.00 33.23 H new ATOM 0 HB2 GLU A 72 -5.813 16.790 -32.424 1.00 33.24 H new ATOM 0 HB3 GLU A 72 -5.637 15.075 -32.111 1.00 33.24 H new ATOM 0 HG2 GLU A 72 -7.575 15.113 -30.601 1.00 71.01 H new ATOM 0 HG3 GLU A 72 -7.722 16.849 -30.790 1.00 71.01 H new ATOM 1166 N TYR A 73 -4.022 18.508 -30.242 1.00 63.33 N ATOM 1167 CA TYR A 73 -3.978 19.938 -29.989 1.00 41.11 C ATOM 1168 C TYR A 73 -3.239 20.629 -31.128 1.00 1.22 C ATOM 1169 O TYR A 73 -2.134 20.227 -31.496 1.00 55.02 O ATOM 1170 CB TYR A 73 -3.284 20.220 -28.650 1.00 53.10 C ATOM 1171 CG TYR A 73 -3.973 21.272 -27.807 1.00 50.23 C ATOM 1172 CD1 TYR A 73 -5.265 21.072 -27.337 1.00 34.40 C ATOM 1173 CD2 TYR A 73 -3.330 22.456 -27.468 1.00 54.33 C ATOM 1174 CE1 TYR A 73 -5.896 22.021 -26.556 1.00 22.40 C ATOM 1175 CE2 TYR A 73 -3.954 23.409 -26.684 1.00 24.42 C ATOM 1176 CZ TYR A 73 -5.236 23.186 -26.232 1.00 21.13 C ATOM 1177 OH TYR A 73 -5.859 24.131 -25.450 1.00 4.13 O ATOM 0 H TYR A 73 -3.130 18.104 -30.528 1.00 63.33 H new ATOM 0 HA TYR A 73 -4.995 20.327 -29.934 1.00 41.11 H new ATOM 0 HB2 TYR A 73 -3.227 19.293 -28.080 1.00 53.10 H new ATOM 0 HB3 TYR A 73 -2.260 20.538 -28.844 1.00 53.10 H new ATOM 0 HD1 TYR A 73 -5.785 20.159 -27.586 1.00 34.40 H new ATOM 0 HD2 TYR A 73 -2.326 22.635 -27.823 1.00 54.33 H new ATOM 0 HE1 TYR A 73 -6.902 21.850 -26.201 1.00 22.40 H new ATOM 0 HE2 TYR A 73 -3.439 24.323 -26.427 1.00 24.42 H new ATOM 0 HH TYR A 73 -5.256 24.892 -25.314 1.00 4.13 H new ATOM 1187 N MET A 74 -3.852 21.658 -31.688 1.00 62.31 N ATOM 1188 CA MET A 74 -3.287 22.345 -32.840 1.00 23.04 C ATOM 1189 C MET A 74 -2.642 23.660 -32.423 1.00 14.34 C ATOM 1190 O MET A 74 -3.207 24.417 -31.634 1.00 34.14 O ATOM 1191 CB MET A 74 -4.369 22.577 -33.902 1.00 55.33 C ATOM 1192 CG MET A 74 -5.556 23.394 -33.417 1.00 14.43 C ATOM 1193 SD MET A 74 -6.952 23.335 -34.562 1.00 21.12 S ATOM 1194 CE MET A 74 -6.186 23.927 -36.070 1.00 61.14 C ATOM 0 H MET A 74 -4.742 22.037 -31.364 1.00 62.31 H new ATOM 0 HA MET A 74 -2.510 21.715 -33.273 1.00 23.04 H new ATOM 0 HB2 MET A 74 -3.920 23.082 -34.757 1.00 55.33 H new ATOM 0 HB3 MET A 74 -4.728 21.610 -34.255 1.00 55.33 H new ATOM 0 HG2 MET A 74 -5.874 23.023 -32.442 1.00 14.43 H new ATOM 0 HG3 MET A 74 -5.247 24.430 -33.279 1.00 14.43 H new ATOM 0 HE1 MET A 74 -6.958 24.149 -36.807 1.00 61.14 H new ATOM 0 HE2 MET A 74 -5.616 24.831 -35.858 1.00 61.14 H new ATOM 0 HE3 MET A 74 -5.518 23.161 -36.464 1.00 61.14 H new ATOM 1204 N HIS A 75 -1.445 23.912 -32.932 1.00 40.32 N ATOM 1205 CA HIS A 75 -0.728 25.145 -32.629 1.00 23.42 C ATOM 1206 C HIS A 75 -0.275 25.826 -33.909 1.00 43.35 C ATOM 1207 O HIS A 75 0.210 25.168 -34.831 1.00 11.53 O ATOM 1208 CB HIS A 75 0.514 24.884 -31.768 1.00 64.04 C ATOM 1209 CG HIS A 75 0.254 24.241 -30.442 1.00 53.31 C ATOM 1210 ND1 HIS A 75 -0.259 24.914 -29.358 1.00 64.43 N ATOM 1211 CD2 HIS A 75 0.500 22.983 -30.018 1.00 34.33 C ATOM 1212 CE1 HIS A 75 -0.309 24.099 -28.322 1.00 14.53 C ATOM 1213 NE2 HIS A 75 0.147 22.915 -28.693 1.00 0.22 N ATOM 0 H HIS A 75 -0.948 23.279 -33.558 1.00 40.32 H new ATOM 0 HA HIS A 75 -1.421 25.783 -32.080 1.00 23.42 H new ATOM 0 HB2 HIS A 75 1.199 24.250 -32.332 1.00 64.04 H new ATOM 0 HB3 HIS A 75 1.023 25.833 -31.599 1.00 64.04 H new ATOM 0 HD2 HIS A 75 0.902 22.176 -30.613 1.00 34.33 H new ATOM 0 HE1 HIS A 75 -0.664 24.356 -27.335 1.00 14.53 H new ATOM 0 HE2 HIS A 75 0.224 22.091 -28.096 1.00 0.22 H new ATOM 1222 N GLN A 76 -0.441 27.134 -33.972 1.00 45.53 N ATOM 1223 CA GLN A 76 0.152 27.915 -35.041 1.00 61.11 C ATOM 1224 C GLN A 76 1.442 28.560 -34.534 1.00 14.01 C ATOM 1225 O GLN A 76 1.423 29.392 -33.623 1.00 2.43 O ATOM 1226 CB GLN A 76 -0.829 28.970 -35.568 1.00 60.12 C ATOM 1227 CG GLN A 76 -1.352 29.926 -34.511 1.00 43.32 C ATOM 1228 CD GLN A 76 -2.065 31.117 -35.115 1.00 74.50 C ATOM 1229 OE1 GLN A 76 -2.676 31.019 -36.181 1.00 71.30 O ATOM 1230 NE2 GLN A 76 -1.973 32.254 -34.451 1.00 70.31 N ATOM 0 H GLN A 76 -0.980 27.677 -33.297 1.00 45.53 H new ATOM 0 HA GLN A 76 0.388 27.256 -35.877 1.00 61.11 H new ATOM 0 HB2 GLN A 76 -0.336 29.547 -36.350 1.00 60.12 H new ATOM 0 HB3 GLN A 76 -1.675 28.462 -36.031 1.00 60.12 H new ATOM 0 HG2 GLN A 76 -2.035 29.394 -33.849 1.00 43.32 H new ATOM 0 HG3 GLN A 76 -0.522 30.275 -33.898 1.00 43.32 H new ATOM 0 HE21 GLN A 76 -1.457 32.291 -33.572 1.00 70.31 H new ATOM 0 HE22 GLN A 76 -2.418 33.096 -34.817 1.00 70.31 H new ATOM 1239 N CYS A 77 2.564 28.157 -35.109 1.00 32.53 N ATOM 1240 CA CYS A 77 3.865 28.589 -34.621 1.00 23.30 C ATOM 1241 C CYS A 77 4.320 29.849 -35.348 1.00 30.12 C ATOM 1242 O CYS A 77 3.920 30.094 -36.489 1.00 73.14 O ATOM 1243 CB CYS A 77 4.892 27.464 -34.798 1.00 45.51 C ATOM 1244 SG CYS A 77 6.492 27.780 -34.009 1.00 11.23 S ATOM 0 H CYS A 77 2.601 27.532 -35.914 1.00 32.53 H new ATOM 0 HA CYS A 77 3.780 28.822 -33.560 1.00 23.30 H new ATOM 0 HB2 CYS A 77 4.476 26.542 -34.392 1.00 45.51 H new ATOM 0 HB3 CYS A 77 5.052 27.299 -35.863 1.00 45.51 H new ATOM 0 HG CYS A 77 7.285 26.770 -34.216 1.00 11.23 H new ATOM 1250 N GLN A 78 5.122 30.660 -34.653 1.00 33.22 N ATOM 1251 CA GLN A 78 5.706 31.887 -35.207 1.00 72.42 C ATOM 1252 C GLN A 78 4.627 32.945 -35.448 1.00 62.21 C ATOM 1253 O GLN A 78 4.890 34.003 -36.017 1.00 32.42 O ATOM 1254 CB GLN A 78 6.465 31.596 -36.512 1.00 23.33 C ATOM 1255 CG GLN A 78 7.516 30.501 -36.384 1.00 70.22 C ATOM 1256 CD GLN A 78 8.180 30.164 -37.706 1.00 30.13 C ATOM 1257 OE1 GLN A 78 7.694 29.323 -38.463 1.00 13.22 O ATOM 1258 NE2 GLN A 78 9.307 30.798 -37.983 1.00 54.05 N ATOM 0 H GLN A 78 5.387 30.484 -33.684 1.00 33.22 H new ATOM 0 HA GLN A 78 6.415 32.275 -34.476 1.00 72.42 H new ATOM 0 HB2 GLN A 78 5.748 31.310 -37.282 1.00 23.33 H new ATOM 0 HB3 GLN A 78 6.948 32.512 -36.852 1.00 23.33 H new ATOM 0 HG2 GLN A 78 8.277 30.816 -35.671 1.00 70.22 H new ATOM 0 HG3 GLN A 78 7.051 29.603 -35.977 1.00 70.22 H new ATOM 0 HE21 GLN A 78 9.678 31.488 -37.330 1.00 54.05 H new ATOM 0 HE22 GLN A 78 9.806 30.597 -38.850 1.00 54.05 H new ATOM 1267 N GLY A 79 3.411 32.662 -34.997 1.00 35.21 N ATOM 1268 CA GLY A 79 2.299 33.568 -35.229 1.00 71.14 C ATOM 1269 C GLY A 79 1.636 33.316 -36.571 1.00 44.44 C ATOM 1270 O GLY A 79 0.609 33.913 -36.891 1.00 20.12 O ATOM 0 H GLY A 79 3.173 31.820 -34.473 1.00 35.21 H new ATOM 0 HA2 GLY A 79 1.564 33.452 -34.433 1.00 71.14 H new ATOM 0 HA3 GLY A 79 2.654 34.598 -35.187 1.00 71.14 H new ATOM 1274 N THR A 80 2.231 32.428 -37.355 1.00 21.14 N ATOM 1275 CA THR A 80 1.706 32.078 -38.664 1.00 52.31 C ATOM 1276 C THR A 80 0.784 30.868 -38.540 1.00 64.43 C ATOM 1277 O THR A 80 1.046 29.976 -37.733 1.00 63.24 O ATOM 1278 CB THR A 80 2.861 31.771 -39.637 1.00 42.32 C ATOM 1279 OG1 THR A 80 3.799 32.855 -39.617 1.00 21.22 O ATOM 1280 CG2 THR A 80 2.355 31.565 -41.059 1.00 73.12 C ATOM 0 H THR A 80 3.086 31.933 -37.102 1.00 21.14 H new ATOM 0 HA THR A 80 1.138 32.921 -39.057 1.00 52.31 H new ATOM 0 HB THR A 80 3.342 30.848 -39.313 1.00 42.32 H new ATOM 0 HG1 THR A 80 4.536 32.662 -40.234 1.00 21.22 H new ATOM 0 HG21 THR A 80 3.197 31.351 -41.717 1.00 73.12 H new ATOM 0 HG22 THR A 80 1.657 30.728 -41.079 1.00 73.12 H new ATOM 0 HG23 THR A 80 1.849 32.468 -41.400 1.00 73.12 H new ATOM 1288 N SER A 81 -0.291 30.844 -39.323 1.00 43.02 N ATOM 1289 CA SER A 81 -1.298 29.796 -39.215 1.00 64.45 C ATOM 1290 C SER A 81 -0.774 28.456 -39.729 1.00 45.24 C ATOM 1291 O SER A 81 -1.073 28.036 -40.849 1.00 4.25 O ATOM 1292 CB SER A 81 -2.579 30.193 -39.963 1.00 34.23 C ATOM 1293 OG SER A 81 -3.598 29.216 -39.802 1.00 62.00 O ATOM 0 H SER A 81 -0.486 31.542 -40.041 1.00 43.02 H new ATOM 0 HA SER A 81 -1.533 29.677 -38.157 1.00 64.45 H new ATOM 0 HB2 SER A 81 -2.934 31.155 -39.594 1.00 34.23 H new ATOM 0 HB3 SER A 81 -2.359 30.320 -41.023 1.00 34.23 H new ATOM 0 HG SER A 81 -3.361 28.615 -39.065 1.00 62.00 H new ATOM 1299 N GLU A 82 0.054 27.816 -38.921 1.00 63.20 N ATOM 1300 CA GLU A 82 0.452 26.445 -39.170 1.00 41.53 C ATOM 1301 C GLU A 82 -0.668 25.522 -38.728 1.00 32.52 C ATOM 1302 O GLU A 82 -1.065 24.617 -39.464 1.00 64.31 O ATOM 1303 CB GLU A 82 1.748 26.116 -38.427 1.00 64.13 C ATOM 1304 CG GLU A 82 2.967 26.809 -39.011 1.00 70.34 C ATOM 1305 CD GLU A 82 3.222 26.405 -40.448 1.00 63.41 C ATOM 1306 OE1 GLU A 82 3.697 25.273 -40.674 1.00 71.24 O ATOM 1307 OE2 GLU A 82 2.934 27.210 -41.359 1.00 31.21 O ATOM 0 H GLU A 82 0.464 28.228 -38.083 1.00 63.20 H new ATOM 0 HA GLU A 82 0.638 26.307 -40.235 1.00 41.53 H new ATOM 0 HB2 GLU A 82 1.642 26.403 -37.381 1.00 64.13 H new ATOM 0 HB3 GLU A 82 1.907 25.038 -38.447 1.00 64.13 H new ATOM 0 HG2 GLU A 82 2.829 27.889 -38.958 1.00 70.34 H new ATOM 0 HG3 GLU A 82 3.843 26.570 -38.407 1.00 70.34 H new ATOM 1314 N SER A 83 -1.171 25.778 -37.519 1.00 54.24 N ATOM 1315 CA SER A 83 -2.333 25.079 -36.977 1.00 72.54 C ATOM 1316 C SER A 83 -2.147 23.566 -37.015 1.00 74.01 