USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 816 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 110 ASN : amide:sc= 0.985 K(o=-0.23,f=-4.5) USER MOD Set 1.2: A 113 GLN : amide:sc= -1.21 K(o=-0.23,f=-9.7!) USER MOD Set 2.1: A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 101 LYS NZ :NH3+ -140:sc= 0.112 (180deg=0) USER MOD Set 3.1: A 65 LYS NZ :NH3+ 159:sc= 0.846 (180deg=0.57) USER MOD Set 3.2: A 71 TYR OH : rot 15:sc= -0.369 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -1.37 K(o=-1.4,f=-3.1) USER MOD Single : A 46 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00673) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot -110:sc= -3.24! USER MOD Single : A 68 ASN : amide:sc= -1.57 K(o=-1.6,f=-0.066) USER MOD Single : A 73 SER OG : rot 166:sc= -0.98! USER MOD Single : A 74 THR OG1 : rot 103:sc= 0.074 USER MOD Single : A 75 GLN : amide:sc= -0.684 K(o=-0.68,f=-0.066) USER MOD Single : A 76 GLN : amide:sc= -0.03 X(o=-0.03,f=-0.13) USER MOD Single : A 83 LYS NZ :NH3+ -152:sc= 1.3 (180deg=1.16) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -1.62! K(o=-1.6!,f=0) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 92 LYS NZ :NH3+ -171:sc= -0.0101 (180deg=-0.131) USER MOD Single : A 93 ASN : amide:sc= -0.622 K(o=-0.62,f=0) USER MOD Single : A 95 ASN : amide:sc= 0.908 K(o=0.91,f=-4.2!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot -108:sc= -1.72! USER MOD Single : A 102 LYS NZ :NH3+ -166:sc= -0.0327 (180deg=-0.242) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 110:sc= -0.0483 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot -67:sc= 0.212 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 11:sc= 1.11 USER MOD Single : A 139 ASN : amide:sc= -0.555 K(o=-0.55,f=-0.048) USER MOD Single : A 145 ASN : amide:sc= -1.78! C(o=-1.8!,f=-5.5!) USER MOD Single : A 148 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 4.369 6.067 -0.743 1.00 61.01 N ATOM 2 CA MET A 39 5.566 5.235 -0.879 1.00 71.04 C ATOM 3 C MET A 39 5.143 3.852 -1.347 1.00 30.20 C ATOM 4 O MET A 39 4.700 3.028 -0.542 1.00 53.51 O ATOM 5 CB MET A 39 6.333 5.072 0.457 1.00 53.43 C ATOM 6 CG MET A 39 6.598 6.333 1.275 1.00 62.24 C ATOM 7 SD MET A 39 5.106 6.983 2.064 1.00 65.22 S ATOM 8 CE MET A 39 5.808 8.298 3.059 1.00 11.21 C ATOM 0 HA MET A 39 6.228 5.727 -1.592 1.00 71.04 H new ATOM 0 HB2 MET A 39 5.774 4.376 1.083 1.00 53.43 H new ATOM 0 HB3 MET A 39 7.293 4.604 0.239 1.00 53.43 H new ATOM 0 HG2 MET A 39 7.342 6.114 2.041 1.00 62.24 H new ATOM 0 HG3 MET A 39 7.023 7.099 0.626 1.00 62.24 H new ATOM 0 HE1 MET A 39 5.014 8.800 3.611 1.00 11.21 H new ATOM 0 HE2 MET A 39 6.528 7.878 3.761 1.00 11.21 H new ATOM 0 HE3 MET A 39 6.310 9.016 2.411 1.00 11.21 H new ATOM 20 N SER A 40 5.247 3.591 -2.616 1.00 32.11 N ATOM 21 CA SER A 40 4.817 2.326 -3.136 1.00 62.45 C ATOM 22 C SER A 40 6.004 1.440 -3.520 1.00 63.24 C ATOM 23 O SER A 40 6.455 1.436 -4.666 1.00 5.23 O ATOM 24 CB SER A 40 3.847 2.528 -4.301 1.00 23.41 C ATOM 25 OG SER A 40 2.762 3.370 -3.895 1.00 21.31 O ATOM 0 H SER A 40 5.625 4.236 -3.310 1.00 32.11 H new ATOM 0 HA SER A 40 4.281 1.798 -2.347 1.00 62.45 H new ATOM 0 HB2 SER A 40 4.369 2.976 -5.146 1.00 23.41 H new ATOM 0 HB3 SER A 40 3.464 1.564 -4.637 1.00 23.41 H new ATOM 0 HG SER A 40 2.146 3.496 -4.647 1.00 21.31 H new ATOM 31 N ARG A 41 6.550 0.779 -2.517 1.00 13.23 N ATOM 32 CA ARG A 41 7.637 -0.191 -2.647 1.00 43.32 C ATOM 33 C ARG A 41 7.514 -1.125 -1.459 1.00 12.44 C ATOM 34 O ARG A 41 6.867 -0.748 -0.473 1.00 3.35 O ATOM 35 CB ARG A 41 9.041 0.463 -2.579 1.00 54.44 C ATOM 36 CG ARG A 41 9.428 1.420 -3.693 1.00 11.44 C ATOM 37 CD ARG A 41 10.859 1.880 -3.481 1.00 43.10 C ATOM 38 NE ARG A 41 11.303 2.887 -4.443 1.00 30.13 N ATOM 39 CZ ARG A 41 12.576 3.294 -4.576 1.00 14.45 C ATOM 40 NH1 ARG A 41 13.542 2.769 -3.809 1.00 75.52 N ATOM 41 NH2 ARG A 41 12.881 4.228 -5.462 1.00 31.12 N ATOM 0 H ARG A 41 6.243 0.902 -1.552 1.00 13.23 H new ATOM 0 HA ARG A 41 7.551 -0.686 -3.614 1.00 43.32 H new ATOM 0 HB2 ARG A 41 9.115 1.001 -1.634 1.00 54.44 H new ATOM 0 HB3 ARG A 41 9.782 -0.336 -2.550 1.00 54.44 H new ATOM 0 HG2 ARG A 41 9.331 0.928 -4.661 1.00 11.44 H new ATOM 0 HG3 ARG A 41 8.755 2.278 -3.702 1.00 11.44 H new ATOM 0 HD2 ARG A 41 10.955 2.286 -2.474 1.00 43.10 H new ATOM 0 HD3 ARG A 41 11.521 1.016 -3.541 1.00 43.10 H new ATOM 0 HE ARG A 41 10.601 3.307 -5.052 1.00 30.13 H new ATOM 0 HH11 ARG A 41 13.313 2.055 -3.118 1.00 75.52 H new ATOM 0 HH12 ARG A 41 14.506 3.084 -3.917 1.00 75.52 H new ATOM 0 HH21 ARG A 41 12.150 4.638 -6.043 1.00 31.12 H new ATOM 0 HH22 ARG A 41 13.847 4.538 -5.564 1.00 31.12 H new ATOM 55 N PRO A 42 8.085 -2.347 -1.516 1.00 20.13 N ATOM 56 CA PRO A 42 8.094 -3.277 -0.369 1.00 71.23 C ATOM 57 C PRO A 42 8.635 -2.597 0.896 1.00 34.54 C ATOM 58 O PRO A 42 9.589 -1.798 0.824 1.00 31.20 O ATOM 59 CB PRO A 42 9.043 -4.379 -0.822 1.00 72.10 C ATOM 60 CG PRO A 42 8.926 -4.380 -2.301 1.00 34.54 C ATOM 61 CD PRO A 42 8.741 -2.947 -2.703 1.00 45.51 C ATOM 0 HA PRO A 42 7.097 -3.636 -0.112 1.00 71.23 H new ATOM 0 HB2 PRO A 42 10.066 -4.178 -0.504 1.00 72.10 H new ATOM 0 HB3 PRO A 42 8.762 -5.344 -0.400 1.00 72.10 H new ATOM 0 HG2 PRO A 42 9.819 -4.802 -2.763 1.00 34.54 H new ATOM 0 HG3 PRO A 42 8.081 -4.988 -2.625 1.00 34.54 H new ATOM 0 HD2 PRO A 42 9.693 -2.464 -2.925 1.00 45.51 H new ATOM 0 HD3 PRO A 42 8.122 -2.855 -3.595 1.00 45.51 H new ATOM 69 N ASP A 43 7.992 -2.867 2.028 1.00 72.15 N ATOM 70 CA ASP A 43 8.305 -2.271 3.348 1.00 3.22 C ATOM 71 C ASP A 43 7.887 -0.828 3.475 1.00 11.41 C ATOM 72 O ASP A 43 7.424 -0.411 4.525 1.00 4.32 O ATOM 73 CB ASP A 43 9.737 -2.504 3.840 1.00 13.52 C ATOM 74 CG ASP A 43 9.910 -3.862 4.455 1.00 64.52 C ATOM 75 OD1 ASP A 43 9.709 -4.004 5.660 1.00 44.24 O ATOM 76 OD2 ASP A 43 10.227 -4.833 3.735 1.00 4.01 O ATOM 0 H ASP A 43 7.213 -3.525 2.067 1.00 72.15 H new ATOM 0 HA ASP A 43 7.675 -2.839 4.033 1.00 3.22 H new ATOM 0 HB2 ASP A 43 10.429 -2.394 3.005 1.00 13.52 H new ATOM 0 HB3 ASP A 43 9.997 -1.739 4.572 1.00 13.52 H new ATOM 81 N GLN A 44 8.000 -0.069 2.403 1.00 22.53 N ATOM 82 CA GLN A 44 7.524 1.309 2.406 1.00 62.11 C ATOM 83 C GLN A 44 6.016 1.283 2.345 1.00 52.54 C ATOM 84 O GLN A 44 5.337 2.191 2.812 1.00 32.34 O ATOM 85 CB GLN A 44 8.047 2.092 1.229 1.00 72.51 C ATOM 86 CG GLN A 44 9.546 2.020 1.021 1.00 2.54 C ATOM 87 CD GLN A 44 9.999 2.941 -0.085 1.00 61.45 C ATOM 88 OE1 GLN A 44 9.232 3.253 -0.994 1.00 13.42 O ATOM 89 NE2 GLN A 44 11.244 3.321 -0.067 1.00 42.22 N ATOM 0 H GLN A 44 8.413 -0.376 1.522 1.00 22.53 H new ATOM 0 HA GLN A 44 7.882 1.797 3.313 1.00 62.11 H new ATOM 0 HB2 GLN A 44 7.553 1.733 0.326 1.00 72.51 H new ATOM 0 HB3 GLN A 44 7.763 3.137 1.353 1.00 72.51 H new ATOM 0 HG2 GLN A 44 10.055 2.285 1.947 1.00 2.54 H new ATOM 0 HG3 GLN A 44 9.832 0.996 0.782 1.00 2.54 H new ATOM 0 HE21 GLN A 44 11.851 3.043 0.704 1.00 42.22 H new ATOM 0 HE22 GLN A 44 11.612 3.897 -0.824 1.00 42.22 H new ATOM 98 N ALA A 45 5.501 0.201 1.790 1.00 12.23 N ATOM 99 CA ALA A 45 4.084 -0.053 1.726 1.00 33.24 C ATOM 100 C ALA A 45 3.540 -0.313 3.129 1.00 34.31 C ATOM 101 O ALA A 45 2.351 -0.216 3.373 1.00 31.11 O ATOM 102 CB ALA A 45 3.804 -1.233 0.821 1.00 52.11 C ATOM 0 H ALA A 45 6.069 -0.533 1.367 1.00 12.23 H new ATOM 0 HA ALA A 45 3.584 0.823 1.313 1.00 33.24 H new ATOM 0 HB1 ALA A 45 2.730 -1.414 0.781 1.00 52.11 H new ATOM 0 HB2 ALA A 45 4.173 -1.018 -0.182 1.00 52.11 H new ATOM 0 HB3 ALA A 45 4.307 -2.118 1.211 1.00 52.11 H new ATOM 108 N LYS A 46 4.431 -0.639 4.052 1.00 32.04 N ATOM 109 CA LYS A 46 4.044 -0.827 5.428 1.00 0.24 C ATOM 110 C LYS A 46 4.048 0.551 6.119 1.00 2.41 C ATOM 111 O LYS A 46 3.260 0.813 7.041 1.00 71.13 O ATOM 112 CB LYS A 46 5.080 -1.725 6.119 1.00 41.32 C ATOM 113 CG LYS A 46 5.245 -3.145 5.566 1.00 50.20 C ATOM 114 CD LYS A 46 4.043 -4.022 5.881 1.00 61.33 C ATOM 115 CE LYS A 46 4.340 -5.502 5.663 1.00 4.01 C ATOM 116 NZ LYS A 46 4.798 -5.818 4.296 1.00 11.13 N ATOM 0 H LYS A 46 5.424 -0.777 3.867 1.00 32.04 H new ATOM 0 HA LYS A 46 3.057 -1.286 5.487 1.00 0.24 H new ATOM 0 HB2 LYS A 46 6.048 -1.227 6.069 1.00 41.32 H new ATOM 0 HB3 LYS A 46 4.814 -1.800 7.173 1.00 41.32 H new ATOM 0 HG2 LYS A 46 5.388 -3.099 4.486 1.00 50.20 H new ATOM 0 HG3 LYS A 46 6.143 -3.596 5.987 1.00 50.20 H new ATOM 0 HD2 LYS A 46 3.739 -3.862 6.916 1.00 61.33 H new ATOM 0 HD3 LYS A 46 3.203 -3.725 5.253 1.00 61.33 H new ATOM 0 HE2 LYS A 46 5.102 -5.820 6.375 1.00 4.01 H new ATOM 0 HE3 LYS A 46 3.441 -6.080 5.879 1.00 4.01 H new ATOM 0 HZ1 LYS A 46 4.932 -6.845 4.204 1.00 11.13 H new ATOM 0 HZ2 LYS A 46 4.086 -5.499 3.609 1.00 11.13 H new ATOM 0 HZ3 LYS A 46 5.699 -5.333 4.111 1.00 11.13 H new ATOM 130 N VAL A 47 4.857 1.458 5.573 1.00 12.11 N ATOM 131 CA VAL A 47 5.019 2.801 6.121 1.00 63.13 C ATOM 132 C VAL A 47 3.793 3.633 5.796 1.00 15.14 C ATOM 133 O VAL A 47 3.222 4.290 6.662 1.00 23.21 O ATOM 134 CB VAL A 47 6.285 3.505 5.517 1.00 14.22 C ATOM 135 CG1 VAL A 47 6.415 4.957 5.978 1.00 13.40 C ATOM 136 CG2 VAL A 47 7.550 2.743 5.857 1.00 31.43 C ATOM 0 H VAL A 47 5.417 1.281 4.739 1.00 12.11 H new ATOM 0 HA VAL A 47 5.144 2.716 7.200 1.00 63.13 H new ATOM 0 HB VAL A 47 6.151 3.507 4.435 1.00 14.22 H new ATOM 0 HG11 VAL A 47 7.306 5.401 5.534 1.00 13.40 H new ATOM 0 HG12 VAL A 47 5.535 5.518 5.665 1.00 13.40 H new ATOM 0 HG13 VAL A 47 6.497 4.988 7.064 1.00 13.40 H new ATOM 0 HG21 VAL A 47 8.410 3.255 5.425 1.00 31.43 H new ATOM 0 HG22 VAL A 47 7.664 2.692 6.940 1.00 31.43 H new ATOM 0 HG23 VAL A 47 7.487 1.733 5.451 1.00 31.43 H new ATOM 146 N THR A 48 3.352 3.521 4.559 1.00 20.11 N ATOM 147 CA THR A 48 2.235 4.290 4.054 1.00 4.11 C ATOM 148 C THR A 48 0.904 3.906 4.766 1.00 3.32 C ATOM 149 O THR A 48 -0.025 4.720 4.864 1.00 50.52 O ATOM 150 CB THR A 48 2.140 4.164 2.495 1.00 71.12 C ATOM 151 OG1 THR A 48 1.098 4.999 1.972 1.00 3.33 O ATOM 152 CG2 THR A 48 1.876 2.732 2.084 1.00 70.33 C ATOM 0 H THR A 48 3.763 2.889 3.872 1.00 20.11 H new ATOM 0 HA THR A 48 2.410 5.341 4.285 1.00 4.11 H new ATOM 0 HB THR A 48 3.097 4.487 2.087 1.00 71.12 H new ATOM 0 HG1 THR A 48 1.060 4.903 0.997 1.00 3.33 H new ATOM 0 HG21 THR A 48 1.814 2.671 0.997 1.00 70.33 H new ATOM 0 HG22 THR A 48 2.688 2.096 2.438 1.00 70.33 H new ATOM 0 HG23 THR A 48 0.935 2.396 2.520 1.00 70.33 H new ATOM 160 N VAL A 49 0.833 2.678 5.285 1.00 71.31 N ATOM 161 CA VAL A 49 -0.329 2.241 6.050 1.00 23.50 C ATOM 162 C VAL A 49 -0.300 2.915 7.408 1.00 13.50 C ATOM 163 O VAL A 49 -1.272 3.585 7.822 1.00 51.40 O ATOM 164 CB VAL A 49 -0.357 0.693 6.238 1.00 74.33 C ATOM 165 CG1 VAL A 49 -1.507 0.258 7.150 1.00 3.44 C ATOM 166 CG2 VAL A 49 -0.473 -0.003 4.891 1.00 53.54 C ATOM 0 H VAL A 49 1.565 1.974 5.188 1.00 71.31 H new ATOM 0 HA VAL A 49 -1.226 2.520 5.497 1.00 23.50 H new ATOM 0 HB VAL A 49 0.580 0.403 6.713 1.00 74.33 H new ATOM 0 HG11 VAL A 49 -1.495 -0.827 7.258 1.00 3.44 H new ATOM 0 HG12 VAL A 49 -1.390 0.722 8.130 1.00 3.44 H new ATOM 0 HG13 VAL A 49 -2.456 0.569 6.713 1.00 3.44 H new ATOM 0 HG21 VAL A 49 -0.491 -1.083 5.040 1.00 53.54 H new ATOM 0 HG22 VAL A 49 -1.393 0.311 4.397 1.00 53.54 H new ATOM 0 HG23 VAL A 49 0.382 0.263 4.269 1.00 53.54 H new ATOM 176 N ALA A 50 0.848 2.825 8.050 1.00 25.23 N ATOM 177 CA ALA A 50 1.016 3.356 9.380 1.00 33.21 C ATOM 178 C ALA A 50 0.867 4.859 9.414 1.00 41.24 C ATOM 179 O ALA A 50 0.509 5.402 10.429 1.00 72.04 O ATOM 180 CB ALA A 50 2.337 2.962 9.956 1.00 13.24 C ATOM 0 H ALA A 50 1.683 2.384 7.664 1.00 25.23 H new ATOM 0 HA ALA A 50 0.222 2.925 9.990 1.00 33.21 H new ATOM 0 HB1 ALA A 50 2.435 3.377 10.959 1.00 13.24 H new ATOM 0 HB2 ALA A 50 2.403 1.875 10.005 1.00 13.24 H new ATOM 0 HB3 ALA A 50 3.138 3.346 9.325 1.00 13.24 H new ATOM 186 N LYS A 51 1.113 5.535 8.288 1.00 33.24 N ATOM 187 CA LYS A 51 0.973 6.994 8.247 1.00 23.25 C ATOM 188 C LYS A 51 -0.496 7.407 