USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 793 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 55 LYS NZ :NH3+ 163:sc= 0.0671 (180deg=-0.228) USER MOD Set 1.2: A 145 ASN : amide:sc= -3.56! C(o=-3.5!,f=-9.2!) USER MOD Set 2.1: A 64 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 68 ASN : amide:sc= -0.339 X(o=-0.34,f=-0.002) USER MOD Set 3.1: A 44 GLN :FLIP amide:sc= -2.16 F(o=-2.4,f=-1.8) USER MOD Set 3.2: A 139 ASN :FLIP amide:sc= 0.362 F(o=-2.4!,f=-1.8) USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 147:sc= 1.27 (180deg=0.889) USER MOD Single : A 48 THR OG1 : rot 106:sc= 1.34 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl 163:sc= -0.119 (180deg=-0.537) USER MOD Single : A 65 LYS NZ :NH3+ 168:sc= -0.0196 (180deg=-0.171) USER MOD Single : A 71 TYR OH : rot 180:sc= -0.487 USER MOD Single : A 73 SER OG : rot 163:sc= -0.509 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0215 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 83 LYS NZ :NH3+ -158:sc= -0.338 (180deg=-0.807) USER MOD Single : A 84 LYS NZ :NH3+ -159:sc= -1.54! (180deg=-2.2!) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.068 USER MOD Single : A 88 ASN : amide:sc= -0.0027 X(o=-0.0027,f=-0.15) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 92 LYS NZ :NH3+ 149:sc= 0.967 (180deg=-0.177) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= -1.07! C(o=-1.1!,f=-12!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot -119:sc= -2.91! USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= 0.405 K(o=0.4,f=-1.6) USER MOD Single : A 112 TYR OH : rot 65:sc= 0.765 USER MOD Single : A 113 GLN : amide:sc= -2.28! C(o=-2.3!,f=-7!) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 160:sc= -0.254 USER MOD Single : A 133 LYS NZ :NH3+ -163:sc= 1.06 (180deg=0.501) USER MOD Single : A 137 SER OG : rot 5:sc= 1.03 USER MOD Single : A 148 ASN : amide:sc= 0.804 K(o=0.8,f=-0.88) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 2.691 5.098 -0.575 1.00 13.43 N ATOM 2 CA MET A 39 3.972 4.491 -0.950 1.00 52.41 C ATOM 3 C MET A 39 3.733 3.062 -1.411 1.00 74.40 C ATOM 4 O MET A 39 3.669 2.146 -0.594 1.00 4.30 O ATOM 5 CB MET A 39 5.004 4.480 0.221 1.00 33.03 C ATOM 6 CG MET A 39 5.297 5.825 0.891 1.00 63.53 C ATOM 7 SD MET A 39 3.882 6.508 1.788 1.00 20.44 S ATOM 8 CE MET A 39 4.597 8.017 2.435 1.00 4.40 C ATOM 0 HA MET A 39 4.393 5.098 -1.751 1.00 52.41 H new ATOM 0 HB2 MET A 39 4.645 3.790 0.985 1.00 33.03 H new ATOM 0 HB3 MET A 39 5.943 4.076 -0.157 1.00 33.03 H new ATOM 0 HG2 MET A 39 6.131 5.704 1.582 1.00 63.53 H new ATOM 0 HG3 MET A 39 5.614 6.539 0.131 1.00 63.53 H new ATOM 0 HE1 MET A 39 3.847 8.555 3.015 1.00 4.40 H new ATOM 0 HE2 MET A 39 5.445 7.773 3.075 1.00 4.40 H new ATOM 0 HE3 MET A 39 4.935 8.643 1.609 1.00 4.40 H new ATOM 20 N SER A 40 3.574 2.864 -2.691 1.00 50.44 N ATOM 21 CA SER A 40 3.328 1.539 -3.217 1.00 53.25 C ATOM 22 C SER A 40 4.625 0.922 -3.726 1.00 42.55 C ATOM 23 O SER A 40 4.888 0.881 -4.931 1.00 22.34 O ATOM 24 CB SER A 40 2.276 1.584 -4.316 1.00 33.12 C ATOM 25 OG SER A 40 1.072 2.184 -3.836 1.00 43.14 O ATOM 0 H SER A 40 3.610 3.602 -3.395 1.00 50.44 H new ATOM 0 HA SER A 40 2.945 0.911 -2.413 1.00 53.25 H new ATOM 0 HB2 SER A 40 2.656 2.149 -5.167 1.00 33.12 H new ATOM 0 HB3 SER A 40 2.069 0.574 -4.670 1.00 33.12 H new ATOM 0 HG SER A 40 0.408 2.206 -4.556 1.00 43.14 H new ATOM 31 N ARG A 41 5.456 0.518 -2.788 1.00 43.12 N ATOM 32 CA ARG A 41 6.762 -0.062 -3.056 1.00 54.45 C ATOM 33 C ARG A 41 7.079 -1.070 -1.954 1.00 43.12 C ATOM 34 O ARG A 41 6.477 -0.982 -0.876 1.00 4.41 O ATOM 35 CB ARG A 41 7.842 1.048 -3.121 1.00 14.30 C ATOM 36 CG ARG A 41 7.753 1.912 -4.365 1.00 22.42 C ATOM 37 CD ARG A 41 8.714 3.072 -4.342 1.00 25.24 C ATOM 38 NE ARG A 41 8.648 3.816 -5.603 1.00 54.30 N ATOM 39 CZ ARG A 41 8.596 5.146 -5.728 1.00 12.44 C ATOM 40 NH1 ARG A 41 8.574 5.928 -4.652 1.00 42.32 N ATOM 41 NH2 ARG A 41 8.556 5.692 -6.938 1.00 75.11 N ATOM 0 H ARG A 41 5.240 0.584 -1.793 1.00 43.12 H new ATOM 0 HA ARG A 41 6.755 -0.570 -4.021 1.00 54.45 H new ATOM 0 HB2 ARG A 41 7.751 1.684 -2.240 1.00 14.30 H new ATOM 0 HB3 ARG A 41 8.828 0.586 -3.080 1.00 14.30 H new ATOM 0 HG2 ARG A 41 7.953 1.298 -5.243 1.00 22.42 H new ATOM 0 HG3 ARG A 41 6.736 2.291 -4.466 1.00 22.42 H new ATOM 0 HD2 ARG A 41 8.475 3.734 -3.509 1.00 25.24 H new ATOM 0 HD3 ARG A 41 9.729 2.709 -4.180 1.00 25.24 H new ATOM 0 HE ARG A 41 8.641 3.269 -6.464 1.00 54.30 H new ATOM 0 HH11 ARG A 41 8.597 5.514 -3.720 1.00 42.32 H new ATOM 0 HH12 ARG A 41 8.534 6.942 -4.759 1.00 42.32 H new ATOM 0 HH21 ARG A 41 8.565 5.097 -7.767 1.00 75.11 H new ATOM 0 HH22 ARG A 41 8.516 6.706 -7.039 1.00 75.11 H new ATOM 55 N PRO A 42 8.002 -2.040 -2.205 1.00 55.43 N ATOM 56 CA PRO A 42 8.370 -3.093 -1.232 1.00 24.31 C ATOM 57 C PRO A 42 8.720 -2.532 0.139 1.00 4.10 C ATOM 58 O PRO A 42 9.581 -1.647 0.252 1.00 54.40 O ATOM 59 CB PRO A 42 9.603 -3.736 -1.859 1.00 50.05 C ATOM 60 CG PRO A 42 9.429 -3.526 -3.314 1.00 50.01 C ATOM 61 CD PRO A 42 8.760 -2.194 -3.464 1.00 14.22 C ATOM 0 HA PRO A 42 7.544 -3.782 -1.057 1.00 24.31 H new ATOM 0 HB2 PRO A 42 10.520 -3.272 -1.498 1.00 50.05 H new ATOM 0 HB3 PRO A 42 9.665 -4.797 -1.615 1.00 50.05 H new ATOM 0 HG2 PRO A 42 10.390 -3.539 -3.827 1.00 50.01 H new ATOM 0 HG3 PRO A 42 8.822 -4.318 -3.752 1.00 50.01 H new ATOM 0 HD2 PRO A 42 9.487 -1.393 -3.594 1.00 14.22 H new ATOM 0 HD3 PRO A 42 8.102 -2.172 -4.333 1.00 14.22 H new ATOM 69 N ASP A 43 7.971 -2.982 1.156 1.00 4.42 N ATOM 70 CA ASP A 43 8.141 -2.623 2.605 1.00 21.10 C ATOM 71 C ASP A 43 7.584 -1.227 2.887 1.00 71.24 C ATOM 72 O ASP A 43 7.088 -0.924 3.983 1.00 41.41 O ATOM 73 CB ASP A 43 9.606 -2.745 3.059 1.00 24.45 C ATOM 74 CG ASP A 43 9.772 -2.929 4.558 1.00 20.43 C ATOM 75 OD1 ASP A 43 8.772 -3.069 5.285 1.00 50.42 O ATOM 76 OD2 ASP A 43 10.926 -3.042 5.004 1.00 72.43 O ATOM 0 H ASP A 43 7.198 -3.630 1.006 1.00 4.42 H new ATOM 0 HA ASP A 43 7.567 -3.341 3.191 1.00 21.10 H new ATOM 0 HB2 ASP A 43 10.066 -3.589 2.546 1.00 24.45 H new ATOM 0 HB3 ASP A 43 10.148 -1.851 2.750 1.00 24.45 H new ATOM 81 N GLN A 44 7.577 -0.407 1.856 1.00 51.04 N ATOM 82 CA GLN A 44 7.028 0.930 1.913 1.00 25.14 C ATOM 83 C GLN A 44 5.520 0.832 2.007 1.00 65.24 C ATOM 84 O GLN A 44 4.842 1.779 2.392 1.00 3.42 O ATOM 85 CB GLN A 44 7.448 1.738 0.685 1.00 42.41 C ATOM 86 CG GLN A 44 8.951 1.726 0.438 1.00 13.21 C ATOM 87 CD GLN A 44 9.753 2.251 1.613 1.00 21.31 C ATOM 88 OE1 GLN A 44 10.916 1.697 1.812 1.00 61.14 O flip ATOM 89 NE2 GLN A 44 9.304 3.123 2.351 1.00 35.30 N flip ATOM 0 H GLN A 44 7.958 -0.655 0.943 1.00 51.04 H new ATOM 0 HA GLN A 44 7.413 1.448 2.791 1.00 25.14 H new ATOM 0 HB2 GLN A 44 6.940 1.340 -0.193 1.00 42.41 H new ATOM 0 HB3 GLN A 44 7.115 2.769 0.806 1.00 42.41 H new ATOM 0 HG2 GLN A 44 9.268 0.707 0.216 1.00 13.21 H new ATOM 0 HG3 GLN A 44 9.173 2.328 -0.443 1.00 13.21 H new ATOM 0 HE21 GLN A 44 8.389 3.531 2.160 1.00 35.30 H new ATOM 0 HE22 GLN A 44 9.846 3.439 3.155 1.00 35.30 H new ATOM 98 N ALA A 45 5.007 -0.345 1.668 1.00 43.44 N ATOM 99 CA ALA A 45 3.612 -0.664 1.829 1.00 41.35 C ATOM 100 C ALA A 45 3.250 -0.664 3.315 1.00 74.32 C ATOM 101 O ALA A 45 2.124 -0.375 3.683 1.00 73.42 O ATOM 102 CB ALA A 45 3.294 -2.010 1.206 1.00 3.24 C ATOM 0 H ALA A 45 5.560 -1.104 1.271 1.00 43.44 H new ATOM 0 HA ALA A 45 3.018 0.094 1.318 1.00 41.35 H new ATOM 0 HB1 ALA A 45 2.235 -2.231 1.339 1.00 3.24 H new ATOM 0 HB2 ALA A 45 3.528 -1.983 0.142 1.00 3.24 H new ATOM 0 HB3 ALA A 45 3.890 -2.784 1.689 1.00 3.24 H new ATOM 108 N LYS A 46 4.226 -0.946 4.175 1.00 2.33 N ATOM 109 CA LYS A 46 3.965 -0.928 5.598 1.00 61.22 C ATOM 110 C LYS A 46 4.087 0.507 6.095 1.00 22.23 C ATOM 111 O LYS A 46 3.423 0.906 7.030 1.00 54.14 O ATOM 112 CB LYS A 46 4.987 -1.783 6.354 1.00 5.25 C ATOM 113 CG LYS A 46 5.147 -3.218 5.870 1.00 42.43 C ATOM 114 CD LYS A 46 6.087 -3.966 6.799 1.00 71.54 C ATOM 115 CE LYS A 46 6.458 -5.343 6.303 1.00 71.15 C ATOM 116 NZ LYS A 46 7.256 -5.277 5.071 1.00 14.32 N ATOM 0 H LYS A 46 5.182 -1.184 3.912 1.00 2.33 H new ATOM 0 HA LYS A 46 2.966 -1.328 5.774 1.00 61.22 H new ATOM 0 HB2 LYS A 46 5.958 -1.290 6.295 1.00 5.25 H new ATOM 0 HB3 LYS A 46 4.705 -1.805 7.407 1.00 5.25 H new ATOM 0 HG2 LYS A 46 4.177 -3.713 5.842 1.00 42.43 H new ATOM 0 HG3 LYS A 46 5.540 -3.228 4.853 1.00 42.43 H new ATOM 0 HD2 LYS A 46 6.996 -3.380 6.932 1.00 71.54 H new ATOM 0 HD3 LYS A 46 5.620 -4.056 7.780 1.00 71.54 H new ATOM 0 HE2 LYS A 46 7.021 -5.869 7.074 1.00 71.15 H new ATOM 0 HE3 LYS A 46 5.552 -5.921 6.120 1.00 71.15 H new ATOM 0 HZ1 LYS A 46 7.933 -6.067 5.053 1.00 14.32 H new ATOM 0 HZ2 LYS A 46 6.626 -5.342 4.246 1.00 14.32 H new ATOM 0 HZ3 LYS A 46 7.775 -4.376 5.041 1.00 14.32 H new ATOM 130 N VAL A 47 4.872 1.302 5.376 1.00 71.30 N ATOM 131 CA VAL A 47 5.084 2.707 5.735 1.00 34.43 C ATOM 132 C VAL A 47 3.847 3.515 5.375 1.00 51.03 C ATOM 133 O VAL A 47 3.367 4.345 6.153 1.00 1.25 O ATOM 134 CB VAL A 47 6.319 3.311 4.990 1.00 74.01 C ATOM 135 CG1 VAL A 47 6.587 4.762 5.397 1.00 13.43 C ATOM 136 CG2 VAL A 47 7.549 2.472 5.229 1.00 3.21 C ATOM 0 H VAL A 47 5.374 1.001 4.540 1.00 71.30 H new ATOM 0 HA VAL A 47 5.272 2.753 6.808 1.00 34.43 H new ATOM 0 HB VAL A 47 6.082 3.305 3.926 1.00 74.01 H new ATOM 0 HG11 VAL A 47 7.454 5.138 4.854 1.00 13.43 H new ATOM 0 HG12 VAL A 47 5.716 5.373 5.159 1.00 13.43 H new ATOM 0 HG13 VAL A 47 6.782 4.809 6.468 1.00 13.43 H new ATOM 0 HG21 VAL A 47 8.396 2.910 4.702 1.00 3.21 H new ATOM 0 HG22 VAL A 47 7.764 2.438 6.297 1.00 3.21 H new ATOM 0 HG23 VAL A 47 7.377 1.460 4.861 1.00 3.21 H new ATOM 146 N THR A 48 3.316 3.230 4.201 1.00 30.33 N ATOM 147 CA THR A 48 2.189 3.945 3.661 1.00 12.41 C ATOM 148 C THR A 48 0.930 3.756 4.522 1.00 2.42 C ATOM 149 O THR A 48 0.111 4.674 4.634 1.00 64.50 O ATOM 150 CB THR A 48 1.935 3.554 2.167 1.00 72.25 C ATOM 151 OG1 THR A 48 1.044 4.465 1.529 1.00 71.32 O ATOM 152 CG2 THR A 48 1.386 2.154 2.015 1.00 1.33 C ATOM 0 H THR A 48 3.663 2.487 3.594 1.00 30.33 H new ATOM 0 HA THR A 48 2.432 5.007 3.685 1.00 12.41 H new ATOM 0 HB THR A 48 2.912 3.598 1.686 1.00 72.25 H new ATOM 0 HG1 THR A 48 1.548 5.039 0.915 1.00 71.32 H new ATOM 0 HG21 THR A 48 1.229 1.937 0.958 1.00 1.33 H new ATOM 0 HG22 THR A 48 2.095 1.438 2.431 1.00 1.33 H new ATOM 0 HG23 THR A 48 0.437 2.076 2.546 1.00 1.33 H new ATOM 160 N VAL A 49 0.790 2.597 5.156 1.00 71.33 N ATOM 161 CA VAL A 49 -0.359 2.382 5.996 1.00 4.03 C ATOM 162 C VAL A 49 -0.140 3.056 7.340 1.00 12.33 C ATOM 163 O VAL A 49 -1.027 3.753 7.848 1.00 62.44 O ATOM 164 CB VAL A 49 -0.740 0.866 6.173 1.00 70.12 C ATOM 165 CG1 VAL A 49 -0.952 0.200 4.826 1.00 0.42 C ATOM 166 CG2 VAL A 49 0.272 0.080 7.018 1.00 55.44 C ATOM 0 H VAL A 49 1.445 1.817 5.101 1.00 71.33 H new ATOM 0 HA VAL A 49 -1.213 2.834 5.492 1.00 4.03 H new ATOM 0 HB VAL A 49 -1.679 0.850 6.727 1.00 70.12 H new ATOM 0 HG11 VAL A 49 -1.214 -0.847 4.975 1.00 0.42 H new ATOM 0 HG12 VAL A 49 -1.759 0.704 4.294 1.00 0.42 H new ATOM 0 HG13 VAL A 49 -0.035 0.264 4.240 1.00 0.42 H new ATOM 0 HG21 VAL A 49 -0.051 -0.958 7.100 1.00 55.44 H new ATOM 0 HG22 VAL A 49 1.252 0.118 6.541 1.00 55.44 H new ATOM 0 HG23 VAL A 49 0.335 0.520 8.013 1.00 55.44 H new ATOM 176 N ALA A 50 1.092 2.954 7.824 1.00 51.21 N ATOM 177 CA ALA A 50 1.497 3.435 9.124 1.00 0.15 C ATOM 178 C ALA A 50 1.259 4.922 9.288 1.00 52.24 C ATOM 179 O ALA A 50 0.794 5.369 10.332 1.00 71.23 O ATOM 180 CB ALA A 50 2.952 3.119 9.336 1.00 2.34 C ATOM 0 H ALA A 50 1.853 2.521 7.302 1.00 51.21 H