USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 949 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 51 GLN : amide:sc= -2.28! X(o=-2!,f=-1.8) USER MOD Set 1.2: A 52 CYS SG : rot -78:sc= 0.333 USER MOD Set 2.1: A 3 THR OG1 : rot 5:sc= 0.771 USER MOD Set 2.2: A 96 THR OG1 : rot 40:sc= 0.367 USER MOD Single : A 4 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0144) USER MOD Single : A 7 LYS NZ :NH3+ -108:sc= -0.799 (180deg=-1.59!) USER MOD Single : A 10 CYS SG : rot 93:sc= -0.543 USER MOD Single : A 14 TYR OH : rot 93:sc= 0.918 USER MOD Single : A 15 ASN : amide:sc= -0.0599 X(o=-0.06,f=-0.43) USER MOD Single : A 28 THR OG1 : rot -152:sc= -2.13! USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc=-0.000353 USER MOD Single : A 41 GLN : amide:sc= -5.5! K(o=-5.5!,f=-3.7) USER MOD Single : A 45 TYR OH : rot -75:sc= 2.06 USER MOD Single : A 46 GLN : amide:sc= -0.193 K(o=-0.19,f=-3!) USER MOD Single : A 47 HIS : no HD1:sc= -0.0874 X(o=-0.087,f=-0.22) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.023 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.277 USER MOD Single : A 85 ASN : amide:sc= -0.0441 X(o=-0.044,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= -1.19 USER MOD Single : A 90 GLN : amide:sc= -0.0467 K(o=-0.047,f=-1.8) USER MOD Single : A 93 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.603) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0293 USER MOD Single : A 98 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.196) USER MOD Single : A 99 THR OG1 : rot 70:sc= 0.271 USER MOD Single : A 102 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00272) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -157:sc= -0.321 (180deg=-1.09) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.123) USER MOD Single : A 123 ASN : amide:sc= -0.0559 X(o=-0.056,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 150:sc= 1.24 (180deg=1.02) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 13 N THR A 3 -2.364 -16.640 -10.498 1.00 0.00 N ATOM 14 CA THR A 3 -3.063 -16.172 -9.303 1.00 0.00 C ATOM 15 C THR A 3 -4.418 -15.574 -9.669 1.00 0.00 C ATOM 16 O THR A 3 -4.547 -14.871 -10.673 1.00 0.00 O ATOM 17 CB THR A 3 -2.220 -15.133 -8.551 1.00 0.00 C ATOM 18 OG1 THR A 3 -0.891 -15.088 -9.051 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.142 -15.397 -7.061 1.00 0.00 C ATOM 0 HA THR A 3 -3.223 -17.031 -8.652 1.00 0.00 H new ATOM 0 HB THR A 3 -2.728 -14.182 -8.715 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.816 -15.674 -9.833 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.532 -14.628 -6.587 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.145 -15.379 -6.635 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.692 -16.375 -6.888 1.00 0.00 H new ATOM 27 N LYS A 4 -5.426 -15.859 -8.848 1.00 0.00 N ATOM 28 CA LYS A 4 -6.775 -15.352 -9.078 1.00 0.00 C ATOM 29 C LYS A 4 -7.051 -14.142 -8.188 1.00 0.00 C ATOM 30 O LYS A 4 -6.546 -14.060 -7.069 1.00 0.00 O ATOM 31 CB LYS A 4 -7.812 -16.445 -8.806 1.00 0.00 C ATOM 32 CG LYS A 4 -7.547 -17.741 -9.557 1.00 0.00 C ATOM 33 CD LYS A 4 -7.977 -17.642 -11.013 1.00 0.00 C ATOM 34 CE LYS A 4 -6.979 -18.322 -11.939 1.00 0.00 C ATOM 35 NZ LYS A 4 -6.858 -19.781 -11.656 1.00 0.00 N ATOM 0 H LYS A 4 -5.333 -16.440 -8.015 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.850 -15.046 -10.122 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.835 -16.654 -7.736 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.799 -16.073 -9.079 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -6.485 -17.981 -9.506 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.082 -18.558 -9.074 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -8.958 -18.100 -11.135 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.078 -16.593 -11.293 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.289 -18.178 -12.974 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -6.003 -17.849 -11.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -6.234 -20.221 -12.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -6.457 -19.918 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -7.798 -20.223 -11.702 1.00 0.00 H new ATOM 49 N ILE A 5 -7.854 -13.207 -8.692 1.00 0.00 N ATOM 50 CA ILE A 5 -8.194 -12.004 -7.938 1.00 0.00 C ATOM 51 C ILE A 5 -9.708 -11.843 -7.813 1.00 0.00 C ATOM 52 O ILE A 5 -10.436 -11.937 -8.802 1.00 0.00 O ATOM 53 CB ILE A 5 -7.590 -10.735 -8.586 1.00 0.00 C ATOM 54 CG1 ILE A 5 -7.888 -9.501 -7.727 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.119 -10.544 -10.002 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.754 -8.500 -7.692 1.00 0.00 C ATOM 0 H ILE A 5 -8.280 -13.260 -9.617 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.765 -12.122 -6.943 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.509 -10.863 -8.644 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.783 -9.010 -8.109 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.110 -9.822 -6.709 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.680 -9.646 -10.436 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.852 -11.409 -10.610 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.204 -10.441 -9.974 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.035 -7.653 -7.066 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.862 -8.974 -7.282 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.546 -8.150 -8.703 1.00 0.00 H new ATOM 68 N ASP A 6 -10.171 -11.596 -6.590 1.00 0.00 N ATOM 69 CA ASP A 6 -11.595 -11.415 -6.335 1.00 0.00 C ATOM 70 C ASP A 6 -11.986 -9.949 -6.495 1.00 0.00 C ATOM 71 O ASP A 6 -11.642 -9.110 -5.660 1.00 0.00 O ATOM 72 CB ASP A 6 -11.957 -11.908 -4.929 1.00 0.00 C ATOM 73 CG ASP A 6 -13.457 -12.058 -4.719 1.00 0.00 C ATOM 74 OD1 ASP A 6 -14.237 -11.649 -5.609 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.853 -12.585 -3.658 1.00 0.00 O ATOM 0 H ASP A 6 -9.581 -11.517 -5.762 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.150 -12.005 -7.065 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.473 -12.868 -4.751 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.561 -11.210 -4.192 1.00 0.00 H new ATOM 80 N LYS A 7 -12.708 -9.649 -7.573 1.00 0.00 N ATOM 81 CA LYS A 7 -13.148 -8.284 -7.849 1.00 0.00 C ATOM 82 C LYS A 7 -14.181 -7.820 -6.824 1.00 0.00 C ATOM 83 O LYS A 7 -14.219 -6.642 -6.466 1.00 0.00 O ATOM 84 CB LYS A 7 -13.731 -8.186 -9.262 1.00 0.00 C ATOM 85 CG LYS A 7 -12.720 -7.744 -10.309 1.00 0.00 C ATOM 86 CD LYS A 7 -12.312 -6.291 -10.116 1.00 0.00 C ATOM 87 CE LYS A 7 -12.282 -5.538 -11.438 1.00 0.00 C ATOM 88 NZ LYS A 7 -12.095 -4.073 -11.243 1.00 0.00 N ATOM 0 H LYS A 7 -13.001 -10.334 -8.270 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.278 -7.631 -7.777 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.136 -9.157 -9.547 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.564 -7.483 -9.254 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -11.837 -8.381 -10.254 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.146 -7.874 -11.304 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.010 -5.804 -9.435 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -11.328 -6.248 -9.649 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.474 -5.927 -12.058 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.212 -5.716 -11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.985 -3.578 -11.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -11.821 -3.886 -10.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.348 -3.730 -11.881 1.00 0.00 H new ATOM 102 N GLU A 8 -15.015 -8.749 -6.353 1.00 0.00 N ATOM 103 CA GLU A 8 -16.045 -8.431 -5.368 1.00 0.00 C ATOM 104 C GLU A 8 -15.429 -7.885 -4.080 1.00 0.00 C ATOM 105 O GLU A 8 -15.786 -6.796 -3.627 1.00 0.00 O ATOM 106 CB GLU A 8 -16.893 -9.669 -5.060 1.00 0.00 C ATOM 107 CG GLU A 8 -18.089 -9.834 -5.987 1.00 0.00 C ATOM 108 CD GLU A 8 -17.687 -9.988 -7.443 1.00 0.00 C ATOM 109 OE1 GLU A 8 -17.409 -11.129 -7.866 1.00 0.00 O ATOM 110 OE2 GLU A 8 -17.649 -8.965 -8.159 1.00 0.00 O ATOM 0 H GLU A 8 -14.996 -9.728 -6.639 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.686 -7.659 -5.794 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.264 -10.557 -5.130 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.247 -9.610 -4.031 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.664 -10.707 -5.679 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.744 -8.969 -5.885 1.00 0.00 H new ATOM 117 N ALA A 9 -14.503 -8.646 -3.497 1.00 0.00 N ATOM 118 CA ALA A 9 -13.838 -8.238 -2.261 1.00 0.00 C ATOM 119 C ALA A 9 -12.932 -7.029 -2.490 1.00 0.00 C ATOM 120 O ALA A 9 -12.957 -6.071 -1.714 1.00 0.00 O ATOM 121 CB ALA A 9 -13.041 -9.398 -1.683 1.00 0.00 C ATOM 0 H ALA A 9 -14.197 -9.548 -3.861 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.607 -7.947 -1.546 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.551 -9.080 -0.763 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.712 -10.229 -1.468 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.288 -9.717 -2.404 1.00 0.00 H new ATOM 127 N CYS A 10 -12.133 -7.079 -3.557 1.00 0.00 N ATOM 128 CA CYS A 10 -11.219 -5.990 -3.892 1.00 0.00 C ATOM 129 C CYS A 10 -11.972 -4.675 -4.093 1.00 0.00 C ATOM 130 O CYS A 10 -11.553 -3.629 -3.590 1.00 0.00 O ATOM 131 CB CYS A 10 -10.432 -6.336 -5.157 1.00 0.00 C ATOM 132 SG CYS A 10 -9.042 -7.461 -4.881 1.00 0.00 S ATOM 0 H CYS A 10 -12.102 -7.866 -4.205 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.529 -5.862 -3.058 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -11.110 -6.786 -5.882 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.056 -5.414 -5.601 1.00 0.00 H new ATOM 0 HG CYS A 10 -9.433 -8.687 -5.064 1.00 0.00 H new ATOM 138 N ARG A 11 -13.083 -4.734 -4.829 1.00 0.00 N ATOM 139 CA ARG A 11 -13.897 -3.548 -5.097 1.00 0.00 C ATOM 140 C ARG A 11 -14.585 -3.061 -3.824 1.00 0.00 C ATOM 141 O ARG A 11 -14.592 -1.864 -3.534 1.00 0.00 O ATOM 142 CB ARG A 11 -14.944 -3.842 -6.179 1.00 0.00 C ATOM 143 CG ARG A 11 -15.591 -2.594 -6.762 1.00 0.00 C ATOM 144 CD ARG A 11 -16.870 -2.924 -7.521 1.00 0.00 C ATOM 145 NE ARG A 11 -17.052 -2.061 -8.689 1.00 0.00 N ATOM 146 CZ ARG A 11 -18.206 -1.923 -9.347 1.00 0.00 C ATOM 147 NH1 ARG A 11 -19.289 -2.592 -8.962 1.00 0.00 N ATOM 148 NH2 ARG A 11 -18.274 -1.112 -10.396 1.00 0.00 N ATOM 0 H ARG A 11 -13.440 -5.592 -5.250 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.233 -2.762 -5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.473 -4.406 -6.984 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.721 -4.479 -5.756 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -15.815 -1.892 -5.959 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.888 -2.099 -7.432 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -16.844 -3.966 -7.840 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.725 -2.817 -6.854 1.00 0.00 H new ATOM 0 HE ARG A 11 -16.246 -1.531 -9.022 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -19.243 -3.217 -8.158 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -20.166 -2.480 -9.471 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -17.447 -0.597 -10.697 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -19.154 -1.004 -10.901 1.00 0.00 H new ATOM 162 N ALA A 12 -15.159 -3.999 -3.068 1.00 0.00 N ATOM 163 CA ALA A 12 -15.844 -3.668 -1.820 1.00 0.00 C ATOM 164 C ALA A 12 -14.924 -2.884 -0.889 1.00 0.00 C ATOM 165 O ALA A 12 -15.321 -1.860 -0.330 1.00 0.00 O ATOM 166 CB ALA A 12 -16.341 -4.933 -1.136 1.00 0.00 C ATOM 0 H ALA A 12 -15.162 -4.992 -3.299 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.703 -3.041 -2.057 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.849 -4.669 -0.208 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -17.036 -5.454 -1.795 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.495 -5.583 -0.914 1.00 0.00 H new ATOM 172 N ALA A 13 -13.689 -3.367 -0.739 1.00 0.00 N ATOM 173 CA ALA A 13 -12.703 -2.709 0.113 1.00 0.00 C ATOM 174 C ALA A 13 -12.394 -1.304 -0.396 1.00 0.00 C ATOM 175 O ALA A 13 -12.389 -0.345 0.377 1.00 0.00 O ATOM 176 CB ALA A 13 -11.430 -3.539 0.188 1.00 0.00 C ATOM 0 H ALA A 13 -13.350 -4.212 -1.198 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.123 -2.622 1.115 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.704 -3.035 0.827 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.659 -4.520 0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.013 -3.657 -0.812 1.00 0.00 H new ATOM 182 N TYR A 14 -12.144 -1.191 -1.704 1.00 0.00 N ATOM 183 CA TYR A 14 -11.841 0.099 -2.323 1.00 0.00 C ATOM 184 C TYR A 14 -12.952 1.112 -2.057 1.00 0.00 C ATOM 185 O TYR A 14 -12.681 2.270 -1.742 1.00 0.00 O ATOM 186 CB TYR A 14 -11.640 -0.064 -3.833 1.00 0.00 C ATOM 187 CG TYR A 14 -10.980 1.128 -4.492 1.00 0.00 C ATOM 188 CD1 TYR A 14 -11.715 2.263 -4.816 1.00 0.00 C ATOM 189 CD2 TYR A 14 -9.621 1.121 -4.786 1.00 0.00 C ATOM 190 CE1 TYR A 14 -11.116 3.353 -5.416 1.00 0.00 C ATOM 191 CE2 TYR A 14 -9.016 2.210 -5.385 1.00 0.00 C ATOM 192 CZ TYR A 14 -9.768 3.322 -5.697 1.00 0.00 C ATOM 193 OH TYR A 14 -9.169 4.407 -6.295 1.00 0.00 O ATOM 0 H TYR A 14 -12.146 -1.978 -2.353 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.919 0.472 -1.878 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.033 -0.951 -4.016 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.608 -0.238 -4.303 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -12.772 2.293 -4.595 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -9.029 0.251 -4.543 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.702 4.226 -5.664 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -7.959 2.190 -5.607 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.803 5.000 -5.606 1.00 0.00 H new ATOM 203 N ASN A 15 -14.203 0.666 -2.186 1.00 0.00 N ATOM 204 CA ASN A 15 -15.359 1.533 -1.960 1.00 0.00 C ATOM 205 C ASN A 15 -15.358 2.092 -0.537 1.00 0.00 C ATOM 206 O ASN A 15 -15.569 3.290 -0.336 1.00 0.00 O ATOM 207 CB ASN A 15 -16.660 0.769 -2.223 1.00 0.00 C ATOM 208 CG ASN A 15 -17.131 0.900 -3.662 1.00 0.00 C ATOM 209 OD1 ASN A 15 -17.154 1.996 -4.223 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.512 -0.220 -4.269 1.00 0.00 N ATOM 0 H ASN A 15 -14.441 -0.291 -2.446 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.292 2.369 -2.656 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -16.513 -0.285 -1.987 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.437 1.140 -1.555 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.839 -0.191 -5.235 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -17.478 -1.108 -3.769 1.00 0.00 H new ATOM 217 N LEU A 16 -15.114 1.222 0.446 1.00 0.00 N ATOM 218 CA LEU A 16 -15.079 1.638 1.847 1.00 0.00 C ATOM 219 C LEU A 16 -13.914 2.594 2.101 1.00 0.00 C ATOM 220 O LEU A 16 -14.075 3.616 2.771 1.00 0.00 O ATOM 221 CB LEU A 16 -14.964 0.417 2.766 1.00 0.00 C ATOM 222 CG LEU A 16 -15.638 0.566 4.134 1.00 0.00 C ATOM 223 CD1 LEU A 16 -16.032 -0.795 4.686 1.00 0.00 C ATOM 224 CD2 LEU A 16 -14.718 1.293 5.106 1.00 0.00 C ATOM 0 H LEU A 16 -14.938 0.228 0.297 1.00 0.00 H new ATOM 0 HA LEU A 16 -16.010 2.160 2.067 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -15.398 -0.444 2.257 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.908 0.197 2.921 1.00 0.00 H new ATOM 0 HG LEU A 16 -16.543 1.160 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -16.509 -0.669 5.658 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.728 -1.278 4.000 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -15.142 -1.414 4.796 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -15.213 1.390 6.072 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -13.795 0.726 5.226 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -14.487 2.284 4.716 1.00 0.00 H new ATOM 236 N VAL A 17 -12.746 2.264 1.547 1.00 0.00 N ATOM 237 CA VAL A 17 -11.557 3.101 1.699 1.00 0.00 C ATOM 238 C VAL A 17 -11.742 4.441 0.981 1.00 0.00 C ATOM 239 O VAL A 17 -11.207 5.462 1.416 1.00 0.00 O ATOM 240 CB VAL A 17 -10.290 2.396 1.158 1.00 0.00 C ATOM 241 CG1 VAL A 17 -9.051 3.250 1.391 1.00 0.00 C ATOM 242 CG2 VAL A 17 -10.122 1.029 1.807 1.00 0.00 C ATOM 0 H VAL A 17 -12.599 1.423 0.989 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.424 3.278 2.766 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.412 2.259 0.084 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.174 2.733 1.002 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.166 4.205 0.879 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.925 3.424 2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.226 0.548 1.415 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.027 1.148 2.886 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.992 0.411 1.585 1.00 0.00 H new ATOM 252 N ARG A 18 -12.513 4.430 -0.111 1.00 0.00 N ATOM 253 CA ARG A 18 -12.783 5.643 -0.883 1.00 0.00 C ATOM 254 C ARG A 18 -13.394 6.725 0.007 1.00 0.00 C ATOM 255 O ARG A 18 -13.082 7.910 -0.141 1.00 0.00 O ATOM 256 CB ARG A 18 -13.723 5.334 -2.054 1.00 0.00 C ATOM 257 CG ARG A 18 -13.156 5.723 -3.410 1.00 0.00 C ATOM 258 CD ARG A 18 -14.237 6.273 -4.329 1.00 0.00 C ATOM 259 NE ARG A 18 -13.718 6.594 -5.658 1.00 0.00 N ATOM 260 CZ ARG A 18 -13.642 5.720 -6.664 1.00 0.00 C ATOM 261 NH1 ARG A 18 -14.029 4.459 -6.493 1.00 0.00 N ATOM 262 NH2 ARG A 18 -13.169 6.108 -7.844 1.00 0.00 N ATOM 0 H ARG A 18 -12.961 3.591 -0.479 1.00 0.00 H new ATOM 0 HA ARG A 18 -11.837 6.012 -1.279 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.948 4.268 -2.056 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -14.666 5.859 -1.900 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.374 6.471 -3.278 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -12.690 4.854 -3.874 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -15.040 5.542 -4.421 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.670 7.169 -3.883 1.00 0.00 H new ATOM 0 HE ARG A 18 -13.394 7.546 -5.827 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -14.387 4.154 -5.588 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.968 3.797 -7.267 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -12.865 7.072 -7.980 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -13.110 5.442 -8.614 1.00 0.00 H new ATOM 276 N ASP A 19 -14.256 6.310 0.936 1.00 0.00 N ATOM 277 CA ASP A 19 -14.901 7.239 1.855 1.00 0.00 C ATOM 278 C ASP A 19 -13.880 7.854 2.804 1.00 0.00 C ATOM 279 O ASP A 19 -13.142 7.138 3.486 1.00 0.00 O ATOM 280 CB ASP A 19 -15.996 6.534 2.660 1.00 0.00 C ATOM 281 CG ASP A 19 -17.101 7.484 3.079 1.00 0.00 C ATOM 282 OD1 ASP A 19 -16.880 8.274 4.021 1.00 0.00 O ATOM 283 OD2 ASP A 19 -18.187 7.441 2.463 1.00 0.00 O ATOM 0 H ASP A 19 -14.522 5.334 1.069 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.356 8.033 1.263 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.420 