8.448 1.00 72.14 C ATOM 189 O LYS A 51 -0.802 8.475 9.006 1.00 11.23 O ATOM 190 CB LYS A 51 1.485 7.558 6.918 1.00 73.03 C ATOM 191 CG LYS A 51 2.975 7.361 6.665 1.00 60.41 C ATOM 192 CD LYS A 51 3.855 8.169 7.621 1.00 52.13 C ATOM 193 CE LYS A 51 3.687 9.673 7.411 1.00 65.23 C ATOM 194 NZ LYS A 51 4.653 10.458 8.208 1.00 1.14 N ATOM 0 H LYS A 51 1.404 5.107 7.409 1.00 33.24 H new ATOM 0 HA LYS A 51 1.574 7.404 9.059 1.00 23.25 H new ATOM 0 HB2 LYS A 51 0.929 7.092 6.105 1.00 73.03 H new ATOM 0 HB3 LYS A 51 1.264 8.625 6.884 1.00 73.03 H new ATOM 0 HG2 LYS A 51 3.218 6.303 6.763 1.00 60.41 H new ATOM 0 HG3 LYS A 51 3.205 7.647 5.639 1.00 60.41 H new ATOM 0 HD2 LYS A 51 3.602 7.915 8.650 1.00 52.13 H new ATOM 0 HD3 LYS A 51 4.900 7.896 7.473 1.00 52.13 H new ATOM 0 HE2 LYS A 51 3.815 9.907 6.354 1.00 65.23 H new ATOM 0 HE3 LYS A 51 2.672 9.965 7.682 1.00 65.23 H new ATOM 0 HZ1 LYS A 51 4.503 11.472 8.035 1.00 1.14 H new ATOM 0 HZ2 LYS A 51 4.515 10.255 9.219 1.00 1.14 H new ATOM 0 HZ3 LYS A 51 5.622 10.199 7.932 1.00 1.14 H new ATOM 208 N GLY A 52 -1.386 6.515 8.085 1.00 72.22 N ATOM 209 CA GLY A 52 -2.783 6.766 8.267 1.00 43.32 C ATOM 210 C GLY A 52 -3.205 6.337 9.632 1.00 5.04 C ATOM 211 O GLY A 52 -4.151 6.884 10.219 1.00 5.22 O ATOM 0 H GLY A 52 -1.162 5.613 7.664 1.00 72.22 H new ATOM 0 HA2 GLY A 52 -2.991 7.827 8.130 1.00 43.32 H new ATOM 0 HA3 GLY A 52 -3.359 6.228 7.514 1.00 43.32 H new ATOM 215 N ASP A 53 -2.488 5.377 10.168 1.00 64.24 N ATOM 216 CA ASP A 53 -2.806 4.846 11.474 1.00 75.02 C ATOM 217 C ASP A 53 -2.321 5.772 12.557 1.00 45.34 C ATOM 218 O ASP A 53 -2.996 5.973 13.545 1.00 20.24 O ATOM 219 CB ASP A 53 -2.238 3.446 11.681 1.00 72.01 C ATOM 220 CG ASP A 53 -2.722 2.451 10.655 1.00 54.41 C ATOM 221 OD1 ASP A 53 -3.941 2.414 10.360 1.00 41.33 O ATOM 222 OD2 ASP A 53 -1.904 1.692 10.130 1.00 61.21 O ATOM 0 H ASP A 53 -1.679 4.947 9.719 1.00 64.24 H new ATOM 0 HA ASP A 53 -3.892 4.769 11.531 1.00 75.02 H new ATOM 0 HB2 ASP A 53 -1.150 3.494 11.646 1.00 72.01 H new ATOM 0 HB3 ASP A 53 -2.510 3.094 12.676 1.00 72.01 H new ATOM 227 N ILE A 54 -1.166 6.368 12.361 1.00 61.04 N ATOM 228 CA ILE A 54 -0.625 7.310 13.328 1.00 14.00 C ATOM 229 C ILE A 54 -1.483 8.567 13.408 1.00 22.11 C ATOM 230 O ILE A 54 -1.701 9.115 14.503 1.00 63.32 O ATOM 231 CB ILE A 54 0.860 7.680 13.053 1.00 51.52 C ATOM 232 CG1 ILE A 54 1.036 8.213 11.626 1.00 12.22 C ATOM 233 CG2 ILE A 54 1.771 6.492 13.319 1.00 65.41 C ATOM 234 CD1 ILE A 54 2.450 8.568 11.247 1.00 70.12 C ATOM 0 H ILE A 54 -0.579 6.220 11.540 1.00 61.04 H new ATOM 0 HA ILE A 54 -0.650 6.803 14.293 1.00 14.00 H new ATOM 0 HB ILE A 54 1.146 8.477 13.740 1.00 51.52 H new ATOM 0 HG12 ILE A 54 0.666 7.463 10.926 1.00 12.22 H new ATOM 0 HG13 ILE A 54 0.411 9.098 11.505 1.00 12.22 H new ATOM 0 HG21 ILE A 54 2.805 6.774 13.120 1.00 65.41 H new ATOM 0 HG22 ILE A 54 1.673 6.184 14.360 1.00 65.41 H new ATOM 0 HG23 ILE A 54 1.489 5.664 12.668 1.00 65.41 H new ATOM 0 HD11 ILE A 54 2.470 8.935 10.221 1.00 70.12 H new ATOM 0 HD12 ILE A 54 2.823 9.343 11.917 1.00 70.12 H new ATOM 0 HD13 ILE A 54 3.082 7.683 11.329 1.00 70.12 H new ATOM 246 N LYS A 55 -1.997 9.028 12.258 1.00 44.12 N ATOM 247 CA LYS A 55 -2.863 10.173 12.243 1.00 44.13 C ATOM 248 C LYS A 55 -4.201 9.830 12.903 1.00 24.40 C ATOM 249 O LYS A 55 -4.888 10.703 13.436 1.00 51.22 O ATOM 250 CB LYS A 55 -3.062 10.675 10.822 1.00 25.04 C ATOM 251 CG LYS A 55 -3.356 12.156 10.745 1.00 51.11 C ATOM 252 CD LYS A 55 -2.181 12.926 11.318 1.00 5.42 C ATOM 253 CE LYS A 55 -2.357 14.429 11.223 1.00 43.20 C ATOM 254 NZ LYS A 55 -1.224 15.155 11.844 1.00 70.31 N ATOM 0 H LYS A 55 -1.818 8.616 11.342 1.00 44.12 H new ATOM 0 HA LYS A 55 -2.397 10.975 12.815 1.00 44.13 H new ATOM 0 HB2 LYS A 55 -2.167 10.459 10.239 1.00 25.04 H new ATOM 0 HB3 LYS A 55 -3.882 10.125 10.361 1.00 25.04 H new ATOM 0 HG2 LYS A 55 -3.531 12.451 9.710 1.00 51.11 H new ATOM 0 HG3 LYS A 55 -4.265 12.388 11.300 1.00 51.11 H new ATOM 0 HD2 LYS A 55 -2.045 12.647 12.363 1.00 5.42 H new ATOM 0 HD3 LYS A 55 -1.272 12.638 10.790 1.00 5.42 H new ATOM 0 HE2 LYS A 55 -2.445 14.719 10.176 1.00 43.20 H new ATOM 0 HE3 LYS A 55 -3.287 14.718 11.713 1.00 43.20 H new ATOM 0 HZ1 LYS A 55 -1.380 16.180 11.759 1.00 70.31 H new ATOM 0 HZ2 LYS A 55 -1.156 14.897 12.849 1.00 70.31 H new ATOM 0 HZ3 LYS A 55 -0.340 14.898 11.360 1.00 70.31 H new ATOM 268 N ALA A 56 -4.551 8.558 12.854 1.00 34.13 N ATOM 269 CA ALA A 56 -5.728 8.043 13.523 1.00 42.35 C ATOM 270 C ALA A 56 -5.555 8.131 15.043 1.00 63.43 C ATOM 271 O ALA A 56 -6.457 8.574 15.764 1.00 30.41 O ATOM 272 CB ALA A 56 -5.937 6.599 13.124 1.00 12.44 C ATOM 0 H ALA A 56 -4.022 7.850 12.345 1.00 34.13 H new ATOM 0 HA ALA A 56 -6.593 8.638 13.230 1.00 42.35 H new ATOM 0 HB1 ALA A 56 -6.822 6.207 13.625 1.00 12.44 H new ATOM 0 HB2 ALA A 56 -6.074 6.536 12.044 1.00 12.44 H new ATOM 0 HB3 ALA A 56 -5.066 6.012 13.414 1.00 12.44 H new ATOM 278 N ILE A 57 -4.379 7.725 15.515 1.00 34.31 N ATOM 279 CA ILE A 57 -4.058 7.729 16.949 1.00 63.00 C ATOM 280 C ILE A 57 -4.044 9.157 17.461 1.00 41.34 C ATOM 281 O ILE A 57 -4.596 9.455 18.502 1.00 31.44 O ATOM 282 CB ILE A 57 -2.674 7.098 17.229 1.00 55.51 C ATOM 283 CG1 ILE A 57 -2.564 5.768 16.518 1.00 44.05 C ATOM 284 CG2 ILE A 57 -2.499 6.886 18.732 1.00 21.35 C ATOM 285 CD1 ILE A 57 -1.191 5.157 16.544 1.00 12.44 C ATOM 0 H ILE A 57 -3.622 7.385 14.922 1.00 34.31 H new ATOM 0 HA ILE A 57 -4.820 7.139 17.458 1.00 63.00 H new ATOM 0 HB ILE A 57 -1.896 7.769 16.864 1.00 55.51 H new ATOM 0 HG12 ILE A 57 -3.267 5.069 16.971 1.00 44.05 H new ATOM 0 HG13 ILE A 57 -2.869 5.899 15.480 1.00 44.05 H new ATOM 0 HG21 ILE A 57 -1.523 6.441 18.925 1.00 21.35 H new ATOM 0 HG22 ILE A 57 -2.569 7.845 19.245 1.00 21.35 H new ATOM 0 HG23 ILE A 57 -3.280 6.220 19.099 1.00 21.35 H new ATOM 0 HD11 ILE A 57 -1.206 4.206 16.011 1.00 12.44 H new ATOM 0 HD12 ILE A 57 -0.483 5.832 16.063 1.00 12.44 H new ATOM 0 HD13 ILE A 57 -0.887 4.989 17.577 1.00 12.44 H new ATOM 297 N ALA A 58 -3.460 10.047 16.674 1.00 1.33 N ATOM 298 CA ALA A 58 -3.373 11.467 17.023 1.00 44.04 C ATOM 299 C ALA A 58 -4.768 12.078 17.219 1.00 41.13 C ATOM 300 O ALA A 58 -4.957 13.002 18.011 1.00 45.53 O ATOM 301 CB ALA A 58 -2.609 12.223 15.944 1.00 53.33 C ATOM 0 H ALA A 58 -3.033 9.813 15.778 1.00 1.33 H new ATOM 0 HA ALA A 58 -2.835 11.554 17.967 1.00 44.04 H new ATOM 0 HB1 ALA A 58 -2.549 13.278 16.212 1.00 53.33 H new ATOM 0 HB2 ALA A 58 -1.603 11.813 15.856 1.00 53.33 H new ATOM 0 HB3 ALA A 58 -3.127 12.120 14.991 1.00 53.33 H new ATOM 307 N ALA A 59 -5.742 11.522 16.533 1.00 42.44 N ATOM 308 CA ALA A 59 -7.103 11.999 16.600 1.00 14.43 C ATOM 309 C ALA A 59 -7.797 11.420 17.819 1.00 61.53 C ATOM 310 O ALA A 59 -8.679 12.042 18.411 1.00 64.54 O ATOM 311 CB ALA A 59 -7.847 11.614 15.342 1.00 55.13 C ATOM 0 H ALA A 59 -5.611 10.724 15.911 1.00 42.44 H new ATOM 0 HA ALA A 59 -7.095 13.086 16.685 1.00 14.43 H new ATOM 0 HB1 ALA A 59 -8.873 11.977 15.400 1.00 55.13 H new ATOM 0 HB2 ALA A 59 -7.354 12.058 14.477 1.00 55.13 H new ATOM 0 HB3 ALA A 59 -7.852 10.529 15.240 1.00 55.13 H new ATOM 317 N ALA A 60 -7.380 10.236 18.203 1.00 4.31 N ATOM 318 CA ALA A 60 -7.941 9.568 19.346 1.00 73.14 C ATOM 319 C ALA A 60 -7.290 10.075 20.630 1.00 51.33 C ATOM 320 O ALA A 60 -7.913 10.107 21.671 1.00 2.13 O ATOM 321 CB ALA A 60 -7.802 8.072 19.203 1.00 45.14 C ATOM 0 H ALA A 60 -6.643 9.712 17.730 1.00 4.31 H new ATOM 0 HA ALA A 60 -9.005 9.796 19.403 1.00 73.14 H new ATOM 0 HB1 ALA A 60 -8.232 7.582 20.077 1.00 45.14 H new ATOM 0 HB2 ALA A 60 -8.327 7.742 18.307 1.00 45.14 H new ATOM 0 HB3 ALA A 60 -6.747 7.811 19.122 1.00 45.14 H new ATOM 327 N LEU A 61 -6.054 10.520 20.534 1.00 74.22 N ATOM 328 CA LEU A 61 -5.355 11.125 21.657 1.00 61.03 C ATOM 329 C LEU A 61 -6.062 12.447 21.994 1.00 1.22 C ATOM 330 O LEU A 61 -6.176 12.838 23.155 1.00 75.12 O ATOM 331 CB LEU A 61 -3.872 11.312 21.256 1.00 73.35 C ATOM 332 CG LEU A 61 -2.828 11.523 22.371 1.00 52.02 C ATOM 333 CD1 LEU A 61 -2.926 12.885 22.992 1.00 74.44 C ATOM 334 CD2 LEU A 61 -2.972 10.471 23.446 1.00 21.24 C ATOM 0 H LEU A 61 -5.503 10.474 19.677 1.00 74.22 H new ATOM 0 HA LEU A 61 -5.374 10.502 22.551 1.00 61.03 H new ATOM 0 HB2 LEU A 61 -3.571 10.436 20.682 1.00 73.35 H new ATOM 0 HB3 LEU A 61 -3.816 12.168 20.584 1.00 73.35 H new ATOM 0 HG LEU A 61 -1.849 11.435 21.901 1.00 52.02 H new ATOM 0 HD11 LEU A 61 -2.170 12.985 23.771 1.00 74.44 H new ATOM 0 HD12 LEU A 61 -2.763 13.646 22.229 1.00 74.44 H new ATOM 0 HD13 LEU A 61 -3.916 13.016 23.428 1.00 74.44 H new ATOM 0 HD21 LEU A 61 -2.225 10.639 24.222 1.00 21.24 H new ATOM 0 HD22 LEU A 61 -3.969 10.531 23.882 1.00 21.24 H new ATOM 0 HD23 LEU A 61 -2.825 9.483 23.010 1.00 21.24 H new ATOM 346 N ASP A 62 -6.628 13.066 20.964 1.00 42.14 N ATOM 347 CA ASP A 62 -7.462 14.268 21.116 1.00 60.41 C ATOM 348 C ASP A 62 -8.809 13.876 21.773 1.00 71.11 C ATOM 349 O ASP A 62 -9.473 14.674 22.432 1.00 12.21 O ATOM 350 CB ASP A 62 -7.688 14.930 19.739 1.00 4.54 C ATOM 351 CG ASP A 62 -8.615 16.137 19.774 1.00 22.02 C ATOM 352 OD1 ASP A 62 -8.135 17.283 19.951 1.00 41.34 O ATOM 353 OD2 ASP A 62 -9.842 15.960 19.590 1.00 24.11 O ATOM 0 H ASP A 62 -6.526 12.755 19.998 1.00 42.14 H new ATOM 0 HA ASP A 62 -6.957 14.990 21.758 1.00 60.41 H new ATOM 0 HB2 ASP A 62 -6.724 15.237 19.333 1.00 4.54 H new ATOM 0 HB3 ASP A 62 -8.100 14.188 19.055 1.00 4.54 H new ATOM 358 N MET A 63 -9.165 12.626 21.635 1.00 43.01 N ATOM 359 CA MET A 63 -10.380 12.105 22.234 1.00 41.10 C ATOM 360 C MET A 63 -10.141 11.719 23.694 1.00 11.35 C ATOM 361 O MET A 63 -11.052 11.764 24.505 1.00 14.54 O ATOM 362 CB MET A 63 -10.961 10.955 21.408 1.00 50.25 C ATOM 363 CG MET A 63 -11.448 11.414 20.044 1.00 31.04 C ATOM 364 SD MET A 63 -12.110 10.088 19.022 1.00 64.43 S ATOM 365 CE MET A 63 -12.825 11.068 17.701 1.00 23.40 C ATOM 0 H MET A 63 -8.628 11.937 21.108 1.00 43.01 H new ATOM 0 HA MET A 63 -11.131 12.895 22.231 1.00 41.10 H new ATOM 0 HB2 MET A 63 -10.202 10.183 21.280 1.00 50.25 H new ATOM 0 HB3 MET A 63 -11.789 10.501 21.953 1.00 50.25 H new ATOM 0 HG2 MET A 63 -12.218 12.173 20.181 1.00 31.04 H new ATOM 0 HG3 MET A 63 -10.622 11.889 19.515 1.00 31.04 H new ATOM 0 HE1 MET A 63 -13.286 10.408 16.966 1.00 23.40 H new ATOM 0 HE2 MET A 63 -13.581 11.737 18.112 1.00 23.40 H new ATOM 0 HE3 MET A 63 -12.043 11.656 17.220 1.00 23.40 H new ATOM 375 N TYR A 64 -8.902 11.344 24.027 1.00 62.53 N ATOM 376 CA TYR A 64 -8.523 11.153 25.431 1.00 64.42 C ATOM 377 C TYR A 64 -8.451 12.522 26.075 1.00 24.31 C ATOM 378 O TYR A 64 -8.802 12.698 27.236 1.00 0.21 O ATOM 379 CB TYR A 64 -7.164 10.473 25.574 1.00 64.52 C ATOM 380 CG TYR A 64 -6.791 10.271 27.028 1.00 15.23 C ATOM 381 CD1 TYR A 64 -7.177 9.141 27.714 1.00 11.22 C ATOM 382 CD2 TYR A 64 -6.073 11.228 27.724 1.00 23.32 C ATOM 383 CE1 TYR A 64 -6.864 8.972 29.005 1.00 24.13 C ATOM 384 CE2 TYR A 64 -5.768 11.062 29.021 1.00 24.54 C ATOM 385 CZ TYR A 64 -6.156 9.932 29.657 1.00 74.40 C ATOM 386 OH TYR A 64 -5.866 9.789 30.947 1.00 2.14 O ATOM 0 H TYR A 64 -8.154 11.169 23.356 1.00 62.53 H new ATOM 0 HA TYR A 64 -9.264 10.512 25.909 1.00 64.42 H new ATOM 0 HB2 TYR A 64 -7.184 9.509 25.066 1.00 64.52 H new ATOM 0 HB3 TYR A 64 -6.401 11.077 25.083 1.00 64.52 H new ATOM 0 HD1 TYR A 64 -7.743 8.377 27.201 1.00 11.22 H new ATOM 0 HD2 TYR A 64 -5.752 12.125 27.215 1.00 23.32 H new ATOM 0 HE1 TYR A 64 -7.173 8.077 29.526 1.00 24.13 H new ATOM 0 HE2 TYR A 64 -5.217 11.824 29.553 1.00 24.54 H new ATOM 0 HH TYR A 64 -6.383 10.435 31.472 1.00 2.14 H new ATOM 396 N LYS A 65 -7.989 13.487 25.288 1.00 70.11 N ATOM 397 CA LYS A 65 -7.968 14.884 25.671 1.00 53.13 C ATOM 398 C LYS A 65 -9.368 15.305 26.098 1.00 54.21 C ATOM 399 O LYS A 65 -9.534 16.071 27.017 1.00 11.14 O ATOM 400 CB LYS A 65 -7.516 15.679 24.459 1.00 4.34 C ATOM 