new ATOM 0 HA ALA A 50 0.887 2.930 9.873 1.00 0.15 H new ATOM 0 HB1 ALA A 50 3.264 3.480 10.316 1.00 2.34 H new ATOM 0 HB2 ALA A 50 3.102 2.041 9.282 1.00 2.34 H new ATOM 0 HB3 ALA A 50 3.547 3.607 8.564 1.00 2.34 H new ATOM 186 N LYS A 51 1.515 5.690 8.231 1.00 44.23 N ATOM 187 CA LYS A 51 1.369 7.145 8.302 1.00 63.22 C ATOM 188 C LYS A 51 -0.107 7.547 8.514 1.00 52.11 C ATOM 189 O LYS A 51 -0.413 8.600 9.117 1.00 1.13 O ATOM 190 CB LYS A 51 1.954 7.835 7.048 1.00 15.21 C ATOM 191 CG LYS A 51 3.414 7.461 6.727 1.00 4.05 C ATOM 192 CD LYS A 51 4.370 7.684 7.910 1.00 45.31 C ATOM 193 CE LYS A 51 4.521 9.153 8.309 1.00 15.35 C ATOM 194 NZ LYS A 51 5.231 9.960 7.294 1.00 10.52 N ATOM 0 H LYS A 51 1.821 5.336 7.325 1.00 44.23 H new ATOM 0 HA LYS A 51 1.940 7.488 9.165 1.00 63.22 H new ATOM 0 HB2 LYS A 51 1.332 7.584 6.189 1.00 15.21 H new ATOM 0 HB3 LYS A 51 1.891 8.915 7.182 1.00 15.21 H new ATOM 0 HG2 LYS A 51 3.456 6.414 6.426 1.00 4.05 H new ATOM 0 HG3 LYS A 51 3.755 8.051 5.876 1.00 4.05 H new ATOM 0 HD2 LYS A 51 4.009 7.118 8.769 1.00 45.31 H new ATOM 0 HD3 LYS A 51 5.351 7.283 7.654 1.00 45.31 H new ATOM 0 HE2 LYS A 51 3.533 9.581 8.478 1.00 15.35 H new ATOM 0 HE3 LYS A 51 5.060 9.213 9.254 1.00 15.35 H new ATOM 0 HZ1 LYS A 51 5.302 10.945 7.621 1.00 10.52 H new ATOM 0 HZ2 LYS A 51 6.186 9.574 7.149 1.00 10.52 H new ATOM 0 HZ3 LYS A 51 4.706 9.930 6.397 1.00 10.52 H new ATOM 208 N GLY A 52 -1.003 6.676 8.099 1.00 54.10 N ATOM 209 CA GLY A 52 -2.409 6.916 8.273 1.00 31.20 C ATOM 210 C GLY A 52 -2.892 6.380 9.601 1.00 15.41 C ATOM 211 O GLY A 52 -3.839 6.914 10.193 1.00 64.53 O ATOM 0 H GLY A 52 -0.776 5.795 7.638 1.00 54.10 H new ATOM 0 HA2 GLY A 52 -2.608 7.986 8.215 1.00 31.20 H new ATOM 0 HA3 GLY A 52 -2.965 6.444 7.463 1.00 31.20 H new ATOM 215 N ASP A 53 -2.216 5.352 10.091 1.00 21.55 N ATOM 216 CA ASP A 53 -2.575 4.713 11.357 1.00 73.10 C ATOM 217 C ASP A 53 -2.146 5.561 12.517 1.00 52.12 C ATOM 218 O ASP A 53 -2.884 5.729 13.494 1.00 25.32 O ATOM 219 CB ASP A 53 -2.034 3.282 11.455 1.00 41.01 C ATOM 220 CG ASP A 53 -2.730 2.346 10.484 1.00 60.21 C ATOM 221 OD1 ASP A 53 -3.977 2.332 10.441 1.00 3.10 O ATOM 222 OD2 ASP A 53 -2.059 1.658 9.694 1.00 22.03 O ATOM 0 H ASP A 53 -1.407 4.936 9.629 1.00 21.55 H new ATOM 0 HA ASP A 53 -3.661 4.628 11.391 1.00 73.10 H new ATOM 0 HB2 ASP A 53 -0.963 3.284 11.253 1.00 41.01 H new ATOM 0 HB3 ASP A 53 -2.165 2.913 12.472 1.00 41.01 H new ATOM 227 N ILE A 54 -0.984 6.164 12.392 1.00 34.14 N ATOM 228 CA ILE A 54 -0.518 7.102 13.396 1.00 54.13 C ATOM 229 C ILE A 54 -1.414 8.336 13.409 1.00 65.50 C ATOM 230 O ILE A 54 -1.698 8.897 14.471 1.00 64.33 O ATOM 231 CB ILE A 54 0.954 7.539 13.180 1.00 75.52 C ATOM 232 CG1 ILE A 54 1.124 8.162 11.791 1.00 5.14 C ATOM 233 CG2 ILE A 54 1.897 6.366 13.387 1.00 23.21 C ATOM 234 CD1 ILE A 54 2.500 8.648 11.469 1.00 21.31 C ATOM 0 H ILE A 54 -0.345 6.024 11.609 1.00 34.14 H new ATOM 0 HA ILE A 54 -0.565 6.584 14.354 1.00 54.13 H new ATOM 0 HB ILE A 54 1.209 8.298 13.920 1.00 75.52 H new ATOM 0 HG12 ILE A 54 0.834 7.424 11.043 1.00 5.14 H new ATOM 0 HG13 ILE A 54 0.431 8.999 11.700 1.00 5.14 H new ATOM 0 HG21 ILE A 54 2.925 6.694 13.231 1.00 23.21 H new ATOM 0 HG22 ILE A 54 1.788 5.986 14.403 1.00 23.21 H new ATOM 0 HG23 ILE A 54 1.656 5.576 12.676 1.00 23.21 H new ATOM 0 HD11 ILE A 54 2.511 9.070 10.464 1.00 21.31 H new ATOM 0 HD12 ILE A 54 2.793 9.414 12.187 1.00 21.31 H new ATOM 0 HD13 ILE A 54 3.201 7.815 11.520 1.00 21.31 H new ATOM 246 N LYS A 55 -1.902 8.732 12.222 1.00 63.41 N ATOM 247 CA LYS A 55 -2.746 9.905 12.113 1.00 23.45 C ATOM 248 C LYS A 55 -4.093 9.634 12.776 1.00 32.31 C ATOM 249 O LYS A 55 -4.729 10.540 13.322 1.00 4.23 O ATOM 250 CB LYS A 55 -2.946 10.307 10.655 1.00 73.12 C ATOM 251 CG LYS A 55 -2.880 11.806 10.451 1.00 12.54 C ATOM 252 CD LYS A 55 -1.448 12.280 10.621 1.00 71.51 C ATOM 253 CE LYS A 55 -1.342 13.788 10.736 1.00 22.04 C ATOM 254 NZ LYS A 55 -1.977 14.300 11.978 1.00 4.21 N ATOM 0 H LYS A 55 -1.722 8.254 11.339 1.00 63.41 H new ATOM 0 HA LYS A 55 -2.252 10.732 12.623 1.00 23.45 H new ATOM 0 HB2 LYS A 55 -2.184 9.826 10.041 1.00 73.12 H new ATOM 0 HB3 LYS A 55 -3.912 9.939 10.310 1.00 73.12 H new ATOM 0 HG2 LYS A 55 -3.244 12.064 9.456 1.00 12.54 H new ATOM 0 HG3 LYS A 55 -3.528 12.310 11.168 1.00 12.54 H new ATOM 0 HD2 LYS A 55 -1.021 11.821 11.512 1.00 71.51 H new ATOM 0 HD3 LYS A 55 -0.854 11.942 9.772 1.00 71.51 H new ATOM 0 HE2 LYS A 55 -0.292 14.079 10.720 1.00 22.04 H new ATOM 0 HE3 LYS A 55 -1.815 14.251 9.870 1.00 22.04 H new ATOM 0 HZ1 LYS A 55 -1.643 15.267 12.166 1.00 4.21 H new ATOM 0 HZ2 LYS A 55 -3.010 14.307 11.862 1.00 4.21 H new ATOM 0 HZ3 LYS A 55 -1.723 13.685 12.777 1.00 4.21 H new ATOM 268 N ALA A 56 -4.496 8.370 12.746 1.00 45.13 N ATOM 269 CA ALA A 56 -5.715 7.911 13.385 1.00 61.14 C ATOM 270 C ALA A 56 -5.609 8.110 14.890 1.00 33.21 C ATOM 271 O ALA A 56 -6.565 8.531 15.554 1.00 21.41 O ATOM 272 CB ALA A 56 -5.924 6.440 13.079 1.00 24.21 C ATOM 0 H ALA A 56 -3.978 7.630 12.272 1.00 45.13 H new ATOM 0 HA ALA A 56 -6.561 8.484 13.005 1.00 61.14 H new ATOM 0 HB1 ALA A 56 -6.840 6.095 13.559 1.00 24.21 H new ATOM 0 HB2 ALA A 56 -6.005 6.300 12.001 1.00 24.21 H new ATOM 0 HB3 ALA A 56 -5.078 5.866 13.457 1.00 24.21 H new ATOM 278 N ILE A 57 -4.433 7.816 15.410 1.00 11.23 N ATOM 279 CA ILE A 57 -4.134 7.966 16.831 1.00 21.52 C ATOM 280 C ILE A 57 -4.160 9.436 17.234 1.00 51.43 C ATOM 281 O ILE A 57 -4.619 9.777 18.300 1.00 32.33 O ATOM 282 CB ILE A 57 -2.761 7.353 17.172 1.00 72.32 C ATOM 283 CG1 ILE A 57 -2.756 5.893 16.763 1.00 21.13 C ATOM 284 CG2 ILE A 57 -2.469 7.482 18.668 1.00 71.12 C ATOM 285 CD1 ILE A 57 -1.414 5.232 16.839 1.00 61.52 C ATOM 0 H ILE A 57 -3.650 7.464 14.860 1.00 11.23 H new ATOM 0 HA ILE A 57 -4.902 7.433 17.391 1.00 21.52 H new ATOM 0 HB ILE A 57 -1.984 7.890 16.628 1.00 72.32 H new ATOM 0 HG12 ILE A 57 -3.452 5.348 17.400 1.00 21.13 H new ATOM 0 HG13 ILE A 57 -3.129 5.813 15.742 1.00 21.13 H new ATOM 0 HG21 ILE A 57 -1.496 7.043 18.888 1.00 71.12 H new ATOM 0 HG22 ILE A 57 -2.464 8.535 18.948 1.00 71.12 H new ATOM 0 HG23 ILE A 57 -3.239 6.959 19.235 1.00 71.12 H new ATOM 0 HD11 ILE A 57 -1.503 4.191 16.529 1.00 61.52 H new ATOM 0 HD12 ILE A 57 -0.716 5.748 16.180 1.00 61.52 H new ATOM 0 HD13 ILE A 57 -1.045 5.275 17.864 1.00 61.52 H new ATOM 297 N ALA A 58 -3.726 10.310 16.339 1.00 4.32 N ATOM 298 CA ALA A 58 -3.735 11.752 16.611 1.00 53.21 C ATOM 299 C ALA A 58 -5.165 12.263 16.821 1.00 73.35 C ATOM 300 O ALA A 58 -5.399 13.240 17.546 1.00 75.54 O ATOM 301 CB ALA A 58 -3.061 12.517 15.491 1.00 30.25 C ATOM 0 H ALA A 58 -3.363 10.055 15.420 1.00 4.32 H new ATOM 0 HA ALA A 58 -3.173 11.920 17.530 1.00 53.21 H new ATOM 0 HB1 ALA A 58 -3.080 13.583 15.716 1.00 30.25 H new ATOM 0 HB2 ALA A 58 -2.027 12.185 15.394 1.00 30.25 H new ATOM 0 HB3 ALA A 58 -3.590 12.334 14.556 1.00 30.25 H new ATOM 307 N ALA A 59 -6.123 11.587 16.212 1.00 3.21 N ATOM 308 CA ALA A 59 -7.516 11.942 16.364 1.00 25.31 C ATOM 309 C ALA A 59 -8.053 11.343 17.658 1.00 63.34 C ATOM 310 O ALA A 59 -8.878 11.942 18.358 1.00 52.22 O ATOM 311 CB ALA A 59 -8.320 11.455 15.167 1.00 53.22 C ATOM 0 H ALA A 59 -5.956 10.785 15.605 1.00 3.21 H new ATOM 0 HA ALA A 59 -7.610 13.027 16.412 1.00 25.31 H new ATOM 0 HB1 ALA A 59 -9.367 11.730 15.296 1.00 53.22 H new ATOM 0 HB2 ALA A 59 -7.933 11.915 14.258 1.00 53.22 H new ATOM 0 HB3 ALA A 59 -8.236 10.371 15.089 1.00 53.22 H new ATOM 317 N ALA A 60 -7.541 10.191 18.001 1.00 23.24 N ATOM 318 CA ALA A 60 -7.965 9.493 19.186 1.00 34.41 C ATOM 319 C ALA A 60 -7.346 10.117 20.437 1.00 51.22 C ATOM 320 O ALA A 60 -7.952 10.128 21.496 1.00 3.13 O ATOM 321 CB ALA A 60 -7.603 8.031 19.071 1.00 40.35 C ATOM 0 H ALA A 60 -6.818 9.710 17.467 1.00 23.24 H new ATOM 0 HA ALA A 60 -9.048 9.579 19.280 1.00 34.41 H new ATOM 0 HB1 ALA A 60 -7.925 7.505 19.970 1.00 40.35 H new ATOM 0 HB2 ALA A 60 -8.099 7.601 18.201 1.00 40.35 H new ATOM 0 HB3 ALA A 60 -6.523 7.931 18.959 1.00 40.35 H new ATOM 327 N LEU A 61 -6.176 10.700 20.293 1.00 11.52 N ATOM 328 CA LEU A 61 -5.505 11.357 21.397 1.00 34.43 C ATOM 329 C LEU A 61 -6.302 12.605 21.778 1.00 2.12 C ATOM 330 O LEU A 61 -6.366 12.994 22.940 1.00 23.25 O ATOM 331 CB LEU A 61 -4.058 11.698 21.002 1.00 33.14 C ATOM 332 CG LEU A 61 -2.957 11.428 22.056 1.00 45.41 C ATOM 333 CD1 LEU A 61 -3.116 12.289 23.276 1.00 72.44 C ATOM 334 CD2 LEU A 61 -2.961 9.988 22.477 1.00 21.32 C ATOM 0 H LEU A 61 -5.663 10.733 19.412 1.00 11.52 H new ATOM 0 HA LEU A 61 -5.456 10.698 22.264 1.00 34.43 H new ATOM 0 HB2 LEU A 61 -3.811 11.134 20.103 1.00 33.14 H new ATOM 0 HB3 LEU A 61 -4.020 12.754 20.736 1.00 33.14 H new ATOM 0 HG LEU A 61 -2.008 11.673 21.579 1.00 45.41 H new ATOM 0 HD11 LEU A 61 -2.321 12.064 23.987 1.00 72.44 H new ATOM 0 HD12 LEU A 61 -3.060 13.339 22.990 1.00 72.44 H new ATOM 0 HD13 LEU A 61 -4.083 12.090 23.738 1.00 72.44 H new ATOM 0 HD21 LEU A 61 -2.179 9.823 23.218 1.00 21.32 H new ATOM 0 HD22 LEU A 61 -3.929 9.738 22.910 1.00 21.32 H new ATOM 0 HD23 LEU A 61 -2.778 9.355 21.609 1.00 21.32 H new ATOM 346 N ASP A 62 -6.963 13.185 20.786 1.00 31.14 N ATOM 347 CA ASP A 62 -7.889 14.299 21.007 1.00 54.00 C ATOM 348 C ASP A 62 -9.102 13.810 21.812 1.00 14.00 C ATOM 349 O ASP A 62 -9.678 14.540 22.625 1.00 25.31 O ATOM 350 CB ASP A 62 -8.333 14.915 19.665 1.00 11.10 C ATOM 351 CG ASP A 62 -9.564 15.814 19.773 1.00 71.43 C ATOM 352 OD1 ASP A 62 -9.434 17.029 20.029 1.00 21.23 O ATOM 353 OD2 ASP A 62 -10.680 15.313 19.573 1.00 52.13 O ATOM 0 H ASP A 62 -6.877 12.903 19.810 1.00 31.14 H new ATOM 0 HA ASP A 62 -7.379 15.076 21.576 1.00 54.00 H new ATOM 0 HB2 ASP A 62 -7.507 15.494 19.252 1.00 11.10 H new ATOM 0 HB3 ASP A 62 -8.543 14.111 18.959 1.00 11.10 H new ATOM 358 N MET A 63 -9.445 12.549 21.631 1.00 2.21 N ATOM 359 CA MET A 63 -10.545 11.960 22.369 1.00 44.41 C ATOM 360 C MET A 63 -10.131 11.696 23.806 1.00 61.43 C ATOM 361 O MET A 63 -10.930 11.824 24.705 1.00 31.51 O ATOM 362 CB MET A 63 -11.077 10.694 21.705 1.00 53.30 C ATOM 363 CG MET A 63 -11.750 10.940 20.368 1.00 44.34 C ATOM 364 SD MET A 63 -12.315 9.421 19.574 1.00 22.42 S ATOM 365 CE MET A 63 -13.463 8.781 20.805 1.00 73.20 C ATOM 0 H MET A 63 -8.980 11.915 20.982 1.00 2.21 H new ATOM 0 HA MET A 63 -11.365 12.678 22.367 1.00 44.41 H new ATOM 0 HB2 MET A 63 -10.252 9.995 21.563 1.00 53.30 H new ATOM 0 HB3 MET A 63 -11.789 10.214 22.377 1.00 53.30 H new ATOM 0 HG2 MET A 63 -12.601 11.606 20.513 1.00 44.34 H new ATOM 0 HG3 MET A 63 -11.053 11.452 19.705 1.00 44.34 H new ATOM 0 HE1 MET A 63 -14.107 8.030 20.347 1.00 73.20 H new ATOM 0 HE2 MET A 63 -12.904 8.329 21.624 1.00 73.20 H new ATOM 0 HE3 MET A 63 -14.075 9.596 21.191 1.00 73.20 H new ATOM 375 N TYR A 64 -8.866 11.350 24.020 1.00 70.22 N ATOM 376 CA TYR A 64 -8.355 11.211 25.375 1.00 64.25 C ATOM 377 C TYR A 64 -8.228 12.589 26.006 1.00 33.53 C ATOM 378 O TYR A 64 -8.490 12.754 27.194 1.00 4.44 O ATOM 379 CB TYR A 64 -6.997 10.536 25.413 1.00 74.04 C ATOM 380 CG TYR A 64 -6.493 10.344 26.835 1.00 53.45 C ATOM 381 CD1 TYR A 64 -6.845 9.226 27.577 1.00 14.44 C ATOM 382 CD2 TYR A 64 -5.664 11.281 27.441 1.00 4.35 C ATOM 383 CE1 TYR A 64 -6.399 9.051 28.823 1.00 61.14 C ATOM 384 CE2 TYR A 64 -5.211 11.094 28.706 1.00 23.20 C ATOM 385 CZ TYR A 64 -5.577 9.975 29.390 1.00 64.34 C ATOM 386 OH TYR A 64 -5.127 9.775 30.643 1.00 12.12 O ATOM 0 H TYR A 64 -8.186 11.163 23.283 1.00 70.22 H new ATOM 0 HA TYR A 64 -9.059 10.587 25.926 1.00 64.25 H new ATOM 0 HB2 TYR A 64 -7.060 