5.727 2.063 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.556 6.078 3.547 1.00 0.00 H new ATOM 318 N ALA A 23 -12.885 6.264 10.072 1.00 0.00 N ATOM 319 CA ALA A 23 -11.523 6.222 10.607 1.00 0.00 C ATOM 320 C ALA A 23 -10.588 5.393 9.719 1.00 0.00 C ATOM 321 O ALA A 23 -9.370 5.565 9.761 1.00 0.00 O ATOM 322 CB ALA A 23 -11.535 5.668 12.026 1.00 0.00 C ATOM 0 HA ALA A 23 -11.140 7.243 10.622 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.517 5.641 12.415 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.149 6.307 12.661 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.948 4.659 12.019 1.00 0.00 H new ATOM 328 N VAL A 24 -11.168 4.495 8.920 1.00 0.00 N ATOM 329 CA VAL A 24 -10.398 3.637 8.021 1.00 0.00 C ATOM 330 C VAL A 24 -9.491 4.457 7.098 1.00 0.00 C ATOM 331 O VAL A 24 -9.974 5.266 6.301 1.00 0.00 O ATOM 332 CB VAL A 24 -11.336 2.760 7.161 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.539 1.888 6.202 1.00 0.00 C ATOM 334 CG2 VAL A 24 -12.232 1.903 8.048 1.00 0.00 C ATOM 0 H VAL A 24 -12.176 4.344 8.879 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.775 2.999 8.647 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.969 3.422 6.569 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.223 1.281 5.609 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.948 2.521 5.540 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.874 1.237 6.769 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.885 1.293 7.424 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.615 1.255 8.670 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.838 2.548 8.685 1.00 0.00 H new ATOM 344 N ILE A 25 -8.177 4.242 7.208 1.00 0.00 N ATOM 345 CA ILE A 25 -7.207 4.963 6.381 1.00 0.00 C ATOM 346 C ILE A 25 -6.480 4.025 5.412 1.00 0.00 C ATOM 347 O ILE A 25 -6.180 4.412 4.281 1.00 0.00 O ATOM 348 CB ILE A 25 -6.166 5.722 7.240 1.00 0.00 C ATOM 349 CG1 ILE A 25 -5.246 4.748 7.984 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.864 6.652 8.222 1.00 0.00 C ATOM 351 CD1 ILE A 25 -4.048 5.417 8.623 1.00 0.00 C ATOM 0 H ILE A 25 -7.762 3.576 7.860 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.780 5.690 5.805 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.549 6.321 6.570 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.821 4.236 8.756 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.898 3.986 7.287 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.118 7.178 8.818 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.466 7.376 7.673 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.509 6.069 8.880 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.441 4.668 9.132 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.451 5.906 7.853 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.388 6.160 9.345 1.00 0.00 H new ATOM 363 N TRP A 26 -6.196 2.796 5.854 1.00 0.00 N ATOM 364 CA TRP A 26 -5.504 1.825 5.009 1.00 0.00 C ATOM 365 C TRP A 26 -6.138 0.437 5.098 1.00 0.00 C ATOM 366 O TRP A 26 -6.813 0.107 6.078 1.00 0.00 O ATOM 367 CB TRP A 26 -4.014 1.746 5.378 1.00 0.00 C ATOM 368 CG TRP A 26 -3.749 1.192 6.750 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.413 1.899 7.867 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.790 -0.188 7.146 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.251 1.048 8.933 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.473 -0.235 8.517 1.00 0.00 C ATOM 373 CE3 TRP A 26 -4.062 -1.385 6.478 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.428 -1.428 9.230 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.015 -2.570 7.190 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.699 -2.582 8.551 1.00 0.00 C ATOM 0 H TRP A 26 -6.433 2.454 6.785 1.00 0.00 H new ATOM 0 HA TRP A 26 -5.599 2.171 3.980 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -3.501 1.126 4.643 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.581 2.744 5.311 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.292 2.971 7.907 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.005 1.328 9.882 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.304 -1.385 5.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.187 -1.442 10.283 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.226 -3.501 6.686 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.668 -3.524 9.078 1.00 0.00 H new ATOM 387 N VAL A 27 -5.903 -0.371 4.066 1.00 0.00 N ATOM 388 CA VAL A 27 -6.428 -1.733 4.001 1.00 0.00 C ATOM 389 C VAL A 27 -5.371 -2.687 3.450 1.00 0.00 C ATOM 390 O VAL A 27 -4.587 -2.310 2.575 1.00 0.00 O ATOM 391 CB VAL A 27 -7.687 -1.815 3.111 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.891 -1.242 3.838 1.00 0.00 C ATOM 393 CG2 VAL A 27 -7.460 -1.093 1.789 1.00 0.00 C ATOM 0 H VAL A 27 -5.346 -0.102 3.255 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.697 -2.022 5.017 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.886 -2.864 2.894 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.769 -1.308 3.196 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.067 -1.808 4.753 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.702 -0.198 4.088 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.359 -1.163 1.177 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -7.233 -0.044 1.981 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -6.625 -1.554 1.261 1.00 0.00 H new ATOM 403 N THR A 28 -5.348 -3.921 3.952 1.00 0.00 N ATOM 404 CA THR A 28 -4.373 -4.903 3.481 1.00 0.00 C ATOM 405 C THR A 28 -4.882 -5.603 2.223 1.00 0.00 C ATOM 406 O THR A 28 -6.073 -5.560 1.920 1.00 0.00 O ATOM 407 CB THR A 28 -4.068 -5.931 4.581 1.00 0.00 C ATOM 408 OG1 THR A 28 -3.522 -5.295 5.721 1.00 0.00 O ATOM 409 CG2 THR A 28 -3.093 -7.011 4.158 1.00 0.00 C ATOM 0 H THR A 28 -5.983 -4.261 4.674 1.00 0.00 H new ATOM 0 HA THR A 28 -3.450 -4.378 3.234 1.00 0.00 H new ATOM 0 HB THR A 28 -5.027 -6.400 4.800 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.944 -5.924 6.201 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.928 -7.698 4.988 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.503 -7.559 3.309 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.146 -6.554 3.872 1.00 0.00 H new ATOM 417 N PHE A 29 -3.975 -6.243 1.493 1.00 0.00 N ATOM 418 CA PHE A 29 -4.335 -6.957 0.275 1.00 0.00 C ATOM 419 C PHE A 29 -3.476 -8.211 0.125 1.00 0.00 C ATOM 420 O PHE A 29 -2.346 -8.154 -0.360 1.00 0.00 O ATOM 421 CB PHE A 29 -4.185 -6.050 -0.950 1.00 0.00 C ATOM 422 CG PHE A 29 -5.458 -5.347 -1.336 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.887 -4.224 -0.645 1.00 0.00 C ATOM 424 CD2 PHE A 29 -6.227 -5.811 -2.393 1.00 0.00 C ATOM 425 CE1 PHE A 29 -7.057 -3.578 -0.999 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.397 -5.168 -2.751 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.813 -4.051 -2.054 1.00 0.00 C ATOM 0 H PHE A 29 -2.983 -6.281 1.725 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.380 -7.258 0.347 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.415 -5.305 -0.749 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.839 -6.647 -1.794 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -5.300 -3.849 0.180 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.908 -6.684 -2.942 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.379 -2.705 -0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.986 -5.539 -3.576 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.727 -3.548 -2.333 1.00 0.00 H new ATOM 437 N LYS A 30 -4.024 -9.342 0.561 1.00 0.00 N ATOM 438 CA LYS A 30 -3.320 -10.621 0.493 1.00 0.00 C ATOM 439 C LYS A 30 -4.166 -11.665 -0.237 1.00 0.00 C ATOM 440 O LYS A 30 -5.280 -11.373 -0.673 1.00 0.00 O ATOM 441 CB LYS A 30 -2.977 -11.110 1.905 1.00 0.00 C ATOM 442 CG LYS A 30 -4.183 -11.210 2.830 1.00 0.00 C ATOM 443 CD LYS A 30 -3.764 -11.337 4.287 1.00 0.00 C ATOM 444 CE LYS A 30 -4.904 -10.972 5.229 1.00 0.00 C ATOM 445 NZ LYS A 30 -5.151 -12.033 6.246 1.00 0.00 N ATOM 0 H LYS A 30 -4.958 -9.399 0.967 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.395 -10.477 -0.066 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.502 -12.089 1.835 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.247 -10.432 2.347 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.810 -10.327 2.707 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.787 -12.072 2.548 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -3.439 -12.358 4.486 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -2.910 -10.688 4.479 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.671 -10.034 5.733 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -5.813 -10.806 4.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.934 -11.744 6.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.399 -12.922 5.