USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=25 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 63 MET CE :methyl 171:sc=-0.00533 (180deg=-0.148) USER MOD Set 1.2: A 92 LYS NZ :NH3+ -152:sc= -0.0383 (180deg=-0.246) USER MOD Single : A 39 MET CE :methyl 161:sc= -0.25 (180deg=-0.764) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.249 K(o=-0.25,f=-5.8!) USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 1.23 (180deg=1.06) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0642) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 30:sc= -0.475 USER MOD Single : A 65 LYS NZ :NH3+ -149:sc= 1.25 (180deg=0.944) USER MOD Single : A 68 ASN :FLIP amide:sc= -2.36! C(o=-5.4!,f=-2.4!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot -76:sc= -0.773 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0139 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0051) USER MOD Single : A 86 THR OG1 : rot -28:sc= 0.22 USER MOD Single : A 88 ASN : amide:sc= -0.197 K(o=-0.2,f=-0.89) USER MOD Single : A 90 GLN : amide:sc=-0.00627 K(o=-0.0063,f=-1.1) USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 95 ASN : amide:sc= 0.339 K(o=0.34,f=-6.2!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot -128:sc= -1.57! USER MOD Single : A 101 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0348) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.147 K(o=-0.15,f=-1.3!) USER MOD Single : A 112 TYR OH : rot -133:sc= 1.25 USER MOD Single : A 113 GLN : amide:sc= -2.58! C(o=-2.6!,f=-9.8!) USER MOD Single : A 114 TYR OH : rot 165:sc= 0 USER MOD Single : A 119 THR OG1 : rot 95:sc= 1.25 USER MOD Single : A 120 LYS NZ :NH3+ 144:sc= -0.559 (180deg=-2.35!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 49:sc= 0.118 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 4:sc= 1.05 USER MOD Single : A 139 ASN :FLIP amide:sc= -0.238 F(o=-1.2,f=-0.24) USER MOD Single : A 145 ASN : amide:sc= -2.48! C(o=-2.5!,f=-2.9!) USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 2.835 6.098 -0.227 1.00 35.12 N ATOM 2 CA MET A 39 3.993 5.392 -0.792 1.00 1.02 C ATOM 3 C MET A 39 3.603 3.949 -1.034 1.00 42.10 C ATOM 4 O MET A 39 3.308 3.237 -0.088 1.00 4.04 O ATOM 5 CB MET A 39 5.222 5.437 0.158 1.00 71.13 C ATOM 6 CG MET A 39 5.745 6.829 0.513 1.00 31.21 C ATOM 7 SD MET A 39 4.620 7.774 1.573 1.00 11.24 S ATOM 8 CE MET A 39 4.556 6.726 3.034 1.00 70.31 C ATOM 0 HA MET A 39 4.276 5.885 -1.722 1.00 1.02 H new ATOM 0 HB2 MET A 39 4.960 4.922 1.083 1.00 71.13 H new ATOM 0 HB3 MET A 39 6.033 4.873 -0.303 1.00 71.13 H new ATOM 0 HG2 MET A 39 6.707 6.730 1.015 1.00 31.21 H new ATOM 0 HG3 MET A 39 5.921 7.388 -0.406 1.00 31.21 H new ATOM 0 HE1 MET A 39 4.196 7.307 3.883 1.00 70.31 H new ATOM 0 HE2 MET A 39 3.880 5.890 2.853 1.00 70.31 H new ATOM 0 HE3 MET A 39 5.554 6.345 3.252 1.00 70.31 H new ATOM 20 N SER A 40 3.597 3.512 -2.266 1.00 50.34 N ATOM 21 CA SER A 40 3.170 2.164 -2.578 1.00 52.41 C ATOM 22 C SER A 40 4.271 1.370 -3.292 1.00 71.21 C ATOM 23 O SER A 40 4.288 1.258 -4.521 1.00 50.01 O ATOM 24 CB SER A 40 1.885 2.191 -3.404 1.00 70.33 C ATOM 25 OG SER A 40 0.861 2.932 -2.733 1.00 43.31 O ATOM 0 H SER A 40 3.882 4.066 -3.073 1.00 50.34 H new ATOM 0 HA SER A 40 2.966 1.652 -1.638 1.00 52.41 H new ATOM 0 HB2 SER A 40 2.084 2.638 -4.378 1.00 70.33 H new ATOM 0 HB3 SER A 40 1.543 1.172 -3.585 1.00 70.33 H new ATOM 0 HG SER A 40 0.049 2.937 -3.281 1.00 43.31 H new ATOM 31 N ARG A 41 5.205 0.872 -2.511 1.00 32.12 N ATOM 32 CA ARG A 41 6.337 0.069 -2.971 1.00 60.11 C ATOM 33 C ARG A 41 6.673 -0.868 -1.830 1.00 35.24 C ATOM 34 O ARG A 41 6.230 -0.598 -0.715 1.00 3.23 O ATOM 35 CB ARG A 41 7.569 0.962 -3.264 1.00 71.13 C ATOM 36 CG ARG A 41 7.396 1.950 -4.403 1.00 60.20 C ATOM 37 CD ARG A 41 8.640 2.787 -4.602 1.00 62.45 C ATOM 38 NE ARG A 41 8.443 3.819 -5.623 1.00 32.33 N ATOM 39 CZ ARG A 41 9.409 4.354 -6.370 1.00 21.43 C ATOM 40 NH1 ARG A 41 10.664 3.969 -6.206 1.00 55.14 N ATOM 41 NH2 ARG A 41 9.120 5.288 -7.262 1.00 61.01 N ATOM 0 H ARG A 41 5.205 1.015 -1.501 1.00 32.12 H new ATOM 0 HA ARG A 41 6.083 -0.460 -3.889 1.00 60.11 H new ATOM 0 HB2 ARG A 41 7.820 1.516 -2.359 1.00 71.13 H new ATOM 0 HB3 ARG A 41 8.419 0.318 -3.489 1.00 71.13 H new ATOM 0 HG2 ARG A 41 7.167 1.411 -5.322 1.00 60.20 H new ATOM 0 HG3 ARG A 41 6.547 2.601 -4.196 1.00 60.20 H new ATOM 0 HD2 ARG A 41 8.917 3.257 -3.658 1.00 62.45 H new ATOM 0 HD3 ARG A 41 9.470 2.142 -4.892 1.00 62.45 H new ATOM 0 HE ARG A 41 7.492 4.155 -5.774 1.00 32.33 H new ATOM 0 HH11 ARG A 41 10.893 3.262 -5.507 1.00 55.14 H new ATOM 0 HH12 ARG A 41 11.402 4.379 -6.778 1.00 55.14 H new ATOM 0 HH21 ARG A 41 8.156 5.600 -7.379 1.00 61.01 H new ATOM 0 HH22 ARG A 41 9.861 5.696 -7.832 1.00 61.01 H new ATOM 55 N PRO A 42 7.409 -1.983 -2.068 1.00 12.25 N ATOM 56 CA PRO A 42 7.842 -2.905 -0.999 1.00 40.35 C ATOM 57 C PRO A 42 8.415 -2.154 0.216 1.00 50.31 C ATOM 58 O PRO A 42 9.256 -1.256 0.070 1.00 71.23 O ATOM 59 CB PRO A 42 8.933 -3.766 -1.666 1.00 11.44 C ATOM 60 CG PRO A 42 9.106 -3.212 -3.049 1.00 54.23 C ATOM 61 CD PRO A 42 7.844 -2.469 -3.377 1.00 64.43 C ATOM 0 HA PRO A 42 7.009 -3.491 -0.610 1.00 40.35 H new ATOM 0 HB2 PRO A 42 9.867 -3.716 -1.106 1.00 11.44 H new ATOM 0 HB3 PRO A 42 8.637 -4.814 -1.699 1.00 11.44 H new ATOM 0 HG2 PRO A 42 9.969 -2.548 -3.095 1.00 54.23 H new ATOM 0 HG3 PRO A 42 9.282 -4.013 -3.767 1.00 54.23 H new ATOM 0 HD2 PRO A 42 8.025 -1.650 -4.073 1.00 64.43 H new ATOM 0 HD3 PRO A 42 7.099 -3.119 -3.836 1.00 64.43 H new ATOM 69 N ASP A 43 7.898 -2.492 1.391 1.00 42.31 N ATOM 70 CA ASP A 43 8.240 -1.865 2.688 1.00 44.12 C ATOM 71 C ASP A 43 7.615 -0.513 2.889 1.00 64.20 C ATOM 72 O ASP A 43 7.108 -0.227 3.965 1.00 41.52 O ATOM 73 CB ASP A 43 9.727 -1.874 3.055 1.00 3.51 C ATOM 74 CG ASP A 43 10.172 -3.209 3.568 1.00 2.14 C ATOM 75 OD1 ASP A 43 9.612 -3.680 4.589 1.00 5.23 O ATOM 76 OD2 ASP A 43 11.068 -3.831 2.964 1.00 21.21 O ATOM 0 H ASP A 43 7.204 -3.234 1.484 1.00 42.31 H new ATOM 0 HA ASP A 43 7.776 -2.539 3.408 1.00 44.12 H new ATOM 0 HB2 ASP A 43 10.318 -1.607 2.179 1.00 3.51 H new ATOM 0 HB3 ASP A 43 9.918 -1.113 3.812 1.00 3.51 H new ATOM 81 N GLN A 44 7.598 0.308 1.855 1.00 73.55 N ATOM 82 CA GLN A 44 6.919 1.602 1.920 1.00 51.52 C ATOM 83 C GLN A 44 5.427 1.401 2.004 1.00 31.10 C ATOM 84 O GLN A 44 4.696 2.251 2.509 1.00 15.15 O ATOM 85 CB GLN A 44 7.257 2.488 0.739 1.00 10.31 C ATOM 86 CG GLN A 44 8.629 3.123 0.799 1.00 32.43 C ATOM 87 CD GLN A 44 8.897 3.997 -0.413 1.00 64.24 C ATOM 88 OE1 GLN A 44 8.411 3.714 -1.499 1.00 32.01 O ATOM 89 NE2 GLN A 44 9.578 5.098 -0.229 1.00 51.43 N ATOM 0 H GLN A 44 8.044 0.108 0.959 1.00 73.55 H new ATOM 0 HA GLN A 44 7.272 2.108 2.818 1.00 51.52 H new ATOM 0 HB2 GLN A 44 7.184 1.897 -0.174 1.00 10.31 H new ATOM 0 HB3 GLN A 44 6.509 3.277 0.668 1.00 10.31 H new ATOM 0 HG2 GLN A 44 8.713 3.722 1.706 1.00 32.43 H new ATOM 0 HG3 GLN A 44 9.388 2.343 0.861 1.00 32.43 H new ATOM 0 HE21 GLN A 44 9.971 5.307 0.689 1.00 51.43 H new ATOM 0 HE22 GLN A 44 9.716 5.748 -1.003 1.00 51.43 H new ATOM 98 N ALA A 45 4.995 0.256 1.543 1.00 41.44 N ATOM 99 CA ALA A 45 3.610 -0.156 1.620 1.00 23.03 C ATOM 100 C ALA A 45 3.200 -0.388 3.075 1.00 65.21 C ATOM 101 O ALA A 45 2.017 -0.388 3.402 1.00 53.03 O ATOM 102 CB ALA A 45 3.383 -1.405 0.796 1.00 45.31 C ATOM 0 H ALA A 45 5.602 -0.430 1.095 1.00 41.44 H new ATOM 0 HA ALA A 45 2.989 0.642 1.212 1.00 23.03 H new ATOM 0 HB1 ALA A 45 2.336 -1.701 0.865 1.00 45.31 H new ATOM 0 HB2 ALA A 45 3.636 -1.205 -0.245 1.00 45.31 H new ATOM 0 HB3 ALA A 45 4.013 -2.210 1.174 1.00 45.31 H new ATOM 108 N LYS A 46 4.182 -0.582 3.953 1.00 13.50 N ATOM 109 CA LYS A 46 3.886 -0.721 5.364 1.00 2.14 C ATOM 110 C LYS A 46 3.880 0.670 5.989 1.00 31.12 C ATOM 111 O LYS A 46 3.126 0.954 6.905 1.00 2.15 O ATOM 112 CB LYS A 46 4.993 -1.544 6.044 1.00 73.41 C ATOM 113 CG LYS A 46 5.240 -2.923 5.450 1.00 24.15 C ATOM 114 CD LYS A 46 6.310 -3.664 6.238 1.00 22.11 C ATOM 115 CE LYS A 46 6.609 -5.053 5.686 1.00 51.34 C ATOM 116 NZ LYS A 46 7.277 -5.016 4.369 1.00 31.23 N ATOM 0 H LYS A 46 5.171 -0.645 3.711 1.00 13.50 H new ATOM 0 HA LYS A 46 2.923 -1.216 5.492 1.00 2.14 H new ATOM 0 HB2 LYS A 46 5.923 -0.977 6.001 1.00 73.41 H new ATOM 0 HB3 LYS A 46 4.740 -1.661 7.098 1.00 73.41 H new ATOM 0 HG2 LYS A 46 4.314 -3.498 5.455 1.00 24.15 H new ATOM 0 HG3 LYS A 46 5.549 -2.826 4.409 1.00 24.15 H new ATOM 0 HD2 LYS A 46 7.227 -3.074 6.236 1.00 22.11 H new ATOM 0 HD3 LYS A 46 5.991 -3.754 7.276 1.00 22.11 H new ATOM 0 HE2 LYS A 46 7.240 -5.591 6.393 1.00 51.34 H new ATOM 0 HE3 LYS A 46 5.678 -5.613 5.600 1.00 51.34 H new ATOM 0 HZ1 LYS A 46 7.592 -5.973 4.113 1.00 31.23 H new ATOM 0 HZ2 LYS A 46 6.610 -4.667 3.651 1.00 31.23 H new ATOM 0 HZ3 LYS A 46 8.100 -4.381 4.415 1.00 31.23 H new ATOM 130 N VAL A 47 4.631 1.567 5.369 1.00 45.20 N ATOM 131 CA VAL A 47 4.801 2.925 5.862 1.00 24.23 C ATOM 132 C VAL A 47 3.550 3.745 5.569 1.00 22.55 C ATOM 133 O VAL A 47 3.091 4.534 6.386 1.00 53.52 O ATOM 134 CB VAL A 47 6.024 3.619 5.206 1.00 41.23 C ATOM 135 CG1 VAL A 47 6.269 4.984 5.817 1.00 62.11 C ATOM 136 CG2 VAL A 47 7.262 2.768 5.331 1.00 34.12 C ATOM 0 H VAL A 47 5.141 1.373 4.507 1.00 45.20 H new ATOM 0 HA VAL A 47 4.969 2.867 6.937 1.00 24.23 H new ATOM 0 HB VAL A 47 5.797 3.748 4.148 1.00 41.23 H new ATOM 0 HG11 VAL A 47 7.132 5.447 5.338 1.00 62.11 H new ATOM 0 HG12 VAL A 47 5.391 5.612 5.668 1.00 62.11 H new ATOM 0 HG13 VAL A 47 6.461 4.876 6.884 1.00 62.11 H new ATOM 0 HG21 VAL A 47 8.103 3.279 4.863 1.00 34.12 H new ATOM 0 HG22 VAL A 47 7.482 2.598 6.385 1.00 34.12 H new ATOM 0 HG23 VAL A 47 7.097 1.811 4.836 1.00 34.12 H new ATOM 146 N THR A 48 3.002 3.542 4.385 1.00 74.22 N ATOM 147 CA THR A 48 1.830 4.267 3.943 1.00 3.02 C ATOM 148 C THR A 48 0.614 3.948 4.842 1.00 74.01 C ATOM 149 O THR A 48 -0.263 4.799 5.048 1.00 64.13 O ATOM 150 CB THR A 48 1.533 3.991 2.434 1.00 64.44 C ATOM 151 OG1 THR A 48 0.503 4.852 1.946 1.00 24.42 O ATOM 152 CG2 THR A 48 1.148 2.542 2.193 1.00 33.34 C ATOM 0 H THR A 48 3.358 2.870 3.705 1.00 74.22 H new ATOM 0 HA THR A 48 2.032 5.334 4.038 1.00 3.02 H new ATOM 0 HB THR A 48 2.454 4.196 1.888 1.00 64.44 H new ATOM 0 HG1 THR A 48 0.337 4.660 0.999 1.00 24.42 H new ATOM 0 HG21 THR A 48 0.949 2.390 1.132 1.00 33.34 H new ATOM 0 HG22 THR A 48 1.965 1.892 2.506 1.00 33.34 H new ATOM 0 HG23 THR A 48 0.253 2.303 2.768 1.00 33.34 H new ATOM 160 N VAL A 49 0.593 2.740 5.402 1.00 12.32 N ATOM 161 CA VAL A 49 -0.448 2.353 6.329 1.00 22.50 C ATOM 162 C VAL A 49 -0.205 3.061 7.639 1.00 33.44 C ATOM 163 O VAL A 49 -1.109 3.679 8.195 1.00 73.21 O ATOM 164 CB VAL A 49 -0.475 0.818 6.571 1.00 40.42 C ATOM 165 CG1 VAL A 49 -1.516 0.445 7.631 1.00 63.21 C ATOM 166 CG2 VAL A 49 -0.763 0.082 5.273 1.00 52.14 C ATOM 0 H VAL A 49 1.290 2.017 5.224 1.00 12.32 H new ATOM 0 HA VAL A 49 -1.411 2.633 5.902 1.00 22.50 H new ATOM 0 HB VAL A 49 0.507 0.518 6.937 1.00 40.42 H new ATOM 0 HG11 VAL A 49 -1.513 -0.635 7.780 1.00 63.21 H new ATOM 0 HG12 VAL A 49 -1.273 0.941 8.570 1.00 63.21 H new ATOM 0 HG13 VAL A 49 -2.504 0.763 7.298 1.00 63.21 H new ATOM 0 HG21 VAL A 49 -0.779 -0.992 5.459 1.00 52.14 H new ATOM 0 HG22 VAL A 49 -1.731 0.397 4.883 1.00 52.14 H new ATOM 0 HG23 VAL A 49 0.014 0.312 4.544 1.00 52.14 H new ATOM 176 N ALA A 50 1.045 3.046 8.055 1.00 65.35 N ATOM 177 CA ALA A 50 1.478 3.617 9.309 1.00 53.22 C ATOM 178 C ALA A 50 1.146 5.094 9.392 1.00 25.34 C ATOM 179 O ALA A 50 0.656 5.562 10.399 1.00 25.42 O ATOM 180 CB ALA A 50 2.961 3.421 9.453 1.00 44.00 C ATOM 0 H ALA A 50 1.803 2.627 7.517 1.00 65.35 H new ATOM 0 HA ALA A 50 0.950 3.112 10.118 1.00 53.22 H new ATOM 0 HB1 ALA A 50 3.295 3.850 10.398 1.00 44.00 H new ATOM 0 HB2 ALA A 50 3.190 2.356 9.437 1.00 44.00 H new ATOM 0 HB3 ALA A 50 3.475 3.915 8.629 1.00 44.00 H new ATOM 186 N LYS A 51 1.360 5.825 8.309 1.00 64.22 