9.567 24.917 1.00 74.04 H new ATOM 0 HB3 TYR A 64 -6.279 11.135 24.852 1.00 74.04 H new ATOM 0 HD1 TYR A 64 -7.493 8.482 27.138 1.00 14.44 H new ATOM 0 HD2 TYR A 64 -5.377 12.169 26.898 1.00 4.35 H new ATOM 0 HE1 TYR A 64 -6.691 8.174 29.382 1.00 61.14 H new ATOM 0 HE2 TYR A 64 -4.565 11.827 29.167 1.00 23.20 H new ATOM 0 HH TYR A 64 -4.550 10.522 30.907 1.00 12.12 H new ATOM 396 N LYS A 65 -7.844 13.613 25.203 1.00 23.25 N ATOM 397 CA LYS A 65 -7.741 14.954 25.764 1.00 71.43 C ATOM 398 C LYS A 65 -9.133 15.455 26.128 1.00 63.14 C ATOM 399 O LYS A 65 -9.302 16.429 26.830 1.00 53.11 O ATOM 400 CB LYS A 65 -7.026 15.979 24.862 1.00 20.32 C ATOM 401 CG LYS A 65 -7.868 16.700 23.828 1.00 12.12 C ATOM 402 CD LYS A 65 -7.043 17.776 23.154 1.00 63.12 C ATOM 403 CE LYS A 65 -7.840 18.596 22.174 1.00 43.31 C ATOM 404 NZ LYS A 65 -8.910 19.362 22.836 1.00 3.55 N ATOM 0 H LYS A 65 -7.613 13.530 24.213 1.00 23.25 H new ATOM 0 HA LYS A 65 -7.111 14.865 26.649 1.00 71.43 H new ATOM 0 HB2 LYS A 65 -6.564 16.729 25.504 1.00 20.32 H new ATOM 0 HB3 LYS A 65 -6.219 15.465 24.341 1.00 20.32 H new ATOM 0 HG2 LYS A 65 -8.234 15.991 23.085 1.00 12.12 H new ATOM 0 HG3 LYS A 65 -8.743 17.144 24.303 1.00 12.12 H new ATOM 0 HD2 LYS A 65 -6.623 18.434 23.914 1.00 63.12 H new ATOM 0 HD3 LYS A 65 -6.204 17.312 22.635 1.00 63.12 H new ATOM 0 HE2 LYS A 65 -7.174 19.282 21.650 1.00 43.31 H new ATOM 0 HE3 LYS A 65 -8.277 17.939 21.422 1.00 43.31 H new ATOM 0 HZ1 LYS A 65 -9.300 20.060 22.171 1.00 3.55 H new ATOM 0 HZ2 LYS A 65 -9.665 18.714 23.139 1.00 3.55 H new ATOM 0 HZ3 LYS A 65 -8.522 19.854 23.666 1.00 3.55 H new ATOM 418 N LEU A 66 -10.116 14.788 25.584 1.00 32.23 N ATOM 419 CA LEU A 66 -11.490 15.034 25.887 1.00 53.14 C ATOM 420 C LEU A 66 -11.921 14.176 27.098 1.00 52.11 C ATOM 421 O LEU A 66 -12.685 14.634 27.945 1.00 3.22 O ATOM 422 CB LEU A 66 -12.326 14.705 24.648 1.00 75.53 C ATOM 423 CG LEU A 66 -13.830 14.915 24.734 1.00 65.43 C ATOM 424 CD1 LEU A 66 -14.160 16.361 25.043 1.00 44.33 C ATOM 425 CD2 LEU A 66 -14.476 14.495 23.431 1.00 60.52 C ATOM 0 H LEU A 66 -9.974 14.042 24.903 1.00 32.23 H new ATOM 0 HA LEU A 66 -11.642 16.080 26.151 1.00 53.14 H new ATOM 0 HB2 LEU A 66 -11.950 15.307 23.820 1.00 75.53 H new ATOM 0 HB3 LEU A 66 -12.147 13.661 24.390 1.00 75.53 H new ATOM 0 HG LEU A 66 -14.222 14.302 25.546 1.00 65.43 H new ATOM 0 HD11 LEU A 66 -15.242 16.483 25.099 1.00 44.33 H new ATOM 0 HD12 LEU A 66 -13.713 16.640 25.997 1.00 44.33 H new ATOM 0 HD13 LEU A 66 -13.763 17.001 24.255 1.00 44.33 H new ATOM 0 HD21 LEU A 66 -15.554 14.646 23.494 1.00 60.52 H new ATOM 0 HD22 LEU A 66 -14.073 15.095 22.615 1.00 60.52 H new ATOM 0 HD23 LEU A 66 -14.267 13.442 23.245 1.00 60.52 H new ATOM 437 N ASP A 67 -11.392 12.955 27.192 1.00 21.42 N ATOM 438 CA ASP A 67 -11.749 12.021 28.287 1.00 2.04 C ATOM 439 C ASP A 67 -11.091 12.409 29.607 1.00 22.42 C ATOM 440 O ASP A 67 -11.645 12.179 30.671 1.00 63.12 O ATOM 441 CB ASP A 67 -11.306 10.594 27.889 1.00 1.01 C ATOM 442 CG ASP A 67 -11.523 9.543 28.970 1.00 42.41 C ATOM 443 OD1 ASP A 67 -12.666 9.071 29.134 1.00 1.43 O ATOM 444 OD2 ASP A 67 -10.543 9.152 29.643 1.00 61.10 O ATOM 0 H ASP A 67 -10.714 12.580 26.528 1.00 21.42 H new ATOM 0 HA ASP A 67 -12.828 12.064 28.434 1.00 2.04 H new ATOM 0 HB2 ASP A 67 -11.850 10.294 26.994 1.00 1.01 H new ATOM 0 HB3 ASP A 67 -10.248 10.615 27.627 1.00 1.01 H new ATOM 449 N ASN A 68 -9.990 13.115 29.546 1.00 1.32 N ATOM 450 CA ASN A 68 -9.366 13.587 30.773 1.00 53.20 C ATOM 451 C ASN A 68 -9.112 15.025 30.674 1.00 21.45 C ATOM 452 O ASN A 68 -8.216 15.531 31.358 1.00 63.41 O ATOM 453 CB ASN A 68 -8.065 12.919 31.055 1.00 2.23 C ATOM 454 CG ASN A 68 -7.863 12.553 32.537 1.00 75.50 C ATOM 455 OD1 ASN A 68 -7.205 11.573 32.859 1.00 64.12 O ATOM 456 ND2 ASN A 68 -8.383 13.350 33.441 1.00 41.35 N ATOM 0 H ASN A 68 -9.510 13.375 28.684 1.00 1.32 H new ATOM 0 HA ASN A 68 -10.059 13.352 31.581 1.00 53.20 H new ATOM 0 HB2 ASN A 68 -7.995 12.013 30.454 1.00 2.23 H new ATOM 0 HB3 ASN A 68 -7.254 13.575 30.739 1.00 2.23 H new ATOM 0 HD21 ASN A 68 -8.242 13.157 34.433 1.00 41.35 H new ATOM 0 HD22 ASN A 68 -8.928 14.162 33.152 1.00 41.35 H new ATOM 463 N PHE A 69 -9.900 15.696 29.814 1.00 20.21 N ATOM 464 CA PHE A 69 -9.909 17.175 29.624 1.00 32.10 C ATOM 465 C PHE A 69 -8.517 17.801 29.570 1.00 31.32 C ATOM 466 O PHE A 69 -8.347 18.978 29.904 1.00 5.53 O ATOM 467 CB PHE A 69 -10.772 17.827 30.721 1.00 65.20 C ATOM 468 CG PHE A 69 -10.481 17.330 32.118 1.00 71.24 C ATOM 469 CD1 PHE A 69 -9.419 17.797 32.826 1.00 34.35 C ATOM 470 CD2 PHE A 69 -11.281 16.397 32.690 1.00 32.41 C ATOM 471 CE1 PHE A 69 -9.154 17.349 34.091 1.00 32.20 C ATOM 472 CE2 PHE A 69 -11.053 15.938 33.949 1.00 51.21 C ATOM 473 CZ PHE A 69 -9.985 16.418 34.665 1.00 42.32 C ATOM 0 H PHE A 69 -10.570 15.219 29.211 1.00 20.21 H new ATOM 0 HA PHE A 69 -10.345 17.368 28.644 1.00 32.10 H new ATOM 0 HB2 PHE A 69 -10.620 18.906 30.693 1.00 65.20 H new ATOM 0 HB3 PHE A 69 -11.823 17.647 30.495 1.00 65.20 H new ATOM 0 HD1 PHE A 69 -8.771 18.537 32.381 1.00 34.35 H new ATOM 0 HD2 PHE A 69 -12.120 16.009 32.132 1.00 32.41 H new ATOM 0 HE1 PHE A 69 -8.299 17.724 34.634 1.00 32.20 H new ATOM 0 HE2 PHE A 69 -11.709 15.199 34.384 1.00 51.21 H new ATOM 0 HZ PHE A 69 -9.800 16.067 35.670 1.00 42.32 H new ATOM 483 N ALA A 70 -7.570 17.050 29.041 1.00 73.23 N ATOM 484 CA ALA A 70 -6.190 17.425 29.000 1.00 73.33 C ATOM 485 C ALA A 70 -5.431 16.299 28.371 1.00 72.44 C ATOM 486 O ALA A 70 -5.950 15.176 28.291 1.00 73.01 O ATOM 487 CB ALA A 70 -5.690 17.615 30.414 1.00 13.31 C ATOM 0 H ALA A 70 -7.756 16.140 28.620 1.00 73.23 H new ATOM 0 HA ALA A 70 -6.058 18.348 28.435 1.00 73.33 H new ATOM 0 HB1 ALA A 70 -4.638 17.901 30.393 1.00 13.31 H new ATOM 0 HB2 ALA A 70 -6.269 18.398 30.903 1.00 13.31 H new ATOM 0 HB3 ALA A 70 -5.801 16.683 30.968 1.00 13.31 H new ATOM 493 N TYR A 71 -4.249 16.579 27.902 1.00 1.22 N ATOM 494 CA TYR A 71 -3.384 15.553 27.406 1.00 20.43 C ATOM 495 C TYR A 71 -2.740 14.794 28.547 1.00 5.31 C ATOM 496 O TYR A 71 -2.620 15.324 29.648 1.00 12.52 O ATOM 497 CB TYR A 71 -2.346 16.117 26.446 1.00 53.34 C ATOM 498 CG TYR A 71 -2.913 16.363 25.093 1.00 23.01 C ATOM 499 CD1 TYR A 71 -3.603 15.360 24.447 1.00 62.13 C ATOM 500 CD2 TYR A 71 -2.763 17.568 24.457 1.00 73.24 C ATOM 501 CE1 TYR A 71 -4.131 15.536 23.217 1.00 51.21 C ATOM 502 CE2 TYR A 71 -3.282 17.768 23.201 1.00 63.31 C ATOM 503 CZ TYR A 71 -3.972 16.746 22.578 1.00 10.24 C ATOM 504 OH TYR A 71 -4.494 16.931 21.319 1.00 4.12 O ATOM 0 H TYR A 71 -3.861 17.521 27.854 1.00 1.22 H new ATOM 0 HA TYR A 71 -3.990 14.846 26.840 1.00 20.43 H new ATOM 0 HB2 TYR A 71 -1.950 17.049 26.848 1.00 53.34 H new ATOM 0 HB3 TYR A 71 -1.510 15.422 26.368 1.00 53.34 H new ATOM 0 HD1 TYR A 71 -3.725 14.406 24.939 1.00 62.13 H new ATOM 0 HD2 TYR A 71 -2.231 18.369 24.949 1.00 73.24 H new ATOM 0 HE1 TYR A 71 -4.674 14.735 22.738 1.00 51.21 H new ATOM 0 HE2 TYR A 71 -3.152 18.718 22.704 1.00 63.31 H new ATOM 0 HH TYR A 71 -4.294 17.840 21.012 1.00 4.12 H new ATOM 514 N PRO A 72 -2.336 13.539 28.308 1.00 61.32 N ATOM 515 CA PRO A 72 -1.730 12.681 29.335 1.00 62.14 C ATOM 516 C PRO A 72 -0.392 13.236 29.849 1.00 11.42 C ATOM 517 O PRO A 72 0.204 14.111 29.217 1.00 4.20 O ATOM 518 CB PRO A 72 -1.481 11.368 28.564 1.00 34.32 C ATOM 519 CG PRO A 72 -1.433 11.757 27.139 1.00 53.11 C ATOM 520 CD PRO A 72 -2.427 12.841 27.006 1.00 73.14 C ATOM 0 HA PRO A 72 -2.362 12.585 30.218 1.00 62.14 H new ATOM 0 HB2 PRO A 72 -0.547 10.900 28.876 1.00 34.32 H new ATOM 0 HB3 PRO A 72 -2.277 10.646 28.748 1.00 34.32 H new ATOM 0 HG2 PRO A 72 -0.437 12.098 26.856 1.00 53.11 H new ATOM 0 HG3 PRO A 72 -1.678 10.915 26.491 1.00 53.11 H new ATOM 0 HD2 PRO A 72 -2.191 13.505 26.175 1.00 73.14 H new ATOM 0 HD3 PRO A 72 -3.429 12.450 26.827 1.00 73.14 H new ATOM 528 N SER A 73 0.066 12.773 30.996 1.00 24.31 N ATOM 529 CA SER A 73 1.378 13.143 31.445 1.00 41.50 C ATOM 530 C SER A 73 2.275 11.991 31.063 1.00 61.42 C ATOM 531 O SER A 73 1.774 10.872 30.911 1.00 73.35 O ATOM 532 CB SER A 73 1.379 13.408 32.948 1.00 23.12 C ATOM 533 OG SER A 73 0.877 12.293 33.659 1.00 34.01 O ATOM 0 H SER A 73 -0.447 12.150 31.620 1.00 24.31 H new ATOM 0 HA SER A 73 1.727 14.069 30.987 1.00 41.50 H new ATOM 0 HB2 SER A 73 2.393 13.630 33.281 1.00 23.12 H new ATOM 0 HB3 SER A 73 0.772 14.287 33.167 1.00 23.12 H new ATOM 0 HG SER A 73 1.133 12.364 34.602 1.00 34.01 H new ATOM 539 N THR A 74 3.560 12.201 30.886 1.00 14.33 N ATOM 540 CA THR A 74 4.389 11.118 30.378 1.00 1.34 C ATOM 541 C THR A 74 4.554 9.995 31.420 1.00 72.34 C ATOM 542 O THR A 74 5.033 8.899 31.122 1.00 11.41 O ATOM 543 CB THR A 74 5.737 11.621 29.794 1.00 53.32 C ATOM 544 OG1 THR A 74 6.136 10.752 28.711 1.00 64.43 O ATOM 545 CG2 THR A 74 6.828 11.670 30.873 1.00 25.41 C ATOM 0 H THR A 74 4.046 13.077 31.077 1.00 14.33 H new ATOM 0 HA THR A 74 3.861 10.676 29.533 1.00 1.34 H new ATOM 0 HB THR A 74 5.602 12.636 29.420 1.00 53.32 H new ATOM 0 HG1 THR A 74 6.986 11.065 28.337 1.00 64.43 H new ATOM 0 HG21 THR A 74 7.759 12.026 30.433 1.00 25.41 H new ATOM 0 HG22 THR A 74 6.521 12.347 31.670 1.00 25.41 H new ATOM 0 HG23 THR A 74 6.979 10.672 31.283 1.00 25.41 H new ATOM 553 N GLN A 75 4.151 10.276 32.627 1.00 34.13 N ATOM 554 CA GLN A 75 4.106 9.279 33.632 1.00 14.32 C ATOM 555 C GLN A 75 2.657 8.792 33.838 1.00 12.33 C ATOM 556 O GLN A 75 2.312 7.681 33.408 1.00 44.00 O ATOM 557 CB GLN A 75 4.696 9.815 34.927 1.00 32.33 C ATOM 558 CG GLN A 75 6.188 10.095 34.868 1.00 22.11 C ATOM 559 CD GLN A 75 6.701 10.687 36.158 1.00 60.24 C ATOM 560 OE1 GLN A 75 7.105 9.968 37.071 1.00 72.31 O ATOM 561 NE2 GLN A 75 6.686 11.986 36.253 1.00 1.13 N ATOM 0 H GLN A 75 3.848 11.201 32.931 1.00 34.13 H new ATOM 0 HA GLN A 75 4.705 8.425 33.314 1.00 14.32 H new ATOM 0 HB2 GLN A 75 4.176 10.735 35.195 1.00 32.33 H new ATOM 0 HB3 GLN A 75 4.505 9.096 35.724 1.00 32.33 H new ATOM 0 HG2 GLN A 75 6.723 9.169 34.655 1.00 22.11 H new ATOM 0 HG3 GLN A 75 6.397 10.780 34.046 1.00 22.11 H new ATOM 0 HE21 GLN A 75 6.344 12.550 35.475 1.00 1.13 H new ATOM 0 HE22 GLN A 75 7.016 12.439 37.105 1.00 1.13 H new ATOM 570 N GLN A 76 1.771 9.675 34.322 1.00 0.14 N ATOM 571 CA GLN A 76 0.428 9.247 34.720 1.00 53.51 C ATOM 572 C GLN A 76 -0.444 9.038 33.526 1.00 71.43 C ATOM 573 O GLN A 76 -1.203 8.081 33.478 1.00 22.10 O ATOM 574 CB GLN A 76 -0.229 10.251 35.656 1.00 74.32 C ATOM 575 CG GLN A 76 0.562 10.561 36.915 1.00 22.15 C ATOM 576 CD GLN A 76 -0.120 11.611 37.766 1.00 34.43 C ATOM 577 OE1 GLN A 76 -1.341 11.713 37.781 1.00 4.11 O ATOM 578 NE2 GLN A 76 0.644 12.405 38.459 1.00 74.03 N ATOM 0 H GLN A 76 1.957 10.670 34.445 1.00 0.14 H new ATOM 0 HA GLN A 76 0.543 8.302 35.251 1.00 53.51 H new ATOM 0 HB2 GLN A 76 -0.395 11.180 35.111 1.00 74.32 H new ATOM 0 HB3 GLN A 76 -1.209 9.871 35.944 1.00 74.32 H new ATOM 0 HG2 GLN A 76 0.690 9.649 37.497 1.00 22.15 H new ATOM 0 HG3 GLN A 76 1.559 10.907 36.642 1.00 22.15 H new ATOM 0 HE21 GLN A 76 1.657 12.295 38.426 1.00 74.03 H new ATOM 0 HE22 GLN A 76 0.229 13.137 39.035 1.00 74.03 H new ATOM 587 N GLY A 77 -0.323 9.903 32.542 1.00 41.11 N ATOM 588 CA GLY A 77 -1.152 9.753 31.404 1.00 5.44 C ATOM 589 C GLY A 77 -0.690 8.653 30.480 1.00 62.45 C ATOM 590 O GLY A 77 -1.485 8.128 29.731 1.00 0.01 O ATOM 0 H GLY A 77 0.326 10.690 32.520 1.00 41.11 H new ATOM 0 HA2 GLY A 77 -2.171 9.543 31.729 1.00 5.44 H new ATOM 0 HA3 GLY A 77 -1.180 10.694 30.855 1.00 5.44 H new ATOM 594 N LEU A 78 0.577 8.271 30.564 1.00 