USER MOD reduce.3.24.130724 H: found=0, std=0, add=1085, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1085 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 43 HIS : no HD1:sc= 0.593 K(o=1.9,f=-3) USER MOD Set 1.2: A 88 THR OG1 : rot -79:sc= 1.26 USER MOD Set 2.1: A 1 ALA N :NH3+ -147:sc= 0.777 (180deg=-0.188) USER MOD Set 2.2: A 22 GLN : amide:sc= -3.24! C(o=-2.5!,f=-8.4!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0.0928 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -139:sc= -1.8 (180deg=-4.08!) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= 0 K(o=0,f=-2) USER MOD Single : A 23 LYS NZ :NH3+ -128:sc= 1.22 (180deg=0.898) USER MOD Single : A 25 SER OG : rot 180:sc= 0.441 USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 30 LYS NZ :NH3+ -163:sc= 0.632 (180deg=0.118) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= -2.55! USER MOD Single : A 46 HIS : no HD1:sc= -1.63 K(o=-1.6,f=-5.5!) USER MOD Single : A 48 HIS : no HD1:sc= -1.77 K(o=-1.8,f=-2.6!) USER MOD Single : A 53 ASN : amide:sc= -1.31 K(o=-1.3,f=-6.7!) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.595 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.0893 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc=-0.000297 X(o=-0.0003,f=0) USER MOD Single : A 65 ASN : amide:sc= -1.37 K(o=-1.4,f=-5.1!) USER MOD Single : A 68 SER OG : rot 98:sc= -1.58! USER MOD Single : A 70 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0498) USER MOD Single : A 71 HIS : no HD1:sc= -0.491 K(o=-0.49,f=-4.4!) USER MOD Single : A 75 LYS NZ :NH3+ -123:sc= 2.34 (180deg=-0.222) USER MOD Single : A 80 HIS : no HE2:sc= -0.195 K(o=-0.19,f=-0.91) USER MOD Single : A 86 ASN : amide:sc= 1.68 K(o=1.7,f=-5.8!) USER MOD Single : A 91 LYS NZ :NH3+ 164:sc= -0.0696 (180deg=-0.329) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -55:sc= -0.894! USER MOD Single : A 105 SER OG : rot -73:sc= -0.758! USER MOD Single : A 107 SER OG : rot -6:sc= 1.1 USER MOD Single : A 110 HIS : no HE2:sc= 0.773 K(o=0.77,f=-6!) USER MOD Single : A 111 SER OG : rot 180:sc= 0.131 USER MOD Single : A 116 THR OG1 : rot -170:sc= -1.86! USER MOD Single : A 120 HIS : no HD1:sc= -0.421 X(o=-0.42,f=-0.42) USER MOD Single : A 122 LYS NZ :NH3+ 167:sc= 0.52 (180deg=0.116) USER MOD Single : A 128 LYS NZ :NH3+ -168:sc= -0.0227 (180deg=-0.159) USER MOD Single : A 131 ASN : amide:sc= -0.97 K(o=-0.97,f=-2.5!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 4:sc= 1.45 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 ASN :FLIP amide:sc= -0.862 F(o=-1.5,f=-0.86) USER MOD Single : A 142 SER OG : rot 180:sc= 0.00107 USER MOD Single : A 153 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 8.243 -12.838 -0.289 1.00 0.00 N ATOM 2 CA ALA A 1 8.197 -13.590 -1.537 1.00 0.00 C ATOM 3 C ALA A 1 7.035 -14.579 -1.535 1.00 0.00 C ATOM 4 O ALA A 1 6.631 -15.070 -2.583 1.00 0.00 O ATOM 5 CB ALA A 1 9.521 -14.300 -1.783 1.00 0.00 C ATOM 0 H1 ALA A 1 8.597 -11.878 -0.475 1.00 0.00 H new ATOM 0 H2 ALA A 1 7.288 -12.782 0.118 1.00 0.00 H new ATOM 0 H3 ALA A 1 8.878 -13.317 0.382 1.00 0.00 H new ATOM 0 HA ALA A 1 8.033 -12.887 -2.354 1.00 0.00 H new ATOM 0 HB1 ALA A 1 9.467 -14.856 -2.719 1.00 0.00 H new ATOM 0 HB2 ALA A 1 10.323 -13.564 -1.844 1.00 0.00 H new ATOM 0 HB3 ALA A 1 9.722 -14.989 -0.963 1.00 0.00 H new ATOM 13 N THR A 2 6.504 -14.873 -0.364 1.00 0.00 N ATOM 14 CA THR A 2 5.386 -15.767 -0.230 1.00 0.00 C ATOM 15 C THR A 2 4.038 -15.074 -0.508 1.00 0.00 C ATOM 16 O THR A 2 3.348 -15.414 -1.470 1.00 0.00 O ATOM 17 CB THR A 2 5.397 -16.366 1.183 1.00 0.00 C ATOM 18 OG1 THR A 2 5.744 -15.315 2.122 1.00 0.00 O ATOM 19 CG2 THR A 2 6.401 -17.513 1.288 1.00 0.00 C ATOM 0 H THR A 2 6.842 -14.494 0.520 1.00 0.00 H new ATOM 0 HA THR A 2 5.490 -16.554 -0.977 1.00 0.00 H new ATOM 0 HB THR A 2 4.410 -16.770 1.411 1.00 0.00 H new ATOM 0 HG1 THR A 2 5.754 -15.679 3.032 1.00 0.00 H new ATOM 0 HG21 THR A 2 6.387 -17.918 2.300 1.00 0.00 H new ATOM 0 HG22 THR A 2 6.133 -18.297 0.580 1.00 0.00 H new ATOM 0 HG23 THR A 2 7.401 -17.144 1.059 1.00 0.00 H new ATOM 27 N LYS A 3 3.681 -14.142 0.333 1.00 0.00 N ATOM 28 CA LYS A 3 2.426 -13.451 0.260 1.00 0.00 C ATOM 29 C LYS A 3 2.473 -12.323 1.230 1.00 0.00 C ATOM 30 O LYS A 3 3.419 -12.218 2.012 1.00 0.00 O ATOM 31 CB LYS A 3 1.250 -14.360 0.660 1.00 0.00 C ATOM 32 CG LYS A 3 1.311 -14.859 2.112 1.00 0.00 C ATOM 33 CD LYS A 3 -0.006 -15.467 2.552 1.00 0.00 C ATOM 34 CE LYS A 3 -0.359 -16.693 1.747 1.00 0.00 C ATOM 35 NZ LYS A 3 -1.717 -17.185 2.043 1.00 0.00 N ATOM 0 H LYS A 3 4.271 -13.836 1.107 1.00 0.00 H new ATOM 0 HA LYS A 3 2.274 -13.116 -0.766 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.317 -13.816 0.513 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.226 -15.221 -0.008 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.104 -15.600 2.209 1.00 0.00 H new ATOM 0 HG3 LYS A 3 1.567 -14.030 2.771 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.051 -15.731 3.608 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.799 -14.726 2.451 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -0.282 -16.462 0.685 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.364 -17.482 1.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -1.914 -18.028 1.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.785 -17.431 3.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.411 -16.443 1.820 1.00 0.00 H new ATOM 49 N ALA A 4 1.487 -11.496 1.184 1.00 0.00 N ATOM 50 CA ALA A 4 1.321 -10.479 2.153 1.00 0.00 C ATOM 51 C ALA A 4 -0.108 -10.567 2.609 1.00 0.00 C ATOM 52 O ALA A 4 -0.943 -11.030 1.857 1.00 0.00 O ATOM 53 CB ALA A 4 1.659 -9.103 1.585 1.00 0.00 C ATOM 0 H ALA A 4 0.767 -11.510 0.462 1.00 0.00 H new ATOM 0 HA ALA A 4 2.003 -10.617 2.992 1.00 0.00 H new ATOM 0 HB1 ALA A 4 1.520 -8.346 2.357 1.00 0.00 H new ATOM 0 HB2 ALA A 4 2.696 -9.093 1.249 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.003 -8.886 0.742 1.00 0.00 H new ATOM 59 N VAL A 5 -0.377 -10.228 3.819 1.00 0.00 N ATOM 60 CA VAL A 5 -1.722 -10.248 4.301 1.00 0.00 C ATOM 61 C VAL A 5 -2.025 -8.894 4.894 1.00 0.00 C ATOM 62 O VAL A 5 -1.140 -8.248 5.478 1.00 0.00 O ATOM 63 CB VAL A 5 -1.974 -11.399 5.334 1.00 0.00 C ATOM 64 CG1 VAL A 5 -1.215 -11.177 6.626 1.00 0.00 C ATOM 65 CG2 VAL A 5 -3.464 -11.604 5.597 1.00 0.00 C ATOM 0 H VAL A 5 0.319 -9.930 4.503 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.396 -10.454 3.470 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.589 -12.315 4.885 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -1.419 -11.998 7.313 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -0.146 -11.135 6.417 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.534 -10.238 7.078 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.599 -12.410 6.318 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -3.893 -10.685 5.996 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -3.966 -11.864 4.665 1.00 0.00 H new ATOM 75 N ALA A 6 -3.218 -8.455 4.699 1.00 0.00 N ATOM 76 CA ALA A 6 -3.647 -7.154 5.158 1.00 0.00 C ATOM 77 C ALA A 6 -4.845 -7.250 6.081 1.00 0.00 C ATOM 78 O ALA A 6 -5.828 -7.919 5.762 1.00 0.00 O ATOM 79 CB ALA A 6 -3.990 -6.284 3.974 1.00 0.00 C ATOM 0 H ALA A 6 -3.942 -8.984 4.213 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.825 -6.712 5.721 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -4.313 -5.304 4.324 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -3.111 -6.171 3.339 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -4.794 -6.748 3.402 1.00 0.00 H new ATOM 85 N VAL A 7 -4.748 -6.605 7.222 1.00 0.00 N ATOM 86 CA VAL A 7 -5.837 -6.533 8.187 1.00 0.00 C ATOM 87 C VAL A 7 -6.035 -5.072 8.549 1.00 0.00 C ATOM 88 O VAL A 7 -5.139 -4.470 9.100 1.00 0.00 O ATOM 89 CB VAL A 7 -5.502 -7.314 9.494 1.00 0.00 C ATOM 90 CG1 VAL A 7 -6.694 -7.330 10.448 1.00 0.00 C ATOM 91 CG2 VAL A 7 -5.037 -8.726 9.193 1.00 0.00 C ATOM 0 H VAL A 7 -3.906 -6.109 7.515 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.729 -6.975 7.743 1.00 0.00 H new ATOM 0 HB VAL A 7 -4.682 -6.790 9.984 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -6.430 -7.882 11.350 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.962 -6.307 10.713 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.542 -7.813 9.962 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.812 -9.242 10.127 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -5.823 -9.263 8.662 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -4.141 -8.690 8.574 1.00 0.00 H new ATOM 101 N LEU A 8 -7.142 -4.493 8.153 1.00 0.00 N ATOM 102 CA LEU A 8 -7.424 -3.089 8.489 1.00 0.00 C ATOM 103 C LEU A 8 -8.531 -2.982 9.540 1.00 0.00 C ATOM 104 O LEU A 8 -9.401 -3.872 9.633 1.00 0.00 O ATOM 105 CB LEU A 8 -7.826 -2.254 7.250 1.00 0.00 C ATOM 106 CG LEU A 8 -6.829 -2.154 6.081 1.00 0.00 C ATOM 107 CD1 LEU A 8 -6.778 -3.435 5.253 1.00 0.00 C ATOM 108 CD2 LEU A 8 -7.168 -0.965 5.212 1.00 0.00 C ATOM 0 H LEU A 8 -7.866 -4.954 7.602 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.495 -2.684 8.891 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.756 -2.666 6.859 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.044 -1.241 7.588 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.835 -2.015 6.506 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.061 -3.315 4.441 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.472 -4.267 5.888 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.765 -3.640 4.838 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -6.457 -0.902 4.388 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -8.176 -1.081 4.814 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.115 -0.053 5.807 1.00 0.00 H new ATOM 120 N LYS A 9 -8.501 -1.918 10.326 1.00 0.00 N ATOM 121 CA LYS A 9 -9.534 -1.648 11.298 1.00 0.00 C ATOM 122 C LYS A 9 -9.846 -0.180 11.182 1.00 0.00 C ATOM 123 O LYS A 9 -8.926 0.643 11.152 1.00 0.00 O ATOM 124 CB LYS A 9 -9.115 -2.005 12.726 1.00 0.00 C ATOM 125 CG LYS A 9 -10.271 -1.864 13.712 1.00 0.00 C ATOM 126 CD LYS A 9 -9.928 -2.240 15.153 1.00 0.00 C ATOM 127 CE LYS A 9 -9.148 -1.163 15.903 1.00 0.00 C ATOM 128 NZ LYS A 9 -7.757 -1.004 15.455 1.00 0.00 N ATOM 0 H LYS A 9 -7.757 -1.220 10.304 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.407 -2.268 11.094 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.741 -3.029 12.749 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -8.294 -1.359 13.035 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -10.623 -0.833 13.694 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -11.098 -2.489 13.374 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -10.851 -2.449 15.693 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.345 -3.161 15.149 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.665 -0.210 15.790 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.150 -1.403 16.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.140 -0.868 16.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.460 -1.855 14.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.686 -0.176 14.830 1.00 0.00 H new ATOM 142 N GLY A 10 -11.093 0.150 11.094 1.00 0.00 N ATOM 143 CA GLY A 10 -11.422 1.473 10.736 1.00 0.00 C ATOM 144 C GLY A 10 -11.903 2.400 11.821 1.00 0.00 C ATOM 145 O GLY A 10 -12.514 1.999 12.824 1.00 0.00 O ATOM 0 H GLY A 10 -11.883 -0.473 11.264 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.542 1.924 10.278 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.194 1.429 9.968 1.00 0.00 H new ATOM 149 N ASP A 11 -11.556 3.664 11.577 1.00 0.00 N ATOM 150 CA ASP A 11 -12.062 4.846 12.290 1.00 0.00 C ATOM 151 C ASP A 11 -13.392 5.184 11.601 1.00 0.00 C ATOM 152 O ASP A 11 -14.261 5.893 12.112 1.00 0.00 O ATOM 153 CB ASP A 11 -11.047 5.990 12.113 1.00 0.00 C ATOM 154 CG ASP A 11 -11.383 7.258 12.872 1.00 0.00 C ATOM 155 OD1 ASP A 11 -11.228 7.280 14.107 1.00 0.00 O ATOM 156 OD2 ASP A 11 -11.721 8.279 12.241 1.00 0.00 O ATOM 0 H ASP A 11 -10.886 3.907 10.847 1.00 0.00 H new ATOM 0 HA ASP A 11 -12.202 4.684 13.359 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -10.066 5.640 12.434 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -10.969 6.228 11.052 1.00 0.00 H new ATOM 161 N GLY A 12 -13.465 4.641 10.408 1.00 0.00 N ATOM 162 CA GLY A 12 -14.604 4.542 9.564 1.00 0.00 C ATOM 163 C GLY A 12 -14.397 3.182 8.951 1.00 0.00 C ATOM 164 O GLY A 12 -13.234 2.841 8.725 1.00 0.00 O ATOM 0 H GLY A 12 -12.642 4.221 9.975 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -15.537 4.603 10.124 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -14.630 5.332 8.813 1.00 0.00 H new ATOM 168 N PRO A 13 -15.414 2.367 8.669 1.00 0.00 N ATOM 169 CA PRO A 13 -15.172 0.978 8.324 1.00 0.00 C ATOM 170 C PRO A 13 -14.512 0.811 6.972 1.00 0.00 C ATOM 171 O PRO A 13 -15.000 1.302 5.940 1.00 0.00 O ATOM 172 CB PRO A 13 -16.574 0.345 8.323 1.00 0.00 C ATOM 173 CG PRO A 13 -17.468 1.387 8.908 1.00 0.00 C ATOM 174 CD PRO A 13 -16.816 2.698 8.600 1.00 0.00 C ATOM 0 HA PRO A 13 -14.483 0.511 9.028 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -16.886 0.079 7.313 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -16.594 -0.570 8.915 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -18.467 1.335 8.474 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.580 1.248 9.983 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -17.098 3.071 7.615 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -17.088 3.467 9.322 1.00 0.00 H new ATOM 182 N VAL A 14 -13.410 0.130 7.001 1.00 0.00 N ATOM 183 CA VAL A 14 -12.660 -0.219 5.848 1.00 0.00 C ATOM 184 C VAL A 14 -12.301 -1.718 5.933 1.00 0.00 C ATOM 185 O VAL A 14 -11.460 -2.138 6.738 1.00 0.00 O ATOM 186 CB VAL A 14 -11.410 0.715 5.678 1.00 0.00 C ATOM 187 CG1 VAL A 14 -10.495 0.708 6.903 1.00 0.00 C ATOM 188 CG2 VAL A 14 -10.644 0.381 4.417 1.00 0.00 C ATOM 0 H VAL A 14 -12.995 -0.210 7.869 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.254 -0.065 4.947 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.792 1.731 5.584 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.648 1.371 6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -11.052 1.052 7.775 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -10.132 -0.304 7.080 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.784 1.045 4.327 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -10.301 -0.653 4.462 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -11.294 0.510 3.552 1.00 0.00 H new ATOM 198 N GLN A 15 -12.965 -2.531 5.168 1.00 0.00 N ATOM 199 CA GLN A 15 -12.730 -3.961 5.273 1.00 0.00 C ATOM 200 C GLN A 15 -12.192 -4.542 3.979 1.00 0.00 C ATOM 201 O GLN A 15 -12.831 -4.440 2.951 1.00 0.00 O ATOM 202 CB GLN A 15 -13.981 -4.712 5.736 1.00 0.00 C ATOM 203 CG GLN A 15 -14.493 -4.280 7.107 1.00 0.00 C ATOM 204 CD GLN A 15 -15.619 -5.153 7.606 1.00 0.00 C ATOM 205 OE1 GLN A 15 -16.799 -4.894 7.343 1.00 0.00 O ATOM 206 NE2 GLN A 15 -15.280 -6.184 8.332 1.00 0.00 N ATOM 0 H GLN A 15 -13.660 -2.250 4.476 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.964 -4.097 6.037 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -14.773 -4.566 5.001 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -13.763 -5.780 5.761 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.672 -4.308 7.823 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -14.835 -3.246 7.054 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -14.296 -6.368 8.529 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -15.999 -6.806 8.702 1.00 0.00 H new ATOM 215 N GLY A 16 -11.004 -5.126 4.032 1.00 0.00 N ATOM 216 CA GLY A 16 -10.405 -5.705 2.857 1.00 0.00 C ATOM 217 C GLY A 16 -9.177 -6.503 3.204 1.00 0.00 C ATOM 218 O GLY A 16 -8.737 -6.472 4.354 1.00 0.00 O ATOM 0 H GLY A 16 -10.442 -5.207 4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.129 -6.348 2.357 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.141 -4.915 2.154 1.00 0.00 H new ATOM 222 N ILE A 17 -8.634 -7.220 2.232 1.00 0.00 N ATOM 223 CA ILE A 17 -7.481 -8.063 2.402 1.00 0.00 C ATOM 224 C ILE A 17 -6.679 -7.957 1.132 1.00 0.00 C ATOM 225 O ILE A 17 -7.254 -7.989 0.034 1.00 0.00 O ATOM 226 CB ILE A 17 -7.857 -9.563 2.681 1.00 0.00 C ATOM 227 CG1 ILE A 17 -8.915 -10.067 1.677 1.00 0.00 C ATOM 228 CG2 ILE A 17 -8.316 -9.765 4.126 1.00 0.00 C ATOM 229 CD1 ILE A 17 -9.276 -11.532 1.822 1.00 0.00 C ATOM 0 H ILE A 17 -9.000 -7.225 1.280 1.00 0.00 