N ATOM 187 CA LYS A 51 1.108 7.268 8.315 1.00 2.30 C ATOM 188 C LYS A 51 -0.395 7.591 8.469 1.00 32.14 C ATOM 189 O LYS A 51 -0.780 8.649 9.011 1.00 62.12 O ATOM 190 CB LYS A 51 1.692 7.926 7.055 1.00 62.21 C ATOM 191 CG LYS A 51 3.187 7.642 6.848 1.00 33.04 C ATOM 192 CD LYS A 51 4.048 8.097 8.037 1.00 70.33 C ATOM 193 CE LYS A 51 4.084 9.614 8.193 1.00 64.45 C ATOM 194 NZ LYS A 51 4.803 10.273 7.087 1.00 74.41 N ATOM 0 H LYS A 51 1.703 5.454 7.423 1.00 64.22 H new ATOM 0 HA LYS A 51 1.614 7.686 9.185 1.00 2.30 H new ATOM 0 HB2 LYS A 51 1.140 7.575 6.183 1.00 62.21 H new ATOM 0 HB3 LYS A 51 1.541 9.004 7.115 1.00 62.21 H new ATOM 0 HG2 LYS A 51 3.331 6.573 6.689 1.00 33.04 H new ATOM 0 HG3 LYS A 51 3.527 8.148 5.944 1.00 33.04 H new ATOM 0 HD2 LYS A 51 3.660 7.651 8.953 1.00 70.33 H new ATOM 0 HD3 LYS A 51 5.064 7.725 7.907 1.00 70.33 H new ATOM 0 HE2 LYS A 51 3.064 9.997 8.240 1.00 64.45 H new ATOM 0 HE3 LYS A 51 4.564 9.869 9.138 1.00 64.45 H new ATOM 0 HZ1 LYS A 51 4.920 11.284 7.302 1.00 74.41 H new ATOM 0 HZ2 LYS A 51 5.738 9.833 6.970 1.00 74.41 H new ATOM 0 HZ3 LYS A 51 4.259 10.167 6.207 1.00 74.41 H new ATOM 208 N GLY A 52 -1.234 6.667 8.071 1.00 55.24 N ATOM 209 CA GLY A 52 -2.656 6.861 8.231 1.00 1.23 C ATOM 210 C GLY A 52 -3.114 6.330 9.570 1.00 22.43 C ATOM 211 O GLY A 52 -4.117 6.776 10.133 1.00 2.12 O ATOM 0 H GLY A 52 -0.963 5.783 7.639 1.00 55.24 H new ATOM 0 HA2 GLY A 52 -2.896 7.921 8.152 1.00 1.23 H new ATOM 0 HA3 GLY A 52 -3.191 6.353 7.429 1.00 1.23 H new ATOM 215 N ASP A 53 -2.335 5.423 10.103 1.00 44.11 N ATOM 216 CA ASP A 53 -2.658 4.753 11.344 1.00 53.00 C ATOM 217 C ASP A 53 -2.251 5.634 12.510 1.00 35.24 C ATOM 218 O ASP A 53 -2.963 5.753 13.497 1.00 62.44 O ATOM 219 CB ASP A 53 -1.961 3.409 11.397 1.00 35.45 C ATOM 220 CG ASP A 53 -2.514 2.508 12.456 1.00 74.45 C ATOM 221 OD1 ASP A 53 -3.639 2.003 12.272 1.00 21.30 O ATOM 222 OD2 ASP A 53 -1.826 2.249 13.446 1.00 62.30 O ATOM 0 H ASP A 53 -1.452 5.124 9.688 1.00 44.11 H new ATOM 0 HA ASP A 53 -3.732 4.576 11.405 1.00 53.00 H new ATOM 0 HB2 ASP A 53 -2.052 2.920 10.427 1.00 35.45 H new ATOM 0 HB3 ASP A 53 -0.897 3.564 11.578 1.00 35.45 H new ATOM 227 N ILE A 54 -1.121 6.306 12.368 1.00 42.45 N ATOM 228 CA ILE A 54 -0.702 7.287 13.352 1.00 4.31 C ATOM 229 C ILE A 54 -1.684 8.447 13.352 1.00 51.31 C ATOM 230 O ILE A 54 -2.000 8.999 14.401 1.00 22.44 O ATOM 231 CB ILE A 54 0.743 7.820 13.117 1.00 74.33 C ATOM 232 CG1 ILE A 54 0.871 8.488 11.743 1.00 65.23 C ATOM 233 CG2 ILE A 54 1.755 6.699 13.286 1.00 10.12 C ATOM 234 CD1 ILE A 54 2.238 9.036 11.428 1.00 72.34 C ATOM 0 H ILE A 54 -0.480 6.190 11.583 1.00 42.45 H new ATOM 0 HA ILE A 54 -0.693 6.786 14.320 1.00 4.31 H new ATOM 0 HB ILE A 54 0.954 8.582 13.867 1.00 74.33 H new ATOM 0 HG12 ILE A 54 0.601 7.762 10.976 1.00 65.23 H new ATOM 0 HG13 ILE A 54 0.147 9.301 11.682 1.00 65.23 H new ATOM 0 HG21 ILE A 54 2.760 7.087 13.119 1.00 10.12 H new ATOM 0 HG22 ILE A 54 1.686 6.295 14.296 1.00 10.12 H new ATOM 0 HG23 ILE A 54 1.547 5.909 12.565 1.00 10.12 H new ATOM 0 HD11 ILE A 54 2.229 9.488 10.436 1.00 72.34 H new ATOM 0 HD12 ILE A 54 2.507 9.790 12.168 1.00 72.34 H new ATOM 0 HD13 ILE A 54 2.968 8.227 11.451 1.00 72.34 H new ATOM 246 N LYS A 55 -2.223 8.774 12.162 1.00 64.10 N ATOM 247 CA LYS A 55 -3.189 9.842 12.045 1.00 50.11 C ATOM 248 C LYS A 55 -4.485 9.451 12.766 1.00 52.11 C ATOM 249 O LYS A 55 -5.220 10.310 13.251 1.00 73.23 O ATOM 250 CB LYS A 55 -3.462 10.166 10.582 1.00 10.22 C ATOM 251 CG LYS A 55 -3.552 11.655 10.299 1.00 4.03 C ATOM 252 CD LYS A 55 -2.204 12.328 10.554 1.00 62.01 C ATOM 253 CE LYS A 55 -2.263 13.829 10.314 1.00 65.55 C ATOM 254 NZ LYS A 55 -0.957 14.484 10.557 1.00 20.33 N ATOM 0 H LYS A 55 -1.997 8.308 11.283 1.00 64.10 H new ATOM 0 HA LYS A 55 -2.781 10.737 12.514 1.00 50.11 H new ATOM 0 HB2 LYS A 55 -2.671 9.735 9.969 1.00 10.22 H new ATOM 0 HB3 LYS A 55 -4.395 9.690 10.280 1.00 10.22 H new ATOM 0 HG2 LYS A 55 -3.857 11.817 9.265 1.00 4.03 H new ATOM 0 HG3 LYS A 55 -4.316 12.106 10.931 1.00 4.03 H new ATOM 0 HD2 LYS A 55 -1.892 12.137 11.581 1.00 62.01 H new ATOM 0 HD3 LYS A 55 -1.449 11.886 9.904 1.00 62.01 H new ATOM 0 HE2 LYS A 55 -2.578 14.019 9.288 1.00 65.55 H new ATOM 0 HE3 LYS A 55 -3.016 14.271 10.966 1.00 65.55 H new ATOM 0 HZ1 LYS A 55 -1.043 15.506 10.382 1.00 20.33 H new ATOM 0 HZ2 LYS A 55 -0.667 14.325 11.543 1.00 20.33 H new ATOM 0 HZ3 LYS A 55 -0.243 14.082 9.917 1.00 20.33 H new ATOM 268 N ALA A 56 -4.743 8.149 12.834 1.00 31.13 N ATOM 269 CA ALA A 56 -5.867 7.606 13.586 1.00 63.40 C ATOM 270 C ALA A 56 -5.654 7.868 15.070 1.00 34.42 C ATOM 271 O ALA A 56 -6.572 8.288 15.790 1.00 53.12 O ATOM 272 CB ALA A 56 -5.977 6.110 13.354 1.00 73.41 C ATOM 0 H ALA A 56 -4.177 7.440 12.368 1.00 31.13 H new ATOM 0 HA ALA A 56 -6.785 8.089 13.251 1.00 63.40 H new ATOM 0 HB1 ALA A 56 -6.820 5.715 13.921 1.00 73.41 H new ATOM 0 HB2 ALA A 56 -6.131 5.917 12.292 1.00 73.41 H new ATOM 0 HB3 ALA A 56 -5.059 5.622 13.682 1.00 73.41 H new ATOM 278 N ILE A 57 -4.431 7.630 15.515 1.00 74.10 N ATOM 279 CA ILE A 57 -4.036 7.849 16.899 1.00 74.22 C ATOM 280 C ILE A 57 -4.117 9.330 17.231 1.00 2.02 C ATOM 281 O ILE A 57 -4.560 9.694 18.283 1.00 12.24 O ATOM 282 CB ILE A 57 -2.602 7.335 17.175 1.00 45.21 C ATOM 283 CG1 ILE A 57 -2.510 5.864 16.799 1.00 44.35 C ATOM 284 CG2 ILE A 57 -2.252 7.518 18.655 1.00 52.31 C ATOM 285 CD1 ILE A 57 -1.116 5.298 16.817 1.00 5.20 C ATOM 0 H ILE A 57 -3.679 7.277 14.923 1.00 74.10 H new ATOM 0 HA ILE A 57 -4.723 7.287 17.532 1.00 74.22 H new ATOM 0 HB ILE A 57 -1.895 7.907 16.575 1.00 45.21 H new ATOM 0 HG12 ILE A 57 -3.131 5.288 17.485 1.00 44.35 H new ATOM 0 HG13 ILE A 57 -2.929 5.731 15.802 1.00 44.35 H new ATOM 0 HG21 ILE A 57 -1.241 7.153 18.838 1.00 52.31 H new ATOM 0 HG22 ILE A 57 -2.309 8.575 18.914 1.00 52.31 H new ATOM 0 HG23 ILE A 57 -2.957 6.956 19.268 1.00 52.31 H new ATOM 0 HD11 ILE A 57 -1.147 4.245 16.536 1.00 5.20 H new ATOM 0 HD12 ILE A 57 -0.492 5.844 16.109 1.00 5.20 H new ATOM 0 HD13 ILE A 57 -0.697 5.394 17.819 1.00 5.20 H new ATOM 297 N ALA A 58 -3.728 10.180 16.295 1.00 2.24 N ATOM 298 CA ALA A 58 -3.798 11.635 16.484 1.00 12.03 C ATOM 299 C ALA A 58 -5.236 12.101 16.750 1.00 62.53 C ATOM 300 O ALA A 58 -5.464 13.115 17.414 1.00 51.22 O ATOM 301 CB ALA A 58 -3.228 12.361 15.277 1.00 1.13 C ATOM 0 H ALA A 58 -3.357 9.894 15.389 1.00 2.24 H new ATOM 0 HA ALA A 58 -3.197 11.879 17.360 1.00 12.03 H new ATOM 0 HB1 ALA A 58 -3.289 13.437 15.437 1.00 1.13 H new ATOM 0 HB2 ALA A 58 -2.186 12.074 15.138 1.00 1.13 H new ATOM 0 HB3 ALA A 58 -3.799 12.093 14.388 1.00 1.13 H new ATOM 307 N ALA A 59 -6.194 11.342 16.262 1.00 23.12 N ATOM 308 CA ALA A 59 -7.590 11.664 16.438 1.00 73.55 C ATOM 309 C ALA A 59 -8.104 11.076 17.742 1.00 63.33 C ATOM 310 O ALA A 59 -8.955 11.661 18.411 1.00 54.24 O ATOM 311 CB ALA A 59 -8.401 11.131 15.274 1.00 55.53 C ATOM 0 H ALA A 59 -6.025 10.486 15.733 1.00 23.12 H new ATOM 0 HA ALA A 59 -7.696 12.748 16.474 1.00 73.55 H new ATOM 0 HB1 ALA A 59 -9.452 11.380 15.419 1.00 55.53 H new ATOM 0 HB2 ALA A 59 -8.046 11.581 14.347 1.00 55.53 H new ATOM 0 HB3 ALA A 59 -8.289 10.048 15.218 1.00 55.53 H new ATOM 317 N ALA A 60 -7.569 9.936 18.110 1.00 12.23 N ATOM 318 CA ALA A 60 -7.999 9.247 19.304 1.00 1.32 C ATOM 319 C ALA A 60 -7.289 9.776 20.557 1.00 55.42 C ATOM 320 O ALA A 60 -7.836 9.751 21.644 1.00 74.21 O ATOM 321 CB ALA A 60 -7.837 7.757 19.140 1.00 51.22 C ATOM 0 H ALA A 60 -6.828 9.462 17.594 1.00 12.23 H new ATOM 0 HA ALA A 60 -9.060 9.450 19.449 1.00 1.32 H new ATOM 0 HB1 ALA A 60 -8.166 7.253 20.049 1.00 51.22 H new ATOM 0 HB2 ALA A 60 -8.439 7.416 18.298 1.00 51.22 H new ATOM 0 HB3 ALA A 60 -6.789 7.523 18.954 1.00 51.22 H new ATOM 327 N LEU A 61 -6.105 10.305 20.392 1.00 62.13 N ATOM 328 CA LEU A 61 -5.372 10.924 21.481 1.00 43.35 C ATOM 329 C LEU A 61 -6.091 12.239 21.816 1.00 42.24 C ATOM 330 O LEU A 61 -6.098 12.708 22.957 1.00 75.43 O ATOM 331 CB LEU A 61 -3.902 11.112 21.027 1.00 75.54 C ATOM 332 CG LEU A 61 -2.806 11.310 22.098 1.00 2.34 C ATOM 333 CD1 LEU A 61 -2.820 12.692 22.677 1.00 54.12 C ATOM 334 CD2 LEU A 61 -2.948 10.292 23.211 1.00 42.42 C ATOM 0 H LEU A 61 -5.614 10.322 19.498 1.00 62.13 H new ATOM 0 HA LEU A 61 -5.345 10.319 22.387 1.00 43.35 H new ATOM 0 HB2 LEU A 61 -3.627 10.241 20.433 1.00 75.54 H new ATOM 0 HB3 LEU A 61 -3.871 11.975 20.361 1.00 75.54 H new ATOM 0 HG LEU A 61 -1.850 11.166 21.594 1.00 2.34 H new ATOM 0 HD11 LEU A 61 -2.032 12.781 23.425 1.00 54.12 H new ATOM 0 HD12 LEU A 61 -2.652 13.421 21.884 1.00 54.12 H new ATOM 0 HD13 LEU A 61 -3.786 12.881 23.144 1.00 54.12 H new ATOM 0 HD21 LEU A 61 -2.165 10.452 23.952 1.00 42.42 H new ATOM 0 HD22 LEU A 61 -3.924 10.403 23.684 1.00 42.42 H new ATOM 0 HD23 LEU A 61 -2.857 9.287 22.799 1.00 42.42 H new ATOM 346 N ASP A 62 -6.787 12.766 20.813 1.00 42.11 N ATOM 347 CA ASP A 62 -7.645 13.936 20.971 1.00 4.14 C ATOM 348 C ASP A 62 -8.938 13.521 21.693 1.00 34.04 C ATOM 349 O ASP A 62 -9.639 14.332 22.299 1.00 42.41 O ATOM 350 CB ASP A 62 -7.977 14.544 19.607 1.00 33.10 C ATOM 351 CG ASP A 62 -8.899 15.745 19.699 1.00 3.35 C ATOM 352 OD1 ASP A 62 -8.431 16.846 20.048 1.00 51.35 O ATOM 353 OD2 ASP A 62 -10.097 15.615 19.383 1.00 72.51 O ATOM 0 H ASP A 62 -6.772 12.392 19.864 1.00 42.11 H new ATOM 0 HA ASP A 62 -7.121 14.687 21.562 1.00 4.14 H new ATOM 0 HB2 ASP A 62 -7.052 14.841 19.113 1.00 33.10 H new ATOM 0 HB3 ASP A 62 -8.443 13.783 18.980 1.00 33.10 H new ATOM 358 N MET A 63 -9.219 12.238 21.652 1.00 53.11 N ATOM 359 CA MET A 63 -10.371 11.671 22.323 1.00 13.02 C ATOM 360 C MET A 63 -10.050 11.461 23.795 1.00 73.04 C ATOM 361 O MET A 63 -10.930 11.531 24.626 1.00 54.11 O ATOM 362 CB MET A 63 -10.818 10.371 21.653 1.00 51.32 C ATOM 363 CG MET A 63 -11.353 10.560 20.245 1.00 41.43 C ATOM 364 SD MET A 63 -11.472 9.017 19.305 1.00 53.12 S ATOM 365 CE MET A 63 -12.497 8.020 20.376 1.00 33.23 C ATOM 0 H MET A 63 -8.653 11.554 21.150 1.00 53.11 H new ATOM 0 HA MET A 63 -11.205 12.368 22.245 1.00 13.02 H new ATOM 0 HB2 MET A 63 -9.975 9.681 21.622 1.00 51.32 H new ATOM 0 HB3 MET A 63 -11.590 9.904 22.265 1.00 51.32 H new ATOM 0 HG2 MET A 63 -12.339 11.021 20.298 1.00 41.43 H new ATOM 0 HG3 MET A 63 -10.706 11.254 19.709 1.00 41.43 H new ATOM 0 HE1 MET A 63 -12.785 7.106 19.856 1.00 33.23 H new ATOM 0 HE2 MET A 63 -11.941 7.765 21.278 1.00 33.23 H new ATOM 0 HE3 MET A 63 -13.392 8.580 20.648 1.00 33.23 H new ATOM 375 N TYR A 64 -8.772 11.212 24.112 1.00 54.14 N ATOM 376 CA TYR A 64 -8.333 11.194 25.512 1.00 13.50 C ATOM 377 C TYR A 64 -8.364 12.638 25.986 1.00 70.44 C ATOM 378 O TYR A 64 -8.765 12.936 27.099 1.00 15.12 O ATOM 379 CB TYR A 64 -6.907 10.673 25.650 1.00 65.42 C ATOM 380 CG TYR A 64 -6.528 10.383 27.095 1.00 42.22 C ATOM 381 CD1 TYR A 64 -6.310 11.399 28.025 1.00 31.43 C ATOM 382 CD2 TYR A 64 -6.380 9.095 27.526 1.00 44.31 C ATOM 383 CE1 TYR A 64 -5.964 11.118 29.301 1.00 4.32 C ATOM 384 CE2 TYR A 64 -6.044 8.813 28.794 1.00 61.23 C ATOM 385 CZ TYR A 64 -5.834 9.829 29.683 1.00 73.11 C ATOM 386 OH TYR A 64 -5.479 9.539 30.946 1.00 14.31 O ATOM 0 H TYR A 64 -8.036 11.024 23.431 1.00 54.14 H new ATOM 0 HA TYR A 64 -8.982 10.540 26.094 1.00 13.50 H new ATOM 0 HB2 TYR A 64 -6.798 9.763 25.060 1.00 65.42 H new ATOM 0 HB3 TYR A 64 -6.214 11.406 25.237 1.00 65.42 H new ATOM 0 HD1 TYR A 64 -6.420 12.429 27.720 1.00 31.43 H new ATOM 0 HD2 TYR A 64 -6.537 8.285 26.830 1.00 44.31 H new ATOM 0 HE1 TYR A 64 -5.793 11.916 30.008 1.00 4.32 H new ATOM 0 HE2 TYR A 64 -5.940 7.786 29.111 1.00 61.23 H new ATOM 0 HH TYR A 64 -5.804 10.242 31.547 1.00 14.31 H new ATOM 396 N LYS A 65 -7.945 13.540 25.091 1.00 3.00 N ATOM 397 CA LYS A 65 -8.030 14.982 25.315 1.00 3.03 C ATOM 398 C LYS A 65 -9.482 15.387 25.617 1.00 52.30 C ATOM 399 O LYS A 65 -9.744 16.377 26.277 1.00 11.44 O ATOM 400 CB LYS A 