51.01 N ATOM 595 CA LEU A 78 1.097 7.234 29.686 1.00 20.53 C ATOM 596 C LEU A 78 0.480 5.924 30.110 1.00 21.54 C ATOM 597 O LEU A 78 -0.123 5.195 29.300 1.00 13.42 O ATOM 598 CB LEU A 78 2.646 7.203 29.741 1.00 42.42 C ATOM 599 CG LEU A 78 3.407 6.305 28.729 1.00 3.41 C ATOM 600 CD1 LEU A 78 4.874 6.649 28.748 1.00 51.13 C ATOM 601 CD2 LEU A 78 3.253 4.822 29.044 1.00 65.31 C ATOM 0 H LEU A 78 1.255 8.657 31.221 1.00 51.01 H new ATOM 0 HA LEU A 78 0.834 7.432 28.647 1.00 20.53 H new ATOM 0 HB2 LEU A 78 3.002 8.225 29.610 1.00 42.42 H new ATOM 0 HB3 LEU A 78 2.936 6.890 30.744 1.00 42.42 H new ATOM 0 HG LEU A 78 2.976 6.493 27.746 1.00 3.41 H new ATOM 0 HD11 LEU A 78 5.405 6.017 28.037 1.00 51.13 H new ATOM 0 HD12 LEU A 78 5.006 7.695 28.473 1.00 51.13 H new ATOM 0 HD13 LEU A 78 5.273 6.484 29.749 1.00 51.13 H new ATOM 0 HD21 LEU A 78 3.803 4.235 28.309 1.00 65.31 H new ATOM 0 HD22 LEU A 78 3.648 4.619 30.039 1.00 65.31 H new ATOM 0 HD23 LEU A 78 2.198 4.550 29.010 1.00 65.31 H new ATOM 613 N GLU A 79 0.556 5.658 31.391 1.00 41.13 N ATOM 614 CA GLU A 79 -0.030 4.466 31.926 1.00 4.14 C ATOM 615 C GLU A 79 -1.542 4.545 31.841 1.00 12.23 C ATOM 616 O GLU A 79 -2.198 3.555 31.799 1.00 4.44 O ATOM 617 CB GLU A 79 0.424 4.212 33.338 1.00 41.52 C ATOM 618 CG GLU A 79 0.125 5.318 34.310 1.00 12.33 C ATOM 619 CD GLU A 79 0.455 4.927 35.711 1.00 53.10 C ATOM 620 OE1 GLU A 79 1.621 5.025 36.115 1.00 52.34 O ATOM 621 OE2 GLU A 79 -0.460 4.490 36.443 1.00 75.50 O ATOM 0 H GLU A 79 1.019 6.254 32.077 1.00 41.13 H new ATOM 0 HA GLU A 79 0.308 3.621 31.326 1.00 4.14 H new ATOM 0 HB2 GLU A 79 -0.047 3.297 33.696 1.00 41.52 H new ATOM 0 HB3 GLU A 79 1.500 4.035 33.332 1.00 41.52 H new ATOM 0 HG2 GLU A 79 0.695 6.206 34.037 1.00 12.33 H new ATOM 0 HG3 GLU A 79 -0.930 5.584 34.245 1.00 12.33 H new ATOM 628 N ALA A 80 -2.056 5.750 31.791 1.00 34.41 N ATOM 629 CA ALA A 80 -3.487 5.992 31.623 1.00 73.12 C ATOM 630 C ALA A 80 -3.923 5.861 30.156 1.00 31.30 C ATOM 631 O ALA A 80 -5.099 5.998 29.834 1.00 51.41 O ATOM 632 CB ALA A 80 -3.868 7.346 32.148 1.00 31.44 C ATOM 0 H ALA A 80 -1.499 6.601 31.865 1.00 34.41 H new ATOM 0 HA ALA A 80 -4.007 5.227 32.200 1.00 73.12 H new ATOM 0 HB1 ALA A 80 -4.938 7.501 32.011 1.00 31.44 H new ATOM 0 HB2 ALA A 80 -3.625 7.406 33.209 1.00 31.44 H new ATOM 0 HB3 ALA A 80 -3.317 8.115 31.606 1.00 31.44 H new ATOM 638 N LEU A 81 -2.964 5.704 29.269 1.00 21.34 N ATOM 639 CA LEU A 81 -3.258 5.396 27.873 1.00 42.41 C ATOM 640 C LEU A 81 -3.270 3.889 27.701 1.00 44.21 C ATOM 641 O LEU A 81 -3.871 3.349 26.772 1.00 30.51 O ATOM 642 CB LEU A 81 -2.198 5.991 26.928 1.00 54.40 C ATOM 643 CG LEU A 81 -2.093 7.516 26.842 1.00 42.00 C ATOM 644 CD1 LEU A 81 -0.901 7.913 25.977 1.00 52.35 C ATOM 645 CD2 LEU A 81 -3.374 8.109 26.273 1.00 71.11 C ATOM 0 H LEU A 81 -1.970 5.783 29.484 1.00 21.34 H new ATOM 0 HA LEU A 81 -4.226 5.830 27.621 1.00 42.41 H new ATOM 0 HB2 LEU A 81 -1.225 5.605 27.231 1.00 54.40 H new ATOM 0 HB3 LEU A 81 -2.393 5.612 25.925 1.00 54.40 H new ATOM 0 HG LEU A 81 -1.947 7.910 27.848 1.00 42.00 H new ATOM 0 HD11 LEU A 81 -0.836 9.000 25.923 1.00 52.35 H new ATOM 0 HD12 LEU A 81 0.015 7.516 26.415 1.00 52.35 H new ATOM 0 HD13 LEU A 81 -1.028 7.507 24.974 1.00 52.35 H new ATOM 0 HD21 LEU A 81 -3.280 9.194 26.220 1.00 71.11 H new ATOM 0 HD22 LEU A 81 -3.547 7.710 25.274 1.00 71.11 H new ATOM 0 HD23 LEU A 81 -4.213 7.849 26.918 1.00 71.11 H new ATOM 657 N VAL A 82 -2.558 3.224 28.584 1.00 52.34 N ATOM 658 CA VAL A 82 -2.453 1.770 28.569 1.00 52.54 C ATOM 659 C VAL A 82 -3.549 1.131 29.437 1.00 63.13 C ATOM 660 O VAL A 82 -4.234 0.190 29.019 1.00 61.51 O ATOM 661 CB VAL A 82 -1.077 1.332 29.113 1.00 40.22 C ATOM 662 CG1 VAL A 82 -0.858 -0.158 28.935 1.00 72.25 C ATOM 663 CG2 VAL A 82 0.029 2.129 28.460 1.00 0.40 C ATOM 0 H VAL A 82 -2.033 3.671 29.336 1.00 52.34 H new ATOM 0 HA VAL A 82 -2.572 1.439 27.537 1.00 52.54 H new ATOM 0 HB VAL A 82 -1.058 1.535 30.184 1.00 40.22 H new ATOM 0 HG11 VAL A 82 0.121 -0.432 29.329 1.00 72.25 H new ATOM 0 HG12 VAL A 82 -1.632 -0.706 29.473 1.00 72.25 H new ATOM 0 HG13 VAL A 82 -0.905 -0.409 27.875 1.00 72.25 H new ATOM 0 HG21 VAL A 82 0.992 1.807 28.856 1.00 0.40 H new ATOM 0 HG22 VAL A 82 0.007 1.967 27.382 1.00 0.40 H new ATOM 0 HG23 VAL A 82 -0.113 3.189 28.670 1.00 0.40 H new ATOM 673 N LYS A 83 -3.688 1.662 30.609 1.00 0.15 N ATOM 674 CA LYS A 83 -4.593 1.216 31.636 1.00 64.02 C ATOM 675 C LYS A 83 -5.583 2.336 31.924 1.00 34.14 C ATOM 676 O LYS A 83 -5.255 3.492 31.716 1.00 73.13 O ATOM 677 CB LYS A 83 -3.784 0.872 32.899 1.00 32.23 C ATOM 678 CG LYS A 83 -4.623 0.614 34.130 1.00 41.51 C ATOM 679 CD LYS A 83 -3.772 0.336 35.342 1.00 53.32 C ATOM 680 CE LYS A 83 -4.623 0.343 36.593 1.00 44.24 C ATOM 681 NZ LYS A 83 -5.204 1.684 36.848 1.00 41.33 N ATOM 0 H LYS A 83 -3.140 2.472 30.900 1.00 0.15 H new ATOM 0 HA LYS A 83 -5.138 0.328 31.316 1.00 64.02 H new ATOM 0 HB2 LYS A 83 -3.177 -0.010 32.697 1.00 32.23 H new ATOM 0 HB3 LYS A 83 -3.096 1.691 33.109 1.00 32.23 H new ATOM 0 HG2 LYS A 83 -5.259 1.478 34.323 1.00 41.51 H new ATOM 0 HG3 LYS A 83 -5.284 -0.234 33.948 1.00 41.51 H new ATOM 0 HD2 LYS A 83 -3.279 -0.630 35.235 1.00 53.32 H new ATOM 0 HD3 LYS A 83 -2.987 1.088 35.424 1.00 53.32 H new ATOM 0 HE2 LYS A 83 -5.425 -0.389 36.493 1.00 44.24 H new ATOM 0 HE3 LYS A 83 -4.018 0.039 37.447 1.00 44.24 H new ATOM 0 HZ1 LYS A 83 -5.454 1.768 37.854 1.00 41.33 H new ATOM 0 HZ2 LYS A 83 -4.508 2.416 36.602 1.00 41.33 H new ATOM 0 HZ3 LYS A 83 -6.058 1.809 36.267 1.00 41.33 H new ATOM 695 N LYS A 84 -6.798 1.980 32.358 1.00 34.45 N ATOM 696 CA LYS A 84 -7.853 2.946 32.639 1.00 40.30 C ATOM 697 C LYS A 84 -7.311 4.010 33.614 1.00 20.13 C ATOM 698 O LYS A 84 -6.720 3.662 34.658 1.00 1.34 O ATOM 699 CB LYS A 84 -9.031 2.215 33.298 1.00 22.22 C ATOM 700 CG LYS A 84 -10.352 2.969 33.271 1.00 34.54 C ATOM 701 CD LYS A 84 -10.978 2.974 31.872 1.00 23.13 C ATOM 702 CE LYS A 84 -11.754 1.677 31.547 1.00 42.23 C ATOM 703 NZ LYS A 84 -10.934 0.433 31.573 1.00 62.51 N ATOM 0 H LYS A 84 -7.072 1.011 32.523 1.00 34.45 H new ATOM 0 HA LYS A 84 -8.180 3.423 31.715 1.00 40.30 H new ATOM 0 HB2 LYS A 84 -9.168 1.255 32.800 1.00 22.22 H new ATOM 0 HB3 LYS A 84 -8.773 2.002 34.335 1.00 22.22 H new ATOM 0 HG2 LYS A 84 -11.045 2.512 33.977 1.00 34.54 H new ATOM 0 HG3 LYS A 84 -10.191 3.995 33.601 1.00 34.54 H new ATOM 0 HD2 LYS A 84 -11.654 3.825 31.786 1.00 23.13 H new ATOM 0 HD3 LYS A 84 -10.192 3.115 31.130 1.00 23.13 H new ATOM 0 HE2 LYS A 84 -12.571 1.571 32.260 1.00 42.23 H new ATOM 0 HE3 LYS A 84 -12.204 1.778 30.559 1.00 42.23 H new ATOM 0 HZ1 LYS A 84 -11.409 -0.308 31.018 1.00 62.51 H new ATOM 0 HZ2 LYS A 84 -9.998 0.626 31.163 1.00 62.51 H new ATOM 0 HZ3 LYS A 84 -10.822 0.111 32.556 1.00 62.51 H new ATOM 717 N PRO A 85 -7.495 5.294 33.268 1.00 50.41 N ATOM 718 CA PRO A 85 -6.947 6.426 34.007 1.00 62.32 C ATOM 719 C PRO A 85 -7.403 6.467 35.459 1.00 34.21 C ATOM 720 O PRO A 85 -8.602 6.396 35.766 1.00 1.11 O ATOM 721 CB PRO A 85 -7.471 7.648 33.233 1.00 51.14 C ATOM 722 CG PRO A 85 -8.640 7.138 32.493 1.00 44.45 C ATOM 723 CD PRO A 85 -8.284 5.750 32.121 1.00 11.03 C ATOM 0 HA PRO A 85 -5.860 6.378 34.067 1.00 62.32 H new ATOM 0 HB2 PRO A 85 -7.750 8.457 33.908 1.00 51.14 H new ATOM 0 HB3 PRO A 85 -6.714 8.045 32.556 1.00 51.14 H new ATOM 0 HG2 PRO A 85 -9.539 7.163 33.109 1.00 44.45 H new ATOM 0 HG3 PRO A 85 -8.842 7.744 31.610 1.00 44.45 H new ATOM 0 HD2 PRO A 85 -9.170 5.133 31.969 1.00 11.03 H new ATOM 0 HD3 PRO A 85 -7.709 5.715 31.196 1.00 11.03 H new ATOM 731 N THR A 86 -6.458 6.557 36.337 1.00 24.41 N ATOM 732 CA THR A 86 -6.723 6.633 37.736 1.00 31.31 C ATOM 733 C THR A 86 -6.797 8.083 38.176 1.00 74.42 C ATOM 734 O THR A 86 -5.791 8.793 38.202 1.00 44.04 O ATOM 735 CB THR A 86 -5.660 5.853 38.523 1.00 73.12 C ATOM 736 OG1 THR A 86 -4.379 5.992 37.872 1.00 64.14 O ATOM 737 CG2 THR A 86 -6.031 4.387 38.625 1.00 44.14 C ATOM 0 H THR A 86 -5.466 6.580 36.099 1.00 24.41 H new ATOM 0 HA THR A 86 -7.689 6.173 37.944 1.00 31.31 H new ATOM 0 HB THR A 86 -5.604 6.262 39.532 1.00 73.12 H new ATOM 0 HG1 THR A 86 -3.701 5.495 38.376 1.00 64.14 H new ATOM 0 HG21 THR A 86 -5.263 3.856 39.187 1.00 44.14 H new ATOM 0 HG22 THR A 86 -6.988 4.289 39.137 1.00 44.14 H new ATOM 0 HG23 THR A 86 -6.109 3.961 37.625 1.00 44.14 H new ATOM 745 N GLY A 87 -7.987 8.524 38.471 1.00 13.21 N ATOM 746 CA GLY A 87 -8.222 9.889 38.837 1.00 33.24 C ATOM 747 C GLY A 87 -9.623 10.259 38.469 1.00 43.42 C ATOM 748 O GLY A 87 -10.550 9.486 38.734 1.00 14.54 O ATOM 0 H GLY A 87 -8.825 7.942 38.464 1.00 13.21 H new ATOM 0 HA2 GLY A 87 -8.066 10.024 39.907 1.00 33.24 H new ATOM 0 HA3 GLY A 87 -7.514 10.542 38.327 1.00 33.24 H new ATOM 752 N ASN A 88 -9.809 11.388 37.838 1.00 63.31 N ATOM 753 CA ASN A 88 -11.144 11.782 37.433 1.00 63.44 C ATOM 754 C ASN A 88 -11.243 12.083 35.937 1.00 2.02 C ATOM 755 O ASN A 88 -10.991 13.198 35.496 1.00 11.21 O ATOM 756 CB ASN A 88 -11.756 12.923 38.312 1.00 31.20 C ATOM 757 CG ASN A 88 -10.922 14.200 38.411 1.00 24.31 C ATOM 758 OD1 ASN A 88 -11.043 15.115 37.597 1.00 44.54 O ATOM 759 ND2 ASN A 88 -10.104 14.296 39.428 1.00 32.23 N ATOM 0 H ASN A 88 -9.069 12.046 37.593 1.00 63.31 H new ATOM 0 HA ASN A 88 -11.767 10.906 37.617 1.00 63.44 H new ATOM 0 HB2 ASN A 88 -12.736 13.181 37.910 1.00 31.20 H new ATOM 0 HB3 ASN A 88 -11.916 12.536 39.318 1.00 31.20 H new ATOM 0 HD21 ASN A 88 -9.550 15.142 39.559 1.00 32.23 H new ATOM 0 HD22 ASN A 88 -10.020 13.524 40.090 1.00 32.23 H new ATOM 766 N PRO A 89 -11.510 11.054 35.124 1.00 35.04 N ATOM 767 CA PRO A 89 -11.797 11.221 33.718 1.00 33.14 C ATOM 768 C PRO A 89 -13.312 11.434 33.552 1.00 53.42 C ATOM 769 O PRO A 89 -14.096 11.174 34.485 1.00 24.32 O ATOM 770 CB PRO A 89 -11.330 9.886 33.076 1.00 50.33 C ATOM 771 CG PRO A 89 -11.070 8.951 34.234 1.00 42.34 C ATOM 772 CD PRO A 89 -11.545 9.637 35.491 1.00 15.23 C ATOM 0 HA PRO A 89 -11.302 12.075 33.256 1.00 33.14 H new ATOM 0 HB2 PRO A 89 -12.093 9.483 32.410 1.00 50.33 H new ATOM 0 HB3 PRO A 89 -10.430 10.031 32.479 1.00 50.33 H new ATOM 0 HG2 PRO A 89 -11.597 8.008 34.090 1.00 42.34 H new ATOM 0 HG3 PRO A 89 -10.008 8.715 34.305 1.00 42.34 H new ATOM 0 HD2 PRO A 89 -12.549 9.317 35.771 1.00 15.23 H new ATOM 0 HD3 PRO A 89 -10.894 9.423 36.339 1.00 15.23 H new ATOM 780 N GLN A 90 -13.724 11.929 32.436 1.00 53.33 N ATOM 781 CA GLN A 90 -15.121 12.208 32.215 1.00 50.13 C ATOM 782 C GLN A 90 -15.678 11.192 31.226 1.00 5.23 C ATOM 783 O GLN A 90 -14.939 10.726 30.388 1.00 14.12 O ATOM 784 CB GLN A 90 -15.287 13.656 31.761 1.00 33.44 C ATOM 785 CG GLN A 90 -14.740 14.633 32.802 1.00 73.21 C ATOM 786 CD GLN A 90 -14.822 16.076 32.397 1.00 23.41 C ATOM 787 OE1 GLN A 90 -14.780 16.406 31.225 1.00 3.13 O ATOM 788 NE2 GLN A 90 -14.905 16.951 33.365 1.00 12.14 N ATOM 0 H GLN A 90 -13.115 12.154 31.649 1.00 53.33 H new ATOM 0 HA GLN A 90 -15.695 12.106 33.136 1.00 50.13 H new ATOM 0 HB2 GLN A 90 -14.769 13.804 30.814 1.00 33.44 H new ATOM 0 HB3 GLN A 90 -16.342 13.864 31.583 1.00 33.44 H new ATOM 0 HG2 GLN A 90 -15.289 14.497 33.734 1.00 73.21 H new ATOM 0 HG3 GLN A 90 -13.699 14.383 33.006 1.00 73.21 H new ATOM 0 HE21 GLN A 90 -14.938 16.637 34.335 1.00 12.14 H new ATOM 0 HE22 GLN A 90 -14.937 17.948 33.150 1.00 12.14 H new ATOM 797 N PRO A 91 -16.980 10.811 31.341 1.00 62.45 N ATOM 798 CA PRO A 91 -17.589 9.720 30.545 1.00 41.45 C ATOM 799 C PRO A 91 -17.377 9.793 29.026 1.00 22.14 C ATOM 800 O PRO A 91 -18.074 10.524 28.301 1.00 4.00 O ATOM 801 