401 CG LYS A 65 -7.735 17.175 24.480 1.00 54.15 C ATOM 402 CD LYS A 65 -7.360 17.725 23.120 1.00 42.45 C ATOM 403 CE LYS A 65 -7.732 19.172 22.925 1.00 64.03 C ATOM 404 NZ LYS A 65 -7.400 19.612 21.551 1.00 10.11 N ATOM 0 H LYS A 65 -7.615 13.313 24.355 1.00 70.11 H new ATOM 0 HA LYS A 65 -7.289 15.059 26.506 1.00 53.13 H new ATOM 0 HB2 LYS A 65 -6.451 15.498 24.317 1.00 4.34 H new ATOM 0 HB3 LYS A 65 -8.027 15.277 23.584 1.00 4.34 H new ATOM 0 HG2 LYS A 65 -8.776 17.404 24.709 1.00 54.15 H new ATOM 0 HG3 LYS A 65 -7.128 17.638 25.258 1.00 54.15 H new ATOM 0 HD2 LYS A 65 -6.285 17.614 22.977 1.00 42.45 H new ATOM 0 HD3 LYS A 65 -7.848 17.127 22.350 1.00 42.45 H new ATOM 0 HE2 LYS A 65 -8.798 19.308 23.109 1.00 64.03 H new ATOM 0 HE3 LYS A 65 -7.202 19.791 23.649 1.00 64.03 H new ATOM 0 HZ1 LYS A 65 -7.960 20.455 21.312 1.00 10.11 H new ATOM 0 HZ2 LYS A 65 -6.387 19.842 21.495 1.00 10.11 H new ATOM 0 HZ3 LYS A 65 -7.619 18.849 20.880 1.00 10.11 H new ATOM 418 N LEU A 66 -10.361 14.764 25.430 1.00 53.34 N ATOM 419 CA LEU A 66 -11.737 15.005 25.795 1.00 14.34 C ATOM 420 C LEU A 66 -12.142 14.181 27.050 1.00 14.51 C ATOM 421 O LEU A 66 -12.845 14.680 27.915 1.00 64.21 O ATOM 422 CB LEU A 66 -12.654 14.662 24.608 1.00 74.34 C ATOM 423 CG LEU A 66 -14.152 14.883 24.816 1.00 12.44 C ATOM 424 CD1 LEU A 66 -14.450 16.345 25.082 1.00 63.55 C ATOM 425 CD2 LEU A 66 -14.935 14.402 23.616 1.00 21.31 C ATOM 0 H LEU A 66 -10.239 14.150 24.625 1.00 53.34 H new ATOM 0 HA LEU A 66 -11.848 16.060 26.044 1.00 14.34 H new ATOM 0 HB2 LEU A 66 -12.338 15.255 23.750 1.00 74.34 H new ATOM 0 HB3 LEU A 66 -12.497 13.615 24.347 1.00 74.34 H new ATOM 0 HG LEU A 66 -14.458 14.304 25.687 1.00 12.44 H new ATOM 0 HD11 LEU A 66 -15.522 16.477 25.227 1.00 63.55 H new ATOM 0 HD12 LEU A 66 -13.920 16.667 25.979 1.00 63.55 H new ATOM 0 HD13 LEU A 66 -14.122 16.944 24.232 1.00 63.55 H new ATOM 0 HD21 LEU A 66 -15.999 14.569 23.785 1.00 21.31 H new ATOM 0 HD22 LEU A 66 -14.618 14.952 22.730 1.00 21.31 H new ATOM 0 HD23 LEU A 66 -14.754 13.338 23.466 1.00 21.31 H new ATOM 437 N ASP A 67 -11.629 12.953 27.167 1.00 75.10 N ATOM 438 CA ASP A 67 -12.020 12.031 28.279 1.00 64.11 C ATOM 439 C ASP A 67 -11.441 12.474 29.621 1.00 32.32 C ATOM 440 O ASP A 67 -12.015 12.221 30.660 1.00 42.25 O ATOM 441 CB ASP A 67 -11.513 10.591 27.966 1.00 14.31 C ATOM 442 CG ASP A 67 -11.791 9.542 29.071 1.00 74.10 C ATOM 443 OD1 ASP A 67 -12.889 8.953 29.084 1.00 21.45 O ATOM 444 OD2 ASP A 67 -10.893 9.261 29.884 1.00 30.41 O ATOM 0 H ASP A 67 -10.946 12.561 26.519 1.00 75.10 H new ATOM 0 HA ASP A 67 -13.107 12.051 28.352 1.00 64.11 H new ATOM 0 HB2 ASP A 67 -11.978 10.252 27.040 1.00 14.31 H new ATOM 0 HB3 ASP A 67 -10.439 10.632 27.787 1.00 14.31 H new ATOM 449 N ASN A 68 -10.376 13.216 29.595 1.00 25.31 N ATOM 450 CA ASN A 68 -9.754 13.662 30.842 1.00 2.10 C ATOM 451 C ASN A 68 -9.550 15.107 30.785 1.00 63.11 C ATOM 452 O ASN A 68 -8.725 15.635 31.532 1.00 31.53 O ATOM 453 CB ASN A 68 -8.425 13.042 30.976 1.00 21.35 C ATOM 454 CG ASN A 68 -7.914 12.805 32.400 1.00 22.11 C ATOM 455 OD1 ASN A 68 -6.705 12.807 32.631 1.00 41.00 O ATOM 456 ND2 ASN A 68 -8.785 12.588 33.349 1.00 50.41 N ATOM 0 H ASN A 68 -9.911 13.532 28.744 1.00 25.31 H new ATOM 0 HA ASN A 68 -10.398 13.387 31.677 1.00 2.10 H new ATOM 0 HB2 ASN A 68 -8.444 12.083 30.458 1.00 21.35 H new ATOM 0 HB3 ASN A 68 -7.703 13.671 30.456 1.00 21.35 H new ATOM 0 HD21 ASN A 68 -8.468 12.416 34.303 1.00 50.41 H new ATOM 0 HD22 ASN A 68 -9.783 12.591 33.136 1.00 50.41 H new ATOM 463 N PHE A 69 -10.301 15.758 29.888 1.00 54.25 N ATOM 464 CA PHE A 69 -10.290 17.227 29.666 1.00 4.23 C ATOM 465 C PHE A 69 -8.882 17.836 29.655 1.00 53.43 C ATOM 466 O PHE A 69 -8.698 19.040 29.950 1.00 71.24 O ATOM 467 CB PHE A 69 -11.188 17.910 30.696 1.00 25.12 C ATOM 468 CG PHE A 69 -10.982 17.461 32.117 1.00 44.03 C ATOM 469 CD1 PHE A 69 -9.960 17.943 32.868 1.00 61.04 C ATOM 470 CD2 PHE A 69 -11.835 16.577 32.676 1.00 65.14 C ATOM 471 CE1 PHE A 69 -9.784 17.558 34.167 1.00 43.05 C ATOM 472 CE2 PHE A 69 -11.705 16.186 33.969 1.00 65.42 C ATOM 473 CZ PHE A 69 -10.672 16.680 34.736 1.00 72.44 C ATOM 0 H PHE A 69 -10.955 15.272 29.274 1.00 54.25 H new ATOM 0 HA PHE A 69 -10.685 17.404 28.666 1.00 4.23 H new ATOM 0 HB2 PHE A 69 -11.022 18.986 30.643 1.00 25.12 H new ATOM 0 HB3 PHE A 69 -12.228 17.734 30.422 1.00 25.12 H new ATOM 0 HD1 PHE A 69 -9.269 18.648 32.429 1.00 61.04 H new ATOM 0 HD2 PHE A 69 -12.640 16.171 32.081 1.00 65.14 H new ATOM 0 HE1 PHE A 69 -8.953 17.941 34.741 1.00 43.05 H new ATOM 0 HE2 PHE A 69 -12.410 15.489 34.396 1.00 65.42 H new ATOM 0 HZ PHE A 69 -10.563 16.381 35.768 1.00 72.44 H new ATOM 483 N ALA A 70 -7.932 17.069 29.175 1.00 23.20 N ATOM 484 CA ALA A 70 -6.549 17.414 29.242 1.00 25.50 C ATOM 485 C ALA A 70 -5.750 16.333 28.580 1.00 22.24 C ATOM 486 O ALA A 70 -6.238 15.210 28.415 1.00 43.41 O ATOM 487 CB ALA A 70 -6.128 17.500 30.707 1.00 31.31 C ATOM 0 H ALA A 70 -8.111 16.174 28.721 1.00 23.20 H new ATOM 0 HA ALA A 70 -6.380 18.370 28.746 1.00 25.50 H new ATOM 0 HB1 ALA A 70 -5.072 17.763 30.767 1.00 31.31 H new ATOM 0 HB2 ALA A 70 -6.721 18.262 31.212 1.00 31.31 H new ATOM 0 HB3 ALA A 70 -6.290 16.536 31.189 1.00 31.31 H new ATOM 493 N TYR A 71 -4.561 16.662 28.181 1.00 4.55 N ATOM 494 CA TYR A 71 -3.661 15.684 27.668 1.00 55.04 C ATOM 495 C TYR A 71 -3.018 14.888 28.788 1.00 61.10 C ATOM 496 O TYR A 71 -2.873 15.386 29.925 1.00 52.03 O ATOM 497 CB TYR A 71 -2.591 16.300 26.768 1.00 22.21 C ATOM 498 CG TYR A 71 -3.100 16.665 25.411 1.00 63.54 C ATOM 499 CD1 TYR A 71 -3.749 15.719 24.627 1.00 31.10 C ATOM 500 CD2 TYR A 71 -2.938 17.936 24.906 1.00 25.22 C ATOM 501 CE1 TYR A 71 -4.214 16.031 23.387 1.00 32.14 C ATOM 502 CE2 TYR A 71 -3.399 18.262 23.657 1.00 0.43 C ATOM 503 CZ TYR A 71 -4.036 17.310 22.897 1.00 51.41 C ATOM 504 OH TYR A 71 -4.492 17.639 21.648 1.00 45.13 O ATOM 0 H TYR A 71 -4.191 17.612 28.202 1.00 4.55 H new ATOM 0 HA TYR A 71 -4.253 15.004 27.055 1.00 55.04 H new ATOM 0 HB2 TYR A 71 -2.190 17.191 27.250 1.00 22.21 H new ATOM 0 HB3 TYR A 71 -1.766 15.596 26.662 1.00 22.21 H new ATOM 0 HD1 TYR A 71 -3.887 14.718 25.009 1.00 31.10 H new ATOM 0 HD2 TYR A 71 -2.441 18.686 25.503 1.00 25.22 H new ATOM 0 HE1 TYR A 71 -4.718 15.285 22.791 1.00 32.14 H new ATOM 0 HE2 TYR A 71 -3.262 19.262 23.272 1.00 0.43 H new ATOM 0 HH TYR A 71 -5.116 16.951 21.336 1.00 45.13 H new ATOM 514 N PRO A 72 -2.655 13.640 28.492 1.00 10.03 N ATOM 515 CA PRO A 72 -1.972 12.755 29.437 1.00 73.34 C ATOM 516 C PRO A 72 -0.560 13.279 29.765 1.00 41.42 C ATOM 517 O PRO A 72 -0.041 14.118 29.044 1.00 44.40 O ATOM 518 CB PRO A 72 -1.872 11.433 28.642 1.00 31.52 C ATOM 519 CG PRO A 72 -1.999 11.805 27.218 1.00 71.22 C ATOM 520 CD PRO A 72 -2.896 12.977 27.188 1.00 10.33 C ATOM 0 HA PRO A 72 -2.490 12.665 30.392 1.00 73.34 H new ATOM 0 HB2 PRO A 72 -0.922 10.934 28.832 1.00 31.52 H new ATOM 0 HB3 PRO A 72 -2.660 10.740 28.936 1.00 31.52 H new ATOM 0 HG2 PRO A 72 -1.027 12.046 26.788 1.00 71.22 H new ATOM 0 HG3 PRO A 72 -2.411 10.982 26.634 1.00 71.22 H new ATOM 0 HD2 PRO A 72 -2.662 13.638 26.354 1.00 10.33 H new ATOM 0 HD3 PRO A 72 -3.939 12.680 27.077 1.00 10.33 H new ATOM 528 N SER A 73 0.050 12.817 30.847 1.00 11.30 N ATOM 529 CA SER A 73 1.423 13.189 31.120 1.00 2.01 C ATOM 530 C SER A 73 2.275 12.042 30.639 1.00 41.30 C ATOM 531 O SER A 73 1.769 10.936 30.529 1.00 65.24 O ATOM 532 CB SER A 73 1.625 13.453 32.605 1.00 62.53 C ATOM 533 OG SER A 73 1.270 12.323 33.374 1.00 24.40 O ATOM 0 H SER A 73 -0.377 12.197 31.535 1.00 11.30 H new ATOM 0 HA SER A 73 1.696 14.112 30.608 1.00 2.01 H new ATOM 0 HB2 SER A 73 2.667 13.712 32.793 1.00 62.53 H new ATOM 0 HB3 SER A 73 1.023 14.309 32.911 1.00 62.53 H new ATOM 0 HG SER A 73 1.613 12.427 34.286 1.00 24.40 H new ATOM 539 N THR A 74 3.522 12.253 30.323 1.00 13.14 N ATOM 540 CA THR A 74 4.301 11.160 29.768 1.00 61.13 C ATOM 541 C THR A 74 4.551 10.030 30.824 1.00 10.41 C ATOM 542 O THR A 74 4.985 8.925 30.490 1.00 63.23 O ATOM 543 CB THR A 74 5.609 11.652 29.092 1.00 24.44 C ATOM 544 OG1 THR A 74 5.978 10.733 28.031 1.00 23.23 O ATOM 545 CG2 THR A 74 6.749 11.763 30.112 1.00 72.23 C ATOM 0 H THR A 74 4.017 13.138 30.432 1.00 13.14 H new ATOM 0 HA THR A 74 3.704 10.714 28.973 1.00 61.13 H new ATOM 0 HB THR A 74 5.434 12.644 28.675 1.00 24.44 H new ATOM 0 HG1 THR A 74 5.746 11.125 27.163 1.00 23.23 H new ATOM 0 HG21 THR A 74 7.653 12.110 29.611 1.00 72.23 H new ATOM 0 HG22 THR A 74 6.472 12.472 30.892 1.00 72.23 H new ATOM 0 HG23 THR A 74 6.934 10.786 30.559 1.00 72.23 H new ATOM 553 N GLN A 75 4.270 10.321 32.084 1.00 23.33 N ATOM 554 CA GLN A 75 4.340 9.320 33.119 1.00 33.24 C ATOM 555 C GLN A 75 2.929 8.818 33.490 1.00 14.23 C ATOM 556 O GLN A 75 2.568 7.676 33.178 1.00 73.54 O ATOM 557 CB GLN A 75 5.063 9.870 34.347 1.00 20.14 C ATOM 558 CG GLN A 75 6.531 10.210 34.117 1.00 75.22 C ATOM 559 CD GLN A 75 7.396 9.020 33.734 1.00 31.14 C ATOM 560 OE1 GLN A 75 8.374 9.174 32.998 1.00 13.31 O ATOM 561 NE2 GLN A 75 7.080 7.847 34.239 1.00 30.21 N ATOM 0 H GLN A 75 3.991 11.247 32.408 1.00 23.33 H new ATOM 0 HA GLN A 75 4.910 8.472 32.739 1.00 33.24 H new ATOM 0 HB2 GLN A 75 4.545 10.766 34.687 1.00 20.14 H new ATOM 0 HB3 GLN A 75 4.994 9.138 35.152 1.00 20.14 H new ATOM 0 HG2 GLN A 75 6.599 10.962 33.331 1.00 75.22 H new ATOM 0 HG3 GLN A 75 6.934 10.660 35.024 1.00 75.22 H new ATOM 0 HE21 GLN A 75 6.264 7.755 34.844 1.00 30.21 H new ATOM 0 HE22 GLN A 75 7.651 7.029 34.025 1.00 30.21 H new ATOM 570 N GLN A 76 2.091 9.709 34.043 1.00 22.22 N ATOM 571 CA GLN A 76 0.755 9.317 34.522 1.00 4.14 C ATOM 572 C GLN A 76 -0.154 9.090 33.376 1.00 54.00 C ATOM 573 O GLN A 76 -0.898 8.125 33.369 1.00 33.41 O ATOM 574 CB GLN A 76 0.158 10.371 35.461 1.00 4.01 C ATOM 575 CG GLN A 76 0.860 10.493 36.798 1.00 70.11 C ATOM 576 CD GLN A 76 0.535 9.334 37.707 1.00 25.44 C ATOM 577 OE1 GLN A 76 1.197 8.305 37.684 1.00 35.44 O ATOM 578 NE2 GLN A 76 -0.469 9.497 38.521 1.00 65.44 N ATOM 0 H GLN A 76 2.311 10.697 34.169 1.00 22.22 H new ATOM 0 HA GLN A 76 0.866 8.391 35.085 1.00 4.14 H new ATOM 0 HB2 GLN A 76 0.184 11.340 34.962 1.00 4.01 H new ATOM 0 HB3 GLN A 76 -0.891 10.130 35.636 1.00 4.01 H new ATOM 0 HG2 GLN A 76 1.937 10.541 36.640 1.00 70.11 H new ATOM 0 HG3 GLN A 76 0.567 11.426 37.279 1.00 70.11 H new ATOM 0 HE21 GLN A 76 -0.997 10.369 38.511 1.00 65.44 H new ATOM 0 HE22 GLN A 76 -0.727 8.752 39.168 1.00 65.44 H new ATOM 587 N GLY A 77 -0.067 9.940 32.380 1.00 25.43 N ATOM 588 CA GLY A 77 -0.917 9.777 31.260 1.00 34.22 C ATOM 589 C GLY A 77 -0.511 8.626 30.355 1.00 64.22 C ATOM 590 O GLY A 77 -1.326 8.131 29.623 1.00 44.12 O ATOM 0 H GLY A 77 0.575 10.731 32.335 1.00 25.43 H new ATOM 0 HA2 GLY A 77 -1.937 9.613 31.608 1.00 34.22 H new ATOM 0 HA3 GLY A 77 -0.923 10.700 30.680 1.00 34.22 H new ATOM 594 N LEU A 78 0.740 8.186 30.418 1.00 60.23 N ATOM 595 CA LEU A 78 1.145 7.027 29.617 1.00 25.03 C ATOM 596 C LEU A 78 0.462 5.824 30.224 1.00 72.33 C ATOM 597 O LEU A 78 -0.193 5.024 29.525 1.00 53.52 O ATOM 598 CB LEU A 78 2.687 6.869 29.585 1.00 10.20 C ATOM 599 CG LEU A 78 3.291 5.860 28.564 1.00 11.42 C ATOM 600 CD1 LEU A 78 4.781 6.067 28.455 1.00 1.31 C ATOM 601 CD2 LEU A 78 3.029 4.407 28.956 1.00 42.45 C ATOM 0 H LEU A 78 1.475 8.596 30.995 1.00 60.23 H new ATOM 0 HA LEU A 78 0.846 7.148 28.576 1.00 25.03 H new ATOM 0 HB2 LEU A 78 3.120 7.849 29.384 1.00 10.20 H new ATOM 0 HB3 LEU A 78 3.014 6.574 30.582 1.00 10.20 H new ATOM 0 HG LEU A 78 2.803 6.049 27.608 1.00 11.42 H new ATOM 0 HD11 LEU A 78 5.196 5.357 27.739 1.00 1.31 H new ATOM 0 HD12 LEU A 78 4.983 7.083 28.117 1.00 1.31 H new ATOM 0 HD13 LEU A 78 5.242 5.910 29.430 1.00 1.31 H new ATOM 0 HD21 LEU A 78 3.470 3.744 28.212 1.00 42.45 H new ATOM 0 HD22 LEU A 78 3.475 4.207 29.930 1.00 42.45 H new ATOM 0 HD23 