65 -7.479 15.723 24.090 1.00 62.02 C ATOM 401 CG LYS A 65 -7.791 17.208 23.998 1.00 44.30 C ATOM 402 CD LYS A 65 -7.049 17.842 22.833 1.00 40.33 C ATOM 403 CE LYS A 65 -7.678 19.149 22.384 1.00 34.33 C ATOM 404 NZ LYS A 65 -8.980 18.913 21.720 1.00 31.43 N ATOM 0 H LYS A 65 -7.537 13.287 24.191 1.00 3.00 H new ATOM 0 HA LYS A 65 -7.426 15.257 26.180 1.00 3.03 H new ATOM 0 HB2 LYS A 65 -6.396 15.601 24.076 1.00 62.02 H new ATOM 0 HB3 LYS A 65 -7.866 15.237 23.195 1.00 62.02 H new ATOM 0 HG2 LYS A 65 -8.864 17.352 23.874 1.00 44.30 H new ATOM 0 HG3 LYS A 65 -7.509 17.702 24.928 1.00 44.30 H new ATOM 0 HD2 LYS A 65 -6.013 18.021 23.121 1.00 40.33 H new ATOM 0 HD3 LYS A 65 -7.031 17.145 21.995 1.00 40.33 H new ATOM 0 HE2 LYS A 65 -7.818 19.803 23.244 1.00 34.33 H new ATOM 0 HE3 LYS A 65 -7.005 19.664 21.699 1.00 34.33 H new ATOM 0 HZ1 LYS A 65 -9.139 19.644 20.998 1.00 31.43 H new ATOM 0 HZ2 LYS A 65 -8.975 17.976 21.269 1.00 31.43 H new ATOM 0 HZ3 LYS A 65 -9.742 18.953 22.426 1.00 31.43 H new ATOM 418 N LEU A 66 -10.406 14.608 25.120 1.00 2.54 N ATOM 419 CA LEU A 66 -11.804 14.800 25.396 1.00 51.12 C ATOM 420 C LEU A 66 -12.197 14.085 26.703 1.00 64.20 C ATOM 421 O LEU A 66 -12.986 14.615 27.492 1.00 0.52 O ATOM 422 CB LEU A 66 -12.641 14.271 24.220 1.00 64.32 C ATOM 423 CG LEU A 66 -14.161 14.404 24.331 1.00 0.11 C ATOM 424 CD1 LEU A 66 -14.568 15.857 24.465 1.00 11.12 C ATOM 425 CD2 LEU A 66 -14.833 13.776 23.126 1.00 51.33 C ATOM 0 H LEU A 66 -10.208 13.817 24.508 1.00 2.54 H new ATOM 0 HA LEU A 66 -11.999 15.865 25.519 1.00 51.12 H new ATOM 0 HB2 LEU A 66 -12.321 14.790 23.317 1.00 64.32 H new ATOM 0 HB3 LEU A 66 -12.403 13.216 24.083 1.00 64.32 H new ATOM 0 HG LEU A 66 -14.485 13.877 25.228 1.00 0.11 H new ATOM 0 HD11 LEU A 66 -15.653 15.925 24.542 1.00 11.12 H new ATOM 0 HD12 LEU A 66 -14.113 16.281 25.360 1.00 11.12 H new ATOM 0 HD13 LEU A 66 -14.231 16.411 23.589 1.00 11.12 H new ATOM 0 HD21 LEU A 66 -15.914 13.878 23.218 1.00 51.33 H new ATOM 0 HD22 LEU A 66 -14.497 14.279 22.219 1.00 51.33 H new ATOM 0 HD23 LEU A 66 -14.571 12.719 23.073 1.00 51.33 H new ATOM 437 N ASP A 67 -11.607 12.914 26.962 1.00 1.11 N ATOM 438 CA ASP A 67 -11.964 12.117 28.152 1.00 31.21 C ATOM 439 C ASP A 67 -11.390 12.733 29.425 1.00 31.51 C ATOM 440 O ASP A 67 -12.004 12.678 30.465 1.00 44.12 O ATOM 441 CB ASP A 67 -11.377 10.691 28.000 1.00 10.01 C ATOM 442 CG ASP A 67 -11.654 9.770 29.195 1.00 35.42 C ATOM 443 OD1 ASP A 67 -12.783 9.276 29.334 1.00 52.32 O ATOM 444 OD2 ASP A 67 -10.743 9.538 30.009 1.00 63.32 O ATOM 0 H ASP A 67 -10.887 12.495 26.374 1.00 1.11 H new ATOM 0 HA ASP A 67 -13.051 12.092 28.229 1.00 31.21 H new ATOM 0 HB2 ASP A 67 -11.788 10.234 27.100 1.00 10.01 H new ATOM 0 HB3 ASP A 67 -10.299 10.767 27.855 1.00 10.01 H new ATOM 449 N ASN A 68 -10.307 13.475 29.294 1.00 12.31 N ATOM 450 CA ASN A 68 -9.666 14.135 30.455 1.00 22.33 C ATOM 451 C ASN A 68 -9.487 15.560 30.218 1.00 74.11 C ATOM 452 O ASN A 68 -8.673 16.175 30.902 1.00 72.52 O ATOM 453 CB ASN A 68 -8.284 13.589 30.839 1.00 53.23 C ATOM 454 CG ASN A 68 -8.216 12.213 31.479 1.00 44.51 C ATOM 455 OD1 ASN A 68 -8.941 11.280 30.988 1.00 14.43 O flip ATOM 456 ND2 ASN A 68 -7.421 11.994 32.394 1.00 43.34 N flip ATOM 0 H ASN A 68 -9.840 13.646 28.403 1.00 12.31 H new ATOM 0 HA ASN A 68 -10.358 13.927 31.271 1.00 22.33 H new ATOM 0 HB2 ASN A 68 -7.670 13.570 29.939 1.00 53.23 H new ATOM 0 HB3 ASN A 68 -7.822 14.300 31.524 1.00 53.23 H new ATOM 0 HD21 ASN A 68 -6.853 12.754 32.769 1.00 43.34 H new ATOM 0 HD22 ASN A 68 -7.330 11.053 32.776 1.00 43.34 H new ATOM 463 N PHE A 69 -10.258 16.110 29.270 1.00 75.11 N ATOM 464 CA PHE A 69 -10.279 17.563 28.930 1.00 0.43 C ATOM 465 C PHE A 69 -8.882 18.188 28.867 1.00 55.13 C ATOM 466 O PHE A 69 -8.721 19.406 29.058 1.00 31.32 O ATOM 467 CB PHE A 69 -11.197 18.323 29.918 1.00 22.04 C ATOM 468 CG PHE A 69 -10.984 17.978 31.368 1.00 65.41 C ATOM 469 CD1 PHE A 69 -9.971 18.530 32.076 1.00 21.12 C ATOM 470 CD2 PHE A 69 -11.806 17.092 31.989 1.00 24.13 C ATOM 471 CE1 PHE A 69 -9.768 18.221 33.390 1.00 52.12 C ATOM 472 CE2 PHE A 69 -11.630 16.758 33.294 1.00 31.13 C ATOM 473 CZ PHE A 69 -10.603 17.328 34.012 1.00 25.40 C ATOM 0 H PHE A 69 -10.900 15.559 28.701 1.00 75.11 H new ATOM 0 HA PHE A 69 -10.686 17.654 27.923 1.00 0.43 H new ATOM 0 HB2 PHE A 69 -11.041 19.394 29.787 1.00 22.04 H new ATOM 0 HB3 PHE A 69 -12.236 18.118 29.659 1.00 22.04 H new ATOM 0 HD1 PHE A 69 -9.308 19.231 31.590 1.00 21.12 H new ATOM 0 HD2 PHE A 69 -12.616 16.644 31.433 1.00 24.13 H new ATOM 0 HE1 PHE A 69 -8.955 18.677 33.936 1.00 52.12 H new ATOM 0 HE2 PHE A 69 -12.293 16.048 33.766 1.00 31.13 H new ATOM 0 HZ PHE A 69 -10.457 17.075 35.052 1.00 25.40 H new ATOM 483 N ALA A 70 -7.921 17.384 28.460 1.00 14.42 N ATOM 484 CA ALA A 70 -6.529 17.729 28.476 1.00 22.24 C ATOM 485 C ALA A 70 -5.753 16.534 27.984 1.00 64.31 C ATOM 486 O ALA A 70 -6.296 15.423 27.946 1.00 73.12 O ATOM 487 CB ALA A 70 -6.110 18.053 29.910 1.00 64.15 C ATOM 0 H ALA A 70 -8.101 16.447 28.100 1.00 14.42 H new ATOM 0 HA ALA A 70 -6.337 18.595 27.843 1.00 22.24 H new ATOM 0 HB1 ALA A 70 -5.052 18.316 29.929 1.00 64.15 H new ATOM 0 HB2 ALA A 70 -6.700 18.892 30.281 1.00 64.15 H new ATOM 0 HB3 ALA A 70 -6.279 17.183 30.544 1.00 64.15 H new ATOM 493 N TYR A 71 -4.536 16.751 27.573 1.00 50.02 N ATOM 494 CA TYR A 71 -3.672 15.668 27.185 1.00 23.52 C ATOM 495 C TYR A 71 -3.107 14.929 28.394 1.00 33.21 C ATOM 496 O TYR A 71 -3.034 15.491 29.498 1.00 54.23 O ATOM 497 CB TYR A 71 -2.544 16.145 26.270 1.00 44.52 C ATOM 498 CG TYR A 71 -2.987 16.417 24.870 1.00 1.43 C ATOM 499 CD1 TYR A 71 -3.823 15.531 24.217 1.00 3.35 C ATOM 500 CD2 TYR A 71 -2.565 17.538 24.192 1.00 62.14 C ATOM 501 CE1 TYR A 71 -4.228 15.749 22.940 1.00 2.12 C ATOM 502 CE2 TYR A 71 -2.963 17.769 22.896 1.00 1.25 C ATOM 503 CZ TYR A 71 -3.798 16.870 22.271 1.00 74.33 C ATOM 504 OH TYR A 71 -4.203 17.093 20.971 1.00 22.02 O ATOM 0 H TYR A 71 -4.115 17.677 27.497 1.00 50.02 H new ATOM 0 HA TYR A 71 -4.287 14.965 26.623 1.00 23.52 H new ATOM 0 HB2 TYR A 71 -2.108 17.052 26.687 1.00 44.52 H new ATOM 0 HB3 TYR A 71 -1.757 15.391 26.254 1.00 44.52 H new ATOM 0 HD1 TYR A 71 -4.162 14.645 24.734 1.00 3.35 H new ATOM 0 HD2 TYR A 71 -1.913 18.245 24.684 1.00 62.14 H new ATOM 0 HE1 TYR A 71 -4.885 15.045 22.452 1.00 2.12 H new ATOM 0 HE2 TYR A 71 -2.623 18.650 22.372 1.00 1.25 H new ATOM 0 HH TYR A 71 -3.810 17.930 20.645 1.00 22.02 H new ATOM 514 N PRO A 72 -2.692 13.659 28.206 1.00 61.31 N ATOM 515 CA PRO A 72 -2.110 12.851 29.272 1.00 1.20 C ATOM 516 C PRO A 72 -0.677 13.323 29.618 1.00 32.23 C ATOM 517 O PRO A 72 -0.105 14.174 28.913 1.00 55.45 O ATOM 518 CB PRO A 72 -2.059 11.430 28.658 1.00 10.04 C ATOM 519 CG PRO A 72 -2.797 11.497 27.371 1.00 33.23 C ATOM 520 CD PRO A 72 -2.740 12.911 26.932 1.00 34.32 C ATOM 0 HA PRO A 72 -2.683 12.911 30.197 1.00 1.20 H new ATOM 0 HB2 PRO A 72 -1.028 11.114 28.498 1.00 10.04 H new ATOM 0 HB3 PRO A 72 -2.515 10.702 29.329 1.00 10.04 H new ATOM 0 HG2 PRO A 72 -2.344 10.841 26.628 1.00 33.23 H new ATOM 0 HG3 PRO A 72 -3.829 11.170 27.497 1.00 33.23 H new ATOM 0 HD2 PRO A 72 -1.862 13.107 26.317 1.00 34.32 H new ATOM 0 HD3 PRO A 72 -3.612 13.184 26.338 1.00 34.32 H new ATOM 528 N SER A 73 -0.106 12.809 30.692 1.00 2.43 N ATOM 529 CA SER A 73 1.258 13.133 31.026 1.00 34.15 C ATOM 530 C SER A 73 2.105 11.928 30.657 1.00 42.33 C ATOM 531 O SER A 73 1.569 10.839 30.560 1.00 43.52 O ATOM 532 CB SER A 73 1.355 13.483 32.506 1.00 3.34 C ATOM 533 OG SER A 73 0.789 12.460 33.295 1.00 62.13 O ATOM 0 H SER A 73 -0.566 12.170 31.340 1.00 2.43 H new ATOM 0 HA SER A 73 1.617 14.004 30.478 1.00 34.15 H new ATOM 0 HB2 SER A 73 2.399 13.628 32.783 1.00 3.34 H new ATOM 0 HB3 SER A 73 0.840 14.425 32.697 1.00 3.34 H new ATOM 0 HG SER A 73 -0.188 12.515 33.250 1.00 62.13 H new ATOM 539 N THR A 74 3.380 12.083 30.410 1.00 52.43 N ATOM 540 CA THR A 74 4.164 10.940 29.967 1.00 11.11 C ATOM 541 C THR A 74 4.354 9.927 31.130 1.00 62.13 C ATOM 542 O THR A 74 4.780 8.782 30.941 1.00 23.44 O ATOM 543 CB THR A 74 5.513 11.372 29.318 1.00 62.53 C ATOM 544 OG1 THR A 74 5.892 10.409 28.320 1.00 61.22 O ATOM 545 CG2 THR A 74 6.629 11.497 30.363 1.00 52.05 C ATOM 0 H THR A 74 3.894 12.959 30.502 1.00 52.43 H new ATOM 0 HA THR A 74 3.608 10.431 29.179 1.00 11.11 H new ATOM 0 HB THR A 74 5.371 12.351 28.861 1.00 62.53 H new ATOM 0 HG1 THR A 74 6.740 10.680 27.909 1.00 61.22 H new ATOM 0 HG21 THR A 74 7.554 11.800 29.873 1.00 52.05 H new ATOM 0 HG22 THR A 74 6.350 12.245 31.105 1.00 52.05 H new ATOM 0 HG23 THR A 74 6.777 10.535 30.854 1.00 52.05 H new ATOM 553 N GLN A 75 4.024 10.359 32.326 1.00 44.15 N ATOM 554 CA GLN A 75 4.036 9.492 33.450 1.00 45.10 C ATOM 555 C GLN A 75 2.617 9.027 33.786 1.00 52.11 C ATOM 556 O GLN A 75 2.288 7.845 33.589 1.00 44.54 O ATOM 557 CB GLN A 75 4.674 10.177 34.638 1.00 22.42 C ATOM 558 CG GLN A 75 6.133 10.518 34.442 1.00 42.22 C ATOM 559 CD GLN A 75 6.702 11.225 35.634 1.00 52.31 C ATOM 560 OE1 GLN A 75 7.207 10.596 36.558 1.00 44.35 O ATOM 561 NE2 GLN A 75 6.626 12.525 35.634 1.00 35.10 N ATOM 0 H GLN A 75 3.743 11.318 32.532 1.00 44.15 H new ATOM 0 HA GLN A 75 4.631 8.612 33.203 1.00 45.10 H new ATOM 0 HB2 GLN A 75 4.124 11.093 34.855 1.00 22.42 H new ATOM 0 HB3 GLN A 75 4.577 9.532 35.511 1.00 22.42 H new ATOM 0 HG2 GLN A 75 6.698 9.605 34.256 1.00 42.22 H new ATOM 0 HG3 GLN A 75 6.244 11.147 33.559 1.00 42.22 H new ATOM 0 HE21 GLN A 75 6.198 13.011 34.846 1.00 35.10 H new ATOM 0 HE22 GLN A 75 6.994 13.057 36.422 1.00 35.10 H new ATOM 570 N GLN A 76 1.735 9.952 34.196 1.00 4.52 N ATOM 571 CA GLN A 76 0.397 9.559 34.639 1.00 74.32 C ATOM 572 C GLN A 76 -0.452 9.219 33.465 1.00 64.35 C ATOM 573 O GLN A 76 -1.178 8.245 33.499 1.00 74.20 O ATOM 574 CB GLN A 76 -0.280 10.647 35.482 1.00 51.11 C ATOM 575 CG GLN A 76 0.455 11.009 36.760 1.00 65.42 C ATOM 576 CD GLN A 76 -0.198 12.158 37.508 1.00 51.53 C ATOM 577 OE1 GLN A 76 0.120 13.322 37.278 1.00 74.34 O ATOM 578 NE2 GLN A 76 -1.094 11.854 38.418 1.00 34.34 N ATOM 0 H GLN A 76 1.922 10.954 34.229 1.00 4.52 H new ATOM 0 HA GLN A 76 0.511 8.681 35.274 1.00 74.32 H new ATOM 0 HB2 GLN A 76 -0.387 11.545 34.874 1.00 51.11 H new ATOM 0 HB3 GLN A 76 -1.286 10.315 35.739 1.00 51.11 H new ATOM 0 HG2 GLN A 76 0.497 10.135 37.410 1.00 65.42 H new ATOM 0 HG3 GLN A 76 1.484 11.276 36.519 1.00 65.42 H new ATOM 0 HE21 GLN A 76 -1.338 10.878 38.587 1.00 34.34 H new ATOM 0 HE22 GLN A 76 -1.546 12.594 38.956 1.00 34.34 H new ATOM 587 N GLY A 77 -0.316 9.985 32.400 1.00 70.25 N ATOM 588 CA GLY A 77 -1.100 9.715 31.254 1.00 44.51 C ATOM 589 C GLY A 77 -0.649 8.485 30.477 1.00 74.03 C ATOM 590 O GLY A 77 -1.444 7.902 29.786 1.00 62.31 O ATOM 0 H GLY A 77 0.321 10.778 32.322 1.00 70.25 H new ATOM 0 HA2 GLY A 77 -2.138 9.581 31.559 1.00 44.51 H new ATOM 0 HA3 GLY A 77 -1.071 10.581 30.593 1.00 44.51 H new ATOM 594 N LEU A 78 0.605 8.051 30.636 1.00 3.22 N ATOM 595 CA LEU A 78 1.070 6.873 29.885 1.00 2.11 C ATOM 596 C LEU A 78 0.434 5.651 30.510 1.00 33.23 C ATOM 597 O LEU A 78 -0.170 4.801 29.819 1.00 21.11 O ATOM 598 CB LEU A 78 2.616 6.790 29.877 1.00 12.12 C ATOM 599 CG LEU A 78 3.291 5.818 28.867 1.00 44.32 C ATOM 600 CD1 LEU A 78 4.774 6.097 28.800 1.00 24.43 C ATOM 601 CD2 LEU A 78 3.083 4.354 29.244 1.00 43.44 C ATOM 0 H LEU A 78 1.297 8.476 31.253 1.00 3.22 H new ATOM 0 HA LEU A 78 0.771 6.943 28.839 1.00 2.11 H new ATOM 0 HB2 LEU A 78 3.003 7.791 29.686 1.00 12.12 H new ATOM 0 HB3 LEU A 78 2.940 6.508 30.879 1.00 12.12 H new ATOM 0 HG LEU A 78 2.823 5.989 27.898 1.00 44.32 H new ATOM 0 HD11 LEU A 78 5.241 5.413 28.091 1.00 24.43 H new ATOM 0 HD12 LEU A 78 4.937 7.124 28.474 1.00 24.43 H new ATOM 0 HD13 LEU A 78 5.216 5.955 29.786 1.00 24.43 H new ATOM 0 HD21 LEU A 78 3.573 3.716 28.509 1.00 43.44 H new ATOM 0 HD22 LEU A 78 3.511 