H new ATOM 0 HA ILE A 17 -6.916 -7.732 3.273 1.00 0.00 H new ATOM 0 HB ILE A 17 -6.957 -10.161 2.540 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -9.820 -9.470 1.793 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -8.547 -9.895 0.665 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.568 -10.814 4.284 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -7.514 -9.478 4.806 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.193 -9.148 4.319 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -10.025 -11.798 1.076 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -8.385 -12.143 1.675 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.677 -11.711 2.820 1.00 0.00 H new ATOM 241 N ILE A 18 -5.399 -7.736 1.263 1.00 0.00 N ATOM 242 CA ILE A 18 -4.531 -7.576 0.104 1.00 0.00 C ATOM 243 C ILE A 18 -3.325 -8.510 0.246 1.00 0.00 C ATOM 244 O ILE A 18 -2.711 -8.561 1.315 1.00 0.00 O ATOM 245 CB ILE A 18 -4.013 -6.087 -0.088 1.00 0.00 C ATOM 246 CG1 ILE A 18 -5.151 -5.020 -0.160 1.00 0.00 C ATOM 247 CG2 ILE A 18 -3.136 -5.969 -1.331 1.00 0.00 C ATOM 248 CD1 ILE A 18 -5.758 -4.612 1.173 1.00 0.00 C ATOM 0 H ILE A 18 -4.922 -7.661 2.161 1.00 0.00 H new ATOM 0 HA ILE A 18 -5.124 -7.826 -0.776 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.431 -5.873 0.808 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.757 -4.128 -0.647 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -5.946 -5.406 -0.797 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.795 -4.939 -1.439 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -2.274 -6.629 -1.232 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -3.712 -6.255 -2.211 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.537 -3.868 1.006 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.190 -5.487 1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.983 -4.188 1.811 1.00 0.00 H new ATOM 260 N ASN A 19 -2.993 -9.234 -0.820 1.00 0.00 N ATOM 261 CA ASN A 19 -1.877 -10.157 -0.823 1.00 0.00 C ATOM 262 C ASN A 19 -0.886 -9.679 -1.832 1.00 0.00 C ATOM 263 O ASN A 19 -1.258 -9.448 -2.976 1.00 0.00 O ATOM 264 CB ASN A 19 -2.305 -11.598 -1.202 1.00 0.00 C ATOM 265 CG ASN A 19 -3.201 -12.304 -0.190 1.00 0.00 C ATOM 266 OD1 ASN A 19 -4.009 -11.695 0.512 1.00 0.00 O ATOM 267 ND2 ASN A 19 -3.072 -13.606 -0.116 1.00 0.00 N ATOM 0 H ASN A 19 -3.497 -9.192 -1.706 1.00 0.00 H new ATOM 0 HA ASN A 19 -1.458 -10.188 0.183 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.824 -11.564 -2.160 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -1.407 -12.199 -1.348 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -3.649 -14.139 0.535 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -2.395 -14.086 -0.709 1.00 0.00 H new ATOM 274 N PHE A 20 0.359 -9.513 -1.432 1.00 0.00 N ATOM 275 CA PHE A 20 1.382 -9.027 -2.331 1.00 0.00 C ATOM 276 C PHE A 20 2.587 -9.960 -2.278 1.00 0.00 C ATOM 277 O PHE A 20 3.182 -10.151 -1.218 1.00 0.00 O ATOM 278 CB PHE A 20 1.773 -7.596 -1.892 1.00 0.00 C ATOM 279 CG PHE A 20 2.819 -6.904 -2.732 1.00 0.00 C ATOM 280 CD1 PHE A 20 2.452 -6.154 -3.832 1.00 0.00 C ATOM 281 CD2 PHE A 20 4.166 -6.984 -2.402 1.00 0.00 C ATOM 282 CE1 PHE A 20 3.399 -5.504 -4.590 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.118 -6.333 -3.159 1.00 0.00 C ATOM 284 CZ PHE A 20 4.735 -5.591 -4.254 1.00 0.00 C ATOM 0 H PHE A 20 0.686 -9.709 -0.486 1.00 0.00 H new ATOM 0 HA PHE A 20 1.016 -9.002 -3.357 1.00 0.00 H new ATOM 0 HB2 PHE A 20 0.873 -6.981 -1.889 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.133 -7.639 -0.864 1.00 0.00 H new ATOM 0 HD1 PHE A 20 1.409 -6.077 -4.101 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.472 -7.563 -1.543 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.096 -4.925 -5.450 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.162 -6.405 -2.893 1.00 0.00 H new ATOM 0 HZ PHE A 20 5.477 -5.079 -4.848 1.00 0.00 H new ATOM 294 N GLU A 21 2.930 -10.547 -3.397 1.00 0.00 N ATOM 295 CA GLU A 21 4.079 -11.408 -3.463 1.00 0.00 C ATOM 296 C GLU A 21 4.980 -11.062 -4.645 1.00 0.00 C ATOM 297 O GLU A 21 4.574 -11.148 -5.811 1.00 0.00 O ATOM 298 CB GLU A 21 3.679 -12.901 -3.515 1.00 0.00 C ATOM 299 CG GLU A 21 2.783 -13.276 -4.685 1.00 0.00 C ATOM 300 CD GLU A 21 2.519 -14.754 -4.800 1.00 0.00 C ATOM 301 OE1 GLU A 21 3.356 -15.482 -5.363 1.00 0.00 O ATOM 302 OE2 GLU A 21 1.441 -15.208 -4.394 1.00 0.00 O ATOM 0 H GLU A 21 2.426 -10.442 -4.277 1.00 0.00 H new ATOM 0 HA GLU A 21 4.642 -11.240 -2.545 1.00 0.00 H new ATOM 0 HB2 GLU A 21 4.585 -13.505 -3.560 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.170 -13.160 -2.587 1.00 0.00 H new ATOM 0 HG2 GLU A 21 1.832 -12.753 -4.584 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.243 -12.926 -5.609 1.00 0.00 H new ATOM 309 N GLN A 22 6.160 -10.591 -4.336 1.00 0.00 N ATOM 310 CA GLN A 22 7.198 -10.454 -5.287 1.00 0.00 C ATOM 311 C GLN A 22 7.903 -11.783 -5.322 1.00 0.00 C ATOM 312 O GLN A 22 7.728 -12.602 -4.404 1.00 0.00 O ATOM 313 CB GLN A 22 8.171 -9.352 -4.900 1.00 0.00 C ATOM 314 CG GLN A 22 8.966 -9.642 -3.636 1.00 0.00 C ATOM 315 CD GLN A 22 8.153 -9.642 -2.333 1.00 0.00 C ATOM 316 OE1 GLN A 22 8.442 -10.385 -1.417 1.00 0.00 O ATOM 317 NE2 GLN A 22 7.193 -8.766 -2.221 1.00 0.00 N ATOM 0 H GLN A 22 6.417 -10.290 -3.396 1.00 0.00 H new ATOM 0 HA GLN A 22 6.794 -10.179 -6.261 1.00 0.00 H new ATOM 0 HB2 GLN A 22 8.866 -9.189 -5.724 1.00 0.00 H new ATOM 0 HB3 GLN A 22 7.616 -8.424 -4.763 1.00 0.00 H new ATOM 0 HG2 GLN A 22 9.447 -10.614 -3.744 1.00 0.00 H new ATOM 0 HG3 GLN A 22 9.761 -8.901 -3.549 1.00 0.00 H new ATOM 0 HE21 GLN A 22 6.968 -8.153 -3.004 1.00 0.00 H new ATOM 0 HE22 GLN A 22 6.667 -8.694 -1.350 1.00 0.00 H new ATOM 326 N LYS A 23 8.667 -12.013 -6.316 1.00 0.00 N ATOM 327 CA LYS A 23 9.234 -13.314 -6.469 1.00 0.00 C ATOM 328 C LYS A 23 10.628 -13.402 -5.910 1.00 0.00 C ATOM 329 O LYS A 23 11.382 -12.415 -5.924 1.00 0.00 O ATOM 330 CB LYS A 23 9.161 -13.807 -7.913 1.00 0.00 C ATOM 331 CG LYS A 23 7.738 -14.054 -8.418 1.00 0.00 C ATOM 332 CD LYS A 23 7.004 -15.074 -7.542 1.00 0.00 C ATOM 333 CE LYS A 23 5.639 -15.412 -8.105 1.00 0.00 C ATOM 334 NZ LYS A 23 4.919 -16.400 -7.274 1.00 0.00 N ATOM 0 H LYS A 23 8.919 -11.334 -7.035 1.00 0.00 H new ATOM 0 HA LYS A 23 8.620 -13.990 -5.874 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.643 -13.074 -8.560 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.731 -14.732 -7.999 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.185 -13.115 -8.427 1.00 0.00 H new ATOM 0 HG3 LYS A 23 7.772 -14.413 -9.447 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.601 -15.983 -7.463 1.00 0.00 H new ATOM 0 HD3 LYS A 23 6.894 -14.676 -6.533 1.00 0.00 H new ATOM 0 HE2 LYS A 23 5.044 -14.502 -8.181 1.00 0.00 H new ATOM 0 HE3 LYS A 23 5.752 -15.804 -9.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 4.595 -17.186 -7.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 5.557 -16.765 -6.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 4.098 -15.945 -6.826 1.00 0.00 H new ATOM 348 N GLU A 24 10.937 -14.582 -5.394 1.00 0.00 N ATOM 349 CA GLU A 24 12.224 -14.928 -4.834 1.00 0.00 C ATOM 350 C GLU A 24 13.314 -14.701 -5.872 1.00 0.00 C ATOM 351 O GLU A 24 14.396 -14.185 -5.560 1.00 0.00 O ATOM 352 CB GLU A 24 12.175 -16.389 -4.370 1.00 0.00 C ATOM 353 CG GLU A 24 13.476 -16.979 -3.877 1.00 0.00 C ATOM 354 CD GLU A 24 13.290 -18.390 -3.406 1.00 0.00 C ATOM 355 OE1 GLU A 24 13.195 -19.316 -4.248 1.00 0.00 O ATOM 356 OE2 GLU A 24 13.225 -18.608 -2.191 1.00 0.00 O ATOM 0 H GLU A 24 10.268 -15.351 -5.355 1.00 0.00 H new ATOM 0 HA GLU A 24 12.455 -14.297 -3.976 1.00 0.00 H new ATOM 0 HB2 GLU A 24 11.438 -16.470 -3.571 1.00 0.00 H new ATOM 0 HB3 GLU A 24 11.815 -16.999 -5.198 1.00 0.00 H new ATOM 0 HG2 GLU A 24 14.215 -16.955 -4.678 1.00 0.00 H new ATOM 0 HG3 GLU A 24 13.868 -16.370 -3.063 1.00 0.00 H new ATOM 363 N SER A 25 13.015 -15.065 -7.095 1.00 0.00 N ATOM 364 CA SER A 25 13.893 -14.802 -8.182 1.00 0.00 C ATOM 365 C SER A 25 13.680 -13.344 -8.628 1.00 0.00 C ATOM 366 O SER A 25 14.504 -12.471 -8.339 1.00 0.00 O ATOM 367 CB SER A 25 13.603 -15.805 -9.305 1.00 0.00 C ATOM 368 OG SER A 25 12.198 -15.863 -9.586 1.00 0.00 O ATOM 0 H SER A 25 12.156 -15.550 -7.353 1.00 0.00 H new ATOM 0 HA SER A 25 14.938 -14.921 -7.897 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.147 -15.517 -10.205 1.00 0.00 H new ATOM 0 HB3 SER A 25 13.962 -16.793 -9.018 1.00 0.00 H new ATOM 0 HG SER A 25 12.035 -16.507 -10.306 1.00 0.00 H new ATOM 374 N ASN A 26 12.534 -13.108 -9.240 1.00 0.00 N ATOM 375 CA ASN A 26 12.039 -11.802 -9.688 1.00 0.00 C ATOM 376 C ASN A 26 10.851 -12.079 -10.577 1.00 0.00 C ATOM 377 O ASN A 26 10.673 -13.224 -11.009 1.00 0.00 O ATOM 378 CB ASN A 26 13.088 -10.967 -10.495 1.00 0.00 C ATOM 379 CG ASN A 26 13.442 -11.525 -11.876 1.00 0.00 C ATOM 380 OD1 ASN A 26 13.463 -12.735 -12.107 1.00 0.00 O ATOM 381 ND2 ASN A 26 13.723 -10.642 -12.801 1.00 0.00 N ATOM 0 H ASN A 26 11.880 -13.861 -9.454 1.00 0.00 H new ATOM 0 HA ASN A 26 11.796 -11.207 -8.808 1.00 0.00 H new ATOM 0 HB2 ASN A 26 12.706 -9.954 -10.617 1.00 0.00 H new ATOM 0 HB3 ASN A 26 14.002 -10.894 -9.905 1.00 0.00 H new ATOM 0 HD21 ASN A 26 13.967 -10.950 -13.742 1.00 0.00 H new ATOM 0 HD22 ASN A 26 13.697 -9.646 -12.580 1.00 0.00 H new ATOM 388 N GLY A 27 10.011 -11.111 -10.806 1.00 0.00 N ATOM 389 CA GLY A 27 8.949 -11.299 -11.714 1.00 0.00 C ATOM 390 C GLY A 27 7.880 -10.359 -11.361 1.00 0.00 C ATOM 391 O GLY A 27 8.028 -9.665 -10.350 1.00 0.00 O ATOM 0 H GLY A 27 10.052 -10.190 -10.371 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.286 -11.126 -12.736 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.585 -12.325 -11.668 1.00 0.00 H new ATOM 395 N PRO A 28 6.818 -10.265 -12.151 1.00 0.00 N ATOM 396 CA PRO A 28 5.706 -9.408 -11.827 1.00 0.00 C ATOM 397 C PRO A 28 5.062 -9.903 -10.554 1.00 0.00 C ATOM 398 O PRO A 28 4.895 -11.119 -10.360 1.00 0.00 O ATOM 399 CB PRO A 28 4.743 -9.570 -13.017 1.00 0.00 C ATOM 400 CG PRO A 28 5.568 -10.172 -14.099 1.00 0.00 C ATOM 401 CD PRO A 28 6.602 -10.997 -13.405 1.00 0.00 C ATOM 0 HA PRO A 28 5.990 -8.367 -11.670 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.901 -10.212 -12.759 1.00 0.00 H new ATOM 0 HB3 PRO A 28 4.329 -8.609 -13.324 1.00 0.00 H new ATOM 0 HG2 PRO A 28 4.958 -10.785 -14.762 1.00 0.00 H new ATOM 0 HG3 PRO A 28 6.031 -9.400 -14.714 1.00 0.00 H new ATOM 0 HD2 PRO A 28 6.253 -12.014 -13.224 1.00 0.00 H new ATOM 0 HD3 PRO A 28 7.518 -11.074 -13.991 1.00 0.00 H new ATOM 409 N VAL A 29 4.731 -9.003 -9.687 1.00 0.00 N ATOM 410 CA VAL A 29 4.133 -9.381 -8.444 1.00 0.00 C ATOM 411 C VAL A 29 2.694 -9.803 -8.646 1.00 0.00 C ATOM 412 O VAL A 29 2.000 -9.349 -9.576 1.00 0.00 O ATOM 413 CB VAL A 29 4.172 -8.233 -7.393 1.00 0.00 C ATOM 414 CG1 VAL A 29 5.592 -7.796 -7.108 1.00 0.00 C ATOM 415 CG2 VAL A 29 3.318 -7.047 -7.827 1.00 0.00 C ATOM 0 H VAL A 29 4.864 -8.000 -9.814 1.00 0.00 H new ATOM 0 HA VAL A 29 4.721 -10.217 -8.065 1.00 0.00 H new ATOM 0 HB VAL A 29 3.749 -8.628 -6.469 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.585 -6.993 -6.370 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.162 -8.640 -6.720 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.054 -7.439 -8.028 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.369 -6.265 -7.069 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.690 -6.658 -8.775 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.283 -7.368 -7.947 1.00 0.00 H new ATOM 425 N LYS A 30 2.291 -10.715 -7.841 1.00 0.00 N ATOM 426 CA LYS A 30 0.941 -11.153 -7.805 1.00 0.00 C ATOM 427 C LYS A 30 0.313 -10.434 -6.647 1.00 0.00 C ATOM 428 O LYS A 30 0.746 -10.606 -5.497 1.00 0.00 O ATOM 429 CB LYS A 30 0.880 -12.650 -7.573 1.00 0.00 C ATOM 430 CG LYS A 30 -0.527 -13.237 -7.560 1.00 0.00 C ATOM 431 CD LYS A 30 -0.526 -14.608 -6.904 1.00 0.00 C ATOM 432 CE LYS A 30 0.399 -15.590 -7.612 1.00 0.00 C ATOM 433 NZ LYS A 30 0.701 -16.758 -6.759 1.00 0.00 N ATOM 0 H LYS A 30 2.900 -11.189 -7.174 1.00 0.00 H new ATOM 0 HA LYS A 30 0.427 -10.944 -8.743 1.00 0.00 H new ATOM 0 HB2 LYS A 30 1.459 -13.148 -8.350 1.00 0.00 H new ATOM 0 HB3 LYS A 30 1.362 -12.876 -6.622 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -1.201 -12.570 -7.022 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -0.904 -13.316 -8.580 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -0.218 -14.509 -5.863 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.540 -15.007 -6.900 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -0.065 -15.925 -8.539 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.327 -15.087 -7.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.536 -17.253 -7.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 0.893 -16.438 -5.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.113 -17.405 -6.756 1.00 0.00 H new ATOM 447 N VAL A 31 -0.626 -9.593 -6.922 1.00 0.00 N ATOM 448 CA VAL A 31 -1.239 -8.825 -5.890 1.00 0.00 C ATOM 449 C VAL A 31 -2.737 -8.771 -6.094 1.00 0.00 C ATOM 450 O VAL A 31 -3.223 -8.504 -7.194 1.00 0.00 O ATOM 451 CB VAL A 31 -0.593 -7.388 -5.739 1.00 0.00 C ATOM 452 CG1 VAL A 31 -0.647 -6.590 -7.023 1.00 0.00 C ATOM 453 CG2 VAL A 31 -1.239 -6.600 -4.604 1.00 0.00 C ATOM 0 H VAL A 31 -0.988 -9.419 -7.859 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.050 -9.328 -4.941 1.00 0.00 H new ATOM 0 HB VAL A 31 0.457 -7.553 -5.497 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -0.191 -5.613 -6.864 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.104 -7.121 -7.805 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.686 -6.460 -7.327 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.770 -5.619 -4.530 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.304 -6.480 -4.805 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.105 -7.138 -3.665 1.00 0.00 H new ATOM 463 N TRP A 32 -3.443 -9.094 -5.072 1.00 0.00 N ATOM 464 CA TRP A 32 -4.869 -9.097 -5.093 1.00 0.00 C ATOM 465 C TRP A 32 -5.336 -8.398 -3.854 1.00 0.00 C ATOM 466 O TRP A 32 -4.885 -8.740 -2.764 1.00 0.00 O ATOM 467 CB TRP A 32 -5.393 -10.541 -5.117 1.00 0.00 C ATOM 468 CG TRP A 32 -6.884 -10.623 -5.181 1.00 0.00 C ATOM 469 CD1 TRP A 32 -7.653 -10.537 -6.293 1.00 0.00 C ATOM 470 CD2 TRP A 32 -7.787 -10.805 -4.082 1.00 0.00 C ATOM 471 NE1 TRP A 32 -8.972 -10.639 -5.961 1.00 0.00 N ATOM 472 CE2 TRP A 32 -9.084 -10.807 -4.614 1.00 0.00 C ATOM 473 CE3 TRP A 32 -7.622 -10.962 -2.705 1.00 0.00 C ATOM 474 CZ2 TRP A 32 -10.213 -10.958 -3.822 1.00 0.00 C ATOM 475 CZ3 TRP A 32 -8.743 -11.114 -1.922 1.00 0.00 C ATOM 476 CH2 TRP A 32 -10.021 -11.111 -2.481 1.00 0.00 C ATOM 0 H TRP A 32 -3.042 -9.370 -4.176 1.00 0.00 H new ATOM 0 HA TRP A 32 -5.242 -8.590 -5.983 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -4.969 -11.061 -5.976 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -5.044 -11.063 -4.226 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -7.276 -10.407 -7.297 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -9.751 -10.596 -6.618 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -6.636 -10.964 -2.264 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -11.204 -10.954 -4.