LEU A 78 1.954 4.232 29.006 1.00 42.45 H new ATOM 613 N GLU A 79 0.559 5.731 31.543 1.00 75.02 N ATOM 614 CA GLU A 79 -0.154 4.717 32.265 1.00 61.24 C ATOM 615 C GLU A 79 -1.633 4.877 32.066 1.00 21.03 C ATOM 616 O GLU A 79 -2.309 3.931 31.948 1.00 41.22 O ATOM 617 CB GLU A 79 0.184 4.711 33.744 1.00 12.24 C ATOM 618 CG GLU A 79 1.477 4.013 34.071 1.00 14.40 C ATOM 619 CD GLU A 79 1.805 4.085 35.536 1.00 55.34 C ATOM 620 OE1 GLU A 79 1.270 3.253 36.331 1.00 41.43 O ATOM 621 OE2 GLU A 79 2.581 4.964 35.934 1.00 34.30 O ATOM 0 H GLU A 79 1.126 6.349 32.123 1.00 75.02 H new ATOM 0 HA GLU A 79 0.162 3.755 31.862 1.00 61.24 H new ATOM 0 HB2 GLU A 79 0.238 5.740 34.098 1.00 12.24 H new ATOM 0 HB3 GLU A 79 -0.626 4.228 34.290 1.00 12.24 H new ATOM 0 HG2 GLU A 79 1.412 2.969 33.766 1.00 14.40 H new ATOM 0 HG3 GLU A 79 2.287 4.463 33.496 1.00 14.40 H new ATOM 628 N ALA A 80 -2.090 6.097 31.931 1.00 11.53 N ATOM 629 CA ALA A 80 -3.504 6.388 31.742 1.00 41.01 C ATOM 630 C ALA A 80 -3.956 6.107 30.305 1.00 43.34 C ATOM 631 O ALA A 80 -5.118 6.226 29.972 1.00 14.12 O ATOM 632 CB ALA A 80 -3.778 7.818 32.105 1.00 33.42 C ATOM 0 H ALA A 80 -1.495 6.925 31.948 1.00 11.53 H new ATOM 0 HA ALA A 80 -4.075 5.729 32.396 1.00 41.01 H new ATOM 0 HB1 ALA A 80 -4.837 8.033 31.963 1.00 33.42 H new ATOM 0 HB2 ALA A 80 -3.511 7.986 33.148 1.00 33.42 H new ATOM 0 HB3 ALA A 80 -3.186 8.475 31.468 1.00 33.42 H new ATOM 638 N LEU A 81 -3.012 5.802 29.460 1.00 12.12 N ATOM 639 CA LEU A 81 -3.290 5.386 28.103 1.00 20.05 C ATOM 640 C LEU A 81 -3.303 3.868 28.008 1.00 35.31 C ATOM 641 O LEU A 81 -3.802 3.296 27.036 1.00 4.52 O ATOM 642 CB LEU A 81 -2.250 5.978 27.149 1.00 23.41 C ATOM 643 CG LEU A 81 -2.683 7.193 26.303 1.00 1.34 C ATOM 644 CD1 LEU A 81 -3.303 8.285 27.156 1.00 42.22 C ATOM 645 CD2 LEU A 81 -1.485 7.742 25.540 1.00 73.45 C ATOM 0 H LEU A 81 -2.019 5.833 29.689 1.00 12.12 H new ATOM 0 HA LEU A 81 -4.274 5.755 27.815 1.00 20.05 H new ATOM 0 HB2 LEU A 81 -1.379 6.268 27.736 1.00 23.41 H new ATOM 0 HB3 LEU A 81 -1.928 5.190 26.469 1.00 23.41 H new ATOM 0 HG LEU A 81 -3.444 6.856 25.599 1.00 1.34 H new ATOM 0 HD11 LEU A 81 -3.594 9.122 26.521 1.00 42.22 H new ATOM 0 HD12 LEU A 81 -4.183 7.893 27.665 1.00 42.22 H new ATOM 0 HD13 LEU A 81 -2.578 8.625 27.895 1.00 42.22 H new ATOM 0 HD21 LEU A 81 -1.795 8.600 24.944 1.00 73.45 H new ATOM 0 HD22 LEU A 81 -0.714 8.051 26.246 1.00 73.45 H new ATOM 0 HD23 LEU A 81 -1.087 6.969 24.883 1.00 73.45 H new ATOM 657 N VAL A 82 -2.713 3.217 28.994 1.00 74.44 N ATOM 658 CA VAL A 82 -2.690 1.749 29.034 1.00 33.54 C ATOM 659 C VAL A 82 -3.687 1.183 30.083 1.00 23.15 C ATOM 660 O VAL A 82 -4.311 0.135 29.869 1.00 53.53 O ATOM 661 CB VAL A 82 -1.255 1.229 29.331 1.00 52.44 C ATOM 662 CG1 VAL A 82 -1.201 -0.293 29.290 1.00 14.11 C ATOM 663 CG2 VAL A 82 -0.269 1.812 28.336 1.00 41.41 C ATOM 0 H VAL A 82 -2.243 3.670 29.778 1.00 74.44 H new ATOM 0 HA VAL A 82 -3.001 1.396 28.051 1.00 33.54 H new ATOM 0 HB VAL A 82 -0.982 1.551 30.336 1.00 52.44 H new ATOM 0 HG11 VAL A 82 -0.185 -0.627 29.501 1.00 14.11 H new ATOM 0 HG12 VAL A 82 -1.880 -0.701 30.038 1.00 14.11 H new ATOM 0 HG13 VAL A 82 -1.499 -0.641 28.301 1.00 14.11 H new ATOM 0 HG21 VAL A 82 0.732 1.440 28.555 1.00 41.41 H new ATOM 0 HG22 VAL A 82 -0.553 1.516 27.326 1.00 41.41 H new ATOM 0 HG23 VAL A 82 -0.276 2.899 28.411 1.00 41.41 H new ATOM 673 N LYS A 83 -3.843 1.898 31.161 1.00 52.43 N ATOM 674 CA LYS A 83 -4.674 1.537 32.297 1.00 22.03 C ATOM 675 C LYS A 83 -5.616 2.730 32.514 1.00 13.33 C ATOM 676 O LYS A 83 -5.266 3.832 32.111 1.00 32.24 O ATOM 677 CB LYS A 83 -3.782 1.308 33.557 1.00 51.52 C ATOM 678 CG LYS A 83 -3.486 2.560 34.366 1.00 3.23 C ATOM 679 CD LYS A 83 -2.498 2.307 35.469 1.00 74.14 C ATOM 680 CE LYS A 83 -2.314 3.556 36.297 1.00 63.42 C ATOM 681 NZ LYS A 83 -1.244 3.409 37.288 1.00 15.23 N ATOM 0 H LYS A 83 -3.375 2.795 31.287 1.00 52.43 H new ATOM 0 HA LYS A 83 -5.230 0.616 32.122 1.00 22.03 H new ATOM 0 HB2 LYS A 83 -4.273 0.582 34.205 1.00 51.52 H new ATOM 0 HB3 LYS A 83 -2.837 0.866 33.240 1.00 51.52 H new ATOM 0 HG2 LYS A 83 -3.098 3.334 33.704 1.00 3.23 H new ATOM 0 HG3 LYS A 83 -4.414 2.942 34.793 1.00 3.23 H new ATOM 0 HD2 LYS A 83 -2.848 1.491 36.101 1.00 74.14 H new ATOM 0 HD3 LYS A 83 -1.542 1.997 35.047 1.00 74.14 H new ATOM 0 HE2 LYS A 83 -2.086 4.395 35.640 1.00 63.42 H new ATOM 0 HE3 LYS A 83 -3.248 3.794 36.806 1.00 63.42 H new ATOM 0 HZ1 LYS A 83 -1.439 4.025 38.103 1.00 15.23 H new ATOM 0 HZ2 LYS A 83 -1.198 2.419 37.605 1.00 15.23 H new ATOM 0 HZ3 LYS A 83 -0.335 3.679 36.860 1.00 15.23 H new ATOM 695 N LYS A 84 -6.811 2.517 33.067 1.00 43.51 N ATOM 696 CA LYS A 84 -7.772 3.631 33.237 1.00 35.33 C ATOM 697 C LYS A 84 -7.152 4.809 34.017 1.00 11.12 C ATOM 698 O LYS A 84 -6.486 4.610 35.049 1.00 73.13 O ATOM 699 CB LYS A 84 -9.108 3.207 33.899 1.00 41.44 C ATOM 700 CG LYS A 84 -10.015 2.293 33.058 1.00 63.52 C ATOM 701 CD LYS A 84 -9.582 0.833 33.072 1.00 44.40 C ATOM 702 CE LYS A 84 -9.772 0.207 34.449 1.00 55.33 C ATOM 703 NZ LYS A 84 -9.331 -1.199 34.485 1.00 64.35 N ATOM 0 H LYS A 84 -7.140 1.611 33.400 1.00 43.51 H new ATOM 0 HA LYS A 84 -8.006 3.956 32.223 1.00 35.33 H new ATOM 0 HB2 LYS A 84 -8.881 2.698 34.836 1.00 41.44 H new ATOM 0 HB3 LYS A 84 -9.667 4.108 34.152 1.00 41.44 H new ATOM 0 HG2 LYS A 84 -11.037 2.365 33.431 1.00 63.52 H new ATOM 0 HG3 LYS A 84 -10.025 2.651 32.029 1.00 63.52 H new ATOM 0 HD2 LYS A 84 -10.158 0.274 32.335 1.00 44.40 H new ATOM 0 HD3 LYS A 84 -8.535 0.760 32.779 1.00 44.40 H new ATOM 0 HE2 LYS A 84 -9.213 0.781 35.188 1.00 55.33 H new ATOM 0 HE3 LYS A 84 -10.823 0.264 34.731 1.00 55.33 H new ATOM 0 HZ1 LYS A 84 -9.478 -1.585 35.440 1.00 64.35 H new ATOM 0 HZ2 LYS A 84 -9.882 -1.753 33.799 1.00 64.35 H new ATOM 0 HZ3 LYS A 84 -8.321 -1.252 34.242 1.00 64.35 H new ATOM 717 N PRO A 85 -7.374 6.036 33.526 1.00 20.04 N ATOM 718 CA PRO A 85 -6.790 7.256 34.082 1.00 43.41 C ATOM 719 C PRO A 85 -7.189 7.511 35.515 1.00 24.11 C ATOM 720 O PRO A 85 -8.382 7.579 35.847 1.00 11.21 O ATOM 721 CB PRO A 85 -7.359 8.371 33.205 1.00 74.41 C ATOM 722 CG PRO A 85 -8.542 7.780 32.542 1.00 31.44 C ATOM 723 CD PRO A 85 -8.231 6.336 32.376 1.00 5.14 C ATOM 0 HA PRO A 85 -5.702 7.189 34.087 1.00 43.41 H new ATOM 0 HB2 PRO A 85 -7.636 9.239 33.803 1.00 74.41 H new ATOM 0 HB3 PRO A 85 -6.625 8.709 32.473 1.00 74.41 H new ATOM 0 HG2 PRO A 85 -9.439 7.920 33.145 1.00 31.44 H new ATOM 0 HG3 PRO A 85 -8.728 8.254 31.578 1.00 31.44 H new ATOM 0 HD2 PRO A 85 -9.135 5.728 32.380 1.00 5.14 H new ATOM 0 HD3 PRO A 85 -7.720 6.141 31.433 1.00 5.14 H new ATOM 731 N THR A 86 -6.219 7.668 36.358 1.00 73.42 N ATOM 732 CA THR A 86 -6.499 7.982 37.714 1.00 25.11 C ATOM 733 C THR A 86 -6.690 9.504 37.804 1.00 44.31 C ATOM 734 O THR A 86 -5.998 10.280 37.102 1.00 71.15 O ATOM 735 CB THR A 86 -5.400 7.447 38.698 1.00 3.11 C ATOM 736 OG1 THR A 86 -5.861 7.554 40.048 1.00 52.43 O ATOM 737 CG2 THR A 86 -4.082 8.207 38.564 1.00 43.54 C ATOM 0 H THR A 86 -5.229 7.583 36.128 1.00 73.42 H new ATOM 0 HA THR A 86 -7.411 7.477 38.032 1.00 25.11 H new ATOM 0 HB THR A 86 -5.218 6.405 38.437 1.00 3.11 H new ATOM 0 HG1 THR A 86 -5.171 7.217 40.657 1.00 52.43 H new ATOM 0 HG21 THR A 86 -3.354 7.800 39.266 1.00 43.54 H new ATOM 0 HG22 THR A 86 -3.704 8.103 37.547 1.00 43.54 H new ATOM 0 HG23 THR A 86 -4.246 9.262 38.784 1.00 43.54 H new ATOM 745 N GLY A 87 -7.640 9.915 38.578 1.00 75.30 N ATOM 746 CA GLY A 87 -7.987 11.295 38.654 1.00 55.12 C ATOM 747 C GLY A 87 -9.438 11.444 38.316 1.00 42.32 C ATOM 748 O GLY A 87 -10.263 10.694 38.827 1.00 51.34 O ATOM 0 H GLY A 87 -8.197 9.304 39.175 1.00 75.30 H new ATOM 0 HA2 GLY A 87 -7.791 11.680 39.655 1.00 55.12 H new ATOM 0 HA3 GLY A 87 -7.376 11.877 37.964 1.00 55.12 H new ATOM 752 N ASN A 88 -9.775 12.357 37.455 1.00 30.13 N ATOM 753 CA ASN A 88 -11.172 12.534 37.056 1.00 54.31 C ATOM 754 C ASN A 88 -11.339 12.503 35.557 1.00 2.31 C ATOM 755 O ASN A 88 -11.050 13.469 34.896 1.00 33.15 O ATOM 756 CB ASN A 88 -11.805 13.846 37.601 1.00 71.24 C ATOM 757 CG ASN A 88 -12.358 13.772 39.026 1.00 3.11 C ATOM 758 OD1 ASN A 88 -13.346 14.451 39.351 1.00 13.13 O ATOM 759 ND2 ASN A 88 -11.769 12.982 39.875 1.00 32.00 N ATOM 0 H ASN A 88 -9.118 12.996 37.008 1.00 30.13 H new ATOM 0 HA ASN A 88 -11.697 11.689 37.502 1.00 54.31 H new ATOM 0 HB2 ASN A 88 -11.053 14.634 37.563 1.00 71.24 H new ATOM 0 HB3 ASN A 88 -12.613 14.144 36.932 1.00 71.24 H new ATOM 0 HD21 ASN A 88 -12.117 12.910 40.831 1.00 32.00 H new ATOM 0 HD22 ASN A 88 -10.959 12.434 39.585 1.00 32.00 H new ATOM 766 N PRO A 89 -11.713 11.372 34.977 1.00 50.14 N ATOM 767 CA PRO A 89 -12.095 11.333 33.592 1.00 60.34 C ATOM 768 C PRO A 89 -13.627 11.523 33.471 1.00 41.11 C ATOM 769 O PRO A 89 -14.391 11.178 34.398 1.00 31.55 O ATOM 770 CB PRO A 89 -11.633 9.940 33.135 1.00 11.22 C ATOM 771 CG PRO A 89 -11.661 9.094 34.389 1.00 4.32 C ATOM 772 CD PRO A 89 -11.746 10.036 35.585 1.00 73.54 C ATOM 0 HA PRO A 89 -11.655 12.120 32.980 1.00 60.34 H new ATOM 0 HB2 PRO A 89 -12.295 9.535 32.369 1.00 11.22 H new ATOM 0 HB3 PRO A 89 -10.632 9.976 32.704 1.00 11.22 H new ATOM 0 HG2 PRO A 89 -12.515 8.417 34.374 1.00 4.32 H new ATOM 0 HG3 PRO A 89 -10.766 8.476 34.453 1.00 4.32 H new ATOM 0 HD2 PRO A 89 -12.661 9.878 36.155 1.00 73.54 H new ATOM 0 HD3 PRO A 89 -10.913 9.888 36.272 1.00 73.54 H new ATOM 780 N GLN A 90 -14.056 12.093 32.383 1.00 44.13 N ATOM 781 CA GLN A 90 -15.464 12.388 32.130 1.00 72.03 C ATOM 782 C GLN A 90 -16.137 11.109 31.674 1.00 65.34 C ATOM 783 O GLN A 90 -15.440 10.192 31.300 1.00 31.05 O ATOM 784 CB GLN A 90 -15.584 13.441 31.026 1.00 33.15 C ATOM 785 CG GLN A 90 -14.766 14.694 31.266 1.00 41.41 C ATOM 786 CD GLN A 90 -15.055 15.784 30.257 1.00 51.33 C ATOM 787 OE1 GLN A 90 -15.432 15.518 29.106 1.00 45.34 O ATOM 788 NE2 GLN A 90 -14.885 17.009 30.668 1.00 11.02 N ATOM 0 H GLN A 90 -13.437 12.377 31.623 1.00 44.13 H new ATOM 0 HA GLN A 90 -15.935 12.770 33.036 1.00 72.03 H new ATOM 0 HB2 GLN A 90 -15.275 12.995 30.080 1.00 33.15 H new ATOM 0 HB3 GLN A 90 -16.632 13.721 30.919 1.00 33.15 H new ATOM 0 HG2 GLN A 90 -14.970 15.070 32.269 1.00 41.41 H new ATOM 0 HG3 GLN A 90 -13.706 14.443 31.230 1.00 41.41 H new ATOM 0 HE21 GLN A 90 -14.574 17.188 31.623 1.00 11.02 H new ATOM 0 HE22 GLN A 90 -15.063 17.789 30.035 1.00 11.02 H new ATOM 797 N PRO A 91 -17.484 10.974 31.747 1.00 21.43 N ATOM 798 CA PRO A 91 -18.141 9.775 31.236 1.00 13.13 C ATOM 799 C PRO A 91 -17.943 9.686 29.720 1.00 64.34 C ATOM 800 O PRO A 91 -18.621 10.382 28.935 1.00 0.42 O ATOM 801 CB PRO A 91 -19.619 9.980 31.565 1.00 22.22 C ATOM 802 CG PRO A 91 -19.669 11.107 32.540 1.00 65.20 C ATOM 803 CD PRO A 91 -18.432 11.931 32.325 1.00 20.44 C ATOM 0 HA PRO A 91 -17.744 8.857 31.670 1.00 13.13 H new ATOM 0 HB2 PRO A 91 -20.190 10.215 30.667 1.00 22.22 H new ATOM 0 HB3 PRO A 91 -20.053 9.076 31.991 1.00 22.22 H new ATOM 0 HG2 PRO A 91 -20.565 11.709 32.387 1.00 65.20 H new ATOM 0 HG3 PRO A 91 -19.709 10.731 33.562 1.00 65.20 H new ATOM 0 HD2 PRO A 91 -18.619 12.768 31.652 1.00 20.44 H new ATOM 0 HD3 PRO A 91 -18.060 12.350 33.260 1.00 20.44 H new ATOM 811 N LYS A 92 -16.966 8.908 29.342 1.00 0.11 N ATOM 812 CA LYS A 92 -16.539 8.738 27.992 1.00 34.20 C ATOM 813 C LYS A 92 -15.930 7.327 27.944 1.00 12.04 C ATOM 814 O LYS A 92 -15.427 6.849 28.971 1.00 73.54 O ATOM 815 CB LYS A 92 -15.516 9.875 27.706 1.00 42.12 C ATOM 816 CG LYS A 92 -15.191 10.216 26.252 1.00 44.42 C ATOM 817 CD LYS A 92 -14.311 9.198 25.567 1.00 5.21 C ATOM 818 CE LYS A 92 -13.914 9.684 24.184 1.00 25.02 C ATOM 819 NZ LYS A 92 -15.077 9.815 23.283 1.00 70.25 N ATOM 0 H LYS A 92 -16.424 8.352 30.003 1.00 0.11 H new ATOM 0 HA LYS A 92 -17.320 8.808 27.235 1.00 34.20 H new ATOM 0 HB2 LYS A 92 -15.886 10.782 28.184 1.00 42.12 H new ATOM 0 HB3 LYS A 92 -14.581 9.612 