C ATOM 1317 O SER A 83 -3.110 22.814 -37.168 1.00 44.42 O ATOM 1318 CB SER A 83 -3.578 25.488 -37.762 1.00 65.54 C ATOM 1319 OG SER A 83 -3.712 26.902 -37.783 1.00 5.31 O ATOM 0 H SER A 83 -0.781 26.478 -36.888 1.00 54.24 H new ATOM 0 HA SER A 83 -2.451 25.362 -35.931 1.00 72.54 H new ATOM 0 HB2 SER A 83 -3.513 25.108 -38.782 1.00 65.54 H new ATOM 0 HB3 SER A 83 -4.463 25.040 -37.311 1.00 65.54 H new ATOM 0 HG SER A 83 -4.513 27.147 -38.291 1.00 5.31 H new ATOM 1325 N SER A 84 -0.905 23.131 -36.852 1.00 53.02 N ATOM 1326 CA SER A 84 -0.579 21.720 -36.883 1.00 53.54 C ATOM 1327 C SER A 84 -1.234 20.999 -35.713 1.00 42.51 C ATOM 1328 O SER A 84 -0.843 21.184 -34.556 1.00 75.21 O ATOM 1329 CB SER A 84 0.941 21.538 -36.845 1.00 32.13 C ATOM 1330 OG SER A 84 1.560 22.236 -37.916 1.00 13.14 O ATOM 0 H SER A 84 -0.104 23.744 -36.696 1.00 53.02 H new ATOM 0 HA SER A 84 -0.962 21.287 -37.807 1.00 53.54 H new ATOM 0 HB2 SER A 84 1.332 21.901 -35.894 1.00 32.13 H new ATOM 0 HB3 SER A 84 1.186 20.478 -36.906 1.00 32.13 H new ATOM 0 HG SER A 84 2.531 22.108 -37.872 1.00 13.14 H new ATOM 1336 N LYS A 85 -2.263 20.218 -36.012 1.00 61.21 N ATOM 1337 CA LYS A 85 -2.937 19.430 -34.997 1.00 33.30 C ATOM 1338 C LYS A 85 -2.118 18.193 -34.666 1.00 54.22 C ATOM 1339 O LYS A 85 -2.149 17.195 -35.386 1.00 44.12 O ATOM 1340 CB LYS A 85 -4.349 19.029 -35.444 1.00 75.12 C ATOM 1341 CG LYS A 85 -5.060 18.129 -34.441 1.00 2.10 C ATOM 1342 CD LYS A 85 -6.437 17.690 -34.921 1.00 55.02 C ATOM 1343 CE LYS A 85 -7.449 18.822 -34.856 1.00 30.12 C ATOM 1344 NZ LYS A 85 -8.836 18.338 -35.084 1.00 62.13 N ATOM 0 H LYS A 85 -2.647 20.115 -36.951 1.00 61.21 H new ATOM 0 HA LYS A 85 -3.033 20.046 -34.103 1.00 33.30 H new ATOM 0 HB2 LYS A 85 -4.943 19.929 -35.601 1.00 75.12 H new ATOM 0 HB3 LYS A 85 -4.288 18.516 -36.404 1.00 75.12 H new ATOM 0 HG2 LYS A 85 -4.447 17.248 -34.251 1.00 2.10 H new ATOM 0 HG3 LYS A 85 -5.161 18.657 -33.493 1.00 2.10 H new ATOM 0 HD2 LYS A 85 -6.365 17.326 -35.946 1.00 55.02 H new ATOM 0 HD3 LYS A 85 -6.785 16.857 -34.311 1.00 55.02 H new ATOM 0 HE2 LYS A 85 -7.389 19.307 -33.882 1.00 30.12 H new ATOM 0 HE3 LYS A 85 -7.200 19.575 -35.603 1.00 30.12 H new ATOM 0 HZ1 LYS A 85 -9.507 19.115 -34.915 1.00 62.13 H new ATOM 0 HZ2 LYS A 85 -8.931 18.006 -36.065 1.00 62.13 H new ATOM 0 HZ3 LYS A 85 -9.042 17.555 -34.432 1.00 62.13 H new ATOM 1358 N LYS A 86 -1.365 18.282 -33.590 1.00 23.02 N ATOM 1359 CA LYS A 86 -0.560 17.172 -33.131 1.00 24.44 C ATOM 1360 C LYS A 86 -1.179 16.567 -31.887 1.00 61.22 C ATOM 1361 O LYS A 86 -1.564 17.284 -30.963 1.00 20.41 O ATOM 1362 CB LYS A 86 0.873 17.629 -32.841 1.00 54.34 C ATOM 1363 CG LYS A 86 1.704 17.882 -34.091 1.00 34.54 C ATOM 1364 CD LYS A 86 2.050 16.582 -34.805 1.00 52.25 C ATOM 1365 CE LYS A 86 2.934 15.694 -33.942 1.00 31.34 C ATOM 1366 NZ LYS A 86 3.263 14.408 -34.612 1.00 44.12 N ATOM 0 H LYS A 86 -1.294 19.120 -33.013 1.00 23.02 H new ATOM 0 HA LYS A 86 -0.526 16.416 -33.916 1.00 24.44 H new ATOM 0 HB2 LYS A 86 0.840 18.543 -32.248 1.00 54.34 H new ATOM 0 HB3 LYS A 86 1.369 16.872 -32.233 1.00 54.34 H new ATOM 0 HG2 LYS A 86 1.154 18.535 -34.769 1.00 34.54 H new ATOM 0 HG3 LYS A 86 2.621 18.404 -33.820 1.00 34.54 H new ATOM 0 HD2 LYS A 86 1.134 16.049 -35.059 1.00 52.25 H new ATOM 0 HD3 LYS A 86 2.560 16.804 -35.743 1.00 52.25 H new ATOM 0 HE2 LYS A 86 3.856 16.224 -33.704 1.00 31.34 H new ATOM 0 HE3 LYS A 86 2.430 15.491 -32.997 1.00 31.34 H new ATOM 0 HZ1 LYS A 86 3.867 13.836 -33.988 1.00 44.12 H new ATOM 0 HZ2 LYS A 86 2.385 13.889 -34.817 1.00 44.12 H new ATOM 0 HZ3 LYS A 86 3.767 14.599 -35.501 1.00 44.12 H new ATOM 1380 N GLN A 87 -1.301 15.255 -31.876 1.00 23.34 N ATOM 1381 CA GLN A 87 -1.803 14.563 -30.708 1.00 71.42 C ATOM 1382 C GLN A 87 -0.622 13.994 -29.932 1.00 41.10 C ATOM 1383 O GLN A 87 0.270 13.372 -30.512 1.00 1.51 O ATOM 1384 CB GLN A 87 -2.831 13.491 -31.120 1.00 23.34 C ATOM 1385 CG GLN A 87 -2.379 12.047 -30.974 1.00 13.50 C ATOM 1386 CD GLN A 87 -3.419 11.071 -31.495 1.00 51.01 C ATOM 1387 OE1 GLN A 87 -4.132 11.365 -32.458 1.00 61.40 O ATOM 1388 NE2 GLN A 87 -3.539 9.925 -30.846 1.00 24.05 N ATOM 0 H GLN A 87 -1.060 14.649 -32.660 1.00 23.34 H new ATOM 0 HA GLN A 87 -2.333 15.251 -30.050 1.00 71.42 H new ATOM 0 HB2 GLN A 87 -3.732 13.631 -30.523 1.00 23.34 H new ATOM 0 HB3 GLN A 87 -3.108 13.661 -32.160 1.00 23.34 H new ATOM 0 HG2 GLN A 87 -1.444 11.903 -31.515 1.00 13.50 H new ATOM 0 HG3 GLN A 87 -2.176 11.835 -29.924 1.00 13.50 H new ATOM 0 HE21 GLN A 87 -2.929 9.721 -30.054 1.00 24.05 H new ATOM 0 HE22 GLN A 87 -4.241 9.245 -31.137 1.00 24.05 H new ATOM 1397 N LYS A 88 -0.576 14.280 -28.638 1.00 30.32 N ATOM 1398 CA LYS A 88 0.560 13.891 -27.814 1.00 65.03 C ATOM 1399 C LYS A 88 0.087 13.299 -26.500 1.00 4.52 C ATOM 1400 O LYS A 88 -0.878 13.783 -25.904 1.00 0.50 O ATOM 1401 CB LYS A 88 1.483 15.083 -27.516 1.00 72.51 C ATOM 1402 CG LYS A 88 2.054 15.782 -28.744 1.00 22.22 C ATOM 1403 CD LYS A 88 1.112 16.850 -29.283 1.00 51.51 C ATOM 1404 CE LYS A 88 0.812 17.919 -28.243 1.00 24.55 C ATOM 1405 NZ LYS A 88 2.039 18.633 -27.805 1.00 54.44 N ATOM 0 H LYS A 88 -1.311 14.779 -28.137 1.00 30.32 H new ATOM 0 HA LYS A 88 1.121 13.146 -28.378 1.00 65.03 H new ATOM 0 HB2 LYS A 88 0.929 15.813 -26.927 1.00 72.51 H new ATOM 0 HB3 LYS A 88 2.310 14.736 -26.897 1.00 72.51 H new ATOM 0 HG2 LYS A 88 3.011 16.238 -28.489 1.00 22.22 H new ATOM 0 HG3 LYS A 88 2.249 15.045 -29.523 1.00 22.22 H new ATOM 0 HD2 LYS A 88 1.556 17.315 -30.164 1.00 51.51 H new ATOM 0 HD3 LYS A 88 0.180 16.384 -29.604 1.00 51.51 H new ATOM 0 HE2 LYS A 88 0.103 18.637 -28.656 1.00 24.55 H new ATOM 0 HE3 LYS A 88 0.333 17.459 -27.379 1.00 24.55 H new ATOM 0 HZ1 LYS A 88 1.775 19.438 -27.202 1.00 54.44 H new ATOM 0 HZ2 LYS A 88 2.646 17.982 -27.267 1.00 54.44 H new ATOM 0 HZ3 LYS A 88 2.555 18.979 -28.639 1.00 54.44 H new ATOM 1419 N LEU A 89 0.789 12.273 -26.045 1.00 31.22 N ATOM 1420 CA LEU A 89 0.438 11.595 -24.811 1.00 45.12 C ATOM 1421 C LEU A 89 1.067 12.295 -23.614 1.00 54.52 C ATOM 1422 O LEU A 89 2.289 12.265 -23.429 1.00 31.25 O ATOM 1423 CB LEU A 89 0.902 10.134 -24.819 1.00 14.24 C ATOM 1424 CG LEU A 89 0.459 9.266 -26.008 1.00 44.34 C ATOM 1425 CD1 LEU A 89 1.272 9.576 -27.260 1.00 61.53 C ATOM 1426 CD2 LEU A 89 0.587 7.795 -25.655 1.00 54.23 C ATOM 0 H LEU A 89 1.609 11.891 -26.516 1.00 31.22 H new ATOM 0 HA LEU A 89 -0.649 11.625 -24.732 1.00 45.12 H new ATOM 0 HB2 LEU A 89 1.991 10.125 -24.780 1.00 14.24 H new ATOM 0 HB3 LEU A 89 0.547 9.661 -23.904 1.00 14.24 H new ATOM 0 HG LEU A 89 -0.585 9.498 -26.221 1.00 44.34 H new ATOM 0 HD11 LEU A 89 0.932 8.944 -28.080 1.00 61.53 H new ATOM 0 HD12 LEU A 89 1.139 10.624 -27.530 1.00 61.53 H new ATOM 0 HD13 LEU A 89 2.327 9.382 -27.066 1.00 61.53 H new ATOM 0 HD21 LEU A 89 0.271 7.188 -26.504 1.00 54.23 H new ATOM 0 HD22 LEU A 89 1.625 7.568 -25.413 1.00 54.23 H new ATOM 0 HD23 LEU A 89 -0.043 7.571 -24.794 1.00 54.23 H new ATOM 1438 N PHE A 90 0.233 12.923 -22.810 1.00 14.44 N ATOM 1439 CA PHE A 90 0.670 13.512 -21.560 1.00 30.11 C ATOM 1440 C PHE A 90 0.115 12.691 -20.405 1.00 4.12 C ATOM 1441 O PHE A 90 -1.072 12.376 -20.376 1.00 40.44 O ATOM 1442 CB PHE A 90 0.197 14.965 -21.459 1.00 12.13 C ATOM 1443 CG PHE A 90 0.745 15.841 -22.547 1.00 23.31 C ATOM 1444 CD1 PHE A 90 2.045 16.311 -22.482 1.00 72.34 C ATOM 1445 CD2 PHE A 90 -0.035 16.185 -23.638 1.00 32.43 C ATOM 1446 CE1 PHE A 90 2.557 17.110 -23.484 1.00 21.13 C ATOM 1447 CE2 PHE A 90 0.472 16.983 -24.644 1.00 60.30 C ATOM 1448 CZ PHE A 90 1.770 17.446 -24.567 1.00 1.00 C ATOM 0 H PHE A 90 -0.762 13.039 -23.003 1.00 14.44 H new ATOM 0 HA PHE A 90 1.759 13.509 -21.518 1.00 30.11 H new ATOM 0 HB2 PHE A 90 -0.892 14.989 -21.496 1.00 12.13 H new ATOM 0 HB3 PHE A 90 0.493 15.370 -20.491 1.00 12.13 H new ATOM 0 HD1 PHE A 90 2.666 16.050 -21.638 1.00 72.34 H new ATOM 0 HD2 PHE A 90 -1.051 15.825 -23.703 1.00 32.43 H new ATOM 0 HE1 PHE A 90 3.573 17.472 -23.421 1.00 21.13 H new ATOM 0 HE2 PHE A 90 -0.146 17.245 -25.490 1.00 60.30 H new ATOM 0 HZ PHE A 90 2.169 18.070 -25.353 1.00 1.00 H new ATOM 1458 N LEU A 91 0.962 12.354 -19.455 1.00 42.51 N ATOM 1459 CA LEU A 91 0.554 11.511 -18.344 1.00 20.11 C ATOM 1460 C LEU A 91 0.264 12.367 -17.125 1.00 12.42 C ATOM 1461 O LEU A 91 1.015 13.291 -16.818 1.00 0.13 O ATOM 1462 CB LEU A 91 1.647 10.490 -18.027 1.00 42.11 C ATOM 1463 CG LEU A 91 1.318 9.503 -16.907 1.00 33.52 C ATOM 1464 CD1 LEU A 91 0.119 8.643 -17.279 1.00 0.53 C ATOM 1465 CD2 LEU A 91 2.525 8.633 -16.602 1.00 65.41 C ATOM 0 H LEU A 91 1.938 12.649 -19.427 1.00 42.51 H new ATOM 0 HA LEU A 91 -0.353 10.974 -18.621 1.00 20.11 H new ATOM 0 HB2 LEU A 91 1.867 9.925 -18.933 1.00 42.11 H new ATOM 0 HB3 LEU A 91 2.556 11.028 -17.759 1.00 42.11 H new ATOM 0 HG LEU A 91 1.062 10.070 -16.012 1.00 33.52 H new ATOM 0 HD11 LEU A 