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -8.631 -11.238 -0.855 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -10.879 -11.233 -1.836 1.00 0.00 H new ATOM 487 N GLY A 33 -6.182 -7.409 -3.999 1.00 0.00 N ATOM 488 CA GLY A 33 -6.668 -6.749 -2.855 1.00 0.00 C ATOM 489 C GLY A 33 -8.101 -6.375 -2.980 1.00 0.00 C ATOM 490 O GLY A 33 -8.560 -5.969 -4.044 1.00 0.00 O ATOM 0 H GLY A 33 -6.533 -7.061 -4.891 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.538 -7.393 -1.985 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.076 -5.851 -2.678 1.00 0.00 H new ATOM 494 N SER A 34 -8.791 -6.546 -1.911 1.00 0.00 N ATOM 495 CA SER A 34 -10.161 -6.186 -1.784 1.00 0.00 C ATOM 496 C SER A 34 -10.241 -5.059 -0.755 1.00 0.00 C ATOM 497 O SER A 34 -9.413 -5.030 0.161 1.00 0.00 O ATOM 498 CB SER A 34 -10.948 -7.430 -1.322 1.00 0.00 C ATOM 499 OG SER A 34 -12.342 -7.175 -1.189 1.00 0.00 O ATOM 0 H SER A 34 -8.402 -6.958 -1.063 1.00 0.00 H new ATOM 0 HA SER A 34 -10.588 -5.843 -2.726 1.00 0.00 H new ATOM 0 HB2 SER A 34 -10.796 -8.238 -2.038 1.00 0.00 H new ATOM 0 HB3 SER A 34 -10.552 -7.772 -0.366 1.00 0.00 H new ATOM 0 HG SER A 34 -12.798 -7.992 -0.896 1.00 0.00 H new ATOM 505 N ILE A 35 -11.146 -4.127 -0.920 1.00 0.00 N ATOM 506 CA ILE A 35 -11.356 -3.102 0.080 1.00 0.00 C ATOM 507 C ILE A 35 -12.799 -2.656 -0.021 1.00 0.00 C ATOM 508 O ILE A 35 -13.358 -2.588 -1.112 1.00 0.00 O ATOM 509 CB ILE A 35 -10.371 -1.852 -0.063 1.00 0.00 C ATOM 510 CG1 ILE A 35 -9.984 -1.302 1.310 1.00 0.00 C ATOM 511 CG2 ILE A 35 -11.009 -0.693 -0.839 1.00 0.00 C ATOM 512 CD1 ILE A 35 -9.171 -2.246 2.162 1.00 0.00 C ATOM 0 H ILE A 35 -11.752 -4.054 -1.738 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.135 -3.528 1.059 1.00 0.00 H new ATOM 0 HB ILE A 35 -9.500 -2.224 -0.602 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.418 -0.381 1.171 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.893 -1.039 1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.300 0.132 -0.909 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -11.275 -1.029 -1.841 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -11.906 -0.357 -0.319 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.944 -1.771 3.116 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.740 -3.159 2.338 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.242 -2.491 1.648 1.00 0.00 H new ATOM 524 N LYS A 36 -13.398 -2.448 1.092 1.00 0.00 N ATOM 525 CA LYS A 36 -14.728 -1.960 1.191 1.00 0.00 C ATOM 526 C LYS A 36 -14.716 -0.814 2.166 1.00 0.00 C ATOM 527 O LYS A 36 -14.569 -0.997 3.380 1.00 0.00 O ATOM 528 CB LYS A 36 -15.692 -3.077 1.615 1.00 0.00 C ATOM 529 CG LYS A 36 -15.814 -4.187 0.576 1.00 0.00 C ATOM 530 CD LYS A 36 -16.715 -5.308 1.035 1.00 0.00 C ATOM 531 CE LYS A 36 -16.831 -6.380 -0.035 1.00 0.00 C ATOM 532 NZ LYS A 36 -17.653 -7.518 0.412 1.00 0.00 N ATOM 0 H LYS A 36 -12.960 -2.619 1.997 1.00 0.00 H new ATOM 0 HA LYS A 36 -15.087 -1.609 0.223 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -15.351 -3.505 2.557 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.677 -2.649 1.798 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -16.202 -3.770 -0.353 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -14.824 -4.587 0.357 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -16.321 -5.745 1.952 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -17.704 -4.913 1.269 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -17.268 -5.948 -0.935 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.836 -6.735 -0.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -17.707 -8.227 -0.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -17.223 -7.947 1.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -18.611 -7.185 0.643 1.00 0.00 H new ATOM 546 N GLY A 37 -14.857 0.338 1.621 1.00 0.00 N ATOM 547 CA GLY A 37 -14.715 1.596 2.310 1.00 0.00 C ATOM 548 C GLY A 37 -15.876 2.468 1.981 1.00 0.00 C ATOM 549 O GLY A 37 -16.746 2.045 1.225 1.00 0.00 O ATOM 0 H GLY A 37 -15.086 0.450 0.633 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -14.662 1.431 3.386 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -13.785 2.082 2.016 1.00 0.00 H new ATOM 553 N LEU A 38 -15.975 3.616 2.592 1.00 0.00 N ATOM 554 CA LEU A 38 -17.071 4.531 2.269 1.00 0.00 C ATOM 555 C LEU A 38 -16.884 5.093 0.834 1.00 0.00 C ATOM 556 O LEU A 38 -15.841 4.879 0.217 1.00 0.00 O ATOM 557 CB LEU A 38 -17.177 5.646 3.310 1.00 0.00 C ATOM 558 CG LEU A 38 -17.472 5.193 4.749 1.00 0.00 C ATOM 559 CD1 LEU A 38 -17.518 6.382 5.681 1.00 0.00 C ATOM 560 CD2 LEU A 38 -18.781 4.415 4.821 1.00 0.00 C ATOM 0 H LEU A 38 -15.329 3.950 3.307 1.00 0.00 H new ATOM 0 HA LEU A 38 -18.012 3.982 2.296 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -16.242 6.207 3.310 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -17.962 6.335 2.998 1.00 0.00 H new ATOM 0 HG LEU A 38 -16.665 4.532 5.064 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -17.728 6.042 6.695 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -16.557 6.896 5.663 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -18.302 7.067 5.359 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -18.965 4.107 5.850 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -19.600 5.048 4.480 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -18.715 3.533 4.184 1.00 0.00 H new ATOM 572 N THR A 39 -17.880 5.778 0.302 1.00 0.00 N ATOM 573 CA THR A 39 -17.831 6.168 -1.104 1.00 0.00 C ATOM 574 C THR A 39 -16.790 7.271 -1.426 1.00 0.00 C ATOM 575 O THR A 39 -16.984 8.430 -1.116 1.00 0.00 O ATOM 576 CB THR A 39 -19.268 6.628 -1.565 1.00 0.00 C ATOM 577 OG1 THR A 39 -19.241 7.232 -2.847 1.00 0.00 O ATOM 578 CG2 THR A 39 -19.912 7.590 -0.582 1.00 0.00 C ATOM 0 H THR A 39 -18.717 6.073 0.805 1.00 0.00 H new ATOM 0 HA THR A 39 -17.504 5.288 -1.658 1.00 0.00 H new ATOM 0 HB THR A 39 -19.867 5.718 -1.606 1.00 0.00 H new ATOM 0 HG1 THR A 39 -20.148 7.503 -3.100 1.00 0.00 H new ATOM 0 HG21 THR A 39 -20.899 7.876 -0.946 1.00 0.00 H new ATOM 0 HG22 THR A 39 -20.010 7.106 0.390 1.00 0.00 H new ATOM 0 HG23 THR A 39 -19.290 8.480 -0.483 1.00 0.00 H new ATOM 586 N GLU A 40 -15.726 6.842 -2.033 1.00 0.00 N ATOM 587 CA GLU A 40 -14.675 7.605 -2.645 1.00 0.00 C ATOM 588 C GLU A 40 -13.781 6.613 -3.226 1.00 0.00 C ATOM 589 O GLU A 40 -13.911 5.443 -2.899 1.00 0.00 O ATOM 590 CB GLU A 40 -13.887 8.567 -1.736 1.00 0.00 C ATOM 591 CG GLU A 40 -14.443 9.972 -1.737 1.00 0.00 C ATOM 592 CD GLU A 40 -13.456 10.998 -1.298 1.00 0.00 C ATOM 593 OE1 GLU A 40 -12.555 11.364 -2.103 1.00 0.00 O ATOM 594 OE2 GLU A 40 -13.565 11.503 -0.168 1.00 0.00 O ATOM 0 H GLU A 40 -15.552 5.841 -2.122 1.00 0.00 H new ATOM 0 HA GLU A 40 -15.132 8.288 -3.362 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -13.893 8.181 -0.717 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -12.847 8.594 -2.061 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -14.789 10.217 -2.741 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -15.313 10.011 -1.081 1.00 0.00 H new ATOM 601 N GLY A 41 -12.943 6.987 -4.050 1.00 0.00 N ATOM 602 CA GLY A 41 -11.972 6.094 -4.441 1.00 0.00 C ATOM 603 C GLY A 41 -11.406 6.465 -5.709 1.00 0.00 C ATOM 604 O GLY A 41 -12.140 6.755 -6.670 1.00 0.00 O ATOM 0 H GLY A 41 -12.900 7.912 -4.478 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.186 6.054 -3.687 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -12.400 5.094 -4.509 1.00 0.00 H new ATOM 608 N LEU A 42 -10.131 6.492 -5.745 1.00 0.00 N ATOM 609 CA LEU A 42 -9.462 6.827 -6.923 1.00 0.00 C ATOM 610 C LEU A 42 -8.518 5.686 -7.231 1.00 0.00 C ATOM 611 O LEU A 42 -8.915 4.727 -7.862 1.00 0.00 O ATOM 612 CB LEU A 42 -8.721 8.173 -6.775 1.00 0.00 C ATOM 613 CG LEU A 42 -9.535 9.432 -6.389 1.00 0.00 C ATOM 614 CD1 LEU A 42 -9.878 9.449 -4.906 1.00 0.00 C ATOM 615 CD2 LEU A 42 -8.787 10.695 -6.769 1.00 0.00 C ATOM 0 H LEU A 42 -9.526 6.281 -4.952 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.162 6.964 -7.748 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.942 8.040 -6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.220 8.380 -7.721 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.470 9.396 -6.948 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.449 10.348 -4.675 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.472 8.569 -4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.959 9.442 -4.320 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.378 11.567 -6.488 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.830 10.722 -6.247 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -8.614 10.705 -7.845 1.00 0.00 H new ATOM 627 N HIS A 43 -7.331 5.735 -6.659 1.00 0.00 N ATOM 628 CA HIS A 43 -6.317 4.699 -6.719 1.00 0.00 C ATOM 629 C HIS A 43 -5.254 5.130 -5.772 1.00 0.00 C ATOM 630 O HIS A 43 -5.247 6.295 -5.361 1.00 0.00 O ATOM 631 CB HIS A 43 -5.661 4.483 -8.123 1.00 0.00 C ATOM 632 CG HIS A 43 -6.501 3.804 -9.184 1.00 0.00 C ATOM 633 ND1 HIS A 43 -7.008 2.524 -9.063 1.00 0.00 N ATOM 634 CD2 HIS A 43 -6.909 4.241 -10.398 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.676 2.216 -10.154 1.00 0.00 C ATOM 636 NE2 HIS A 43 -7.637 3.233 -10.977 1.00 0.00 N ATOM 0 H HIS A 43 -7.032 6.541 -6.111 1.00 0.00 H new ATOM 0 HA HIS A 43 -6.794 3.749 -6.478 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -5.356 5.457 -8.506 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.753 3.896 -7.985 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -6.700 5.208 -10.832 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.175 1.277 -10.340 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -8.076 3.270 -11.897 1.00 0.00 H new ATOM 645 N GLY A 44 -4.411 4.234 -5.384 1.00 0.00 N ATOM 646 CA GLY A 44 -3.305 4.622 -4.571 1.00 0.00 C ATOM 647 C GLY A 44 -3.111 3.739 -3.390 1.00 0.00 C ATOM 648 O GLY A 44 -4.070 3.201 -2.842 1.00 0.00 O ATOM 0 H GLY A 44 -4.463 3.241 -5.611 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.398 4.615 -5.175 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -3.454 5.647 -4.231 1.00 0.00 H new ATOM 652 N PHE A 45 -1.874 3.548 -3.057 1.00 0.00 N ATOM 653 CA PHE A 45 -1.436 2.804 -1.905 1.00 0.00 C ATOM 654 C PHE A 45 0.026 3.105 -1.674 1.00 0.00 C ATOM 655 O PHE A 45 0.904 2.553 -2.313 1.00 0.00 O ATOM 656 CB PHE A 45 -1.684 1.294 -2.073 1.00 0.00 C ATOM 657 CG PHE A 45 -1.166 0.374 -0.982 1.00 0.00 C ATOM 658 CD1 PHE A 45 0.158 -0.040 -0.973 1.00 0.00 C ATOM 659 CD2 PHE A 45 -2.008 -0.117 -0.013 1.00 0.00 C ATOM 660 CE1 PHE A 45 0.625 -0.904 -0.029 1.00 0.00 C ATOM 661 CE2 PHE A 45 -1.538 -0.983 0.945 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.217 -1.376 0.933 1.00 0.00 C ATOM 0 H PHE A 45 -1.099 3.923 -3.604 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.015 3.109 -1.033 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -2.759 1.137 -2.163 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.236 0.982 -3.017 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.833 0.331 -1.730 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.046 0.180 -0.004 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.659 -1.214 -0.043 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.205 -1.356 1.708 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.151 -2.058 1.686 1.00 0.00 H new ATOM 672 N HIS A 46 0.268 4.016 -0.806 1.00 0.00 N ATOM 673 CA HIS A 46 1.573 4.379 -0.440 1.00 0.00 C ATOM 674 C HIS A 46 1.715 3.993 0.963 1.00 0.00 C ATOM 675 O HIS A 46 1.298 4.732 1.913 1.00 0.00 O ATOM 676 CB HIS A 46 1.818 5.874 -0.702 1.00 0.00 C ATOM 677 CG HIS A 46 3.060 6.549 -0.151 1.00 0.00 C ATOM 678 ND1 HIS A 46 4.139 5.925 0.459 1.00 0.00 N ATOM 679 CD2 HIS A 46 3.350 7.864 -0.117 1.00 0.00 C ATOM 680 CE1 HIS A 46 5.008 6.834 0.830 1.00 0.00 C ATOM 681 NE2 HIS A 46 4.555 8.015 0.490 1.00 0.00 N ATOM 0 H HIS A 46 -0.460 4.540 -0.321 1.00 0.00 H new ATOM 0 HA HIS A 46 2.332 3.872 -1.036 1.00 0.00 H new ATOM 0 HB2 HIS A 46 1.824 6.017 -1.783 1.00 0.00 H new ATOM 0 HB3 HIS A 46 0.956 6.416 -0.314 1.00 0.00 H new ATOM 0 HD2 HIS A 46 2.732 8.660 -0.505 1.00 0.00 H new ATOM 0 HE1 HIS A 46 5.944 6.641 1.333 1.00 0.00 H new ATOM 0 HE2 HIS A 46 5.030 8.903 0.654 1.00 0.00 H new ATOM 690 N VAL A 47 2.145 2.787 1.081 1.00 0.00 N ATOM 691 CA VAL A 47 2.458 2.159 2.293 1.00 0.00 C ATOM 692 C VAL A 47 3.706 2.816 2.826 1.00 0.00 C ATOM 693 O VAL A 47 4.335 3.631 2.157 1.00 0.00 O ATOM 694 CB VAL A 47 2.702 0.616 2.044 1.00 0.00 C ATOM 695 CG1 VAL A 47 3.915 0.358 1.152 1.00 0.00 C ATOM 696 CG2 VAL A 47 2.782 -0.212 3.333 1.00 0.00 C ATOM 0 H VAL A 47 2.294 2.182 0.273 1.00 0.00 H new ATOM 0 HA VAL A 47 1.644 2.257 3.011 1.00 0.00 H new ATOM 0 HB VAL A 47 1.814 0.274 1.513 1.00 0.00 H new ATOM 0 HG11 VAL A 47 4.041 -0.715 1.011 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.763 0.836 0.184 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.808 0.769 1.624 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.951 -1.259 3.083 1.00 0.00 H new ATOM 0 HG22 VAL A 47 3.605 0.151 3.948 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.847 -0.117 3.885 1.00 0.00 H new ATOM 706 N HIS A 48 3.975 2.532 3.995 1.00 0.00 N ATOM 707 CA HIS A 48 5.165 2.937 4.638 1.00 0.00 C ATOM 708 C HIS A 48 5.465 1.956 5.730 1.00 0.00 C ATOM 709 O HIS A 48 4.800 1.919 6.769 1.00 0.00 O ATOM 710 CB HIS A 48 5.118 4.390 5.149 1.00 0.00 C ATOM 711 CG HIS A 48 6.402 4.833 5.803 1.00 0.00 C ATOM 712 ND1 HIS A 48 7.638 4.443 5.366 1.00 0.00 N ATOM 713 CD2 HIS A 48 6.624 5.593 6.889 1.00 0.00 C ATOM 714 CE1 HIS A 48 8.559 4.939 6.158 1.00 0.00 C ATOM 715 NE2 HIS A 48 7.972 5.642 7.092 1.00 0.00 N ATOM 0 H HIS A 48 3.357 1.981 4.590 1.00 0.00 H new ATOM 0 HA HIS A 48 5.976 2.935 3.909 1.00 0.00 H new ATOM 0 HB2 HIS A 48 4.895 5.055 4.314 1.00 0.00 H new ATOM 0 HB3 HIS A 48 4.301 4.491 5.863 1.00 0.00 H new ATOM 0 HD2 HIS A 48 5.871 6.078 7.492 1.00 0.00 H new ATOM 0 HE1 HIS A 48 9.624 4.791 6.056 1.00 0.00 H new ATOM 0 HE2 HIS A 48 8.443 6.143 7.845 1.00 0.00 H new ATOM 724 N GLU A 49 6.420 1.134 5.450 1.00 0.00 N ATOM 725 CA GLU A 49 6.883 0.119 6.379 1.00 0.00 C ATOM 726 C GLU A 49 7.566 0.801 7.570 1.00 0.00 C ATOM 727 O GLU A 49 8.038 1.942 7.438 1.00 0.00 O ATOM 728 CB GLU A 49 7.861 -0.879 5.720 1.00 0.00 C ATOM 729 CG GLU A 49 7.480 -1.399 4.341 1.00 0.00 C ATOM 730 CD GLU A 49 7.886 -0.437 3.234 1.00 0.00 C ATOM 731 OE1 GLU A 49 7.142 0.491 2.945 1.00 0.00 O ATOM 732 OE2 GLU A 49 8.996 -0.612 2.668 1.00 0.00 O ATOM 0 H GLU A 49 6.918 1.136 4.560 1.00 0.00 H new ATOM 0 HA GLU A 49 6.014 -0.450 6.710 1.00 0.00 H new ATOM 0 HB2 GLU A 49 8.837 -0.400 5.645 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.975 -1.734 6.386 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.956 -2.365 4.174 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.403 -1.564 4.301 1.00 0.00 H new ATOM 739 N PHE A 50 7.635 0.082 8.668 1.00 0.00 N ATOM 740 CA PHE A 50 7.973 0.599 9.975 1.00 0.00 C ATOM 741 C PHE A 50 6.748 1.289 10.518 1.00 0.00 C ATOM 742 O PHE A 50 6.637 2.510 10.620 1.00 0.00 O ATOM 743 CB PHE A 50 9.252 1.477 10.043 1.00 0.00 C ATOM 744 CG PHE A 50 9.574 2.005 11.420 1.00 0.00 C ATOM 745 CD1 PHE A 50 9.850 1.138 12.465 1.00 0.00 C ATOM 746 CD2 PHE A 50 9.584 3.368 11.669 1.00 0.00 C ATOM 747 CE1 PHE A 50 10.133 1.617 13.724 1.00 0.00 C ATOM 748 CE2 PHE A 50 9.866 3.853 12.929 1.00 0.00 C ATOM 749 CZ PHE A 50 10.140 2.974 13.957 1.00 0.00 C ATOM 0 H PHE A 50 7.449 -0.921 8.675 1.00 0.00 H new ATOM 0 HA PHE A 50 8.255 -0.243 10.607 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.099 0.892 9.684 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.136 2.320 9.362 1.00 0.00 H new ATOM 0 HD1 PHE A 50 9.843 0.072 12.289 1.00 0.00 H new ATOM 0 HD2 PHE A 50 9.368 4.059 10.867 1.00 0.00 H new ATOM 0 HE1 PHE A 50 10.349 0.929 14.528 1.00 0.00 H new ATOM 0 HE2 PHE A 50 9.872 4.918 13.111 1.00 0.00 H new ATOM 0 HZ PHE A 50 10.360 3.351 14.945 1.00 0.00 H new ATOM 759 N GLY A 51 5.772 0.451 10.700 1.00 0.00 N ATOM 760 CA GLY A 51 4.541 0.806 11.303 1.00 0.00 C ATOM 761 C GLY A 51 4.468 0.093 12.603 1.00 0.00 C ATOM 762 O GLY A 51 5.435 0.162 13.371 1.00 0.00 O ATOM 0 H GLY A 51 5.821 -0.529 10.420 1.00 0.00 H new ATOM 0 HA2 GLY A 51 4.482 1.884 11.452 1.00 0.00 H new ATOM 0 HA3 GLY A 51 3.704 0.526 10.663 1.00 0.00 H new ATOM 766 N ASP A 52 3.393 -0.659 12.844 1.00 0.00 N ATOM 767 CA ASP A 52 3.286 -1.425 14.099 1.00 0.00 C ATOM 768 C ASP A 52 2.039 -2.270 14.162 1.00 0.00 C ATOM 769 O ASP A 52 2.106 -3.496 14.032 1.00 0.00 O ATOM 770 CB ASP A 52 3.363 -0.537 15.352 1.00 0.00 C ATOM 771 CG ASP A 52 3.428 -1.362 16.616 1.00 0.00 C ATOM 772 OD1 ASP A 52 4.471 -2.029 16.852 1.00 0.00 O ATOM 773 OD2 ASP A 52 2.450 -1.376 17.386 1.00 0.00 O ATOM 0 H ASP A 52 2.600 -0.757 12.209 1.00 0.00 H new ATOM 0 HA ASP A 52 4.153 -2.085 14.092 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.242 0.105 15.290 1.00 0.00 H new ATOM 0 HB3 ASP A 52 2.492 0.118 15.389 1.00 0.00 H new ATOM 778 N ASN A 53 0.904 -1.631 14.321 1.00 0.00 N ATOM 779 CA ASN A 53 -0.338 -2.347 14.519 1.00 0.00 C ATOM 780 C ASN A 53 -1.461 -1.847 13.621 1.00 0.00 C ATOM 781 O ASN A 53 -1.311 -0.884 12.879 1.00 0.00 O ATOM 782 CB ASN A 53 -0.774 -2.306 16.007 1.00 0.00 C ATOM 783 CG ASN A 53 -0.982 -0.896 16.559 1.00 0.00 C ATOM 784 OD1 ASN A 53 -1.294 0.041 15.827 1.00 0.00 O ATOM 785 ND2 ASN A 53 -0.855 -0.747 17.847 1.00 0.00 N ATOM 0 H ASN A 53 0.813 -0.615 14.317 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.143 -3.381 14.236 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -1.701 -2.868 16.118 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.020 -2.813 16.609 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -1.016 0.166 18.273 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -0.595 -1.543 18.429 1.00 0.00 H new ATOM 792 N THR A 54 -2.572 -2.510 13.734 1.00 0.00 N ATOM 793 CA THR A 54 -3.795 -2.249 13.004 1.00 0.00 C ATOM 794 C THR A 54 -4.627 -1.132 13.708 1.00 0.00 C ATOM 795 O THR A 54 -5.780 -0.837 13.362 1.00 0.00 O ATOM 796 CB THR A 54 -4.579 -3.581 12.903 1.00 0.00 C ATOM 797 OG1 THR A 54 -3.686 -4.580 12.389 1.00 0.00 O ATOM 798 CG2 THR A 54 -5.777 -3.481 11.981 1.00 0.00 C ATOM 0 H THR A 54 -2.664 -3.298 14.375 1.00 0.00 H new ATOM 0 HA THR A 54 -3.576 -1.883 12.001 1.00 0.00 H new ATOM 0 HB THR A 54 -4.951 -3.834 13.896 1.00 0.00 H new ATOM 0 HG1 THR A 54 -4.159 -5.435 12.317 1.00 0.00 H new ATOM 0 HG21 THR A 54 -6.291 -4.442 11.946 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.460 -2.718 12.353 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.443 -3.212 10.979 1.00 0.00 H new ATOM 806 N ALA A 55 -4.043 -0.541 14.713 1.00 0.00 N ATOM 807 CA ALA A 55 -4.711 0.490 15.472 1.00 0.00 C ATOM 808 C ALA A 55 -4.566 1.813 14.770 1.00 0.00 C ATOM 809 O ALA A 55 -5.450 2.676 14.839 1.00 0.00 O ATOM 810 CB ALA A 55 -4.164 0.575 16.874 1.00 0.00 C ATOM 0 H ALA A 55 -3.098 -0.755 15.031 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.769 0.236 15.543 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.686 1.360 17.421 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -4.310 -0.379 17.380 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -3.099 0.806 16.836 1.00 0.00 H new ATOM 816 N GLY A 56 -3.476 1.971 14.110 1.00 0.00 N ATOM 817 CA GLY A 56 -3.214 3.155 13.386 1.00 0.00 C ATOM 818 C GLY A 56 -1.775 3.207 13.061 1.00 0.00 C ATOM 819 O GLY A 56 -0.972 2.563 13.739 1.00 0.00 O ATOM 0 H GLY A 56 -2.735 1.272 14.059 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.808 3.178 12.472 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -3.500 4.027 13.974 1.00 0.00 H new ATOM 823 N CYS A 57 -1.421 3.915 12.039 1.00 0.00 N ATOM 824 CA CYS A 57 -0.046 4.016 11.678 1.00 0.00 C ATOM 825 C CYS A 57 0.586 5.074 12.509 1.00 0.00 C ATOM 826 O CYS A 57 0.536 6.259 12.165 1.00 0.00 O ATOM 827 CB CYS A 57 0.115 4.347 10.220 1.00 0.00 C ATOM 828 SG CYS A 57 -0.747 3.189 9.102 1.00 0.00 S ATOM 0 H CYS A 57 -2.065 4.432 11.440 1.00 0.00 H new ATOM 0 HA CYS A 57 0.437 3.055 11.854 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -0.259 5.355 10.042 1.00 0.00 H new ATOM 0 HB3 CYS A 57 1.177 4.353 9.973 1.00 0.00 H new ATOM 833 N THR A 58 1.086 4.652 13.641 1.00 0.00 N ATOM 834 CA THR A 58 1.757 5.487 14.574 1.00 0.00 C ATOM 835 C THR A 58 3.154 5.803 14.075 1.00 0.00 C ATOM 836 O THR A 58 3.502 6.956 13.844 1.00 0.00 O ATOM 837 CB THR A 58 1.822 4.742 15.919 1.00 0.00 C ATOM 838 OG1 THR A 58 2.180 3.357 15.660 1.00 0.00 O ATOM 839 CG2 THR A 58 0.473 4.798 16.630 1.00 0.00 C ATOM 0 H THR A 58 1.029 3.678 13.940 1.00 0.00 H new ATOM 0 HA THR A 58 1.222 6.429 14.696 1.00 0.00 H new ATOM 0 HB THR A 58 2.566 5.215 16.560 1.00 0.00 H new ATOM 0 HG1 THR A 58 2.228 2.867 16.508 1.00 0.00 H new ATOM 0 HG21 THR A 58 0.539 4.266 17.579 1.00 0.00 H new ATOM 0 HG22 THR A 58 0.202 5.837 16.815 1.00 0.00 H new ATOM 0 HG23 THR A 58 -0.288 4.331 16.004 1.00 0.00 H new ATOM 847 N SER A 59 3.922 4.765 13.864 1.00 0.00 N ATOM 848 CA SER A 59 5.274 4.895 13.433 1.00 0.00 C ATOM 849 C SER A 59 5.413 5.416 12.013 1.00 0.00 C ATOM 850 O SER A 59 6.231 6.301 11.755 1.00 0.00 O ATOM 851 CB SER A 59 6.017 3.580 13.628 1.00 0.00 C ATOM 852 OG SER A 59 6.059 3.236 15.007 1.00 0.00 O ATOM 0 H SER A 59 3.616 3.800 13.990 1.00 0.00 H new ATOM 0 HA SER A 59 5.734 5.657 14.062 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.523 2.789 13.064 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.031 3.666 13.237 1.00 0.00 H new ATOM 0 HG SER A 59 6.538 2.388 15.118 1.00 0.00 H new ATOM 858 N ALA A 60 4.600 4.927 11.104 1.00 0.00 N ATOM 859 CA ALA A 60 4.738 5.330 9.740 1.00 0.00 C ATOM 860 C ALA A 60 4.178 6.727 9.488 1.00 0.00 C ATOM 861 O ALA A 60 4.704 7.451 8.628 1.00 0.00 O ATOM 862 CB ALA A 60 4.033 4.323 8.859 1.00 0.00 C ATOM 0 H ALA A 60 3.850 4.260 11.288 1.00 0.00 H new ATOM 0 HA ALA A 60 5.801 5.367 9.503 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.132 4.621 7.815 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.481 3.339 9.000 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.977 4.282 9.126 1.00 0.00 H new ATOM 868 N GLY A 61 3.221 7.152 10.322 1.00 0.00 N ATOM 869 CA GLY A 61 2.568 8.441 10.131 1.00 0.00 C ATOM 870 C GLY A 61 2.094 8.619 8.686 1.00 0.00 C ATOM 871 O GLY A 61 1.667 7.666 8.058 1.00 0.00 O ATOM 0 H GLY A 61 2.888 6.623 11.128 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.717 8.523 10.807 1.00 0.00 H new ATOM 0 HA3 GLY A 61 3.260 9.243 10.390 1.00 0.00 H new ATOM 875 N PRO A 62 2.149 9.824 8.143 1.00 0.00 N ATOM 876 CA PRO A 62 1.850 10.071 6.741 1.00 0.00 C ATOM 877 C PRO A 62 3.151 10.203 5.922 1.00 0.00 C ATOM 878 O PRO A 62 3.131 10.469 4.713 1.00 0.00 O ATOM 879 CB PRO A 62 1.132 11.420 6.815 1.00 0.00 C ATOM 880 CG PRO A 62 1.755 12.134 7.993 1.00 0.00 C ATOM 881 CD PRO A 62 2.440 11.084 8.853 1.00 0.00 C ATOM 0 HA PRO A 62 1.274 9.279 6.263 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.265 11.988 5.894 1.00 0.00 H new ATOM 0 HB3 PRO A 62 0.059 11.288 6.956 1.00 0.00 H new ATOM 0 HG2 PRO A 62 2.474 12.880 7.653 1.00 0.00 H new ATOM 0 HG3 PRO A 62 0.994 12.663 8.567 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.512 11.264 8.930 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.044 11.075 9.869 1.00 0.00 H new ATOM 889 N HIS A 63 4.265 9.954 6.598 1.00 0.00 N ATOM 890 CA HIS A 63 5.590 10.236 6.089 1.00 0.00 C ATOM 891 C HIS A 63 6.043 9.188 5.070 1.00 0.00 C ATOM 892 O HIS A 63 5.632 8.027 5.129 1.00 0.00 O ATOM 893 CB HIS A 63 6.570 10.342 7.280 1.00 0.00 C ATOM 894 CG HIS A 63 7.918 10.919 6.951 1.00 0.00 C ATOM 895 ND1 HIS A 63 8.116 12.253 6.717 1.00 0.00 N ATOM 896 CD2 HIS A 63 9.125 10.337 6.811 1.00 0.00 C ATOM 897 CE1 HIS A 63 9.382 12.470 6.444 1.00 0.00 C ATOM 898 NE2 HIS A 63 10.016 11.322 6.494 1.00 0.00 N ATOM 0 H HIS A 63 4.267 9.543 7.532 1.00 0.00 H new ATOM 0 HA HIS A 63 5.573 11.186 5.555 1.00 0.00 H new ATOM 0 HB2 HIS A 63 6.110 10.955 8.055 1.00 0.00 H new ATOM 0 HB3 HIS A 63 6.712 9.347 7.703 1.00 0.00 H new ATOM 0 HD2 HIS A 63 9.347 9.286 6.928 1.00 0.00 H new ATOM 0 HE1 HIS A 63 9.825 13.428 6.217 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.013 11.187 6.324 1.00 0.00 H new ATOM 907 N PHE A 64 6.863 9.615 4.130 1.00 0.00 N ATOM 908 CA PHE A 64 7.386 8.745 3.091 1.00 0.00 C ATOM 909 C PHE A 64 8.586 7.905 3.562 1.00 0.00 C ATOM 910 O PHE A 64 9.137 8.131 4.644 1.00 0.00 O ATOM 911 CB PHE A 64 7.710 9.542 1.826 1.00 0.00 C ATOM 912 CG PHE A 64 8.621 10.734 2.025 1.00 0.00 C ATOM 913 CD1 PHE A 64 9.978 10.570 2.272 1.00 0.00 C ATOM 914 CD2 PHE A 64 8.116 12.014 1.953 1.00 0.00 C ATOM 915 CE1 PHE A 64 10.796 11.657 2.447 1.00 0.00 C ATOM 916 CE2 PHE A 64 8.935 13.106 2.127 1.00 0.00 C ATOM 917 CZ PHE A 64 10.276 12.928 2.373 1.00 0.00 C ATOM 0 H PHE A 64 7.188 10.580 4.064 1.00 0.00 H new ATOM 0 HA PHE A 64 6.599 8.030 2.849 1.00 0.00 H new ATOM 0 HB2 PHE A 64 8.172 8.870 1.102 1.00 0.00 H new ATOM 0 HB3 PHE A 64 6.775 9.890 1.387 1.00 0.00 H new ATOM 0 HD1 PHE A 64 10.394 9.575 2.327 1.00 0.00 H new ATOM 0 HD2 PHE A 64 7.064 12.162 1.758 1.00 0.00 H new ATOM 0 HE1 PHE A 64 11.849 11.515 2.643 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.524 14.103 2.070 1.00 0.00 H new ATOM 0 HZ PHE A 64 10.920 13.785 2.508 1.00 0.00 H new ATOM 927 N ASN A 65 8.970 6.963 2.748 1.00 0.00 N ATOM 928 CA ASN A 65 9.999 6.009 3.073 1.00 0.00 C ATOM 929 C ASN A 65 11.291 6.354 2.306 1.00 0.00 C ATOM 930 O ASN A 65 11.244 6.804 1.184 1.00 0.00 O ATOM 931 CB ASN A 65 9.437 4.634 2.638 1.00 0.00 C ATOM 932 CG ASN A 65 10.278 3.412 2.938 1.00 0.00 C ATOM 933 OD1 ASN A 65 11.051 3.369 3.893 1.00 0.00 O ATOM 934 ND2 ASN A 65 10.085 2.395 2.153 1.00 0.00 N ATOM 0 H ASN A 65 8.569 6.832 1.819 1.00 0.00 H new ATOM 0 HA ASN A 65 10.252 6.011 4.133 1.00 0.00 H new ATOM 0 HB2 ASN A 65 8.466 4.500 3.115 1.00 0.00 H new ATOM 0 HB3 ASN A 65 9.262 4.667 1.563 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.584 1.521 2.319 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.435 2.471 1.371 1.00 0.00 H new ATOM 941 N PRO A 66 12.474 6.173 2.901 1.00 0.00 N ATOM 942 CA PRO A 66 13.739 6.384 2.187 1.00 0.00 C ATOM 943 C PRO A 66 14.023 5.233 1.229 1.00 0.00 C ATOM 944 O PRO A 66 14.814 5.350 0.301 1.00 0.00 O ATOM 945 CB PRO A 66 14.793 6.379 3.302 1.00 0.00 C ATOM 946 CG PRO A 66 14.032 6.460 4.578 1.00 0.00 C ATOM 947 CD PRO A 66 12.704 5.846 4.308 1.00 0.00 C ATOM 0 HA PRO A 66 13.727 7.299 1.594 1.00 0.00 H new ATOM 0 HB2 PRO A 66 15.398 5.473 3.264 1.00 0.00 H new ATOM 0 HB3 PRO A 66 15.475 7.223 3.199 1.00 0.00 H new ATOM 0 HG2 PRO A 66 14.552 5.929 5.376 1.00 0.00 H new ATOM 0 HG3 PRO A 66 13.924 7.495 4.902 1.00 0.00 H new ATOM 0 HD2 PRO A 66 12.715 4.769 4.476 1.00 0.00 H new ATOM 0 HD3 PRO A 66 11.928 6.261 4.951 1.00 0.00 H new ATOM 955 N LEU A 67 13.282 4.168 1.404 1.00 0.00 N ATOM 956 CA LEU A 67 13.522 2.934 0.714 1.00 0.00 C ATOM 957 C LEU A 67 12.428 2.731 -0.311 1.00 0.00 C ATOM 958 O LEU A 67 12.209 1.643 -0.844 1.00 0.00 O ATOM 959 CB LEU A 67 13.619 1.767 1.717 1.00 0.00 C ATOM 960 CG LEU A 67 14.060 0.406 1.154 1.00 0.00 C ATOM 961 CD1 LEU A 67 15.420 0.513 0.469 1.00 0.00 C ATOM 962 CD2 LEU A 67 14.115 -0.624 2.259 1.00 0.00 C ATOM 0 H LEU A 67 12.485 4.137 2.040 1.00 0.00 H new ATOM 0 HA LEU A 67 14.477 2.969 0.190 1.00 0.00 H new ATOM 0 HB2 LEU A 67 14.318 2.052 2.504 1.00 0.00 H new ATOM 0 HB3 LEU A 67 12.644 1.641 2.187 1.00 0.00 H new ATOM 0 HG LEU A 67 13.326 0.092 0.411 1.00 0.00 H new ATOM 0 HD11 LEU A 67 15.709 -0.463 0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 67 15.359 1.228 -0.352 1.00 0.00 H new ATOM 0 HD13 LEU A 67 16.165 0.851 1.190 1.00 0.00 H new ATOM 0 HD21 LEU A 67 14.429 -1.583 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 67 14.828 -0.305 3.019 1.00 0.00 H new ATOM 0 HD23 LEU A 67 13.128 -0.728 2.709 1.00 0.00 H new ATOM 974 N SER A 68 11.804 3.838 -0.672 1.00 0.00 N ATOM 975 CA SER A 68 10.826 3.867 -1.713 1.00 0.00 C ATOM 976 C SER A 68 11.526 3.745 -3.066 1.00 0.00 C ATOM 977 O SER A 68 10.904 3.585 -4.075 1.00 0.00 O ATOM 978 CB SER A 68 10.052 5.145 -1.623 1.00 0.00 C ATOM 979 OG SER A 68 9.450 5.262 -0.366 1.00 0.00 O ATOM 0 H SER A 68 11.973 4.745 -0.238 1.00 0.00 H new ATOM 0 HA SER A 68 10.133 3.032 -1.606 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.715 5.992 -1.796 1.00 0.00 H new ATOM 0 HB3 SER A 68 9.290 5.172 -2.402 1.00 0.00 H new ATOM 0 HG SER A 68 10.004 5.829 0.210 1.00 0.00 H new ATOM 985 N ARG A 69 12.864 3.673 -2.992 1.00 0.00 N ATOM 986 CA ARG A 69 13.843 3.503 -4.070 1.00 0.00 C ATOM 987 C ARG A 69 13.718 2.123 -4.651 1.00 0.00 C ATOM 988 O ARG A 69 14.396 1.782 -5.608 1.00 0.00 O ATOM 989 CB ARG A 69 15.245 3.584 -3.447 1.00 0.00 C ATOM 990 CG ARG A 69 15.708 4.951 -2.955 1.00 0.00 C ATOM 991 CD ARG A 69 16.312 5.793 -4.074 1.00 0.00 C ATOM 992 NE ARG A 69 15.355 6.209 -5.106 1.00 0.00 N ATOM 993 CZ ARG A 69 15.521 5.987 -6.422 1.00 0.00 C ATOM 994 NH1 ARG A 69 16.392 5.066 -6.843 1.00 0.00 N ATOM 995 NH2 ARG A 69 14.778 6.648 -7.300 1.00 0.00 N ATOM 0 H ARG A 69 13.330 3.739 -2.087 1.00 0.00 H new ATOM 0 HA ARG A 69 13.679 4.263 -4.834 1.00 0.00 H new ATOM 0 HB2 ARG A 69 15.282 2.891 -2.606 1.00 0.00 H new ATOM 0 HB3 ARG A 69 15.964 3.229 -4.185 1.00 0.00 H new ATOM 0 HG2 ARG A 69 14.863 5.483 -2.518 1.00 0.00 H new ATOM 0 HG3 ARG A 69 16.446 4.819 -2.163 1.00 0.00 H new ATOM 0 HD2 ARG A 69 16.766 6.683 -3.638 1.00 0.00 H new ATOM 0 HD3 ARG A 69 17.113 5.225 -4.547 1.00 0.00 H new ATOM 0 HE ARG A 69 14.511 6.697 -4.806 1.00 0.00 H new ATOM 0 HH11 ARG A 69 16.933 4.529 -6.166 1.00 0.00 H new ATOM 0 HH12 ARG A 69 16.516 4.900 -7.842 1.00 0.00 H new ATOM 0 HH21 ARG A 69 14.084 7.322 -6.976 1.00 0.00 H new ATOM 0 HH22 ARG A 69 14.901 6.483 -8.299 1.00 0.00 H new ATOM 1009 N LYS A 70 12.857 1.354 -4.048 1.00 0.00 N ATOM 1010 CA LYS A 70 12.523 0.023 -4.472 1.00 0.00 C ATOM 1011 C LYS A 70 11.015 -0.173 -4.289 1.00 0.00 C ATOM 1012 O LYS A 70 10.534 -1.278 -4.052 1.00 0.00 O ATOM 1013 CB LYS A 70 13.355 -1.021 -3.697 1.00 0.00 C ATOM 1014 CG LYS A 70 14.859 -0.965 -4.015 1.00 0.00 C ATOM 1015 CD LYS A 70 15.652 -1.957 -3.195 1.00 0.00 C ATOM 1016 CE LYS A 70 17.145 -1.898 -3.491 1.00 0.00 C ATOM 1017 NZ LYS A 70 17.471 -2.292 -4.879 1.00 0.00 N ATOM 0 H LYS A 70 12.348 1.648 -3.214 1.00 0.00 H new ATOM 0 HA LYS A 70 12.768 -0.118 -5.525 1.00 0.00 H new ATOM 0 HB2 LYS A 70 13.212 -0.867 -2.628 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.980 -2.018 -3.928 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.013 -1.167 -5.075 1.00 0.00 H new ATOM 0 HG3 LYS A 70 15.232 0.042 -3.825 1.00 0.00 H new ATOM 0 HD2 LYS A 70 15.487 -1.762 -2.135 1.00 0.00 H new ATOM 0 HD3 LYS A 70 15.285 -2.964 -3.394 1.00 0.00 H new ATOM 0 HE2 LYS A 70 17.506 -0.885 -3.311 1.00 0.00 H new ATOM 0 HE3 LYS A 70 17.674 -2.553 -2.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 18.503 -2.348 -4.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 17.050 -3.220 -5.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 17.090 -1.585 -5.539 1.00 0.00 H new ATOM 1031 N HIS A 71 10.280 0.936 -4.411 1.00 0.00 N ATOM 1032 CA HIS A 71 8.813 0.966 -4.351 1.00 0.00 C ATOM 1033 C HIS A 71 8.277 2.033 -5.348 1.00 0.00 C ATOM 1034 O HIS A 71 8.089 1.745 -6.505 1.00 0.00 O ATOM 1035 CB HIS A 71 8.260 1.264 -2.943 1.00 0.00 C ATOM 1036 CG HIS A 71 8.544 0.271 -1.841 1.00 0.00 C ATOM 1037 ND1 HIS A 71 7.967 -0.978 -1.777 1.00 0.00 N ATOM 1038 CD2 HIS A 71 9.276 0.394 -0.706 1.00 0.00 C ATOM 1039 CE1 HIS A 71 8.327 -1.561 -0.644 1.00 0.00 C ATOM 1040 NE2 HIS A 71 9.116 -0.749 0.018 1.00 0.00 N ATOM 0 H HIS A 71 10.694 1.857 -4.557 1.00 0.00 H new ATOM 0 HA HIS A 71 8.469 -0.033 -4.620 1.00 0.00 H new ATOM 0 HB2 HIS A 71 8.652 2.231 -2.629 1.00 0.00 H new ATOM 0 HB3 HIS A 71 7.178 1.370 -3.025 1.00 0.00 H new ATOM 0 HD2 HIS A 71 9.878 1.246 -0.426 1.00 0.00 H new ATOM 0 HE1 HIS A 71 8.021 -2.544 -0.318 1.00 0.00 H new ATOM 0 HE2 HIS A 71 9.540 -0.942 0.925 1.00 0.00 H new ATOM 1049 N GLY A 72 8.056 3.263 -4.877 1.00 0.00 N ATOM 1050 CA GLY A 72 7.696 4.377 -5.757 1.00 0.00 C ATOM 1051 C GLY A 72 6.250 4.474 -6.147 1.00 0.00 C ATOM 1052 O GLY A 72 5.582 5.461 -5.849 1.00 0.00 O ATOM 0 H GLY A 72 8.120 3.512 -3.890 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.981 5.307 -5.266 1.00 0.00 H new ATOM 0 HA3 GLY A 72 8.292 4.301 -6.667 1.00 0.00 H new ATOM 1056 N GLY A 73 5.821 3.501 -6.830 1.00 0.00 N ATOM 1057 CA GLY A 73 4.496 3.398 -7.318 1.00 0.00 C ATOM 1058 C GLY A 73 4.298 1.991 -7.796 1.00 0.00 C ATOM 1059 O GLY A 73 5.286 1.317 -8.065 1.00 0.00 O ATOM 0 H GLY A 73 6.407 2.706 -7.084 1.00 0.00 H new ATOM 0 HA2 GLY A 73 3.779 3.641 -6.534 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.331 4.105 -8.131 1.00 0.00 H new ATOM 1063 N PRO A 74 3.061 1.527 -7.951 1.00 0.00 N ATOM 1064 CA PRO A 74 2.745 0.130 -8.305 1.00 0.00 C ATOM 1065 C PRO A 74 3.411 -0.389 -9.597 1.00 0.00 C ATOM 1066 O PRO A 74 3.703 -1.578 -9.714 1.00 0.00 O ATOM 1067 CB PRO A 74 1.224 0.136 -8.459 1.00 0.00 C ATOM 1068 CG PRO A 74 0.873 1.562 -8.646 1.00 0.00 C ATOM 1069 CD PRO A 74 1.851 2.326 -7.808 1.00 0.00 C ATOM 0 HA PRO A 74 3.128 -0.544 -7.539 1.00 0.00 H new ATOM 0 HB2 PRO A 74 0.910 -0.465 -9.312 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.735 -0.280 -7.578 1.00 0.00 H new ATOM 0 HG2 PRO A 74 0.945 1.850 -9.695 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -0.152 1.759 -8.331 1.00 0.00 H new ATOM 0 HD2 PRO A 74 1.990 3.345 -8.170 1.00 0.00 H new ATOM 0 HD3 PRO A 74 1.530 2.398 -6.769 1.00 0.00 H new ATOM 1077 N LYS A 75 3.653 0.480 -10.548 1.00 0.00 N ATOM 1078 CA LYS A 75 4.233 0.051 -11.807 1.00 0.00 C ATOM 1079 C LYS A 75 5.739 0.391 -11.842 1.00 0.00 C ATOM 1080 O LYS A 75 6.466 0.016 -12.782 1.00 0.00 O ATOM 1081 CB LYS A 75 3.499 0.716 -12.998 1.00 0.00 C ATOM 1082 CG LYS A 75 3.889 0.150 -14.362 1.00 0.00 C ATOM 1083 CD LYS A 75 3.262 -1.215 -14.627 1.00 0.00 C ATOM 1084 CE LYS A 75 1.845 -1.063 -15.153 1.00 0.00 C ATOM 1085 NZ LYS A 75 1.182 -2.361 -15.388 1.00 0.00 N ATOM 0 H LYS A 75 3.461 1.480 -10.481 1.00 0.00 H new ATOM 0 HA LYS A 75 4.117 -1.029 -11.894 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.424 0.598 -12.861 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.706 1.786 -12.987 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.581 0.846 -15.142 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.974 0.066 -14.420 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.866 -1.764 -15.349 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.253 -1.801 -13.708 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.258 -0.483 -14.441 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.866 -0.497 -16.