28.202 1.00 42.12 H new ATOM 0 HG2 LYS A 92 -16.123 10.310 25.694 1.00 44.42 H new ATOM 0 HG3 LYS A 92 -14.699 11.188 26.218 1.00 44.42 H new ATOM 0 HD2 LYS A 92 -13.418 9.018 26.166 1.00 5.21 H new ATOM 0 HD3 LYS A 92 -14.838 8.247 25.488 1.00 5.21 H new ATOM 0 HE2 LYS A 92 -13.413 10.648 24.270 1.00 25.02 H new ATOM 0 HE3 LYS A 92 -13.196 8.989 23.749 1.00 25.02 H new ATOM 0 HZ1 LYS A 92 -14.747 10.000 22.314 1.00 70.25 H new ATOM 0 HZ2 LYS A 92 -15.629 8.934 23.298 1.00 70.25 H new ATOM 0 HZ3 LYS A 92 -15.676 10.604 23.601 1.00 70.25 H new ATOM 833 N ASN A 93 -16.035 6.627 26.844 1.00 31.44 N ATOM 834 CA ASN A 93 -15.485 5.282 26.802 1.00 31.43 C ATOM 835 C ASN A 93 -13.986 5.312 26.533 1.00 61.13 C ATOM 836 O ASN A 93 -13.557 5.395 25.378 1.00 73.44 O ATOM 837 CB ASN A 93 -16.183 4.385 25.770 1.00 40.33 C ATOM 838 CG ASN A 93 -15.662 2.941 25.796 1.00 34.40 C ATOM 839 OD1 ASN A 93 -15.563 2.284 24.759 1.00 24.25 O ATOM 840 ND2 ASN A 93 -15.389 2.416 26.974 1.00 71.34 N ATOM 0 H ASN A 93 -16.481 6.947 25.984 1.00 31.44 H new ATOM 0 HA ASN A 93 -15.666 4.849 27.786 1.00 31.43 H new ATOM 0 HB2 ASN A 93 -17.256 4.384 25.961 1.00 40.33 H new ATOM 0 HB3 ASN A 93 -16.037 4.802 24.774 1.00 40.33 H new ATOM 0 HD21 ASN A 93 -15.088 1.444 27.042 1.00 71.34 H new ATOM 0 HD22 ASN A 93 -15.479 2.982 27.818 1.00 71.34 H new ATOM 847 N TRP A 94 -13.218 5.316 27.610 1.00 32.22 N ATOM 848 CA TRP A 94 -11.782 5.253 27.581 1.00 11.05 C ATOM 849 C TRP A 94 -11.285 4.032 26.788 1.00 15.34 C ATOM 850 O TRP A 94 -11.889 2.955 26.834 1.00 32.53 O ATOM 851 CB TRP A 94 -11.259 5.235 29.022 1.00 25.24 C ATOM 852 CG TRP A 94 -9.792 5.075 29.141 1.00 43.00 C ATOM 853 CD1 TRP A 94 -8.855 6.059 29.151 1.00 2.21 C ATOM 854 CD2 TRP A 94 -9.087 3.839 29.268 1.00 41.42 C ATOM 855 NE1 TRP A 94 -7.613 5.499 29.254 1.00 20.34 N ATOM 856 CE2 TRP A 94 -7.731 4.143 29.326 1.00 64.24 C ATOM 857 CE3 TRP A 94 -9.483 2.499 29.328 1.00 71.33 C ATOM 858 CZ2 TRP A 94 -6.761 3.168 29.442 1.00 43.01 C ATOM 859 CZ3 TRP A 94 -8.521 1.530 29.447 1.00 33.45 C ATOM 860 CH2 TRP A 94 -7.174 1.869 29.502 1.00 2.00 C ATOM 0 H TRP A 94 -13.598 5.365 28.555 1.00 32.22 H new ATOM 0 HA TRP A 94 -11.395 6.133 27.067 1.00 11.05 H new ATOM 0 HB2 TRP A 94 -11.551 6.163 29.513 1.00 25.24 H new ATOM 0 HB3 TRP A 94 -11.745 4.422 29.561 1.00 25.24 H new ATOM 0 HD1 TRP A 94 -9.060 7.117 29.088 1.00 2.21 H new ATOM 0 HE1 TRP A 94 -6.734 6.016 29.274 1.00 20.34 H new ATOM 0 HE3 TRP A 94 -10.529 2.232 29.281 1.00 71.33 H new ATOM 0 HZ2 TRP A 94 -5.713 3.424 29.484 1.00 43.01 H new ATOM 0 HZ3 TRP A 94 -8.813 0.491 29.499 1.00 33.45 H new ATOM 0 HH2 TRP A 94 -6.437 1.085 29.594 1.00 2.00 H new ATOM 871 N ASN A 95 -10.196 4.217 26.083 1.00 72.41 N ATOM 872 CA ASN A 95 -9.584 3.197 25.267 1.00 2.41 C ATOM 873 C ASN A 95 -8.121 3.059 25.661 1.00 64.12 C ATOM 874 O ASN A 95 -7.449 4.062 25.876 1.00 74.14 O ATOM 875 CB ASN A 95 -9.666 3.585 23.782 1.00 74.41 C ATOM 876 CG ASN A 95 -8.942 2.627 22.824 1.00 2.51 C ATOM 877 OD1 ASN A 95 -8.419 3.056 21.823 1.00 31.31 O ATOM 878 ND2 ASN A 95 -8.949 1.342 23.083 1.00 61.03 N ATOM 0 H ASN A 95 -9.697 5.106 26.060 1.00 72.41 H new ATOM 0 HA ASN A 95 -10.109 2.254 25.421 1.00 2.41 H new ATOM 0 HB2 ASN A 95 -10.716 3.641 23.493 1.00 74.41 H new ATOM 0 HB3 ASN A 95 -9.248 4.584 23.659 1.00 74.41 H new ATOM 0 HD21 ASN A 95 -8.509 0.689 22.435 1.00 61.03 H new ATOM 0 HD22 ASN A 95 -9.395 0.995 23.932 1.00 61.03 H new ATOM 885 N LYS A 96 -7.635 1.844 25.767 1.00 12.33 N ATOM 886 CA LYS A 96 -6.239 1.626 26.074 1.00 13.11 C ATOM 887 C LYS A 96 -5.424 1.684 24.770 1.00 55.10 C ATOM 888 O LYS A 96 -5.920 2.137 23.738 1.00 35.50 O ATOM 889 CB LYS A 96 -6.023 0.252 26.759 1.00 71.04 C ATOM 890 CG LYS A 96 -6.074 -0.947 25.823 1.00 32.42 C ATOM 891 CD LYS A 96 -5.827 -2.246 26.567 1.00 52.13 C ATOM 892 CE LYS A 96 -5.758 -3.426 25.607 1.00 23.44 C ATOM 893 NZ LYS A 96 -5.373 -4.674 26.296 1.00 14.54 N ATOM 0 H LYS A 96 -8.184 0.993 25.646 1.00 12.33 H new ATOM 0 HA LYS A 96 -5.909 2.404 26.763 1.00 13.11 H new ATOM 0 HB2 LYS A 96 -5.056 0.261 27.261 1.00 71.04 H new ATOM 0 HB3 LYS A 96 -6.782 0.124 27.531 1.00 71.04 H new ATOM 0 HG2 LYS A 96 -7.047 -0.986 25.334 1.00 32.42 H new ATOM 0 HG3 LYS A 96 -5.327 -0.829 25.038 1.00 32.42 H new ATOM 0 HD2 LYS A 96 -4.895 -2.175 27.128 1.00 52.13 H new ATOM 0 HD3 LYS A 96 -6.624 -2.410 27.292 1.00 52.13 H new ATOM 0 HE2 LYS A 96 -6.727 -3.561 25.127 1.00 23.44 H new ATOM 0 HE3 LYS A 96 -5.038 -3.210 24.817 1.00 23.44 H new ATOM 0 HZ1 LYS A 96 -5.337 -5.453 25.608 1.00 14.54 H new ATOM 0 HZ2 LYS A 96 -4.437 -4.555 26.733 1.00 14.54 H new ATOM 0 HZ3 LYS A 96 -6.073 -4.894 27.033 1.00 14.54 H new ATOM 907 N ASP A 97 -4.161 1.279 24.862 1.00 0.04 N ATOM 908 CA ASP A 97 -3.236 1.118 23.731 1.00 34.11 C ATOM 909 C ASP A 97 -2.834 2.469 23.177 1.00 30.15 C ATOM 910 O ASP A 97 -2.228 2.582 22.119 1.00 54.11 O ATOM 911 CB ASP A 97 -3.823 0.184 22.660 1.00 71.00 C ATOM 912 CG ASP A 97 -2.780 -0.716 22.007 1.00 54.52 C ATOM 913 OD1 ASP A 97 -1.930 -1.279 22.743 1.00 41.30 O ATOM 914 OD2 ASP A 97 -2.835 -0.959 20.773 1.00 1.41 O ATOM 0 H ASP A 97 -3.732 1.044 25.757 1.00 0.04 H new ATOM 0 HA ASP A 97 -2.326 0.637 24.089 1.00 34.11 H new ATOM 0 HB2 ASP A 97 -4.596 -0.437 23.113 1.00 71.00 H new ATOM 0 HB3 ASP A 97 -4.308 0.785 21.890 1.00 71.00 H new ATOM 919 N GLY A 98 -3.161 3.493 23.947 1.00 74.34 N ATOM 920 CA GLY A 98 -2.746 4.822 23.643 1.00 53.23 C ATOM 921 C GLY A 98 -3.820 5.634 22.999 1.00 62.30 C ATOM 922 O GLY A 98 -3.543 6.711 22.478 1.00 72.11 O ATOM 0 H GLY A 98 -3.721 3.411 24.796 1.00 74.34 H new ATOM 0 HA2 GLY A 98 -2.425 5.316 24.560 1.00 53.23 H new ATOM 0 HA3 GLY A 98 -1.880 4.784 22.982 1.00 53.23 H new ATOM 926 N TYR A 99 -5.055 5.131 23.088 1.00 71.24 N ATOM 927 CA TYR A 99 -6.202 5.720 22.437 1.00 43.41 C ATOM 928 C TYR A 99 -6.047 5.601 20.926 1.00 23.23 C ATOM 929 O TYR A 99 -5.440 6.430 20.256 1.00 31.02 O ATOM 930 CB TYR A 99 -6.516 7.154 22.926 1.00 55.35 C ATOM 931 CG TYR A 99 -7.825 7.261 23.623 1.00 41.31 C ATOM 932 CD1 TYR A 99 -7.915 7.015 24.969 1.00 4.25 C ATOM 933 CD2 TYR A 99 -8.972 7.611 22.939 1.00 14.14 C ATOM 934 CE1 TYR A 99 -9.107 7.113 25.618 1.00 23.43 C ATOM 935 CE2 TYR A 99 -10.170 7.713 23.582 1.00 14.25 C ATOM 936 CZ TYR A 99 -10.230 7.461 24.920 1.00 10.21 C ATOM 937 OH TYR A 99 -11.411 7.561 25.565 1.00 44.42 O ATOM 0 H TYR A 99 -5.276 4.292 23.624 1.00 71.24 H new ATOM 0 HA TYR A 99 -7.089 5.156 22.725 1.00 43.41 H new ATOM 0 HB2 TYR A 99 -5.725 7.483 23.600 1.00 55.35 H new ATOM 0 HB3 TYR A 99 -6.510 7.832 22.072 1.00 55.35 H new ATOM 0 HD1 TYR A 99 -7.028 6.740 25.521 1.00 4.25 H new ATOM 0 HD2 TYR A 99 -8.920 7.807 21.878 1.00 14.14 H new ATOM 0 HE1 TYR A 99 -9.166 6.917 26.678 1.00 23.43 H new ATOM 0 HE2 TYR A 99 -11.061 7.990 23.038 1.00 14.25 H new ATOM 0 HH TYR A 99 -11.986 6.809 25.313 1.00 44.42 H new ATOM 947 N LEU A 100 -6.578 4.532 20.427 1.00 55.01 N ATOM 948 CA LEU A 100 -6.434 4.123 19.067 1.00 24.11 C ATOM 949 C LEU A 100 -7.822 3.953 18.440 1.00 33.30 C ATOM 950 O LEU A 100 -8.841 4.036 19.124 1.00 71.22 O ATOM 951 CB LEU A 100 -5.669 2.774 19.072 1.00 4.22 C ATOM 952 CG LEU A 100 -5.386 2.082 17.730 1.00 52.35 C ATOM 953 CD1 LEU A 100 -4.469 2.909 16.861 1.00 24.33 C ATOM 954 CD2 LEU A 100 -4.803 0.710 17.963 1.00 23.11 C ATOM 0 H LEU A 100 -7.149 3.892 20.980 1.00 55.01 H new ATOM 0 HA LEU A 100 -5.887 4.863 18.484 1.00 24.11 H new ATOM 0 HB2 LEU A 100 -4.712 2.938 19.567 1.00 4.22 H new ATOM 0 HB3 LEU A 100 -6.233 2.076 19.691 1.00 4.22 H new ATOM 0 HG LEU A 100 -6.333 1.978 17.201 1.00 52.35 H new ATOM 0 HD11 LEU A 100 -4.291 2.388 15.920 1.00 24.33 H new ATOM 0 HD12 LEU A 100 -4.932 3.875 16.659 1.00 24.33 H new ATOM 0 HD13 LEU A 100 -3.520 3.062 17.376 1.00 24.33 H new ATOM 0 HD21 LEU A 100 -4.607 0.230 17.004 1.00 23.11 H new ATOM 0 HD22 LEU A 100 -3.871 0.801 18.521 1.00 23.11 H new ATOM 0 HD23 LEU A 100 -5.509 0.106 18.533 1.00 23.11 H new ATOM 966 N LYS A 101 -7.855 3.753 17.151 1.00 43.44 N ATOM 967 CA LYS A 101 -9.080 3.471 16.437 1.00 61.01 C ATOM 968 C LYS A 101 -9.212 1.945 16.337 1.00 72.44 C ATOM 969 O LYS A 101 -8.468 1.216 17.018 1.00 51.32 O ATOM 970 CB LYS A 101 -9.007 4.096 15.036 1.00 4.22 C ATOM 971 CG LYS A 101 -8.822 5.612 15.027 1.00 55.55 C ATOM 972 CD LYS A 101 -10.000 6.346 15.641 1.00 55.23 C ATOM 973 CE LYS A 101 -9.771 7.844 15.636 1.00 64.33 C ATOM 974 NZ LYS A 101 -10.979 8.587 16.043 1.00 21.12 N ATOM 0 H LYS A 101 -7.027 3.780 16.557 1.00 43.44 H new ATOM 0 HA LYS A 101 -9.944 3.890 16.953 1.00 61.01 H new ATOM 0 HB2 LYS A 101 -8.181 3.639 14.491 1.00 4.22 H new ATOM 0 HB3 LYS A 101 -9.921 3.851 14.495 1.00 4.22 H new ATOM 0 HG2 LYS A 101 -7.914 5.867 15.574 1.00 55.55 H new ATOM 0 HG3 LYS A 101 -8.682 5.951 14.001 1.00 55.55 H new ATOM 0 HD2 LYS A 101 -10.908 6.112 15.086 1.00 55.23 H new ATOM 0 HD3 LYS A 101 -10.154 6.002 16.664 1.00 55.23 H new ATOM 0 HE2 LYS A 101 -8.950 8.088 16.311 1.00 64.33 H new ATOM 0 HE3 LYS A 101 -9.469 8.162 14.638 1.00 64.33 H new ATOM 0 HZ1 LYS A 101 -11.080 9.436 15.451 1.00 21.12 H new ATOM 0 HZ2 LYS A 101 -11.816 7.981 15.924 1.00 21.12 H new ATOM 0 HZ3 LYS A 101 -10.894 8.868 17.041 1.00 21.12 H new ATOM 988 N LYS A 102 -10.132 1.445 15.530 1.00 63.04 N ATOM 989 CA LYS A 102 -10.225 -0.009 15.332 1.00 42.51 C ATOM 990 C LYS A 102 -9.101 -0.502 14.383 1.00 62.14 C ATOM 991 O LYS A 102 -9.315 -0.844 13.217 1.00 11.40 O ATOM 992 CB LYS A 102 -11.653 -0.519 14.902 1.00 51.12 C ATOM 993 CG LYS A 102 -12.156 -0.147 13.487 1.00 12.21 C ATOM 994 CD LYS A 102 -12.511 1.320 13.303 1.00 73.41 C ATOM 995 CE LYS A 102 -13.736 1.719 14.120 1.00 33.15 C ATOM 996 NZ LYS A 102 -14.947 1.003 13.693 1.00 44.52 N ATOM 0 H LYS A 102 -10.813 1.998 15.010 1.00 63.04 H new ATOM 0 HA LYS A 102 -10.071 -0.463 16.311 1.00 42.51 H new ATOM 0 HB2 LYS A 102 -11.659 -1.606 14.985 1.00 51.12 H new ATOM 0 HB3 LYS A 102 -12.376 -0.140 15.625 1.00 51.12 H new ATOM 0 HG2 LYS A 102 -11.388 -0.414 12.761 1.00 12.21 H new ATOM 0 HG3 LYS A 102 -13.034 -0.751 13.258 1.00 12.21 H new ATOM 0 HD2 LYS A 102 -11.662 1.938 13.597 1.00 73.41 H new ATOM 0 HD3 LYS A 102 -12.699 1.518 12.248 1.00 73.41 H new ATOM 0 HE2 LYS A 102 -13.549 1.516 15.174 1.00 33.15 H new ATOM 0 HE3 LYS A 102 -13.899 2.793 14.026 1.00 33.15 H new ATOM 0 HZ1 LYS A 102 -15.785 1.465 14.100 1.00 44.52 H new ATOM 0 HZ2 LYS A 102 -15.012 1.020 12.655 1.00 44.52 H new ATOM 0 HZ3 LYS A 102 -14.901 0.017 14.021 1.00 44.52 H new ATOM 1010 N LEU A 103 -7.906 -0.477 14.887 1.00 32.10 N ATOM 1011 CA LEU A 103 -6.725 -0.775 14.111 1.00 30.53 C ATOM 1012 C LEU A 103 -5.856 -1.784 14.826 1.00 30.12 C ATOM 1013 O LEU A 103 -5.846 -1.823 16.057 1.00 5.24 O ATOM 1014 CB LEU A 103 -5.918 0.513 13.904 1.00 44.41 C ATOM 1015 CG LEU A 103 -6.623 1.642 13.162 1.00 32.04 C ATOM 1016 CD1 LEU A 103 -5.769 2.890 13.176 1.00 54.01 C ATOM 1017 CD2 LEU A 103 -6.928 1.229 11.732 1.00 50.23 C ATOM 0 H LEU A 103 -7.713 -0.247 15.862 1.00 32.10 H new ATOM 0 HA LEU A 103 -7.035 -1.190 13.152 1.00 30.53 H new ATOM 0 HB2 LEU A 103 -5.612 0.885 14.882 1.00 44.41 H new ATOM 0 HB3 LEU A 103 -5.008 0.262 13.359 1.00 44.41 H new ATOM 0 HG LEU A 103 -7.564 1.855 13.669 1.00 32.04 H new ATOM 0 HD11 LEU A 103 -6.284 3.689 12.643 1.00 54.01 H new ATOM 0 HD12 LEU A 103 -5.591 3.197 14.206 1.00 54.01 H new ATOM 0 HD13 LEU A 103 -4.816 2.684 12.689 1.00 54.01 H new ATOM 0 HD21 LEU A 103 -7.431 2.047 11.217 1.00 50.23 H new ATOM 0 HD22 LEU A 103 -5.998 0.992 11.215 1.00 50.23 H new ATOM 0 HD23 LEU A 103 -7.574 0.351 11.737 1.00 50.23 H new ATOM 1029 N PRO A 104 -5.150 -2.640 14.075 1.00 75.13 N ATOM 1030 CA PRO A 104 -4.169 -3.559 14.648 1.00 61.44 C ATOM 1031 C PRO A 104 -2.883 -2.799 15.048 1.00 53.31 C ATOM 1032 O PRO A 104 -2.854 -1.556 15.069 1.00 61.22 O ATOM 1033 