91 -0.096 7.948 -16.467 1.00 0.53 H new ATOM 0 HD12 LEU A 91 -0.748 9.282 -17.450 1.00 0.53 H new ATOM 0 HD13 LEU A 91 0.341 8.082 -18.187 1.00 0.53 H new ATOM 0 HD21 LEU A 91 2.277 7.935 -15.803 1.00 65.41 H new ATOM 0 HD22 LEU A 91 2.807 8.076 -17.496 1.00 65.41 H new ATOM 0 HD23 LEU A 91 3.358 9.263 -16.289 1.00 65.41 H new ATOM 1477 N MET A 92 -0.831 12.078 -16.443 1.00 24.23 N ATOM 1478 CA MET A 92 -1.207 12.857 -15.278 1.00 44.23 C ATOM 1479 C MET A 92 -1.800 11.981 -14.188 1.00 41.42 C ATOM 1480 O MET A 92 -2.753 11.235 -14.414 1.00 50.10 O ATOM 1481 CB MET A 92 -2.183 13.977 -15.665 1.00 52.34 C ATOM 1482 CG MET A 92 -3.412 13.504 -16.430 1.00 22.40 C ATOM 1483 SD MET A 92 -4.494 14.871 -16.906 1.00 65.13 S ATOM 1484 CE MET A 92 -5.121 15.380 -15.305 1.00 25.33 C ATOM 0 H MET A 92 -1.470 11.317 -16.674 1.00 24.23 H new ATOM 0 HA MET A 92 -0.300 13.311 -14.879 1.00 44.23 H new ATOM 0 HB2 MET A 92 -2.508 14.488 -14.759 1.00 52.34 H new ATOM 0 HB3 MET A 92 -1.653 14.711 -16.272 1.00 52.34 H new ATOM 0 HG2 MET A 92 -3.096 12.966 -17.324 1.00 22.40 H new ATOM 0 HG3 MET A 92 -3.971 12.799 -15.815 1.00 22.40 H new ATOM 0 HE1 MET A 92 -6.204 15.488 -15.356 1.00 25.33 H new ATOM 0 HE2 MET A 92 -4.866 14.628 -14.559 1.00 25.33 H new ATOM 0 HE3 MET A 92 -4.674 16.334 -15.026 1.00 25.33 H new ATOM 1494 N SER A 93 -1.210 12.061 -13.006 1.00 14.21 N ATOM 1495 CA SER A 93 -1.743 11.373 -11.849 1.00 42.15 C ATOM 1496 C SER A 93 -2.724 12.292 -11.139 1.00 13.51 C ATOM 1497 O SER A 93 -2.321 13.197 -10.415 1.00 52.22 O ATOM 1498 CB SER A 93 -0.616 10.949 -10.901 1.00 34.13 C ATOM 1499 OG SER A 93 -1.095 10.095 -9.876 1.00 34.22 O ATOM 0 H SER A 93 -0.361 12.597 -12.826 1.00 14.21 H new ATOM 0 HA SER A 93 -2.259 10.469 -12.172 1.00 42.15 H new ATOM 0 HB2 SER A 93 0.164 10.439 -11.466 1.00 34.13 H new ATOM 0 HB3 SER A 93 -0.161 11.834 -10.456 1.00 34.13 H new ATOM 0 HG SER A 93 -0.353 9.841 -9.289 1.00 34.22 H new ATOM 1505 N TRP A 94 -4.005 12.091 -11.394 1.00 3.45 N ATOM 1506 CA TRP A 94 -5.034 12.941 -10.828 1.00 61.31 C ATOM 1507 C TRP A 94 -5.487 12.371 -9.492 1.00 24.42 C ATOM 1508 O TRP A 94 -6.266 11.422 -9.446 1.00 20.33 O ATOM 1509 CB TRP A 94 -6.192 13.060 -11.828 1.00 42.43 C ATOM 1510 CG TRP A 94 -7.377 13.877 -11.380 1.00 43.41 C ATOM 1511 CD1 TRP A 94 -8.665 13.714 -11.804 1.00 51.13 C ATOM 1512 CD2 TRP A 94 -7.404 14.972 -10.447 1.00 64.32 C ATOM 1513 NE1 TRP A 94 -9.486 14.630 -11.197 1.00 34.50 N ATOM 1514 CE2 TRP A 94 -8.742 15.410 -10.359 1.00 20.12 C ATOM 1515 CE3 TRP A 94 -6.440 15.625 -9.676 1.00 23.45 C ATOM 1516 CZ2 TRP A 94 -9.130 16.463 -9.538 1.00 41.45 C ATOM 1517 CZ3 TRP A 94 -6.830 16.668 -8.860 1.00 65.11 C ATOM 1518 CH2 TRP A 94 -8.164 17.079 -8.797 1.00 30.12 C ATOM 0 H TRP A 94 -4.357 11.343 -11.992 1.00 3.45 H new ATOM 0 HA TRP A 94 -4.646 13.942 -10.642 1.00 61.31 H new ATOM 0 HB2 TRP A 94 -5.805 13.494 -12.750 1.00 42.43 H new ATOM 0 HB3 TRP A 94 -6.540 12.056 -12.070 1.00 42.43 H new ATOM 0 HD1 TRP A 94 -8.991 12.970 -12.516 1.00 51.13 H new ATOM 0 HE1 TRP A 94 -10.491 14.715 -11.348 1.00 34.50 H new ATOM 0 HE3 TRP A 94 -5.405 15.319 -9.717 1.00 23.45 H new ATOM 0 HZ2 TRP A 94 -10.161 16.782 -9.489 1.00 41.45 H new ATOM 0 HZ3 TRP A 94 -6.090 17.176 -8.259 1.00 65.11 H new ATOM 0 HH2 TRP A 94 -8.436 17.900 -8.150 1.00 30.12 H new ATOM 1529 N CYS A 95 -4.945 12.931 -8.416 1.00 15.12 N ATOM 1530 CA CYS A 95 -5.281 12.521 -7.059 1.00 12.22 C ATOM 1531 C CYS A 95 -4.569 13.424 -6.056 1.00 33.01 C ATOM 1532 O CYS A 95 -3.363 13.653 -6.169 1.00 74.14 O ATOM 1533 CB CYS A 95 -4.896 11.056 -6.815 1.00 5.23 C ATOM 1534 SG CYS A 95 -5.303 10.449 -5.160 1.00 12.04 S ATOM 0 H CYS A 95 -4.258 13.684 -8.461 1.00 15.12 H new ATOM 0 HA CYS A 95 -6.359 12.614 -6.928 1.00 12.22 H new ATOM 0 HB2 CYS A 95 -5.400 10.432 -7.553 1.00 5.23 H new ATOM 0 HB3 CYS A 95 -3.824 10.941 -6.979 1.00 5.23 H new ATOM 0 HG CYS A 95 -4.942 9.205 -5.053 1.00 12.04 H new ATOM 1540 N PRO A 96 -5.313 13.957 -5.072 1.00 71.32 N ATOM 1541 CA PRO A 96 -4.766 14.855 -4.046 1.00 33.00 C ATOM 1542 C PRO A 96 -3.576 14.262 -3.299 1.00 30.41 C ATOM 1543 O PRO A 96 -3.618 13.123 -2.828 1.00 74.41 O ATOM 1544 CB PRO A 96 -5.944 15.064 -3.096 1.00 31.21 C ATOM 1545 CG PRO A 96 -7.143 14.841 -3.941 1.00 25.41 C ATOM 1546 CD PRO A 96 -6.762 13.752 -4.900 1.00 23.55 C ATOM 0 HA PRO A 96 -4.379 15.774 -4.486 1.00 33.00 H new ATOM 0 HB2 PRO A 96 -5.910 14.364 -2.261 1.00 31.21 H new ATOM 0 HB3 PRO A 96 -5.938 16.068 -2.671 1.00 31.21 H new ATOM 0 HG2 PRO A 96 -8.001 14.548 -3.335 1.00 25.41 H new ATOM 0 HG3 PRO A 96 -7.423 15.751 -4.472 1.00 25.41 H new ATOM 0 HD2 PRO A 96 -6.985 12.764 -4.498 1.00 23.55 H new ATOM 0 HD3 PRO A 96 -7.298 13.840 -5.845 1.00 23.55 H new ATOM 1554 N ASP A 97 -2.528 15.065 -3.183 1.00 2.01 N ATOM 1555 CA ASP A 97 -1.288 14.654 -2.531 1.00 24.34 C ATOM 1556 C ASP A 97 -1.420 14.763 -1.017 1.00 21.51 C ATOM 1557 O ASP A 97 -0.886 13.945 -0.268 1.00 14.41 O ATOM 1558 CB ASP A 97 -0.141 15.548 -3.025 1.00 30.11 C ATOM 1559 CG ASP A 97 1.199 15.246 -2.382 1.00 41.32 C ATOM 1560 OD1 ASP A 97 1.451 15.738 -1.266 1.00 2.21 O ATOM 1561 OD2 ASP A 97 2.021 14.541 -3.008 1.00 54.44 O ATOM 0 H ASP A 97 -2.511 16.021 -3.538 1.00 2.01 H new ATOM 0 HA ASP A 97 -1.078 13.614 -2.782 1.00 24.34 H new ATOM 0 HB2 ASP A 97 -0.047 15.437 -4.105 1.00 30.11 H new ATOM 0 HB3 ASP A 97 -0.398 16.590 -2.833 1.00 30.11 H new ATOM 1566 N THR A 98 -2.164 15.767 -0.584 1.00 23.32 N ATOM 1567 CA THR A 98 -2.261 16.107 0.826 1.00 33.42 C ATOM 1568 C THR A 98 -3.523 15.541 1.479 1.00 61.11 C ATOM 1569 O THR A 98 -3.784 15.790 2.658 1.00 11.13 O ATOM 1570 CB THR A 98 -2.241 17.637 0.994 1.00 62.34 C ATOM 1571 OG1 THR A 98 -3.125 18.240 0.033 1.00 32.45 O ATOM 1572 CG2 THR A 98 -0.833 18.181 0.809 1.00 40.53 C ATOM 0 H THR A 98 -2.716 16.367 -1.197 1.00 23.32 H new ATOM 0 HA THR A 98 -1.403 15.658 1.326 1.00 33.42 H new ATOM 0 HB THR A 98 -2.576 17.880 2.002 1.00 62.34 H new ATOM 0 HG1 THR A 98 -3.112 19.214 0.143 1.00 32.45 H new ATOM 0 HG21 THR A 98 -0.842 19.264 0.932 1.00 40.53 H new ATOM 0 HG22 THR A 98 -0.171 17.737 1.552 1.00 40.53 H new ATOM 0 HG23 THR A 98 -0.475 17.932 -0.190 1.00 40.53 H new ATOM 1580 N ALA A 99 -4.297 14.772 0.724 1.00 72.32 N ATOM 1581 CA ALA A 99 -5.549 14.232 1.238 1.00 5.31 C ATOM 1582 C ALA A 99 -5.328 12.922 1.985 1.00 75.44 C ATOM 1583 O ALA A 99 -5.274 12.902 3.214 1.00 44.22 O ATOM 1584 CB ALA A 99 -6.553 14.042 0.114 1.00 0.22 C ATOM 0 H ALA A 99 -4.083 14.510 -0.238 1.00 72.32 H new ATOM 0 HA ALA A 99 -5.953 14.955 1.947 1.00 5.31 H new ATOM 0 HB1 ALA A 99 -7.481 13.638 0.519 1.00 0.22 H new ATOM 0 HB2 ALA A 99 -6.753 15.002 -0.362 1.00 0.22 H new ATOM 0 HB3 ALA A 99 -6.147 13.349 -0.623 1.00 0.22 H new ATOM 1590 N LYS A 100 -5.193 11.831 1.241 1.00 24.35 N ATOM 1591 CA LYS A 100 -5.010 10.520 1.846 1.00 41.10 C ATOM 1592 C LYS A 100 -3.525 10.177 1.893 1.00 34.41 C ATOM 1593 O LYS A 100 -2.943 9.781 0.886 1.00 24.12 O ATOM 1594 CB LYS A 100 -5.776 9.458 1.051 1.00 50.32 C ATOM 1595 CG LYS A 100 -6.453 8.413 1.924 1.00 41.34 C ATOM 1596 CD LYS A 100 -7.788 8.910 2.457 1.00 33.02 C ATOM 1597 CE LYS A 100 -8.829 9.003 1.349 1.00 21.25 C ATOM 1598 NZ LYS A 100 -10.142 9.479 1.855 1.00 54.45 N ATOM 0 H LYS A 100 -5.207 11.829 0.221 1.00 24.35 H new ATOM 0 HA LYS A 100 -5.402 10.540 2.863 1.00 41.10 H new ATOM 0 HB2 LYS A 100 -6.530 9.950 0.437 1.00 50.32 H new ATOM 0 HB3 LYS A 100 -5.087 8.959 0.370 1.00 50.32 H new ATOM 0 HG2 LYS A 100 -6.607 7.501 1.348 1.00 41.34 H new ATOM 0 HG3 LYS A 100 -5.800 8.156 2.758 1.00 41.34 H new ATOM 0 HD2 LYS A 100 -8.144 8.237 3.237 1.00 33.02 H new ATOM 0 HD3 LYS A 100 -7.656 9.889 2.917 1.00 33.02 H new ATOM 0 HE2 LYS A 100 -8.473 9.681 0.573 1.00 21.25 H new ATOM 0 HE3 LYS A 100 -8.953 8.024 0.885 1.00 21.25 H new ATOM 0 HZ1 LYS A 100 -10.820 9.527 1.068 1.00 54.45 H new ATOM 0 HZ2 LYS A 100 -10.496 8.819 2.577 1.00 54.45 H new ATOM 0 HZ3 LYS A 100 -10.030 10.424 2.275 1.00 54.45 H new ATOM 1612 N VAL A 101 -2.927 10.328 3.069 1.00 74.32 N ATOM 1613 CA VAL A 101 -1.477 10.224 3.228 1.00 63.51 C ATOM 1614 C VAL A 101 -0.923 8.854 2.821 1.00 1.21 C ATOM 1615 O VAL A 101 0.148 8.771 2.219 1.00 34.42 O ATOM 1616 CB VAL A 101 -1.042 10.548 4.676 1.00 11.14 C ATOM 1617 CG1 VAL A 101 -1.318 12.007 4.996 1.00 25.22 C ATOM 1618 CG2 VAL A 101 -1.745 9.643 5.679 1.00 65.32 C ATOM 0 H VAL A 101 -3.428 10.525 3.936 1.00 74.32 H new ATOM 0 HA VAL A 101 -1.056 10.965 2.549 1.00 63.51 H new ATOM 0 HB VAL A 101 0.030 10.366 4.754 1.00 11.14 H new ATOM 0 HG11 VAL A 101 -1.007 12.220 6.019 1.00 25.22 H new ATOM 0 HG12 VAL A 101 -0.761 12.642 4.307 1.00 25.22 H new ATOM 0 HG13 VAL A 101 -2.384 12.207 4.892 1.00 25.22 H new ATOM 0 HG21 VAL A 101 -1.418 9.895 6.688 1.00 65.32 H new ATOM 0 HG22 VAL A 101 -2.823 9.782 5.601 1.00 