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.872 -2.418 -16.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.850 -3.133 -15.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.356 -2.447 -14.762 1.00 0.00 H new ATOM 1099 N ASP A 76 6.209 1.075 -10.827 1.00 0.00 N ATOM 1100 CA ASP A 76 7.601 1.493 -10.780 1.00 0.00 C ATOM 1101 C ASP A 76 8.290 0.684 -9.685 1.00 0.00 C ATOM 1102 O ASP A 76 7.763 -0.356 -9.292 1.00 0.00 O ATOM 1103 CB ASP A 76 7.702 3.005 -10.492 1.00 0.00 C ATOM 1104 CG ASP A 76 8.965 3.629 -11.074 1.00 0.00 C ATOM 1105 OD1 ASP A 76 10.081 3.261 -10.681 1.00 0.00 O ATOM 1106 OD2 ASP A 76 8.857 4.497 -11.961 1.00 0.00 O ATOM 0 H ASP A 76 5.653 1.357 -10.020 1.00 0.00 H new ATOM 0 HA ASP A 76 8.086 1.314 -11.740 1.00 0.00 H new ATOM 0 HB2 ASP A 76 6.828 3.509 -10.905 1.00 0.00 H new ATOM 0 HB3 ASP A 76 7.684 3.168 -9.414 1.00 0.00 H new ATOM 1111 N GLU A 77 9.465 1.127 -9.237 1.00 0.00 N ATOM 1112 CA GLU A 77 10.232 0.471 -8.189 1.00 0.00 C ATOM 1113 C GLU A 77 11.419 1.333 -7.750 1.00 0.00 C ATOM 1114 O GLU A 77 12.515 0.835 -7.517 1.00 0.00 O ATOM 1115 CB GLU A 77 10.655 -0.939 -8.616 1.00 0.00 C ATOM 1116 CG GLU A 77 11.255 -1.009 -9.998 1.00 0.00 C ATOM 1117 CD GLU A 77 11.324 -2.409 -10.510 1.00 0.00 C ATOM 1118 OE1 GLU A 77 10.476 -3.260 -10.106 1.00 0.00 O ATOM 1119 OE2 GLU A 77 12.185 -2.687 -11.361 1.00 0.00 O ATOM 0 H GLU A 77 9.914 1.967 -9.602 1.00 0.00 H new ATOM 0 HA GLU A 77 9.590 0.356 -7.316 1.00 0.00 H new ATOM 0 HB2 GLU A 77 11.379 -1.323 -7.897 1.00 0.00 H new ATOM 0 HB3 GLU A 77 9.786 -1.596 -8.575 1.00 0.00 H new ATOM 0 HG2 GLU A 77 10.661 -0.402 -10.682 1.00 0.00 H new ATOM 0 HG3 GLU A 77 12.257 -0.580 -9.980 1.00 0.00 H new ATOM 1126 N GLU A 78 11.173 2.623 -7.628 1.00 0.00 N ATOM 1127 CA GLU A 78 12.139 3.591 -7.129 1.00 0.00 C ATOM 1128 C GLU A 78 11.359 4.830 -6.754 1.00 0.00 C ATOM 1129 O GLU A 78 10.301 4.940 -7.219 1.00 0.00 O ATOM 1130 CB GLU A 78 13.195 3.954 -8.185 1.00 0.00 C ATOM 1131 CG GLU A 78 12.672 4.773 -9.351 1.00 0.00 C ATOM 1132 CD GLU A 78 13.763 5.229 -10.265 1.00 0.00 C ATOM 1133 OE1 GLU A 78 14.472 6.224 -9.932 1.00 0.00 O ATOM 1134 OE2 GLU A 78 13.940 4.628 -11.327 1.00 0.00 O ATOM 0 H GLU A 78 10.276 3.040 -7.878 1.00 0.00 H new ATOM 0 HA GLU A 78 12.674 3.166 -6.280 1.00 0.00 H new ATOM 0 HB2 GLU A 78 13.998 4.509 -7.700 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.633 3.034 -8.572 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.954 4.178 -9.916 1.00 0.00 H new ATOM 0 HG3 GLU A 78 12.136 5.642 -8.969 1.00 0.00 H new ATOM 1141 N ARG A 79 11.819 5.594 -5.746 1.00 0.00 N ATOM 1142 CA ARG A 79 11.346 6.948 -5.324 1.00 0.00 C ATOM 1143 C ARG A 79 11.845 7.196 -3.894 1.00 0.00 C ATOM 1144 O ARG A 79 12.740 6.508 -3.381 1.00 0.00 O ATOM 1145 CB ARG A 79 9.778 7.206 -5.347 1.00 0.00 C ATOM 1146 CG ARG A 79 9.113 7.387 -6.733 1.00 0.00 C ATOM 1147 CD ARG A 79 9.664 8.554 -7.539 1.00 0.00 C ATOM 1148 NE ARG A 79 9.249 8.444 -8.947 1.00 0.00 N ATOM 1149 CZ ARG A 79 8.564 9.353 -9.663 1.00 0.00 C ATOM 1150 NH1 ARG A 79 8.291 10.561 -9.167 1.00 0.00 N ATOM 1151 NH2 ARG A 79 8.206 9.057 -10.906 1.00 0.00 N ATOM 0 H ARG A 79 12.585 5.269 -5.156 1.00 0.00 H new ATOM 0 HA ARG A 79 11.751 7.631 -6.070 1.00 0.00 H new ATOM 0 HB2 ARG A 79 9.290 6.371 -4.844 1.00 0.00 H new ATOM 0 HB3 ARG A 79 9.573 8.098 -4.755 1.00 0.00 H new ATOM 0 HG2 ARG A 79 9.241 6.470 -7.308 1.00 0.00 H new ATOM 0 HG3 ARG A 79 8.041 7.529 -6.594 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.307 9.495 -7.120 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.752 8.568 -7.474 1.00 0.00 H new ATOM 0 HE ARG A 79 9.509 7.585 -9.432 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.603 10.809 -8.228 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.770 11.236 -9.727 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.451 8.151 -11.305 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.686 9.736 -11.462 1.00 0.00 H new ATOM 1165 N HIS A 80 11.277 8.169 -3.296 1.00 0.00 N ATOM 1166 CA HIS A 80 11.435 8.508 -1.889 1.00 0.00 C ATOM 1167 C HIS A 80 10.091 8.946 -1.353 1.00 0.00 C ATOM 1168 O HIS A 80 9.755 8.684 -0.239 1.00 0.00 O ATOM 1169 CB HIS A 80 12.450 9.650 -1.637 1.00 0.00 C ATOM 1170 CG HIS A 80 13.894 9.278 -1.755 1.00 0.00 C ATOM 1171 ND1 HIS A 80 14.722 9.088 -0.665 1.00 0.00 N ATOM 1172 CD2 HIS A 80 14.667 9.081 -2.839 1.00 0.00 C ATOM 1173 CE1 HIS A 80 15.929 8.789 -1.086 1.00 0.00 C ATOM 1174 NE2 HIS A 80 15.924 8.777 -2.397 1.00 0.00 N ATOM 0 H HIS A 80 10.645 8.805 -3.782 1.00 0.00 H new ATOM 0 HA HIS A 80 11.818 7.620 -1.387 1.00 0.00 H new ATOM 0 HB2 HIS A 80 12.244 10.456 -2.342 1.00 0.00 H new ATOM 0 HB3 HIS A 80 12.278 10.049 -0.637 1.00 0.00 H new ATOM 0 HD1 HIS A 80 14.440 9.167 0.312 1.00 0.00 H new ATOM 0 HD2 HIS A 80 14.352 9.150 -3.870 1.00 0.00 H new ATOM 0 HE1 HIS A 80 16.784 8.587 -0.457 1.00 0.00 H new ATOM 1183 N VAL A 81 9.316 9.611 -2.190 1.00 0.00 N ATOM 1184 CA VAL A 81 8.048 10.178 -1.764 1.00 0.00 C ATOM 1185 C VAL A 81 6.849 9.192 -1.945 1.00 0.00 C ATOM 1186 O VAL A 81 5.764 9.436 -1.424 1.00 0.00 O ATOM 1187 CB VAL A 81 7.786 11.542 -2.507 1.00 0.00 C ATOM 1188 CG1 VAL A 81 6.532 12.252 -2.005 1.00 0.00 C ATOM 1189 CG2 VAL A 81 8.989 12.466 -2.363 1.00 0.00 C ATOM 0 H VAL A 81 9.542 9.772 -3.171 1.00 0.00 H new ATOM 0 HA VAL A 81 8.122 10.367 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 81 7.629 11.300 -3.558 1.00 0.00 H new ATOM 0 HG11 VAL A 81 6.399 13.186 -2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.664 11.613 -2.164 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.636 12.465 -0.941 1.00 0.00 H new ATOM 0 HG21 VAL A 81 8.792 13.404 -2.882 1.00 0.00 H new ATOM 0 HG22 VAL A 81 9.169 12.667 -1.307 1.00 0.00 H new ATOM 0 HG23 VAL A 81 9.868 11.989 -2.797 1.00 0.00 H new ATOM 1199 N GLY A 82 7.055 8.059 -2.599 1.00 0.00 N ATOM 1200 CA GLY A 82 5.926 7.158 -2.862 1.00 0.00 C ATOM 1201 C GLY A 82 6.301 5.716 -2.728 1.00 0.00 C ATOM 1202 O GLY A 82 7.460 5.384 -2.867 1.00 0.00 O ATOM 0 H GLY A 82 7.959 7.742 -2.950 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.115 7.385 -2.170 1.00 0.00 H new ATOM 0 HA3 GLY A 82 5.547 7.340 -3.868 1.00 0.00 H new ATOM 1206 N ASP A 83 5.327 4.854 -2.523 1.00 0.00 N ATOM 1207 CA ASP A 83 5.585 3.445 -2.308 1.00 0.00 C ATOM 1208 C ASP A 83 4.728 2.590 -3.202 1.00 0.00 C ATOM 1209 O ASP A 83 3.845 3.082 -3.858 1.00 0.00 O ATOM 1210 CB ASP A 83 5.568 3.009 -0.830 1.00 0.00 C ATOM 1211 CG ASP A 83 6.791 3.517 -0.060 1.00 0.00 C ATOM 1212 OD1 ASP A 83 7.908 2.989 -0.264 1.00 0.00 O ATOM 1213 OD2 ASP A 83 6.657 4.468 0.708 1.00 0.00 O ATOM 0 H ASP A 83 4.339 5.108 -2.501 1.00 0.00 H new ATOM 0 HA ASP A 83 6.621 3.279 -2.604 1.00 0.00 H new ATOM 0 HB2 ASP A 83 4.661 3.382 -0.354 1.00 0.00 H new ATOM 0 HB3 ASP A 83 5.533 1.921 -0.775 1.00 0.00 H new ATOM 1218 N LEU A 84 4.969 1.321 -3.216 1.00 0.00 N ATOM 1219 CA LEU A 84 4.402 0.509 -4.268 1.00 0.00 C ATOM 1220 C LEU A 84 3.135 -0.233 -3.858 1.00 0.00 C ATOM 1221 O LEU A 84 3.180 -1.169 -3.048 1.00 0.00 O ATOM 1222 CB LEU A 84 5.483 -0.437 -4.830 1.00 0.00 C ATOM 1223 CG LEU A 84 5.183 -1.145 -6.163 1.00 0.00 C ATOM 1224 CD1 LEU A 84 6.457 -1.665 -6.764 1.00 0.00 C ATOM 1225 CD2 LEU A 84 4.199 -2.292 -6.001 1.00 0.00 C ATOM 0 H LEU A 84 5.540 0.823 -2.533 1.00 0.00 H new ATOM 0 HA LEU A 84 4.074 1.182 -5.060 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.401 0.137 -4.953 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.683 -1.202 -4.080 1.00 0.00 H new ATOM 0 HG LEU A 84 4.727 -0.407 -6.823 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.237 -2.165 -7.707 1.00 0.00 H new ATOM 0 HD12 LEU A 84 7.140 -0.835 -6.944 1.00 0.00 H new ATOM 0 HD13 LEU A 84 6.921 -2.373 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.021 -2.758 -6.970 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.611 -3.030 -5.313 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.258 -1.911 -5.603 1.00 0.00 H new ATOM 1237 N GLY A 85 2.018 0.238 -4.371 1.00 0.00 N ATOM 1238 CA GLY A 85 0.761 -0.464 -4.273 1.00 0.00 C ATOM 1239 C GLY A 85 -0.341 0.361 -4.887 1.00 0.00 C ATOM 1240 O GLY A 85 -0.082 1.460 -5.361 1.00 0.00 O ATOM 0 H GLY A 85 1.959 1.125 -4.871 1.00 0.00 H new ATOM 0 HA2 GLY A 85 0.832 -1.426 -4.781 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.532 -0.671 -3.228 1.00 0.00 H new ATOM 1244 N ASN A 86 -1.550 -0.146 -4.905 1.00 0.00 N ATOM 1245 CA ASN A 86 -2.678 0.628 -5.354 1.00 0.00 C ATOM 1246 C ASN A 86 -3.928 -0.006 -4.794 1.00 0.00 C ATOM 1247 O ASN A 86 -4.028 -1.227 -4.745 1.00 0.00 O ATOM 1248 CB ASN A 86 -2.761 0.738 -6.904 1.00 0.00 C ATOM 1249 CG ASN A 86 -3.130 -0.557 -7.601 1.00 0.00 C ATOM 1250 OD1 ASN A 86 -4.309 -0.844 -7.834 1.00 0.00 O ATOM 1251 ND2 ASN A 86 -2.140 -1.334 -7.950 1.00 0.00 N ATOM 0 H ASN A 86 -1.777 -1.096 -4.612 1.00 0.00 H new ATOM 0 HA ASN A 86 -2.565 1.650 -4.993 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.496 1.500 -7.164 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -1.799 1.081 -7.285 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.327 -2.213 -8.433 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -1.180 -1.062 -7.740 1.00 0.00 H new ATOM 1258 N VAL A 87 -4.819 0.802 -4.287 1.00 0.00 N ATOM 1259 CA VAL A 87 -6.064 0.356 -3.789 1.00 0.00 C ATOM 1260 C VAL A 87 -7.097 1.205 -4.486 1.00 0.00 C ATOM 1261 O VAL A 87 -6.789 2.323 -4.899 1.00 0.00 O ATOM 1262 CB VAL A 87 -6.133 0.517 -2.228 1.00 0.00 C ATOM 1263 CG1 VAL A 87 -7.512 0.209 -1.691 1.00 0.00 C ATOM 1264 CG2 VAL A 87 -5.139 -0.412 -1.555 1.00 0.00 C ATOM 0 H VAL A 87 -4.683 1.810 -4.213 1.00 0.00 H new ATOM 0 HA VAL A 87 -6.228 -0.704 -3.983 1.00 0.00 H new ATOM 0 HB VAL A 87 -5.891 1.557 -2.007 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.517 0.332 -0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.237 0.890 -2.137 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -7.779 -0.818 -1.940 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -5.200 -0.288 -0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.372 -1.444 -1.815 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -4.131 -0.172 -1.892 1.00 0.00 H new ATOM 1274 N THR A 88 -8.258 0.689 -4.665 1.00 0.00 N ATOM 1275 CA THR A 88 -9.278 1.364 -5.354 1.00 0.00 C ATOM 1276 C THR A 88 -10.539 1.199 -4.536 1.00 0.00 C ATOM 1277 O THR A 88 -10.651 0.287 -3.789 1.00 0.00 O ATOM 1278 CB THR A 88 -9.475 0.732 -6.757 1.00 0.00 C ATOM 1279 OG1 THR A 88 -8.197 0.594 -7.423 1.00 0.00 O ATOM 1280 CG2 THR A 88 -10.397 1.581 -7.629 1.00 0.00 C ATOM 0 H THR A 88 -8.524 -0.235 -4.326 1.00 0.00 H new ATOM 0 HA THR A 88 -9.031 2.417 -5.488 1.00 0.00 H new ATOM 0 HB THR A 88 -9.933 -0.247 -6.614 1.00 0.00 H new ATOM 0 HG1 THR A 88 -7.924 1.461 -7.790 1.00 0.00 H new ATOM 0 HG21 THR A 88 -10.512 1.108 -8.604 1.00 0.00 H new ATOM 0 HG22 THR A 88 -11.372 1.668 -7.150 1.00 0.00 H new ATOM 0 HG23 THR A 88 -9.965 2.574 -7.756 1.00 0.00 H new ATOM 1288 N ALA A 89 -11.356 2.134 -4.589 1.00 0.00 N ATOM 1289 CA ALA A 89 -12.639 2.139 -4.030 1.00 0.00 C ATOM 1290 C ALA A 89 -13.389 3.022 -4.970 1.00 0.00 C ATOM 1291 O ALA A 89 -12.738 3.732 -5.724 1.00 0.00 O ATOM 1292 CB ALA A 89 -12.616 2.688 -2.612 1.00 0.00 C ATOM 0 H ALA A 89 -11.139 3.008 -5.068 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.086 1.150 -3.929 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -13.626 2.680 -2.202 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -11.968 2.068 -1.992 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -12.237 3.710 -2.624 1.00 0.00 H new ATOM 1298 N ASP A 90 -14.626 2.889 -5.103 1.00 0.00 N ATOM 1299 CA ASP A 90 -15.321 3.852 -5.894 1.00 0.00 C ATOM 1300 C ASP A 90 -16.466 4.356 -5.048 1.00 0.00 C ATOM 1301 O ASP A 90 -16.430 4.224 -3.824 1.00 0.00 O ATOM 1302 CB ASP A 90 -15.778 3.246 -7.249 1.00 0.00 C ATOM 1303 CG ASP A 90 -16.191 4.309 -8.244 1.00 0.00 C ATOM 1304 OD1 ASP A 90 -15.305 4.938 -8.864 1.00 0.00 O ATOM 1305 OD2 ASP A 90 -17.402 4.578 -8.370 1.00 0.00 O ATOM 0 H ASP A 90 -15.195 2.147 -4.694 1.00 0.00 H new ATOM 0 HA ASP A 90 -14.676 4.686 -6.170 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -14.967 2.652 -7.671 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -16.614 2.568 -7.078 1.00 0.00 H new ATOM 1310 N LYS A 91 -17.465 4.889 -5.651 1.00 0.00 N ATOM 1311 CA LYS A 91 -18.622 5.423 -4.981 1.00 0.00 C ATOM 1312 C LYS A 91 -19.490 4.339 -4.304 1.00 0.00 C ATOM 1313 O LYS A 91 -20.564 4.625 -3.771 1.00 0.00 O ATOM 1314 CB LYS A 91 -19.434 6.274 -5.952 1.00 0.00 C ATOM 1315 CG LYS A 91 -18.648 7.448 -6.504 1.00 0.00 C ATOM 1316 CD LYS A 91 -19.464 8.265 -7.480 1.00 0.00 C ATOM 1317 CE LYS A 91 -18.655 9.428 -8.028 1.00 0.00 C ATOM 1318 NZ LYS A 91 -17.440 8.972 -8.741 1.00 0.00 N ATOM 0 H LYS A 91 -17.513 4.975 -6.666 1.00 0.00 H new ATOM 0 HA LYS A 91 -18.266 6.054 -4.167 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -19.774 5.650 -6.778 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -20.325 6.645 -5.445 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.322 8.085 -5.682 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -17.749 7.082 -7.000 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -19.797 7.630 -8.301 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -20.359 8.642 -6.985 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -19.275 10.013 -8.707 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.369 10.088 -7.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -17.066 9.749 -9.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -16.720 8.680 -8.