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -4.293 -12.174 6.816 1.00 0.00 H new ATOM 459 N TYR A 31 -3.637 -12.878 -0.369 1.00 0.00 N ATOM 460 CA TYR A 31 -4.360 -13.949 -1.048 1.00 0.00 C ATOM 461 C TYR A 31 -4.824 -15.016 -0.062 1.00 0.00 C ATOM 462 O TYR A 31 -4.022 -15.577 0.689 1.00 0.00 O ATOM 463 CB TYR A 31 -3.496 -14.582 -2.146 1.00 0.00 C ATOM 464 CG TYR A 31 -2.186 -15.159 -1.653 1.00 0.00 C ATOM 465 CD1 TYR A 31 -1.046 -14.370 -1.579 1.00 0.00 C ATOM 466 CD2 TYR A 31 -2.089 -16.491 -1.269 1.00 0.00 C ATOM 467 CE1 TYR A 31 0.154 -14.890 -1.135 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.892 -17.018 -0.823 1.00 0.00 C ATOM 469 CZ TYR A 31 0.226 -16.214 -0.758 1.00 0.00 C ATOM 470 OH TYR A 31 1.421 -16.735 -0.318 1.00 0.00 O ATOM 0 H TYR A 31 -2.717 -13.143 -0.018 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.242 -13.506 -1.511 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.068 -15.373 -2.631 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.285 -13.829 -2.905 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -1.098 -13.332 -1.874 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.963 -17.124 -1.320 1.00 0.00 H new ATOM 0 HE1 TYR A 31 1.031 -14.263 -1.083 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -0.833 -18.055 -0.527 1.00 0.00 H new ATOM 0 HH TYR A 31 1.302 -17.681 -0.090 1.00 0.00 H new ATOM 480 N ASP A 32 -6.125 -15.296 -0.078 1.00 0.00 N ATOM 481 CA ASP A 32 -6.707 -16.303 0.802 1.00 0.00 C ATOM 482 C ASP A 32 -6.797 -17.640 0.077 1.00 0.00 C ATOM 483 O ASP A 32 -7.691 -17.852 -0.747 1.00 0.00 O ATOM 484 CB ASP A 32 -8.095 -15.864 1.281 1.00 0.00 C ATOM 485 CG ASP A 32 -8.270 -16.033 2.777 1.00 0.00 C ATOM 486 OD1 ASP A 32 -8.255 -17.189 3.251 1.00 0.00 O ATOM 487 OD2 ASP A 32 -8.420 -15.008 3.477 1.00 0.00 O ATOM 0 H ASP A 32 -6.797 -14.837 -0.693 1.00 0.00 H new ATOM 0 HA ASP A 32 -6.063 -16.416 1.674 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.254 -14.819 1.015 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.857 -16.445 0.761 1.00 0.00 H new ATOM 492 N GLY A 33 -5.852 -18.532 0.371 1.00 0.00 N ATOM 493 CA GLY A 33 -5.830 -19.832 -0.276 1.00 0.00 C ATOM 494 C GLY A 33 -5.286 -19.751 -1.689 1.00 0.00 C ATOM 495 O GLY A 33 -4.193 -20.245 -1.969 1.00 0.00 O ATOM 0 H GLY A 33 -5.103 -18.376 1.045 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.219 -20.519 0.310 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.839 -20.244 -0.298 1.00 0.00 H new ATOM 499 N SER A 34 -6.050 -19.120 -2.580 1.00 0.00 N ATOM 500 CA SER A 34 -5.639 -18.964 -3.974 1.00 0.00 C ATOM 501 C SER A 34 -6.407 -17.826 -4.655 1.00 0.00 C ATOM 502 O SER A 34 -6.688 -17.887 -5.855 1.00 0.00 O ATOM 503 CB SER A 34 -5.849 -20.275 -4.740 1.00 0.00 C ATOM 504 OG SER A 34 -7.200 -20.700 -4.670 1.00 0.00 O ATOM 0 H SER A 34 -6.957 -18.709 -2.361 1.00 0.00 H new ATOM 0 HA SER A 34 -4.579 -18.711 -3.985 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.561 -20.140 -5.783 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.200 -21.048 -4.328 1.00 0.00 H new ATOM 0 HG SER A 34 -7.306 -21.537 -5.168 1.00 0.00 H new ATOM 510 N THR A 35 -6.742 -16.786 -3.888 1.00 0.00 N ATOM 511 CA THR A 35 -7.472 -15.643 -4.430 1.00 0.00 C ATOM 512 C THR A 35 -7.118 -14.354 -3.689 1.00 0.00 C ATOM 513 O THR A 35 -7.133 -14.308 -2.458 1.00 0.00 O ATOM 514 CB THR A 35 -8.985 -15.890 -4.364 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.703 -14.716 -4.708 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.467 -16.338 -2.998 1.00 0.00 C ATOM 0 H THR A 35 -6.520 -16.714 -2.895 1.00 0.00 H new ATOM 0 HA THR A 35 -7.177 -15.527 -5.473 1.00 0.00 H new ATOM 0 HB THR A 35 -9.173 -16.693 -5.077 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.665 -14.896 -4.661 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.545 -16.494 -3.026 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.973 -17.271 -2.726 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.230 -15.572 -2.259 1.00 0.00 H new ATOM 524 N ILE A 36 -6.805 -13.309 -4.454 1.00 0.00 N ATOM 525 CA ILE A 36 -6.453 -12.011 -3.883 1.00 0.00 C ATOM 526 C ILE A 36 -7.679 -11.328 -3.280 1.00 0.00 C ATOM 527 O ILE A 36 -8.720 -11.215 -3.930 1.00 0.00 O ATOM 528 CB ILE A 36 -5.826 -11.077 -4.941 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.677 -11.782 -5.669 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.341 -9.786 -4.294 1.00 0.00 C ATOM 531 CD1 ILE A 36 -3.554 -12.220 -4.753 1.00 0.00 C ATOM 0 H ILE A 36 -6.788 -13.337 -5.473 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.719 -12.199 -3.099 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.592 -10.826 -5.675 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.070 -12.655 -6.190 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.274 -11.112 -6.428 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.902 -9.140 -5.055 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -6.182 -9.275 -3.826 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.591 -10.017 -3.538 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.777 -12.711 -5.339 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.133 -11.349 -4.251 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.942 -12.916 -4.009 1.00 0.00 H new ATOM 543 N VAL A 37 -7.543 -10.873 -2.034 1.00 0.00 N ATOM 544 CA VAL A 37 -8.633 -10.199 -1.330 1.00 0.00 C ATOM 545 C VAL A 37 -8.092 -9.215 -0.289 1.00 0.00 C ATOM 546 O VAL A 37 -6.955 -9.347 0.171 1.00 0.00 O ATOM 547 CB VAL A 37 -9.569 -11.210 -0.630 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.482 -11.885 -1.644 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.767 -12.249 0.144 1.00 0.00 C ATOM 0 H VAL A 37 -6.685 -10.960 -1.490 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.203 -9.653 -2.082 1.00 0.00 H new ATOM 0 HB VAL A 37 -10.188 -10.662 0.081 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -11.134 -12.593 -1.132 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -11.089 -11.131 -2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.878 -12.415 -2.381 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -9.449 -12.949 0.627 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.116 -12.792 -0.542 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -8.161 -11.751 0.901 1.00 0.00 H new ATOM 559 N PRO A 38 -8.900 -8.209 0.101 1.00 0.00 N ATOM 560 CA PRO A 38 -8.494 -7.206 1.095 1.00 0.00 C ATOM 561 C PRO A 38 -8.209 -7.822 2.465 1.00 0.00 C ATOM 562 O PRO A 38 -8.614 -8.952 2.743 1.00 0.00 O ATOM 563 CB PRO A 38 -9.697 -6.259 1.169 1.00 0.00 C ATOM 564 CG PRO A 38 -10.846 -7.049 0.645 1.00 0.00 C ATOM 565 CD PRO A 38 -10.270 -7.973 -0.391 1.00 0.00 C ATOM 0 HA PRO A 38 -7.566 -6.710 0.811 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.878 -5.931 2.193 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.530 -5.362 0.572 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.331 -7.611 1.444 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.603 -6.397 0.209 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.838 -8.901 -0.465 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -10.270 -7.519 -1.382 1.00 0.00 H new ATOM 573 N GLY A 39 -7.503 -7.073 3.314 1.00 0.00 N ATOM 574 CA GLY A 39 -7.167 -7.553 4.635 1.00 0.00 C ATOM 575 C GLY A 39 -7.322 -6.487 5.702 1.00 0.00 C ATOM 576 O GLY A 39 -8.200 -5.631 5.609 1.00 0.00 O ATOM 0 H GLY A 39 -7.159 -6.137 3.102 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.804 -8.403 4.881 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.139 -7.915 4.635 1.00 0.00 H new ATOM 580 N GLU A 40 -6.461 -6.556 6.719 1.00 0.00 N ATOM 581 CA GLU A 40 -6.471 -5.626 7.852 1.00 0.00 C ATOM 582 C GLU A 40 -6.975 -4.234 7.474 1.00 0.00 C ATOM 583 O GLU A 40 -6.566 -3.661 6.463 1.00 0.00 O ATOM 584 CB GLU A 40 -5.075 -5.523 8.472 1.00 0.00 C ATOM 585 CG GLU A 40 -4.745 -6.651 9.440 1.00 0.00 C ATOM 586 CD GLU A 40 -4.484 -7.971 8.736 1.00 0.00 C ATOM 587 OE1 GLU A 40 -3.334 -8.195 8.303 1.00 0.00 O ATOM 588 OE2 GLU A 40 -5.430 -8.778 8.613 1.00 0.00 O ATOM 0 H GLU A 40 -5.730 -7.265 6.781 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.170 -6.034 8.582 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.333 -5.514 7.673 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.990 -4.571 8.996 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.867 -6.377 10.025 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.570 -6.775 10.141 1.00 0.00 H new ATOM 595 N GLN A 41 -7.863 -3.703 8.310 1.00 0.00 N ATOM 596 CA GLN A 41 -8.441 -2.380 8.101 1.00 0.00 C ATOM 597 C GLN A 41 -8.360 -1.565 9.390 1.00 0.00 C ATOM 598 O GLN A 41 -9.157 -1.762 10.308 1.00 0.00 O ATOM 599 CB GLN A 41 -9.899 -2.506 7.646 1.00 0.00 C ATOM 600 CG GLN A 41 -10.398 -1.309 6.853 1.00 0.00 C ATOM 601 CD GLN A 41 -11.443 -1.685 5.819 1.00 0.00 C ATOM 602 OE1 GLN A 41 -11.261 -2.629 5.050 1.00 0.00 O ATOM 603 NE2 GLN A 41 -12.549 -0.947 5.791 1.00 0.00 N ATOM 0 H GLN A 41 -8.201 -4.176 9.148 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.875 -1.867 7.323 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.004 -3.404 7.036 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.533 -2.640 8.522 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.820 -0.574 7.539 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.554 -0.832 6.354 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -12.662 -0.173 6.445 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -13.284 -1.155 5.115 1.00 0.00 H new ATOM 612 N GLY A 42 -7.381 -0.663 9.462 1.00 0.00 N ATOM 613 CA GLY A 42 -7.210 0.148 10.655 1.00 0.00 C ATOM 614 C GLY A 42 -6.920 1.608 10.358 1.00 0.00 C ATOM 615 O GLY A 42 -6.578 1.967 9.229 1.00 0.00 O ATOM 0 H GLY A 42 -6.707 -0.481 8.718 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.113 0.081 11.263 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.394 -0.263 11.250 1.00 0.00 H new ATOM 619 N ALA A 43 -7.055 2.447 11.386 1.00 0.00 N ATOM 620 CA ALA A 43 -6.805 3.882 11.260 1.00 0.00 C ATOM 621 C ALA A 43 -5.358 4.232 11.617 1.00 0.00 C ATOM 622 O ALA A 43 -4.905 5.348 11.361 1.00 0.00 O ATOM 623 CB ALA A 43 -7.768 4.661 12.145 1.00 0.00 C ATOM 0 H ALA A 43 -7.338 2.154 12.321 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.969 4.161 10.219 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.573 5.729 12.043 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.793 4.449 11.842 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.628 4.364 13.184 1.00 0.00 H new ATOM 629 N GLU A 44 -4.638 3.278 12.211 1.00 0.00 N ATOM 630 CA GLU A 44 -3.248 3.491 12.602 1.00 0.00 C ATOM 631 C GLU A 44 -2.324 2.561 11.822 1.00 0.00 C ATOM 632 O GLU A 44 -2.600 1.367 11.689 1.00 0.00 O ATOM 633 CB GLU A 44 -3.081 3.264 14.105 1.00 0.00 C ATOM 634 CG GLU A 44 -4.112 3.997 14.948 1.00 0.00 C ATOM 635 CD GLU A 44 -3.594 4.352 16.328 1.00 0.00 C ATOM 636 OE1 GLU A 44 -3.558 3.456 17.198 1.00 0.00 O ATOM 637 OE2 GLU A 44 -3.225 5.527 16.539 1.00 0.00 O ATOM 0 H GLU A 44 -4.998 2.349 12.431 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.977 4.521 12.370 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.147 2.196 14.312 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -2.084 3.586 14.404 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.415 4.908 14.433 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.002 3.376 15.047 1.00 0.00 H new ATOM 644 N TYR A 45 -1.229 3.114 11.303 1.00 0.00 N ATOM 645 CA TYR A 45 -0.271 2.328 10.531 1.00 0.00 C ATOM 646 C TYR A 45 0.501 1.344 11.412 1.00 0.00 C ATOM 647 O TYR A 45 1.074 0.378 10.904 1.00 0.00 O ATOM 648 CB TYR A 45 0.707 3.240 9.793 1.00 0.00 C ATOM 649 CG TYR A 45 1.433 2.545 8.664 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.791 2.278 7.463 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.758 2.156 8.800 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.451 1.647 6.425 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.426 1.524 7.769 1.00 0.00 C ATOM 654 CZ TYR A 45 2.768 1.273 6.582 1.00 0.00 C ATOM 655 OH TYR A 45 3.426 0.645 5.546 1.00 0.00 O ATOM 0 H TYR A 45 -0.985 4.099 11.403 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.843 1.752 9.804 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.164 4.097 9.394 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.438 3.628 10.502 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.242 2.568 7.337 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.276 2.351 9.728 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.937 1.448 5.496 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.457 1.228 7.891 1.00 0.00 H new ATOM 0 HH TYR A 45 3.119 -0.283 5.479 1.00 0.00 H new ATOM 665 N GLN A 46 0.516 1.584 12.727 1.00 0.00 N ATOM 666 CA GLN A 46 1.219 0.704 13.659 1.00 0.00 C ATOM 667 C GLN A 46 0.836 -0.756 13.422 1.00 0.00 C ATOM 668 O GLN A 46 1.689 -1.645 13.468 1.00 0.00 O ATOM 669 CB GLN A 46 0.911 1.098 15.108 1.00 0.00 C ATOM 670 CG GLN A 46 2.093 1.727 15.829 1.00 0.00 C ATOM 671 CD GLN A 46 3.171 0.718 16.179 1.00 0.00 C ATOM 672 OE1 GLN A 46 3.692 0.023 15.305 1.00 0.00 O ATOM 673 NE2 GLN A 46 3.512 0.629 17.461 1.00 0.00 N ATOM 0 H GLN A 46 0.050 2.378 13.167 1.00 0.00 H new ATOM 0 HA GLN A 46 2.289 0.815 13.484 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.076 1.798 15.116 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.590 0.213 15.657 1.00 0.00 H new ATOM 0 HG2 GLN A 46 2.522 2.508 15.201 1.00 0.00 H new ATOM 0 HG3 GLN A 46 1.742 2.209 16.742 1.00 0.00 H new ATOM 0 HE21 GLN A 46 3.055 1.224 18.153 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.230 -0.034 17.753 1.00 0.00 H new ATOM 682 N HIS A 47 -0.450 -0.991 13.156 1.00 0.00 N ATOM 683 CA HIS A 47 -0.953 -2.337 12.896 1.00 0.00 C ATOM 684 C HIS A 47 -0.291 -2.951 11.665 1.00 0.00 C ATOM 685 O HIS A 47 -0.030 -4.156 11.635 1.00 0.00 O ATOM 686 CB HIS A 47 -2.469 -2.306 12.701 1.00 0.00 C ATOM 687 CG HIS A 47 -3.248 -2.463 13.969 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.699 -2.292 15.224 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.546 -2.783 14.168 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.628 -2.501 16.140 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.759 -2.800 15.526 1.00 0.00 N ATOM 0 H HIS A 47 -1.163 -0.263 13.115 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.709 -2.954 13.760 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.746 -1.362 12.231 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.753 -3.101 12.011 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.280 -2.987 13.402 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.487 -2.438 17.209 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.646 -3.009 15.985 1.00 0.00 H new ATOM 700 N PHE A 48 -0.017 -2.125 10.652 1.00 0.00 N ATOM 701 CA PHE A 48 0.612 -2.608 9.432 1.00 0.00 C ATOM 702 C PHE A 48 2.022 -3.115 9.712 1.00 0.00 C ATOM 703 O PHE A 48 2.312 -4.292 9.503 1.00 0.00 O ATOM 704 CB PHE A 48 0.641 -1.506 8.371 1.00 0.00 C ATOM 705 CG PHE A 48 0.975 -2.016 7.001 1.00 0.00 C ATOM 706 CD1 PHE A 48 0.006 -2.626 6.223 1.00 0.00 C ATOM 707 CD2 PHE A 48 2.259 -1.897 6.498 1.00 0.00 C ATOM 708 CE1 PHE A 48 0.312 -3.109 4.966 1.00 0.00 C ATOM 709 CE2 PHE A 48 2.572 -2.374 5.241 1.00 0.00 C ATOM 710 CZ PHE A 48 1.597 -2.983 4.474 1.00 0.00 C ATOM 0 H PHE A 48 -0.221 -1.126 10.657 1.00 0.00 H new ATOM 0 HA PHE A 48 0.020 -3.441 9.052 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.331 -1.013 8.342 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.373 -0.751 8.660 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -1.000 -2.725 6.603 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.025 -1.425 7.096 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.452 -3.584 4.369 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.577 -2.271 4.858 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.839 -3.360 3.491 1.00 0.00 H new ATOM 720 N ILE A 49 2.891 -2.228 10.196 1.00 0.00 N ATOM 721 CA ILE A 49 4.267 -2.605 10.512 1.00 0.00 C ATOM 722 C ILE A 49 4.307 -3.749 11.530 1.00 0.00 C ATOM 723 O ILE A 49 5.231 -4.566 11.519 1.00 0.00 O ATOM 724 CB ILE A 49 5.079 -1.411 11.064 1.00 0.00 C ATOM 725 CG1 ILE A 49 5.017 -0.224 10.097 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.526 -1.825 11.305 1.00 0.00 C ATOM 727 CD1 ILE A 49 5.831 0.972 10.546 1.00 0.00 C ATOM 0 H ILE A 49 2.668 -1.249 10.377 1.00 0.00 H new ATOM 0 HA ILE A 49 4.720 -2.934 9.577 1.00 0.00 H new ATOM 0 HB ILE A 49 4.640 -1.103 12.013 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.371 -0.546 9.118 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.977 0.080 9.976 1.00 0.00 H new ATOM 0 HG21 ILE A 49 7.088 -0.975 11.694 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.556 -2.641 12.027 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.971 -2.155 10.366 1.00 0.00 H new ATOM 0 HD11 ILE A 49 5.738 1.772 9.811 1.00 0.00 H new ATOM 0 HD12 ILE A 49 5.463 1.321 11.511 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.878 0.685 10.639 1.00 0.00 H new ATOM 739 N GLN A 50 3.301 -3.799 12.409 1.00 0.00 N ATOM 740 CA GLN A 50 3.220 -4.836 13.436 1.00 0.00 C ATOM 741 C GLN A 50 3.190 -6.241 12.828 1.00 0.00 C ATOM 742 O GLN A 50 3.913 -7.127 13.281 1.00 0.00 O ATOM 743 CB GLN A 50 1.981 -4.619 14.313 1.00 0.00 C ATOM 744 CG GLN A 50 1.900 -5.560 15.507 1.00 0.00 C ATOM 745 CD GLN A 50 0.591 -6.327 15.555 1.00 0.00 C ATOM 746 OE1 GLN A 50 0.526 -7.488 15.150 1.00 0.00 O ATOM 747 NE2 GLN A 50 -0.461 -5.682 16.048 1.00 0.00 N ATOM 0 H GLN A 50 2.531 -3.130 12.428 1.00 0.00 H new ATOM 0 HA GLN A 50 4.118 -4.759 14.049 1.00 0.00 H new ATOM 0 HB2 GLN A 50 1.978 -3.590 14.673 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.088 -4.746 13.701 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.730 -6.266 15.466 1.00 0.00 H new ATOM 0 HG3 GLN A 50 2.015 -4.986 16.426 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -0.363 -4.720 16.373 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -1.366 -6.149 16.102 1.00 0.00 H new ATOM 756 N GLN A 51 2.352 -6.446 11.808 1.00 0.00 N ATOM 757 CA GLN A 51 2.248 -7.759 11.169 1.00 0.00 C ATOM 758 C GLN A 51 3.050 -7.851 9.862 1.00 0.00 C ATOM 759 O GLN A 51 3.062 -8.901 9.219 1.00 0.00 O ATOM 760 CB GLN A 51 0.776 -8.135 10.931 1.00 0.00 C ATOM 761 CG GLN A 51 0.004 -7.149 10.070 1.00 0.00 C ATOM 762 CD GLN A 51 0.367 -7.260 8.607 1.00 0.00 C ATOM 763 OE1 GLN A 51 -0.176 -8.092 7.879 1.00 0.00 O ATOM 764 NE2 GLN A 51 1.288 -6.418 8.163 1.00 0.00 N ATOM 0 H GLN A 51 1.744 -5.730 11.412 1.00 0.00 H new ATOM 0 HA GLN A 51 2.690 -8.478 11.859 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.737 -9.117 10.460 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.277 -8.224 11.896 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.065 -7.323 10.191 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.203 -6.135 10.416 1.00 0.00 H new ATOM 0 HE21 GLN A 51 1.713 -5.744 8.800 1.00 0.00 H new ATOM 0 HE22 GLN A 51 1.573 -6.443 7.184 1.00 0.00 H new ATOM 773 N CYS A 52 3.721 -6.763 9.473 1.00 0.00 N ATOM 774 CA CYS A 52 4.517 -6.752 8.245 1.00 0.00 C ATOM 775 C CYS A 52 5.946 -7.225 8.513 1.00 0.00 C ATOM 776 O CYS A 52 6.836 -6.422 8.801 1.00 0.00 O ATOM 777 CB CYS A 52 4.536 -5.352 7.624 1.00 0.00 C ATOM 778 SG CYS A 52 3.762 -5.259 5.992 1.00 0.00 S ATOM 0 H CYS A 52 3.728 -5.883 9.989 1.00 0.00 H new ATOM 0 HA CYS A 52 4.051 -7.442 7.541 