65.32 H new ATOM 0 HG23 VAL A 101 -1.497 8.603 5.467 1.00 65.32 H new ATOM 1628 N LYS A 102 -1.633 7.784 3.150 1.00 43.22 N ATOM 1629 CA LYS A 102 -1.183 6.451 2.804 1.00 62.02 C ATOM 1630 C LYS A 102 -1.575 6.103 1.372 1.00 32.21 C ATOM 1631 O LYS A 102 -0.785 5.536 0.615 1.00 4.33 O ATOM 1632 CB LYS A 102 -1.770 5.423 3.776 1.00 1.25 C ATOM 1633 CG LYS A 102 -1.266 4.016 3.525 1.00 44.02 C ATOM 1634 CD LYS A 102 0.243 3.948 3.660 1.00 23.12 C ATOM 1635 CE LYS A 102 0.677 3.712 5.100 1.00 72.33 C ATOM 1636 NZ LYS A 102 0.287 2.361 5.582 1.00 23.44 N ATOM 0 H LYS A 102 -2.519 7.816 3.654 1.00 43.22 H new ATOM 0 HA LYS A 102 -0.096 6.427 2.879 1.00 62.02 H new ATOM 0 HB2 LYS A 102 -1.524 5.715 4.797 1.00 1.25 H new ATOM 0 HB3 LYS A 102 -2.857 5.434 3.695 1.00 1.25 H new ATOM 0 HG2 LYS A 102 -1.729 3.328 4.232 1.00 44.02 H new ATOM 0 HG3 LYS A 102 -1.560 3.693 2.526 1.00 44.02 H new ATOM 0 HD2 LYS A 102 0.628 3.146 3.030 1.00 23.12 H new ATOM 0 HD3 LYS A 102 0.682 4.877 3.297 1.00 23.12 H new ATOM 0 HE2 LYS A 102 1.758 3.827 5.177 1.00 72.33 H new ATOM 0 HE3 LYS A 102 0.230 4.470 5.743 1.00 72.33 H new ATOM 0 HZ1 LYS A 102 0.880 2.098 6.395 1.00 23.44 H new ATOM 0 HZ2 LYS A 102 -0.712 2.371 5.871 1.00 23.44 H new ATOM 0 HZ3 LYS A 102 0.420 1.668 4.818 1.00 23.44 H new ATOM 1650 N LYS A 103 -2.793 6.468 1.000 1.00 3.53 N ATOM 1651 CA LYS A 103 -3.334 6.109 -0.303 1.00 42.34 C ATOM 1652 C LYS A 103 -2.607 6.821 -1.437 1.00 50.44 C ATOM 1653 O LYS A 103 -2.443 6.260 -2.520 1.00 70.24 O ATOM 1654 CB LYS A 103 -4.833 6.401 -0.346 1.00 2.33 C ATOM 1655 CG LYS A 103 -5.423 6.402 -1.746 1.00 64.31 C ATOM 1656 CD LYS A 103 -6.914 6.134 -1.720 1.00 35.14 C ATOM 1657 CE LYS A 103 -7.196 4.681 -1.383 1.00 31.30 C ATOM 1658 NZ LYS A 103 -8.648 4.409 -1.257 1.00 71.14 N ATOM 0 H LYS A 103 -3.427 7.014 1.584 1.00 3.53 H new ATOM 0 HA LYS A 103 -3.178 5.040 -0.448 1.00 42.34 H new ATOM 0 HB2 LYS A 103 -5.355 5.657 0.256 1.00 2.33 H new ATOM 0 HB3 LYS A 103 -5.017 7.371 0.115 1.00 2.33 H new ATOM 0 HG2 LYS A 103 -5.233 7.364 -2.221 1.00 64.31 H new ATOM 0 HG3 LYS A 103 -4.926 5.644 -2.352 1.00 64.31 H new ATOM 0 HD2 LYS A 103 -7.391 6.782 -0.985 1.00 35.14 H new ATOM 0 HD3 LYS A 103 -7.349 6.378 -2.689 1.00 35.14 H new ATOM 0 HE2 LYS A 103 -6.774 4.041 -2.158 1.00 31.30 H new ATOM 0 HE3 LYS A 103 -6.697 4.423 -0.449 1.00 31.30 H new ATOM 0 HZ1 LYS A 103 -8.800 3.388 -1.127 1.00 71.14 H new ATOM 0 HZ2 LYS A 103 -9.027 4.923 -0.436 1.00 71.14 H new ATOM 0 HZ3 LYS A 103 -9.136 4.725 -2.119 1.00 71.14 H new ATOM 1672 N LYS A 104 -2.148 8.041 -1.189 1.00 63.21 N ATOM 1673 CA LYS A 104 -1.438 8.799 -2.211 1.00 73.25 C ATOM 1674 C LYS A 104 -0.167 8.064 -2.634 1.00 44.55 C ATOM 1675 O LYS A 104 0.279 8.183 -3.772 1.00 51.53 O ATOM 1676 CB LYS A 104 -1.116 10.217 -1.712 1.00 2.40 C ATOM 1677 CG LYS A 104 -0.129 10.276 -0.552 1.00 2.34 C ATOM 1678 CD LYS A 104 1.299 10.493 -1.030 1.00 61.25 C ATOM 1679 CE LYS A 104 1.440 11.837 -1.720 1.00 14.43 C ATOM 1680 NZ LYS A 104 2.834 12.110 -2.151 1.00 24.24 N ATOM 0 H LYS A 104 -2.253 8.524 -0.297 1.00 63.21 H new ATOM 0 HA LYS A 104 -2.084 8.891 -3.084 1.00 73.25 H new ATOM 0 HB2 LYS A 104 -0.714 10.797 -2.543 1.00 2.40 H new ATOM 0 HB3 LYS A 104 -2.044 10.699 -1.406 1.00 2.40 H new ATOM 0 HG2 LYS A 104 -0.412 11.083 0.124 1.00 2.34 H new ATOM 0 HG3 LYS A 104 -0.184 9.349 0.018 1.00 2.34 H new ATOM 0 HD2 LYS A 104 1.982 10.441 -0.182 1.00 61.25 H new ATOM 0 HD3 LYS A 104 1.582 9.695 -1.717 1.00 61.25 H new ATOM 0 HE2 LYS A 104 0.782 11.867 -2.588 1.00 14.43 H new ATOM 0 HE3 LYS A 104 1.111 12.626 -1.043 1.00 14.43 H new ATOM 0 HZ1 LYS A 104 2.888 13.060 -2.571 1.00 24.24 H new ATOM 0 HZ2 LYS A 104 3.468 12.058 -1.328 1.00 24.24 H new ATOM 0 HZ3 LYS A 104 3.124 11.403 -2.856 1.00 24.24 H new ATOM 1694 N MET A 105 0.395 7.281 -1.716 1.00 32.11 N ATOM 1695 CA MET A 105 1.608 6.519 -1.986 1.00 30.43 C ATOM 1696 C MET A 105 1.298 5.369 -2.943 1.00 62.15 C ATOM 1697 O MET A 105 2.115 5.021 -3.797 1.00 44.32 O ATOM 1698 CB MET A 105 2.205 6.002 -0.667 1.00 73.34 C ATOM 1699 CG MET A 105 3.616 5.434 -0.784 1.00 75.14 C ATOM 1700 SD MET A 105 3.659 3.735 -1.388 1.00 11.42 S ATOM 1701 CE MET A 105 5.427 3.457 -1.457 1.00 31.02 C ATOM 0 H MET A 105 0.025 7.158 -0.773 1.00 32.11 H new ATOM 0 HA MET A 105 2.346 7.165 -2.462 1.00 30.43 H new ATOM 0 HB2 MET A 105 2.215 6.818 0.056 1.00 73.34 H new ATOM 0 HB3 MET A 105 1.549 5.229 -0.266 1.00 73.34 H new ATOM 0 HG2 MET A 105 4.199 6.065 -1.455 1.00 75.14 H new ATOM 0 HG3 MET A 105 4.099 5.477 0.192 1.00 75.14 H new ATOM 0 HE1 MET A 105 5.625 2.479 -1.897 1.00 31.02 H new ATOM 0 HE2 MET A 105 5.893 4.230 -2.067 1.00 31.02 H new ATOM 0 HE3 MET A 105 5.840 3.492 -0.449 1.00 31.02 H new ATOM 1711 N LEU A 106 0.094 4.814 -2.816 1.00 21.41 N ATOM 1712 CA LEU A 106 -0.361 3.727 -3.680 1.00 32.12 C ATOM 1713 C LEU A 106 -0.460 4.208 -5.125 1.00 12.32 C ATOM 1714 O LEU A 106 -0.084 3.503 -6.060 1.00 31.44 O ATOM 1715 CB LEU A 106 -1.736 3.220 -3.221 1.00 21.54 C ATOM 1716 CG LEU A 106 -1.848 2.848 -1.738 1.00 22.45 C ATOM 1717 CD1 LEU A 106 -3.292 2.533 -1.382 1.00 31.34 C ATOM 1718 CD2 LEU A 106 -0.958 1.661 -1.408 1.00 0.14 C ATOM 0 H LEU A 106 -0.589 5.103 -2.116 1.00 21.41 H new ATOM 0 HA LEU A 106 0.362 2.914 -3.617 1.00 32.12 H new ATOM 0 HB2 LEU A 106 -2.478 3.988 -3.441 1.00 21.54 H new ATOM 0 HB3 LEU A 106 -1.997 2.345 -3.816 1.00 21.54 H new ATOM 0 HG LEU A 106 -1.515 3.701 -1.147 1.00 22.45 H new ATOM 0 HD11 LEU A 106 -3.357 2.270 -0.326 1.00 31.34 H new ATOM 0 HD12 LEU A 106 -3.914 3.406 -1.578 1.00 31.34 H new ATOM 0 HD13 LEU A 106 -3.641 1.696 -1.986 1.00 31.34 H new ATOM 0 HD21 LEU A 106 -1.055 1.416 -0.350 1.00 0.14 H new ATOM 0 HD22 LEU A 106 -1.259 0.802 -2.008 1.00 0.14 H new ATOM 0 HD23 LEU A 106 0.080 1.912 -1.629 1.00 0.14 H new ATOM 1730 N TYR A 107 -0.962 5.424 -5.287 1.00 20.45 N ATOM 1731 CA TYR A 107 -1.161 6.015 -6.606 1.00 4.31 C ATOM 1732 C TYR A 107 0.151 6.531 -7.193 1.00 31.54 C ATOM 1733 O TYR A 107 0.296 6.640 -8.412 1.00 2.43 O ATOM 1734 CB TYR A 107 -2.176 7.156 -6.518 1.00 60.32 C ATOM 1735 CG TYR A 107 -3.612 6.700 -6.350 1.00 22.21 C ATOM 1736 CD1 TYR A 107 -4.048 6.113 -5.170 1.00 23.41 C ATOM 1737 CD2 TYR A 107 -4.533 6.856 -7.377 1.00 44.21 C ATOM 1738 CE1 TYR A 107 -5.356 5.694 -5.020 1.00 33.11 C ATOM 1739 CE2 TYR A 107 -5.843 6.439 -7.234 1.00 74.43 C ATOM 1740 CZ TYR A 107 -6.249 5.861 -6.053 1.00 73.35 C ATOM 1741 OH TYR A 107 -7.553 5.441 -5.906 1.00 22.03 O ATOM 0 H TYR A 107 -1.242 6.027 -4.514 1.00 20.45 H new ATOM 0 HA TYR A 107 -1.542 5.237 -7.268 1.00 4.31 H new ATOM 0 HB2 TYR A 107 -1.911 7.799 -5.679 1.00 60.32 H new ATOM 0 HB3 TYR A 107 -2.103 7.763 -7.421 1.00 60.32 H new ATOM 0 HD1 TYR A 107 -3.352 5.981 -4.355 1.00 23.41 H new ATOM 0 HD2 TYR A 107 -4.220 7.312 -8.305 1.00 44.21 H new ATOM 0 HE1 TYR A 107 -5.676 5.237 -4.095 1.00 33.11 H new ATOM 0 HE2 TYR A 107 -6.545 6.566 -8.045 1.00 74.43 H new ATOM 0 HH TYR A 107 -7.927 5.818 -5.082 1.00 22.03 H new ATOM 1751 N SER A 108 1.104 6.849 -6.327 1.00 15.43 N ATOM 1752 CA SER A 108 2.387 7.382 -6.770 1.00 21.32 C ATOM 1753 C SER A 108 3.291 6.272 -7.305 1.00 64.40 C ATOM 1754 O SER A 108 4.179 6.520 -8.119 1.00 43.23 O ATOM 1755 CB SER A 108 3.085 8.114 -5.622 1.00 40.44 C ATOM 1756 OG SER A 108 2.282 9.173 -5.124 1.00 73.23 O ATOM 0 H SER A 108 1.014 6.748 -5.316 1.00 15.43 H new ATOM 0 HA SER A 108 2.194 8.087 -7.579 1.00 21.32 H new ATOM 0 HB2 SER A 108 3.303 7.411 -4.818 1.00 40.44 H new ATOM 0 HB3 SER A 108 4.040 8.510 -5.967 1.00 40.44 H new ATOM 0 HG SER A 108 1.691 8.832 -4.420 1.00 73.23 H new ATOM 1762 N SER A 109 3.061 5.049 -6.850 1.00 22.15 N ATOM 1763 CA SER A 109 3.891 3.926 -7.249 1.00 45.20 C ATOM 1764 C SER A 109 3.412 3.319 -8.567 1.00 3.01 C ATOM 1765 O SER A 109 4.225 3.032 -9.449 1.00 11.01 O ATOM 1766 CB SER A 109 3.923 2.885 -6.135 1.00 54.12 C ATOM 1767 OG SER A 109 2.714 2.905 -5.399 1.00 32.33 O ATOM 0 H SER A 109 2.307 4.811 -6.205 1.00 22.15 H new ATOM 0 HA SER A 109 4.906 4.286 -7.417 1.00 45.20 H new ATOM 0 HB2 SER A 109 4.079 1.894 -6.561 1.00 54.12 H new ATOM 0 HB3 SER A 109 4.763 3.082 -5.470 1.00 54.12 H new ATOM 0 HG SER A 109 2.725 3.658 -4.772 1.00 32.33 H new ATOM 1773 N SER A 110 2.099 3.136 -8.715 1.00 45.42 N ATOM 1774 CA SER A 110 1.550 2.616 -9.961 1.00 13.14 C ATOM 1775 C SER A 110 1.862 3.557 -11.124 1.00 41.15 C ATOM 1776 O SER A 110 2.011 3.120 -12.268 1.00 11.13 O ATOM 1777 CB SER A 110 0.042 2.405 -9.825 1.00 1.31 C ATOM 1778 OG SER A 110 -0.598 3.571 -9.340 1.00 51.42 O ATOM 0 H SER A 110 1.406 3.338 -7.995 1.00 45.42 H new ATOM 0 HA SER A 110 2.017 1.654 -10.172 1.00 13.14 H new ATOM 0 HB2 SER A 110 -0.378 2.133 -10.793 1.00 1.31 H new ATOM 0 HB3 SER A 110 -0.152 1.573 -9.148 1.00 1.31 H new ATOM 0 HG SER A 110 -1.441 3.706 -9.822 1.00 51.42 H