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -17.679 8.166 -9.353 1.00 0.00 H new ATOM 1332 N ASP A 92 -19.017 3.117 -4.318 1.00 0.00 N ATOM 1333 CA ASP A 92 -19.671 2.026 -3.632 1.00 0.00 C ATOM 1334 C ASP A 92 -18.738 1.509 -2.547 1.00 0.00 C ATOM 1335 O ASP A 92 -19.147 0.738 -1.679 1.00 0.00 O ATOM 1336 CB ASP A 92 -20.014 0.871 -4.589 1.00 0.00 C ATOM 1337 CG ASP A 92 -20.824 1.297 -5.787 1.00 0.00 C ATOM 1338 OD1 ASP A 92 -22.050 1.444 -5.670 1.00 0.00 O ATOM 1339 OD2 ASP A 92 -20.230 1.493 -6.878 1.00 0.00 O ATOM 0 H ASP A 92 -18.163 2.848 -4.808 1.00 0.00 H new ATOM 0 HA ASP A 92 -20.604 2.397 -3.208 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.089 0.409 -4.933 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -20.567 0.108 -4.040 1.00 0.00 H new ATOM 1344 N GLY A 93 -17.494 1.992 -2.568 1.00 0.00 N ATOM 1345 CA GLY A 93 -16.464 1.530 -1.654 1.00 0.00 C ATOM 1346 C GLY A 93 -16.101 0.070 -1.862 1.00 0.00 C ATOM 1347 O GLY A 93 -16.429 -0.771 -1.036 1.00 0.00 O ATOM 0 H GLY A 93 -17.180 2.712 -3.219 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -15.571 2.143 -1.781 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -16.805 1.672 -0.628 1.00 0.00 H new ATOM 1351 N VAL A 94 -15.392 -0.213 -2.951 1.00 0.00 N ATOM 1352 CA VAL A 94 -15.021 -1.558 -3.380 1.00 0.00 C ATOM 1353 C VAL A 94 -13.759 -1.420 -4.220 1.00 0.00 C ATOM 1354 O VAL A 94 -13.683 -0.538 -5.083 1.00 0.00 O ATOM 1355 CB VAL A 94 -16.126 -2.262 -4.276 1.00 0.00 C ATOM 1356 CG1 VAL A 94 -15.693 -3.660 -4.698 1.00 0.00 C ATOM 1357 CG2 VAL A 94 -17.477 -2.346 -3.582 1.00 0.00 C ATOM 0 H VAL A 94 -15.048 0.512 -3.580 1.00 0.00 H new ATOM 0 HA VAL A 94 -14.890 -2.173 -2.490 1.00 0.00 H new ATOM 0 HB VAL A 94 -16.236 -1.633 -5.159 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -16.473 -4.113 -5.310 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -14.770 -3.597 -5.274 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -15.526 -4.272 -3.812 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -18.194 -2.836 -4.240 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -17.378 -2.921 -2.661 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -17.828 -1.341 -3.347 1.00 0.00 H new ATOM 1367 N ALA A 95 -12.801 -2.244 -3.956 1.00 0.00 N ATOM 1368 CA ALA A 95 -11.556 -2.263 -4.659 1.00 0.00 C ATOM 1369 C ALA A 95 -11.518 -3.227 -5.776 1.00 0.00 C ATOM 1370 O ALA A 95 -11.855 -4.403 -5.643 1.00 0.00 O ATOM 1371 CB ALA A 95 -10.409 -2.653 -3.734 1.00 0.00 C ATOM 0 H ALA A 95 -12.862 -2.948 -3.220 1.00 0.00 H new ATOM 0 HA ALA A 95 -11.451 -1.249 -5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.475 -2.659 -4.296 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -10.338 -1.933 -2.919 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.593 -3.646 -3.325 1.00 0.00 H new ATOM 1377 N ASP A 96 -11.156 -2.698 -6.875 1.00 0.00 N ATOM 1378 CA ASP A 96 -10.673 -3.451 -7.959 1.00 0.00 C ATOM 1379 C ASP A 96 -9.215 -3.159 -7.919 1.00 0.00 C ATOM 1380 O ASP A 96 -8.803 -2.010 -8.132 1.00 0.00 O ATOM 1381 CB ASP A 96 -11.260 -2.994 -9.294 1.00 0.00 C ATOM 1382 CG ASP A 96 -10.662 -3.744 -10.469 1.00 0.00 C ATOM 1383 OD1 ASP A 96 -10.820 -4.968 -10.546 1.00 0.00 O ATOM 1384 OD2 ASP A 96 -10.032 -3.117 -11.342 1.00 0.00 O ATOM 0 H ASP A 96 -11.189 -1.694 -7.052 1.00 0.00 H new ATOM 0 HA ASP A 96 -10.932 -4.507 -7.882 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -12.340 -3.140 -9.283 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -11.084 -1.926 -9.420 1.00 0.00 H new ATOM 1389 N VAL A 97 -8.438 -4.091 -7.509 1.00 0.00 N ATOM 1390 CA VAL A 97 -7.047 -3.810 -7.425 1.00 0.00 C ATOM 1391 C VAL A 97 -6.430 -4.005 -8.783 1.00 0.00 C ATOM 1392 O VAL A 97 -6.789 -4.927 -9.532 1.00 0.00 O ATOM 1393 CB VAL A 97 -6.304 -4.695 -6.374 1.00 0.00 C ATOM 1394 CG1 VAL A 97 -6.149 -6.129 -6.846 1.00 0.00 C ATOM 1395 CG2 VAL A 97 -4.956 -4.103 -5.994 1.00 0.00 C ATOM 0 H VAL A 97 -8.725 -5.030 -7.233 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.940 -2.778 -7.091 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.928 -4.708 -5.481 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.627 -6.708 -6.084 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.134 -6.563 -7.021 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -5.575 -6.147 -7.772 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -4.469 -4.747 -5.261 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -4.329 -4.026 -6.882 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -5.102 -3.111 -5.566 1.00 0.00 H new ATOM 1405 N SER A 98 -5.589 -3.128 -9.144 1.00 0.00 N ATOM 1406 CA SER A 98 -4.855 -3.327 -10.304 1.00 0.00 C ATOM 1407 C SER A 98 -3.642 -4.125 -9.892 1.00 0.00 C ATOM 1408 O SER A 98 -2.879 -3.700 -9.022 1.00 0.00 O ATOM 1409 CB SER A 98 -4.449 -1.983 -10.911 1.00 0.00 C ATOM 1410 OG SER A 98 -5.593 -1.173 -11.190 1.00 0.00 O ATOM 0 H SER A 98 -5.395 -2.260 -8.645 1.00 0.00 H new ATOM 0 HA SER A 98 -5.431 -3.854 -11.065 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.787 -1.456 -10.224 1.00 0.00 H new ATOM 0 HB3 SER A 98 -3.887 -2.151 -11.830 1.00 0.00 H new ATOM 0 HG SER A 98 -5.304 -0.320 -11.575 1.00 0.00 H new ATOM 1416 N ILE A 99 -3.467 -5.266 -10.455 1.00 0.00 N ATOM 1417 CA ILE A 99 -2.273 -5.992 -10.162 1.00 0.00 C ATOM 1418 C ILE A 99 -1.254 -5.575 -11.196 1.00 0.00 C ATOM 1419 O ILE A 99 -1.370 -5.856 -12.364 1.00 0.00 O ATOM 1420 CB ILE A 99 -2.546 -7.545 -10.197 1.00 0.00 C ATOM 1421 CG1 ILE A 99 -1.252 -8.372 -10.227 1.00 0.00 C ATOM 1422 CG2 ILE A 99 -3.491 -7.945 -11.333 1.00 0.00 C ATOM 1423 CD1 ILE A 99 -1.492 -9.868 -10.229 1.00 0.00 C ATOM 0 H ILE A 99 -4.113 -5.713 -11.105 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.905 -5.772 -9.160 1.00 0.00 H new ATOM 0 HB ILE A 99 -3.051 -7.779 -9.260 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -0.678 -8.103 -11.114 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -0.643 -8.111 -9.362 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -3.647 -9.024 -11.314 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -4.447 -7.438 -11.206 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -3.052 -7.659 -12.289 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -0.535 -10.390 -10.251 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -2.039 -10.150 -9.329 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -2.075 -10.142 -11.108 1.00 0.00 H new ATOM 1435 N GLU A 100 -0.234 -4.940 -10.703 1.00 0.00 N ATOM 1436 CA GLU A 100 0.733 -4.245 -11.508 1.00 0.00 C ATOM 1437 C GLU A 100 2.015 -4.981 -11.576 1.00 0.00 C ATOM 1438 O GLU A 100 2.298 -5.827 -10.728 1.00 0.00 O ATOM 1439 CB GLU A 100 0.919 -2.815 -10.993 1.00 0.00 C ATOM 1440 CG GLU A 100 -0.314 -1.937 -11.209 1.00 0.00 C ATOM 1441 CD GLU A 100 -0.540 -1.613 -12.663 1.00 0.00 C ATOM 1442 OE1 GLU A 100 -0.661 -2.538 -13.487 1.00 0.00 O ATOM 1443 OE2 GLU A 100 -0.582 -0.423 -13.018 1.00 0.00 O ATOM 0 H GLU A 100 -0.043 -4.888 -9.702 1.00 0.00 H new ATOM 0 HA GLU A 100 0.355 -4.189 -12.529 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.155 -2.846 -9.929 1.00 0.00 H new ATOM 0 HB3 GLU A 100 1.773 -2.362 -11.496 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.193 -2.445 -10.812 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -0.200 -1.010 -10.646 1.00 0.00 H new ATOM 1450 N ASP A 101 2.777 -4.712 -12.598 1.00 0.00 N ATOM 1451 CA ASP A 101 3.988 -5.440 -12.788 1.00 0.00 C ATOM 1452 C ASP A 101 5.060 -4.738 -12.011 1.00 0.00 C ATOM 1453 O ASP A 101 5.610 -3.724 -12.454 1.00 0.00 O ATOM 1454 CB ASP A 101 4.388 -5.429 -14.274 1.00 0.00 C ATOM 1455 CG ASP A 101 3.236 -5.659 -15.221 1.00 0.00 C ATOM 1456 OD1 ASP A 101 2.901 -6.828 -15.515 1.00 0.00 O ATOM 1457 OD2 ASP A 101 2.640 -4.645 -15.701 1.00 0.00 O ATOM 0 H ASP A 101 2.580 -4.001 -13.302 1.00 0.00 H new ATOM 0 HA ASP A 101 3.856 -6.471 -12.460 1.00 0.00 H new ATOM 0 HB2 ASP A 101 4.851 -4.471 -14.508 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.142 -6.197 -14.442 1.00 0.00 H new ATOM 1462 N SER A 102 5.286 -5.217 -10.845 1.00 0.00 N ATOM 1463 CA SER A 102 6.326 -4.773 -10.016 1.00 0.00 C ATOM 1464 C SER A 102 7.323 -5.865 -10.080 1.00 0.00 C ATOM 1465 O SER A 102 6.904 -7.020 -10.135 1.00 0.00 O ATOM 1466 CB SER A 102 5.798 -4.620 -8.615 1.00 0.00 C ATOM 1467 OG SER A 102 4.543 -3.960 -8.627 1.00 0.00 O ATOM 0 H SER A 102 4.724 -5.960 -10.431 1.00 0.00 H new ATOM 0 HA SER A 102 6.748 -3.813 -10.315 1.00 0.00 H new ATOM 0 HB2 SER A 102 5.696 -5.600 -8.149 1.00 0.00 H new ATOM 0 HB3 SER A 102 6.508 -4.053 -8.012 1.00 0.00 H new ATOM 0 HG SER A 102 4.626 -3.108 -9.104 1.00 0.00 H new ATOM 1473 N VAL A 103 8.569 -5.599 -10.104 1.00 0.00 N ATOM 1474 CA VAL A 103 9.465 -6.700 -10.081 1.00 0.00 C ATOM 1475 C VAL A 103 10.360 -6.702 -8.857 1.00 0.00 C ATOM 1476 O VAL A 103 10.382 -7.682 -8.111 1.00 0.00 O ATOM 1477 CB VAL A 103 10.217 -6.938 -11.442 1.00 0.00 C ATOM 1478 CG1 VAL A 103 10.833 -5.682 -11.984 1.00 0.00 C ATOM 1479 CG2 VAL A 103 11.272 -8.014 -11.311 1.00 0.00 C ATOM 0 H VAL A 103 8.988 -4.670 -10.138 1.00 0.00 H new ATOM 0 HA VAL A 103 8.842 -7.588 -9.975 1.00 0.00 H new ATOM 0 HB VAL A 103 9.460 -7.271 -12.152 1.00 0.00 H new ATOM 0 HG11 VAL A 103 11.339 -5.901 -12.924 1.00 0.00 H new ATOM 0 HG12 VAL A 103 10.054 -4.940 -12.156 1.00 0.00 H new ATOM 0 HG13 VAL A 103 11.554 -5.291 -11.266 1.00 0.00 H new ATOM 0 HG21 VAL A 103 11.772 -8.152 -12.270 1.00 0.00 H new ATOM 0 HG22 VAL A 103 12.004 -7.716 -10.560 1.00 0.00 H new ATOM 0 HG23 VAL A 103 10.802 -8.950 -11.009 1.00 0.00 H new ATOM 1489 N ILE A 104 10.977 -5.573 -8.586 1.00 0.00 N ATOM 1490 CA ILE A 104 12.014 -5.475 -7.566 1.00 0.00 C ATOM 1491 C ILE A 104 11.494 -5.327 -6.092 1.00 0.00 C ATOM 1492 O ILE A 104 12.282 -5.440 -5.152 1.00 0.00 O ATOM 1493 CB ILE A 104 13.031 -4.311 -7.958 1.00 0.00 C ATOM 1494 CG1 ILE A 104 13.731 -4.618 -9.298 1.00 0.00 C ATOM 1495 CG2 ILE A 104 14.075 -3.993 -6.888 1.00 0.00 C ATOM 1496 CD1 ILE A 104 14.475 -5.943 -9.342 1.00 0.00 C ATOM 0 H ILE A 104 10.779 -4.693 -9.063 1.00 0.00 H new ATOM 0 HA ILE A 104 12.528 -6.436 -7.558 1.00 0.00 H new ATOM 0 HB ILE A 104 12.413 -3.418 -8.054 1.00 0.00 H new ATOM 0 HG12 ILE A 104 12.984 -4.611 -10.092 1.00 0.00 H new ATOM 0 HG13 ILE A 104 14.435 -3.815 -9.516 1.00 0.00 H new ATOM 0 HG21 ILE A 104 14.723 -3.190 -7.239 1.00 0.00 H new ATOM 0 HG22 ILE A 104 13.574 -3.680 -5.972 1.00 0.00 H new ATOM 0 HG23 ILE A 104 14.674 -4.882 -6.688 1.00 0.00 H new ATOM 0 HD11 ILE A 104 14.934 -6.070 -10.323 1.00 0.00 H new ATOM 0 HD12 ILE A 104 15.250 -5.951 -8.575 1.00 0.00 H new ATOM 0 HD13 ILE A 104 13.776 -6.759 -9.160 1.00 0.00 H new ATOM 1508 N SER A 105 10.205 -5.148 -5.842 1.00 0.00 N ATOM 1509 CA SER A 105 9.854 -4.847 -4.462 1.00 0.00 C ATOM 1510 C SER A 105 9.792 -6.032 -3.456 1.00 0.00 C ATOM 1511 O SER A 105 8.739 -6.585 -3.186 1.00 0.00 O ATOM 1512 CB SER A 105 8.561 -4.058 -4.396 1.00 0.00 C ATOM 1513 OG SER A 105 8.682 -2.854 -5.092 1.00 0.00 O ATOM 0 H SER A 105 9.440 -5.200 -6.514 1.00 0.00 H new ATOM 0 HA SER A 105 10.708 -4.260 -4.124 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.747 -4.648 -4.818 1.00 0.00 H new ATOM 0 HB3 SER A 105 8.304 -3.858 -3.356 1.00 0.00 H new ATOM 0 HG SER A 105 9.242 -2.235 -4.579 1.00 0.00 H new ATOM 1519 N LEU A 106 10.962 -6.364 -2.938 1.00 0.00 N ATOM 1520 CA LEU A 106 11.183 -7.008 -1.688 1.00 0.00 C ATOM 1521 C LEU A 106 12.381 -6.320 -1.134 1.00 0.00 C ATOM 1522 O LEU A 106 13.523 -6.749 -1.256 1.00 0.00 O ATOM 1523 CB LEU A 106 11.437 -8.565 -1.742 1.00 0.00 C ATOM 1524 CG LEU A 106 12.605 -9.145 -2.607 1.00 0.00 C ATOM 1525 CD1 LEU A 106 12.735 -10.640 -2.374 1.00 0.00 C ATOM 1526 CD2 LEU A 106 12.414 -8.886 -4.099 1.00 0.00 C ATOM 0 H LEU A 106 11.835 -6.169 -3.428 1.00 0.00 H new ATOM 0 HA LEU A 106 10.278 -6.928 -1.085 1.00 0.00 H new ATOM 0 HB2 LEU A 106 11.596 -8.902 -0.718 1.00 0.00 H new ATOM 0 HB3 LEU A 106 10.515 -9.030 -2.091 1.00 0.00 H new ATOM 0 HG LEU A 106 13.514 -8.631 -2.293 1.00 0.00 H new ATOM 0 HD11 LEU A 106 13.551 -11.033 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.943 -10.827 -1.321 1.00 0.00 H new ATOM 0 HD13 LEU A 106 11.804 -11.134 -2.653 1.00 0.00 H new ATOM 0 HD21 LEU A 106 13.253 -9.309 -4.652 1.00 0.00 H new ATOM 0 HD22 LEU A 106 11.487 -9.352 -4.433 1.00 0.00 H new ATOM 0 HD23 LEU A 106 12.366 -7.812 -4.279 1.00 0.00 H new ATOM 1538 N SER A 107 12.093 -5.257 -0.579 1.00 0.00 N ATOM 1539 CA SER A 107 12.962 -4.412 0.101 1.00 0.00 C ATOM 1540 C SER A 107 12.043 -3.460 0.698 1.00 0.00 C ATOM 1541 O SER A 107 11.630 -2.479 0.075 1.00 0.00 O ATOM 1542 CB SER A 107 13.956 -3.651 -0.814 1.00 0.00 C ATOM 1543 OG SER A 107 14.825 -4.513 -1.530 1.00 0.00 O ATOM 0 H SER A 107 11.137 -4.901 -0.580 1.00 0.00 H new ATOM 0 HA SER A 107 13.598 -4.967 0.790 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.395 -3.041 -1.522 1.00 0.00 H new ATOM 0 HB3 SER A 107 14.550 -2.969 -0.206 1.00 0.00 H new ATOM 0 HG SER A 107 14.692 -5.436 -1.229 1.00 0.00 H new ATOM 1549 N GLY A 108 11.601 -3.811 1.796 1.00 0.00 N ATOM 1550 CA GLY A 108 10.791 -2.967 2.519 1.00 0.00 C ATOM 1551 C GLY A 108 11.556 -2.568 3.680 1.00 0.00 C ATOM 1552 O GLY A 108 12.513 -3.267 4.046 1.00 0.00 O ATOM 0 H GLY A 108 11.790 -4.711 2.237 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.504 -2.099 1.925 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.870 -3.470 2.814 1.00 0.00 H new ATOM 1556 N ASP A 109 11.215 -1.469 4.272 1.00 0.00 N ATOM 1557 CA ASP A 109 11.933 -1.030 5.472 1.00 0.00 C ATOM 1558 C ASP A 109 11.764 -2.058 6.574 1.00 0.00 C ATOM 1559 O ASP A 109 12.693 -2.390 7.292 1.00 0.00 O ATOM 1560 CB ASP A 109 11.448 0.333 5.966 1.00 0.00 C ATOM 1561 CG ASP A 109 12.166 0.778 7.222 1.00 0.00 C ATOM 1562 OD1 ASP A 109 11.742 0.420 8.331 1.00 0.00 O ATOM 1563 OD2 ASP A 109 13.158 1.515 7.115 1.00 0.00 O ATOM 0 H ASP A 109 10.461 -0.854 3.968 1.00 0.00 H new ATOM 0 HA ASP A 109 12.986 -0.932 5.207 1.00 0.00 H new ATOM 0 HB2 ASP A 109 11.598 1.075 5.182 1.00 0.00 H new ATOM 0 HB3 ASP A 109 10.376 0.286 6.160 1.00 0.00 H new ATOM 1568 N HIS A 110 10.566 -2.552 6.690 1.00 0.00 N ATOM 1569 CA HIS A 110 10.255 -3.585 7.648 1.00 0.00 C ATOM 1570 C HIS A 110 9.658 -4.819 6.984 1.00 0.00 C ATOM 1571 O HIS A 110 9.724 -5.905 7.539 1.00 0.00 O ATOM 1572 CB HIS A 110 9.419 -3.051 8.805 1.00 0.00 C ATOM 1573 CG HIS A 110 10.251 -2.604 9.983 1.00 0.00 C ATOM 1574 ND1 HIS A 110 11.089 -1.510 9.966 1.00 0.00 N ATOM 1575 CD2 HIS A 110 10.406 -3.157 11.206 1.00 0.00 C ATOM 1576 CE1 HIS A 110 11.715 -1.425 11.115 1.00 0.00 C ATOM 1577 NE2 HIS A 110 11.318 -2.405 11.873 1.00 0.00 N ATOM 0 H HIS A 110 9.772 -2.253 6.124 1.00 0.00 H new ATOM 0 HA HIS A 110 11.195 -3.917 8.090 1.00 0.00 H new ATOM 0 HB2 HIS A 110 8.818 -2.212 8.454 1.00 0.00 H new ATOM 0 HB3 HIS A 110 8.725 -3.826 9.131 1.00 0.00 H new ATOM 0 HD1 HIS A 110 11.204 -0.867 9.182 1.00 0.00 H new ATOM 0 HD2 HIS A 110 9.899 -4.033 11.582 1.00 0.00 H new ATOM 0 HE1 HIS A 110 12.438 -0.670 11.386 1.00 0.00 H new ATOM 1586 N SER A 111 9.042 -4.608 5.803 1.00 0.00 N ATOM 1587 CA SER A 111 8.549 -5.672 4.868 1.00 0.00 C ATOM 1588 C SER A 111 7.493 -6.624 5.475 1.00 0.00 C ATOM 1589 O SER A 111 6.314 -6.591 5.128 1.00 0.00 O ATOM 1590 CB SER A 111 9.739 -6.504 4.347 1.00 0.00 C ATOM 1591 OG SER A 111 10.793 -5.672 3.913 1.00 0.00 O ATOM 0 H SER A 111 8.862 -3.668 5.451 1.00 0.00 H new ATOM 0 HA SER A 111 8.051 -5.140 4.058 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.096 -7.166 5.136 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.410 -7.138 3.524 1.00 0.00 H new ATOM 0 HG SER A 111 11.535 -6.225 3.590 1.00 0.00 H new ATOM 1597 N ILE A 112 7.945 -7.435 6.371 1.00 0.00 N ATOM 1598 CA ILE A 112 7.183 -8.469 6.992 1.00 0.00 C ATOM 1599 C ILE A 112 6.665 -8.006 8.349 1.00 0.00 C ATOM 1600 O ILE A 112 5.512 -8.208 8.695 1.00 0.00 O ATOM 1601 CB ILE A 112 8.079 -9.773 7.134 1.00 0.00 C ATOM 1602 CG1 ILE A 112 7.459 -10.823 8.076 1.00 0.00 C ATOM 1603 CG2 ILE A 112 9.517 -9.442 7.551 1.00 0.00 C ATOM 1604 CD1 ILE A 112 8.230 -12.127 8.157 1.00 0.00 C ATOM 0 H ILE A 112 8.907 -7.393 6.709 1.00 0.00 H new ATOM 0 HA ILE A 112 6.319 -8.706 6.372 1.00 0.00 H new ATOM 0 HB ILE A 112 8.115 -10.218 6.140 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.385 -10.397 9.076 1.00 0.00 H new ATOM 0 HG13 ILE A 112 6.443 -11.036 7.744 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.093 -10.364 7.636 1.00 0.00 H new ATOM 0 HG22 ILE A 112 9.974 -8.796 6.801 1.00 0.00 H new ATOM 0 HG23 ILE A 112 9.508 -8.930 8.513 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.723 -12.807 8.842 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.283 -12.581 7.167 1.00 0.00 H new ATOM 0 HD13 ILE A 112 9.239 -11.931 8.520 1.00 0.00 H new ATOM 1616 N ILE A 113 7.502 -7.372 9.084 1.00 0.00 N ATOM 1617 CA ILE A 113 7.202 -7.024 10.453 1.00 0.00 C ATOM 1618 C ILE A 113 6.865 -5.560 10.647 1.00 0.00 C ATOM 1619 O ILE A 113 7.738 -4.718 10.613 1.00 0.00 O ATOM 1620 CB ILE A 113 8.329 -7.489 11.435 1.00 0.00 C ATOM 1621 CG1 ILE A 113 8.038 -7.030 12.882 1.00 0.00 C ATOM 1622 CG2 ILE A 113 9.720 -7.041 10.963 1.00 0.00 C ATOM 1623 CD1 ILE A 113 9.084 -7.448 13.897 1.00 0.00 C ATOM 0 H ILE A 113 8.423 -7.071 8.766 1.00 0.00 H new ATOM 0 HA ILE A 113 6.295 -7.575 10.701 1.00 0.00 H new ATOM 0 HB ILE A 113 8.332 -8.579 11.433 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.952 -5.943 12.895 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.072 -7.430 13.189 1.00 0.00 H new ATOM 0 HG21 ILE A 113 10.473 -7.384 11.673 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.926 -7.467 9.981 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.750 -5.953 10.900 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.799 -7.084 14.884 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.156 -8.535 13.918 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.050 -7.026 13.619 1.00 0.00 H new ATOM 1635 N GLY A 114 5.604 -5.245 10.782 1.00 0.00 N ATOM 1636 CA GLY A 114 5.276 -3.877 11.151 1.00 0.00 C ATOM 1637 C GLY A 114 5.213 -3.036 9.942 1.00 0.00 C ATOM 1638 O GLY A 114 5.976 -2.094 9.739 1.00 0.00 O ATOM 0 H GLY A 114 4.814 -5.877 10.651 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.320 -3.851 11.674 1.00 0.00 H new ATOM 0 HA3 GLY A 114 6.026 -3.486 11.839 1.00 0.00 H new ATOM 1642 N ARG A 115 4.346 -3.426 9.127 1.00 0.00 N ATOM 1643 CA ARG A 115 4.119 -2.845 7.867 1.00 0.00 C ATOM 1644 C ARG