4.168 30.229 1.00 43.44 H new ATOM 0 HD23 LEU A 78 2.016 4.132 29.264 1.00 43.44 H new ATOM 613 N GLU A 79 0.500 5.601 31.830 1.00 44.35 N ATOM 614 CA GLU A 79 -0.165 4.559 32.569 1.00 33.34 C ATOM 615 C GLU A 79 -1.642 4.634 32.348 1.00 54.24 C ATOM 616 O GLU A 79 -2.291 3.645 32.322 1.00 74.13 O ATOM 617 CB GLU A 79 0.159 4.612 34.052 1.00 61.14 C ATOM 618 CG GLU A 79 1.542 4.126 34.360 1.00 43.03 C ATOM 619 CD GLU A 79 1.874 4.163 35.824 1.00 13.23 C ATOM 620 OE1 GLU A 79 1.520 3.210 36.546 1.00 52.24 O ATOM 621 OE2 GLU A 79 2.527 5.124 36.274 1.00 54.21 O ATOM 0 H GLU A 79 1.009 6.273 32.405 1.00 44.35 H new ATOM 0 HA GLU A 79 0.204 3.604 32.196 1.00 33.34 H new ATOM 0 HB2 GLU A 79 0.051 5.637 34.407 1.00 61.14 H new ATOM 0 HB3 GLU A 79 -0.564 4.008 34.599 1.00 61.14 H new ATOM 0 HG2 GLU A 79 1.650 3.104 33.996 1.00 43.03 H new ATOM 0 HG3 GLU A 79 2.263 4.736 33.816 1.00 43.03 H new ATOM 628 N ALA A 80 -2.131 5.825 32.113 1.00 22.23 N ATOM 629 CA ALA A 80 -3.529 6.051 31.873 1.00 31.31 C ATOM 630 C ALA A 80 -3.907 5.856 30.386 1.00 53.12 C ATOM 631 O ALA A 80 -5.047 6.074 29.995 1.00 0.32 O ATOM 632 CB ALA A 80 -3.902 7.414 32.347 1.00 12.22 C ATOM 0 H ALA A 80 -1.563 6.671 32.083 1.00 22.23 H new ATOM 0 HA ALA A 80 -4.093 5.307 32.435 1.00 31.31 H new ATOM 0 HB1 ALA A 80 -4.963 7.585 32.165 1.00 12.22 H new ATOM 0 HB2 ALA A 80 -3.700 7.496 33.415 1.00 12.22 H new ATOM 0 HB3 ALA A 80 -3.317 8.159 31.809 1.00 12.22 H new ATOM 638 N LEU A 81 -2.936 5.527 29.566 1.00 4.35 N ATOM 639 CA LEU A 81 -3.184 5.148 28.178 1.00 72.22 C ATOM 640 C LEU A 81 -3.229 3.633 28.051 1.00 24.11 C ATOM 641 O LEU A 81 -3.755 3.083 27.075 1.00 43.13 O ATOM 642 CB LEU A 81 -2.101 5.710 27.242 1.00 65.33 C ATOM 643 CG LEU A 81 -2.140 7.214 26.946 1.00 14.33 C ATOM 644 CD1 LEU A 81 -0.932 7.622 26.120 1.00 71.51 C ATOM 645 CD2 LEU A 81 -3.420 7.581 26.209 1.00 65.33 C ATOM 0 H LEU A 81 -1.952 5.512 29.833 1.00 4.35 H new ATOM 0 HA LEU A 81 -4.145 5.570 27.884 1.00 72.22 H new ATOM 0 HB2 LEU A 81 -1.128 5.476 27.673 1.00 65.33 H new ATOM 0 HB3 LEU A 81 -2.166 5.177 26.293 1.00 65.33 H new ATOM 0 HG LEU A 81 -2.117 7.750 27.895 1.00 14.33 H new ATOM 0 HD11 LEU A 81 -0.974 8.692 25.918 1.00 71.51 H new ATOM 0 HD12 LEU A 81 -0.020 7.392 26.671 1.00 71.51 H new ATOM 0 HD13 LEU A 81 -0.934 7.075 25.177 1.00 71.51 H new ATOM 0 HD21 LEU A 81 -3.430 8.652 26.008 1.00 65.33 H new ATOM 0 HD22 LEU A 81 -3.467 7.034 25.267 1.00 65.33 H new ATOM 0 HD23 LEU A 81 -4.281 7.320 26.824 1.00 65.33 H new ATOM 657 N VAL A 82 -2.632 2.962 29.010 1.00 24.14 N ATOM 658 CA VAL A 82 -2.616 1.503 29.015 1.00 30.24 C ATOM 659 C VAL A 82 -3.573 0.942 30.103 1.00 70.42 C ATOM 660 O VAL A 82 -4.174 -0.139 29.949 1.00 31.12 O ATOM 661 CB VAL A 82 -1.163 0.978 29.228 1.00 33.22 C ATOM 662 CG1 VAL A 82 -1.096 -0.534 29.126 1.00 25.02 C ATOM 663 CG2 VAL A 82 -0.210 1.620 28.222 1.00 13.11 C ATOM 0 H VAL A 82 -2.150 3.395 29.798 1.00 24.14 H new ATOM 0 HA VAL A 82 -2.970 1.152 28.046 1.00 30.24 H new ATOM 0 HB VAL A 82 -0.855 1.258 30.235 1.00 33.22 H new ATOM 0 HG11 VAL A 82 -0.069 -0.864 29.280 1.00 25.02 H new ATOM 0 HG12 VAL A 82 -1.738 -0.979 29.887 1.00 25.02 H new ATOM 0 HG13 VAL A 82 -1.434 -0.847 28.138 1.00 25.02 H new ATOM 0 HG21 VAL A 82 0.799 1.242 28.385 1.00 13.11 H new ATOM 0 HG22 VAL A 82 -0.530 1.374 27.209 1.00 13.11 H new ATOM 0 HG23 VAL A 82 -0.218 2.702 28.353 1.00 13.11 H new ATOM 673 N LYS A 83 -3.715 1.696 31.160 1.00 31.24 N ATOM 674 CA LYS A 83 -4.554 1.402 32.313 1.00 42.23 C ATOM 675 C LYS A 83 -5.487 2.589 32.513 1.00 54.10 C ATOM 676 O LYS A 83 -5.152 3.672 32.110 1.00 70.33 O ATOM 677 CB LYS A 83 -3.677 1.180 33.560 1.00 12.40 C ATOM 678 CG LYS A 83 -2.837 -0.076 33.501 1.00 63.34 C ATOM 679 CD LYS A 83 -1.926 -0.184 34.704 1.00 45.12 C ATOM 680 CE LYS A 83 -1.164 -1.491 34.685 1.00 70.15 C ATOM 681 NZ LYS A 83 -0.204 -1.597 35.790 1.00 11.23 N ATOM 0 H LYS A 83 -3.224 2.585 31.254 1.00 31.24 H new ATOM 0 HA LYS A 83 -5.133 0.493 32.151 1.00 42.23 H new ATOM 0 HB2 LYS A 83 -3.019 2.040 33.688 1.00 12.40 H new ATOM 0 HB3 LYS A 83 -4.318 1.136 34.440 1.00 12.40 H new ATOM 0 HG2 LYS A 83 -3.487 -0.949 33.455 1.00 63.34 H new ATOM 0 HG3 LYS A 83 -2.240 -0.075 32.589 1.00 63.34 H new ATOM 0 HD2 LYS A 83 -1.225 0.651 34.711 1.00 45.12 H new ATOM 0 HD3 LYS A 83 -2.514 -0.114 35.619 1.00 45.12 H new ATOM 0 HE2 LYS A 83 -1.869 -2.320 34.740 1.00 70.15 H new ATOM 0 HE3 LYS A 83 -0.634 -1.585 33.737 1.00 70.15 H new ATOM 0 HZ1 LYS A 83 0.292 -2.509 35.733 1.00 11.23 H new ATOM 0 HZ2 LYS A 83 0.487 -0.822 35.725 1.00 11.23 H new ATOM 0 HZ3 LYS A 83 -0.710 -1.534 36.697 1.00 11.23 H new ATOM 695 N LYS A 84 -6.666 2.367 33.069 1.00 15.14 N ATOM 696 CA LYS A 84 -7.690 3.434 33.217 1.00 2.11 C ATOM 697 C LYS A 84 -7.149 4.686 33.952 1.00 32.42 C ATOM 698 O LYS A 84 -6.347 4.565 34.887 1.00 20.12 O ATOM 699 CB LYS A 84 -8.940 2.892 33.917 1.00 14.35 C ATOM 700 CG LYS A 84 -9.667 1.823 33.147 1.00 0.43 C ATOM 701 CD LYS A 84 -10.910 1.407 33.892 1.00 3.23 C ATOM 702 CE LYS A 84 -11.752 0.453 33.086 1.00 2.03 C ATOM 703 NZ LYS A 84 -11.083 -0.848 32.834 1.00 21.41 N ATOM 0 H LYS A 84 -6.956 1.459 33.433 1.00 15.14 H new ATOM 0 HA LYS A 84 -7.959 3.753 32.210 1.00 2.11 H new ATOM 0 HB2 LYS A 84 -8.653 2.491 34.889 1.00 14.35 H new ATOM 0 HB3 LYS A 84 -9.625 3.719 34.103 1.00 14.35 H new ATOM 0 HG2 LYS A 84 -9.933 2.193 32.157 1.00 0.43 H new ATOM 0 HG3 LYS A 84 -9.015 0.962 33.000 1.00 0.43 H new ATOM 0 HD2 LYS A 84 -10.629 0.937 34.834 1.00 3.23 H new ATOM 0 HD3 LYS A 84 -11.498 2.291 34.140 1.00 3.23 H new ATOM 0 HE2 LYS A 84 -12.691 0.276 33.610 1.00 2.03 H new ATOM 0 HE3 LYS A 84 -12.002 0.916 32.132 1.00 2.03 H new ATOM 0 HZ1 LYS A 84 -11.725 -1.472 32.305 1.00 21.41 H new ATOM 0 HZ2 LYS A 84 -10.217 -0.692 32.279 1.00 21.41 H new ATOM 0 HZ3 LYS A 84 -10.837 -1.293 33.741 1.00 21.41 H new ATOM 717 N PRO A 85 -7.583 5.896 33.502 1.00 12.44 N ATOM 718 CA PRO A 85 -7.112 7.198 33.998 1.00 11.34 C ATOM 719 C PRO A 85 -7.023 7.314 35.511 1.00 23.41 C ATOM 720 O PRO A 85 -7.965 6.993 36.240 1.00 62.03 O ATOM 721 CB PRO A 85 -8.126 8.206 33.437 1.00 52.31 C ATOM 722 CG PRO A 85 -9.217 7.386 32.858 1.00 25.44 C ATOM 723 CD PRO A 85 -8.598 6.089 32.472 1.00 3.45 C ATOM 0 HA PRO A 85 -6.086 7.368 33.672 1.00 11.34 H new ATOM 0 HB2 PRO A 85 -8.502 8.863 34.221 1.00 52.31 H new ATOM 0 HB3 PRO A 85 -7.669 8.843 32.680 1.00 52.31 H new ATOM 0 HG2 PRO A 85 -10.018 7.235 33.582 1.00 25.44 H new ATOM 0 HG3 PRO A 85 -9.659 7.880 31.993 1.00 25.44 H new ATOM 0 HD2 PRO A 85 -9.327 5.279 32.466 1.00 3.45 H new ATOM 0 HD3 PRO A 85 -8.160 6.131 31.475 1.00 3.45 H new ATOM 731 N THR A 86 -5.898 7.805 35.961 1.00 14.21 N ATOM 732 CA THR A 86 -5.613 7.943 37.366 1.00 24.11 C ATOM 733 C THR A 86 -5.966 9.367 37.839 1.00 74.25 C ATOM 734 O THR A 86 -5.832 9.712 39.022 1.00 20.31 O ATOM 735 CB THR A 86 -4.109 7.616 37.626 1.00 15.12 C ATOM 736 OG1 THR A 86 -3.806 7.603 39.026 1.00 14.12 O ATOM 737 CG2 THR A 86 -3.185 8.604 36.913 1.00 30.42 C ATOM 0 H THR A 86 -5.143 8.125 35.354 1.00 14.21 H new ATOM 0 HA THR A 86 -6.222 7.241 37.936 1.00 24.11 H new ATOM 0 HB THR A 86 -3.935 6.619 37.220 1.00 15.12 H new ATOM 0 HG1 THR A 86 -4.419 8.204 39.499 1.00 14.12 H new ATOM 0 HG21 THR A 86 -2.147 8.344 37.118 1.00 30.42 H new ATOM 0 HG22 THR A 86 -3.365 8.560 35.839 1.00 30.42 H new ATOM 0 HG23 THR A 86 -3.384 9.613 37.273 1.00 30.42 H new ATOM 745 N GLY A 87 -6.415 10.173 36.904 1.00 73.11 N ATOM 746 CA GLY A 87 -6.800 11.527 37.213 1.00 71.50 C ATOM 747 C GLY A 87 -8.297 11.652 37.397 1.00 3.14 C ATOM 748 O GLY A 87 -8.941 10.745 37.935 1.00 54.33 O ATOM 0 H GLY A 87 -6.522 9.912 35.924 1.00 73.11 H new ATOM 0 HA2 GLY A 87 -6.293 11.852 38.121 1.00 71.50 H new ATOM 0 HA3 GLY A 87 -6.475 12.190 36.412 1.00 71.50 H new ATOM 752 N ASN A 88 -8.856 12.730 36.916 1.00 1.50 N ATOM 753 CA ASN A 88 -10.280 12.989 37.040 1.00 33.42 C ATOM 754 C ASN A 88 -10.897 13.285 35.668 1.00 13.32 C ATOM 755 O ASN A 88 -10.979 14.421 35.238 1.00 71.22 O ATOM 756 CB ASN A 88 -10.586 14.104 38.094 1.00 60.34 C ATOM 757 CG ASN A 88 -9.896 15.458 37.845 1.00 33.35 C ATOM 758 OD1 ASN A 88 -10.447 16.365 37.207 1.00 73.00 O ATOM 759 ND2 ASN A 88 -8.706 15.611 38.355 1.00 74.20 N ATOM 0 H ASN A 88 -8.342 13.461 36.424 1.00 1.50 H new ATOM 0 HA ASN A 88 -10.755 12.085 37.421 1.00 33.42 H new ATOM 0 HB2 ASN A 88 -11.664 14.265 38.124 1.00 60.34 H new ATOM 0 HB3 ASN A 88 -10.290 13.741 39.078 1.00 60.34 H new ATOM 0 HD21 ASN A 88 -8.208 16.493 38.232 1.00 74.20 H new ATOM 0 HD22 ASN A 88 -8.273 14.849 38.877 1.00 74.20 H new ATOM 766 N PRO A 89 -11.293 12.239 34.938 1.00 12.01 N ATOM 767 CA PRO A 89 -11.830 12.380 33.599 1.00 21.30 C ATOM 768 C PRO A 89 -13.371 12.526 33.580 1.00 21.03 C ATOM 769 O PRO A 89 -14.067 12.177 34.554 1.00 73.03 O ATOM 770 CB PRO A 89 -11.384 11.065 32.945 1.00 22.34 C ATOM 771 CG PRO A 89 -11.407 10.058 34.052 1.00 14.31 C ATOM 772 CD PRO A 89 -11.243 10.821 35.351 1.00 32.51 C ATOM 0 HA PRO A 89 -11.480 13.279 33.091 1.00 21.30 H new ATOM 0 HB2 PRO A 89 -12.056 10.778 32.136 1.00 22.34 H new ATOM 0 HB3 PRO A 89 -10.387 11.156 32.514 1.00 22.34 H new ATOM 0 HG2 PRO A 89 -12.344 9.502 34.048 1.00 14.31 H new ATOM 0 HG3 PRO A 89 -10.604 9.331 33.928 1.00 14.31 H new ATOM 0 HD2 PRO A 89 -12.038 10.582 36.058 1.00 32.51 H new ATOM 0 HD3 PRO A 89 -10.299 10.580 35.840 1.00 32.51 H new ATOM 780 N GLN A 90 -13.897 13.021 32.478 1.00 74.45 N ATOM 781 CA GLN A 90 -15.334 13.210 32.309 1.00 44.21 C ATOM 782 C GLN A 90 -15.874 12.063 31.492 1.00 44.44 C ATOM 783 O GLN A 90 -15.254 11.723 30.493 1.00 2.12 O ATOM 784 CB GLN A 90 -15.643 14.521 31.601 1.00 44.03 C ATOM 785 CG GLN A 90 -15.356 15.767 32.406 1.00 33.12 C ATOM 786 CD GLN A 90 -15.748 17.020 31.655 1.00 41.53 C ATOM 787 OE1 GLN A 90 -16.666 17.004 30.837 1.00 43.13 O ATOM 788 NE2 GLN A 90 -15.087 18.106 31.930 1.00 11.33 N ATOM 0 H GLN A 90 -13.344 13.306 31.670 1.00 74.45 H new ATOM 0 HA GLN A 90 -15.802 13.241 33.293 1.00 44.21 H new ATOM 0 HB2 GLN A 90 -15.065 14.562 30.678 1.00 44.03 H new ATOM 0 HB3 GLN A 90 -16.696 14.524 31.318 1.00 44.03 H new ATOM 0 HG2 GLN A 90 -15.899 15.724 33.350 1.00 33.12 H new ATOM 0 HG3 GLN A 90 -14.294 15.806 32.650 1.00 33.12 H new ATOM 0 HE21 GLN A 90 -14.331 18.083 32.614 1.00 11.33 H new ATOM 0 HE22 GLN A 90 -15.325 18.980 31.461 1.00 11.33 H new ATOM 797 N PRO A 91 -17.030 11.460 31.905 1.00 74.14 N ATOM 798 CA PRO A 91 -17.630 10.245 31.292 1.00 12.14 C ATOM 799 C PRO A 91 -17.472 10.141 29.768 1.00 5.21 C ATOM 800 O PRO A 91 -18.170 10.818 28.992 1.00 64.41 O ATOM 801 CB PRO A 91 -19.118 10.322 31.688 1.00 61.24 C ATOM 802 CG PRO A 91 -19.257 11.567 32.520 1.00 63.00 C ATOM 803 CD PRO A 91 -17.878 11.929 32.999 1.00 11.21 C ATOM 0 HA PRO A 91 -17.118 9.353 31.653 1.00 12.14 H new ATOM 0 HB2 PRO A 91 -19.756 10.369 30.805 1.00 61.24 H new ATOM 0 HB3 PRO A 91 -19.419 9.439 32.252 1.00 61.24 H new ATOM 0 HG2 PRO A 91 -19.687 12.378 31.932 1.00 63.00 H new ATOM 0 HG3 PRO A 91 -19.926 11.395 33.363 1.00 63.00 H new ATOM 0 HD2 PRO A 91 -17.774 13.002 33.162 1.00 11.21 H new ATOM 0 HD3 PRO A 91 -17.634 11.438 33.941 1.00 11.21 H new ATOM 811 N LYS A 92 -16.513 9.345 29.368 1.00 14.25 N ATOM 812 CA LYS A 92 -16.185 9.110 27.993 1.00 2.42 C ATOM 813 C LYS A 92 -15.614 7.696 27.932 1.00 74.13 C ATOM 814 O LYS A 92 -15.065 7.210 28.937 1.00 41.24 O ATOM 815 CB LYS A 92 -15.168 10.195 27.526 1.00 50.41 C ATOM 816 CG LYS A 92 -14.902 10.312 26.018 1.00 3.04 C ATOM 817 CD LYS A 92 -14.023 9.207 25.465 1.00 23.44 C ATOM 818 CE LYS A 92 -13.814 9.361 23.973 1.00 51.43 C ATOM 819 NZ LYS A 92 -15.072 9.228 23.217 1.00 30.14 N ATOM 0 H LYS A 92 -15.921 8.827 30.017 1.00 14.25 H new ATOM 0 HA LYS A 92 -17.044 9.182 27.326 1.00 2.42 H new ATOM 0 HB2 LYS A 92 -15.521 11.163 27.882 1.00 50.41 H