new ATOM 1784 N PHE A 111 1.987 4.843 -10.801 1.00 60.13 N ATOM 1785 CA PHE A 111 2.298 5.883 -11.777 1.00 24.24 C ATOM 1786 C PHE A 111 3.553 5.545 -12.584 1.00 64.34 C ATOM 1787 O PHE A 111 3.595 5.769 -13.791 1.00 52.31 O ATOM 1788 CB PHE A 111 2.478 7.223 -11.048 1.00 14.14 C ATOM 1789 CG PHE A 111 2.799 8.400 -11.938 1.00 11.43 C ATOM 1790 CD1 PHE A 111 1.785 9.166 -12.497 1.00 40.22 C ATOM 1791 CD2 PHE A 111 4.116 8.750 -12.202 1.00 5.42 C ATOM 1792 CE1 PHE A 111 2.079 10.250 -13.303 1.00 40.20 C ATOM 1793 CE2 PHE A 111 4.413 9.835 -13.006 1.00 43.20 C ATOM 1794 CZ PHE A 111 3.393 10.585 -13.556 1.00 44.42 C ATOM 0 H PHE A 111 1.875 5.193 -9.850 1.00 60.13 H new ATOM 0 HA PHE A 111 1.469 5.953 -12.481 1.00 24.24 H new ATOM 0 HB2 PHE A 111 1.565 7.444 -10.496 1.00 14.14 H new ATOM 0 HB3 PHE A 111 3.276 7.115 -10.314 1.00 14.14 H new ATOM 0 HD1 PHE A 111 0.754 8.912 -12.300 1.00 40.22 H new ATOM 0 HD2 PHE A 111 4.919 8.168 -11.774 1.00 5.42 H new ATOM 0 HE1 PHE A 111 1.280 10.835 -13.735 1.00 40.20 H new ATOM 0 HE2 PHE A 111 5.442 10.095 -13.204 1.00 43.20 H new ATOM 0 HZ PHE A 111 3.623 11.433 -14.184 1.00 44.42 H new ATOM 1804 N ASP A 112 4.563 4.989 -11.924 1.00 74.54 N ATOM 1805 CA ASP A 112 5.840 4.725 -12.584 1.00 40.13 C ATOM 1806 C ASP A 112 5.809 3.422 -13.378 1.00 13.42 C ATOM 1807 O ASP A 112 6.319 3.362 -14.496 1.00 44.24 O ATOM 1808 CB ASP A 112 6.984 4.689 -11.569 1.00 15.54 C ATOM 1809 CG ASP A 112 8.310 4.336 -12.216 1.00 44.54 C ATOM 1810 OD1 ASP A 112 8.850 5.171 -12.978 1.00 22.41 O ATOM 1811 OD2 ASP A 112 8.824 3.226 -11.960 1.00 4.20 O ATOM 0 H ASP A 112 4.526 4.714 -10.942 1.00 74.54 H new ATOM 0 HA ASP A 112 6.012 5.544 -13.283 1.00 40.13 H new ATOM 0 HB2 ASP A 112 7.066 5.660 -11.081 1.00 15.54 H new ATOM 0 HB3 ASP A 112 6.755 3.960 -10.791 1.00 15.54 H new ATOM 1816 N ALA A 113 5.204 2.386 -12.810 1.00 53.20 N ATOM 1817 CA ALA A 113 5.136 1.086 -13.470 1.00 34.21 C ATOM 1818 C ALA A 113 4.379 1.165 -14.790 1.00 23.34 C ATOM 1819 O ALA A 113 4.718 0.473 -15.756 1.00 40.53 O ATOM 1820 CB ALA A 113 4.497 0.059 -12.556 1.00 25.42 C ATOM 0 H ALA A 113 4.754 2.419 -11.895 1.00 53.20 H new ATOM 0 HA ALA A 113 6.157 0.775 -13.691 1.00 34.21 H new ATOM 0 HB1 ALA A 113 4.455 -0.904 -13.064 1.00 25.42 H new ATOM 0 HB2 ALA A 113 5.089 -0.037 -11.646 1.00 25.42 H new ATOM 0 HB3 ALA A 113 3.487 0.379 -12.299 1.00 25.42 H new ATOM 1826 N LEU A 114 3.363 2.015 -14.845 1.00 21.22 N ATOM 1827 CA LEU A 114 2.584 2.161 -16.065 1.00 3.34 C ATOM 1828 C LEU A 114 3.344 2.982 -17.100 1.00 3.30 C ATOM 1829 O LEU A 114 3.123 2.818 -18.292 1.00 52.32 O ATOM 1830 CB LEU A 114 1.191 2.756 -15.781 1.00 35.14 C ATOM 1831 CG LEU A 114 1.146 4.121 -15.085 1.00 12.12 C ATOM 1832 CD1 LEU A 114 1.357 5.257 -16.073 1.00 43.22 C ATOM 1833 CD2 LEU A 114 -0.179 4.291 -14.362 1.00 55.04 C ATOM 0 H LEU A 114 3.062 2.606 -14.070 1.00 21.22 H new ATOM 0 HA LEU A 114 2.427 1.165 -16.480 1.00 3.34 H new ATOM 0 HB2 LEU A 114 0.659 2.841 -16.729 1.00 35.14 H new ATOM 0 HB3 LEU A 114 0.637 2.045 -15.168 1.00 35.14 H new ATOM 0 HG LEU A 114 1.959 4.157 -14.360 1.00 12.12 H new ATOM 0 HD11 LEU A 114 1.319 6.210 -15.545 1.00 43.22 H new ATOM 0 HD12 LEU A 114 2.330 5.146 -16.552 1.00 43.22 H new ATOM 0 HD13 LEU A 114 0.574 5.230 -16.831 1.00 43.22 H new ATOM 0 HD21 LEU A 114 -0.203 5.263 -13.870 1.00 55.04 H new ATOM 0 HD22 LEU A 114 -0.996 4.228 -15.080 1.00 55.04 H new ATOM 0 HD23 LEU A 114 -0.290 3.504 -13.616 1.00 55.04 H new ATOM 1845 N LYS A 115 4.263 3.834 -16.638 1.00 22.40 N ATOM 1846 CA LYS A 115 5.075 4.666 -17.534 1.00 20.44 C ATOM 1847 C LYS A 115 5.816 3.815 -18.556 1.00 14.22 C ATOM 1848 O LYS A 115 5.968 4.200 -19.712 1.00 42.11 O ATOM 1849 CB LYS A 115 6.081 5.490 -16.729 1.00 4.13 C ATOM 1850 CG LYS A 115 5.472 6.689 -16.026 1.00 43.23 C ATOM 1851 CD LYS A 115 6.366 7.234 -14.915 1.00 73.03 C ATOM 1852 CE LYS A 115 7.757 7.615 -15.408 1.00 45.20 C ATOM 1853 NZ LYS A 115 8.721 6.481 -15.323 1.00 73.11 N ATOM 0 H LYS A 115 4.465 3.967 -15.647 1.00 22.40 H new ATOM 0 HA LYS A 115 4.400 5.336 -18.066 1.00 20.44 H new ATOM 0 HB2 LYS A 115 6.551 4.846 -15.986 1.00 4.13 H new ATOM 0 HB3 LYS A 115 6.870 5.835 -17.397 1.00 4.13 H new ATOM 0 HG2 LYS A 115 5.284 7.477 -16.756 1.00 43.23 H new ATOM 0 HG3 LYS A 115 4.507 6.407 -15.605 1.00 43.23 H new ATOM 0 HD2 LYS A 115 5.892 8.108 -14.469 1.00 73.03 H new ATOM 0 HD3 LYS A 115 6.457 6.485 -14.128 1.00 73.03 H new ATOM 0 HE2 LYS A 115 7.692 7.957 -16.441 1.00 45.20 H new ATOM 0 HE3 LYS A 115 8.132 8.452 -14.819 1.00 45.20 H new ATOM 0 HZ1 LYS A 115 9.682 6.852 -15.183 1.00 73.11 H new ATOM 0 HZ2 LYS A 115 8.467 5.868 -14.522 1.00 73.11 H new ATOM 0 HZ3 LYS A 115 8.687 5.930 -16.204 1.00 73.11 H new ATOM 1867 N LYS A 116 6.271 2.656 -18.119 1.00 0.04 N ATOM 1868 CA LYS A 116 6.973 1.730 -18.992 1.00 61.35 C ATOM 1869 C LYS A 116 5.979 0.936 -19.838 1.00 54.51 C ATOM 1870 O LYS A 116 6.221 0.666 -21.016 1.00 33.42 O ATOM 1871 CB LYS A 116 7.851 0.805 -18.136 1.00 23.35 C ATOM 1872 CG LYS A 116 8.574 -0.300 -18.899 1.00 64.10 C ATOM 1873 CD LYS A 116 7.748 -1.579 -18.967 1.00 11.22 C ATOM 1874 CE LYS A 116 7.384 -2.088 -17.577 1.00 45.13 C ATOM 1875 NZ LYS A 116 8.587 -2.404 -16.760 1.00 14.11 N ATOM 0 H LYS A 116 6.167 2.330 -17.158 1.00 0.04 H new ATOM 0 HA LYS A 116 7.613 2.282 -19.680 1.00 61.35 H new ATOM 0 HB2 LYS A 116 8.594 1.413 -17.619 1.00 23.35 H new ATOM 0 HB3 LYS A 116 7.226 0.346 -17.370 1.00 23.35 H new ATOM 0 HG2 LYS A 116 8.796 0.043 -19.910 1.00 64.10 H new ATOM 0 HG3 LYS A 116 9.528 -0.510 -18.416 1.00 64.10 H new ATOM 0 HD2 LYS A 116 6.838 -1.395 -19.537 1.00 11.22 H new ATOM 0 HD3 LYS A 116 8.308 -2.347 -19.501 1.00 11.22 H new ATOM 0 HE2 LYS A 116 6.785 -1.337 -17.062 1.00 45.13 H new ATOM 0 HE3 LYS A 116 6.765 -2.981 -17.670 1.00 45.13 H new ATOM 0 HZ1 LYS A 116 8.294 -2.856 -15.871 1.00 14.11 H new ATOM 0 HZ2 LYS A 116 9.206 -3.050 -17.289 1.00 14.11 H new ATOM 0 HZ3 LYS A 116 9.103 -1.526 -16.548 1.00 14.11 H new ATOM 1889 N SER A 117 4.845 0.604 -19.238 1.00 10.44 N ATOM 1890 CA SER A 117 3.859 -0.269 -19.865 1.00 54.45 C ATOM 1891 C SER A 117 3.064 0.451 -20.962 1.00 5.10 C ATOM 1892 O SER A 117 2.632 -0.168 -21.935 1.00 72.31 O ATOM 1893 CB SER A 117 2.915 -0.811 -18.793 1.00 44.41 C ATOM 1894 OG SER A 117 3.649 -1.411 -17.733 1.00 72.31 O ATOM 0 H SER A 117 4.582 0.929 -18.308 1.00 10.44 H new ATOM 0 HA SER A 117 4.389 -1.091 -20.345 1.00 54.45 H new ATOM 0 HB2 SER A 117 2.298 -0.002 -18.402 1.00 44.41 H new ATOM 0 HB3 SER A 117 2.239 -1.543 -19.234 1.00 44.41 H new ATOM 0 HG SER A 117 3.983 -0.714 -17.131 1.00 72.31 H new ATOM 1900 N LEU A 118 2.884 1.759 -20.809 1.00 61.12 N ATOM 1901 CA LEU A 118 2.125 2.547 -21.779 1.00 41.44 C ATOM 1902 C LEU A 118 2.962 2.876 -23.014 1.00 40.21 C ATOM 1903 O LEU A 118 2.441 3.453 -23.969 1.00 70.23 O ATOM 1904 CB LEU A 118 1.590 3.834 -21.131 1.00 34.55 C ATOM 1905 CG LEU A 118 2.609 4.725 -20.407 1.00 32.02 C ATOM 1906 CD1 LEU A 118 3.540 5.425 -21.383 1.00 63.31 C ATOM 1907 CD2 LEU A 118 1.886 5.747 -19.548 1.00 2.44 C ATOM 0 H LEU A 118 3.252 2.297 -20.024 1.00 61.12 H new ATOM 0 HA LEU A 118 1.279 1.942 -22.105 1.00 41.44 H new ATOM 0 HB2 LEU A 118 1.110 4.430 -21.907 1.00 34.55 H new ATOM 0 HB3 LEU A 118 0.815 3.557 -20.417 1.00 34.55 H new ATOM 0 HG LEU A 118 3.220 4.084 -19.772 1.00 32.02 H new ATOM 0 HD11 LEU A 118 4.246 6.046 -20.831 1.00 63.31 H new ATOM 0 HD12 LEU A 118 4.087 4.681 -21.962 1.00 63.31 H new ATOM 0 HD13 LEU A 118 2.956 6.051 -22.057 1.00 63.31 H new ATOM 0 HD21 LEU A 118 2.616 6.375 -19.038 1.00 2.44 H new ATOM 0 HD22 LEU A 118 1.251 6.368 -20.179 1.00 2.44 H new ATOM 0 HD23 LEU A 118 1.271 5.232 -18.810 1.00 2.44 H new ATOM 1919 N VAL A 119 4.233 2.438 -22.987 1.00 62.12 N ATOM 1920 CA VAL A 119 5.272 2.812 -23.965 1.00 72.32 C ATOM 1921 C VAL A 119 4.924 4.073 -24.771 1.00 55.40 C ATOM 1922 O VAL A 119 4.272 4.026 -25.820 1.00 72.14 O ATOM 1923 CB VAL A 119 5.632 1.629 -24.906 1.00 24.54 C ATOM 1924 CG1 VAL A 119 4.407 1.068 -25.614 1.00 52.04 C ATOM 1925 CG2 VAL A 119 6.695 2.045 -25.918 1.00 55.44 C ATOM 0 H VAL A 119 4.575 1.800 -22.269 1.00 62.12 H new ATOM 0 HA VAL A 119 6.155 3.057 -23.375 1.00 72.32 H new ATOM 0 HB VAL A 119 6.038 0.834 -24.281 1.00 24.54 H new ATOM 0 HG11 VAL A 119 4.706 0.243 -26.261 1.00 52.04 H new ATOM 0 HG12 VAL A 119 3.692 0.708 -24.874 1.00 52.04 H new ATOM 0 HG13 VAL A 119 3.944 1.851 -26.215 1.00 52.04 H new ATOM 0 HG21 VAL A 119 6.931 1.201 -26.566 1.00 55.44 H new ATOM 0 HG22 VAL A 119 6.319 2.871 -26.521 1.00 55.44 H new ATOM 0 HG23 VAL A 119 7.595 2.361 -25.391 1.00 55.44 H new ATOM 1935 N GLY A 120 5.364 5.206 -24.246 1.00 13.02 N ATOM 1936 CA GLY A 120 5.051 6.487 -24.838 1.00 54.42 C ATOM 1937 C GLY A 120 5.255 7.610 -23.846 1.00 22.24 C ATOM 1938 O GLY A 120 6.266 7.628 -23.145 