CB PRO A 104 -3.886 -4.534 13.497 1.00 53.02 C ATOM 1034 CG PRO A 104 -4.153 -3.747 12.261 1.00 54.35 C ATOM 1035 CD PRO A 104 -5.263 -2.792 12.607 1.00 1.25 C ATOM 0 HA PRO A 104 -4.522 -4.055 15.552 1.00 61.44 H new ATOM 0 HB2 PRO A 104 -2.857 -4.891 13.524 1.00 53.02 H new ATOM 0 HB3 PRO A 104 -4.530 -5.412 13.554 1.00 53.02 H new ATOM 0 HG2 PRO A 104 -3.261 -3.208 11.941 1.00 54.35 H new ATOM 0 HG3 PRO A 104 -4.443 -4.400 11.438 1.00 54.35 H new ATOM 0 HD2 PRO A 104 -5.144 -1.837 12.095 1.00 1.25 H new ATOM 0 HD3 PRO A 104 -6.237 -3.189 12.319 1.00 1.25 H new ATOM 1043 N VAL A 105 -1.838 -3.513 15.358 1.00 20.33 N ATOM 1044 CA VAL A 105 -0.601 -2.875 15.741 1.00 23.43 C ATOM 1045 C VAL A 105 0.203 -2.554 14.462 1.00 71.22 C ATOM 1046 O VAL A 105 -0.221 -2.967 13.361 1.00 75.42 O ATOM 1047 CB VAL A 105 0.190 -3.776 16.710 1.00 30.30 C ATOM 1048 CG1 VAL A 105 0.921 -4.904 16.001 1.00 43.43 C ATOM 1049 CG2 VAL A 105 1.095 -2.971 17.602 1.00 61.44 C ATOM 0 H VAL A 105 -1.813 -4.533 15.355 1.00 20.33 H new ATOM 0 HA VAL A 105 -0.802 -1.943 16.270 1.00 23.43 H new ATOM 0 HB VAL A 105 -0.542 -4.261 17.356 1.00 30.30 H new ATOM 0 HG11 VAL A 105 1.460 -5.505 16.733 1.00 43.43 H new ATOM 0 HG12 VAL A 105 0.200 -5.531 15.476 1.00 43.43 H new ATOM 0 HG13 VAL A 105 1.627 -4.486 15.284 1.00 43.43 H new ATOM 0 HG21 VAL A 105 1.636 -3.640 18.271 1.00 61.44 H new ATOM 0 HG22 VAL A 105 1.807 -2.415 16.992 1.00 61.44 H new ATOM 0 HG23 VAL A 105 0.499 -2.273 18.191 1.00 61.44 H new ATOM 1059 N ASP A 106 1.323 -1.850 14.574 1.00 15.23 N ATOM 1060 CA ASP A 106 2.071 -1.452 13.392 1.00 50.01 C ATOM 1061 C ASP A 106 2.784 -2.620 12.762 1.00 45.32 C ATOM 1062 O ASP A 106 2.946 -3.683 13.398 1.00 52.43 O ATOM 1063 CB ASP A 106 2.997 -0.232 13.649 1.00 0.55 C ATOM 1064 CG ASP A 106 3.834 -0.356 14.869 1.00 13.41 C ATOM 1065 OD1 ASP A 106 3.288 -0.159 15.966 1.00 55.32 O ATOM 1066 OD2 ASP A 106 5.035 -0.574 14.754 1.00 14.50 O ATOM 0 H ASP A 106 1.728 -1.547 15.460 1.00 15.23 H new ATOM 0 HA ASP A 106 1.343 -1.107 12.658 1.00 50.01 H new ATOM 0 HB2 ASP A 106 3.649 -0.095 12.786 1.00 0.55 H new ATOM 0 HB3 ASP A 106 2.384 0.666 13.731 1.00 0.55 H new ATOM 1071 N PRO A 107 3.114 -2.512 11.458 1.00 40.34 N ATOM 1072 CA PRO A 107 3.798 -3.565 10.736 1.00 24.03 C ATOM 1073 C PRO A 107 5.147 -3.913 11.326 1.00 21.23 C ATOM 1074 O PRO A 107 5.633 -3.249 12.215 1.00 21.12 O ATOM 1075 CB PRO A 107 3.978 -3.003 9.337 1.00 10.11 C ATOM 1076 CG PRO A 107 3.839 -1.534 9.499 1.00 23.34 C ATOM 1077 CD PRO A 107 2.832 -1.362 10.574 1.00 53.02 C ATOM 0 HA PRO A 107 3.224 -4.491 10.771 1.00 24.03 H new ATOM 0 HB2 PRO A 107 4.953 -3.265 8.928 1.00 10.11 H new ATOM 0 HB3 PRO A 107 3.228 -3.398 8.652 1.00 10.11 H new ATOM 0 HG2 PRO A 107 4.789 -1.075 9.771 1.00 23.34 H new ATOM 0 HG3 PRO A 107 3.511 -1.064 8.572 1.00 23.34 H new ATOM 0 HD2 PRO A 107 2.951 -0.411 11.094 1.00 53.02 H new ATOM 0 HD3 PRO A 107 1.814 -1.388 10.185 1.00 53.02 H new ATOM 1085 N TRP A 108 5.725 -4.987 10.805 1.00 1.24 N ATOM 1086 CA TRP A 108 7.039 -5.537 11.208 1.00 61.34 C ATOM 1087 C TRP A 108 6.966 -6.115 12.617 1.00 23.04 C ATOM 1088 O TRP A 108 7.989 -6.419 13.240 1.00 23.11 O ATOM 1089 CB TRP A 108 8.156 -4.477 11.159 1.00 61.23 C ATOM 1090 CG TRP A 108 8.147 -3.635 9.938 1.00 73.14 C ATOM 1091 CD1 TRP A 108 8.405 -4.027 8.677 1.00 63.41 C ATOM 1092 CD2 TRP A 108 7.856 -2.246 9.888 1.00 30.35 C ATOM 1093 NE1 TRP A 108 8.307 -2.962 7.823 1.00 24.32 N ATOM 1094 CE2 TRP A 108 7.962 -1.844 8.551 1.00 32.13 C ATOM 1095 CE3 TRP A 108 7.514 -1.305 10.861 1.00 0.13 C ATOM 1096 CZ2 TRP A 108 7.736 -0.525 8.156 1.00 2.44 C ATOM 1097 CZ3 TRP A 108 7.288 -0.006 10.470 1.00 72.44 C ATOM 1098 CH2 TRP A 108 7.399 0.371 9.135 1.00 4.24 C ATOM 0 H TRP A 108 5.286 -5.529 10.061 1.00 1.24 H new ATOM 0 HA TRP A 108 7.282 -6.322 10.492 1.00 61.34 H new ATOM 0 HB2 TRP A 108 8.066 -3.831 12.032 1.00 61.23 H new ATOM 0 HB3 TRP A 108 9.121 -4.979 11.232 1.00 61.23 H new ATOM 0 HD1 TRP A 108 8.653 -5.036 8.382 1.00 63.41 H new ATOM 0 HE1 TRP A 108 8.463 -2.991 6.815 1.00 24.32 H new ATOM 0 HE3 TRP A 108 7.429 -1.591 11.899 1.00 0.13 H new ATOM 0 HZ2 TRP A 108 7.823 -0.224 7.123 1.00 2.44 H new ATOM 0 HZ3 TRP A 108 7.020 0.733 11.211 1.00 72.44 H new ATOM 0 HH2 TRP A 108 7.214 1.400 8.863 1.00 4.24 H new ATOM 1109 N GLY A 109 5.752 -6.309 13.078 1.00 41.44 N ATOM 1110 CA GLY A 109 5.487 -6.872 14.388 1.00 64.11 C ATOM 1111 C GLY A 109 5.856 -5.952 15.549 1.00 53.22 C ATOM 1112 O GLY A 109 5.960 -6.411 16.694 1.00 31.20 O ATOM 0 H GLY A 109 4.910 -6.079 12.551 1.00 41.44 H new ATOM 0 HA2 GLY A 109 4.428 -7.120 14.457 1.00 64.11 H new ATOM 0 HA3 GLY A 109 6.040 -7.806 14.489 1.00 64.11 H new ATOM 1116 N ASN A 110 6.089 -4.689 15.278 1.00 20.50 N ATOM 1117 CA ASN A 110 6.397 -3.742 16.313 1.00 22.52 C ATOM 1118 C ASN A 110 5.107 -3.187 16.969 1.00 74.44 C ATOM 1119 O ASN A 110 4.042 -3.101 16.315 1.00 22.05 O ATOM 1120 CB ASN A 110 7.288 -2.618 15.739 1.00 64.31 C ATOM 1121 CG ASN A 110 7.587 -1.516 16.736 1.00 23.24 C ATOM 1122 OD1 ASN A 110 8.538 -1.613 17.535 1.00 53.03 O ATOM 1123 ND2 ASN A 110 6.836 -0.470 16.680 1.00 62.05 N ATOM 0 H ASN A 110 6.070 -4.295 14.337 1.00 20.50 H new ATOM 0 HA ASN A 110 6.953 -4.246 17.104 1.00 22.52 H new ATOM 0 HB2 ASN A 110 8.227 -3.050 15.394 1.00 64.31 H new ATOM 0 HB3 ASN A 110 6.797 -2.185 14.867 1.00 64.31 H new ATOM 0 HD21 ASN A 110 7.011 0.317 17.304 1.00 62.05 H new ATOM 0 HD22 ASN A 110 6.067 -0.430 16.011 1.00 62.05 H new ATOM 1130 N PRO A 111 5.136 -2.969 18.309 1.00 44.32 N ATOM 1131 CA PRO A 111 4.056 -2.305 19.014 1.00 13.11 C ATOM 1132 C PRO A 111 4.201 -0.786 18.966 1.00 0.24 C ATOM 1133 O PRO A 111 5.312 -0.276 19.024 1.00 4.53 O ATOM 1134 CB PRO A 111 4.202 -2.815 20.446 1.00 20.23 C ATOM 1135 CG PRO A 111 5.660 -3.078 20.609 1.00 33.24 C ATOM 1136 CD PRO A 111 6.200 -3.411 19.237 1.00 0.14 C ATOM 0 HA PRO A 111 3.081 -2.517 18.576 1.00 13.11 H new ATOM 0 HB2 PRO A 111 3.850 -2.077 21.167 1.00 20.23 H new ATOM 0 HB3 PRO A 111 3.616 -3.720 20.605 1.00 20.23 H new ATOM 0 HG2 PRO A 111 6.166 -2.206 21.022 1.00 33.24 H new ATOM 0 HG3 PRO A 111 5.829 -3.903 21.302 1.00 33.24 H new ATOM 0 HD2 PRO A 111 7.139 -2.892 19.042 1.00 0.14 H new ATOM 0 HD3 PRO A 111 6.398 -4.478 19.136 1.00 0.14 H new ATOM 1144 N TYR A 112 3.084 -0.076 18.950 1.00 52.35 N ATOM 1145 CA TYR A 112 3.110 1.371 18.864 1.00 60.14 C ATOM 1146 C TYR A 112 3.691 1.965 20.115 1.00 4.13 C ATOM 1147 O TYR A 112 3.466 1.472 21.236 1.00 3.11 O ATOM 1148 CB TYR A 112 1.687 1.967 18.664 1.00 50.43 C ATOM 1149 CG TYR A 112 1.107 1.839 17.270 1.00 14.12 C ATOM 1150 CD1 TYR A 112 1.476 2.733 16.284 1.00 1.43 C ATOM 1151 CD2 TYR A 112 0.196 0.843 16.940 1.00 3.53 C ATOM 1152 CE1 TYR A 112 0.975 2.642 15.002 1.00 10.00 C ATOM 1153 CE2 TYR A 112 -0.320 0.748 15.654 1.00 51.52 C ATOM 1154 CZ TYR A 112 0.080 1.651 14.689 1.00 53.40 C ATOM 1155 OH TYR A 112 -0.400 1.549 13.394 1.00 5.14 O ATOM 0 H TYR A 112 2.149 -0.481 18.996 1.00 52.35 H new ATOM 0 HA TYR A 112 3.727 1.619 18.000 1.00 60.14 H new ATOM 0 HB2 TYR A 112 1.009 1.481 19.365 1.00 50.43 H new ATOM 0 HB3 TYR A 112 1.716 3.024 18.929 1.00 50.43 H new ATOM 0 HD1 TYR A 112 2.174 3.522 16.522 1.00 1.43 H new ATOM 0 HD2 TYR A 112 -0.115 0.134 17.693 1.00 3.53 H new ATOM 0 HE1 TYR A 112 1.287 3.349 14.247 1.00 10.00 H new ATOM 0 HE2 TYR A 112 -1.030 -0.028 15.410 1.00 51.52 H new ATOM 0 HH TYR A 112 -1.024 0.796 13.335 1.00 5.14 H new ATOM 1165 N GLN A 113 4.448 3.001 19.935 1.00 61.42 N ATOM 1166 CA GLN A 113 5.001 3.707 21.043 1.00 54.01 C ATOM 1167 C GLN A 113 4.221 4.993 21.207 1.00 52.41 C ATOM 1168 O GLN A 113 4.264 5.889 20.360 1.00 10.24 O ATOM 1169 CB GLN A 113 6.539 4.031 20.905 1.00 74.32 C ATOM 1170 CG GLN A 113 7.296 3.609 19.627 1.00 60.30 C ATOM 1171 CD GLN A 113 7.336 2.123 19.331 1.00 44.31 C ATOM 1172 OE1 GLN A 113 7.409 1.722 18.176 1.00 12.14 O ATOM 1173 NE2 GLN A 113 7.303 1.301 20.338 1.00 73.11 N ATOM 0 H GLN A 113 4.698 3.378 19.021 1.00 61.42 H new ATOM 0 HA GLN A 113 4.919 3.060 21.916 1.00 54.01 H new ATOM 0 HB2 GLN A 113 6.656 5.109 21.012 1.00 74.32 H new ATOM 0 HB3 GLN A 113 7.047 3.570 21.752 1.00 74.32 H new ATOM 0 HG2 GLN A 113 6.840 4.115 18.776 1.00 60.30 H new ATOM 0 HG3 GLN A 113 8.321 3.971 19.701 1.00 60.30 H new ATOM 0 HE21 GLN A 113 7.242 1.663 21.290 1.00 73.11 H new ATOM 0 HE22 GLN A 113 7.338 0.295 20.176 1.00 73.11 H new ATOM 1182 N TYR A 114 3.512 5.067 22.285 1.00 71.32 N ATOM 1183 CA TYR A 114 2.708 6.194 22.612 1.00 34.54 C ATOM 1184 C TYR A 114 3.213 6.823 23.892 1.00 34.45 C ATOM 1185 O TYR A 114 3.265 6.184 24.948 1.00 2.42 O ATOM 1186 CB TYR A 114 1.194 5.795 22.671 1.00 30.13 C ATOM 1187 CG TYR A 114 0.876 4.429 23.328 1.00 75.30 C ATOM 1188 CD1 TYR A 114 1.084 3.238 22.629 1.00 5.45 C ATOM 1189 CD2 TYR A 114 0.366 4.331 24.622 1.00 24.02 C ATOM 1190 CE1 TYR A 114 0.800 2.009 23.194 1.00 23.51 C ATOM 1191 CE2 TYR A 114 0.084 3.095 25.186 1.00 20.50 C ATOM 1192 CZ TYR A 114 0.305 1.943 24.467 1.00 72.11 C ATOM 1193 OH TYR A 114 0.035 0.708 25.035 1.00 34.22 O ATOM 0 H TYR A 114 3.476 4.323 22.981 1.00 71.32 H new ATOM 0 HA TYR A 114 2.789 6.949 21.830 1.00 34.54 H new ATOM 0 HB2 TYR A 114 0.655 6.571 23.215 1.00 30.13 H new ATOM 0 HB3 TYR A 114 0.801 5.787 21.654 1.00 30.13 H new ATOM 0 HD1 TYR A 114 1.476 3.278 21.623 1.00 5.45 H new ATOM 0 HD2 TYR A 114 0.188 5.230 25.193 1.00 24.02 H new ATOM 0 HE1 TYR A 114 0.969 1.103 22.631 1.00 23.51 H new ATOM 0 HE2 TYR A 114 -0.309 3.037 26.190 1.00 20.50 H new ATOM 0 HH TYR A 114 0.684 0.526 25.746 1.00 34.22 H new ATOM 1203 N LEU A 115 3.615 8.055 23.769 1.00 63.14 N ATOM 1204 CA LEU A 115 4.175 8.837 24.836 1.00 50.44 C ATOM 1205 C LEU A 115 3.396 10.137 24.901 1.00 2.13 C ATOM 1206 O LEU A 115 2.806 10.571 23.898 1.00 60.11 O ATOM 1207 CB LEU A 115 5.658 9.146 24.554 1.00 71.41 C ATOM 1208 CG LEU A 115 6.593 7.956 24.279 1.00 61.21 C ATOM 1209 CD1 LEU A 115 7.991 8.452 23.951 1.00 41.12 C ATOM 1210 CD2 LEU A 115 6.640 7.009 25.462 1.00 31.02 C ATOM 0 H LEU A 115 3.560 8.564 22.887 1.00 63.14 H new ATOM 0 HA LEU A 115 4.112 8.290 25.777 1.00 50.44 H new ATOM 0 HB2 LEU A 115 5.704 9.815 23.695 1.00 71.41 H new ATOM 0 HB3 LEU A 115 6.055 9.695 25.408 1.00 71.41 H new ATOM 0 HG LEU A 115 6.198 7.409 23.423 1.00 61.21 H new ATOM 0 HD11 LEU A 115 8.643 7.600 23.758 1.00 41.12 H new ATOM 0 HD12 LEU A 115 7.953 9.088 23.066 1.00 41.12 H new ATOM 0 HD13 LEU A 115 8.381 9.024 24.793 1.00 41.12 H new ATOM 0 HD21 LEU A 115 7.309 6.178 25.237 1.00 31.02 H new ATOM 0 HD22 LEU A 115 7.005 7.542 26.340 1.00 31.02 H new ATOM 0 HD23 LEU A 115 5.639 6.625 25.661 1.00 31.02 H new ATOM 1222 N ALA A 116 3.364 10.753 26.035 1.00 64.05 N ATOM 1223 CA ALA A 116 2.626 11.949 26.177 1.00 53.44 C ATOM 1224 C ALA A 116 3.617 13.146 26.194 1.00 22.05 C ATOM 1225 O ALA A 116 4.814 12.873 26.083 1.00 63.51 O ATOM 1226 CB ALA A 116 1.703 11.814 27.351 1.00 21.14 C ATOM 0 H ALA A 116 3.846 10.440 26.878 1.00 64.05 H new ATOM 0 HA ALA A 116 1.964 12.151 25.335 1.00 53.44 H new ATOM 0 HB1 ALA A 116 1.128 12.733 27.469 1.00 21.14 H new ATOM 0 HB2 ALA A 116 1.022 10.979 27.185 1.00 21.14 H new ATOM 0 HB3 ALA A 116 2.286 11.632 28.254 1.00 21.14 H new ATOM 1232 N PRO A 117 3.180 14.455 26.356 1.00 22.43 N ATOM 1233 CA PRO A 117 4.020 15.628 26.067 1.00 71.23 C ATOM 1234 C PRO A 117 5.382 15.576 26.629 1.00 62.43 C ATOM 1235 O PRO A 117 5.591 15.579 27.852 1.00 1.20 O ATOM 1236 CB PRO A 117 3.249 16.834 26.600 1.00 12.12 C ATOM 1237 CG PRO A 117 2.244 16.254 27.510 1.00 45.04 C ATOM 1238 CD PRO A 117 1.927 14.890 26.954 1.00 54.25 C ATOM 0 HA PRO A 117 4.196 15.678 24.992 1.00 71.23 H new ATOM 0 HB2 PRO A 117 3.907 17.526 27.125 1.00 12.12 H new ATOM 0 HB3 PRO A 117 2.778 17.393 25.792 1.00 12.12 H new ATOM 0 HG2 PRO A 117 2.632 16.182 28.526 