new ATOM 0 HB3 LYS A 92 -14.217 10.001 28.022 1.00 50.41 H new ATOM 0 HG2 LYS A 92 -15.855 10.305 25.489 1.00 3.04 H new ATOM 0 HG3 LYS A 92 -14.432 11.274 25.815 1.00 3.04 H new ATOM 0 HD2 LYS A 92 -13.058 9.219 25.972 1.00 23.44 H new ATOM 0 HD3 LYS A 92 -14.479 8.239 25.672 1.00 23.44 H new ATOM 0 HE2 LYS A 92 -13.371 10.336 23.769 1.00 51.43 H new ATOM 0 HE3 LYS A 92 -13.104 8.610 23.628 1.00 51.43 H new ATOM 0 HZ1 LYS A 92 -14.867 8.870 22.262 1.00 30.14 H new ATOM 0 HZ2 LYS A 92 -15.703 8.563 23.708 1.00 30.14 H new ATOM 0 HZ3 LYS A 92 -15.535 10.157 23.147 1.00 30.14 H new ATOM 833 N ASN A 93 -15.840 7.000 26.836 1.00 70.31 N ATOM 834 CA ASN A 93 -15.315 5.656 26.667 1.00 25.12 C ATOM 835 C ASN A 93 -13.804 5.660 26.487 1.00 51.11 C ATOM 836 O ASN A 93 -13.277 6.012 25.414 1.00 33.34 O ATOM 837 CB ASN A 93 -15.982 4.903 25.507 1.00 1.33 C ATOM 838 CG ASN A 93 -17.441 4.542 25.754 1.00 22.12 C ATOM 839 OD1 ASN A 93 -18.183 5.249 26.451 1.00 62.32 O ATOM 840 ND2 ASN A 93 -17.866 3.433 25.198 1.00 24.05 N ATOM 0 H ASN A 93 -16.386 7.343 26.045 1.00 70.31 H new ATOM 0 HA ASN A 93 -15.555 5.124 27.588 1.00 25.12 H new ATOM 0 HB2 ASN A 93 -15.918 5.515 24.607 1.00 1.33 H new ATOM 0 HB3 ASN A 93 -15.421 3.989 25.312 1.00 1.33 H new ATOM 0 HD21 ASN A 93 -18.831 3.132 25.334 1.00 24.05 H new ATOM 0 HD22 ASN A 93 -17.232 2.872 24.629 1.00 24.05 H new ATOM 847 N TRP A 94 -13.125 5.337 27.554 1.00 63.15 N ATOM 848 CA TRP A 94 -11.700 5.194 27.592 1.00 11.41 C ATOM 849 C TRP A 94 -11.250 3.988 26.763 1.00 3.32 C ATOM 850 O TRP A 94 -11.972 2.978 26.656 1.00 52.25 O ATOM 851 CB TRP A 94 -11.238 5.056 29.041 1.00 2.23 C ATOM 852 CG TRP A 94 -9.772 4.886 29.174 1.00 44.41 C ATOM 853 CD1 TRP A 94 -8.835 5.863 29.146 1.00 53.11 C ATOM 854 CD2 TRP A 94 -9.074 3.657 29.330 1.00 11.41 C ATOM 855 NE1 TRP A 94 -7.590 5.311 29.275 1.00 1.10 N ATOM 856 CE2 TRP A 94 -7.714 3.960 29.386 1.00 54.23 C ATOM 857 CE3 TRP A 94 -9.477 2.324 29.424 1.00 2.40 C ATOM 858 CZ2 TRP A 94 -6.751 2.991 29.531 1.00 12.24 C ATOM 859 CZ3 TRP A 94 -8.515 1.361 29.570 1.00 32.35 C ATOM 860 CH2 TRP A 94 -7.167 1.699 29.623 1.00 22.40 C ATOM 0 H TRP A 94 -13.570 5.160 28.455 1.00 63.15 H new ATOM 0 HA TRP A 94 -11.245 6.084 27.157 1.00 11.41 H new ATOM 0 HB2 TRP A 94 -11.547 5.940 29.599 1.00 2.23 H new ATOM 0 HB3 TRP A 94 -11.739 4.201 29.495 1.00 2.23 H new ATOM 0 HD1 TRP A 94 -9.039 6.918 29.038 1.00 53.11 H new ATOM 0 HE1 TRP A 94 -6.711 5.828 29.286 1.00 1.10 H new ATOM 0 HE3 TRP A 94 -10.523 2.059 29.383 1.00 2.40 H new ATOM 0 HZ2 TRP A 94 -5.702 3.246 29.571 1.00 12.24 H new ATOM 0 HZ3 TRP A 94 -8.807 0.324 29.645 1.00 32.35 H new ATOM 0 HH2 TRP A 94 -6.432 0.916 29.740 1.00 22.40 H new ATOM 871 N ASN A 95 -10.114 4.121 26.140 1.00 21.30 N ATOM 872 CA ASN A 95 -9.519 3.072 25.360 1.00 33.45 C ATOM 873 C ASN A 95 -8.065 2.923 25.764 1.00 30.11 C ATOM 874 O ASN A 95 -7.361 3.916 25.928 1.00 53.23 O ATOM 875 CB ASN A 95 -9.580 3.414 23.875 1.00 10.53 C ATOM 876 CG ASN A 95 -8.909 2.378 22.973 1.00 10.31 C ATOM 877 OD1 ASN A 95 -8.356 2.729 21.955 1.00 12.44 O ATOM 878 ND2 ASN A 95 -9.000 1.109 23.288 1.00 71.13 N ATOM 0 H ASN A 95 -9.564 4.979 26.160 1.00 21.30 H new ATOM 0 HA ASN A 95 -10.065 2.145 25.538 1.00 33.45 H new ATOM 0 HB2 ASN A 95 -10.624 3.518 23.579 1.00 10.53 H new ATOM 0 HB3 ASN A 95 -9.105 4.382 23.715 1.00 10.53 H new ATOM 0 HD21 ASN A 95 -8.602 0.401 22.672 1.00 71.13 H new ATOM 0 HD22 ASN A 95 -9.469 0.830 24.150 1.00 71.13 H new ATOM 885 N LYS A 96 -7.636 1.704 25.954 1.00 53.34 N ATOM 886 CA LYS A 96 -6.246 1.412 26.219 1.00 51.04 C ATOM 887 C LYS A 96 -5.522 1.375 24.878 1.00 50.02 C ATOM 888 O LYS A 96 -6.050 1.860 23.883 1.00 75.24 O ATOM 889 CB LYS A 96 -6.133 0.050 26.922 1.00 32.51 C ATOM 890 CG LYS A 96 -6.481 -1.125 26.038 1.00 2.52 C ATOM 891 CD LYS A 96 -6.755 -2.367 26.848 1.00 11.53 C ATOM 892 CE LYS A 96 -7.162 -3.503 25.943 1.00 31.54 C ATOM 893 NZ LYS A 96 -7.596 -4.687 26.696 1.00 14.40 N ATOM 0 H LYS A 96 -8.239 0.881 25.930 1.00 53.34 H new ATOM 0 HA LYS A 96 -5.804 2.169 26.866 1.00 51.04 H new ATOM 0 HB2 LYS A 96 -5.115 -0.074 27.291 1.00 32.51 H new ATOM 0 HB3 LYS A 96 -6.790 0.045 27.792 1.00 32.51 H new ATOM 0 HG2 LYS A 96 -7.357 -0.882 25.436 1.00 2.52 H new ATOM 0 HG3 LYS A 96 -5.661 -1.315 25.345 1.00 2.52 H new ATOM 0 HD2 LYS A 96 -5.865 -2.644 27.413 1.00 11.53 H new ATOM 0 HD3 LYS A 96 -7.545 -2.170 27.573 1.00 11.53 H new ATOM 0 HE2 LYS A 96 -7.971 -3.173 25.291 1.00 31.54 H new ATOM 0 HE3 LYS A 96 -6.323 -3.771 25.300 1.00 31.54 H new ATOM 0 HZ1 LYS A 96 -7.866 -5.441 26.032 1.00 14.40 H new ATOM 0 HZ2 LYS A 96 -6.817 -5.019 27.299 1.00 14.40 H new ATOM 0 HZ3 LYS A 96 -8.413 -4.440 27.290 1.00 14.40 H new ATOM 907 N ASP A 97 -4.306 0.844 24.860 1.00 54.22 N ATOM 908 CA ASP A 97 -3.529 0.664 23.613 1.00 33.21 C ATOM 909 C ASP A 97 -3.176 2.045 23.035 1.00 23.44 C ATOM 910 O ASP A 97 -2.835 2.203 21.873 1.00 61.23 O ATOM 911 CB ASP A 97 -4.317 -0.241 22.605 1.00 3.35 C ATOM 912 CG ASP A 97 -3.491 -0.795 21.442 1.00 12.44 C ATOM 913 OD1 ASP A 97 -2.602 -1.664 21.682 1.00 50.15 O ATOM 914 OD2 ASP A 97 -3.757 -0.434 20.270 1.00 12.51 O ATOM 0 H ASP A 97 -3.821 0.523 25.698 1.00 54.22 H new ATOM 0 HA ASP A 97 -2.593 0.146 23.820 1.00 33.21 H new ATOM 0 HB2 ASP A 97 -4.749 -1.078 23.154 1.00 3.35 H new ATOM 0 HB3 ASP A 97 -5.148 0.335 22.197 1.00 3.35 H new ATOM 919 N GLY A 98 -3.259 3.045 23.909 1.00 74.44 N ATOM 920 CA GLY A 98 -2.845 4.379 23.580 1.00 22.34 C ATOM 921 C GLY A 98 -3.912 5.176 22.891 1.00 53.14 C ATOM 922 O GLY A 98 -3.611 6.216 22.312 1.00 70.25 O ATOM 0 H GLY A 98 -3.616 2.940 24.859 1.00 74.44 H new ATOM 0 HA2 GLY A 98 -2.547 4.895 24.493 1.00 22.34 H new ATOM 0 HA3 GLY A 98 -1.965 4.332 22.939 1.00 22.34 H new ATOM 926 N TYR A 99 -5.165 4.704 22.996 1.00 61.15 N ATOM 927 CA TYR A 99 -6.294 5.307 22.307 1.00 40.01 C ATOM 928 C TYR A 99 -6.128 5.182 20.786 1.00 4.35 C ATOM 929 O TYR A 99 -5.520 6.018 20.120 1.00 44.13 O ATOM 930 CB TYR A 99 -6.565 6.766 22.750 1.00 61.23 C ATOM 931 CG TYR A 99 -7.744 6.981 23.640 1.00 62.33 C ATOM 932 CD1 TYR A 99 -7.622 6.932 25.010 1.00 65.41 C ATOM 933 CD2 TYR A 99 -8.973 7.309 23.102 1.00 22.21 C ATOM 934 CE1 TYR A 99 -8.689 7.209 25.818 1.00 70.00 C ATOM 935 CE2 TYR A 99 -10.045 7.574 23.903 1.00 73.04 C ATOM 936 CZ TYR A 99 -9.896 7.528 25.258 1.00 33.01 C ATOM 937 OH TYR A 99 -10.944 7.832 26.050 1.00 75.40 O ATOM 0 H TYR A 99 -5.413 3.893 23.563 1.00 61.15 H new ATOM 0 HA TYR A 99 -7.184 4.748 22.596 1.00 40.01 H new ATOM 0 HB2 TYR A 99 -5.678 7.138 23.262 1.00 61.23 H new ATOM 0 HB3 TYR A 99 -6.696 7.376 21.856 1.00 61.23 H new ATOM 0 HD1 TYR A 99 -6.672 6.672 25.452 1.00 65.41 H new ATOM 0 HD2 TYR A 99 -9.087 7.356 22.029 1.00 22.21 H new ATOM 0 HE1 TYR A 99 -8.580 7.176 26.892 1.00 70.00 H new ATOM 0 HE2 TYR A 99 -11.003 7.818 23.468 1.00 73.04 H new ATOM 0 HH TYR A 99 -11.716 7.284 25.796 1.00 75.40 H new ATOM 947 N LEU A 100 -6.635 4.106 20.266 1.00 50.05 N ATOM 948 CA LEU A 100 -6.578 3.795 18.862 1.00 70.13 C ATOM 949 C LEU A 100 -7.935 3.225 18.450 1.00 60.41 C ATOM 950 O LEU A 100 -8.784 2.943 19.300 1.00 1.40 O ATOM 951 CB LEU A 100 -5.423 2.785 18.594 1.00 21.14 C ATOM 952 CG LEU A 100 -5.243 2.269 17.147 1.00 30.44 C ATOM 953 CD1 LEU A 100 -4.932 3.397 16.179 1.00 13.33 C ATOM 954 CD2 LEU A 100 -4.166 1.199 17.082 1.00 11.41 C ATOM 0 H LEU A 100 -7.115 3.396 20.820 1.00 50.05 H new ATOM 0 HA LEU A 100 -6.372 4.687 18.271 1.00 70.13 H new ATOM 0 HB2 LEU A 100 -4.489 3.254 18.902 1.00 21.14 H new ATOM 0 HB3 LEU A 100 -5.575 1.922 19.242 1.00 21.14 H new ATOM 0 HG LEU A 100 -6.192 1.826 16.843 1.00 30.44 H new ATOM 0 HD11 LEU A 100 -4.813 2.992 15.174 1.00 13.33 H new ATOM 0 HD12 LEU A 100 -5.750 4.118 16.185 1.00 13.33 H new ATOM 0 HD13 LEU A 100 -4.010 3.892 16.482 1.00 13.33 H new ATOM 0 HD21 LEU A 100 -4.059 0.853 16.054 1.00 11.41 H new ATOM 0 HD22 LEU A 100 -3.219 1.615 17.425 1.00 11.41 H new ATOM 0 HD23 LEU A 100 -4.447 0.361 17.720 1.00 11.41 H new ATOM 966 N LYS A 101 -8.160 3.080 17.180 1.00 53.03 N ATOM 967 CA LYS A 101 -9.395 2.514 16.696 1.00 25.34 C ATOM 968 C LYS A 101 -9.236 0.995 16.664 1.00 0.22 C ATOM 969 O LYS A 101 -8.236 0.468 17.173 1.00 22.21 O ATOM 970 CB LYS A 101 -9.712 3.069 15.296 1.00 41.42 C ATOM 971 CG LYS A 101 -9.776 4.597 15.232 1.00 51.40 C ATOM 972 CD LYS A 101 -10.817 5.158 16.193 1.00 52.15 C ATOM 973 CE LYS A 101 -10.872 6.688 16.157 1.00 5.01 C ATOM 974 NZ LYS A 101 -11.320 7.216 14.845 1.00 50.34 N ATOM 0 H LYS A 101 -7.501 3.347 16.449 1.00 53.03 H new ATOM 0 HA LYS A 101 -10.225 2.779 17.351 1.00 25.34 H new ATOM 0 HB2 LYS A 101 -8.953 2.718 14.597 1.00 41.42 H new ATOM 0 HB3 LYS A 101 -10.666 2.661 14.962 1.00 41.42 H new ATOM 0 HG2 LYS A 101 -8.797 5.013 15.472 1.00 51.40 H new ATOM 0 HG3 LYS A 101 -10.014 4.909 14.215 1.00 51.40 H new ATOM 0 HD2 LYS A 101 -11.797 4.755 15.940 1.00 52.15 H new ATOM 0 HD3 LYS A 101 -10.589 4.828 17.206 1.00 52.15 H new ATOM 0 HE2 LYS A 101 -11.548 7.041 16.936 1.00 5.01 H new ATOM 0 HE3 LYS A 101 -9.884 7.088 16.387 1.00 5.01 H new ATOM 0 HZ1 LYS A 101 -11.436 8.248 14.907 1.00 50.34 H new ATOM 0 HZ2 LYS A 101 -10.610 6.991 14.119 1.00 50.34 H new ATOM 0 HZ3 LYS A 101 -12.228 6.780 14.587 1.00 50.34 H new ATOM 988 N LYS A 102 -10.191 0.289 16.100 1.00 61.34 N ATOM 989 CA LYS A 102 -10.076 -1.174 15.990 1.00 34.35 C ATOM 990 C LYS A 102 -9.082 -1.565 14.874 1.00 52.25 C ATOM 991 O LYS A 102 -9.446 -2.022 13.790 1.00 41.33 O ATOM 992 CB LYS A 102 -11.455 -1.914 15.880 1.00 3.44 C ATOM 993 CG LYS A 102 -12.275 -1.705 14.620 1.00 22.41 C ATOM 994 CD LYS A 102 -12.714 -0.284 14.441 1.00 74.40 C ATOM 995 CE LYS A 102 -13.686 -0.184 13.322 1.00 43.21 C ATOM 996 NZ LYS A 102 -14.049 1.217 13.020 1.00 3.11 N ATOM 0 H LYS A 102 -11.048 0.683 15.712 1.00 61.34 H new ATOM 0 HA LYS A 102 -9.663 -1.528 16.935 1.00 34.35 H new ATOM 0 HB2 LYS A 102 -11.270 -2.983 15.985 1.00 3.44 H new ATOM 0 HB3 LYS A 102 -12.066 -1.611 16.730 1.00 3.44 H new ATOM 0 HG2 LYS A 102 -11.687 -2.010 13.755 1.00 22.41 H new ATOM 0 HG3 LYS A 102 -13.153 -2.350 14.652 1.00 22.41 H new ATOM 0 HD2 LYS A 102 -13.169 0.082 15.361 1.00 74.40 H new ATOM 0 HD3 LYS A 102 -11.850 0.349 14.239 1.00 74.40 H new ATOM 0 HE2 LYS A 102 -13.261 -0.647 12.432 1.00 43.21 H new ATOM 0 HE3 LYS A 102 -14.586 -0.744 13.574 1.00 43.21 H new ATOM 0 HZ1 LYS A 102 -14.729 1.238 12.233 1.00 3.11 H new ATOM 0 HZ2 LYS A 102 -14.479 1.653 13.861 1.00 3.11 H new ATOM 0 HZ3 LYS A 102 -13.195 1.747 12.753 1.00 3.11 H new ATOM 1010 N LEU A 103 -7.842 -1.299 15.149 1.00 4.10 N ATOM 1011 CA LEU A 103 -6.754 -1.484 14.234 1.00 21.53 C ATOM 1012 C LEU A 103 -5.655 -2.257 14.948 1.00 21.11 C ATOM 1013 O LEU A 103 -5.537 -2.145 16.178 1.00 23.05 O ATOM 1014 CB LEU A 103 -6.246 -0.102 13.780 1.00 11.03 C ATOM 1015 CG LEU A 103 -7.264 0.763 13.012 1.00 42.51 C ATOM 1016 CD1 LEU A 103 -6.749 2.176 12.824 1.00 64.03 C ATOM 1017 CD2 LEU A 103 -7.575 0.140 11.659 1.00 13.51 C ATOM 0 H LEU A 103 -7.547 -0.932 16.054 1.00 4.10 H new ATOM 0 HA LEU A 103 -7.071 -2.044 13.355 1.00 21.53 H new ATOM 0 HB2 LEU A 103 -5.917 0.451 14.660 1.00 11.03 H new ATOM 0 HB3 LEU A 103 -5.370 -0.247 13.148 1.00 11.03 H new ATOM 0 HG LEU A 103 -8.179 0.807 13.603 1.00 42.51 H new ATOM 0 HD11 LEU A 103 -7.488 2.763 12.279 1.00 64.03 H new ATOM 0 HD12 LEU A 103 -6.571 2.631 13.798 1.00 64.03 H new ATOM 0 HD13 LEU A 103 -5.817 2.151 12.259 1.00 64.03 H new ATOM 0 HD21 LEU A 103 -8.296 0.763 11.129 1.00 13.51 H new ATOM 0 HD22 LEU A 103 -6.659 0.066 11.073 1.00 13.51 H new ATOM 0 HD23 LEU A 103 -7.994 -0.856 11.805 1.00 13.51 H new ATOM 1029 N PRO A 104 -4.882 -3.096 14.227 1.00 65.24 N ATOM 1030 CA PRO A 104 -3.783 -3.876 14.819 1.00 75.14 C ATOM 1031 C PRO A 104 -2.569 -2.991 15.168 1.00 2.14 C ATOM 1032 O PRO A 104 -2.653 -1.759 15.144 