CB PRO A 91 -19.073 9.818 30.883 1.00 23.43 C ATOM 802 CG PRO A 91 -19.098 10.417 32.235 1.00 31.13 C ATOM 803 CD PRO A 91 -17.961 11.394 32.273 1.00 5.42 C ATOM 0 HA PRO A 91 -17.116 8.773 30.802 1.00 41.45 H new ATOM 0 HB2 PRO A 91 -19.605 10.439 30.162 1.00 23.43 H new ATOM 0 HB3 PRO A 91 -19.549 8.838 30.873 1.00 23.43 H new ATOM 0 HG2 PRO A 91 -20.048 10.916 32.423 1.00 31.13 H new ATOM 0 HG3 PRO A 91 -18.982 9.652 33.003 1.00 31.13 H new ATOM 0 HD2 PRO A 91 -18.275 12.389 31.956 1.00 5.42 H new ATOM 0 HD3 PRO A 91 -17.551 11.494 33.278 1.00 5.42 H new ATOM 811 N LYS A 92 -16.405 9.039 28.582 1.00 4.12 N ATOM 812 CA LYS A 92 -16.021 8.810 27.202 1.00 3.20 C ATOM 813 C LYS A 92 -15.498 7.384 27.127 1.00 31.32 C ATOM 814 O LYS A 92 -15.041 6.834 28.146 1.00 41.23 O ATOM 815 CB LYS A 92 -14.952 9.815 26.634 1.00 34.12 C ATOM 816 CG LYS A 92 -15.456 11.244 26.327 1.00 32.03 C ATOM 817 CD LYS A 92 -15.574 12.113 27.569 1.00 61.54 C ATOM 818 CE LYS A 92 -16.416 13.350 27.324 1.00 52.35 C ATOM 819 NZ LYS A 92 -17.809 13.000 26.943 1.00 23.43 N ATOM 0 H LYS A 92 -15.807 8.523 29.227 1.00 4.12 H new ATOM 0 HA LYS A 92 -16.898 8.973 26.576 1.00 3.20 H new ATOM 0 HB2 LYS A 92 -14.134 9.887 27.351 1.00 34.12 H new ATOM 0 HB3 LYS A 92 -14.538 9.393 25.718 1.00 34.12 H new ATOM 0 HG2 LYS A 92 -14.775 11.720 25.621 1.00 32.03 H new ATOM 0 HG3 LYS A 92 -16.429 11.183 25.839 1.00 32.03 H new ATOM 0 HD2 LYS A 92 -16.014 11.530 28.378 1.00 61.54 H new ATOM 0 HD3 LYS A 92 -14.579 12.412 27.897 1.00 61.54 H new ATOM 0 HE2 LYS A 92 -16.428 13.966 28.223 1.00 52.35 H new ATOM 0 HE3 LYS A 92 -15.962 13.949 26.534 1.00 52.35 H new ATOM 0 HZ1 LYS A 92 -18.457 13.740 27.280 1.00 23.43 H new ATOM 0 HZ2 LYS A 92 -17.877 12.925 25.908 1.00 23.43 H new ATOM 0 HZ3 LYS A 92 -18.068 12.090 27.374 1.00 23.43 H new ATOM 833 N ASN A 93 -15.675 6.742 26.009 1.00 50.51 N ATOM 834 CA ASN A 93 -15.227 5.360 25.847 1.00 12.43 C ATOM 835 C ASN A 93 -13.715 5.273 25.713 1.00 33.13 C ATOM 836 O ASN A 93 -13.174 5.368 24.601 1.00 4.14 O ATOM 837 CB ASN A 93 -15.913 4.649 24.665 1.00 73.03 C ATOM 838 CG ASN A 93 -17.411 4.492 24.848 1.00 71.32 C ATOM 839 OD1 ASN A 93 -17.884 3.505 25.435 1.00 35.13 O ATOM 840 ND2 ASN A 93 -18.175 5.432 24.342 1.00 45.13 N ATOM 0 H ASN A 93 -16.126 7.141 25.185 1.00 50.51 H new ATOM 0 HA ASN A 93 -15.524 4.839 26.757 1.00 12.43 H new ATOM 0 HB2 ASN A 93 -15.722 5.212 23.751 1.00 73.03 H new ATOM 0 HB3 ASN A 93 -15.465 3.664 24.532 1.00 73.03 H new ATOM 0 HD21 ASN A 93 -19.189 5.364 24.425 1.00 45.13 H new ATOM 0 HD22 ASN A 93 -17.754 6.230 23.866 1.00 45.13 H new ATOM 847 N TRP A 94 -13.050 5.148 26.860 1.00 43.43 N ATOM 848 CA TRP A 94 -11.623 5.027 26.966 1.00 53.31 C ATOM 849 C TRP A 94 -11.075 3.867 26.125 1.00 12.04 C ATOM 850 O TRP A 94 -11.708 2.805 25.982 1.00 22.31 O ATOM 851 CB TRP A 94 -11.221 4.900 28.446 1.00 35.32 C ATOM 852 CG TRP A 94 -9.749 4.785 28.658 1.00 73.43 C ATOM 853 CD1 TRP A 94 -8.847 5.801 28.819 1.00 31.55 C ATOM 854 CD2 TRP A 94 -9.003 3.570 28.716 1.00 4.45 C ATOM 855 NE1 TRP A 94 -7.590 5.271 28.945 1.00 12.53 N ATOM 856 CE2 TRP A 94 -7.666 3.913 28.886 1.00 55.12 C ATOM 857 CE3 TRP A 94 -9.350 2.221 28.627 1.00 2.34 C ATOM 858 CZ2 TRP A 94 -6.672 2.966 28.969 1.00 51.21 C ATOM 859 CZ3 TRP A 94 -8.359 1.281 28.717 1.00 23.00 C ATOM 860 CH2 TRP A 94 -7.038 1.658 28.884 1.00 52.33 C ATOM 0 H TRP A 94 -13.520 5.129 27.765 1.00 43.43 H new ATOM 0 HA TRP A 94 -11.173 5.932 26.558 1.00 53.31 H new ATOM 0 HB2 TRP A 94 -11.591 5.769 28.990 1.00 35.32 H new ATOM 0 HB3 TRP A 94 -11.710 4.025 28.873 1.00 35.32 H new ATOM 0 HD1 TRP A 94 -9.088 6.854 28.843 1.00 31.55 H new ATOM 0 HE1 TRP A 94 -6.732 5.809 29.064 1.00 12.53 H new ATOM 0 HE3 TRP A 94 -10.380 1.925 28.490 1.00 2.34 H new ATOM 0 HZ2 TRP A 94 -5.638 3.250 29.097 1.00 51.21 H new ATOM 0 HZ3 TRP A 94 -8.611 0.233 28.657 1.00 23.00 H new ATOM 0 HH2 TRP A 94 -6.277 0.894 28.949 1.00 52.33 H new ATOM 871 N ASN A 95 -9.916 4.086 25.566 1.00 15.41 N ATOM 872 CA ASN A 95 -9.254 3.135 24.729 1.00 61.42 C ATOM 873 C ASN A 95 -7.830 2.867 25.218 1.00 31.21 C ATOM 874 O ASN A 95 -7.113 3.794 25.586 1.00 73.03 O ATOM 875 CB ASN A 95 -9.249 3.610 23.282 1.00 52.42 C ATOM 876 CG ASN A 95 -8.319 2.786 22.414 1.00 63.15 C ATOM 877 OD1 ASN A 95 -7.199 3.136 22.244 1.00 35.40 O ATOM 878 ND2 ASN A 95 -8.753 1.689 21.896 1.00 54.41 N ATOM 0 H ASN A 95 -9.396 4.955 25.686 1.00 15.41 H new ATOM 0 HA ASN A 95 -9.806 2.196 24.781 1.00 61.42 H new ATOM 0 HB2 ASN A 95 -10.261 3.557 22.880 1.00 52.42 H new ATOM 0 HB3 ASN A 95 -8.946 4.656 23.246 1.00 52.42 H new ATOM 0 HD21 ASN A 95 -8.131 1.110 21.332 1.00 54.41 H new ATOM 0 HD22 ASN A 95 -9.719 1.399 22.050 1.00 54.41 H new ATOM 885 N LYS A 96 -7.440 1.604 25.220 1.00 30.21 N ATOM 886 CA LYS A 96 -6.120 1.190 25.686 1.00 20.53 C ATOM 887 C LYS A 96 -5.085 1.276 24.576 1.00 35.35 C ATOM 888 O LYS A 96 -5.402 1.521 23.420 1.00 40.21 O ATOM 889 CB LYS A 96 -6.146 -0.278 26.128 1.00 45.33 C ATOM 890 CG LYS A 96 -6.279 -1.237 24.950 1.00 32.41 C ATOM 891 CD LYS A 96 -6.282 -2.684 25.364 1.00 51.02 C ATOM 892 CE LYS A 96 -6.352 -3.571 24.138 1.00 74.14 C ATOM 893 NZ LYS A 96 -6.305 -4.995 24.477 1.00 25.10 N ATOM 0 H LYS A 96 -8.027 0.834 24.899 1.00 30.21 H new ATOM 0 HA LYS A 96 -5.860 1.857 26.508 1.00 20.53 H new ATOM 0 HB2 LYS A 96 -5.232 -0.506 26.677 1.00 45.33 H new ATOM 0 HB3 LYS A 96 -6.978 -0.433 26.815 1.00 45.33 H new ATOM 0 HG2 LYS A 96 -7.201 -1.017 24.413 1.00 32.41 H new ATOM 0 HG3 LYS A 96 -5.457 -1.066 24.255 1.00 32.41 H new ATOM 0 HD2 LYS A 96 -5.382 -2.910 25.936 1.00 51.02 H new ATOM 0 HD3 LYS A 96 -7.132 -2.883 26.016 1.00 51.02 H new ATOM 0 HE2 LYS A 96 -7.272 -3.360 23.592 1.00 74.14 H new ATOM 0 HE3 LYS A 96 -5.524 -3.331 23.471 1.00 74.14 H new ATOM 0 HZ1 LYS A 96 -6.356 -5.561 23.606 1.00 25.10 H new ATOM 0 HZ2 LYS A 96 -5.416 -5.204 24.975 1.00 25.10 H new ATOM 0 HZ3 LYS A 96 -7.110 -5.232 25.091 1.00 25.10 H new ATOM 907 N ASP A 97 -3.851 1.040 24.962 1.00 2.53 N ATOM 908 CA ASP A 97 -2.713 0.859 24.055 1.00 64.05 C ATOM 909 C ASP A 97 -2.328 2.155 23.334 1.00 51.44 C ATOM 910 O ASP A 97 -1.581 2.157 22.362 1.00 60.15 O ATOM 911 CB ASP A 97 -2.953 -0.339 23.098 1.00 22.13 C ATOM 912 CG ASP A 97 -1.717 -0.802 22.343 1.00 30.13 C ATOM 913 OD1 ASP A 97 -0.652 -1.030 22.979 1.00 12.03 O ATOM 914 OD2 ASP A 97 -1.808 -1.048 21.125 1.00 11.33 O ATOM 0 H ASP A 97 -3.592 0.964 25.946 1.00 2.53 H new ATOM 0 HA ASP A 97 -1.840 0.606 24.657 1.00 64.05 H new ATOM 0 HB2 ASP A 97 -3.345 -1.176 23.676 1.00 22.13 H new ATOM 0 HB3 ASP A 97 -3.722 -0.062 22.376 1.00 22.13 H new ATOM 919 N GLY A 98 -2.829 3.263 23.841 1.00 52.23 N ATOM 920 CA GLY A 98 -2.333 4.547 23.383 1.00 22.31 C ATOM 921 C GLY A 98 -3.369 5.422 22.757 1.00 63.10 C ATOM 922 O GLY A 98 -3.036 6.468 22.218 1.00 22.33 O ATOM 0 H GLY A 98 -3.560 3.304 24.551 1.00 52.23 H new ATOM 0 HA2 GLY A 98 -1.892 5.075 24.229 1.00 22.31 H new ATOM 0 HA3 GLY A 98 -1.534 4.377 22.661 1.00 22.31 H new ATOM 926 N TYR A 99 -4.615 5.010 22.858 1.00 3.14 N ATOM 927 CA TYR A 99 -5.720 5.682 22.206 1.00 30.32 C ATOM 928 C TYR A 99 -5.597 5.578 20.683 1.00 72.44 C ATOM 929 O TYR A 99 -5.134 6.466 19.988 1.00 53.45 O ATOM 930 CB TYR A 99 -6.024 7.108 22.744 1.00 43.32 C ATOM 931 CG TYR A 99 -7.340 7.191 23.449 1.00 73.34 C ATOM 932 CD1 TYR A 99 -7.442 6.935 24.798 1.00 13.31 C ATOM 933 CD2 TYR A 99 -8.487 7.524 22.763 1.00 22.54 C ATOM 934 CE1 TYR A 99 -8.651 7.015 25.430 1.00 63.42 C ATOM 935 CE2 TYR A 99 -9.691 7.604 23.385 1.00 34.34 C ATOM 936 CZ TYR A 99 -9.769 7.352 24.712 1.00 11.23 C ATOM 937 OH TYR A 99 -10.958 7.409 25.324 1.00 75.12 O ATOM 0 H TYR A 99 -4.892 4.192 23.400 1.00 3.14 H new ATOM 0 HA TYR A 99 -6.626 5.143 22.483 1.00 30.32 H new ATOM 0 HB2 TYR A 99 -5.231 7.411 23.428 1.00 43.32 H new ATOM 0 HB3 TYR A 99 -6.016 7.814 21.914 1.00 43.32 H new ATOM 0 HD1 TYR A 99 -6.560 6.669 25.361 1.00 13.31 H new ATOM 0 HD2 TYR A 99 -8.427 7.727 21.704 1.00 22.54 H new ATOM 0 HE1 TYR A 99 -8.725 6.814 26.489 1.00 63.42 H new ATOM 0 HE2 TYR A 99 -10.577 7.866 22.826 1.00 34.34 H new ATOM 0 HH TYR A 99 -11.568 6.761 24.914 1.00 75.12 H new ATOM 947 N LEU A 100 -5.972 4.426 20.229 1.00 41.43 N ATOM 948 CA LEU A 100 -5.917 3.987 18.875 1.00 42.14 C ATOM 949 C LEU A 100 -7.340 3.622 18.444 1.00 73.11 C ATOM 950 O LEU A 100 -8.245 3.558 19.274 1.00 13.31 O ATOM 951 CB LEU A 100 -4.991 2.746 18.836 1.00 72.31 C ATOM 952 CG LEU A 100 -4.845 1.978 17.513 1.00 13.55 C ATOM 953 CD1 LEU A 100 -4.234 2.832 16.425 1.00 3.34 C ATOM 954 CD2 LEU A 100 -4.034 0.717 17.726 1.00 3.33 C ATOM 0 H LEU A 100 -6.356 3.711 20.847 1.00 41.43 H new ATOM 0 HA LEU A 100 -5.530 4.752 18.202 1.00 42.14 H new ATOM 0 HB2 LEU A 100 -3.996 3.066 19.144 1.00 72.31 H new ATOM 0 HB3 LEU A 100 -5.348 2.043 19.589 1.00 72.31 H new ATOM 0 HG LEU A 100 -5.846 1.703 17.179 1.00 13.55 H new ATOM 0 HD11 LEU A 100 -4.150 2.248 15.508 1.00 3.34 H new ATOM 0 HD12 LEU A 100 -4.868 3.701 16.245 1.00 3.34 H new ATOM 0 HD13 LEU A 100 -3.243 3.164 16.736 1.00 3.34 H new ATOM 0 HD21 LEU A 100 -3.938 0.182 16.781 1.00 3.33 H new ATOM 0 HD22 LEU A 100 -3.043 0.980 18.096 1.00 3.33 H new ATOM 0 HD23 LEU A 100 -4.536 0.080 18.454 1.00 3.33 H new ATOM 966 N LYS A 101 -7.536 3.405 17.170 1.00 22.22 N ATOM 967 CA LYS A 101 -8.828 3.002 16.634 1.00 33.43 C ATOM 968 C LYS A 101 -8.955 1.480 16.779 1.00 44.23 C ATOM 969 O LYS A 101 -8.186 0.857 17.531 1.00 64.05 O ATOM 970 CB LYS A 101 -8.891 3.374 15.146 1.00 64.41 C ATOM 971 CG LYS A 101 -8.676 4.848 14.830 1.00 23.12 C ATOM 972 CD LYS A 101 -9.761 5.721 15.418 1.00 72.14 C ATOM 973 CE LYS A 101 -9.582 7.176 15.010 1.00 61.30 C ATOM 974 NZ LYS A 101 -10.701 8.014 15.472 1.00 33.33 N ATOM 0 H LYS A 101 -6.806 3.501 16.464 1.00 22.22 H new ATOM 0 HA LYS A 101 -9.635 3.502 17.169 1.00 33.43 H new ATOM 0 HB2 LYS A 101 -8.140 2.792 14.612 1.00 64.41 H new ATOM 0 HB3 LYS A 101 -9.863 3.074 14.755 1.00 64.41 H new ATOM 0 HG2 LYS A 101 -7.708 5.164 15.218 1.00 23.12 H new ATOM 0 HG3 LYS A 101 -8.647 4.986 13.749 1.00 23.12 H new ATOM 0 HD2 LYS A 101 -10.736 5.365 15.086 1.00 72.14 H new ATOM 0 HD3 LYS A 101 -9.746 5.641 16.505 1.00 72.14 H new ATOM 0 HE2 LYS A 101 -8.648 7.557 15.423 1.00 61.30 H new ATOM 0 HE3 LYS A 101 -9.502 7.242 13.925 1.00 61.30 H new ATOM 0 HZ1 LYS A 101 -10.543 8.998 15.175 1.00 33.33 H new ATOM 0 HZ2 LYS A 101 -11.589 7.666 15.058 1.00 33.33 H new ATOM 0 HZ3 LYS A 101 -10.762 7.971 16.509 1.00 33.33 H new ATOM 988 N LYS A 102 -9.905 0.873 16.078 1.00 34.52 N ATOM 989 CA LYS A 102 -10.002 -0.587 16.057 1.00 23.21 C ATOM 990 C LYS A 102 -8.902 -1.160 15.125 1.00 73.24 C ATOM 991 O LYS A 102 -9.146 -1.601 14.005 1.00 3.32 O ATOM 992 CB LYS A 102 -11.447 -1.115 15.704 1.00 54.43 C ATOM 993 CG LYS A 102 -11.954 -0.923 14.282 1.00 13.41 C ATOM 994 CD LYS A 102 -12.201 0.514 13.911 1.00 74.22 C ATOM 995 CE LYS A 102 -12.797 0.564 12.536 1.00 11.33 C ATOM 996 NZ LYS A 102 -13.141 1.937 12.090 1.00 61.42 N ATOM 0 H LYS A 102 -10.611 1.357 15.523 1.00 34.52 H new ATOM 0 HA LYS A 102 -9.827 -0.954 17.068 1.00 23.21 H new ATOM 0 HB2 LYS A 102 -11.476 -2.182 15.927 1.00 54.43 H new ATOM 0 HB3 LYS A 102 -12.153 -0.630 16.378 1.00 54.43 H new ATOM 0 HG2 LYS A 102 -11.229 -1.348 13.588 1.00 13.41 H new ATOM 0 HG3 LYS A 102 -12.880 -1.484 14.158 1.00 13.41 H new ATOM 0 HD2 LYS A 102 -12.874 0.979 14.631 1.00 74.22 H new ATOM 0 HD3 LYS A 102 -11.268 1.076 13.938 1.00 74.22 H new ATOM 0 HE2 LYS A 102 -12.094 0.126 