1.00 50.24 O ATOM 0 H GLY A 120 5.941 5.259 -23.407 1.00 13.02 H new ATOM 0 HA2 GLY A 120 5.681 6.651 -25.712 1.00 54.42 H new ATOM 0 HA3 GLY A 120 4.018 6.488 -25.185 1.00 54.42 H new ATOM 1942 N VAL A 121 4.278 8.517 -23.761 1.00 15.24 N ATOM 1943 CA VAL A 121 4.355 9.681 -22.866 1.00 30.34 C ATOM 1944 C VAL A 121 5.499 10.629 -23.237 1.00 71.52 C ATOM 1945 O VAL A 121 6.667 10.244 -23.282 1.00 42.15 O ATOM 1946 CB VAL A 121 4.490 9.259 -21.381 1.00 45.41 C ATOM 1947 CG1 VAL A 121 4.943 10.418 -20.506 1.00 1.20 C ATOM 1948 CG2 VAL A 121 3.169 8.719 -20.870 1.00 0.32 C ATOM 0 H VAL A 121 3.417 8.469 -24.305 1.00 15.24 H new ATOM 0 HA VAL A 121 3.414 10.216 -22.995 1.00 30.34 H new ATOM 0 HB VAL A 121 5.250 8.479 -21.328 1.00 45.41 H new ATOM 0 HG11 VAL A 121 5.026 10.083 -19.472 1.00 1.20 H new ATOM 0 HG12 VAL A 121 5.913 10.776 -20.850 1.00 1.20 H new ATOM 0 HG13 VAL A 121 4.215 11.227 -20.568 1.00 1.20 H new ATOM 0 HG21 VAL A 121 3.275 8.426 -19.826 1.00 0.32 H new ATOM 0 HG22 VAL A 121 2.404 9.491 -20.954 1.00 0.32 H new ATOM 0 HG23 VAL A 121 2.877 7.852 -21.462 1.00 0.32 H new ATOM 1958 N GLN A 122 5.154 11.879 -23.506 1.00 23.34 N ATOM 1959 CA GLN A 122 6.159 12.901 -23.760 1.00 21.23 C ATOM 1960 C GLN A 122 6.311 13.812 -22.546 1.00 52.32 C ATOM 1961 O GLN A 122 7.222 14.635 -22.483 1.00 15.45 O ATOM 1962 CB GLN A 122 5.804 13.714 -25.004 1.00 23.33 C ATOM 1963 CG GLN A 122 5.860 12.902 -26.287 1.00 75.24 C ATOM 1964 CD GLN A 122 5.695 13.756 -27.529 1.00 52.05 C ATOM 1965 OE1 GLN A 122 5.006 14.775 -27.509 1.00 55.35 O ATOM 1966 NE2 GLN A 122 6.342 13.354 -28.612 1.00 51.41 N ATOM 0 H GLN A 122 4.190 12.210 -23.554 1.00 23.34 H new ATOM 0 HA GLN A 122 7.113 12.406 -23.941 1.00 21.23 H new ATOM 0 HB2 GLN A 122 4.802 14.127 -24.886 1.00 23.33 H new ATOM 0 HB3 GLN A 122 6.489 14.558 -25.086 1.00 23.33 H new ATOM 0 HG2 GLN A 122 6.813 12.375 -26.337 1.00 75.24 H new ATOM 0 HG3 GLN A 122 5.078 12.143 -26.266 1.00 75.24 H new ATOM 0 HE21 GLN A 122 6.903 12.502 -28.584 1.00 51.41 H new ATOM 0 HE22 GLN A 122 6.280 13.896 -29.474 1.00 51.41 H new ATOM 1975 N LYS A 123 5.410 13.652 -21.584 1.00 2.24 N ATOM 1976 CA LYS A 123 5.472 14.399 -20.336 1.00 51.15 C ATOM 1977 C LYS A 123 4.588 13.755 -19.280 1.00 22.21 C ATOM 1978 O LYS A 123 3.485 13.295 -19.580 1.00 13.14 O ATOM 1979 CB LYS A 123 5.056 15.857 -20.545 1.00 1.44 C ATOM 1980 CG LYS A 123 4.836 16.619 -19.245 1.00 14.44 C ATOM 1981 CD LYS A 123 4.851 18.115 -19.472 1.00 33.55 C ATOM 1982 CE LYS A 123 6.245 18.588 -19.852 1.00 60.23 C ATOM 1983 NZ LYS A 123 6.268 20.024 -20.224 1.00 2.02 N ATOM 0 H LYS A 123 4.623 13.006 -21.647 1.00 2.24 H new ATOM 0 HA LYS A 123 6.506 14.381 -19.991 1.00 51.15 H new ATOM 0 HB2 LYS A 123 5.823 16.365 -21.129 1.00 1.44 H new ATOM 0 HB3 LYS A 123 4.138 15.884 -21.132 1.00 1.44 H new ATOM 0 HG2 LYS A 123 3.882 16.326 -18.807 1.00 14.44 H new ATOM 0 HG3 LYS A 123 5.612 16.350 -18.528 1.00 14.44 H new ATOM 0 HD2 LYS A 123 4.146 18.375 -20.261 1.00 33.55 H new ATOM 0 HD3 LYS A 123 4.521 18.628 -18.569 1.00 33.55 H new ATOM 0 HE2 LYS A 123 6.924 18.420 -19.016 1.00 60.23 H new ATOM 0 HE3 LYS A 123 6.614 17.992 -20.687 1.00 60.23 H new ATOM 0 HZ1 LYS A 123 7.251 20.362 -20.244 1.00 2.02 H new ATOM 0 HZ2 LYS A 123 5.841 20.146 -21.164 1.00 2.02 H new ATOM 0 HZ3 LYS A 123 5.728 20.573 -19.525 1.00 2.02 H new ATOM 1997 N TYR A 124 5.081 13.723 -18.052 1.00 42.32 N ATOM 1998 CA TYR A 124 4.322 13.197 -16.932 1.00 11.22 C ATOM 1999 C TYR A 124 4.208 14.258 -15.840 1.00 64.14 C ATOM 2000 O TYR A 124 5.205 14.852 -15.431 1.00 53.41 O ATOM 2001 CB TYR A 124 4.970 11.912 -16.391 1.00 43.34 C ATOM 2002 CG TYR A 124 6.441 12.046 -16.049 1.00 62.51 C ATOM 2003 CD1 TYR A 124 7.419 11.877 -17.024 1.00 54.02 C ATOM 2004 CD2 TYR A 124 6.852 12.342 -14.754 1.00 24.13 C ATOM 2005 CE1 TYR A 124 8.760 12.004 -16.718 1.00 51.31 C ATOM 2006 CE2 TYR A 124 8.191 12.472 -14.443 1.00 42.42 C ATOM 2007 CZ TYR A 124 9.139 12.302 -15.426 1.00 23.15 C ATOM 2008 OH TYR A 124 10.472 12.433 -15.120 1.00 32.54 O ATOM 0 H TYR A 124 6.012 14.059 -17.806 1.00 42.32 H new ATOM 0 HA TYR A 124 3.319 12.941 -17.273 1.00 11.22 H new ATOM 0 HB2 TYR A 124 4.430 11.596 -15.499 1.00 43.34 H new ATOM 0 HB3 TYR A 124 4.853 11.121 -17.132 1.00 43.34 H new ATOM 0 HD1 TYR A 124 7.125 11.643 -18.036 1.00 54.02 H new ATOM 0 HD2 TYR A 124 6.112 12.472 -13.979 1.00 24.13 H new ATOM 0 HE1 TYR A 124 9.507 11.871 -17.486 1.00 51.31 H new ATOM 0 HE2 TYR A 124 8.493 12.706 -13.433 1.00 42.42 H new ATOM 0 HH TYR A 124 10.570 12.645 -14.168 1.00 32.54 H new ATOM 2018 N ILE A 125 2.987 14.512 -15.400 1.00 30.11 N ATOM 2019 CA ILE A 125 2.727 15.534 -14.395 1.00 15.45 C ATOM 2020 C ILE A 125 1.564 15.121 -13.491 1.00 44.15 C ATOM 2021 O ILE A 125 0.447 14.901 -13.956 1.00 54.13 O ATOM 2022 CB ILE A 125 2.432 16.904 -15.056 1.00 32.14 C ATOM 2023 CG1 ILE A 125 2.026 17.940 -14.001 1.00 73.34 C ATOM 2024 CG2 ILE A 125 1.365 16.772 -16.136 1.00 4.40 C ATOM 2025 CD1 ILE A 125 1.785 19.323 -14.566 1.00 3.03 C ATOM 0 H ILE A 125 2.154 14.022 -15.725 1.00 30.11 H new ATOM 0 HA ILE A 125 3.624 15.635 -13.784 1.00 15.45 H new ATOM 0 HB ILE A 125 3.347 17.253 -15.535 1.00 32.14 H new ATOM 0 HG12 ILE A 125 1.120 17.599 -13.500 1.00 73.34 H new ATOM 0 HG13 ILE A 125 2.807 17.998 -13.243 1.00 73.34 H new ATOM 0 HG21 ILE A 125 1.177 17.748 -16.583 1.00 4.40 H new ATOM 0 HG22 ILE A 125 1.709 16.081 -16.905 1.00 4.40 H new ATOM 0 HG23 ILE A 125 0.444 16.393 -15.693 1.00 4.40 H new ATOM 0 HD11 ILE A 125 1.502 20.001 -13.761 1.00 3.03 H new ATOM 0 HD12 ILE A 125 2.696 19.686 -15.042 1.00 3.03 H new ATOM 0 HD13 ILE A 125 0.983 19.280 -15.303 1.00 3.03 H new ATOM 2037 N GLN A 126 1.834 14.985 -12.201 1.00 72.53 N ATOM 2038 CA GLN A 126 0.792 14.641 -11.247 1.00 63.03 C ATOM 2039 C GLN A 126 -0.023 15.874 -10.883 1.00 53.10 C ATOM 2040 O GLN A 126 0.531 16.933 -10.583 1.00 21.00 O ATOM 2041 CB GLN A 126 1.390 14.010 -9.984 1.00 72.30 C ATOM 2042 CG GLN A 126 0.373 13.768 -8.878 1.00 51.14 C ATOM 2043 CD GLN A 126 0.973 13.090 -7.661 1.00 74.32 C ATOM 2044 OE1 GLN A 126 2.149 13.266 -7.348 1.00 61.23 O ATOM 2045 NE2 GLN A 126 0.164 12.306 -6.966 1.00 4.24 N ATOM 0 H GLN A 126 2.761 15.107 -11.793 1.00 72.53 H new ATOM 0 HA GLN A 126 0.134 13.909 -11.716 1.00 63.03 H new ATOM 0 HB2 GLN A 126 1.857 13.062 -10.249 1.00 72.30 H new ATOM 0 HB3 GLN A 126 2.179 14.659 -9.604 1.00 72.30 H new ATOM 0 HG2 GLN A 126 -0.064 14.721 -8.578 1.00 51.14 H new ATOM 0 HG3 GLN A 126 -0.439 13.153 -9.266 1.00 51.14 H new ATOM 0 HE21 GLN A 126 -0.806 12.186 -7.259 1.00 4.24 H new ATOM 0 HE22 GLN A 126 0.510 11.822 -6.138 1.00 4.24 H new ATOM 2054 N ALA A 127 -1.334 15.726 -10.929 1.00 33.40 N ATOM 2055 CA ALA A 127 -2.244 16.784 -10.540 1.00 5.03 C ATOM 2056 C ALA A 127 -2.809 16.467 -9.167 1.00 14.13 C ATOM 2057 O ALA A 127 -3.486 15.456 -8.989 1.00 53.23 O ATOM 2058 CB ALA A 127 -3.358 16.929 -11.561 1.00 12.14 C ATOM 0 H ALA A 127 -1.796 14.870 -11.237 1.00 33.40 H new ATOM 0 HA ALA A 127 -1.707 17.732 -10.499 1.00 5.03 H new ATOM 0 HB1 ALA A 127 -4.032 17.728 -11.253 1.00 12.14 H new ATOM 0 HB2 ALA A 127 -2.930 17.170 -12.534 1.00 12.14 H new ATOM 0 HB3 ALA A 127 -3.912 15.993 -11.630 1.00 12.14 H new ATOM 2064 N THR A 128 -2.508 17.308 -8.196 1.00 13.14 N ATOM 2065 CA THR A 128 -2.882 17.029 -6.825 1.00 20.24 C ATOM 2066 C THR A 128 -4.298 17.506 -6.516 1.00 42.33 C ATOM 2067 O THR A 128 -5.202 16.700 -6.327 1.00 63.35 O ATOM 2068 CB THR A 128 -1.883 17.665 -5.847 1.00 62.34 C ATOM 2069 OG1 THR A 128 -1.741 19.068 -6.118 1.00 13.15 O ATOM 2070 CG2 THR A 128 -0.528 16.989 -5.967 1.00 62.13 C ATOM 0 H THR A 128 -2.007 18.186 -8.331 1.00 13.14 H new ATOM 0 HA THR A 128 -2.859 15.947 -6.699 1.00 20.24 H new ATOM 0 HB THR A 128 -2.264 17.533 -4.834 1.00 62.34 H new ATOM 0 HG1 THR A 128 -1.103 19.460 -5.486 1.00 13.15 H new ATOM 0 HG21 THR A 128 0.171 17.449 -5.269 1.00 62.13 H new ATOM 0 HG22 THR A 128 -0.628 15.929 -5.735 1.00 62.13 H new ATOM 0 HG23 THR A 128 -0.153 17.104 -6.984 1.00 62.13 H new ATOM 2078 N ASP A 129 -4.491 18.813 -6.462 1.00 1.51 N ATOM 2079 CA ASP A 129 -5.808 19.366 -6.187 1.00 53.45 C ATOM 2080 C ASP A 129 -6.376 20.032 -7.437 1.00 52.22 C ATOM 2081 O ASP A 129 -5.786 19.954 -8.517 1.00 53.43 O ATOM 2082 CB ASP A 129 -5.751 20.370 -5.030 1.00 43.21 C ATOM 2083 CG ASP A 129 -5.139 21.693 -5.430 1.00 45.11 C ATOM 2084 OD1 ASP A 129 -3.902 21.772 -5.546 1.00 14.12 O ATOM 2085 OD2 ASP A 129 -5.901 22.658 -5.636 1.00 1.52 O ATOM 0 H ASP A 129 -3.758 19.508 -6.604 1.00 1.51 H new ATOM 0 HA ASP A 129 -6.465 18.547 -5.895 1.00 53.45 H new ATOM 0 HB2 ASP A 129 -6.760 20.541 -4.654 1.00 43.21 H new ATOM 0 HB3 ASP A 129 -5.174 19.941 -4.211 1.00 43.21 H new ATOM 2090 N LEU A 130 -7.510 20.701 -7.277 1.00 45.41 N ATOM 2091 CA LEU A 130 -8.228 21.300 -8.398 