1.00 45.04 H new ATOM 0 HG3 PRO A 117 1.350 16.876 27.553 1.00 45.04 H new ATOM 0 HD2 PRO A 117 1.599 14.206 27.737 1.00 54.25 H new ATOM 0 HD3 PRO A 117 1.127 14.936 26.215 1.00 54.25 H new ATOM 1246 N GLY A 118 6.304 15.496 25.739 1.00 35.42 N ATOM 1247 CA GLY A 118 7.651 15.440 26.107 1.00 64.51 C ATOM 1248 C GLY A 118 8.232 16.789 26.214 1.00 24.32 C ATOM 1249 O GLY A 118 8.108 17.465 27.245 1.00 53.12 O ATOM 0 H GLY A 118 6.133 15.468 24.734 1.00 35.42 H new ATOM 0 HA2 GLY A 118 7.748 14.923 27.062 1.00 64.51 H new ATOM 0 HA3 GLY A 118 8.207 14.859 25.371 1.00 64.51 H new ATOM 1253 N THR A 119 8.826 17.215 25.168 1.00 3.11 N ATOM 1254 CA THR A 119 9.445 18.482 25.158 1.00 62.34 C ATOM 1255 C THR A 119 8.666 19.378 24.231 1.00 74.32 C ATOM 1256 O THR A 119 8.690 19.190 23.010 1.00 22.33 O ATOM 1257 CB THR A 119 10.900 18.382 24.697 1.00 1.12 C ATOM 1258 OG1 THR A 119 11.482 17.183 25.259 1.00 53.31 O ATOM 1259 CG2 THR A 119 11.687 19.582 25.208 1.00 32.35 C ATOM 0 H THR A 119 8.898 16.696 24.293 1.00 3.11 H new ATOM 0 HA THR A 119 9.450 18.892 26.168 1.00 62.34 H new ATOM 0 HB THR A 119 10.934 18.356 23.608 1.00 1.12 H new ATOM 0 HG1 THR A 119 12.415 17.106 24.970 1.00 53.31 H new ATOM 0 HG21 THR A 119 12.723 19.506 24.877 1.00 32.35 H new ATOM 0 HG22 THR A 119 11.247 20.499 24.816 1.00 32.35 H new ATOM 0 HG23 THR A 119 11.655 19.601 26.297 1.00 32.35 H new ATOM 1267 N LYS A 120 7.910 20.281 24.835 1.00 15.10 N ATOM 1268 CA LYS A 120 7.091 21.294 24.161 1.00 44.13 C ATOM 1269 C LYS A 120 5.795 20.748 23.585 1.00 54.31 C ATOM 1270 O LYS A 120 4.763 21.419 23.652 1.00 13.33 O ATOM 1271 CB LYS A 120 7.882 22.069 23.083 1.00 0.03 C ATOM 1272 CG LYS A 120 9.122 22.767 23.604 1.00 0.45 C ATOM 1273 CD LYS A 120 8.769 23.777 24.670 1.00 50.23 C ATOM 1274 CE LYS A 120 10.000 24.458 25.228 1.00 31.34 C ATOM 1275 NZ LYS A 120 9.650 25.459 26.252 1.00 14.43 N ATOM 0 H LYS A 120 7.843 20.336 25.851 1.00 15.10 H new ATOM 0 HA LYS A 120 6.813 21.994 24.949 1.00 44.13 H new ATOM 0 HB2 LYS A 120 8.173 21.376 22.294 1.00 0.03 H new ATOM 0 HB3 LYS A 120 7.225 22.811 22.629 1.00 0.03 H new ATOM 0 HG2 LYS A 120 9.814 22.030 24.012 1.00 0.45 H new ATOM 0 HG3 LYS A 120 9.635 23.266 22.782 1.00 0.45 H new ATOM 0 HD2 LYS A 120 8.097 24.526 24.252 1.00 50.23 H new ATOM 0 HD3 LYS A 120 8.231 23.280 25.477 1.00 50.23 H new ATOM 0 HE2 LYS A 120 10.665 23.711 25.661 1.00 31.34 H new ATOM 0 HE3 LYS A 120 10.548 24.941 24.419 1.00 31.34 H new ATOM 0 HZ1 LYS A 120 10.518 25.905 26.612 1.00 14.43 H new ATOM 0 HZ2 LYS A 120 9.036 26.185 25.832 1.00 14.43 H new ATOM 0 HZ3 LYS A 120 9.149 24.993 27.036 1.00 14.43 H new ATOM 1289 N GLY A 121 5.795 19.523 23.135 1.00 14.03 N ATOM 1290 CA GLY A 121 4.672 19.062 22.396 1.00 72.12 C ATOM 1291 C GLY A 121 3.745 18.214 23.166 1.00 44.40 C ATOM 1292 O GLY A 121 4.186 17.260 23.778 1.00 40.41 O ATOM 0 H GLY A 121 6.546 18.846 23.267 1.00 14.03 H new ATOM 0 HA2 GLY A 121 4.125 19.924 22.014 1.00 72.12 H new ATOM 0 HA3 GLY A 121 5.026 18.500 21.532 1.00 72.12 H new ATOM 1296 N PRO A 122 2.418 18.593 23.153 1.00 42.54 N ATOM 1297 CA PRO A 122 1.286 17.885 23.786 1.00 53.12 C ATOM 1298 C PRO A 122 1.288 16.365 23.701 1.00 4.10 C ATOM 1299 O PRO A 122 0.575 15.732 24.471 1.00 21.12 O ATOM 1300 CB PRO A 122 0.099 18.435 23.031 1.00 12.50 C ATOM 1301 CG PRO A 122 0.455 19.848 22.848 1.00 45.43 C ATOM 1302 CD PRO A 122 1.920 19.841 22.526 1.00 1.14 C ATOM 0 HA PRO A 122 1.306 18.055 24.863 1.00 53.12 H new ATOM 0 HB2 PRO A 122 -0.044 17.927 22.077 1.00 12.50 H new ATOM 0 HB3 PRO A 122 -0.827 18.321 23.595 1.00 12.50 H new ATOM 0 HG2 PRO A 122 -0.124 20.300 22.042 1.00 45.43 H new ATOM 0 HG3 PRO A 122 0.252 20.426 23.749 1.00 45.43 H new ATOM 0 HD2 PRO A 122 2.092 19.843 21.450 1.00 1.14 H new ATOM 0 HD3 PRO A 122 2.422 20.719 22.931 1.00 1.14 H new ATOM 1310 N PHE A 123 2.014 15.779 22.755 1.00 30.42 N ATOM 1311 CA PHE A 123 2.186 14.315 22.757 1.00 52.23 C ATOM 1312 C PHE A 123 3.313 13.873 21.853 1.00 4.33 C ATOM 1313 O PHE A 123 3.856 14.691 21.114 1.00 34.42 O ATOM 1314 CB PHE A 123 0.872 13.527 22.491 1.00 73.14 C ATOM 1315 CG PHE A 123 0.163 13.834 21.195 1.00 12.32 C ATOM 1316 CD1 PHE A 123 -0.746 14.883 21.114 1.00 52.25 C ATOM 1317 CD2 PHE A 123 0.381 13.058 20.073 1.00 34.22 C ATOM 1318 CE1 PHE A 123 -1.415 15.146 19.940 1.00 62.21 C ATOM 1319 CE2 PHE A 123 -0.285 13.319 18.893 1.00 54.34 C ATOM 1320 CZ PHE A 123 -1.184 14.363 18.828 1.00 31.52 C ATOM 0 H PHE A 123 2.484 16.270 21.994 1.00 30.42 H new ATOM 0 HA PHE A 123 2.472 14.058 23.777 1.00 52.23 H new ATOM 0 HB2 PHE A 123 1.101 12.462 22.512 1.00 73.14 H new ATOM 0 HB3 PHE A 123 0.183 13.722 23.313 1.00 73.14 H new ATOM 0 HD1 PHE A 123 -0.929 15.499 21.982 1.00 52.25 H new ATOM 0 HD2 PHE A 123 1.081 12.237 20.120 1.00 34.22 H new ATOM 0 HE1 PHE A 123 -2.119 15.963 19.890 1.00 62.21 H new ATOM 0 HE2 PHE A 123 -0.103 12.707 18.022 1.00 54.34 H new ATOM 0 HZ PHE A 123 -1.708 14.568 17.906 1.00 31.52 H new ATOM 1330 N ASP A 124 3.697 12.603 21.972 1.00 53.54 N ATOM 1331 CA ASP A 124 4.742 11.963 21.152 1.00 74.11 C ATOM 1332 C ASP A 124 4.316 10.554 20.792 1.00 24.13 C ATOM 1333 O ASP A 124 4.321 9.688 21.649 1.00 41.24 O ATOM 1334 CB ASP A 124 6.074 11.831 21.920 1.00 71.23 C ATOM 1335 CG ASP A 124 6.922 13.073 22.008 1.00 64.02 C ATOM 1336 OD1 ASP A 124 7.772 13.274 21.129 1.00 4.45 O ATOM 1337 OD2 ASP A 124 6.813 13.836 23.001 1.00 54.25 O ATOM 0 H ASP A 124 3.284 11.969 22.656 1.00 53.54 H new ATOM 0 HA ASP A 124 4.879 12.590 20.271 1.00 74.11 H new ATOM 0 HB2 ASP A 124 5.852 11.496 22.933 1.00 71.23 H new ATOM 0 HB3 ASP A 124 6.665 11.047 21.447 1.00 71.23 H new ATOM 1342 N LEU A 125 3.940 10.281 19.571 1.00 41.14 N ATOM 1343 CA LEU A 125 3.609 8.898 19.267 1.00 61.21 C ATOM 1344 C LEU A 125 4.198 8.453 17.959 1.00 34.22 C ATOM 1345 O LEU A 125 4.258 9.226 17.002 1.00 1.30 O ATOM 1346 CB LEU A 125 2.107 8.591 19.442 1.00 25.11 C ATOM 1347 CG LEU A 125 1.104 9.334 18.571 1.00 63.35 C ATOM 1348 CD1 LEU A 125 0.936 8.657 17.216 1.00 5.52 C ATOM 1349 CD2 LEU A 125 -0.211 9.445 19.302 1.00 23.34 C ATOM 0 H LEU A 125 3.855 10.948 18.804 1.00 41.14 H new ATOM 0 HA LEU A 125 4.093 8.274 20.018 1.00 61.21 H new ATOM 0 HB2 LEU A 125 1.966 7.524 19.272 1.00 25.11 H new ATOM 0 HB3 LEU A 125 1.849 8.785 20.483 1.00 25.11 H new ATOM 0 HG LEU A 125 1.481 10.338 18.375 1.00 63.35 H new ATOM 0 HD11 LEU A 125 0.213 9.213 16.619 1.00 5.52 H new ATOM 0 HD12 LEU A 125 1.895 8.636 16.698 1.00 5.52 H new ATOM 0 HD13 LEU A 125 0.580 7.637 17.361 1.00 5.52 H new ATOM 0 HD21 LEU A 125 -0.930 9.977 18.679 1.00 23.34 H new ATOM 0 HD22 LEU A 125 -0.590 8.447 19.522 1.00 23.34 H new ATOM 0 HD23 LEU A 125 -0.064 9.991 20.234 1.00 23.34 H new ATOM 1361 N TYR A 126 4.666 7.230 17.930 1.00 32.42 N ATOM 1362 CA TYR A 126 5.392 6.707 16.790 1.00 24.42 C ATOM 1363 C TYR A 126 5.536 5.210 16.860 1.00 25.41 C ATOM 1364 O TYR A 126 5.143 4.596 17.830 1.00 41.15 O ATOM 1365 CB TYR A 126 6.779 7.398 16.615 1.00 23.15 C ATOM 1366 CG TYR A 126 7.779 7.231 17.763 1.00 31.42 C ATOM 1367 CD1 TYR A 126 7.643 7.947 18.950 1.00 32.14 C ATOM 1368 CD2 TYR A 126 8.872 6.379 17.638 1.00 42.12 C ATOM 1369 CE1 TYR A 126 8.561 7.817 19.975 1.00 21.22 C ATOM 1370 CE2 TYR A 126 9.802 6.246 18.656 1.00 33.41 C ATOM 1371 CZ TYR A 126 9.643 6.966 19.825 1.00 54.31 C ATOM 1372 OH TYR A 126 10.571 6.837 20.849 1.00 71.41 O ATOM 0 H TYR A 126 4.556 6.565 18.695 1.00 32.42 H new ATOM 0 HA TYR A 126 4.798 6.940 15.906 1.00 24.42 H new ATOM 0 HB2 TYR A 126 7.239 7.013 15.704 1.00 23.15 H new ATOM 0 HB3 TYR A 126 6.611 8.464 16.462 1.00 23.15 H new ATOM 0 HD1 TYR A 126 6.804 8.616 19.072 1.00 32.14 H new ATOM 0 HD2 TYR A 126 8.998 5.810 16.729 1.00 42.12 H new ATOM 0 HE1 TYR A 126 8.435 8.377 20.890 1.00 21.22 H new ATOM 0 HE2 TYR A 126 10.647 5.583 18.537 1.00 33.41 H new ATOM 0 HH TYR A 126 11.266 6.200 20.582 1.00 71.41 H new ATOM 1382 N SER A 127 5.989 4.658 15.796 1.00 22.23 N ATOM 1383 CA SER A 127 6.312 3.273 15.680 1.00 2.54 C ATOM 1384 C SER A 127 7.761 3.175 15.221 1.00 40.43 C ATOM 1385 O SER A 127 8.277 4.110 14.574 1.00 65.31 O ATOM 1386 CB SER A 127 5.415 2.635 14.640 1.00 11.54 C ATOM 1387 OG SER A 127 4.068 2.950 14.892 1.00 75.44 O ATOM 0 H SER A 127 6.155 5.180 14.936 1.00 22.23 H new ATOM 0 HA SER A 127 6.173 2.763 16.633 1.00 2.54 H new ATOM 0 HB2 SER A 127 5.696 2.983 13.646 1.00 11.54 H new ATOM 0 HB3 SER A 127 5.550 1.553 14.649 1.00 11.54 H new ATOM 0 HG SER A 127 3.780 2.515 15.722 1.00 75.44 H new ATOM 1393 N LEU A 128 8.426 2.117 15.586 1.00 61.44 N ATOM 1394 CA LEU A 128 9.788 1.881 15.153 1.00 12.21 C ATOM 1395 C LEU A 128 9.828 1.435 13.700 1.00 33.31 C ATOM 1396 O LEU A 128 8.845 0.941 13.169 1.00 40.45 O ATOM 1397 CB LEU A 128 10.462 0.837 16.039 1.00 73.45 C ATOM 1398 CG LEU A 128 10.656 1.226 17.509 1.00 14.33 C ATOM 1399 CD1 LEU A 128 11.357 0.120 18.255 1.00 62.51 C ATOM 1400 CD2 LEU A 128 11.437 2.529 17.636 1.00 31.12 C ATOM 0 H LEU A 128 8.047 1.389 16.192 1.00 61.44 H new ATOM 0 HA LEU A 128 10.333 2.821 15.241 1.00 12.21 H new ATOM 0 HB2 LEU A 128 9.871 -0.078 16.001 1.00 73.45 H new ATOM 0 HB3 LEU A 128 11.438 0.604 15.614 1.00 73.45 H new ATOM 0 HG LEU A 128 9.671 1.380 17.950 1.00 14.33 H new ATOM 0 HD11 LEU A 128 11.488 0.410 19.297 1.00 62.51 H new ATOM 0 HD12 LEU A 128 10.758 -0.790 18.204 1.00 62.51 H new ATOM 0 HD13 LEU A 128 12.332 -0.062 17.804 1.00 62.51 H new ATOM 0 HD21 LEU A 128 11.559 2.779 18.690 1.00 31.12 H new ATOM 0 HD22 LEU A 128 12.418 2.412 17.175 1.00 31.12 H new ATOM 0 HD23 LEU A 128 10.894 3.329 17.134 1.00 31.12 H new ATOM 1412 N GLY A 129 10.971 1.621 13.062 1.00 11.34 N ATOM 1413 CA GLY A 129 11.115 1.217 11.684 1.00 23.41 C ATOM 1414 C GLY A 129 11.297 -0.273 11.543 1.00 61.44 C ATOM 1415 O GLY A 129 11.391 -0.995 12.546 1.00 62.22 O ATOM 0 H GLY A 129 11.802 2.045 13.475 1.00 11.34 H new ATOM 0 HA2 GLY A 129 10.235 1.528 11.122 1.00 23.41 H new ATOM 0 HA3 GLY A 129 11.971 1.729 11.245 1.00 23.41 H new ATOM 1419 N ALA A 130 11.419 -0.720 10.312 1.00 51.14 N ATOM 1420 CA ALA A 130 11.551 -2.138 9.969 1.00 65.20 C ATOM 1421 C ALA A 130 12.761 -2.795 10.621 1.00 73.14 C ATOM 1422 O ALA A 130 12.771 -3.990 10.856 1.00 24.24 O ATOM 1423 CB ALA A 130 11.635 -2.294 8.463 1.00 65.21 C ATOM 0 H ALA A 130 11.431 -0.104 9.499 1.00 51.14 H new ATOM 0 HA ALA A 130 10.666 -2.644 10.355 1.00 65.20 H new ATOM 0 HB1 ALA A 130 11.733 -3.350 8.212 1.00 65.21 H new ATOM 0 HB2 ALA A 130 10.730 -1.894 8.005 1.00 65.21 H new ATOM 0 HB3 ALA A 130 12.502 -1.750 8.089 1.00 65.21 H new ATOM 1429 N ASP A 131 13.760 -2.010 10.934 1.00 13.23 N ATOM 1430 CA ASP A 131 14.992 -2.545 11.503 1.00 73.32 C ATOM 1431 C ASP A 131 14.961 -2.474 13.048 1.00 2.03 C ATOM 1432 O ASP A 131 15.918 -2.842 13.725 1.00 62.14 O ATOM 1433 CB ASP A 131 16.193 -1.781 10.927 1.00 61.00 C ATOM 1434 CG ASP A 131 17.533 -2.448 11.180 1.00 25.43 C ATOM 1435 OD1 ASP A 131 17.829 -3.488 10.536 1.00 45.12 O ATOM 1436 OD2 ASP A 131 18.337 -1.918 11.957 1.00 2.12 O ATOM 0 H ASP A 131 13.754 -0.998 10.808 1.00 13.23 H new ATOM 0 HA ASP A 131 15.087 -3.597 11.233 1.00 73.32 H new ATOM 0 HB2 ASP A 131 16.054 -1.665 9.852 1.00 61.00 H new ATOM 0 HB3 ASP A 131 16.212 -0.779 11.356 1.00 61.00 H new ATOM 1441 N GLY A 132 13.830 -2.021 13.596 1.00 42.21 N ATOM 1442 CA GLY A 132 13.665 -1.935 15.045 1.00 50.43 C ATOM 1443 C GLY A 132 14.447 -0.798 15.650 1.00 33.42 C ATOM 1444 O GLY A 132 14.951 -0.897 16.778 1.00 32.31 O ATOM 0 H GLY A 132 13.020 -1.710 13.059 1.00 42.21 H new ATOM 0 HA2 GLY A 132 12.608 -1.810 15.280 1.00 50.43 H new ATOM 0 HA3 GLY A 132 13.984 -2.873 15.500 1.00 50.43 H new ATOM 1448 N LYS A 133 14.543 0.278 14.919 1.00 43.14 N ATOM 1449 CA LYS A 133 15.307 1.424 15.339 1.00 15.42 C ATOM 1450 C LYS A 133 14.580 2.707 14.984 1.00 74.33 C ATOM 1451 