11.828 1.00 11.33 H new ATOM 0 HE3 LYS A 102 -13.696 -0.052 12.516 1.00 11.33 H new ATOM 0 HZ1 LYS A 102 -13.548 1.900 11.134 1.00 61.42 H new ATOM 0 HZ2 LYS A 102 -13.834 2.351 12.745 1.00 61.42 H new ATOM 0 HZ3 LYS A 102 -12.282 2.524 12.078 1.00 61.42 H new ATOM 1010 N LEU A 103 -7.681 -1.012 15.570 1.00 20.54 N ATOM 1011 CA LEU A 103 -6.510 -1.367 14.814 1.00 73.52 C ATOM 1012 C LEU A 103 -5.552 -2.201 15.652 1.00 1.04 C ATOM 1013 O LEU A 103 -5.534 -2.080 16.891 1.00 4.50 O ATOM 1014 CB LEU A 103 -5.811 -0.095 14.308 1.00 61.25 C ATOM 1015 CG LEU A 103 -6.623 0.772 13.345 1.00 60.34 C ATOM 1016 CD1 LEU A 103 -5.886 2.058 13.027 1.00 24.10 C ATOM 1017 CD2 LEU A 103 -6.930 0.005 12.067 1.00 20.12 C ATOM 0 H LEU A 103 -7.469 -0.631 16.492 1.00 20.54 H new ATOM 0 HA LEU A 103 -6.819 -1.969 13.959 1.00 73.52 H new ATOM 0 HB2 LEU A 103 -5.535 0.513 15.170 1.00 61.25 H new ATOM 0 HB3 LEU A 103 -4.884 -0.385 13.813 1.00 61.25 H new ATOM 0 HG LEU A 103 -7.565 1.029 13.830 1.00 60.34 H new ATOM 0 HD11 LEU A 103 -6.482 2.659 12.340 1.00 24.10 H new ATOM 0 HD12 LEU A 103 -5.718 2.618 13.947 1.00 24.10 H new ATOM 0 HD13 LEU A 103 -4.927 1.823 12.565 1.00 24.10 H new ATOM 0 HD21 LEU A 103 -7.508 0.637 11.393 1.00 20.12 H new ATOM 0 HD22 LEU A 103 -5.997 -0.283 11.583 1.00 20.12 H new ATOM 0 HD23 LEU A 103 -7.505 -0.889 12.308 1.00 20.12 H new ATOM 1029 N PRO A 104 -4.813 -3.102 15.013 1.00 1.10 N ATOM 1030 CA PRO A 104 -3.763 -3.877 15.665 1.00 0.54 C ATOM 1031 C PRO A 104 -2.480 -3.029 15.836 1.00 72.11 C ATOM 1032 O PRO A 104 -2.497 -1.810 15.642 1.00 51.10 O ATOM 1033 CB PRO A 104 -3.519 -5.020 14.679 1.00 63.52 C ATOM 1034 CG PRO A 104 -3.835 -4.434 13.357 1.00 42.51 C ATOM 1035 CD PRO A 104 -4.946 -3.454 13.585 1.00 14.51 C ATOM 0 HA PRO A 104 -4.037 -4.215 16.664 1.00 0.54 H new ATOM 0 HB2 PRO A 104 -2.488 -5.370 14.723 1.00 63.52 H new ATOM 0 HB3 PRO A 104 -4.156 -5.877 14.897 1.00 63.52 H new ATOM 0 HG2 PRO A 104 -2.961 -3.939 12.932 1.00 42.51 H new ATOM 0 HG3 PRO A 104 -4.138 -5.208 12.651 1.00 42.51 H new ATOM 0 HD2 PRO A 104 -4.845 -2.577 12.945 1.00 14.51 H new ATOM 0 HD3 PRO A 104 -5.919 -3.895 13.370 1.00 14.51 H new ATOM 1043 N VAL A 105 -1.385 -3.672 16.189 1.00 13.35 N ATOM 1044 CA VAL A 105 -0.120 -2.979 16.383 1.00 4.21 C ATOM 1045 C VAL A 105 0.528 -2.716 14.998 1.00 5.21 C ATOM 1046 O VAL A 105 0.097 -3.324 14.002 1.00 35.31 O ATOM 1047 CB VAL A 105 0.810 -3.807 17.314 1.00 12.20 C ATOM 1048 CG1 VAL A 105 1.382 -5.050 16.641 1.00 12.42 C ATOM 1049 CG2 VAL A 105 1.889 -2.956 17.921 1.00 53.22 C ATOM 0 H VAL A 105 -1.343 -4.679 16.349 1.00 13.35 H new ATOM 0 HA VAL A 105 -0.288 -2.019 16.872 1.00 4.21 H new ATOM 0 HB VAL A 105 0.178 -4.169 18.125 1.00 12.20 H new ATOM 0 HG11 VAL A 105 2.022 -5.583 17.344 1.00 12.42 H new ATOM 0 HG12 VAL A 105 0.567 -5.702 16.327 1.00 12.42 H new ATOM 0 HG13 VAL A 105 1.967 -4.755 15.770 1.00 12.42 H new ATOM 0 HG21 VAL A 105 2.518 -3.571 18.565 1.00 53.22 H new ATOM 0 HG22 VAL A 105 2.497 -2.520 17.129 1.00 53.22 H new ATOM 0 HG23 VAL A 105 1.436 -2.159 18.510 1.00 53.22 H new ATOM 1059 N ASP A 106 1.552 -1.857 14.920 1.00 65.03 N ATOM 1060 CA ASP A 106 2.081 -1.462 13.604 1.00 43.24 C ATOM 1061 C ASP A 106 2.991 -2.571 13.087 1.00 62.02 C ATOM 1062 O ASP A 106 3.467 -3.401 13.894 1.00 64.30 O ATOM 1063 CB ASP A 106 2.839 -0.101 13.683 1.00 32.22 C ATOM 1064 CG ASP A 106 2.633 0.760 12.445 1.00 34.23 C ATOM 1065 OD1 ASP A 106 1.493 1.280 12.246 1.00 3.41 O ATOM 1066 OD2 ASP A 106 3.572 0.910 11.672 1.00 41.13 O ATOM 0 H ASP A 106 2.019 -1.433 15.721 1.00 65.03 H new ATOM 0 HA ASP A 106 1.252 -1.321 12.910 1.00 43.24 H new ATOM 0 HB2 ASP A 106 2.501 0.448 14.562 1.00 32.22 H new ATOM 0 HB3 ASP A 106 3.904 -0.290 13.815 1.00 32.22 H new ATOM 1071 N PRO A 107 3.157 -2.704 11.750 1.00 72.31 N ATOM 1072 CA PRO A 107 4.071 -3.671 11.144 1.00 74.21 C ATOM 1073 C PRO A 107 5.492 -3.653 11.721 1.00 74.22 C ATOM 1074 O PRO A 107 5.849 -2.808 12.525 1.00 53.24 O ATOM 1075 CB PRO A 107 4.116 -3.273 9.689 1.00 13.31 C ATOM 1076 CG PRO A 107 2.803 -2.632 9.432 1.00 53.23 C ATOM 1077 CD PRO A 107 2.414 -1.955 10.710 1.00 73.10 C ATOM 0 HA PRO A 107 3.713 -4.683 11.331 1.00 74.21 H new ATOM 0 HB2 PRO A 107 4.938 -2.585 9.492 1.00 13.31 H new ATOM 0 HB3 PRO A 107 4.266 -4.140 9.046 1.00 13.31 H new ATOM 0 HG2 PRO A 107 2.873 -1.913 8.616 1.00 53.23 H new ATOM 0 HG3 PRO A 107 2.058 -3.373 9.141 1.00 53.23 H new ATOM 0 HD2 PRO A 107 2.690 -0.900 10.703 1.00 73.10 H new ATOM 0 HD3 PRO A 107 1.338 -2.002 10.876 1.00 73.10 H new ATOM 1085 N TRP A 108 6.277 -4.640 11.287 1.00 41.23 N ATOM 1086 CA TRP A 108 7.678 -4.902 11.697 1.00 34.51 C ATOM 1087 C TRP A 108 7.707 -5.395 13.147 1.00 15.04 C ATOM 1088 O TRP A 108 8.765 -5.463 13.787 1.00 55.51 O ATOM 1089 CB TRP A 108 8.593 -3.653 11.587 1.00 21.34 C ATOM 1090 CG TRP A 108 8.416 -2.853 10.345 1.00 45.14 C ATOM 1091 CD1 TRP A 108 8.702 -3.223 9.076 1.00 40.00 C ATOM 1092 CD2 TRP A 108 7.906 -1.526 10.284 1.00 2.04 C ATOM 1093 NE1 TRP A 108 8.397 -2.197 8.207 1.00 0.21 N ATOM 1094 CE2 TRP A 108 7.894 -1.138 8.942 1.00 50.04 C ATOM 1095 CE3 TRP A 108 7.448 -0.632 11.256 1.00 24.54 C ATOM 1096 CZ2 TRP A 108 7.437 0.117 8.546 1.00 11.30 C ATOM 1097 CZ3 TRP A 108 6.993 0.593 10.873 1.00 64.22 C ATOM 1098 CH2 TRP A 108 6.986 0.967 9.540 1.00 20.41 C ATOM 0 H TRP A 108 5.945 -5.320 10.603 1.00 41.23 H new ATOM 0 HA TRP A 108 8.063 -5.657 11.011 1.00 34.51 H new ATOM 0 HB2 TRP A 108 8.408 -3.008 12.446 1.00 21.34 H new ATOM 0 HB3 TRP A 108 9.632 -3.976 11.649 1.00 21.34 H new ATOM 0 HD1 TRP A 108 9.109 -4.180 8.786 1.00 40.00 H new ATOM 0 HE1 TRP A 108 8.521 -2.215 7.195 1.00 0.21 H new ATOM 0 HE3 TRP A 108 7.455 -0.910 12.300 1.00 24.54 H new ATOM 0 HZ2 TRP A 108 7.435 0.414 7.508 1.00 11.30 H new ATOM 0 HZ3 TRP A 108 6.632 1.284 11.621 1.00 64.22 H new ATOM 0 HH2 TRP A 108 6.620 1.946 9.270 1.00 20.41 H new ATOM 1109 N GLY A 109 6.540 -5.785 13.623 1.00 22.54 N ATOM 1110 CA GLY A 109 6.347 -6.239 14.997 1.00 60.24 C ATOM 1111 C GLY A 109 6.612 -5.172 16.048 1.00 31.11 C ATOM 1112 O GLY A 109 6.729 -5.479 17.242 1.00 22.11 O ATOM 0 H GLY A 109 5.687 -5.798 13.065 1.00 22.54 H new ATOM 0 HA2 GLY A 109 5.324 -6.598 15.109 1.00 60.24 H new ATOM 0 HA3 GLY A 109 7.005 -7.088 15.183 1.00 60.24 H new ATOM 1116 N ASN A 110 6.702 -3.945 15.623 1.00 62.02 N ATOM 1117 CA ASN A 110 6.951 -2.854 16.503 1.00 70.41 C ATOM 1118 C ASN A 110 5.682 -2.341 17.120 1.00 74.41 C ATOM 1119 O ASN A 110 4.633 -2.173 16.441 1.00 2.52 O ATOM 1120 CB ASN A 110 7.736 -1.732 15.820 1.00 64.10 C ATOM 1121 CG ASN A 110 9.163 -2.135 15.518 1.00 3.23 C ATOM 1122 OD1 ASN A 110 9.772 -2.931 16.236 1.00 13.44 O ATOM 1123 ND2 ASN A 110 9.715 -1.585 14.494 1.00 5.43 N ATOM 0 H ASN A 110 6.603 -3.677 14.644 1.00 62.02 H new ATOM 0 HA ASN A 110 7.577 -3.235 17.310 1.00 70.41 H new ATOM 0 HB2 ASN A 110 7.235 -1.453 14.893 1.00 64.10 H new ATOM 0 HB3 ASN A 110 7.737 -0.850 16.460 1.00 64.10 H new ATOM 0 HD21 ASN A 110 10.683 -1.804 14.257 1.00 5.43 H new ATOM 0 HD22 ASN A 110 9.185 -0.930 13.919 1.00 5.43 H new ATOM 1130 N PRO A 111 5.727 -2.145 18.430 1.00 65.31 N ATOM 1131 CA PRO A 111 4.621 -1.625 19.172 1.00 53.33 C ATOM 1132 C PRO A 111 4.464 -0.150 18.947 1.00 70.53 C ATOM 1133 O PRO A 111 5.408 0.524 18.552 1.00 61.31 O ATOM 1134 CB PRO A 111 4.995 -1.907 20.621 1.00 52.44 C ATOM 1135 CG PRO A 111 6.476 -1.874 20.636 1.00 12.35 C ATOM 1136 CD PRO A 111 6.905 -2.406 19.303 1.00 53.35 C ATOM 0 HA PRO A 111 3.673 -2.075 18.879 1.00 53.33 H new ATOM 0 HB2 PRO A 111 4.575 -1.158 21.292 1.00 52.44 H new ATOM 0 HB3 PRO A 111 4.616 -2.876 20.947 1.00 52.44 H new ATOM 0 HG2 PRO A 111 6.844 -0.860 20.790 1.00 12.35 H new ATOM 0 HG3 PRO A 111 6.873 -2.484 21.448 1.00 12.35 H new ATOM 0 HD2 PRO A 111 7.797 -1.898 18.936 1.00 53.35 H new ATOM 0 HD3 PRO A 111 7.141 -3.469 19.352 1.00 53.35 H new ATOM 1144 N TYR A 112 3.278 0.351 19.123 1.00 30.22 N ATOM 1145 CA TYR A 112 3.122 1.761 19.099 1.00 34.43 C ATOM 1146 C TYR A 112 3.761 2.294 20.356 1.00 64.23 C ATOM 1147 O TYR A 112 3.584 1.720 21.458 1.00 42.11 O ATOM 1148 CB TYR A 112 1.649 2.202 18.991 1.00 74.44 C ATOM 1149 CG TYR A 112 1.032 2.035 17.609 1.00 12.15 C ATOM 1150 CD1 TYR A 112 1.284 2.969 16.608 1.00 72.30 C ATOM 1151 CD2 TYR A 112 0.184 0.973 17.311 1.00 54.22 C ATOM 1152 CE1 TYR A 112 0.716 2.852 15.347 1.00 65.53 C ATOM 1153 CE2 TYR A 112 -0.387 0.844 16.051 1.00 3.51 C ATOM 1154 CZ TYR A 112 -0.121 1.784 15.072 1.00 33.13 C ATOM 1155 OH TYR A 112 -0.709 1.657 13.823 1.00 64.34 O ATOM 0 H TYR A 112 2.426 -0.187 19.281 1.00 30.22 H new ATOM 0 HA TYR A 112 3.603 2.165 18.208 1.00 34.43 H new ATOM 0 HB2 TYR A 112 1.060 1.630 19.708 1.00 74.44 H new ATOM 0 HB3 TYR A 112 1.576 3.250 19.282 1.00 74.44 H new ATOM 0 HD1 TYR A 112 1.936 3.804 16.817 1.00 72.30 H new ATOM 0 HD2 TYR A 112 -0.034 0.237 18.071 1.00 54.22 H new ATOM 0 HE1 TYR A 112 0.925 3.589 14.586 1.00 65.53 H new ATOM 0 HE2 TYR A 112 -1.038 0.010 15.836 1.00 3.51 H new ATOM 0 HH TYR A 112 -0.014 1.515 13.147 1.00 64.34 H new ATOM 1165 N GLN A 113 4.487 3.336 20.216 1.00 41.11 N ATOM 1166 CA GLN A 113 5.175 3.915 21.327 1.00 0.34 C ATOM 1167 C GLN A 113 4.367 5.109 21.709 1.00 73.42 C ATOM 1168 O GLN A 113 4.233 6.069 20.930 1.00 52.24 O ATOM 1169 CB GLN A 113 6.582 4.458 20.959 1.00 72.12 C ATOM 1170 CG GLN A 113 7.391 3.731 19.881 1.00 63.22 C ATOM 1171 CD GLN A 113 7.758 2.288 20.143 1.00 54.02 C ATOM 1172 OE1 GLN A 113 7.915 1.515 19.182 1.00 50.55 O ATOM 1173 NE2 GLN A 113 7.947 1.917 21.400 1.00 13.14 N ATOM 0 H GLN A 113 4.628 3.821 19.330 1.00 41.11 H new ATOM 0 HA GLN A 113 5.294 3.156 22.100 1.00 0.34 H new ATOM 0 HB2 GLN A 113 6.464 5.494 20.642 1.00 72.12 H new ATOM 0 HB3 GLN A 113 7.181 4.470 21.870 1.00 72.12 H new ATOM 0 HG2 GLN A 113 6.825 3.771 18.950 1.00 63.22 H new ATOM 0 HG3 GLN A 113 8.313 4.289 19.718 1.00 63.22 H new ATOM 0 HE21 GLN A 113 7.806 2.587 22.156 1.00 13.14 H new ATOM 0 HE22 GLN A 113 8.234 0.961 21.612 1.00 13.14 H new ATOM 1182 N TYR A 114 3.807 5.046 22.860 1.00 52.23 N ATOM 1183 CA TYR A 114 3.014 6.115 23.354 1.00 34.44 C ATOM 1184 C TYR A 114 3.775 6.879 24.396 1.00 41.44 C ATOM 1185 O TYR A 114 4.202 6.320 25.407 1.00 64.24 O ATOM 1186 CB TYR A 114 1.660 5.592 23.898 1.00 1.25 C ATOM 1187 CG TYR A 114 1.680 4.175 24.509 1.00 65.02 C ATOM 1188 CD1 TYR A 114 2.596 3.789 25.479 1.00 32.35 C ATOM 1189 CD2 TYR A 114 0.759 3.236 24.097 1.00 5.24 C ATOM 1190 CE1 TYR A 114 2.583 2.516 26.003 1.00 52.21 C ATOM 1191 CE2 TYR A 114 0.731 1.961 24.618 1.00 54.32 C ATOM 1192 CZ TYR A 114 1.644 1.607 25.566 1.00 45.20 C ATOM 1193 OH TYR A 114 1.617 0.341 26.094 1.00 55.01 O ATOM 0 H TYR A 114 3.885 4.249 23.491 1.00 52.23 H new ATOM 0 HA TYR A 114 2.788 6.797 22.534 1.00 34.44 H new ATOM 0 HB2 TYR A 114 1.302 6.288 24.656 1.00 1.25 H new ATOM 0 HB3 TYR A 114 0.934 5.606 23.085 1.00 1.25 H new ATOM 0 HD1 TYR A 114 3.331 4.499 25.828 1.00 32.35 H new ATOM 0 HD2 TYR A 114 0.036 3.508 23.342 1.00 5.24 H new ATOM 0 HE1 TYR A 114 3.306 2.231 26.753 1.00 52.21 H new ATOM 0 HE2 TYR A 114 -0.007 1.249 24.279 1.00 54.32 H new ATOM 0 HH TYR A 114 0.893 -0.172 25.677 1.00 55.01 H new ATOM 1203 N LEU A 115 4.005 8.122 24.121 1.00 34.55 N ATOM 1204 CA LEU A 115 4.650 9.006 25.040 1.00 52.33 C ATOM 1205 C LEU A 115 3.818 10.255 25.176 1.00 3.21 C ATOM 1206 O LEU A 115 3.087 10.624 24.244 1.00 1.24 O ATOM 1207 CB LEU A 115 6.067 9.346 24.580 1.00 41.15 C ATOM 1208 CG LEU A 115 7.049 8.178 24.432 1.00 22.03 C ATOM 