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.027 -4.661 8.296 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.570 -5.015 7.544 1.00 0.00 H new ATOM 0 HG CYS A 52 4.579 -5.730 5.097 1.00 0.00 H new ATOM 784 N THR A 53 6.153 -8.535 8.414 1.00 0.00 N ATOM 785 CA THR A 53 7.471 -9.129 8.641 1.00 0.00 C ATOM 786 C THR A 53 8.160 -9.449 7.317 1.00 0.00 C ATOM 787 O THR A 53 7.503 -9.609 6.285 1.00 0.00 O ATOM 788 CB THR A 53 7.355 -10.401 9.493 1.00 0.00 C ATOM 789 OG1 THR A 53 6.045 -10.945 9.427 1.00 0.00 O ATOM 790 CG2 THR A 53 7.690 -10.174 10.954 1.00 0.00 C ATOM 0 H THR A 53 5.424 -9.209 8.178 1.00 0.00 H new ATOM 0 HA THR A 53 8.076 -8.400 9.180 1.00 0.00 H new ATOM 0 HB THR A 53 8.084 -11.094 9.071 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.999 -11.755 9.977 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.589 -11.112 11.500 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.715 -9.813 11.040 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.008 -9.434 11.373 1.00 0.00 H new ATOM 798 N ASP A 54 9.489 -9.534 7.350 1.00 0.00 N ATOM 799 CA ASP A 54 10.278 -9.825 6.156 1.00 0.00 C ATOM 800 C ASP A 54 10.289 -11.327 5.841 1.00 0.00 C ATOM 801 O ASP A 54 11.342 -11.968 5.848 1.00 0.00 O ATOM 802 CB ASP A 54 11.709 -9.304 6.337 1.00 0.00 C ATOM 803 CG ASP A 54 12.341 -9.741 7.648 1.00 0.00 C ATOM 804 OD1 ASP A 54 11.965 -9.186 8.704 1.00 0.00 O ATOM 805 OD2 ASP A 54 13.210 -10.637 7.620 1.00 0.00 O ATOM 0 H ASP A 54 10.044 -9.404 8.196 1.00 0.00 H new ATOM 0 HA ASP A 54 9.815 -9.316 5.311 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.325 -9.655 5.509 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.702 -8.215 6.289 1.00 0.00 H new ATOM 810 N ASP A 55 9.109 -11.882 5.560 1.00 0.00 N ATOM 811 CA ASP A 55 8.985 -13.306 5.245 1.00 0.00 C ATOM 812 C ASP A 55 7.665 -13.605 4.535 1.00 0.00 C ATOM 813 O ASP A 55 6.995 -14.587 4.850 1.00 0.00 O ATOM 814 CB ASP A 55 9.080 -14.129 6.534 1.00 0.00 C ATOM 815 CG ASP A 55 9.746 -15.477 6.329 1.00 0.00 C ATOM 816 OD1 ASP A 55 9.270 -16.259 5.478 1.00 0.00 O ATOM 817 OD2 ASP A 55 10.745 -15.753 7.027 1.00 0.00 O ATOM 0 H ASP A 55 8.228 -11.369 5.544 1.00 0.00 H new ATOM 0 HA ASP A 55 9.799 -13.579 4.573 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.639 -13.563 7.279 1.00 0.00 H new ATOM 0 HB3 ASP A 55 8.078 -14.282 6.935 1.00 0.00 H new ATOM 822 N VAL A 56 7.303 -12.749 3.575 1.00 0.00 N ATOM 823 CA VAL A 56 6.056 -12.905 2.810 1.00 0.00 C ATOM 824 C VAL A 56 5.775 -11.666 1.965 1.00 0.00 C ATOM 825 O VAL A 56 6.195 -10.561 2.310 1.00 0.00 O ATOM 826 CB VAL A 56 4.817 -13.147 3.714 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.524 -14.635 3.857 1.00 0.00 C ATOM 828 CG2 VAL A 56 4.990 -12.489 5.078 1.00 0.00 C ATOM 0 H VAL A 56 7.857 -11.936 3.306 1.00 0.00 H new ATOM 0 HA VAL A 56 6.211 -13.781 2.180 1.00 0.00 H new ATOM 0 HB VAL A 56 3.959 -12.682 3.229 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.651 -14.774 4.495 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.327 -15.063 2.874 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.384 -15.134 4.304 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.106 -12.677 5.687 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.867 -12.905 5.574 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.121 -11.415 4.950 1.00 0.00 H new ATOM 838 N ARG A 57 5.046 -11.852 0.869 1.00 0.00 N ATOM 839 CA ARG A 57 4.693 -10.745 -0.014 1.00 0.00 C ATOM 840 C ARG A 57 3.229 -10.357 0.181 1.00 0.00 C ATOM 841 O ARG A 57 2.340 -11.209 0.118 1.00 0.00 O ATOM 842 CB ARG A 57 4.957 -11.118 -1.477 1.00 0.00 C ATOM 843 CG ARG A 57 4.160 -12.322 -1.964 1.00 0.00 C ATOM 844 CD ARG A 57 3.325 -11.986 -3.193 1.00 0.00 C ATOM 845 NE ARG A 57 1.901 -11.865 -2.878 1.00 0.00 N ATOM 846 CZ ARG A 57 1.294 -10.717 -2.561 1.00 0.00 C ATOM 847 NH1 ARG A 57 1.977 -9.576 -2.519 1.00 0.00 N ATOM 848 NH2 ARG A 57 -0.006 -10.712 -2.289 1.00 0.00 N ATOM 0 H ARG A 57 4.688 -12.759 0.571 1.00 0.00 H new ATOM 0 HA ARG A 57 5.317 -9.888 0.240 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.722 -10.261 -2.108 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.020 -11.324 -1.602 1.00 0.00 H new ATOM 0 HG2 ARG A 57 4.842 -13.139 -2.200 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.507 -12.673 -1.165 1.00 0.00 H new ATOM 0 HD2 ARG A 57 3.680 -11.051 -3.627 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.464 -12.760 -3.947 1.00 0.00 H new ATOM 0 HE ARG A 57 1.334 -12.713 -2.902 1.00 0.00 H new ATOM 0 HH11 ARG A 57 2.975 -9.571 -2.730 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.503 -8.706 -2.276 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.537 -11.582 -2.322 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.473 -9.838 -2.047 1.00 0.00 H new ATOM 862 N LEU A 58 2.982 -9.072 0.430 1.00 0.00 N ATOM 863 CA LEU A 58 1.620 -8.585 0.645 1.00 0.00 C ATOM 864 C LEU A 58 1.411 -7.204 0.028 1.00 0.00 C ATOM 865 O LEU A 58 2.362 -6.442 -0.156 1.00 0.00 O ATOM 866 CB LEU A 58 1.305 -8.525 2.144 1.00 0.00 C ATOM 867 CG LEU A 58 1.582 -9.812 2.924 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.716 -9.518 4.410 1.00 0.00 C ATOM 869 CD2 LEU A 58 0.481 -10.831 2.679 1.00 0.00 C ATOM 0 H LEU A 58 3.703 -8.353 0.488 1.00 0.00 H new ATOM 0 HA LEU A 58 0.944 -9.286 0.155 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.888 -7.718 2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.254 -8.265 2.267 1.00 0.00 H new ATOM 0 HG LEU A 58 2.524 -10.232 2.571 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.913 -10.445 4.948 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.541 -8.823 4.571 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.791 -9.074 4.778 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.695 -11.740 3.242 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.475 -10.419 3.004 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.432 -11.066 1.616 1.00 0.00 H new ATOM 881 N PHE A 59 0.153 -6.883 -0.269 1.00 0.00 N ATOM 882 CA PHE A 59 -0.202 -5.589 -0.844 1.00 0.00 C ATOM 883 C PHE A 59 -0.839 -4.697 0.219 1.00 0.00 C ATOM 884 O PHE A 59 -1.303 -5.186 1.251 1.00 0.00 O ATOM 885 CB PHE A 59 -1.172 -5.763 -2.016 1.00 0.00 C ATOM 886 CG PHE A 59 -0.548 -6.369 -3.240 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.207 -5.597 -4.107 1.00 0.00 C ATOM 888 CD2 PHE A 59 -0.723 -7.712 -3.525 1.00 0.00 C ATOM 889 CE1 PHE A 59 0.779 -6.154 -5.234 1.00 0.00 C ATOM 890 CE2 PHE A 59 -0.155 -8.276 -4.650 1.00 0.00 C ATOM 891 CZ PHE A 59 0.598 -7.496 -5.506 1.00 0.00 C ATOM 0 H PHE A 59 -0.641 -7.506 -0.119 1.00 0.00 H new ATOM 0 HA PHE A 59 0.710 -5.119 -1.211 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -2.004 -6.391 -1.696 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.589 -4.790 -2.277 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.350 -4.547 -3.899 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.311 -8.326 -2.859 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.367 -5.541 -5.901 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -0.299 -9.325 -4.860 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.044 -7.935 -6.386 1.00 0.00 H new ATOM 901 N ALA A 60 -0.861 -3.392 -0.034 1.00 0.00 N ATOM 902 CA ALA A 60 -1.443 -2.443 0.909 1.00 0.00 C ATOM 903 C ALA A 60 -1.929 -1.181 0.204 1.00 0.00 C ATOM 904 O ALA A 60 -1.336 -0.739 -0.782 1.00 0.00 O ATOM 905 CB ALA A 60 -0.438 -2.089 1.994 1.00 0.00 C ATOM 0 H ALA A 60 -0.484 -2.968 -0.882 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.307 -2.921 1.370 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.888 -1.380 2.689 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.150 -2.992 2.532 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.445 -1.641 1.539 1.00 0.00 H new ATOM 911 N PHE A 61 -3.009 -0.607 0.723 1.00 0.00 N ATOM 912 CA PHE A 61 -3.584 0.608 0.161 1.00 0.00 C ATOM 913 C PHE A 61 -3.780 1.659 1.248 1.00 0.00 C ATOM 914 O PHE A 61 -4.626 1.498 2.129 1.00 0.00 O ATOM 915 CB PHE A 61 -4.919 0.295 -0.517 1.00 0.00 C ATOM 916 CG PHE A 61 -5.162 1.105 -1.756 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.633 0.708 -2.973 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.916 2.266 -1.702 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.852 1.454 -4.116 1.00 0.00 C ATOM 920 CE2 PHE A 61 -6.139 3.015 -2.840 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.607 2.610 -4.048 1.00 0.00 C ATOM 0 H PHE A 61 -3.506 -0.967 1.538 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.894 1.005 -0.584 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.949 -0.764 -0.773 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.728 0.475 0.190 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.043 -0.195 -3.030 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.334 2.588 -0.760 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.434 1.135 -5.059 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.730 3.918 -2.785 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.780 3.196 -4.939 1.00 0.00 H new ATOM 931 N VAL A 62 -2.988 2.728 1.187 1.00 0.00 N ATOM 932 CA VAL A 62 -3.071 3.800 2.176 1.00 0.00 C ATOM 933 C VAL A 62 -3.271 5.159 1.508 1.00 0.00 C ATOM 934 O VAL A 62 -2.551 5.517 0.574 1.00 0.00 O ATOM 935 CB VAL A 62 -1.807 3.858 3.063 1.00 0.00 C ATOM 936 CG1 VAL A 62 -2.012 4.822 4.224 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.434 2.470 