A 115 2.704 -2.319 7.799 1.00 0.00 C ATOM 1645 O ARG A 115 1.816 -3.037 7.520 1.00 0.00 O ATOM 1646 CB ARG A 115 4.400 -3.922 6.789 1.00 0.00 C ATOM 1647 CG ARG A 115 4.376 -5.397 7.327 1.00 0.00 C ATOM 1648 CD ARG A 115 2.985 -5.884 7.816 1.00 0.00 C ATOM 1649 NE ARG A 115 3.044 -7.209 8.475 1.00 0.00 N ATOM 1650 CZ ARG A 115 1.986 -7.957 8.879 1.00 0.00 C ATOM 1651 NH1 ARG A 115 0.768 -7.741 8.396 1.00 0.00 N ATOM 1652 NH2 ARG A 115 2.172 -8.979 9.701 1.00 0.00 N ATOM 0 H ARG A 115 3.726 -4.212 9.322 1.00 0.00 H new ATOM 0 HA ARG A 115 4.781 -1.997 7.694 1.00 0.00 H new ATOM 0 HB2 ARG A 115 3.660 -3.826 5.994 1.00 0.00 H new ATOM 0 HB3 ARG A 115 5.375 -3.726 6.342 1.00 0.00 H new ATOM 0 HG2 ARG A 115 4.723 -6.064 6.537 1.00 0.00 H new ATOM 0 HG3 ARG A 115 5.086 -5.481 8.150 1.00 0.00 H new ATOM 0 HD2 ARG A 115 2.573 -5.154 8.513 1.00 0.00 H new ATOM 0 HD3 ARG A 115 2.303 -5.935 6.967 1.00 0.00 H new ATOM 0 HE ARG A 115 3.972 -7.598 8.642 1.00 0.00 H new ATOM 0 HH11 ARG A 115 0.615 -7.002 7.709 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -0.015 -8.314 8.712 1.00 0.00 H new ATOM 0 HH21 ARG A 115 3.111 -9.204 10.031 1.00 0.00 H new ATOM 0 HH22 ARG A 115 1.377 -9.541 10.004 1.00 0.00 H new ATOM 1666 N THR A 116 2.500 -1.102 8.173 1.00 0.00 N ATOM 1667 CA THR A 116 1.194 -0.519 8.134 1.00 0.00 C ATOM 1668 C THR A 116 0.962 0.258 6.857 1.00 0.00 C ATOM 1669 O THR A 116 1.820 1.049 6.425 1.00 0.00 O ATOM 1670 CB THR A 116 1.006 0.398 9.330 1.00 0.00 C ATOM 1671 OG1 THR A 116 2.162 1.248 9.450 1.00 0.00 O ATOM 1672 CG2 THR A 116 0.824 -0.406 10.597 1.00 0.00 C ATOM 0 H THR A 116 3.232 -0.479 8.515 1.00 0.00 H new ATOM 0 HA THR A 116 0.467 -1.331 8.168 1.00 0.00 H new ATOM 0 HB THR A 116 0.112 1.003 9.181 1.00 0.00 H new ATOM 0 HG1 THR A 116 2.126 1.731 10.302 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.691 0.270 11.441 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.055 -1.043 10.501 1.00 0.00 H new ATOM 0 HG23 THR A 116 1.705 -1.026 10.764 1.00 0.00 H new ATOM 1680 N LEU A 117 -0.161 0.026 6.248 1.00 0.00 N ATOM 1681 CA LEU A 117 -0.532 0.765 5.087 1.00 0.00 C ATOM 1682 C LEU A 117 -1.106 2.069 5.529 1.00 0.00 C ATOM 1683 O LEU A 117 -2.019 2.091 6.328 1.00 0.00 O ATOM 1684 CB LEU A 117 -1.535 -0.037 4.201 1.00 0.00 C ATOM 1685 CG LEU A 117 -2.947 -0.394 4.772 1.00 0.00 C ATOM 1686 CD1 LEU A 117 -3.963 0.696 4.486 1.00 0.00 C ATOM 1687 CD2 LEU A 117 -3.449 -1.715 4.225 1.00 0.00 C ATOM 0 H LEU A 117 -0.840 -0.677 6.542 1.00 0.00 H new ATOM 0 HA LEU A 117 0.345 0.946 4.466 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.687 0.531 3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.049 -0.972 3.921 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.831 -0.482 5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -4.930 0.409 4.899 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.635 1.629 4.945 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.055 0.834 3.409 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.432 -1.932 4.643 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.521 -1.655 3.139 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.755 -2.510 4.499 1.00 0.00 H new ATOM 1699 N VAL A 118 -0.520 3.161 5.117 1.00 0.00 N ATOM 1700 CA VAL A 118 -1.193 4.410 5.432 1.00 0.00 C ATOM 1701 C VAL A 118 -1.905 4.832 4.218 1.00 0.00 C ATOM 1702 O VAL A 118 -1.244 5.463 3.297 1.00 0.00 O ATOM 1703 CB VAL A 118 -0.230 5.521 5.779 1.00 0.00 C ATOM 1704 CG1 VAL A 118 -0.965 6.735 6.310 1.00 0.00 C ATOM 1705 CG2 VAL A 118 0.810 5.038 6.734 1.00 0.00 C ATOM 0 H VAL A 118 0.357 3.225 4.600 1.00 0.00 H new ATOM 0 HA VAL A 118 -1.843 4.238 6.290 1.00 0.00 H new ATOM 0 HB VAL A 118 0.280 5.830 4.867 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.247 7.518 6.551 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -1.659 7.100 5.553 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.519 6.461 7.208 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.493 5.854 6.971 1.00 0.00 H new ATOM 0 HG22 VAL A 118 0.330 4.689 7.649 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.367 4.218 6.281 1.00 0.00 H new ATOM 1715 N VAL A 119 -3.175 4.537 4.171 1.00 0.00 N ATOM 1716 CA VAL A 119 -4.052 4.761 3.033 1.00 0.00 C ATOM 1717 C VAL A 119 -5.451 5.033 3.619 1.00 0.00 C ATOM 1718 O VAL A 119 -5.605 5.015 4.815 1.00 0.00 O ATOM 1719 CB VAL A 119 -4.094 3.490 2.053 1.00 0.00 C ATOM 1720 CG1 VAL A 119 -4.877 3.756 0.767 1.00 0.00 C ATOM 1721 CG2 VAL A 119 -2.696 2.995 1.692 1.00 0.00 C ATOM 0 H VAL A 119 -3.660 4.112 4.961 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.692 5.597 2.433 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.613 2.715 2.617 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -4.870 2.861 0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -5.906 4.018 1.015 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -4.414 4.579 0.223 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.775 2.134 1.028 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.146 3.791 1.190 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -2.167 2.705 2.600 1.00 0.00 H new ATOM 1731 N HIS A 120 -6.370 5.435 2.814 1.00 0.00 N ATOM 1732 CA HIS A 120 -7.778 5.523 3.166 1.00 0.00 C ATOM 1733 C HIS A 120 -8.497 5.551 1.819 1.00 0.00 C ATOM 1734 O HIS A 120 -7.758 5.587 0.839 1.00 0.00 O ATOM 1735 CB HIS A 120 -8.140 6.717 4.110 1.00 0.00 C ATOM 1736 CG HIS A 120 -8.097 8.121 3.569 1.00 0.00 C ATOM 1737 ND1 HIS A 120 -6.936 8.831 3.357 1.00 0.00 N ATOM 1738 CD2 HIS A 120 -9.105 8.977 3.302 1.00 0.00 C ATOM 1739 CE1 HIS A 120 -7.241 10.064 2.991 1.00 0.00 C ATOM 1740 NE2 HIS A 120 -8.548 10.174 2.951 1.00 0.00 N ATOM 0 H HIS A 120 -6.175 5.726 1.856 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.091 4.676 3.777 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -9.147 6.542 4.488 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -7.466 6.675 4.966 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -10.161 8.756 3.356 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -6.534 10.848 2.763 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -9.064 11.017 2.699 1.00 0.00 H new ATOM 1749 N GLU A 121 -9.804 5.474 1.702 1.00 0.00 N ATOM 1750 CA GLU A 121 -10.369 5.485 0.339 1.00 0.00 C ATOM 1751 C GLU A 121 -10.189 6.883 -0.296 1.00 0.00 C ATOM 1752 O GLU A 121 -11.017 7.779 -0.153 1.00 0.00 O ATOM 1753 CB GLU A 121 -11.838 4.955 0.274 1.00 0.00 C ATOM 1754 CG GLU A 121 -12.895 5.700 1.104 1.00 0.00 C ATOM 1755 CD GLU A 121 -12.687 5.624 2.596 1.00 0.00 C ATOM 1756 OE1 GLU A 121 -13.194 4.687 3.232 1.00 0.00 O ATOM 1757 OE2 GLU A 121 -12.018 6.540 3.162 1.00 0.00 O ATOM 0 H GLU A 121 -10.473 5.407 2.469 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.806 4.772 -0.264 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.156 4.970 -0.768 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.834 3.912 0.591 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.902 6.748 0.804 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -13.878 5.294 0.866 1.00 0.00 H new ATOM 1764 N LYS A 122 -9.039 7.059 -0.929 1.00 0.00 N ATOM 1765 CA LYS A 122 -8.589 8.320 -1.434 1.00 0.00 C ATOM 1766 C LYS A 122 -7.342 8.017 -2.230 1.00 0.00 C ATOM 1767 O LYS A 122 -6.884 6.874 -2.222 1.00 0.00 O ATOM 1768 CB LYS A 122 -8.180 9.197 -0.249 1.00 0.00 C ATOM 1769 CG LYS A 122 -8.282 10.694 -0.461 1.00 0.00 C ATOM 1770 CD LYS A 122 -9.731 11.126 -0.460 1.00 0.00 C ATOM 1771 CE LYS A 122 -9.877 12.634 -0.456 1.00 0.00 C ATOM 1772 NZ LYS A 122 -11.282 13.039 -0.350 1.00 0.00 N ATOM 0 H LYS A 122 -8.383 6.297 -1.104 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.356 8.821 -2.025 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -8.800 8.929 0.606 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -7.150 8.957 0.016 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.739 11.218 0.326 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -7.815 10.967 -1.407 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.231 10.716 -1.337 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.232 10.712 0.415 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.313 13.053 0.378 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.447 13.044 -1.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -11.335 14.054 -0.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.765 12.855 -1.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.744 12.496 0.407 1.00 0.00 H new ATOM 1786 N ALA A 123 -6.831 8.985 -2.926 1.00 0.00 N ATOM 1787 CA ALA A 123 -5.551 8.848 -3.568 1.00 0.00 C ATOM 1788 C ALA A 123 -4.420 9.043 -2.533 1.00 0.00 C ATOM 1789 O ALA A 123 -4.287 10.119 -1.955 1.00 0.00 O ATOM 1790 CB ALA A 123 -5.428 9.877 -4.661 1.00 0.00 C ATOM 0 H ALA A 123 -7.282 9.889 -3.067 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.467 7.850 -3.999 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.459 9.775 -5.149 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -6.221 9.726 -5.394 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -5.515 10.875 -4.232 1.00 0.00 H new ATOM 1796 N ASP A 124 -3.612 8.012 -2.326 1.00 0.00 N ATOM 1797 CA ASP A 124 -2.492 8.039 -1.383 1.00 0.00 C ATOM 1798 C ASP A 124 -1.365 7.330 -2.016 1.00 0.00 C ATOM 1799 O ASP A 124 -1.193 6.157 -1.799 1.00 0.00 O ATOM 1800 CB ASP A 124 -2.810 7.370 0.017 1.00 0.00 C ATOM 1801 CG ASP A 124 -1.565 7.167 0.975 1.00 0.00 C ATOM 1802 OD1 ASP A 124 -0.752 6.265 0.871 1.00 0.00 O ATOM 1803 OD2 ASP A 124 -1.355 7.787 1.981 1.00 0.00 O ATOM 0 H ASP A 124 -3.713 7.121 -2.812 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.264 9.083 -1.168 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.548 7.984 0.534 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.272 6.399 -0.161 1.00 0.00 H new ATOM 1808 N ASP A 125 -0.702 8.005 -2.909 1.00 0.00 N ATOM 1809 CA ASP A 125 0.514 7.516 -3.524 1.00 0.00 C ATOM 1810 C ASP A 125 1.052 8.552 -4.451 1.00 0.00 C ATOM 1811 O ASP A 125 0.310 9.428 -4.900 1.00 0.00 O ATOM 1812 CB ASP A 125 0.380 6.150 -4.239 1.00 0.00 C ATOM 1813 CG ASP A 125 1.722 5.679 -4.722 1.00 0.00 C ATOM 1814 OD1 ASP A 125 2.714 5.845 -3.940 1.00 0.00 O ATOM 1815 OD2 ASP A 125 1.824 5.278 -5.888 1.00 0.00 O ATOM 0 H ASP A 125 -0.989 8.926 -3.241 1.00 0.00 H new ATOM 0 HA ASP A 125 1.213 7.330 -2.709 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -0.047 5.415 -3.556 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -0.306 6.239 -5.081 1.00 0.00 H new ATOM 1820 N LEU A 126 2.315 8.451 -4.716 1.00 0.00 N ATOM 1821 CA LEU A 126 3.029 9.387 -5.528 1.00 0.00 C ATOM 1822 C LEU A 126 2.970 8.906 -6.953 1.00 0.00 C ATOM 1823 O LEU A 126 2.795 9.697 -7.879 1.00 0.00 O ATOM 1824 CB LEU A 126 4.485 9.486 -5.019 1.00 0.00 C ATOM 1825 CG LEU A 126 5.450 10.564 -5.607 1.00 0.00 C ATOM 1826 CD1 LEU A 126 5.865 10.271 -7.035 1.00 0.00 C ATOM 1827 CD2 LEU A 126 4.852 11.951 -5.504 1.00 0.00 C ATOM 0 H LEU A 126 2.897 7.692 -4.363 1.00 0.00 H new ATOM 0 HA LEU A 126 2.588 10.382 -5.474 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.441 9.645 -3.942 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.950 8.513 -5.179 1.00 0.00 H new ATOM 0 HG LEU A 126 6.354 10.524 -4.999 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.535 11.055 -7.387 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.378 9.310 -7.075 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.981 10.236 -7.671 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.548 12.679 -5.922 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.914 11.985 -6.059 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.663 12.189 -4.457 1.00 0.00 H new ATOM 1839 N GLY A 127 3.110 7.611 -7.133 1.00 0.00 N ATOM 1840 CA GLY A 127 3.107 7.059 -8.447 1.00 0.00 C ATOM 1841 C GLY A 127 1.711 6.904 -8.979 1.00 0.00 C ATOM 1842 O GLY A 127 1.410 7.320 -10.114 1.00 0.00 O ATOM 0 H GLY A 127 3.226 6.932 -6.381 1.00 0.00 H new ATOM 0 HA2 GLY A 127 3.682 7.702 -9.114 1.00 0.00 H new ATOM 0 HA3 GLY A 127 3.602 6.088 -8.435 1.00 0.00 H new ATOM 1846 N LYS A 128 0.854 6.325 -8.193 1.00 0.00 N ATOM 1847 CA LYS A 128 -0.498 6.090 -8.616 1.00 0.00 C ATOM 1848 C LYS A 128 -1.515 6.711 -7.666 1.00 0.00 C ATOM 1849 O LYS A 128 -2.439 6.036 -7.226 1.00 0.00 O ATOM 1850 CB LYS A 128 -0.761 4.593 -8.784 1.00 0.00 C ATOM 1851 CG LYS A 128 -1.310 4.198 -10.154 1.00 0.00 C ATOM 1852 CD LYS A 128 -2.640 4.866 -10.434 1.00 0.00 C ATOM 1853 CE LYS A 128 -3.179 4.518 -11.808 1.00 0.00 C ATOM 1854 NZ LYS A 128 -2.286 4.969 -12.896 1.00 0.00 N ATOM 0 H LYS A 128 1.067 6.004 -7.249 1.00 0.00 H new ATOM 0 HA LYS A 128 -0.620 6.578 -9.583 1.00 0.00 H new ATOM 0 HB2 LYS A 128 0.169 4.051 -8.609 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -1.466 4.272 -8.017 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -0.593 4.474 -10.927 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -1.429 3.115 -10.201 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.362 4.565 -9.675 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.525 5.947 -10.354 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -3.316 3.439 -11.879 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -4.161 4.973 -11.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -2.783 4.894 -13.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -2.011 5.958 -12.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -1.435 4.372 -12.916 1.00 0.00 H new ATOM 1868 N GLY A 129 -1.351 7.978 -7.362 1.00 0.00 N ATOM 1869 CA GLY A 129 -2.317 8.646 -6.539 1.00 0.00 C ATOM 1870 C GLY A 129 -3.539 9.069 -7.336 1.00 0.00 C ATOM 1871 O GLY A 129 -4.363 8.234 -7.725 1.00 0.00 O ATOM 0 H GLY A 129 -0.568 8.555 -7.670 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -2.623 7.985 -5.728 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.860 9.523 -6.081 1.00 0.00 H new ATOM 1875 N GLY A 130 -3.654 10.351 -7.610 1.00 0.00 N ATOM 1876 CA GLY A 130 -4.824 10.848 -8.303 1.00 0.00 C ATOM 1877 C GLY A 130 -4.539 12.099 -9.104 1.00 0.00 C ATOM 1878 O GLY A 130 -4.016 12.023 -10.210 1.00 0.00 O ATOM 0 H GLY A 130 -2.962 11.060 -7.368 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -5.203 10.073 -8.969 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -5.610 11.057 -7.577 1.00 0.00 H new ATOM 1882 N ASN A 131 -4.818 13.248 -8.530 1.00 0.00 N ATOM 1883 CA ASN A 131 -4.634 14.526 -9.258 1.00 0.00 C ATOM 1884 C ASN A 131 -3.165 14.911 -9.225 1.00 0.00 C ATOM 1885 O ASN A 131 -2.477 14.495 -8.295 1.00 0.00 O ATOM 1886 CB ASN A 131 -5.526 15.629 -8.644 1.00 0.00 C ATOM 1887 CG ASN A 131 -5.296 17.008 -9.244 1.00 0.00 C ATOM 1888 OD1 ASN A 131 -4.467 17.776 -8.752 1.00 0.00 O ATOM 1889 ND2 ASN A 131 -6.017 17.337 -10.275 1.00 0.00 N ATOM 0 H ASN A 131 -5.169 13.345 -7.577 1.00 0.00 H new ATOM 0 HA ASN A 131 -4.938 14.406 -10.298 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -6.572 15.354 -8.778 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -5.344 15.675 -7.570 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -5.906 18.256 -10.703 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -6.694 16.676 -10.656 1.00 0.00 H new ATOM 1896 N GLU A 132 -2.673 15.691 -10.225 1.00 0.00 N ATOM 1897 CA GLU A 132 -1.242 16.043 -10.296 1.00 0.00 C ATOM 1898 C GLU A 132 -0.628 16.500 -8.957 1.00 0.00 C ATOM 1899 O GLU A 132 0.365 15.950 -8.521 1.00 0.00 O ATOM 1900 CB GLU A 132 -0.948 17.032 -11.421 1.00 0.00 C ATOM 1901 CG GLU A 132 -1.805 18.279 -11.433 1.00 0.00 C ATOM 1902 CD GLU A 132 -1.415 19.190 -12.558 1.00 0.00 C ATOM 1903 OE1 GLU A 132 -1.827 18.948 -13.705 1.00 0.00 O ATOM 1904 OE2 GLU A 132 -0.653 20.154 -12.329 1.00 0.00 O ATOM 0 H GLU A 132 -3.241 16.079 -10.978 1.00 0.00 H new ATOM 0 HA GLU A 132 -0.738 15.106 -10.534 1.00 0.00 H new ATOM 0 HB2 GLU A 132 0.098 17.332 -11.354 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -1.072 16.518 -12.374 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -2.855 18.002 -11.532 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -1.702 18.804 -10.483 1.00 0.00 H new ATOM 1911 N GLU A 133 -1.249 17.443 -8.276 1.00 0.00 N ATOM 1912 CA GLU A 133 -0.698 17.924 -7.004 1.00 0.00 C ATOM 1913 C GLU A 133 -1.044 16.970 -5.857 1.00 0.00 C ATOM 1914 O GLU A 133 -0.310 16.855 -4.866 1.00 0.00 O ATOM 1915 CB GLU A 133 -1.232 19.305 -6.667 1.00 0.00 C ATOM 1916 CG GLU A 133 -2.736 19.345 -6.557 1.00 0.00 C ATOM 1917 CD