1209 CD1 LEU A 115 8.383 8.679 23.919 1.00 5.42 C ATOM 1210 CD2 LEU A 115 7.237 7.464 25.761 1.00 2.32 C ATOM 0 H LEU A 115 3.746 8.560 23.237 1.00 34.55 H new ATOM 0 HA LEU A 115 4.736 8.515 26.009 1.00 52.33 H new ATOM 0 HB2 LEU A 115 5.998 9.855 23.619 1.00 41.15 H new ATOM 0 HB3 LEU A 115 6.491 10.058 25.288 1.00 41.15 H new ATOM 0 HG LEU A 115 6.635 7.470 23.714 1.00 22.03 H new ATOM 0 HD11 LEU A 115 9.072 7.841 23.818 1.00 5.42 H new ATOM 0 HD12 LEU A 115 8.244 9.154 22.948 1.00 5.42 H new ATOM 0 HD13 LEU A 115 8.794 9.404 24.622 1.00 5.42 H new ATOM 0 HD21 LEU A 115 7.937 6.638 25.635 1.00 2.32 H new ATOM 0 HD22 LEU A 115 7.631 8.164 26.498 1.00 2.32 H new ATOM 0 HD23 LEU A 115 6.278 7.077 26.105 1.00 2.32 H new ATOM 1222 N ALA A 116 3.917 10.903 26.288 1.00 63.25 N ATOM 1223 CA ALA A 116 3.188 12.089 26.524 1.00 32.14 C ATOM 1224 C ALA A 116 4.191 13.268 26.503 1.00 21.43 C ATOM 1225 O ALA A 116 5.364 12.990 26.245 1.00 13.23 O ATOM 1226 CB ALA A 116 2.372 11.926 27.767 1.00 43.42 C ATOM 0 H ALA A 116 4.515 10.615 27.063 1.00 63.25 H new ATOM 0 HA ALA A 116 2.453 12.312 25.751 1.00 32.14 H new ATOM 0 HB1 ALA A 116 1.807 12.839 27.954 1.00 43.42 H new ATOM 0 HB2 ALA A 116 1.682 11.092 27.642 1.00 43.42 H new ATOM 0 HB3 ALA A 116 3.032 11.728 28.612 1.00 43.42 H new ATOM 1232 N PRO A 117 3.799 14.573 26.758 1.00 44.42 N ATOM 1233 CA PRO A 117 4.650 15.729 26.454 1.00 74.04 C ATOM 1234 C PRO A 117 6.074 15.618 26.916 1.00 43.34 C ATOM 1235 O PRO A 117 6.378 15.591 28.127 1.00 64.33 O ATOM 1236 CB PRO A 117 3.934 16.934 27.054 1.00 2.31 C ATOM 1237 CG PRO A 117 2.982 16.350 28.029 1.00 61.23 C ATOM 1238 CD PRO A 117 2.598 15.012 27.469 1.00 63.23 C ATOM 0 HA PRO A 117 4.770 15.814 25.374 1.00 74.04 H new ATOM 0 HB2 PRO A 117 4.636 17.611 27.541 1.00 2.31 H new ATOM 0 HB3 PRO A 117 3.415 17.510 26.288 1.00 2.31 H new ATOM 0 HG2 PRO A 117 3.442 16.246 29.012 1.00 61.23 H new ATOM 0 HG3 PRO A 117 2.107 16.988 28.153 1.00 61.23 H new ATOM 0 HD2 PRO A 117 2.322 14.312 28.258 1.00 63.23 H new ATOM 0 HD3 PRO A 117 1.742 15.090 26.798 1.00 63.23 H new ATOM 1289 N GLY A 121 6.216 19.289 23.273 1.00 72.05 N ATOM 1290 CA GLY A 121 4.986 18.915 22.639 1.00 41.24 C ATOM 1291 C GLY A 121 4.103 18.045 23.464 1.00 44.14 C ATOM 1292 O GLY A 121 4.585 17.088 24.031 1.00 51.33 O ATOM 0 HA2 GLY A 121 4.439 19.820 22.375 1.00 41.24 H new ATOM 0 HA3 GLY A 121 5.215 18.398 21.707 1.00 41.24 H new ATOM 1296 N PRO A 122 2.777 18.408 23.545 1.00 24.31 N ATOM 1297 CA PRO A 122 1.685 17.682 24.256 1.00 42.30 C ATOM 1298 C PRO A 122 1.677 16.151 24.191 1.00 33.53 C ATOM 1299 O PRO A 122 1.009 15.526 25.009 1.00 30.03 O ATOM 1300 CB PRO A 122 0.467 18.219 23.560 1.00 53.30 C ATOM 1301 CG PRO A 122 0.793 19.638 23.379 1.00 4.25 C ATOM 1302 CD PRO A 122 2.227 19.659 22.966 1.00 11.34 C ATOM 0 HA PRO A 122 1.777 17.851 25.329 1.00 42.30 H new ATOM 0 HB2 PRO A 122 0.293 17.720 22.607 1.00 53.30 H new ATOM 0 HB3 PRO A 122 -0.433 18.084 24.159 1.00 53.30 H new ATOM 0 HG2 PRO A 122 0.158 20.095 22.620 1.00 4.25 H new ATOM 0 HG3 PRO A 122 0.640 20.198 24.302 1.00 4.25 H new ATOM 0 HD2 PRO A 122 2.331 19.678 21.881 1.00 11.34 H new ATOM 0 HD3 PRO A 122 2.742 20.539 23.351 1.00 11.34 H new ATOM 1310 N PHE A 123 2.337 15.557 23.216 1.00 4.04 N ATOM 1311 CA PHE A 123 2.495 14.101 23.178 1.00 5.32 C ATOM 1312 C PHE A 123 3.458 13.718 22.102 1.00 44.11 C ATOM 1313 O PHE A 123 3.793 14.548 21.261 1.00 21.02 O ATOM 1314 CB PHE A 123 1.149 13.309 23.039 1.00 23.42 C ATOM 1315 CG PHE A 123 0.352 13.515 21.769 1.00 32.53 C ATOM 1316 CD1 PHE A 123 -0.595 14.521 21.681 1.00 73.14 C ATOM 1317 CD2 PHE A 123 0.524 12.666 20.682 1.00 2.44 C ATOM 1318 CE1 PHE A 123 -1.351 14.680 20.538 1.00 72.35 C ATOM 1319 CE2 PHE A 123 -0.225 12.827 19.534 1.00 54.33 C ATOM 1320 CZ PHE A 123 -1.165 13.833 19.462 1.00 51.12 C ATOM 0 H PHE A 123 2.774 16.051 22.438 1.00 4.04 H new ATOM 0 HA PHE A 123 2.894 13.813 24.150 1.00 5.32 H new ATOM 0 HB2 PHE A 123 1.372 12.246 23.129 1.00 23.42 H new ATOM 0 HB3 PHE A 123 0.513 13.574 23.884 1.00 23.42 H new ATOM 0 HD1 PHE A 123 -0.744 15.189 22.517 1.00 73.14 H new ATOM 0 HD2 PHE A 123 1.253 11.871 20.736 1.00 2.44 H new ATOM 0 HE1 PHE A 123 -2.089 15.467 20.484 1.00 72.35 H new ATOM 0 HE2 PHE A 123 -0.075 12.166 18.693 1.00 54.33 H new ATOM 0 HZ PHE A 123 -1.755 13.959 18.566 1.00 51.12 H new ATOM 1330 N ASP A 124 3.914 12.488 22.144 1.00 2.10 N ATOM 1331 CA ASP A 124 4.799 11.935 21.127 1.00 52.30 C ATOM 1332 C ASP A 124 4.309 10.560 20.765 1.00 74.02 C ATOM 1333 O ASP A 124 4.370 9.637 21.579 1.00 12.32 O ATOM 1334 CB ASP A 124 6.273 11.839 21.586 1.00 62.12 C ATOM 1335 CG ASP A 124 6.986 13.158 21.713 1.00 11.20 C ATOM 1336 OD1 ASP A 124 7.362 13.751 20.682 1.00 61.35 O ATOM 1337 OD2 ASP A 124 7.224 13.621 22.844 1.00 60.12 O ATOM 0 H ASP A 124 3.683 11.831 22.889 1.00 2.10 H new ATOM 0 HA ASP A 124 4.777 12.611 20.273 1.00 52.30 H new ATOM 0 HB2 ASP A 124 6.305 11.331 22.550 1.00 62.12 H new ATOM 0 HB3 ASP A 124 6.818 11.215 20.878 1.00 62.12 H new ATOM 1342 N LEU A 125 3.792 10.414 19.577 1.00 11.54 N ATOM 1343 CA LEU A 125 3.287 9.141 19.151 1.00 14.34 C ATOM 1344 C LEU A 125 4.068 8.678 17.940 1.00 34.42 C ATOM 1345 O LEU A 125 4.217 9.430 16.982 1.00 74.53 O ATOM 1346 CB LEU A 125 1.770 9.265 18.863 1.00 54.35 C ATOM 1347 CG LEU A 125 0.978 7.993 18.480 1.00 22.32 C ATOM 1348 CD1 LEU A 125 1.295 7.503 17.070 1.00 14.14 C ATOM 1349 CD2 LEU A 125 1.188 6.882 19.507 1.00 45.04 C ATOM 0 H LEU A 125 3.710 11.161 18.887 1.00 11.54 H new ATOM 0 HA LEU A 125 3.413 8.391 19.932 1.00 14.34 H new ATOM 0 HB2 LEU A 125 1.300 9.692 19.749 1.00 54.35 H new ATOM 0 HB3 LEU A 125 1.645 9.987 18.056 1.00 54.35 H new ATOM 0 HG LEU A 125 -0.076 8.271 18.485 1.00 22.32 H new ATOM 0 HD11 LEU A 125 0.711 6.608 16.856 1.00 14.14 H new ATOM 0 HD12 LEU A 125 1.044 8.281 16.349 1.00 14.14 H new ATOM 0 HD13 LEU A 125 2.357 7.269 16.996 1.00 14.14 H new ATOM 0 HD21 LEU A 125 0.619 6.001 19.211 1.00 45.04 H new ATOM 0 HD22 LEU A 125 2.247 6.630 19.559 1.00 45.04 H new ATOM 0 HD23 LEU A 125 0.848 7.222 20.485 1.00 45.04 H new ATOM 1361 N TYR A 126 4.554 7.453 17.986 1.00 3.33 N ATOM 1362 CA TYR A 126 5.324 6.875 16.890 1.00 43.01 C ATOM 1363 C TYR A 126 5.464 5.399 17.089 1.00 15.23 C ATOM 1364 O TYR A 126 5.085 4.896 18.115 1.00 2.02 O ATOM 1365 CB TYR A 126 6.729 7.543 16.717 1.00 13.21 C ATOM 1366 CG TYR A 126 7.683 7.429 17.904 1.00 72.44 C ATOM 1367 CD1 TYR A 126 7.535 8.254 19.011 1.00 40.43 C ATOM 1368 CD2 TYR A 126 8.746 6.510 17.910 1.00 10.31 C ATOM 1369 CE1 TYR A 126 8.394 8.176 20.081 1.00 35.11 C ATOM 1370 CE2 TYR A 126 9.606 6.435 18.984 1.00 42.21 C ATOM 1371 CZ TYR A 126 9.429 7.268 20.062 1.00 64.13 C ATOM 1372 OH TYR A 126 10.293 7.182 21.135 1.00 64.35 O ATOM 0 H TYR A 126 4.429 6.827 18.781 1.00 3.33 H new ATOM 0 HA TYR A 126 4.773 7.070 15.970 1.00 43.01 H new ATOM 0 HB2 TYR A 126 7.213 7.102 15.846 1.00 13.21 H new ATOM 0 HB3 TYR A 126 6.580 8.600 16.498 1.00 13.21 H new ATOM 0 HD1 TYR A 126 6.728 8.972 19.032 1.00 40.43 H new ATOM 0 HD2 TYR A 126 8.891 5.855 17.063 1.00 10.31 H new ATOM 0 HE1 TYR A 126 8.258 8.825 20.934 1.00 35.11 H new ATOM 0 HE2 TYR A 126 10.418 5.723 18.978 1.00 42.21 H new ATOM 0 HH TYR A 126 10.965 6.490 20.960 1.00 64.35 H new ATOM 1382 N SER A 127 5.922 4.726 16.096 1.00 15.10 N ATOM 1383 CA SER A 127 6.288 3.344 16.190 1.00 62.11 C ATOM 1384 C SER A 127 7.717 3.279 15.732 1.00 63.03 C ATOM 1385 O SER A 127 8.095 4.059 14.837 1.00 74.03 O ATOM 1386 CB SER A 127 5.426 2.498 15.260 1.00 40.12 C ATOM 1387 OG SER A 127 4.050 2.756 15.465 1.00 22.40 O ATOM 0 H SER A 127 6.059 5.124 15.167 1.00 15.10 H new ATOM 0 HA SER A 127 6.153 2.965 17.203 1.00 62.11 H new ATOM 0 HB2 SER A 127 5.688 2.710 14.223 1.00 40.12 H new ATOM 0 HB3 SER A 127 5.630 1.441 15.431 1.00 40.12 H new ATOM 0 HG SER A 127 3.542 2.468 14.678 1.00 22.40 H new ATOM 1393 N LEU A 128 8.530 2.445 16.353 1.00 1.53 N ATOM 1394 CA LEU A 128 9.913 2.287 15.887 1.00 22.23 C ATOM 1395 C LEU A 128 9.971 1.804 14.430 1.00 14.13 C ATOM 1396 O LEU A 128 9.112 1.026 13.986 1.00 34.14 O ATOM 1397 CB LEU A 128 10.694 1.340 16.804 1.00 53.33 C ATOM 1398 CG LEU A 128 11.571 2.013 17.889 1.00 15.31 C ATOM 1399 CD1 LEU A 128 10.788 2.992 18.731 1.00 44.41 C ATOM 1400 CD2 LEU A 128 12.213 0.971 18.778 1.00 25.41 C ATOM 0 H LEU A 128 8.276 1.876 17.161 1.00 1.53 H new ATOM 0 HA LEU A 128 10.383 3.270 15.926 1.00 22.23 H new ATOM 0 HB2 LEU A 128 9.984 0.678 17.299 1.00 53.33 H new ATOM 0 HB3 LEU A 128 11.335 0.713 16.184 1.00 53.33 H new ATOM 0 HG LEU A 128 12.347 2.572 17.366 1.00 15.31 H new ATOM 0 HD11 LEU A 128 11.446 3.438 19.477 1.00 44.41 H new ATOM 0 HD12 LEU A 128 10.380 3.776 18.093 1.00 44.41 H new ATOM 0 HD13 LEU A 128 9.972 2.470 19.232 1.00 44.41 H new ATOM 0 HD21 LEU A 128 12.825 1.464 19.533 1.00 25.41 H new ATOM 0 HD22 LEU A 128 11.437 0.382 19.267 1.00 25.41 H new ATOM 0 HD23 LEU A 128 12.840 0.315 18.175 1.00 25.41 H new ATOM 1412 N GLY A 129 10.948 2.310 13.687 1.00 42.35 N ATOM 1413 CA GLY A 129 11.142 1.908 12.297 1.00 52.23 C ATOM 1414 C GLY A 129 11.497 0.446 12.127 1.00 75.12 C ATOM 1415 O GLY A 129 11.767 -0.275 13.103 1.00 62.35 O ATOM 0 H GLY A 129 11.619 3.000 14.023 1.00 42.35 H new ATOM 0 HA2 GLY A 129 10.231 2.118 11.737 1.00 52.23 H new ATOM 0 HA3 GLY A 129 11.933 2.517 11.859 1.00 52.23 H new ATOM 1419 N ALA A 130 11.567 0.025 10.877 1.00 65.33 N ATOM 1420 CA ALA A 130 11.827 -1.369 10.478 1.00 44.31 C ATOM 1421 C ALA A 130 13.209 -1.904 10.886 1.00 11.41 C ATOM 1422 O ALA A 130 13.575 -3.039 10.541 1.00 4.41 O ATOM 1423 CB ALA A 130 11.662 -1.499 8.994 1.00 60.21 C ATOM 0 H ALA A 130 11.443 0.651 10.081 1.00 65.33 H new ATOM 0 HA ALA A 130 11.100 -1.976 11.017 1.00 44.31 H new ATOM 0 HB1 ALA A 130 11.854 -2.530 8.695 1.00 60.21 H new ATOM 0 HB2 ALA A 130 10.645 -1.224 8.716 1.00 60.21 H new ATOM 0 HB3 ALA A 130 12.367 -0.838 8.490 1.00 60.21 H new ATOM 1429 N ASP A 131 13.953 -1.123 11.620 1.00 71.03 N ATOM 1430 CA ASP A 131 15.255 -1.537 12.084 1.00 13.12 C ATOM 1431 C ASP A 131 15.101 -2.132 13.477 1.00 2.21 C ATOM 1432 O ASP A 131 16.007 -2.764 14.011 1.00 63.44 O ATOM 1433 CB ASP A 131 16.197 -0.322 12.121 1.00 4.52 C ATOM 1434 CG ASP A 131 17.629 -0.671 12.472 1.00 32.33 C ATOM 1435 OD1 ASP A 131 18.373 -1.164 11.583 1.00 42.42 O ATOM 1436 OD2 ASP A 131 18.065 -0.417 13.613 1.00 23.33 O ATOM 0 H ASP A 131 13.679 -0.186 11.914 1.00 71.03 H new ATOM 0 HA ASP A 131 15.680 -2.283 11.413 1.00 13.12 H new ATOM 0 HB2 ASP A 131 16.180 0.169 11.148 1.00 4.52 H new ATOM 0 HB3 ASP A 131 15.819 0.397 12.848 1.00 4.52 H new ATOM 1441 N GLY A 132 13.910 -1.960 14.045 1.00 23.33 N ATOM 1442 CA GLY A 132 13.613 -2.480 15.374 1.00 11.20 C ATOM 1443 C GLY A 132 14.099 -1.548 16.454 1.00 32.40 C ATOM 1444 O GLY A 132 13.893 -1.783 17.649 1.00 33.13 O ATOM 0 H GLY A 132 13.135 -1.464 13.604 1.00 23.33 H new ATOM 0 HA2 GLY A 132 12.538 -2.627 15.476 1.00 11.20 H new ATOM 0 HA3 GLY A 132 14.082 -3.456 15.497 1.00 11.20 H new ATOM 1448 N LYS A 133 14.714 -0.489 16.021 1.00 51.43 N ATOM 1449 CA LYS A 133 15.306 0.502 16.852 1.00 43.34 C ATOM 1450 C LYS A 133 15.012 1.842 16.201 1.00 41.21 C ATOM 1451 O LYS A 133 14.837 1.878 14.978 1.00 41.43 O ATOM 1452 CB LYS A 133 16.809 0.275 17.003 1.00 62.42 C ATOM 1453 CG LYS A 133 17.375 1.061 18.142 1.00 42.43 C ATOM 1454 CD LYS A 133 18.867 0.983 18.267 1.00 62.10 C ATOM 1455 CE LYS A 133 19.312 1.798 19.471 1.00 60.42 C ATOM 1456 NZ LYS A 133 18.755 3.185 