1.00 71.21 O ATOM 1033 CB PRO A 104 -3.397 -4.872 13.700 1.00 32.54 C ATOM 1034 CG PRO A 104 -4.451 -4.735 12.650 1.00 73.35 C ATOM 1035 CD PRO A 104 -4.999 -3.351 12.785 1.00 71.22 C ATOM 0 HA PRO A 104 -4.084 -4.353 15.752 1.00 75.14 H new ATOM 0 HB2 PRO A 104 -2.411 -4.643 13.296 1.00 32.54 H new ATOM 0 HB3 PRO A 104 -3.356 -5.892 14.082 1.00 32.54 H new ATOM 0 HG2 PRO A 104 -4.033 -4.892 11.656 1.00 73.35 H new ATOM 0 HG3 PRO A 104 -5.236 -5.479 12.787 1.00 73.35 H new ATOM 0 HD2 PRO A 104 -4.428 -2.631 12.199 1.00 71.22 H new ATOM 0 HD3 PRO A 104 -6.033 -3.290 12.446 1.00 71.22 H new ATOM 1043 N VAL A 105 -1.453 -3.618 15.493 1.00 24.20 N ATOM 1044 CA VAL A 105 -0.233 -2.887 15.792 1.00 63.42 C ATOM 1045 C VAL A 105 0.530 -2.670 14.459 1.00 61.33 C ATOM 1046 O VAL A 105 0.103 -3.229 13.423 1.00 43.44 O ATOM 1047 CB VAL A 105 0.617 -3.650 16.854 1.00 42.33 C ATOM 1048 CG1 VAL A 105 1.373 -4.846 16.279 1.00 62.03 C ATOM 1049 CG2 VAL A 105 1.517 -2.720 17.641 1.00 73.33 C ATOM 0 H VAL A 105 -1.365 -4.632 15.557 1.00 24.20 H new ATOM 0 HA VAL A 105 -0.458 -1.915 16.230 1.00 63.42 H new ATOM 0 HB VAL A 105 -0.098 -4.071 17.561 1.00 42.33 H new ATOM 0 HG11 VAL A 105 1.943 -5.331 17.071 1.00 62.03 H new ATOM 0 HG12 VAL A 105 0.663 -5.556 15.856 1.00 62.03 H new ATOM 0 HG13 VAL A 105 2.053 -4.505 15.498 1.00 62.03 H new ATOM 0 HG21 VAL A 105 2.089 -3.296 18.368 1.00 73.33 H new ATOM 0 HG22 VAL A 105 2.201 -2.213 16.960 1.00 73.33 H new ATOM 0 HG23 VAL A 105 0.909 -1.980 18.162 1.00 73.33 H new ATOM 1059 N ASP A 106 1.636 -1.925 14.455 1.00 32.42 N ATOM 1060 CA ASP A 106 2.276 -1.551 13.172 1.00 51.14 C ATOM 1061 C ASP A 106 3.098 -2.731 12.619 1.00 1.41 C ATOM 1062 O ASP A 106 3.459 -3.650 13.396 1.00 62.30 O ATOM 1063 CB ASP A 106 3.154 -0.274 13.335 1.00 15.42 C ATOM 1064 CG ASP A 106 3.360 0.455 12.029 1.00 35.12 C ATOM 1065 OD1 ASP A 106 2.358 0.928 11.447 1.00 60.44 O ATOM 1066 OD2 ASP A 106 4.489 0.542 11.578 1.00 4.54 O ATOM 0 H ASP A 106 2.103 -1.573 15.291 1.00 32.42 H new ATOM 0 HA ASP A 106 1.492 -1.317 12.451 1.00 51.14 H new ATOM 0 HB2 ASP A 106 2.683 0.398 14.052 1.00 15.42 H new ATOM 0 HB3 ASP A 106 4.123 -0.553 13.749 1.00 15.42 H new ATOM 1071 N PRO A 107 3.288 -2.828 11.266 1.00 14.14 N ATOM 1072 CA PRO A 107 4.149 -3.831 10.640 1.00 61.43 C ATOM 1073 C PRO A 107 5.540 -3.926 11.250 1.00 43.23 C ATOM 1074 O PRO A 107 5.930 -3.140 12.082 1.00 44.32 O ATOM 1075 CB PRO A 107 4.261 -3.367 9.205 1.00 22.11 C ATOM 1076 CG PRO A 107 2.979 -2.675 8.951 1.00 22.14 C ATOM 1077 CD PRO A 107 2.630 -1.994 10.233 1.00 24.04 C ATOM 0 HA PRO A 107 3.722 -4.826 10.768 1.00 61.43 H new ATOM 0 HB2 PRO A 107 5.110 -2.697 9.067 1.00 22.11 H new ATOM 0 HB3 PRO A 107 4.403 -4.206 8.524 1.00 22.11 H new ATOM 0 HG2 PRO A 107 3.076 -1.955 8.138 1.00 22.14 H new ATOM 0 HG3 PRO A 107 2.203 -3.382 8.659 1.00 22.14 H new ATOM 0 HD2 PRO A 107 2.997 -0.968 10.254 1.00 24.04 H new ATOM 0 HD3 PRO A 107 1.551 -1.950 10.382 1.00 24.04 H new ATOM 1085 N TRP A 108 6.264 -4.934 10.803 1.00 23.52 N ATOM 1086 CA TRP A 108 7.612 -5.323 11.259 1.00 0.31 C ATOM 1087 C TRP A 108 7.518 -5.868 12.688 1.00 15.44 C ATOM 1088 O TRP A 108 8.531 -6.082 13.369 1.00 31.24 O ATOM 1089 CB TRP A 108 8.630 -4.151 11.255 1.00 41.34 C ATOM 1090 CG TRP A 108 8.569 -3.254 10.069 1.00 34.44 C ATOM 1091 CD1 TRP A 108 8.895 -3.548 8.797 1.00 14.34 C ATOM 1092 CD2 TRP A 108 8.147 -1.898 10.086 1.00 22.11 C ATOM 1093 NE1 TRP A 108 8.705 -2.441 7.998 1.00 21.32 N ATOM 1094 CE2 TRP A 108 8.231 -1.407 8.784 1.00 65.51 C ATOM 1095 CE3 TRP A 108 7.698 -1.062 11.100 1.00 3.02 C ATOM 1096 CZ2 TRP A 108 7.873 -0.089 8.469 1.00 74.34 C ATOM 1097 CZ3 TRP A 108 7.345 0.217 10.799 1.00 54.41 C ATOM 1098 CH2 TRP A 108 7.428 0.702 9.508 1.00 31.12 C ATOM 0 H TRP A 108 5.918 -5.549 10.067 1.00 23.52 H new ATOM 0 HA TRP A 108 7.974 -6.074 10.556 1.00 0.31 H new ATOM 0 HB2 TRP A 108 8.471 -3.551 12.151 1.00 41.34 H new ATOM 0 HB3 TRP A 108 9.636 -4.566 11.324 1.00 41.34 H new ATOM 0 HD1 TRP A 108 9.252 -4.508 8.454 1.00 14.34 H new ATOM 0 HE1 TRP A 108 8.884 -2.393 6.995 1.00 21.32 H new ATOM 0 HE3 TRP A 108 7.630 -1.423 12.116 1.00 3.02 H new ATOM 0 HZ2 TRP A 108 7.942 0.290 7.460 1.00 74.34 H new ATOM 0 HZ3 TRP A 108 6.992 0.867 11.586 1.00 54.41 H new ATOM 0 HH2 TRP A 108 7.138 1.723 9.308 1.00 31.12 H new ATOM 1109 N GLY A 109 6.295 -6.159 13.091 1.00 60.50 N ATOM 1110 CA GLY A 109 5.984 -6.634 14.434 1.00 41.03 C ATOM 1111 C GLY A 109 6.390 -5.645 15.512 1.00 31.41 C ATOM 1112 O GLY A 109 6.811 -6.039 16.601 1.00 1.12 O ATOM 0 H GLY A 109 5.476 -6.072 12.489 1.00 60.50 H new ATOM 0 HA2 GLY A 109 4.914 -6.828 14.508 1.00 41.03 H new ATOM 0 HA3 GLY A 109 6.492 -7.583 14.607 1.00 41.03 H new ATOM 1116 N ASN A 110 6.300 -4.381 15.199 1.00 4.12 N ATOM 1117 CA ASN A 110 6.669 -3.342 16.118 1.00 13.44 C ATOM 1118 C ASN A 110 5.491 -2.845 16.905 1.00 65.40 C ATOM 1119 O ASN A 110 4.397 -2.598 16.336 1.00 2.11 O ATOM 1120 CB ASN A 110 7.393 -2.183 15.433 1.00 33.44 C ATOM 1121 CG ASN A 110 8.774 -2.569 14.956 1.00 44.24 C ATOM 1122 OD1 ASN A 110 9.435 -3.439 15.533 1.00 24.44 O ATOM 1123 ND2 ASN A 110 9.237 -1.924 13.937 1.00 71.45 N ATOM 0 H ASN A 110 5.967 -4.043 14.296 1.00 4.12 H new ATOM 0 HA ASN A 110 7.373 -3.795 16.817 1.00 13.44 H new ATOM 0 HB2 ASN A 110 6.801 -1.839 14.585 1.00 33.44 H new ATOM 0 HB3 ASN A 110 7.472 -1.346 16.127 1.00 33.44 H new ATOM 0 HD21 ASN A 110 10.173 -2.128 13.587 1.00 71.45 H new ATOM 0 HD22 ASN A 110 8.666 -1.211 13.482 1.00 71.45 H new ATOM 1130 N PRO A 111 5.658 -2.740 18.229 1.00 73.03 N ATOM 1131 CA PRO A 111 4.649 -2.177 19.089 1.00 73.44 C ATOM 1132 C PRO A 111 4.669 -0.662 19.005 1.00 63.31 C ATOM 1133 O PRO A 111 5.700 -0.076 18.741 1.00 24.31 O ATOM 1134 CB PRO A 111 5.065 -2.641 20.486 1.00 20.35 C ATOM 1135 CG PRO A 111 6.545 -2.808 20.413 1.00 13.14 C ATOM 1136 CD PRO A 111 6.862 -3.170 18.987 1.00 4.42 C ATOM 0 HA PRO A 111 3.639 -2.489 18.822 1.00 73.44 H new ATOM 0 HB2 PRO A 111 4.787 -1.908 21.244 1.00 20.35 H new ATOM 0 HB3 PRO A 111 4.575 -3.577 20.753 1.00 20.35 H new ATOM 0 HG2 PRO A 111 7.054 -1.889 20.703 1.00 13.14 H new ATOM 0 HG3 PRO A 111 6.882 -3.588 21.096 1.00 13.14 H new ATOM 0 HD2 PRO A 111 7.758 -2.659 18.636 1.00 4.42 H new ATOM 0 HD3 PRO A 111 7.041 -4.240 18.877 1.00 4.42 H new ATOM 1144 N TYR A 112 3.545 -0.042 19.218 1.00 62.20 N ATOM 1145 CA TYR A 112 3.477 1.392 19.200 1.00 30.23 C ATOM 1146 C TYR A 112 4.001 1.956 20.493 1.00 14.53 C ATOM 1147 O TYR A 112 3.765 1.390 21.578 1.00 70.34 O ATOM 1148 CB TYR A 112 2.059 1.894 18.951 1.00 45.30 C ATOM 1149 CG TYR A 112 1.711 2.137 17.508 1.00 25.43 C ATOM 1150 CD1 TYR A 112 2.037 3.344 16.915 1.00 13.33 C ATOM 1151 CD2 TYR A 112 1.043 1.190 16.745 1.00 25.25 C ATOM 1152 CE1 TYR A 112 1.714 3.609 15.608 1.00 10.34 C ATOM 1153 CE2 TYR A 112 0.716 1.448 15.426 1.00 3.33 C ATOM 1154 CZ TYR A 112 1.056 2.666 14.865 1.00 51.40 C ATOM 1155 OH TYR A 112 0.729 2.942 13.567 1.00 55.43 O ATOM 0 H TYR A 112 2.658 -0.509 19.407 1.00 62.20 H new ATOM 0 HA TYR A 112 4.100 1.736 18.374 1.00 30.23 H new ATOM 0 HB2 TYR A 112 1.356 1.168 19.361 1.00 45.30 H new ATOM 0 HB3 TYR A 112 1.917 2.822 19.504 1.00 45.30 H new ATOM 0 HD1 TYR A 112 2.557 4.094 17.493 1.00 13.33 H new ATOM 0 HD2 TYR A 112 0.775 0.241 17.186 1.00 25.25 H new ATOM 0 HE1 TYR A 112 1.978 4.559 15.167 1.00 10.34 H new ATOM 0 HE2 TYR A 112 0.199 0.704 14.838 1.00 3.33 H new ATOM 0 HH TYR A 112 -0.203 2.688 13.403 1.00 55.43 H new ATOM 1165 N GLN A 113 4.690 3.055 20.399 1.00 51.22 N ATOM 1166 CA GLN A 113 5.225 3.691 21.562 1.00 11.23 C ATOM 1167 C GLN A 113 4.345 4.899 21.835 1.00 21.01 C ATOM 1168 O GLN A 113 4.295 5.854 21.017 1.00 43.31 O ATOM 1169 CB GLN A 113 6.687 4.206 21.359 1.00 35.10 C ATOM 1170 CG GLN A 113 7.500 3.673 20.160 1.00 32.33 C ATOM 1171 CD GLN A 113 7.712 2.171 20.069 1.00 75.41 C ATOM 1172 OE1 GLN A 113 7.845 1.646 18.979 1.00 0.11 O ATOM 1173 NE2 GLN A 113 7.754 1.479 21.173 1.00 1.22 N ATOM 0 H GLN A 113 4.895 3.531 19.520 1.00 51.22 H new ATOM 0 HA GLN A 113 5.244 2.967 22.376 1.00 11.23 H new ATOM 0 HB2 GLN A 113 6.646 5.292 21.274 1.00 35.10 H new ATOM 0 HB3 GLN A 113 7.247 3.978 22.266 1.00 35.10 H new ATOM 0 HG2 GLN A 113 7.004 3.999 19.246 1.00 32.33 H new ATOM 0 HG3 GLN A 113 8.480 4.151 20.179 1.00 32.33 H new ATOM 0 HE21 GLN A 113 7.639 1.946 22.072 1.00 1.22 H new ATOM 0 HE22 GLN A 113 7.902 0.470 21.137 1.00 1.22 H new ATOM 1182 N TYR A 114 3.637 4.868 22.941 1.00 24.24 N ATOM 1183 CA TYR A 114 2.775 5.963 23.282 1.00 60.15 C ATOM 1184 C TYR A 114 3.528 6.790 24.281 1.00 70.23 C ATOM 1185 O TYR A 114 3.900 6.285 25.347 1.00 21.22 O ATOM 1186 CB TYR A 114 1.456 5.475 23.968 1.00 55.40 C ATOM 1187 CG TYR A 114 0.955 4.083 23.582 1.00 64.11 C ATOM 1188 CD1 TYR A 114 0.881 3.673 22.262 1.00 23.11 C ATOM 1189 CD2 TYR A 114 0.565 3.170 24.572 1.00 42.41 C ATOM 1190 CE1 TYR A 114 0.452 2.405 21.938 1.00 70.41 C ATOM 1191 CE2 TYR A 114 0.127 1.901 24.245 1.00 25.50 C ATOM 1192 CZ TYR A 114 0.078 1.528 22.930 1.00 1.24 C ATOM 1193 OH TYR A 114 -0.336 0.258 22.601 1.00 45.44 O ATOM 0 H TYR A 114 3.644 4.100 23.612 1.00 24.24 H new ATOM 0 HA TYR A 114 2.504 6.509 22.378 1.00 60.15 H new ATOM 0 HB2 TYR A 114 1.606 5.495 25.047 1.00 55.40 H new ATOM 0 HB3 TYR A 114 0.669 6.194 23.742 1.00 55.40 H new ATOM 0 HD1 TYR A 114 1.164 4.357 21.475 1.00 23.11 H new ATOM 0 HD2 TYR A 114 0.608 3.464 25.610 1.00 42.41 H new ATOM 0 HE1 TYR A 114 0.409 2.098 20.903 1.00 70.41 H new ATOM 0 HE2 TYR A 114 -0.173 1.211 25.020 1.00 25.50 H new ATOM 0 HH TYR A 114 -0.334 -0.305 23.403 1.00 45.44 H new ATOM 1203 N LEU A 115 3.804 8.002 23.946 1.00 52.14 N ATOM 1204 CA LEU A 115 4.438 8.903 24.850 1.00 53.25 C ATOM 1205 C LEU A 115 3.653 10.187 24.901 1.00 61.14 C ATOM 1206 O LEU A 115 3.070 10.622 23.899 1.00 34.45 O ATOM 1207 CB LEU A 115 5.904 9.151 24.465 1.00 22.54 C ATOM 1208 CG LEU A 115 6.877 7.973 24.619 1.00 61.44 C ATOM 1209 CD1 LEU A 115 8.248 8.354 24.091 1.00 70.24 C ATOM 1210 CD2 LEU A 115 6.982 7.547 26.079 1.00 72.13 C ATOM 0 H LEU A 115 3.595 8.401 23.031 1.00 52.14 H new ATOM 0 HA LEU A 115 4.452 8.457 25.844 1.00 53.25 H new ATOM 0 HB2 LEU A 115 5.930 9.477 23.425 1.00 22.54 H new ATOM 0 HB3 LEU A 115 6.277 9.979 25.068 1.00 22.54 H new ATOM 0 HG LEU A 115 6.492 7.133 24.040 1.00 61.44 H new ATOM 0 HD11 LEU A 115 8.929 7.511 24.206 1.00 70.24 H new ATOM 0 HD12 LEU A 115 8.171 8.618 23.036 1.00 70.24 H new ATOM 0 HD13 LEU A 115 8.630 9.207 24.652 1.00 70.24 H new ATOM 0 HD21 LEU A 115 7.676 6.711 26.165 1.00 72.13 H new ATOM 0 HD22 LEU A 115 7.345 8.383 26.677 1.00 72.13 H new ATOM 0 HD23 LEU A 115 6.000 7.242 26.440 1.00 72.13 H new ATOM 1222 N ALA A 116 3.616 10.781 26.029 1.00 32.31 N ATOM 1223 CA ALA A 116 2.943 12.001 26.187 1.00 2.44 C ATOM 1224 C ALA A 116 4.030 13.092 26.322 1.00 22.44 C ATOM 1225 O ALA A 116 5.202 12.696 26.279 1.00 52.25 O ATOM 1226 CB ALA A 116 1.939 11.875 27.309 1.00 21.10 C ATOM 0 H ALA A 116 4.058 10.427 26.877 1.00 32.31 H new ATOM 0 HA ALA A 116 2.328 12.295 25.336 1.00 2.44 H new ATOM 0 HB1 ALA A 116 1.414 12.822 27.435 1.00 21.10 H new ATOM 0 HB2 ALA A 116 1.221 11.091 27.069 1.00 21.10 H new ATOM 0 HB3 ALA A 116 2.457 11.622 28.234 1.00 21.10 H new ATOM 1232 N PRO A 117 3.708 14.432 26.529 1.00 11.22 N ATOM 1233 CA PRO A 117 4.667 15.540 26.296 1.00 3.44 C ATOM 1234 C PRO A 117 6.080 15.253 26.748 1.00 15.44 C ATOM 1235 O PRO A 117 6.377 15.203 27.957 1.00 43.42 O ATOM 1236 CB PRO A 117 4.084 16.737 27.071 1.00 31.50 C ATOM 1237 CG PRO A 117 2.913 16.203 27.818 1.00 35.04 C ATOM 1238 CD PRO A 117 2.481 14.950 27.116 1.00 22.21 C ATOM 0 HA PRO A 117 4.767 15.718 25.225 1.00 3.44 H new ATOM 0 HB2 PRO A 117 4.823 17.160 27.752 1.00 31.50 H new ATOM 0 HB3 PRO A 117 3.784 17.535 26.391 1.00 31.50 H new ATOM 0 HG2 PRO A 117 3.179 