O LYS A 133 13.809 2.740 14.011 1.00 71.22 O ATOM 1452 CB LYS A 133 16.710 1.403 14.695 1.00 63.42 C ATOM 1453 CG LYS A 133 17.579 2.609 15.051 1.00 60.44 C ATOM 1454 CD LYS A 133 18.981 2.515 14.483 1.00 22.45 C ATOM 1455 CE LYS A 133 19.795 1.430 15.167 1.00 43.02 C ATOM 1456 NZ LYS A 133 21.175 1.405 14.665 1.00 31.44 N ATOM 0 H LYS A 133 14.092 0.387 14.011 1.00 43.14 H new ATOM 0 HA LYS A 133 15.423 1.382 16.422 1.00 15.42 H new ATOM 0 HB2 LYS A 133 17.226 0.494 15.003 1.00 63.42 H new ATOM 0 HB3 LYS A 133 16.600 1.355 13.612 1.00 63.42 H new ATOM 0 HG2 LYS A 133 17.102 3.516 14.680 1.00 60.44 H new ATOM 0 HG3 LYS A 133 17.637 2.701 16.136 1.00 60.44 H new ATOM 0 HD2 LYS A 133 18.927 2.309 13.414 1.00 22.45 H new ATOM 0 HD3 LYS A 133 19.485 3.475 14.598 1.00 22.45 H new ATOM 0 HE2 LYS A 133 19.800 1.600 16.244 1.00 43.02 H new ATOM 0 HE3 LYS A 133 19.327 0.460 14.999 1.00 43.02 H new ATOM 0 HZ1 LYS A 133 21.707 0.655 15.150 1.00 31.44 H new ATOM 0 HZ2 LYS A 133 21.169 1.219 13.642 1.00 31.44 H new ATOM 0 HZ3 LYS A 133 21.627 2.323 14.847 1.00 31.44 H new ATOM 1470 N GLU A 134 14.760 3.721 15.806 1.00 45.24 N ATOM 1471 CA GLU A 134 14.254 5.028 15.514 1.00 40.45 C ATOM 1472 C GLU A 134 15.323 5.878 14.808 1.00 65.53 C ATOM 1473 O GLU A 134 16.312 6.311 15.399 1.00 52.54 O ATOM 1474 CB GLU A 134 13.635 5.711 16.764 1.00 61.21 C ATOM 1475 CG GLU A 134 14.286 5.388 18.122 1.00 3.31 C ATOM 1476 CD GLU A 134 15.734 5.786 18.252 1.00 75.42 C ATOM 1477 OE1 GLU A 134 16.022 6.963 18.567 1.00 43.21 O ATOM 1478 OE2 GLU A 134 16.616 4.919 18.054 1.00 32.44 O ATOM 0 H GLU A 134 15.262 3.653 16.691 1.00 45.24 H new ATOM 0 HA GLU A 134 13.425 4.926 14.813 1.00 40.45 H new ATOM 0 HB2 GLU A 134 13.674 6.790 16.616 1.00 61.21 H new ATOM 0 HB3 GLU A 134 12.582 5.434 16.817 1.00 61.21 H new ATOM 0 HG2 GLU A 134 13.717 5.886 18.907 1.00 3.31 H new ATOM 0 HG3 GLU A 134 14.203 4.316 18.300 1.00 3.31 H new ATOM 1485 N GLY A 135 15.132 6.061 13.538 1.00 53.05 N ATOM 1486 CA GLY A 135 16.081 6.784 12.727 1.00 75.41 C ATOM 1487 C GLY A 135 15.397 7.477 11.584 1.00 64.30 C ATOM 1488 O GLY A 135 14.155 7.492 11.522 1.00 24.45 O ATOM 0 H GLY A 135 14.318 5.717 13.029 1.00 53.05 H new ATOM 0 HA2 GLY A 135 16.604 7.517 13.341 1.00 75.41 H new ATOM 0 HA3 GLY A 135 16.833 6.096 12.342 1.00 75.41 H new ATOM 1492 N GLY A 136 16.168 8.059 10.691 1.00 14.54 N ATOM 1493 CA GLY A 136 15.604 8.675 9.523 1.00 10.50 C ATOM 1494 C GLY A 136 15.978 7.853 8.324 1.00 71.54 C ATOM 1495 O GLY A 136 17.152 7.608 8.091 1.00 50.51 O ATOM 0 H GLY A 136 17.184 8.115 10.756 1.00 14.54 H new ATOM 0 HA2 GLY A 136 14.520 8.740 9.615 1.00 10.50 H new ATOM 0 HA3 GLY A 136 15.976 9.694 9.415 1.00 10.50 H new ATOM 1499 N SER A 137 14.989 7.477 7.554 1.00 44.01 N ATOM 1500 CA SER A 137 15.081 6.533 6.443 1.00 41.15 C ATOM 1501 C SER A 137 13.675 6.406 5.874 1.00 72.55 C ATOM 1502 O SER A 137 12.800 7.153 6.286 1.00 44.21 O ATOM 1503 CB SER A 137 15.585 5.151 6.916 1.00 62.31 C ATOM 1504 OG SER A 137 16.948 5.163 7.332 1.00 72.43 O ATOM 0 H SER A 137 14.042 7.834 7.683 1.00 44.01 H new ATOM 0 HA SER A 137 15.792 6.890 5.698 1.00 41.15 H new ATOM 0 HB2 SER A 137 14.963 4.808 7.742 1.00 62.31 H new ATOM 0 HB3 SER A 137 15.465 4.431 6.106 1.00 62.31 H new ATOM 0 HG SER A 137 17.262 6.089 7.397 1.00 72.43 H new ATOM 1510 N ASP A 138 13.466 5.565 4.901 1.00 12.12 N ATOM 1511 CA ASP A 138 12.111 5.333 4.395 1.00 5.32 C ATOM 1512 C ASP A 138 11.378 4.356 5.292 1.00 54.22 C ATOM 1513 O ASP A 138 10.521 4.741 6.065 1.00 43.42 O ATOM 1514 CB ASP A 138 12.119 4.840 2.941 1.00 61.23 C ATOM 1515 CG ASP A 138 12.603 5.891 1.972 1.00 71.20 C ATOM 1516 OD1 ASP A 138 11.784 6.672 1.475 1.00 61.11 O ATOM 1517 OD2 ASP A 138 13.818 5.960 1.692 1.00 12.23 O ATOM 0 H ASP A 138 14.197 5.026 4.436 1.00 12.12 H new ATOM 0 HA ASP A 138 11.584 6.287 4.406 1.00 5.32 H new ATOM 0 HB2 ASP A 138 12.757 3.959 2.864 1.00 61.23 H new ATOM 0 HB3 ASP A 138 11.112 4.530 2.661 1.00 61.23 H new ATOM 1522 N ASN A 139 11.759 3.105 5.241 1.00 11.01 N ATOM 1523 CA ASN A 139 11.102 2.078 6.049 1.00 55.23 C ATOM 1524 C ASN A 139 11.898 1.773 7.302 1.00 52.21 C ATOM 1525 O ASN A 139 11.462 1.019 8.160 1.00 71.42 O ATOM 1526 CB ASN A 139 10.845 0.795 5.239 1.00 73.34 C ATOM 1527 CG ASN A 139 12.108 0.155 4.687 1.00 74.43 C ATOM 1528 OD1 ASN A 139 12.553 0.491 3.597 1.00 72.10 O ATOM 1529 ND2 ASN A 139 12.677 -0.776 5.411 1.00 2.12 N ATOM 0 H ASN A 139 12.518 2.761 4.653 1.00 11.01 H new ATOM 0 HA ASN A 139 10.134 2.477 6.351 1.00 55.23 H new ATOM 0 HB2 ASN A 139 10.330 0.073 5.873 1.00 73.34 H new ATOM 0 HB3 ASN A 139 10.175 1.027 4.411 1.00 73.34 H new ATOM 0 HD21 ASN A 139 13.517 -1.245 5.071 1.00 2.12 H new ATOM 0 HD22 ASN A 139 12.281 -1.032 6.315 1.00 2.12 H new ATOM 1536 N ASP A 140 13.068 2.354 7.407 1.00 55.31 N ATOM 1537 CA ASP A 140 13.915 2.158 8.594 1.00 75.12 C ATOM 1538 C ASP A 140 13.795 3.347 9.524 1.00 41.53 C ATOM 1539 O ASP A 140 14.532 3.474 10.498 1.00 62.23 O ATOM 1540 CB ASP A 140 15.390 1.964 8.216 1.00 31.12 C ATOM 1541 CG ASP A 140 15.649 0.731 7.405 1.00 4.52 C ATOM 1542 OD1 ASP A 140 15.595 0.804 6.154 1.00 64.32 O ATOM 1543 OD2 ASP A 140 15.947 -0.314 7.990 1.00 2.23 O ATOM 0 H ASP A 140 13.468 2.967 6.697 1.00 55.31 H new ATOM 0 HA ASP A 140 13.566 1.255 9.094 1.00 75.12 H new ATOM 0 HB2 ASP A 140 15.729 2.835 7.655 1.00 31.12 H new ATOM 0 HB3 ASP A 140 15.986 1.920 9.127 1.00 31.12 H new ATOM 1548 N ALA A 141 12.878 4.219 9.205 1.00 40.45 N ATOM 1549 CA ALA A 141 12.630 5.407 9.990 1.00 60.52 C ATOM 1550 C ALA A 141 11.618 5.141 11.050 1.00 52.32 C ATOM 1551 O ALA A 141 10.832 4.210 10.931 1.00 15.15 O ATOM 1552 CB ALA A 141 12.121 6.523 9.122 1.00 52.04 C ATOM 0 H ALA A 141 12.275 4.128 8.387 1.00 40.45 H new ATOM 0 HA ALA A 141 13.576 5.695 10.447 1.00 60.52 H new ATOM 0 HB1 ALA A 141 11.941 7.407 9.734 1.00 52.04 H new ATOM 0 HB2 ALA A 141 12.862 6.756 8.357 1.00 52.04 H new ATOM 0 HB3 ALA A 141 11.190 6.217 8.644 1.00 52.04 H new ATOM 1558 N ASP A 142 11.642 5.937 12.097 1.00 73.52 N ATOM 1559 CA ASP A 142 10.597 5.850 13.075 1.00 54.31 C ATOM 1560 C ASP A 142 9.442 6.601 12.468 1.00 50.11 C ATOM 1561 O ASP A 142 9.614 7.718 11.930 1.00 3.02 O ATOM 1562 CB ASP A 142 10.983 6.457 14.454 1.00 44.24 C ATOM 1563 CG ASP A 142 10.867 7.973 14.559 1.00 23.22 C ATOM 1564 OD1 ASP A 142 11.792 8.695 14.134 1.00 32.24 O ATOM 1565 OD2 ASP A 142 9.861 8.474 15.106 1.00 25.32 O ATOM 0 H ASP A 142 12.361 6.636 12.285 1.00 73.52 H new ATOM 0 HA ASP A 142 10.367 4.807 13.293 1.00 54.31 H new ATOM 0 HB2 ASP A 142 10.350 6.008 15.219 1.00 44.24 H new ATOM 0 HB3 ASP A 142 12.010 6.172 14.682 1.00 44.24 H new ATOM 1570 N ILE A 143 8.323 5.994 12.448 1.00 5.40 N ATOM 1571 CA ILE A 143 7.199 6.575 11.808 1.00 74.11 C ATOM 1572 C ILE A 143 6.131 6.907 12.803 1.00 34.03 C ATOM 1573 O ILE A 143 5.578 6.044 13.458 1.00 2.04 O ATOM 1574 CB ILE A 143 6.673 5.699 10.643 1.00 14.20 C ATOM 1575 CG1 ILE A 143 6.350 4.272 11.102 1.00 12.52 C ATOM 1576 CG2 ILE A 143 7.699 5.676 9.510 1.00 41.41 C ATOM 1577 CD1 ILE A 143 5.844 3.402 9.991 1.00 41.35 C ATOM 0 H ILE A 143 8.153 5.082 12.872 1.00 5.40 H new ATOM 0 HA ILE A 143 7.523 7.512 11.355 1.00 74.11 H new ATOM 0 HB ILE A 143 5.744 6.141 10.283 1.00 14.20 H new ATOM 0 HG12 ILE A 143 7.246 3.822 11.530 1.00 12.52 H new ATOM 0 HG13 ILE A 143 5.603 4.311 11.895 1.00 12.52 H new ATOM 0 HG21 ILE A 143 7.325 5.059 8.693 1.00 41.41 H new ATOM 0 HG22 ILE A 143 7.867 6.691 9.151 1.00 41.41 H new ATOM 0 HG23 ILE A 143 8.638 5.261 9.878 1.00 41.41 H new ATOM 0 HD11 ILE A 143 5.633 2.405 10.377 1.00 41.35 H new ATOM 0 HD12 ILE A 143 4.931 3.832 9.579 1.00 41.35 H new ATOM 0 HD13 ILE A 143 6.599 3.335 9.208 1.00 41.35 H new ATOM 1589 N GLY A 144 5.889 8.160 12.959 1.00 51.01 N ATOM 1590 CA GLY A 144 4.930 8.595 13.894 1.00 40.25 C ATOM 1591 C GLY A 144 4.619 10.018 13.704 1.00 31.25 C ATOM 1592 O GLY A 144 5.186 10.675 12.822 1.00 44.04 O ATOM 0 H GLY A 144 6.352 8.906 12.440 1.00 51.01 H new ATOM 0 HA2 GLY A 144 4.021 8.003 13.790 1.00 40.25 H new ATOM 0 HA3 GLY A 144 5.303 8.432 14.905 1.00 40.25 H new ATOM 1596 N ASN A 145 3.761 10.513 14.510 1.00 15.15 N ATOM 1597 CA ASN A 145 3.364 11.867 14.439 1.00 64.44 C ATOM 1598 C ASN A 145 2.956 12.344 15.782 1.00 23.11 C ATOM 1599 O ASN A 145 2.583 11.543 16.660 1.00 51.35 O ATOM 1600 CB ASN A 145 2.255 12.126 13.381 1.00 65.44 C ATOM 1601 CG ASN A 145 0.922 11.370 13.547 1.00 44.23 C ATOM 1602 OD1 ASN A 145 0.250 11.119 12.559 1.00 14.11 O ATOM 1603 ND2 ASN A 145 0.533 10.993 14.745 1.00 52.11 N ATOM 0 H ASN A 145 3.306 9.981 15.251 1.00 15.15 H new ATOM 0 HA ASN A 145 4.228 12.441 14.103 1.00 64.44 H new ATOM 0 HB2 ASN A 145 2.038 13.194 13.376 1.00 65.44 H new ATOM 0 HB3 ASN A 145 2.662 11.879 12.400 1.00 65.44 H new ATOM 0 HD21 ASN A 145 -0.343 10.482 14.860 1.00 52.11 H new ATOM 0 HD22 ASN A 145 1.107 11.211 15.560 1.00 52.11 H new ATOM 1610 N TRP A 146 3.033 13.594 15.958 1.00 13.45 N ATOM 1611 CA TRP A 146 2.640 14.212 17.159 1.00 71.41 C ATOM 1612 C TRP A 146 2.288 15.625 16.888 1.00 72.54 C ATOM 1613 O TRP A 146 2.400 16.089 15.745 1.00 74.23 O ATOM 1614 CB TRP A 146 3.713 14.102 18.240 1.00 40.31 C ATOM 1615 CG TRP A 146 5.085 14.569 17.851 1.00 62.32 C ATOM 1616 CD1 TRP A 146 5.510 15.852 17.647 1.00 61.22 C ATOM 1617 CD2 TRP A 146 6.220 13.740 17.669 1.00 11.52 C ATOM 1618 NE1 TRP A 146 6.837 15.855 17.312 1.00 53.34 N ATOM 1619 CE2 TRP A 146 7.300 14.569 17.327 1.00 41.15 C ATOM 1620 CE3 TRP A 146 6.421 12.369 17.755 1.00 4.11 C ATOM 1621 CZ2 TRP A 146 8.569 14.068 17.070 1.00 63.11 C ATOM 1622 CZ3 TRP A 146 7.679 11.867 17.505 1.00 71.35 C ATOM 1623 CH2 TRP A 146 8.741 12.718 17.166 1.00 1.42 C ATOM 0 H TRP A 146 3.382 14.242 15.252 1.00 13.45 H new ATOM 0 HA TRP A 146 1.764 13.691 17.546 1.00 71.41 H new ATOM 0 HB2 TRP A 146 3.387 14.676 19.108 1.00 40.31 H new ATOM 0 HB3 TRP A 146 3.780 13.060 18.554 1.00 40.31 H new ATOM 0 HD1 TRP A 146 4.891 16.732 17.737 1.00 61.22 H new ATOM 0 HE1 TRP A 146 7.390 16.682 17.088 1.00 53.34 H new ATOM 0 HE3 TRP A 146 5.606 11.709 18.013 1.00 4.11 H new ATOM 0 HZ2 TRP A 146 9.387 14.721 16.805 1.00 63.11 H new ATOM 0 HZ3 TRP A 146 7.850 10.803 17.571 1.00 71.35 H new ATOM 0 HH2 TRP A 146 9.717 12.295 16.977 1.00 1.42 H new ATOM 1634 N ASP A 147 1.858 16.294 17.891 1.00 1.41 N ATOM 1635 CA ASP A 147 1.509 17.668 17.770 1.00 31.13 C ATOM 1636 C ASP A 147 2.170 18.459 18.842 1.00 4.22 C ATOM 1637 O ASP A 147 2.254 18.008 20.027 1.00 13.22 O ATOM 1638 CB ASP A 147 -0.012 17.919 17.719 1.00 4.31 C ATOM 1639 CG ASP A 147 -0.638 17.524 16.385 1.00 62.32 C ATOM 1640 OD1 ASP A 147 -0.424 18.240 15.378 1.00 32.23 O ATOM 1641 OD2 ASP A 147 -1.350 16.494 16.312 1.00 75.21 O ATOM 0 H ASP A 147 1.736 15.907 18.827 1.00 1.41 H new ATOM 0 HA ASP A 147 1.880 18.007 16.803 1.00 31.13 H new ATOM 0 HB2 ASP A 147 -0.494 17.359 18.520 1.00 4.31 H new ATOM 0 HB3 ASP A 147 -0.207 18.975 17.907 1.00 4.31 H new ATOM 1646 N ASN A 148 2.687 19.586 18.410 1.00 33.20 N ATOM 1647 CA ASN A 148 3.398 20.559 19.199 1.00 65.02 C ATOM 1648 C ASN A 148 2.931 21.919 18.759 1.00 75.43 C ATOM 1649 O ASN A 148 2.042 22.509 19.419 1.00 72.31 O ATOM 1650 CB ASN A 148 4.923 20.435 18.979 1.00 32.14 C ATOM 1651 CG ASN A 148 5.716 21.514 19.715 1.00 21.12 C ATOM 1652 OD1 ASN A 148 5.301 22.015 20.748 1.00 1.14 O ATOM 1653 ND2 ASN A 148 6.864 21.861 19.201 1.00 12.21 N ATOM 1654 OXT ASN A 148 3.364 22.367 17.686 1.00 0.00 O ATOM 0 H ASN A 148 2.616 19.864 17.431 1.00 33.20 H new ATOM 0 HA ASN A 148 3.201 20.399 20.259 1.00 65.02 H new ATOM 0 HB2 ASN A 148 5.256 19.453 19.315 1.00 32.14 H new ATOM 0 HB3 ASN A 148 5.138 20.496 17.912 1.00 32.14 H new ATOM 0 HD21 ASN A 148 7.438 22.566 19.664 1.00 12.21 H new ATOM 0 HD22 ASN A 148 7.188 21.427 18.337 1.00 12.21 H new TER 1661 ASN A 148