19.450 1.00 3.02 N ATOM 0 H LYS A 133 14.819 -0.288 15.027 1.00 51.43 H new ATOM 0 HA LYS A 133 14.893 0.461 17.860 1.00 43.34 H new ATOM 0 HB2 LYS A 133 17.003 -0.786 17.161 1.00 62.42 H new ATOM 0 HB3 LYS A 133 17.314 0.557 16.079 1.00 62.42 H new ATOM 0 HG2 LYS A 133 17.086 2.106 18.026 1.00 42.43 H new ATOM 0 HG3 LYS A 133 16.926 0.708 19.070 1.00 42.43 H new ATOM 0 HD2 LYS A 133 19.181 -0.055 18.380 1.00 62.10 H new ATOM 0 HD3 LYS A 133 19.340 1.362 17.361 1.00 62.10 H new ATOM 0 HE2 LYS A 133 18.996 1.295 20.385 1.00 60.42 H new ATOM 0 HE3 LYS A 133 20.401 1.846 19.493 1.00 60.42 H new ATOM 0 HZ1 LYS A 133 19.294 3.786 20.106 1.00 3.02 H new ATOM 0 HZ2 LYS A 133 18.826 3.573 18.488 1.00 3.02 H new ATOM 0 HZ3 LYS A 133 17.757 3.163 19.742 1.00 3.02 H new ATOM 1470 N GLU A 134 14.918 2.913 16.986 1.00 32.23 N ATOM 1471 CA GLU A 134 14.499 4.213 16.463 1.00 61.44 C ATOM 1472 C GLU A 134 15.560 4.752 15.496 1.00 62.32 C ATOM 1473 O GLU A 134 16.682 5.087 15.908 1.00 24.32 O ATOM 1474 CB GLU A 134 14.298 5.266 17.599 1.00 15.20 C ATOM 1475 CG GLU A 134 14.206 4.750 19.026 1.00 70.33 C ATOM 1476 CD GLU A 134 15.555 4.433 19.602 1.00 54.11 C ATOM 1477 OE1 GLU A 134 16.198 5.325 20.167 1.00 23.24 O ATOM 1478 OE2 GLU A 134 15.996 3.292 19.507 1.00 60.03 O ATOM 0 H GLU A 134 15.126 2.907 17.985 1.00 32.23 H new ATOM 0 HA GLU A 134 13.547 4.060 15.954 1.00 61.44 H new ATOM 0 HB2 GLU A 134 15.124 5.975 17.550 1.00 15.20 H new ATOM 0 HB3 GLU A 134 13.386 5.823 17.383 1.00 15.20 H new ATOM 0 HG2 GLU A 134 13.713 5.496 19.649 1.00 70.33 H new ATOM 0 HG3 GLU A 134 13.584 3.855 19.048 1.00 70.33 H new ATOM 1485 N GLY A 135 15.206 4.840 14.234 1.00 23.14 N ATOM 1486 CA GLY A 135 16.148 5.217 13.191 1.00 73.03 C ATOM 1487 C GLY A 135 15.534 6.134 12.152 1.00 72.22 C ATOM 1488 O GLY A 135 14.406 6.615 12.331 1.00 44.12 O ATOM 0 H GLY A 135 14.261 4.654 13.897 1.00 23.14 H new ATOM 0 HA2 GLY A 135 17.007 5.712 13.644 1.00 73.03 H new ATOM 0 HA3 GLY A 135 16.521 4.317 12.701 1.00 73.03 H new ATOM 1492 N GLY A 136 16.276 6.423 11.087 1.00 42.11 N ATOM 1493 CA GLY A 136 15.755 7.265 10.047 1.00 12.43 C ATOM 1494 C GLY A 136 16.145 6.766 8.672 1.00 13.12 C ATOM 1495 O GLY A 136 17.328 6.571 8.392 1.00 1.41 O ATOM 0 H GLY A 136 17.226 6.086 10.934 1.00 42.11 H new ATOM 0 HA2 GLY A 136 14.669 7.307 10.124 1.00 12.43 H new ATOM 0 HA3 GLY A 136 16.124 8.282 10.183 1.00 12.43 H new ATOM 1499 N SER A 137 15.144 6.617 7.828 1.00 22.34 N ATOM 1500 CA SER A 137 15.181 6.113 6.453 1.00 14.02 C ATOM 1501 C SER A 137 13.725 6.137 5.981 1.00 5.12 C ATOM 1502 O SER A 137 12.892 6.588 6.727 1.00 4.40 O ATOM 1503 CB SER A 137 15.718 4.676 6.376 1.00 12.23 C ATOM 1504 OG SER A 137 17.071 4.580 6.775 1.00 60.22 O ATOM 0 H SER A 137 14.194 6.866 8.104 1.00 22.34 H new ATOM 0 HA SER A 137 15.844 6.722 5.839 1.00 14.02 H new ATOM 0 HB2 SER A 137 15.110 4.030 7.009 1.00 12.23 H new ATOM 0 HB3 SER A 137 15.617 4.308 5.355 1.00 12.23 H new ATOM 0 HG SER A 137 17.380 5.452 7.097 1.00 60.22 H new ATOM 1510 N ASP A 138 13.419 5.699 4.780 1.00 22.32 N ATOM 1511 CA ASP A 138 12.001 5.611 4.346 1.00 60.31 C ATOM 1512 C ASP A 138 11.217 4.647 5.209 1.00 71.02 C ATOM 1513 O ASP A 138 10.198 5.013 5.782 1.00 33.04 O ATOM 1514 CB ASP A 138 11.864 5.221 2.874 1.00 3.21 C ATOM 1515 CG ASP A 138 12.103 6.356 1.929 1.00 30.11 C ATOM 1516 OD1 ASP A 138 13.274 6.766 1.736 1.00 3.24 O ATOM 1517 OD2 ASP A 138 11.119 6.858 1.337 1.00 34.20 O ATOM 0 H ASP A 138 14.101 5.399 4.083 1.00 22.32 H new ATOM 0 HA ASP A 138 11.585 6.611 4.466 1.00 60.31 H new ATOM 0 HB2 ASP A 138 12.569 4.420 2.652 1.00 3.21 H new ATOM 0 HB3 ASP A 138 10.864 4.822 2.704 1.00 3.21 H new ATOM 1522 N ASN A 139 11.696 3.429 5.333 1.00 1.30 N ATOM 1523 CA ASN A 139 10.968 2.445 6.127 1.00 21.01 C ATOM 1524 C ASN A 139 11.623 2.186 7.474 1.00 0.13 C ATOM 1525 O ASN A 139 11.015 1.601 8.363 1.00 63.13 O ATOM 1526 CB ASN A 139 10.749 1.120 5.367 1.00 13.44 C ATOM 1527 CG ASN A 139 12.022 0.374 5.056 1.00 74.33 C ATOM 1528 OD1 ASN A 139 12.446 -0.444 5.968 1.00 74.11 O flip ATOM 1529 ND2 ASN A 139 12.624 0.555 4.000 1.00 23.43 N flip ATOM 0 H ASN A 139 12.562 3.095 4.910 1.00 1.30 H new ATOM 0 HA ASN A 139 9.989 2.886 6.314 1.00 21.01 H new ATOM 0 HB2 ASN A 139 10.098 0.477 5.959 1.00 13.44 H new ATOM 0 HB3 ASN A 139 10.226 1.330 4.434 1.00 13.44 H new ATOM 0 HD21 ASN A 139 12.256 1.208 3.308 1.00 23.43 H new ATOM 0 HD22 ASN A 139 13.492 0.052 3.815 1.00 23.43 H new ATOM 1536 N ASP A 140 12.855 2.611 7.640 1.00 23.43 N ATOM 1537 CA ASP A 140 13.542 2.375 8.916 1.00 73.33 C ATOM 1538 C ASP A 140 13.417 3.566 9.831 1.00 44.25 C ATOM 1539 O ASP A 140 14.050 3.620 10.874 1.00 52.00 O ATOM 1540 CB ASP A 140 15.018 1.975 8.746 1.00 54.33 C ATOM 1541 CG ASP A 140 15.202 0.700 7.975 1.00 21.54 C ATOM 1542 OD1 ASP A 140 15.107 -0.389 8.564 1.00 1.00 O ATOM 1543 OD2 ASP A 140 15.459 0.755 6.762 1.00 71.35 O ATOM 0 H ASP A 140 13.400 3.110 6.937 1.00 23.43 H new ATOM 0 HA ASP A 140 13.039 1.524 9.375 1.00 73.33 H new ATOM 0 HB2 ASP A 140 15.549 2.779 8.237 1.00 54.33 H new ATOM 0 HB3 ASP A 140 15.473 1.865 9.730 1.00 54.33 H new ATOM 1548 N ALA A 141 12.581 4.512 9.442 1.00 33.35 N ATOM 1549 CA ALA A 141 12.319 5.676 10.261 1.00 61.23 C ATOM 1550 C ALA A 141 11.226 5.370 11.194 1.00 4.20 C ATOM 1551 O ALA A 141 10.377 4.522 10.906 1.00 60.11 O ATOM 1552 CB ALA A 141 11.885 6.873 9.449 1.00 55.03 C ATOM 0 H ALA A 141 12.071 4.494 8.559 1.00 33.35 H new ATOM 0 HA ALA A 141 13.250 5.917 10.774 1.00 61.23 H new ATOM 0 HB1 ALA A 141 11.702 7.717 10.114 1.00 55.03 H new ATOM 0 HB2 ALA A 141 12.669 7.134 8.738 1.00 55.03 H new ATOM 0 HB3 ALA A 141 10.970 6.633 8.907 1.00 55.03 H new ATOM 1558 N ASP A 142 11.207 6.066 12.273 1.00 41.45 N ATOM 1559 CA ASP A 142 10.152 5.920 13.213 1.00 1.44 C ATOM 1560 C ASP A 142 9.016 6.690 12.675 1.00 11.51 C ATOM 1561 O ASP A 142 9.151 7.891 12.362 1.00 21.20 O ATOM 1562 CB ASP A 142 10.523 6.473 14.573 1.00 63.00 C ATOM 1563 CG ASP A 142 11.807 5.923 15.077 1.00 21.12 C ATOM 1564 OD1 ASP A 142 12.000 4.697 15.026 1.00 12.34 O ATOM 1565 OD2 ASP A 142 12.689 6.749 15.483 1.00 74.23 O ATOM 0 H ASP A 142 11.918 6.750 12.530 1.00 41.45 H new ATOM 0 HA ASP A 142 9.921 4.864 13.350 1.00 1.44 H new ATOM 0 HB2 ASP A 142 10.595 7.559 14.513 1.00 63.00 H new ATOM 0 HB3 ASP A 142 9.729 6.245 15.284 1.00 63.00 H new ATOM 1570 N ILE A 143 7.929 6.045 12.520 1.00 72.04 N ATOM 1571 CA ILE A 143 6.803 6.662 11.944 1.00 61.04 C ATOM 1572 C ILE A 143 5.888 7.169 13.023 1.00 14.54 C ATOM 1573 O ILE A 143 5.488 6.434 13.906 1.00 40.11 O ATOM 1574 CB ILE A 143 6.108 5.746 10.861 1.00 4.00 C ATOM 1575 CG1 ILE A 143 5.788 4.305 11.352 1.00 21.23 C ATOM 1576 CG2 ILE A 143 6.992 5.658 9.631 1.00 73.24 C ATOM 1577 CD1 ILE A 143 4.598 4.166 12.268 1.00 22.03 C ATOM 0 H ILE A 143 7.793 5.071 12.790 1.00 72.04 H new ATOM 0 HA ILE A 143 7.122 7.536 11.377 1.00 61.04 H new ATOM 0 HB ILE A 143 5.152 6.219 10.638 1.00 4.00 H new ATOM 0 HG12 ILE A 143 5.625 3.673 10.479 1.00 21.23 H new ATOM 0 HG13 ILE A 143 6.666 3.915 11.868 1.00 21.23 H new ATOM 0 HG21 ILE A 143 6.513 5.026 8.883 1.00 73.24 H new ATOM 0 HG22 ILE A 143 7.143 6.656 9.220 1.00 73.24 H new ATOM 0 HG23 ILE A 143 7.956 5.229 9.905 1.00 73.24 H new ATOM 0 HD11 ILE A 143 4.472 3.119 12.545 1.00 22.03 H new ATOM 0 HD12 ILE A 143 4.759 4.762 13.166 1.00 22.03 H new ATOM 0 HD13 ILE A 143 3.702 4.516 11.756 1.00 22.03 H new ATOM 1589 N GLY A 144 5.645 8.440 13.017 1.00 25.24 N ATOM 1590 CA GLY A 144 4.849 8.997 14.041 1.00 61.43 C ATOM 1591 C GLY A 144 4.375 10.361 13.723 1.00 63.43 C ATOM 1592 O GLY A 144 4.721 10.928 12.686 1.00 40.53 O ATOM 0 H GLY A 144 5.986 9.100 12.318 1.00 25.24 H new ATOM 0 HA2 GLY A 144 3.989 8.351 14.218 1.00 61.43 H new ATOM 0 HA3 GLY A 144 5.423 9.024 14.967 1.00 61.43 H new ATOM 1596 N ASN A 145 3.605 10.886 14.609 1.00 50.03 N ATOM 1597 CA ASN A 145 3.002 12.173 14.465 1.00 73.13 C ATOM 1598 C ASN A 145 2.581 12.587 15.831 1.00 43.02 C ATOM 1599 O ASN A 145 2.437 11.717 16.720 1.00 63.12 O ATOM 1600 CB ASN A 145 1.791 12.156 13.480 1.00 40.25 C ATOM 1601 CG ASN A 145 0.481 11.518 13.993 1.00 5.24 C ATOM 1602 OD1 ASN A 145 -0.596 11.929 13.581 1.00 41.21 O ATOM 1603 ND2 ASN A 145 0.549 10.537 14.866 1.00 20.11 N ATOM 0 H ASN A 145 3.367 10.420 15.484 1.00 50.03 H new ATOM 0 HA ASN A 145 3.711 12.879 14.033 1.00 73.13 H new ATOM 0 HB2 ASN A 145 1.576 13.184 13.189 1.00 40.25 H new ATOM 0 HB3 ASN A 145 2.095 11.626 12.577 1.00 40.25 H new ATOM 0 HD21 ASN A 145 -0.306 10.103 15.213 1.00 20.11 H new ATOM 0 HD22 ASN A 145 1.457 10.210 15.196 1.00 20.11 H new ATOM 1610 N TRP A 146 2.403 13.850 16.037 1.00 1.00 N ATOM 1611 CA TRP A 146 2.081 14.347 17.344 1.00 65.40 C ATOM 1612 C TRP A 146 1.658 15.784 17.326 1.00 62.15 C ATOM 1613 O TRP A 146 1.637 16.435 16.279 1.00 62.21 O ATOM 1614 CB TRP A 146 3.251 14.149 18.326 1.00 14.15 C ATOM 1615 CG TRP A 146 4.597 14.602 17.827 1.00 60.31 C ATOM 1616 CD1 TRP A 146 5.034 15.883 17.644 1.00 21.42 C ATOM 1617 CD2 TRP A 146 5.689 13.752 17.478 1.00 50.11 C ATOM 1618 NE1 TRP A 146 6.328 15.874 17.193 1.00 14.43 N ATOM 1619 CE2 TRP A 146 6.754 14.576 17.083 1.00 51.41 C ATOM 1620 CE3 TRP A 146 5.862 12.370 17.461 1.00 50.31 C ATOM 1621 CZ2 TRP A 146 7.981 14.058 16.674 1.00 3.11 C ATOM 1622 CZ3 TRP A 146 7.071 11.854 17.057 1.00 32.33 C ATOM 1623 CH2 TRP A 146 8.119 12.694 16.670 1.00 44.51 C ATOM 0 H TRP A 146 2.475 14.566 15.314 1.00 1.00 H new ATOM 0 HA TRP A 146 1.230 13.760 17.690 1.00 65.40 H new ATOM 0 HB2 TRP A 146 3.025 14.686 19.247 1.00 14.15 H new ATOM 0 HB3 TRP A 146 3.314 13.091 18.581 1.00 14.15 H new ATOM 0 HD1 TRP A 146 4.447 16.771 17.827 1.00 21.42 H new ATOM 0 HE1 TRP A 146 6.885 16.700 16.974 1.00 14.43 H new ATOM 0 HE3 TRP A 146 5.059 11.713 17.761 1.00 50.31 H new ATOM 0 HZ2 TRP A 146 8.791 14.705 16.372 1.00 3.11 H new ATOM 0 HZ3 TRP A 146 7.213 10.784 17.038 1.00 32.33 H new ATOM 0 HH2 TRP A 146 9.058 12.259 16.361 1.00 44.51 H new ATOM 1634 N ASP A 147 1.311 16.260 18.476 1.00 11.24 N ATOM 1635 CA ASP A 147 0.941 17.624 18.666 1.00 61.31 C ATOM 1636 C ASP A 147 2.042 18.260 19.456 1.00 74.04 C ATOM 1637 O ASP A 147 2.409 17.750 20.532 1.00 32.11 O ATOM 1638 CB ASP A 147 -0.381 17.734 19.428 1.00 71.41 C ATOM 1639 CG ASP A 147 -0.871 19.158 19.571 1.00 62.31 C ATOM 1640 OD1 ASP A 147 -0.513 19.829 20.535 1.00 14.40 O ATOM 1641 OD2 ASP A 147 -1.657 19.607 18.724 1.00 62.24 O ATOM 0 H ASP A 147 1.276 15.700 19.328 1.00 11.24 H new ATOM 0 HA ASP A 147 0.800 18.119 17.705 1.00 61.31 H new ATOM 0 HB2 ASP A 147 -1.140 17.146 18.912 1.00 71.41 H new ATOM 0 HB3 ASP A 147 -0.259 17.298 20.419 1.00 71.41 H new ATOM 1646 N ASN A 148 2.624 19.283 18.892 1.00 42.40 N ATOM 1647 CA ASN A 148 3.679 20.022 19.521 1.00 13.32 C ATOM 1648 C ASN A 148 3.331 21.496 19.586 1.00 3.01 C ATOM 1649 O ASN A 148 3.221 22.148 18.529 1.00 71.40 O ATOM 1650 CB ASN A 148 5.094 19.717 18.910 1.00 0.33 C ATOM 1651 CG ASN A 148 5.262 19.875 17.379 1.00 63.13 C ATOM 1652 OD1 ASN A 148 6.023 19.132 16.759 1.00 12.43 O ATOM 1653 ND2 ASN A 148 4.631 20.838 16.780 1.00 0.04 N ATOM 1654 OXT ASN A 148 3.105 22.012 20.687 1.00 0.00 O ATOM 0 H ASN A 148 2.372 19.631 17.967 1.00 42.40 H new ATOM 0 HA ASN A 148 3.764 19.677 20.551 1.00 13.32 H new ATOM 0 HB2 ASN A 148 5.818 20.370 19.397 1.00 0.33 H new ATOM 0 HB3 ASN A 148 5.360 18.693 19.174 1.00 0.33 H new ATOM 0 HD21 ASN A 148 4.762 20.989 15.780 1.00 0.04 H new ATOM 0 HD22 ASN A 148 4.004 21.444 17.309 1.00 0.04 H new