3.574 1.00 0.00 C ATOM 0 H VAL A 62 -2.283 2.874 0.465 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.934 3.576 2.803 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.982 4.225 2.453 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.111 4.849 4.837 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.218 5.820 3.836 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.854 4.488 4.830 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.541 2.539 4.196 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.257 2.066 4.164 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.237 1.812 2.728 1.00 0.00 H new ATOM 947 N ARG A 63 -4.250 5.916 2.004 1.00 0.00 N ATOM 948 CA ARG A 63 -4.544 7.243 1.471 1.00 0.00 C ATOM 949 C ARG A 63 -3.704 8.306 2.176 1.00 0.00 C ATOM 950 O ARG A 63 -3.329 8.140 3.338 1.00 0.00 O ATOM 951 CB ARG A 63 -6.034 7.570 1.629 1.00 0.00 C ATOM 952 CG ARG A 63 -6.958 6.482 1.102 1.00 0.00 C ATOM 953 CD ARG A 63 -8.348 7.021 0.793 1.00 0.00 C ATOM 954 NE ARG A 63 -8.848 7.914 1.838 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.237 7.515 3.055 1.00 0.00 C ATOM 956 NH1 ARG A 63 -9.175 6.234 3.400 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.694 8.407 3.928 1.00 0.00 N ATOM 0 H ARG A 63 -4.853 5.631 2.776 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.293 7.243 0.410 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.250 7.738 2.684 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.250 8.502 1.107 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.529 6.046 0.200 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.034 5.682 1.838 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.324 7.556 -0.156 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -9.039 6.187 0.671 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.904 8.910 1.625 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.828 5.543 2.735 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.474 5.941 4.330 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -9.747 9.392 3.670 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -9.991 8.106 4.856 1.00 0.00 H new ATOM 971 N PHE A 64 -3.413 9.394 1.466 1.00 0.00 N ATOM 972 CA PHE A 64 -2.617 10.487 2.021 1.00 0.00 C ATOM 973 C PHE A 64 -3.331 11.825 1.846 1.00 0.00 C ATOM 974 O PHE A 64 -4.205 11.964 0.990 1.00 0.00 O ATOM 975 CB PHE A 64 -1.242 10.540 1.350 1.00 0.00 C ATOM 976 CG PHE A 64 -0.297 9.478 1.835 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.509 8.147 1.515 1.00 0.00 C ATOM 978 CD2 PHE A 64 0.801 9.810 2.612 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.355 7.167 1.960 1.00 0.00 C ATOM 980 CE2 PHE A 64 1.670 8.834 3.061 1.00 0.00 C ATOM 981 CZ PHE A 64 1.446 7.511 2.734 1.00 0.00 C ATOM 0 H PHE A 64 -3.717 9.542 0.504 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.487 10.300 3.087 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.368 10.438 0.272 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.797 11.519 1.527 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.361 7.873 0.910 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.980 10.843 2.870 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.178 6.133 1.703 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.522 9.105 3.666 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.124 6.746 3.083 1.00 0.00 H new ATOM 991 N THR A 65 -2.949 12.805 2.659 1.00 0.00 N ATOM 992 CA THR A 65 -3.547 14.135 2.592 1.00 0.00 C ATOM 993 C THR A 65 -2.495 15.214 2.841 1.00 0.00 C ATOM 994 O THR A 65 -1.750 15.154 3.821 1.00 0.00 O ATOM 995 CB THR A 65 -4.695 14.261 3.602 1.00 0.00 C ATOM 996 OG1 THR A 65 -5.169 15.595 3.662 1.00 0.00 O ATOM 997 CG2 THR A 65 -4.318 13.847 5.009 1.00 0.00 C ATOM 0 H THR A 65 -2.227 12.703 3.373 1.00 0.00 H new ATOM 0 HA THR A 65 -3.952 14.277 1.590 1.00 0.00 H new ATOM 0 HB THR A 65 -5.465 13.580 3.238 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.902 15.653 4.310 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.180 13.963 5.666 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.000 12.804 5.009 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.502 14.475 5.367 1.00 0.00 H new ATOM 1122 N SER A 74 -6.146 15.473 -1.094 1.00 0.00 N ATOM 1123 CA SER A 74 -6.129 14.026 -0.898 1.00 0.00 C ATOM 1124 C SER A 74 -5.319 13.340 -1.996 1.00 0.00 C ATOM 1125 O SER A 74 -5.326 13.775 -3.150 1.00 0.00 O ATOM 1126 CB SER A 74 -7.556 13.473 -0.877 1.00 0.00 C ATOM 1127 OG SER A 74 -7.562 12.078 -0.618 1.00 0.00 O ATOM 0 HA SER A 74 -5.656 13.820 0.062 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.138 13.990 -0.114 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.039 13.670 -1.834 1.00 0.00 H new ATOM 0 HG SER A 74 -8.486 11.751 -0.608 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.620 12.268 -1.628 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.801 11.521 -2.577 1.00 0.00 C ATOM 1135 C LYS A 75 -3.849 10.022 -2.288 1.00 0.00 C ATOM 1136 O LYS A 75 -4.141 9.605 -1.166 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.354 12.017 -2.529 1.00 0.00 C ATOM 1138 CG LYS A 75 -2.091 13.211 -3.431 1.00 0.00 C ATOM 1139 CD LYS A 75 -0.701 13.779 -3.210 1.00 0.00 C ATOM 1140 CE LYS A 75 -0.272 14.670 -4.364 1.00 0.00 C ATOM 1141 NZ LYS A 75 1.193 14.581 -4.622 1.00 0.00 N ATOM 0 H LYS A 75 -4.605 11.898 -0.678 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.205 11.688 -3.575 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.104 12.286 -1.502 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.689 11.202 -2.816 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.202 12.912 -4.473 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.836 13.984 -3.240 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.684 14.351 -2.282 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.012 12.963 -3.095 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.817 14.385 -5.264 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.539 15.703 -4.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.444 15.204 -5.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.714 14.877 -3.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.445 13.600 -4.858 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.560 9.220 -3.309 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.566 7.765 -3.175 1.00 0.00 C ATOM 1157 C PHE A 76 -2.142 7.216 -3.187 1.00 0.00 C ATOM 1158 O PHE A 76 -1.260 7.769 -3.847 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.378 7.129 -4.307 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.867 7.219 -4.115 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.484 8.444 -3.912 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.649 6.077 -4.141 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -7.851 8.526 -3.737 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -8.017 6.153 -3.966 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.619 7.379 -3.764 1.00 0.00 C ATOM 0 H PHE A 76 -3.318 9.554 -4.242 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.029 7.514 -2.221 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.113 7.613 -5.247 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.096 6.080 -4.398 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.888 9.345 -3.891 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.184 5.115 -4.300 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.319 9.486 -3.579 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.615 5.254 -3.987 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.689 7.441 -3.627 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.922 6.124 -2.456 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.603 5.504 -2.386 1.00 0.00 C ATOM 1177 C ALA A 77 -0.706 3.991 -2.219 1.00 0.00 C ATOM 1178 O ALA A 77 -1.203 3.502 -1.201 1.00 0.00 O ATOM 1179 CB ALA A 77 0.208 6.107 -1.248 1.00 0.00 C ATOM 0 H ALA A 77 -2.640 5.652 -1.906 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.092 5.703 -3.328 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.189 5.634 -1.210 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.328 7.178 -1.414 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.311 5.942 -0.304 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.225 3.255 -3.220 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.250 1.798 -3.182 1.00 0.00 C ATOM 1187 C LEU A 78 1.072 1.263 -2.641 1.00 0.00 C ATOM 1188 O LEU A 78 2.097 1.303 -3.327 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.519 1.229 -4.578 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.940 -0.241 -4.609 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -1.972 -0.481 -5.702 1.00 0.00 C ATOM 1192 CD2 LEU A 78 0.272 -1.139 -4.813 1.00 0.00 C ATOM 0 H LEU A 78 0.187 3.647 -4.067 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.056 1.483 -2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.299 1.824 -5.052 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.382 1.346 -5.181 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.394 -0.487 -3.649 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.258 -1.533 -5.707 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.852 0.134 -5.513 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.546 -0.216 -6.670 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.047 -2.181 -4.832 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.755 -0.889 -5.758 