1.00 13.53 C ATOM 2092 C LEU A 130 -7.430 22.433 -9.043 1.00 12.23 C ATOM 2093 O LEU A 130 -7.674 22.795 -10.194 1.00 61.12 O ATOM 2094 CB LEU A 130 -9.591 21.814 -7.931 1.00 55.43 C ATOM 2095 CG LEU A 130 -10.502 20.752 -7.310 1.00 65.24 C ATOM 2096 CD1 LEU A 130 -11.831 21.361 -6.893 1.00 74.05 C ATOM 2097 CD2 LEU A 130 -10.725 19.604 -8.280 1.00 44.34 C ATOM 0 H LEU A 130 -7.958 20.844 -6.372 1.00 45.41 H new ATOM 0 HA LEU A 130 -8.370 20.527 -9.153 1.00 13.53 H new ATOM 0 HB2 LEU A 130 -9.433 22.608 -7.201 1.00 55.43 H new ATOM 0 HB3 LEU A 130 -10.106 22.261 -8.782 1.00 55.43 H new ATOM 0 HG LEU A 130 -10.010 20.360 -6.420 1.00 65.24 H new ATOM 0 HD11 LEU A 130 -12.463 20.589 -6.454 1.00 74.05 H new ATOM 0 HD12 LEU A 130 -11.656 22.148 -6.159 1.00 74.05 H new ATOM 0 HD13 LEU A 130 -12.328 21.783 -7.766 1.00 74.05 H new ATOM 0 HD21 LEU A 130 -11.375 18.860 -7.820 1.00 44.34 H new ATOM 0 HD22 LEU A 130 -11.193 19.982 -9.189 1.00 44.34 H new ATOM 0 HD23 LEU A 130 -9.768 19.146 -8.528 1.00 44.34 H new ATOM 2109 N SER A 131 -6.478 22.991 -8.304 1.00 50.12 N ATOM 2110 CA SER A 131 -5.617 24.034 -8.843 1.00 10.34 C ATOM 2111 C SER A 131 -4.690 23.457 -9.909 1.00 31.51 C ATOM 2112 O SER A 131 -4.410 24.101 -10.920 1.00 3.13 O ATOM 2113 CB SER A 131 -4.786 24.673 -7.728 1.00 3.43 C ATOM 2114 OG SER A 131 -5.601 25.036 -6.624 1.00 1.31 O ATOM 0 H SER A 131 -6.284 22.739 -7.335 1.00 50.12 H new ATOM 0 HA SER A 131 -6.249 24.799 -9.295 1.00 10.34 H new ATOM 0 HB2 SER A 131 -4.015 23.976 -7.400 1.00 3.43 H new ATOM 0 HB3 SER A 131 -4.275 25.556 -8.112 1.00 3.43 H new ATOM 0 HG SER A 131 -5.672 24.278 -6.006 1.00 1.31 H new ATOM 2120 N GLU A 132 -4.233 22.230 -9.680 1.00 1.32 N ATOM 2121 CA GLU A 132 -3.299 21.575 -10.585 1.00 71.20 C ATOM 2122 C GLU A 132 -4.040 20.872 -11.714 1.00 32.34 C ATOM 2123 O GLU A 132 -3.566 20.825 -12.848 1.00 33.22 O ATOM 2124 CB GLU A 132 -2.433 20.577 -9.816 1.00 74.44 C ATOM 2125 CG GLU A 132 -1.589 21.220 -8.727 1.00 35.31 C ATOM 2126 CD GLU A 132 -0.520 22.147 -9.274 1.00 21.03 C ATOM 2127 OE1 GLU A 132 -0.866 23.231 -9.792 1.00 14.50 O ATOM 2128 OE2 GLU A 132 0.676 21.805 -9.169 1.00 0.24 O ATOM 0 H GLU A 132 -4.497 21.668 -8.871 1.00 1.32 H new ATOM 0 HA GLU A 132 -2.655 22.337 -11.024 1.00 71.20 H new ATOM 0 HB2 GLU A 132 -3.076 19.820 -9.367 1.00 74.44 H new ATOM 0 HB3 GLU A 132 -1.776 20.062 -10.517 1.00 74.44 H new ATOM 0 HG2 GLU A 132 -2.239 21.781 -8.055 1.00 35.31 H new ATOM 0 HG3 GLU A 132 -1.115 20.438 -8.133 1.00 35.31 H new ATOM 2135 N ALA A 133 -5.203 20.320 -11.405 1.00 60.33 N ATOM 2136 CA ALA A 133 -6.022 19.701 -12.430 1.00 30.01 C ATOM 2137 C ALA A 133 -7.132 20.635 -12.857 1.00 43.31 C ATOM 2138 O ALA A 133 -8.251 20.574 -12.352 1.00 70.20 O ATOM 2139 CB ALA A 133 -6.593 18.377 -11.968 1.00 44.04 C ATOM 0 H ALA A 133 -5.596 20.289 -10.464 1.00 60.33 H new ATOM 0 HA ALA A 133 -5.379 19.501 -13.287 1.00 30.01 H new ATOM 0 HB1 ALA A 133 -7.200 17.945 -12.764 1.00 44.04 H new ATOM 0 HB2 ALA A 133 -5.779 17.695 -11.722 1.00 44.04 H new ATOM 0 HB3 ALA A 133 -7.212 18.536 -11.085 1.00 44.04 H new ATOM 2145 N SER A 134 -6.797 21.526 -13.765 1.00 5.32 N ATOM 2146 CA SER A 134 -7.760 22.446 -14.326 1.00 12.33 C ATOM 2147 C SER A 134 -7.492 22.557 -15.822 1.00 40.23 C ATOM 2148 O SER A 134 -6.385 22.254 -16.267 1.00 40.31 O ATOM 2149 CB SER A 134 -7.650 23.808 -13.633 1.00 54.00 C ATOM 2150 OG SER A 134 -8.831 24.569 -13.807 1.00 63.31 O ATOM 0 H SER A 134 -5.852 21.632 -14.134 1.00 5.32 H new ATOM 0 HA SER A 134 -8.776 22.084 -14.169 1.00 12.33 H new ATOM 0 HB2 SER A 134 -7.461 23.663 -12.569 1.00 54.00 H new ATOM 0 HB3 SER A 134 -6.799 24.356 -14.036 1.00 54.00 H new ATOM 0 HG SER A 134 -8.734 25.432 -13.353 1.00 63.31 H new ATOM 2156 N ARG A 135 -8.483 22.973 -16.600 1.00 24.42 N ATOM 2157 CA ARG A 135 -8.357 22.947 -18.056 1.00 32.22 C ATOM 2158 C ARG A 135 -7.238 23.881 -18.536 1.00 24.22 C ATOM 2159 O ARG A 135 -6.574 23.599 -19.534 1.00 15.02 O ATOM 2160 CB ARG A 135 -9.700 23.280 -18.722 1.00 52.12 C ATOM 2161 CG ARG A 135 -10.105 24.739 -18.633 1.00 33.02 C ATOM 2162 CD ARG A 135 -11.589 24.925 -18.900 1.00 63.23 C ATOM 2163 NE ARG A 135 -11.998 26.323 -18.796 1.00 71.11 N ATOM 2164 CZ ARG A 135 -13.094 26.822 -19.363 1.00 44.24 C ATOM 2165 NH1 ARG A 135 -13.919 26.025 -20.030 1.00 52.43 N ATOM 2166 NH2 ARG A 135 -13.380 28.112 -19.229 1.00 73.14 N ATOM 0 H ARG A 135 -9.374 23.329 -16.255 1.00 24.42 H new ATOM 0 HA ARG A 135 -8.079 21.936 -18.355 1.00 32.22 H new ATOM 0 HB2 ARG A 135 -9.650 22.994 -19.773 1.00 52.12 H new ATOM 0 HB3 ARG A 135 -10.479 22.672 -18.263 1.00 52.12 H new ATOM 0 HG2 ARG A 135 -9.862 25.125 -17.643 1.00 33.02 H new ATOM 0 HG3 ARG A 135 -9.530 25.321 -19.352 1.00 33.02 H new ATOM 0 HD2 ARG A 135 -11.827 24.552 -19.896 1.00 63.23 H new ATOM 0 HD3 ARG A 135 -12.162 24.327 -18.191 1.00 63.23 H new ATOM 0 HE ARG A 135 -11.408 26.956 -18.256 1.00 71.11 H new ATOM 0 HH11 ARG A 135 -13.714 25.029 -20.109 1.00 52.43 H new ATOM 0 HH12 ARG A 135 -14.759 26.408 -20.464 1.00 52.43 H new ATOM 0 HH21 ARG A 135 -12.760 28.719 -18.692 1.00 73.14 H new ATOM 0 HH22 ARG A 135 -14.219 28.496 -19.663 1.00 73.14 H new ATOM 2180 N GLU A 136 -7.014 24.972 -17.807 1.00 3.43 N ATOM 2181 CA GLU A 136 -5.892 25.863 -18.085 1.00 11.44 C ATOM 2182 C GLU A 136 -4.568 25.143 -17.831 1.00 21.31 C ATOM 2183 O GLU A 136 -3.659 25.175 -18.659 1.00 2.10 O ATOM 2184 CB GLU A 136 -5.978 27.115 -17.209 1.00 1.31 C ATOM 2185 CG GLU A 136 -4.796 28.056 -17.370 1.00 32.30 C ATOM 2186 CD GLU A 136 -4.836 29.216 -16.400 1.00 62.24 C ATOM 2187 OE1 GLU A 136 -4.562 29.002 -15.201 1.00 34.11 O ATOM 2188 OE2 GLU A 136 -5.137 30.349 -16.830 1.00 43.22 O ATOM 0 H GLU A 136 -7.595 25.260 -17.020 1.00 3.43 H new ATOM 0 HA GLU A 136 -5.939 26.160 -19.133 1.00 11.44 H new ATOM 0 HB2 GLU A 136 -6.895 27.653 -17.449 1.00 1.31 H new ATOM 0 HB3 GLU A 136 -6.050 26.812 -16.164 1.00 1.31 H new ATOM 0 HG2 GLU A 136 -3.871 27.498 -17.225 1.00 32.30 H new ATOM 0 HG3 GLU A 136 -4.780 28.441 -18.390 1.00 32.30 H new ATOM 2195 N ALA A 137 -4.477 24.480 -16.685 1.00 70.23 N ATOM 2196 CA ALA A 137 -3.271 23.752 -16.314 1.00 31.11 C ATOM 2197 C ALA A 137 -3.017 22.597 -17.278 1.00 31.24 C ATOM 2198 O ALA A 137 -1.874 22.200 -17.514 1.00 23.35 O ATOM 2199 CB ALA A 137 -3.382 23.244 -14.886 1.00 53.14 C ATOM 0 H ALA A 137 -5.227 24.432 -15.995 1.00 70.23 H new ATOM 0 HA ALA A 137 -2.423 24.435 -16.375 1.00 31.11 H new ATOM 0 HB1 ALA A 137 -2.474 22.702 -14.621 1.00 53.14 H new ATOM 0 HB2 ALA A 137 -3.511 24.088 -14.209 1.00 53.14 H new ATOM 0 HB3 ALA A 137 -4.240 22.577 -14.803 1.00 53.14 H new ATOM 2205 N VAL A 138 -4.092 22.073 -17.841 1.00 52.52 N ATOM 2206 CA VAL A 138 -3.999 21.008 -18.819 1.00 44.34 C ATOM 2207 C VAL A 138 -3.318 21.493 -20.103 1.00 65.32 C ATOM 2208 O VAL A 138 -2.540 20.753 -20.709 1.00 24.42 O ATOM 2209 CB VAL A 138 -5.390 20.396 -19.121 1.00 42.34 C ATOM 2210 CG1 VAL A 138 -5.360 19.541 -20.380 1.00 0.33 C ATOM 2211 CG2 VAL A 138 -5.852 19.560 -17.938 1.00 21.54 C ATOM 0 H VAL A 138 -5.045 22.372 -17.634 1.00 52.52 H new ATOM 0 HA VAL A 138 -3.379 20.221 -18.390 1.00 44.34 H new ATOM 0 HB VAL A 138 -6.091 21.214 -19.288 1.00 42.34 H new ATOM 0 HG11 VAL A 138 -6.352 19.127 -20.562 1.00 0.33 H new ATOM 0 HG12 VAL A 138 -5.061 20.155 -21.230 1.00 0.33 H new ATOM 0 HG13 VAL A 138 -4.646 18.728 -20.251 1.00 0.33 H new ATOM 0 HG21 VAL A 138 -6.831 19.132 -18.155 1.00 21.54 H new ATOM 0 HG22 VAL A 138 -5.137 18.758 -17.758 1.00 21.54 H new ATOM 0 HG23 VAL A 138 -5.921 20.191 -17.052 1.00 21.54 H new ATOM 2221 N GLU A 139 -3.578 22.733 -20.509 1.00 2.43 N ATOM 2222 CA GLU A 139 -2.926 23.269 -21.696 1.00 14.03 C ATOM 2223 C GLU A 139 -1.516 23.764 -21.371 1.00 70.00 C ATOM 2224 O GLU A 139 -0.628 23.726 -22.221 1.00 64.21 O ATOM 2225 CB GLU A 139 -3.745 24.391 -22.357 1.00 35.15 C ATOM 2226 CG GLU A 139 -3.619 25.749 -21.684 1.00 32.54 C ATOM 2227 CD GLU A 139 -3.919 26.897 -22.628 1.00 62.45 C ATOM 2228 OE1 GLU A 139 -3.157 27.085 -23.603 1.00 33.42 O ATOM 2229 OE2 GLU A 139 -4.896 27.636 -22.391 1.00 22.22 O ATOM 0 H GLU A 139 -4.222 23.373 -20.044 1.00 2.43 H new ATOM 0 HA GLU A 139 -2.857 22.449 -22.411 1.00 14.03 H new ATOM 0 HB2 GLU A 139 -3.433 24.486 -23.397 1.00 35.15 H new ATOM 0 HB3 GLU A 139 -4.795 24.100 -22.364 1.00 35.15 H new ATOM 0 HG2 GLU A 139 -4.301 25.794 -20.835 1.00 32.54 H new ATOM 0 HG3 GLU A 139 -2.609 25.862 -21.289 1.00 32.54 H new ATOM 2236 N GLU A 140 -1.285 24.210 -20.139 1.00 61.51 N ATOM 2237 CA GLU A 140 0.012 24.781 -19.805 1.00 32.51 C ATOM 2238 C GLU A 140 1.082 23.699 -19.663 1.00 63.21 C ATOM 2239 O GLU A 140 2.270 23.975 -19.829 1.00 2.24 O ATOM 2240 CB GLU A 140 -0.055 25.662 -18.555 1.00 23.34 C ATOM 2241 CG GLU A 140 -0.330 24.916 -17.268 1.00 72.22 C ATOM 2242 CD GLU A 140 -0.341 