GLU A 133 -3.242 20.620 -6.005 1.00 0.00 C ATOM 1918 OE1 GLU A 133 -3.456 21.566 -6.775 1.00 0.00 O ATOM 1919 OE2 GLU A 133 -3.475 20.694 -4.778 1.00 0.00 O ATOM 0 H GLU A 133 -2.119 17.890 -8.566 1.00 0.00 H new ATOM 0 HA GLU A 133 0.385 17.971 -7.122 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -0.795 19.637 -5.725 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -0.910 20.010 -7.434 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -3.171 19.185 -7.543 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -3.070 18.523 -5.924 1.00 0.00 H new ATOM 1926 N SER A 134 -2.134 16.271 -6.018 1.00 0.00 N ATOM 1927 CA SER A 134 -2.674 15.432 -4.988 1.00 0.00 C ATOM 1928 C SER A 134 -1.887 14.122 -4.890 1.00 0.00 C ATOM 1929 O SER A 134 -1.760 13.544 -3.826 1.00 0.00 O ATOM 1930 CB SER A 134 -4.157 15.185 -5.269 1.00 0.00 C ATOM 1931 OG SER A 134 -4.794 14.467 -4.235 1.00 0.00 O ATOM 0 H SER A 134 -2.678 16.269 -6.881 1.00 0.00 H new ATOM 0 HA SER A 134 -2.583 15.930 -4.022 1.00 0.00 H new ATOM 0 HB2 SER A 134 -4.661 16.142 -5.406 1.00 0.00 H new ATOM 0 HB3 SER A 134 -4.259 14.635 -6.204 1.00 0.00 H new ATOM 0 HG SER A 134 -5.739 14.337 -4.461 1.00 0.00 H new ATOM 1937 N THR A 135 -1.324 13.684 -5.991 1.00 0.00 N ATOM 1938 CA THR A 135 -0.542 12.481 -5.995 1.00 0.00 C ATOM 1939 C THR A 135 0.839 12.778 -5.368 1.00 0.00 C ATOM 1940 O THR A 135 1.467 11.926 -4.790 1.00 0.00 O ATOM 1941 CB THR A 135 -0.427 11.889 -7.444 1.00 0.00 C ATOM 1942 OG1 THR A 135 0.046 10.549 -7.411 1.00 0.00 O ATOM 1943 CG2 THR A 135 0.489 12.714 -8.342 1.00 0.00 C ATOM 0 H THR A 135 -1.396 14.148 -6.896 1.00 0.00 H new ATOM 0 HA THR A 135 -1.035 11.717 -5.393 1.00 0.00 H new ATOM 0 HB THR A 135 -1.433 11.918 -7.862 1.00 0.00 H new ATOM 0 HG1 THR A 135 0.136 10.257 -6.480 1.00 0.00 H new ATOM 0 HG21 THR A 135 0.533 12.260 -9.332 1.00 0.00 H new ATOM 0 HG22 THR A 135 0.100 13.729 -8.425 1.00 0.00 H new ATOM 0 HG23 THR A 135 1.490 12.743 -7.912 1.00 0.00 H new ATOM 1951 N LYS A 136 1.241 14.027 -5.436 1.00 0.00 N ATOM 1952 CA LYS A 136 2.503 14.467 -4.862 1.00 0.00 C ATOM 1953 C LYS A 136 2.437 14.469 -3.356 1.00 0.00 C ATOM 1954 O LYS A 136 3.435 14.221 -2.670 1.00 0.00 O ATOM 1955 CB LYS A 136 2.839 15.854 -5.348 1.00 0.00 C ATOM 1956 CG LYS A 136 3.046 15.930 -6.832 1.00 0.00 C ATOM 1957 CD LYS A 136 3.254 17.365 -7.300 1.00 0.00 C ATOM 1958 CE LYS A 136 4.464 18.015 -6.649 1.00 0.00 C ATOM 1959 NZ LYS A 136 4.661 19.400 -7.111 1.00 0.00 N ATOM 0 H LYS A 136 0.707 14.769 -5.889 1.00 0.00 H new ATOM 0 HA LYS A 136 3.278 13.770 -5.180 1.00 0.00 H new ATOM 0 HB2 LYS A 136 2.036 16.535 -5.065 1.00 0.00 H new ATOM 0 HB3 LYS A 136 3.742 16.199 -4.844 1.00 0.00 H new ATOM 0 HG2 LYS A 136 3.911 15.328 -7.110 1.00 0.00 H new ATOM 0 HG3 LYS A 136 2.183 15.503 -7.342 1.00 0.00 H new ATOM 0 HD2 LYS A 136 3.377 17.377 -8.383 1.00 0.00 H new ATOM 0 HD3 LYS A 136 2.364 17.951 -7.073 1.00 0.00 H new ATOM 0 HE2 LYS A 136 4.341 18.008 -5.566 1.00 0.00 H new ATOM 0 HE3 LYS A 136 5.355 17.428 -6.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.496 19.807 -6.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 4.804 19.405 -8.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 3.822 19.967 -6.875 1.00 0.00 H new ATOM 1973 N THR A 137 1.292 14.802 -2.846 1.00 0.00 N ATOM 1974 CA THR A 137 1.111 14.811 -1.446 1.00 0.00 C ATOM 1975 C THR A 137 0.720 13.402 -0.977 1.00 0.00 C ATOM 1976 O THR A 137 1.118 12.966 0.115 1.00 0.00 O ATOM 1977 CB THR A 137 0.079 15.907 -1.003 1.00 0.00 C ATOM 1978 OG1 THR A 137 0.109 16.071 0.419 1.00 0.00 O ATOM 1979 CG2 THR A 137 -1.344 15.583 -1.437 1.00 0.00 C ATOM 0 H THR A 137 0.472 15.071 -3.389 1.00 0.00 H new ATOM 0 HA THR A 137 2.050 15.081 -0.962 1.00 0.00 H new ATOM 0 HB THR A 137 0.376 16.832 -1.497 1.00 0.00 H new ATOM 0 HG1 THR A 137 -0.538 16.758 0.683 1.00 0.00 H new ATOM 0 HG21 THR A 137 -2.015 16.375 -1.104 1.00 0.00 H new ATOM 0 HG22 THR A 137 -1.384 15.506 -2.524 1.00 0.00 H new ATOM 0 HG23 THR A 137 -1.653 14.636 -0.995 1.00 0.00 H new ATOM 1987 N GLY A 138 0.002 12.679 -1.861 1.00 0.00 N ATOM 1988 CA GLY A 138 -0.483 11.366 -1.562 1.00 0.00 C ATOM 1989 C GLY A 138 -1.338 11.418 -0.348 1.00 0.00 C ATOM 1990 O GLY A 138 -0.912 10.941 0.710 1.00 0.00 O ATOM 0 H GLY A 138 -0.244 13.011 -2.794 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -1.054 10.977 -2.405 1.00 0.00 H new ATOM 0 HA3 GLY A 138 0.353 10.686 -1.402 1.00 0.00 H new ATOM 1994 N ASN A 139 -2.556 11.977 -0.493 1.00 0.00 N ATOM 1995 CA ASN A 139 -3.445 12.266 0.669 1.00 0.00 C ATOM 1996 C ASN A 139 -3.651 11.048 1.597 1.00 0.00 C ATOM 1997 O ASN A 139 -4.404 10.106 1.303 1.00 0.00 O ATOM 1998 CB ASN A 139 -4.774 12.892 0.207 1.00 0.00 C ATOM 1999 CG ASN A 139 -5.719 13.260 1.352 1.00 0.00 C ATOM 2000 OD1 ASN A 139 -6.976 13.404 1.041 1.00 0.00 O flip ATOM 2001 ND2 ASN A 139 -5.303 13.492 2.488 1.00 0.00 N flip ATOM 0 H ASN A 139 -2.953 12.239 -1.395 1.00 0.00 H new ATOM 0 HA ASN A 139 -2.931 13.005 1.284 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -4.559 13.788 -0.375 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -5.281 12.193 -0.459 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -4.313 13.371 2.703 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -5.948 13.805 3.213 1.00 0.00 H new ATOM 2008 N ALA A 140 -2.999 11.117 2.740 1.00 0.00 N ATOM 2009 CA ALA A 140 -2.900 10.021 3.665 1.00 0.00 C ATOM 2010 C ALA A 140 -4.026 9.978 4.681 1.00 0.00 C ATOM 2011 O ALA A 140 -4.773 10.931 4.865 1.00 0.00 O ATOM 2012 CB ALA A 140 -1.564 10.087 4.386 1.00 0.00 C ATOM 0 H ALA A 140 -2.515 11.958 3.053 1.00 0.00 H new ATOM 0 HA ALA A 140 -2.980 9.107 3.076 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -1.488 9.256 5.088 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -0.755 10.023 3.659 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.490 11.029 4.929 1.00 0.00 H new ATOM 2018 N GLY A 141 -4.139 8.841 5.316 1.00 0.00 N ATOM 2019 CA GLY A 141 -5.073 8.623 6.382 1.00 0.00 C ATOM 2020 C GLY A 141 -4.378 7.806 7.419 1.00 0.00 C ATOM 2021 O GLY A 141 -4.451 6.595 7.390 1.00 0.00 O ATOM 0 H GLY A 141 -3.569 8.023 5.099 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -5.407 9.572 6.801 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -5.960 8.106 6.016 1.00 0.00 H new ATOM 2025 N SER A 142 -3.675 8.483 8.302 1.00 0.00 N ATOM 2026 CA SER A 142 -2.794 7.870 9.291 1.00 0.00 C ATOM 2027 C SER A 142 -3.518 6.946 10.277 1.00 0.00 C ATOM 2028 O SER A 142 -2.879 6.169 11.003 1.00 0.00 O ATOM 2029 CB SER A 142 -2.070 8.983 10.039 1.00 0.00 C ATOM 2030 OG SER A 142 -1.483 9.910 9.116 1.00 0.00 O ATOM 0 H SER A 142 -3.696 9.501 8.359 1.00 0.00 H new ATOM 0 HA SER A 142 -2.092 7.230 8.757 1.00 0.00 H new ATOM 0 HB2 SER A 142 -2.769 9.505 10.692 1.00 0.00 H new ATOM 0 HB3 SER A 142 -1.296 8.557 10.677 1.00 0.00 H new ATOM 0 HG SER A 142 -1.024 10.619 9.612 1.00 0.00 H new ATOM 2036 N ARG A 143 -4.766 7.084 10.380 1.00 0.00 N ATOM 2037 CA ARG A 143 -5.492 6.229 11.239 1.00 0.00 C ATOM 2038 C ARG A 143 -6.532 5.504 10.462 1.00 0.00 C ATOM 2039 O ARG A 143 -6.698 4.295 10.640 1.00 0.00 O ATOM 2040 CB ARG A 143 -6.196 7.021 12.350 1.00 0.00 C ATOM 2041 CG ARG A 143 -6.855 6.132 13.410 1.00 0.00 C ATOM 2042 CD ARG A 143 -7.896 6.885 14.225 1.00 0.00 C ATOM 2043 NE ARG A 143 -7.376 8.109 14.834 1.00 0.00 N ATOM 2044 CZ ARG A 143 -8.129 9.176 15.161 1.00 0.00 C ATOM 2045 NH1 ARG A 143 -9.458 9.150 15.000 1.00 0.00 N ATOM 2046 NH2 ARG A 143 -7.552 10.265 15.658 1.00 0.00 N ATOM 0 H ARG A 143 -5.321 7.780 9.883 1.00 0.00 H new ATOM 0 HA ARG A 143 -4.783 5.532 11.687 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -5.471 7.675 12.835 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -6.955 7.663 11.903 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -7.325 5.277 12.924 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -6.089 5.737 14.078 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -8.739 7.137 13.582 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -8.277 6.231 15.009 1.00 0.00 H new ATOM 0 HE ARG A 143 -6.375 8.157 15.024 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -9.910 8.316 14.626 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -10.018 9.965 15.251 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -6.541 10.291 15.791 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -8.120 11.075 15.907 1.00 0.00 H new ATOM 2060 N LEU A 144 -7.250 6.273 9.629 1.00 0.00 N ATOM 2061 CA LEU A 144 -8.510 5.867 9.007 1.00 0.00 C ATOM 2062 C LEU A 144 -8.422 4.488 8.437 1.00 0.00 C ATOM 2063 O LEU A 144 -9.318 3.670 8.669 1.00 0.00 O ATOM 2064 CB LEU A 144 -8.948 6.908 7.937 1.00 0.00 C ATOM 2065 CG LEU A 144 -10.442 6.931 7.480 1.00 0.00 C ATOM 2066 CD1 LEU A 144 -10.696 8.150 6.619 1.00 0.00 C ATOM 2067 CD2 LEU A 144 -10.852 5.678 6.707 1.00 0.00 C ATOM 0 H LEU A 144 -6.960 7.215 9.366 1.00 0.00 H new ATOM 0 HA LEU A 144 -9.277 5.838 9.780 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.704 7.899 8.321 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.334 6.749 7.051 1.00 0.00 H new ATOM 0 HG LEU A 144 -11.045 6.965 8.387 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.739 8.161 6.303 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.481 9.052 7.192 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -10.051 8.116 5.741 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.900 5.755 6.418 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -10.235 5.584 5.813 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.714 4.800 7.338 1.00 0.00 H new ATOM 2079 N ALA A 145 -7.372 4.200 7.755 1.00 0.00 N ATOM 2080 CA ALA A 145 -7.205 2.934 7.193 1.00 0.00 C ATOM 2081 C ALA A 145 -5.792 2.560 7.372 1.00 0.00 C ATOM 2082 O ALA A 145 -4.923 2.904 6.579 1.00 0.00 O ATOM 2083 CB ALA A 145 -7.627 2.897 5.737 1.00 0.00 C ATOM 0 H ALA A 145 -6.606 4.850 7.577 1.00 0.00 H new ATOM 0 HA ALA A 145 -7.850 2.212 7.693 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -7.480 1.892 5.341 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -8.680 3.168 5.656 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -7.025 3.604 5.166 1.00 0.00 H new ATOM 2089 N CYS A 146 -5.560 1.965 8.468 1.00 0.00 N ATOM 2090 CA CYS A 146 -4.300 1.469 8.801 1.00 0.00 C ATOM 2091 C CYS A 146 -4.430 0.073 9.249 1.00 0.00 C ATOM 2092 O CYS A 146 -5.402 -0.311 9.927 1.00 0.00 O ATOM 2093 CB CYS A 146 -3.586 2.326 9.830 1.00 0.00 C ATOM 2094 SG CYS A 146 -2.718 3.778 9.133 1.00 0.00 S ATOM 0 H CYS A 146 -6.270 1.805 9.183 1.00 0.00 H new ATOM 0 HA CYS A 146 -3.675 1.503 7.909 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -4.313 2.671 10.565 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -2.864 1.707 10.362 1.00 0.00 H new ATOM 2099 N GLY A 147 -3.506 -0.684 8.836 1.00 0.00 N ATOM 2100 CA GLY A 147 -3.494 -2.036 9.108 1.00 0.00 C ATOM 2101 C GLY A 147 -2.212 -2.602 8.694 1.00 0.00 C ATOM 2102 O GLY A 147 -1.565 -2.066 7.771 1.00 0.00 O ATOM 0 H GLY A 147 -2.714 -0.361 8.281 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -3.652 -2.205 10.173 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -4.310 -2.531 8.582 1.00 0.00 H new ATOM 2106 N VAL A 148 -1.790 -3.601 9.376 1.00 0.00 N ATOM 2107 CA VAL A 148 -0.623 -4.300 9.019 1.00 0.00 C ATOM 2108 C VAL A 148 -0.837 -5.116 7.742 1.00 0.00 C ATOM 2109 O VAL A 148 -1.591 -6.084 7.705 1.00 0.00 O ATOM 2110 CB VAL A 148 -0.060 -5.175 10.181 1.00 0.00 C ATOM 2111 CG1 VAL A 148 0.498 -4.288 11.271 1.00 0.00 C ATOM 2112 CG2 VAL A 148 -1.133 -6.099 10.768 1.00 0.00 C ATOM 0 H VAL A 148 -2.256 -3.958 10.210 1.00 0.00 H new ATOM 0 HA VAL A 148 0.141 -3.550 8.813 1.00 0.00 H new ATOM 0 HB VAL A 148 0.733 -5.799 9.770 1.00 0.00 H new ATOM 0 HG11 VAL A 148 0.889 -4.907 12.079 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.300 -3.672 10.864 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -0.293 -3.645 11.657 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -0.701 -6.692 11.574 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -1.955 -5.500 11.158 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.506 -6.764 9.989 1.00 0.00 H new ATOM 2122 N ILE A 149 -0.202 -4.676 6.710 1.00 0.00 N ATOM 2123 CA ILE A 149 -0.190 -5.345 5.441 1.00 0.00 C ATOM 2124 C ILE A 149 1.226 -5.652 5.057 1.00 0.00 C ATOM 2125 O ILE A 149 2.048 -4.764 4.824 1.00 0.00 O ATOM 2126 CB ILE A 149 -0.877 -4.567 4.294 1.00 0.00 C ATOM 2127 CG1 ILE A 149 -0.733 -5.345 2.966 1.00 0.00 C ATOM 2128 CG2 ILE A 149 -0.304 -3.173 4.161 1.00 0.00 C ATOM 2129 CD1 ILE A 149 -1.399 -4.688 1.783 1.00 0.00 C ATOM 0 H ILE A 149 0.343 -3.814 6.720 1.00 0.00 H new ATOM 0 HA ILE A 149 -0.776 -6.254 5.576 1.00 0.00 H new ATOM 0 HB ILE A 149 -1.936 -4.469 4.532 1.00 0.00 H new ATOM 0 HG12 ILE A 149 0.327 -5.472 2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -1.153 -6.342 3.096 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -0.806 -2.650 3.347 1.00 0.00 H new ATOM 0 HG22 ILE A 149 -0.456 -2.627 5.092 1.00 0.00 H new ATOM 0 HG23 ILE A 149 0.763 -3.237 3.948 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -1.248 -5.301 0.894 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -2.467 -4.586 1.977 1.00 0.00 H new ATOM 0 HD13 ILE A 149 -0.964 -3.702 1.622 1.00 0.00 H new ATOM 2141 N GLY A 150 1.542 -6.861 5.108 1.00 0.00 N ATOM 2142 CA GLY A 150 2.801 -7.264 4.694 1.00 0.00 C ATOM 2143 C GLY A 150 2.899 -8.689 4.832 1.00 0.00 C ATOM 2144 O GLY A 150 1.902 -9.342 5.135 1.00 0.00 O ATOM 0 H GLY A 150 0.933 -7.609 5.440 1.00 0.00 H new ATOM 0 HA2 GLY A 150 2.968 -6.973 3.657 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.570 -6.773 5.291 1.00 0.00 H new ATOM 2148 N ILE A 151 4.052 -9.173 4.653 1.00 0.00 N ATOM 2149 CA ILE A 151 4.294 -10.585 4.664 1.00 0.00 C ATOM 2150 C ILE A 151 4.001 -11.166 6.036 1.00 0.00 C ATOM 2151 O ILE A 151 4.718 -10.893 6.994 1.00 0.00 O ATOM 2152 CB ILE A 151 5.766 -10.893 4.265 1.00 0.00 C ATOM 2153 CG1 ILE A 151 6.078 -10.268 2.891 1.00 0.00 C ATOM 2154 CG2 ILE A 151 6.018 -12.407 4.243 1.00 0.00 C ATOM 2155 CD1 ILE A 151 7.518 -10.422 2.446 1.00 0.00 C ATOM 0 H ILE A 151 4.885 -8.607 4.490 1.00 0.00 H new ATOM 0 HA ILE A 151 3.628 -11.047 3.935 1.00 0.00 H new ATOM 0 HB ILE A 151 6.430 -10.454 5.009 1.00 0.00 H new ATOM 0 HG12 ILE A 151 5.429 -10.723 2.143 1.00 0.00 H new ATOM 0 HG13 ILE A 151 5.832 -9.207 2.924 1.00 0.00 H new ATOM 0 HG21 ILE A 151 7.053 -12.599 3.962 1.00 0.00 H new ATOM 0 HG22 ILE A 151 5.828 -12.822 5.233 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.352 -12.876 3.519 1.00 0.00 H new ATOM 0 HD11 ILE A 151 7.649 -9.954 1.470 1.00 0.00 H new ATOM 0 HD12 ILE A 151 8.176 -9.942 3.170 1.00 0.00 H new ATOM 0 HD13 ILE A 151 7.766 -11.481 2.377 1.00 0.00 H new ATOM 2167 N ALA A 152 2.878 -11.849 6.149 1.00 0.00 N ATOM 2168 CA ALA A 152 2.614 -12.627 7.323 1.00 0.00 C ATOM 2169 C ALA A 152 1.920 -13.900 6.944 1.00 0.00 C ATOM 2170 O ALA A 152 0.716 -13.912 6.655 1.00 0.00 O ATOM 2171 CB ALA A 152 1.820 -11.861 8.364 1.00 0.00 C ATOM 0 H ALA A 152 2.144 -11.875 5.442 1.00 0.00 H new ATOM 0 HA ALA A 152 3.573 -12.864 7.784 1.00 0.00 H new ATOM 0 HB1 ALA A 152 1.648 -12.498 9.232 1.00 0.00 H new ATOM 0 HB2 ALA A 152 2.378 -10.975 8.668 1.00 0.00 H new ATOM 0 HB3 ALA A 152 0.862 -11.559 7.941 1.00 0.00 H new ATOM 2177 N GLN A 153 2.668 -14.948 6.883 1.00 0.00 N ATOM 2178 CA GLN A 153 2.130 -16.231 6.597 1.00 0.00 C ATOM 2179 C GLN A 153 2.459 -17.114 7.760 1.00 0.00 C ATOM 2180 O GLN A 153 1.559 -17.405 8.551 1.00 0.00 O ATOM 2181 CB GLN A 153 2.691 -16.814 5.297 1.00 0.00 C ATOM 2182 CG GLN A 153 2.040 -18.138 4.906 1.00 0.00 C ATOM 2183 CD GLN A 153 2.603 -18.727 3.634 1.00 0.00 C ATOM 2184 OE1 GLN A 153 3.769 -18.536 3.303 1.00 0.00 O ATOM 2185 NE2 GLN A 153 1.783 -19.450 2.910 1.00 0.00 N ATOM 2186 OXT GLN A 153 3.651 -17.450 7.935 1.00 0.00 O ATOM 0 H GLN A 153 3.677 -14.937 7.031 1.00 0.00 H new ATOM 0 HA GLN A 153 1.052 -16.156 6.453 1.00 0.00 H new ATOM 0 HB2 GLN A 153 2.549 -16.094 4.491 1.00 0.00 H new ATOM 0 HB3 GLN A 153 3.765 -16.962 5.406 1.00 0.00 H new ATOM 0 HG2 GLN A 153 2.170 -18.853 5.718 1.00 0.00 H new ATOM 0 HG3 GLN A 153 0.968 -17.986 4.784 1.00 0.00 H new ATOM 0 HE21 GLN A 153 0.820 -19.588 3.215 1.00 0.00 H new ATOM 0 HE22 GLN A 153 2.108 -19.874 2.041 1.00 0.00 H new TER 2195 GLN A 153 HETATM 2196 CU CU A 201 -0.194 6.643 2.338 1.00 0.00 CU