15.993 28.854 1.00 35.04 H new ATOM 0 HG3 PRO A 117 2.103 16.932 27.839 1.00 35.04 H new ATOM 0 HD2 PRO A 117 2.039 14.236 27.811 1.00 22.21 H new ATOM 0 HD3 PRO A 117 1.731 15.159 26.353 1.00 22.21 H new ATOM 1246 N GLY A 118 6.941 15.057 25.795 1.00 71.23 N ATOM 1247 CA GLY A 118 8.282 14.736 26.095 1.00 13.53 C ATOM 1248 C GLY A 118 9.242 15.543 25.325 1.00 33.44 C ATOM 1249 O GLY A 118 9.841 16.482 25.867 1.00 2.41 O ATOM 0 H GLY A 118 6.725 15.117 24.800 1.00 71.23 H new ATOM 0 HA2 GLY A 118 8.458 14.886 27.160 1.00 13.53 H new ATOM 0 HA3 GLY A 118 8.454 13.679 25.889 1.00 13.53 H new ATOM 1253 N THR A 119 9.389 15.233 24.071 1.00 31.34 N ATOM 1254 CA THR A 119 10.322 15.938 23.272 1.00 15.03 C ATOM 1255 C THR A 119 9.690 17.205 22.781 1.00 21.41 C ATOM 1256 O THR A 119 8.912 17.204 21.813 1.00 70.41 O ATOM 1257 CB THR A 119 10.800 15.114 22.075 1.00 52.35 C ATOM 1258 OG1 THR A 119 11.140 13.782 22.512 1.00 0.20 O ATOM 1259 CG2 THR A 119 12.031 15.748 21.427 1.00 51.43 C ATOM 0 H THR A 119 8.872 14.498 23.589 1.00 31.34 H new ATOM 0 HA THR A 119 11.193 16.154 23.891 1.00 15.03 H new ATOM 0 HB THR A 119 9.993 15.081 21.343 1.00 52.35 H new ATOM 0 HG1 THR A 119 10.370 13.189 22.384 1.00 0.20 H new ATOM 0 HG21 THR A 119 12.349 15.141 20.579 1.00 51.43 H new ATOM 0 HG22 THR A 119 11.784 16.752 21.082 1.00 51.43 H new ATOM 0 HG23 THR A 119 12.839 15.803 22.157 1.00 51.43 H new ATOM 1267 N LYS A 120 9.969 18.257 23.522 1.00 64.23 N ATOM 1268 CA LYS A 120 9.634 19.640 23.208 1.00 53.21 C ATOM 1269 C LYS A 120 8.149 19.982 23.278 1.00 32.00 C ATOM 1270 O LYS A 120 7.810 21.164 23.373 1.00 43.32 O ATOM 1271 CB LYS A 120 10.187 20.040 21.828 1.00 54.12 C ATOM 1272 CG LYS A 120 11.647 19.671 21.605 1.00 24.11 C ATOM 1273 CD LYS A 120 12.602 20.265 22.641 1.00 11.50 C ATOM 1274 CE LYS A 120 12.887 21.767 22.470 1.00 3.52 C ATOM 1275 NZ LYS A 120 11.729 22.647 22.739 1.00 64.23 N ATOM 0 H LYS A 120 10.463 18.171 24.410 1.00 64.23 H new ATOM 0 HA LYS A 120 10.112 20.219 23.998 1.00 53.21 H new ATOM 0 HB2 LYS A 120 9.582 19.564 21.056 1.00 54.12 H new ATOM 0 HB3 LYS A 120 10.074 21.117 21.703 1.00 54.12 H new ATOM 0 HG2 LYS A 120 11.743 18.585 21.617 1.00 24.11 H new ATOM 0 HG3 LYS A 120 11.949 20.006 20.613 1.00 24.11 H new ATOM 0 HD2 LYS A 120 12.186 20.099 23.635 1.00 11.50 H new ATOM 0 HD3 LYS A 120 13.547 19.723 22.596 1.00 11.50 H new ATOM 0 HE2 LYS A 120 13.702 22.047 23.137 1.00 3.52 H new ATOM 0 HE3 LYS A 120 13.233 21.944 21.452 1.00 3.52 H new ATOM 0 HZ1 LYS A 120 12.057 23.523 23.193 1.00 64.23 H new ATOM 0 HZ2 LYS A 120 11.253 22.878 21.844 1.00 64.23 H new ATOM 0 HZ3 LYS A 120 11.061 22.159 23.370 1.00 64.23 H new ATOM 1289 N GLY A 121 7.265 19.008 23.273 1.00 74.33 N ATOM 1290 CA GLY A 121 5.896 19.376 23.134 1.00 20.24 C ATOM 1291 C GLY A 121 4.866 18.368 23.551 1.00 22.12 C ATOM 1292 O GLY A 121 5.205 17.263 23.974 1.00 32.22 O ATOM 0 H GLY A 121 7.464 18.011 23.359 1.00 74.33 H new ATOM 0 HA2 GLY A 121 5.731 20.285 23.712 1.00 20.24 H new ATOM 0 HA3 GLY A 121 5.719 19.626 22.088 1.00 20.24 H new ATOM 1296 N PRO A 122 3.573 18.804 23.430 1.00 62.33 N ATOM 1297 CA PRO A 122 2.340 18.098 23.840 1.00 52.31 C ATOM 1298 C PRO A 122 2.282 16.591 23.660 1.00 44.23 C ATOM 1299 O PRO A 122 1.659 15.942 24.488 1.00 33.53 O ATOM 1300 CB PRO A 122 1.262 18.774 23.021 1.00 70.43 C ATOM 1301 CG PRO A 122 1.725 20.172 22.924 1.00 34.34 C ATOM 1302 CD PRO A 122 3.222 20.110 22.835 1.00 64.44 C ATOM 0 HA PRO A 122 2.244 18.177 24.923 1.00 52.31 H new ATOM 0 HB2 PRO A 122 1.160 18.316 22.037 1.00 70.43 H new ATOM 0 HB3 PRO A 122 0.288 18.707 23.506 1.00 70.43 H new ATOM 0 HG2 PRO A 122 1.303 20.662 22.047 1.00 34.34 H new ATOM 0 HG3 PRO A 122 1.410 20.748 23.794 1.00 34.34 H new ATOM 0 HD2 PRO A 122 3.562 20.180 21.802 1.00 64.44 H new ATOM 0 HD3 PRO A 122 3.687 20.932 23.379 1.00 64.44 H new ATOM 1310 N PHE A 123 2.842 16.015 22.594 1.00 44.12 N ATOM 1311 CA PHE A 123 2.865 14.536 22.540 1.00 3.41 C ATOM 1312 C PHE A 123 3.867 13.955 21.577 1.00 10.20 C ATOM 1313 O PHE A 123 4.098 14.497 20.473 1.00 35.02 O ATOM 1314 CB PHE A 123 1.462 13.842 22.418 1.00 73.30 C ATOM 1315 CG PHE A 123 0.655 14.106 21.162 1.00 53.03 C ATOM 1316 CD1 PHE A 123 0.940 13.437 19.977 1.00 25.24 C ATOM 1317 CD2 PHE A 123 -0.419 14.989 21.183 1.00 52.02 C ATOM 1318 CE1 PHE A 123 0.179 13.645 18.844 1.00 42.44 C ATOM 1319 CE2 PHE A 123 -1.180 15.202 20.047 1.00 42.44 C ATOM 1320 CZ PHE A 123 -0.881 14.529 18.878 1.00 24.22 C ATOM 0 H PHE A 123 3.262 16.502 21.802 1.00 44.12 H new ATOM 0 HA PHE A 123 3.223 14.284 23.538 1.00 3.41 H new ATOM 0 HB2 PHE A 123 1.611 12.765 22.501 1.00 73.30 H new ATOM 0 HB3 PHE A 123 0.861 14.147 23.274 1.00 73.30 H new ATOM 0 HD1 PHE A 123 1.768 12.745 19.942 1.00 25.24 H new ATOM 0 HD2 PHE A 123 -0.662 15.514 22.095 1.00 52.02 H new ATOM 0 HE1 PHE A 123 0.413 13.117 17.932 1.00 42.44 H new ATOM 0 HE2 PHE A 123 -2.008 15.895 20.074 1.00 42.44 H new ATOM 0 HZ PHE A 123 -1.476 14.694 17.992 1.00 24.22 H new ATOM 1330 N ASP A 124 4.416 12.827 21.995 1.00 4.23 N ATOM 1331 CA ASP A 124 5.426 12.092 21.265 1.00 1.14 C ATOM 1332 C ASP A 124 4.788 10.769 20.851 1.00 24.00 C ATOM 1333 O ASP A 124 4.590 9.889 21.678 1.00 1.32 O ATOM 1334 CB ASP A 124 6.632 11.757 22.199 1.00 22.20 C ATOM 1335 CG ASP A 124 7.443 12.931 22.765 1.00 42.23 C ATOM 1336 OD1 ASP A 124 6.873 13.919 23.249 1.00 2.12 O ATOM 1337 OD2 ASP A 124 8.703 12.827 22.803 1.00 11.23 O ATOM 0 H ASP A 124 4.161 12.387 22.879 1.00 4.23 H new ATOM 0 HA ASP A 124 5.777 12.678 20.416 1.00 1.14 H new ATOM 0 HB2 ASP A 124 6.254 11.174 23.039 1.00 22.20 H new ATOM 0 HB3 ASP A 124 7.316 11.113 21.646 1.00 22.20 H new ATOM 1342 N LEU A 125 4.451 10.603 19.608 1.00 33.45 N ATOM 1343 CA LEU A 125 3.777 9.393 19.221 1.00 44.21 C ATOM 1344 C LEU A 125 4.484 8.766 18.051 1.00 22.52 C ATOM 1345 O LEU A 125 4.708 9.429 17.044 1.00 14.15 O ATOM 1346 CB LEU A 125 2.300 9.727 18.911 1.00 63.10 C ATOM 1347 CG LEU A 125 1.313 8.573 18.632 1.00 74.15 C ATOM 1348 CD1 LEU A 125 1.514 7.932 17.259 1.00 22.25 C ATOM 1349 CD2 LEU A 125 1.371 7.523 19.738 1.00 13.40 C ATOM 0 H LEU A 125 4.625 11.271 18.857 1.00 33.45 H new ATOM 0 HA LEU A 125 3.796 8.663 20.030 1.00 44.21 H new ATOM 0 HB2 LEU A 125 1.908 10.298 19.753 1.00 63.10 H new ATOM 0 HB3 LEU A 125 2.287 10.387 18.044 1.00 63.10 H new ATOM 0 HG LEU A 125 0.317 9.016 18.623 1.00 74.15 H new ATOM 0 HD11 LEU A 125 0.790 7.128 17.123 1.00 22.25 H new ATOM 0 HD12 LEU A 125 1.372 8.683 16.482 1.00 22.25 H new ATOM 0 HD13 LEU A 125 2.524 7.527 17.191 1.00 22.25 H new ATOM 0 HD21 LEU A 125 0.666 6.722 19.516 1.00 13.40 H new ATOM 0 HD22 LEU A 125 2.379 7.113 19.798 1.00 13.40 H new ATOM 0 HD23 LEU A 125 1.109 7.983 20.691 1.00 13.40 H new ATOM 1361 N TYR A 126 4.838 7.488 18.177 1.00 31.11 N ATOM 1362 CA TYR A 126 5.527 6.791 17.102 1.00 64.34 C ATOM 1363 C TYR A 126 5.558 5.302 17.329 1.00 24.34 C ATOM 1364 O TYR A 126 5.201 4.830 18.388 1.00 5.41 O ATOM 1365 CB TYR A 126 6.962 7.345 16.858 1.00 63.22 C ATOM 1366 CG TYR A 126 7.941 7.254 18.023 1.00 62.34 C ATOM 1367 CD1 TYR A 126 7.903 8.172 19.062 1.00 50.43 C ATOM 1368 CD2 TYR A 126 8.926 6.273 18.056 1.00 71.10 C ATOM 1369 CE1 TYR A 126 8.808 8.115 20.101 1.00 42.14 C ATOM 1370 CE2 TYR A 126 9.841 6.212 19.089 1.00 51.11 C ATOM 1371 CZ TYR A 126 9.776 7.135 20.110 1.00 72.33 C ATOM 1372 OH TYR A 126 10.689 7.084 21.146 1.00 24.21 O ATOM 0 H TYR A 126 4.659 6.922 19.006 1.00 31.11 H new ATOM 0 HA TYR A 126 4.949 6.980 16.197 1.00 64.34 H new ATOM 0 HB2 TYR A 126 7.392 6.812 16.010 1.00 63.22 H new ATOM 0 HB3 TYR A 126 6.877 8.392 16.567 1.00 63.22 H new ATOM 0 HD1 TYR A 126 7.150 8.946 19.057 1.00 50.43 H new ATOM 0 HD2 TYR A 126 8.977 5.545 17.259 1.00 71.10 H new ATOM 0 HE1 TYR A 126 8.758 8.835 20.904 1.00 42.14 H new ATOM 0 HE2 TYR A 126 10.602 5.446 19.096 1.00 51.11 H new ATOM 0 HH TYR A 126 11.304 6.334 21.004 1.00 24.21 H new ATOM 1382 N SER A 127 5.894 4.588 16.313 1.00 11.34 N ATOM 1383 CA SER A 127 6.175 3.185 16.386 1.00 31.53 C ATOM 1384 C SER A 127 7.557 3.014 15.786 1.00 2.51 C ATOM 1385 O SER A 127 7.969 3.841 14.945 1.00 72.41 O ATOM 1386 CB SER A 127 5.125 2.367 15.610 1.00 33.00 C ATOM 1387 OG SER A 127 5.315 0.973 15.759 1.00 72.24 O ATOM 0 H SER A 127 5.986 4.972 15.372 1.00 11.34 H new ATOM 0 HA SER A 127 6.138 2.822 17.413 1.00 31.53 H new ATOM 0 HB2 SER A 127 4.128 2.635 15.959 1.00 33.00 H new ATOM 0 HB3 SER A 127 5.173 2.627 14.553 1.00 33.00 H new ATOM 0 HG SER A 127 5.424 0.757 16.709 1.00 72.24 H new ATOM 1393 N LEU A 128 8.292 2.036 16.239 1.00 70.33 N ATOM 1394 CA LEU A 128 9.611 1.765 15.704 1.00 65.31 C ATOM 1395 C LEU A 128 9.529 1.362 14.241 1.00 74.42 C ATOM 1396 O LEU A 128 8.573 0.721 13.821 1.00 50.14 O ATOM 1397 CB LEU A 128 10.307 0.661 16.505 1.00 70.11 C ATOM 1398 CG LEU A 128 10.649 0.978 17.956 1.00 21.21 C ATOM 1399 CD1 LEU A 128 11.244 -0.242 18.629 1.00 30.30 C ATOM 1400 CD2 LEU A 128 11.611 2.154 18.039 1.00 44.14 C ATOM 0 H LEU A 128 8.002 1.404 16.985 1.00 70.33 H new ATOM 0 HA LEU A 128 10.196 2.681 15.785 1.00 65.31 H new ATOM 0 HB2 LEU A 128 9.669 -0.223 16.491 1.00 70.11 H new ATOM 0 HB3 LEU A 128 11.229 0.396 15.988 1.00 70.11 H new ATOM 0 HG LEU A 128 9.731 1.254 18.476 1.00 21.21 H new ATOM 0 HD11 LEU A 128 11.485 -0.005 19.665 1.00 30.30 H new ATOM 0 HD12 LEU A 128 10.524 -1.060 18.602 1.00 30.30 H new ATOM 0 HD13 LEU A 128 12.152 -0.540 18.105 1.00 30.30 H new ATOM 0 HD21 LEU A 128 11.841 2.363 19.084 1.00 44.14 H new ATOM 0 HD22 LEU A 128 12.530 1.910 17.506 1.00 44.14 H new ATOM 0 HD23 LEU A 128 11.151 3.033 17.586 1.00 44.14 H new ATOM 1412 N GLY A 129 10.516 1.758 13.474 1.00 53.32 N ATOM 1413 CA GLY A 129 10.566 1.367 12.096 1.00 51.32 C ATOM 1414 C GLY A 129 11.253 0.047 11.927 1.00 74.32 C ATOM 1415 O GLY A 129 11.592 -0.626 12.911 1.00 62.32 O ATOM 0 H GLY A 129 11.289 2.347 13.783 1.00 53.32 H new ATOM 0 HA2 GLY A 129 9.554 1.306 11.697 1.00 51.32 H new ATOM 0 HA3 GLY A 129 11.091 2.128 11.519 1.00 51.32 H new ATOM 1419 N ALA A 130 11.531 -0.289 10.703 1.00 11.42 N ATOM 1420 CA ALA A 130 12.137 -1.559 10.329 1.00 1.33 C ATOM 1421 C ALA A 130 13.580 -1.713 10.840 1.00 31.42 C ATOM 1422 O ALA A 130 14.188 -2.768 10.688 1.00 53.13 O ATOM 1423 CB ALA A 130 12.087 -1.714 8.826 1.00 71.45 C ATOM 0 H ALA A 130 11.343 0.320 9.906 1.00 11.42 H new ATOM 0 HA ALA A 130 11.560 -2.350 10.808 1.00 1.33 H new ATOM 0 HB1 ALA A 130 12.540 -2.664 8.543 1.00 71.45 H new ATOM 0 HB2 ALA A 130 11.050 -1.693 8.492 1.00 71.45 H new ATOM 0 HB3 ALA A 130 12.635 -0.897 8.358 1.00 71.45 H new ATOM 1429 N ASP A 131 14.124 -0.661 11.422 1.00 53.10 N ATOM 1430 CA ASP A 131 15.479 -0.701 11.977 1.00 41.20 C ATOM 1431 C ASP A 131 15.424 -0.996 13.482 1.00 0.24 C ATOM 1432 O ASP A 131 16.443 -1.252 14.127 1.00 53.14 O ATOM 1433 CB ASP A 131 16.203 0.624 11.700 1.00 10.11 C ATOM 1434 CG ASP A 131 17.674 0.615 12.077 1.00 13.41 C ATOM 1435 OD1 ASP A 131 18.436 -0.192 11.501 1.00 50.11 O ATOM 1436 OD2 ASP A 131 18.093 1.426 12.933 1.00 3.23 O ATOM 0 H ASP A 131 13.653 0.238 11.527 1.00 53.10 H new ATOM 0 HA ASP A 131 16.040 -1.501 11.494 1.00 41.20 H new ATOM 0 HB2 ASP A 131 16.112 0.861 10.640 1.00 10.11 H new ATOM 0 HB3 ASP A 131 15.703 1.421 12.249 1.00 10.11 H new ATOM 1441 N GLY A 132 14.210 -0.971 14.035 1.00 52.52 N ATOM 1442 CA GLY A 132 13.994 -1.261 15.457 1.00 22.43 C ATOM 1443 C GLY A 132 14.475 -0.149 16.378 1.00 41.33 C ATOM 1444 O GLY A 132 14.476 -0.292 17.599 1.00 13.12 O ATOM 0 H GLY A 132 13.358 -0.752 13.519 1.00 52.52 H new ATOM 0 HA2 GLY A 132 12.931 -1.431 15.629 1.00 22.43 H new ATOM 0 HA3 GLY A 132 14.511 -2.186 15.715 1.00 22.43 H new ATOM 1448 N LYS A 133 14.853 0.948 15.794 1.00 41.30 N ATOM 1449 CA LYS A 133 15.395 2.076 16.495 1.00 51.23 C ATOM 1450 C LYS A 133 14.816 3.308 15.852 1.00 5.51 C ATOM 1451 