25.839 -16.070 1.00 13.41 C ATOM 2243 OE1 GLU A 140 -1.367 26.505 -15.839 1.00 33.20 O ATOM 2244 OE2 GLU A 140 0.685 25.920 -15.368 1.00 4.42 O ATOM 0 H GLU A 140 -1.960 24.188 -19.375 1.00 61.51 H new ATOM 0 HA GLU A 140 0.299 25.423 -20.638 1.00 32.51 H new ATOM 0 HB2 GLU A 140 0.889 26.197 -18.454 1.00 23.34 H new ATOM 0 HB3 GLU A 140 -0.833 26.412 -18.697 1.00 23.34 H new ATOM 0 HG2 GLU A 140 -1.291 24.407 -17.342 1.00 72.22 H new ATOM 0 HG3 GLU A 140 0.429 24.146 -17.126 1.00 72.22 H new ATOM 2251 N LYS A 141 0.677 22.465 -19.375 1.00 42.41 N ATOM 2252 CA LYS A 141 1.634 21.363 -19.353 1.00 73.33 C ATOM 2253 C LYS A 141 2.026 20.975 -20.776 1.00 52.33 C ATOM 2254 O LYS A 141 3.160 20.569 -21.027 1.00 62.51 O ATOM 2255 CB LYS A 141 1.090 20.133 -18.609 1.00 74.41 C ATOM 2256 CG LYS A 141 -0.235 19.620 -19.145 1.00 43.34 C ATOM 2257 CD LYS A 141 -0.611 18.286 -18.521 1.00 20.20 C ATOM 2258 CE LYS A 141 -1.984 17.817 -18.978 1.00 25.24 C ATOM 2259 NZ LYS A 141 -2.346 16.502 -18.380 1.00 32.41 N ATOM 0 H LYS A 141 -0.285 22.206 -19.158 1.00 42.41 H new ATOM 0 HA LYS A 141 2.513 21.713 -18.812 1.00 73.33 H new ATOM 0 HB2 LYS A 141 1.827 19.332 -18.666 1.00 74.41 H new ATOM 0 HB3 LYS A 141 0.971 20.383 -17.555 1.00 74.41 H new ATOM 0 HG2 LYS A 141 -1.018 20.351 -18.942 1.00 43.34 H new ATOM 0 HG3 LYS A 141 -0.173 19.511 -20.228 1.00 43.34 H new ATOM 0 HD2 LYS A 141 0.136 17.537 -18.786 1.00 20.20 H new ATOM 0 HD3 LYS A 141 -0.601 18.377 -17.435 1.00 20.20 H new ATOM 0 HE2 LYS A 141 -2.732 18.560 -18.702 1.00 25.24 H new ATOM 0 HE3 LYS A 141 -1.998 17.738 -20.065 1.00 25.24 H new ATOM 0 HZ1 LYS A 141 -2.503 15.807 -19.138 1.00 32.41 H new ATOM 0 HZ2 LYS A 141 -1.573 16.175 -17.766 1.00 32.41 H new ATOM 0 HZ3 LYS A 141 -3.215 16.604 -17.818 1.00 32.41 H new ATOM 2273 N LEU A 142 1.092 21.118 -21.714 1.00 11.51 N ATOM 2274 CA LEU A 142 1.353 20.729 -23.092 1.00 3.03 C ATOM 2275 C LEU A 142 2.117 21.827 -23.833 1.00 65.22 C ATOM 2276 O LEU A 142 3.005 21.533 -24.631 1.00 62.43 O ATOM 2277 CB LEU A 142 0.047 20.352 -23.825 1.00 53.51 C ATOM 2278 CG LEU A 142 -1.013 21.451 -23.980 1.00 23.32 C ATOM 2279 CD1 LEU A 142 -0.731 22.319 -25.197 1.00 11.12 C ATOM 2280 CD2 LEU A 142 -2.400 20.841 -24.082 1.00 41.31 C ATOM 0 H LEU A 142 0.160 21.496 -21.545 1.00 11.51 H new ATOM 0 HA LEU A 142 1.983 19.840 -23.077 1.00 3.03 H new ATOM 0 HB2 LEU A 142 0.310 19.993 -24.820 1.00 53.51 H new ATOM 0 HB3 LEU A 142 -0.409 19.516 -23.295 1.00 53.51 H new ATOM 0 HG LEU A 142 -0.970 22.084 -23.094 1.00 23.32 H new ATOM 0 HD11 LEU A 142 -1.498 23.088 -25.281 1.00 11.12 H new ATOM 0 HD12 LEU A 142 0.246 22.791 -25.089 1.00 11.12 H new ATOM 0 HD13 LEU A 142 -0.738 21.700 -26.095 1.00 11.12 H new ATOM 0 HD21 LEU A 142 -3.139 21.634 -24.191 1.00 41.31 H new ATOM 0 HD22 LEU A 142 -2.445 20.181 -24.949 1.00 41.31 H new ATOM 0 HD23 LEU A 142 -2.613 20.269 -23.179 1.00 41.31 H new ATOM 2292 N ARG A 143 1.799 23.089 -23.539 1.00 62.43 N ATOM 2293 CA ARG A 143 2.467 24.217 -24.192 1.00 25.51 C ATOM 2294 C ARG A 143 3.932 24.287 -23.781 1.00 1.52 C ATOM 2295 O ARG A 143 4.756 24.851 -24.491 1.00 71.31 O ATOM 2296 CB ARG A 143 1.777 25.546 -23.858 1.00 13.32 C ATOM 2297 CG ARG A 143 1.781 25.883 -22.375 1.00 60.21 C ATOM 2298 CD ARG A 143 2.125 27.343 -22.120 1.00 74.01 C ATOM 2299 NE ARG A 143 3.460 27.678 -22.611 1.00 63.25 N ATOM 2300 CZ ARG A 143 4.553 27.728 -21.845 1.00 12.52 C ATOM 2301 NH1 ARG A 143 4.479 27.482 -20.541 1.00 20.45 N ATOM 2302 NH2 ARG A 143 5.720 28.042 -22.390 1.00 22.53 N ATOM 0 H ARG A 143 1.088 23.355 -22.858 1.00 62.43 H new ATOM 0 HA ARG A 143 2.402 24.053 -25.268 1.00 25.51 H new ATOM 0 HB2 ARG A 143 2.271 26.349 -24.405 1.00 13.32 H new ATOM 0 HB3 ARG A 143 0.746 25.508 -24.210 1.00 13.32 H new ATOM 0 HG2 ARG A 143 0.801 25.663 -21.951 1.00 60.21 H new ATOM 0 HG3 ARG A 143 2.501 25.246 -21.861 1.00 60.21 H new ATOM 0 HD2 ARG A 143 1.388 27.981 -22.607 1.00 74.01 H new ATOM 0 HD3 ARG A 143 2.068 27.549 -21.051 1.00 74.01 H new ATOM 0 HE ARG A 143 3.564 27.887 -23.604 1.00 63.25 H new ATOM 0 HH11 ARG A 143 3.581 27.252 -20.116 1.00 20.45 H new ATOM 0 HH12 ARG A 143 5.320 27.523 -19.966 1.00 20.45 H new ATOM 0 HH21 ARG A 143 5.779 28.244 -23.388 1.00 22.53 H new ATOM 0 HH22 ARG A 143 6.559 28.082 -21.811 1.00 22.53 H new ATOM 2316 N ALA A 144 4.248 23.710 -22.627 1.00 74.42 N ATOM 2317 CA ALA A 144 5.623 23.671 -22.148 1.00 52.24 C ATOM 2318 C ALA A 144 6.367 22.496 -22.769 1.00 55.43 C ATOM 2319 O ALA A 144 7.568 22.333 -22.577 1.00 34.32 O ATOM 2320 CB ALA A 144 5.657 23.576 -20.632 1.00 11.53 C ATOM 0 H ALA A 144 3.572 23.264 -22.008 1.00 74.42 H new ATOM 0 HA ALA A 144 6.119 24.595 -22.447 1.00 52.24 H new ATOM 0 HB1 ALA A 144 6.692 23.548 -20.292 1.00 11.53 H new ATOM 0 HB2 ALA A 144 5.157 24.444 -20.202 1.00 11.53 H new ATOM 0 HB3 ALA A 144 5.146 22.668 -20.313 1.00 11.53 H new ATOM 2326 N THR A 145 5.633 21.670 -23.500 1.00 61.11 N ATOM 2327 CA THR A 145 6.215 20.536 -24.198 1.00 52.52 C ATOM 2328 C THR A 145 6.311 20.849 -25.687 1.00 65.05 C ATOM 2329 O THR A 145 7.189 20.352 -26.395 1.00 74.04 O ATOM 2330 CB THR A 145 5.366 19.270 -23.984 1.00 4.24 C ATOM 2331 OG1 THR A 145 4.966 19.190 -22.610 1.00 34.21 O ATOM 2332 CG2 THR A 145 6.148 18.018 -24.353 1.00 4.51 C ATOM 0 H THR A 145 4.625 21.766 -23.625 1.00 61.11 H new ATOM 0 HA THR A 145 7.212 20.353 -23.797 1.00 52.52 H new ATOM 0 HB THR A 145 4.489 19.333 -24.628 1.00 4.24 H new ATOM 0 HG1 THR A 145 4.250 19.837 -22.439 1.00 34.21 H new ATOM 0 HG21 THR A 145 5.524 17.139 -24.192 1.00 4.51 H new ATOM 0 HG22 THR A 145 6.441 18.068 -25.402 1.00 4.51 H new ATOM 0 HG23 THR A 145 7.040 17.949 -23.730 1.00 4.51 H new ATOM 2340 N ASP A 146 5.391 21.679 -26.154 1.00 25.20 N ATOM 2341 CA ASP A 146 5.444 22.192 -27.509 1.00 24.03 C ATOM 2342 C ASP A 146 6.409 23.361 -27.565 1.00 4.35 C ATOM 2343 O ASP A 146 6.672 24.003 -26.549 1.00 25.00 O ATOM 2344 CB ASP A 146 4.056 22.626 -27.994 1.00 63.02 C ATOM 2345 CG ASP A 146 3.112 21.455 -28.184 1.00 44.34 C ATOM 2346 OD1 ASP A 146 3.439 20.548 -28.978 1.00 4.04 O ATOM 2347 OD2 ASP A 146 2.039 21.424 -27.535 1.00 74.41 O ATOM 0 H ASP A 146 4.596 22.012 -25.609 1.00 25.20 H new ATOM 0 HA ASP A 146 5.791 21.397 -28.169 1.00 24.03 H new ATOM 0 HB2 ASP A 146 3.625 23.322 -27.274 1.00 63.02 H new ATOM 0 HB3 ASP A 146 4.156 23.164 -28.937 1.00 63.02 H new ATOM 2352 N ARG A 147 6.946 23.627 -28.739 1.00 53.43 N ATOM 2353 CA ARG A 147 7.905 24.708 -28.899 1.00 4.31 C ATOM 2354 C ARG A 147 7.198 25.973 -29.364 1.00 23.24 C ATOM 2355 O ARG A 147 6.952 26.163 -30.558 1.00 74.31 O ATOM 2356 CB ARG A 147 9.008 24.298 -29.879 1.00 53.52 C ATOM 2357 CG ARG A 147 9.811 23.101 -29.397 1.00 23.03 C ATOM 2358 CD ARG A 147 10.800 22.619 -30.443 1.00 13.25 C ATOM 2359 NE ARG A 147 11.539 21.443 -29.984 1.00 12.20 N ATOM 2360 CZ ARG A 147 11.551 20.271 -30.618 1.00 23.32 C ATOM 2361 NH1 ARG A 147 10.903 20.120 -31.767 1.00 1.25 N ATOM 2362 NH2 ARG A 147 12.238 19.256 -30.114 1.00 31.34 N ATOM 0 H ARG A 147 6.737 23.113 -29.595 1.00 53.43 H new ATOM 0 HA ARG A 147 8.371 24.916 -27.936 1.00 4.31 H new ATOM 0 HB2 ARG A 147 8.560 24.064 -30.845 1.00 53.52 H new ATOM 0 HB3 ARG A 147 9.681 25.141 -30.035 1.00 53.52 H new ATOM 0 HG2 ARG A 147 10.348 23.368 -28.487 1.00 23.03 H new ATOM 0 HG3 ARG A 147 9.131 22.289 -29.140 1.00 23.03 H new ATOM 0 HD2 ARG A 147 10.268 22.379 -31.364 1.00 13.25 H new ATOM 0 HD3 ARG A 147 11.500 23.420 -30.679 1.00 13.25 H new ATOM 0 HE ARG A 147 12.080 21.525 -29.123 1.00 12.20 H new ATOM 0 HH11 ARG A 147 10.391 20.904 -32.171 1.00 1.25 H new ATOM 0 HH12 ARG A 147 10.917 19.220 -32.246 1.00 1.25 H new ATOM 0 HH21 ARG A 147 12.756 19.373 -29.243 1.00 31.34 H new ATOM 0 HH22 ARG A 147 12.249 18.358 -30.597 1.00 31.34 H new ATOM 2376 N GLN A 148 6.849 26.821 -28.409 1.00 34.53 N ATOM 2377 CA GLN A 148 6.140 28.057 -28.699 1.00 21.25 C ATOM 2378 C GLN A 148 6.875 29.243 -28.092 1.00 13.23 C ATOM 2379 O GLN A 148 6.803 29.425 -26.856 1.00 73.55 O ATOM 2380 CB GLN A 148 4.707 27.998 -28.162 1.00 4.11 C ATOM 2381 CG GLN A 148 3.855 26.912 -28.798 1.00 24.13 C ATOM 2382 CD GLN A 148 2.428 26.925 -28.288 1.00 41.31 C ATOM 2383 OE1 GLN A 148 2.093 26.249 -27.317 1.00 52.24 O ATOM 2384 NE2 GLN A 148 1.578 27.698 -28.942 1.00 21.15 N ATOM 2385 OXT GLN A 148 7.524 29.989 -28.849 1.00 0.00 O ATOM 0 H GLN A 148 7.047 26.674 -27.419 1.00 34.53 H new ATOM 0 HA GLN A 148 6.100 28.181 -29.781 1.00 21.25 H new ATOM 0 HB2 GLN A 148 4.740 27.836 -27.085 1.00 4.11 H new ATOM 0 HB3 GLN A 148 4.228 28.964 -28.325 1.00 4.11 H new ATOM 0 HG2 GLN A 148 3.853 27.043 -29.880 1.00 24.13 H new ATOM 0 HG3 GLN A 148 4.302 25.938 -28.596 1.00 24.13 H new ATOM 0 HE21 GLN A 148 1.897 28.243 -29.743 1.00 21.15 H new ATOM 0 HE22 GLN A 148 0.603 27.749 -28.646 1.00 21.15 H new TER 2394 GLN A 148