O LYS A 133 14.501 3.267 14.653 1.00 22.22 O ATOM 1452 CB LYS A 133 16.924 2.050 16.350 1.00 44.25 C ATOM 1453 CG LYS A 133 17.691 3.144 17.090 1.00 3.11 C ATOM 1454 CD LYS A 133 19.201 2.968 16.910 1.00 11.30 C ATOM 1455 CE LYS A 133 19.624 3.130 15.458 1.00 13.33 C ATOM 1456 NZ LYS A 133 21.040 2.759 15.234 1.00 14.13 N ATOM 0 H LYS A 133 14.791 1.088 14.786 1.00 41.30 H new ATOM 0 HA LYS A 133 15.150 2.060 17.557 1.00 51.23 H new ATOM 0 HB2 LYS A 133 17.285 1.083 16.700 1.00 44.25 H new ATOM 0 HB3 LYS A 133 17.169 2.117 15.290 1.00 44.25 H new ATOM 0 HG2 LYS A 133 17.388 4.122 16.717 1.00 3.11 H new ATOM 0 HG3 LYS A 133 17.441 3.115 18.151 1.00 3.11 H new ATOM 0 HD2 LYS A 133 19.727 3.699 17.525 1.00 11.30 H new ATOM 0 HD3 LYS A 133 19.496 1.981 17.266 1.00 11.30 H new ATOM 0 HE2 LYS A 133 18.986 2.512 14.826 1.00 13.33 H new ATOM 0 HE3 LYS A 133 19.470 4.165 15.152 1.00 13.33 H new ATOM 0 HZ1 LYS A 133 21.278 2.887 14.230 1.00 14.13 H new ATOM 0 HZ2 LYS A 133 21.654 3.365 15.815 1.00 14.13 H new ATOM 0 HZ3 LYS A 133 21.184 1.764 15.500 1.00 14.13 H new ATOM 1470 N GLU A 134 14.602 4.354 16.613 1.00 4.23 N ATOM 1471 CA GLU A 134 14.074 5.559 16.034 1.00 51.21 C ATOM 1472 C GLU A 134 15.153 6.341 15.272 1.00 62.44 C ATOM 1473 O GLU A 134 16.212 6.662 15.807 1.00 32.41 O ATOM 1474 CB GLU A 134 13.236 6.392 17.046 1.00 12.00 C ATOM 1475 CG GLU A 134 13.896 6.809 18.357 1.00 24.33 C ATOM 1476 CD GLU A 134 14.884 7.934 18.214 1.00 35.13 C ATOM 1477 OE1 GLU A 134 14.486 9.040 17.791 1.00 33.50 O ATOM 1478 OE2 GLU A 134 16.062 7.761 18.592 1.00 43.23 O ATOM 0 H GLU A 134 14.782 4.394 17.616 1.00 4.23 H new ATOM 0 HA GLU A 134 13.347 5.277 15.272 1.00 51.21 H new ATOM 0 HB2 GLU A 134 12.904 7.297 16.538 1.00 12.00 H new ATOM 0 HB3 GLU A 134 12.343 5.818 17.291 1.00 12.00 H new ATOM 0 HG2 GLU A 134 13.121 7.107 19.063 1.00 24.33 H new ATOM 0 HG3 GLU A 134 14.404 5.946 18.787 1.00 24.33 H new ATOM 1485 N GLY A 135 14.914 6.521 14.002 1.00 72.44 N ATOM 1486 CA GLY A 135 15.834 7.206 13.133 1.00 20.12 C ATOM 1487 C GLY A 135 15.095 7.883 12.013 1.00 41.40 C ATOM 1488 O GLY A 135 13.864 7.875 12.003 1.00 71.42 O ATOM 0 H GLY A 135 14.068 6.194 13.536 1.00 72.44 H new ATOM 0 HA2 GLY A 135 16.400 7.944 13.702 1.00 20.12 H new ATOM 0 HA3 GLY A 135 16.555 6.497 12.725 1.00 20.12 H new ATOM 1492 N GLY A 136 15.816 8.449 11.067 1.00 55.33 N ATOM 1493 CA GLY A 136 15.177 9.075 9.934 1.00 63.41 C ATOM 1494 C GLY A 136 15.516 8.306 8.690 1.00 21.10 C ATOM 1495 O GLY A 136 16.698 8.093 8.398 1.00 53.14 O ATOM 0 H GLY A 136 16.835 8.487 11.062 1.00 55.33 H new ATOM 0 HA2 GLY A 136 14.097 9.099 10.078 1.00 63.41 H new ATOM 0 HA3 GLY A 136 15.509 10.109 9.839 1.00 63.41 H new ATOM 1499 N SER A 137 14.498 7.931 7.951 1.00 31.12 N ATOM 1500 CA SER A 137 14.546 7.033 6.801 1.00 31.00 C ATOM 1501 C SER A 137 13.113 6.884 6.302 1.00 12.42 C ATOM 1502 O SER A 137 12.222 7.565 6.809 1.00 1.45 O ATOM 1503 CB SER A 137 15.085 5.639 7.209 1.00 41.41 C ATOM 1504 OG SER A 137 16.454 5.664 7.556 1.00 45.10 O ATOM 0 H SER A 137 13.552 8.261 8.142 1.00 31.12 H new ATOM 0 HA SER A 137 15.207 7.438 6.035 1.00 31.00 H new ATOM 0 HB2 SER A 137 14.507 5.264 8.054 1.00 41.41 H new ATOM 0 HB3 SER A 137 14.936 4.941 6.385 1.00 41.41 H new ATOM 0 HG SER A 137 16.782 6.587 7.527 1.00 45.10 H new ATOM 1510 N ASP A 138 12.894 6.075 5.292 1.00 31.44 N ATOM 1511 CA ASP A 138 11.526 5.753 4.896 1.00 41.44 C ATOM 1512 C ASP A 138 10.924 4.729 5.833 1.00 61.34 C ATOM 1513 O ASP A 138 10.181 5.066 6.739 1.00 30.14 O ATOM 1514 CB ASP A 138 11.425 5.263 3.450 1.00 64.05 C ATOM 1515 CG ASP A 138 11.325 6.383 2.463 1.00 35.52 C ATOM 1516 OD1 ASP A 138 12.343 7.037 2.169 1.00 13.14 O ATOM 1517 OD2 ASP A 138 10.219 6.637 1.964 1.00 70.12 O ATOM 0 H ASP A 138 13.623 5.631 4.734 1.00 31.44 H new ATOM 0 HA ASP A 138 10.960 6.682 4.961 1.00 41.44 H new ATOM 0 HB2 ASP A 138 12.299 4.655 3.215 1.00 64.05 H new ATOM 0 HB3 ASP A 138 10.552 4.618 3.350 1.00 64.05 H new ATOM 1522 N ASN A 139 11.311 3.486 5.669 1.00 45.02 N ATOM 1523 CA ASN A 139 10.729 2.412 6.468 1.00 22.01 C ATOM 1524 C ASN A 139 11.589 2.077 7.666 1.00 42.11 C ATOM 1525 O ASN A 139 11.150 1.407 8.583 1.00 73.22 O ATOM 1526 CB ASN A 139 10.461 1.147 5.625 1.00 3.34 C ATOM 1527 CG ASN A 139 11.707 0.552 5.002 1.00 72.31 C ATOM 1528 OD1 ASN A 139 12.347 -0.341 5.704 1.00 52.45 O flip ATOM 1529 ND2 ASN A 139 12.084 0.904 3.890 1.00 11.33 N flip ATOM 0 H ASN A 139 12.019 3.186 4.999 1.00 45.02 H new ATOM 0 HA ASN A 139 9.770 2.781 6.832 1.00 22.01 H new ATOM 0 HB2 ASN A 139 9.987 0.395 6.256 1.00 3.34 H new ATOM 0 HB3 ASN A 139 9.752 1.392 4.834 1.00 3.34 H new ATOM 0 HD21 ASN A 139 11.556 1.606 3.371 1.00 11.33 H new ATOM 0 HD22 ASN A 139 12.925 0.495 3.484 1.00 11.33 H new ATOM 1536 N ASP A 140 12.818 2.543 7.663 1.00 32.21 N ATOM 1537 CA ASP A 140 13.735 2.292 8.786 1.00 74.24 C ATOM 1538 C ASP A 140 13.622 3.393 9.828 1.00 3.23 C ATOM 1539 O ASP A 140 14.336 3.401 10.831 1.00 41.44 O ATOM 1540 CB ASP A 140 15.190 2.142 8.312 1.00 63.10 C ATOM 1541 CG ASP A 140 15.435 0.894 7.487 1.00 24.11 C ATOM 1542 OD1 ASP A 140 15.739 -0.179 8.062 1.00 11.32 O ATOM 1543 OD2 ASP A 140 15.351 0.969 6.236 1.00 64.34 O ATOM 0 H ASP A 140 13.218 3.097 6.905 1.00 32.21 H new ATOM 0 HA ASP A 140 13.440 1.347 9.243 1.00 74.24 H new ATOM 0 HB2 ASP A 140 15.463 3.017 7.722 1.00 63.10 H new ATOM 0 HB3 ASP A 140 15.847 2.127 9.182 1.00 63.10 H new ATOM 1548 N ALA A 141 12.710 4.301 9.582 1.00 44.23 N ATOM 1549 CA ALA A 141 12.444 5.427 10.452 1.00 32.45 C ATOM 1550 C ALA A 141 11.329 5.108 11.382 1.00 4.44 C ATOM 1551 O ALA A 141 10.534 4.215 11.108 1.00 25.41 O ATOM 1552 CB ALA A 141 12.047 6.628 9.657 1.00 44.44 C ATOM 0 H ALA A 141 12.117 4.280 8.753 1.00 44.23 H new ATOM 0 HA ALA A 141 13.358 5.634 11.009 1.00 32.45 H new ATOM 0 HB1 ALA A 141 11.852 7.462 10.331 1.00 44.44 H new ATOM 0 HB2 ALA A 141 12.853 6.895 8.973 1.00 44.44 H new ATOM 0 HB3 ALA A 141 11.146 6.405 9.086 1.00 44.44 H new ATOM 1558 N ASP A 142 11.275 5.806 12.476 1.00 70.04 N ATOM 1559 CA ASP A 142 10.177 5.655 13.385 1.00 64.20 C ATOM 1560 C ASP A 142 9.023 6.421 12.799 1.00 63.21 C ATOM 1561 O ASP A 142 9.159 7.582 12.404 1.00 13.51 O ATOM 1562 CB ASP A 142 10.510 6.195 14.789 1.00 10.43 C ATOM 1563 CG ASP A 142 10.832 7.685 14.821 1.00 23.33 C ATOM 1564 OD1 ASP A 142 11.909 8.072 14.328 1.00 72.53 O ATOM 1565 OD2 ASP A 142 10.035 8.489 15.370 1.00 51.23 O ATOM 0 H ASP A 142 11.979 6.487 12.762 1.00 70.04 H new ATOM 0 HA ASP A 142 9.942 4.598 13.508 1.00 64.20 H new ATOM 0 HB2 ASP A 142 9.666 6.002 15.451 1.00 10.43 H new ATOM 0 HB3 ASP A 142 11.360 5.642 15.188 1.00 10.43 H new ATOM 1570 N ILE A 143 7.931 5.774 12.665 1.00 14.41 N ATOM 1571 CA ILE A 143 6.800 6.390 12.081 1.00 63.10 C ATOM 1572 C ILE A 143 5.863 6.922 13.133 1.00 33.40 C ATOM 1573 O ILE A 143 5.421 6.204 14.024 1.00 22.53 O ATOM 1574 CB ILE A 143 6.114 5.505 10.974 1.00 53.52 C ATOM 1575 CG1 ILE A 143 5.937 4.021 11.381 1.00 72.35 C ATOM 1576 CG2 ILE A 143 6.906 5.578 9.684 1.00 41.11 C ATOM 1577 CD1 ILE A 143 4.918 3.755 12.450 1.00 64.40 C ATOM 0 H ILE A 143 7.793 4.806 12.955 1.00 14.41 H new ATOM 0 HA ILE A 143 7.149 7.262 11.528 1.00 63.10 H new ATOM 0 HB ILE A 143 5.114 5.917 10.838 1.00 53.52 H new ATOM 0 HG12 ILE A 143 5.663 3.451 10.494 1.00 72.35 H new ATOM 0 HG13 ILE A 143 6.900 3.639 11.720 1.00 72.35 H new ATOM 0 HG21 ILE A 143 6.423 4.962 8.925 1.00 41.11 H new ATOM 0 HG22 ILE A 143 6.947 6.612 9.340 1.00 41.11 H new ATOM 0 HG23 ILE A 143 7.918 5.213 9.857 1.00 41.11 H new ATOM 0 HD11 ILE A 143 4.877 2.685 12.656 1.00 64.40 H new ATOM 0 HD12 ILE A 143 5.196 4.289 13.359 1.00 64.40 H new ATOM 0 HD13 ILE A 143 3.939 4.097 12.113 1.00 64.40 H new ATOM 1589 N GLY A 144 5.658 8.199 13.107 1.00 34.52 N ATOM 1590 CA GLY A 144 4.805 8.785 14.064 1.00 14.22 C ATOM 1591 C GLY A 144 4.582 10.225 13.807 1.00 53.42 C ATOM 1592 O GLY A 144 5.330 10.857 13.061 1.00 20.44 O ATOM 0 H GLY A 144 6.071 8.845 12.434 1.00 34.52 H new ATOM 0 HA2 GLY A 144 3.847 8.265 14.061 1.00 14.22 H new ATOM 0 HA3 GLY A 144 5.235 8.657 15.058 1.00 14.22 H new ATOM 1596 N ASN A 145 3.562 10.734 14.405 1.00 10.23 N ATOM 1597 CA ASN A 145 3.230 12.124 14.318 1.00 25.03 C ATOM 1598 C ASN A 145 3.576 12.778 15.623 1.00 64.40 C ATOM 1599 O ASN A 145 3.639 12.103 16.661 1.00 34.02 O ATOM 1600 CB ASN A 145 1.752 12.349 13.926 1.00 12.21 C ATOM 1601 CG ASN A 145 0.696 11.638 14.793 1.00 33.54 C ATOM 1602 OD1 ASN A 145 -0.356 11.307 14.299 1.00 24.52 O ATOM 1603 ND2 ASN A 145 0.961 11.389 16.066 1.00 0.23 N ATOM 0 H ASN A 145 2.919 10.190 14.981 1.00 10.23 H new ATOM 0 HA ASN A 145 3.812 12.583 13.519 1.00 25.03 H new ATOM 0 HB2 ASN A 145 1.551 13.420 13.953 1.00 12.21 H new ATOM 0 HB3 ASN A 145 1.620 12.026 12.893 1.00 12.21 H new ATOM 0 HD21 ASN A 145 0.272 10.911 16.646 1.00 0.23 H new ATOM 0 HD22 ASN A 145 1.854 11.676 16.466 1.00 0.23 H new ATOM 1610 N TRP A 146 3.710 14.053 15.625 1.00 32.51 N ATOM 1611 CA TRP A 146 4.225 14.717 16.777 1.00 11.52 C ATOM 1612 C TRP A 146 3.502 16.009 16.929 1.00 43.45 C ATOM 1613 O TRP A 146 3.247 16.700 15.935 1.00 1.11 O ATOM 1614 CB TRP A 146 5.688 15.012 16.508 1.00 72.41 C ATOM 1615 CG TRP A 146 6.575 14.889 17.683 1.00 1.42 C ATOM 1616 CD1 TRP A 146 6.881 15.843 18.610 1.00 12.33 C ATOM 1617 CD2 TRP A 146 7.298 13.724 18.038 1.00 72.02 C ATOM 1618 NE1 TRP A 146 7.770 15.330 19.519 1.00 41.14 N ATOM 1619 CE2 TRP A 146 8.036 14.022 19.184 1.00 44.53 C ATOM 1620 CE3 TRP A 146 7.389 12.444 17.486 1.00 34.34 C ATOM 1621 CZ2 TRP A 146 8.862 13.086 19.788 1.00 14.30 C ATOM 1622 CZ3 TRP A 146 8.203 11.522 18.091 1.00 70.44 C ATOM 1623 CH2 TRP A 146 8.929 11.844 19.230 1.00 35.14 C ATOM 0 H TRP A 146 3.472 14.664 14.844 1.00 32.51 H new ATOM 0 HA TRP A 146 4.105 14.110 17.675 1.00 11.52 H new ATOM 0 HB2 TRP A 146 6.043 14.335 15.731 1.00 72.41 H new ATOM 0 HB3 TRP A 146 5.772 16.024 16.112 1.00 72.41 H new ATOM 0 HD1 TRP A 146 6.484 16.847 18.625 1.00 12.33 H new ATOM 0 HE1 TRP A 146 8.168 15.834 20.312 1.00 41.14 H new ATOM 0 HE3 TRP A 146 6.829 12.186 16.600 1.00 34.34 H new ATOM 0 HZ2 TRP A 146 9.433 13.333 20.671 1.00 14.30 H new ATOM 0 HZ3 TRP A 146 8.281 10.528 17.675 1.00 70.44 H new ATOM 0 HH2 TRP A 146 9.560 11.094 19.684 1.00 35.14 H new ATOM 1634 N ASP A 147 3.136 16.345 18.119 1.00 62.04 N ATOM 1635 CA ASP A 147 2.477 17.600 18.305 1.00 35.43 C ATOM 1636 C ASP A 147 3.412 18.547 18.954 1.00 22.31 C ATOM 1637 O ASP A 147 3.587 18.506 20.189 1.00 23.21 O ATOM 1638 CB ASP A 147 1.185 17.503 19.090 1.00 50.22 C ATOM 1639 CG ASP A 147 0.426 18.815 19.077 1.00 40.45 C ATOM 1640 OD1 ASP A 147 -0.384 19.039 18.154 1.00 44.31 O ATOM 1641 OD2 ASP A 147 0.613 19.645 19.967 1.00 74.54 O ATOM 0 H ASP A 147 3.275 15.787 18.961 1.00 62.04 H new ATOM 0 HA ASP A 147 2.191 17.961 17.317 1.00 35.43 H new ATOM 0 HB2 ASP A 147 0.560 16.716 18.668 1.00 50.22 H new ATOM 0 HB3 ASP A 147 1.404 17.219 20.119 1.00 50.22 H new ATOM 1646 N ASN A 148 4.110 19.277 18.081 1.00 65.45 N ATOM 1647 CA ASN A 148 5.045 20.352 18.383 1.00 31.45 C ATOM 1648 C ASN A 148 5.781 20.681 17.111 1.00 41.11 C ATOM 1649 O ASN A 148 5.465 21.691 16.471 1.00 71.22 O ATOM 1650 CB ASN A 148 6.055 19.997 19.469 1.00 75.23 C ATOM 1651 CG ASN A 148 6.923 21.194 19.854 1.00 50.42 C ATOM 1652 OD1 ASN A 148 6.542 22.011 20.701 1.00 12.44 O ATOM 1653 ND2 ASN A 148 8.091 21.294 19.281 1.00 21.43 N ATOM 1654 OXT ASN A 148 6.630 19.876 16.684 1.00 0.00 O ATOM 0 H ASN A 148 4.028 19.118 17.077 1.00 65.45 H new ATOM 0 HA ASN A 148 4.473 21.198 18.765 1.00 31.45 H new ATOM 0 HB2 ASN A 148 5.527 19.633 20.350 1.00 75.23 H new ATOM 0 HB3 ASN A 148 6.692 19.184 19.121 1.00 75.23 H new ATOM 0 HD21 ASN A 148 8.716 22.061 19.528 1.00 21.43 H new ATOM 0 HD22 ASN A 148 8.379 20.605 18.586 1.00 21.43 H new TER 1661 ASN A 148