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.977 -0.990 -3.995 1.00 0.00 H new ATOM 1204 N ILE A 79 1.045 0.775 -1.403 1.00 0.00 N ATOM 1205 CA ILE A 79 2.243 0.244 -0.761 1.00 0.00 C ATOM 1206 C ILE A 79 2.341 -1.268 -0.936 1.00 0.00 C ATOM 1207 O ILE A 79 1.456 -2.013 -0.515 1.00 0.00 O ATOM 1208 CB ILE A 79 2.277 0.584 0.748 1.00 0.00 C ATOM 1209 CG1 ILE A 79 1.984 2.073 0.971 1.00 0.00 C ATOM 1210 CG2 ILE A 79 3.623 0.207 1.352 1.00 0.00 C ATOM 1211 CD1 ILE A 79 2.927 3.000 0.232 1.00 0.00 C ATOM 0 H ILE A 79 0.206 0.737 -0.825 1.00 0.00 H new ATOM 0 HA ILE A 79 3.095 0.717 -1.249 1.00 0.00 H new ATOM 0 HB ILE A 79 1.502 0.003 1.248 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.962 2.284 0.656 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.040 2.289 2.038 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.627 0.454 2.414 1.00 0.00 H new ATOM 0 HG22 ILE A 79 3.791 -0.863 1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.416 0.760 0.848 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.656 4.035 0.439 1.00 0.00 H new ATOM 0 HD12 ILE A 79 3.949 2.819 0.564 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.855 2.814 -0.840 1.00 0.00 H new ATOM 1223 N THR A 80 3.431 -1.713 -1.555 1.00 0.00 N ATOM 1224 CA THR A 80 3.662 -3.136 -1.785 1.00 0.00 C ATOM 1225 C THR A 80 4.754 -3.651 -0.853 1.00 0.00 C ATOM 1226 O THR A 80 5.867 -3.126 -0.845 1.00 0.00 O ATOM 1227 CB THR A 80 4.055 -3.401 -3.245 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.959 -2.222 -4.029 1.00 0.00 O ATOM 1229 CG2 THR A 80 3.206 -4.465 -3.908 1.00 0.00 C ATOM 0 H THR A 80 4.171 -1.106 -1.908 1.00 0.00 H new ATOM 0 HA THR A 80 2.733 -3.666 -1.577 1.00 0.00 H new ATOM 0 HB THR A 80 5.086 -3.752 -3.199 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.217 -2.422 -4.953 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.535 -4.604 -4.938 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.309 -5.404 -3.364 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.161 -4.154 -3.900 1.00 0.00 H new ATOM 1237 N TRP A 81 4.435 -4.678 -0.070 1.00 0.00 N ATOM 1238 CA TRP A 81 5.402 -5.253 0.859 1.00 0.00 C ATOM 1239 C TRP A 81 5.915 -6.597 0.353 1.00 0.00 C ATOM 1240 O TRP A 81 5.139 -7.434 -0.111 1.00 0.00 O ATOM 1241 CB TRP A 81 4.781 -5.424 2.249 1.00 0.00 C ATOM 1242 CG TRP A 81 5.704 -6.084 3.230 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.451 -7.199 3.976 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.035 -5.670 3.565 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.541 -7.501 4.756 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.527 -6.579 4.520 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.858 -4.620 3.147 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.804 -6.468 5.066 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 9.125 -4.511 3.688 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.588 -5.431 4.637 1.00 0.00 C ATOM 0 H TRP A 81 3.519 -5.127 -0.060 1.00 0.00 H new ATOM 0 HA TRP A 81 6.244 -4.564 0.929 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.491 -4.446 2.633 1.00 0.00 H new ATOM 0 HB3 TRP A 81 3.869 -6.015 2.163 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.529 -7.761 3.956 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.606 -8.285 5.406 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.510 -3.907 2.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.162 -7.174 5.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.769 -3.703 3.374 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.584 -5.320 5.039 1.00 0.00 H new ATOM 1261 N ILE A 82 7.226 -6.797 0.454 1.00 0.00 N ATOM 1262 CA ILE A 82 7.849 -8.039 0.016 1.00 0.00 C ATOM 1263 C ILE A 82 8.899 -8.498 1.027 1.00 0.00 C ATOM 1264 O ILE A 82 10.058 -8.084 0.966 1.00 0.00 O ATOM 1265 CB ILE A 82 8.502 -7.893 -1.376 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.520 -7.262 -2.370 1.00 0.00 C ATOM 1267 CG2 ILE A 82 8.975 -9.248 -1.884 1.00 0.00 C ATOM 1268 CD1 ILE A 82 8.113 -7.025 -3.742 1.00 0.00 C ATOM 0 H ILE A 82 7.878 -6.112 0.837 1.00 0.00 H new ATOM 0 HA ILE A 82 7.060 -8.787 -0.055 1.00 0.00 H new ATOM 0 HB ILE A 82 9.366 -7.235 -1.283 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.649 -7.909 -2.467 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.168 -6.312 -1.967 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.433 -9.129 -2.866 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.707 -9.661 -1.190 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.124 -9.925 -1.960 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.361 -6.577 -4.391 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.967 -6.353 -3.658 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.439 -7.975 -4.166 1.00 0.00 H new ATOM 1280 N GLY A 83 8.479 -9.354 1.957 1.00 0.00 N ATOM 1281 CA GLY A 83 9.385 -9.859 2.976 1.00 0.00 C ATOM 1282 C GLY A 83 10.505 -10.701 2.394 1.00 0.00 C ATOM 1283 O GLY A 83 10.254 -11.787 1.868 1.00 0.00 O ATOM 0 H GLY A 83 7.524 -9.707 2.023 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.813 -9.020 3.524 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.822 -10.455 3.694 1.00 0.00 H new ATOM 1287 N GLU A 84 11.732 -10.168 2.487 1.00 0.00 N ATOM 1288 CA GLU A 84 12.953 -10.806 1.967 1.00 0.00 C ATOM 1289 C GLU A 84 12.871 -12.322 1.845 1.00 0.00 C ATOM 1290 O GLU A 84 13.325 -12.882 0.845 1.00 0.00 O ATOM 1291 CB GLU A 84 14.140 -10.477 2.854 1.00 0.00 C ATOM 1292 CG GLU A 84 14.560 -9.015 2.815 1.00 0.00 C ATOM 1293 CD GLU A 84 14.762 -8.435 4.202 1.00 0.00 C ATOM 1294 OE1 GLU A 84 15.715 -8.858 4.889 1.00 0.00 O ATOM 1295 OE2 GLU A 84 13.963 -7.563 4.604 1.00 0.00 O ATOM 0 H GLU A 84 11.908 -9.267 2.932 1.00 0.00 H new ATOM 0 HA GLU A 84 13.071 -10.401 0.962 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.897 -10.747 3.882 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.986 -11.095 2.554 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.485 -8.920 2.246 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.801 -8.436 2.289 1.00 0.00 H new ATOM 1302 N ASN A 85 12.316 -12.993 2.855 1.00 0.00 N ATOM 1303 CA ASN A 85 12.212 -14.453 2.835 1.00 0.00 C ATOM 1304 C ASN A 85 11.157 -14.931 1.836 1.00 0.00 C ATOM 1305 O ASN A 85 10.375 -15.842 2.121 1.00 0.00 O ATOM 1306 CB ASN A 85 11.906 -14.981 4.235 1.00 0.00 C ATOM 1307 CG ASN A 85 13.159 -15.120 5.067 1.00 0.00 C ATOM 1308 OD1 ASN A 85 13.571 -16.226 5.412 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.770 -13.989 5.398 1.00 0.00 N ATOM 0 H ASN A 85 11.934 -12.553 3.692 1.00 0.00 H new ATOM 0 HA ASN A 85 13.173 -14.851 2.510 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.211 -14.306 4.734 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.411 -15.949 4.158 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.619 -14.014 5.962 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.390 -13.095 5.088 1.00 0.00 H new ATOM 1316 N VAL A 86 11.157 -14.317 0.659 1.00 0.00 N ATOM 1317 CA VAL A 86 10.221 -14.675 -0.403 1.00 0.00 C ATOM 1318 C VAL A 86 10.641 -15.982 -1.071 1.00 0.00 C ATOM 1319 O VAL A 86 11.779 -16.120 -1.523 1.00 0.00 O ATOM 1320 CB VAL A 86 10.126 -13.579 -1.488 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.948 -13.843 -2.410 1.00 0.00 C ATOM 1322 CG2 VAL A 86 10.016 -12.197 -0.865 1.00 0.00 C ATOM 0 H VAL A 86 11.799 -13.563 0.414 1.00 0.00 H new ATOM 0 HA VAL A 86 9.245 -14.787 0.068 1.00 0.00 H new ATOM 0 HB VAL A 86 11.043 -13.609 -2.077 1.00 0.00 H new ATOM 0 HG11 VAL A 86 8.897 -13.061 -3.168 1.00 0.00 H new ATOM 0 HG12 VAL A 86 9.075 -14.811 -2.895 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.025 -13.847 -1.830 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.951 -11.447 -1.653 1.00 0.00 H new ATOM 0 HG22 VAL A 86 9.122 -12.148 -0.243 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.896 -12.003 -0.252 1.00 0.00 H new ATOM 1332 N SER A 87 9.713 -16.934 -1.139 1.00 0.00 N ATOM 1333 CA SER A 87 9.986 -18.226 -1.763 1.00 0.00 C ATOM 1334 C SER A 87 10.058 -18.095 -3.285 1.00 0.00 C ATOM 1335 O SER A 87 9.613 -17.096 -3.855 1.00 0.00 O ATOM 1336 CB SER A 87 8.916 -19.253 -1.371 1.00 0.00 C ATOM 1337 OG SER A 87 7.632 -18.658 -1.295 1.00 0.00 O ATOM 0 H SER A 87 8.767 -16.835 -0.770 1.00 0.00 H new ATOM 0 HA SER A 87 10.954 -18.574 -1.402 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.901 -20.062 -2.101 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.171 -19.697 -0.409 1.00 0.00 H new ATOM 0 HG SER A 87 6.971 -19.337 -1.045 1.00 0.00 H new ATOM 1343 N GLY A 88 10.625 -19.113 -3.937 1.00 0.00 N ATOM 1344 CA GLY A 88 10.754 -19.102 -5.386 1.00 0.00 C ATOM 1345 C GLY A 88 9.446 -18.793 -6.099 1.00 0.00 C ATOM 1346 O GLY A 88 9.440 -18.087 -7.109 1.00 0.00 O ATOM 0 H GLY A 88 10.998 -19.947 -3.484 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.501 -18.362 -5.673 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.122 -20.072 -5.719 1.00 0.00 H new ATOM 1350 N LEU A 89 8.340 -19.327 -5.579 1.00 0.00 N ATOM 1351 CA LEU A 89 7.022 -19.110 -6.176 1.00 0.00 C ATOM 1352 C LEU A 89 6.420 -17.767 -5.756 1.00 0.00 C ATOM 1353 O LEU A 89 5.808 -17.076 -6.572 1.00 0.00 O ATOM 1354 CB LEU A 89 6.073 -20.249 -5.793 1.00 0.00 C ATOM 1355 CG LEU A 89 5.872 -21.319 -6.869 1.00 0.00 C ATOM 1356 CD1 LEU A 89 7.127 -22.165 -7.027 1.00 0.00 C ATOM 1357 CD2 LEU A 89 4.679 -22.197 -6.526 1.00 0.00 C ATOM 0 H LEU A 89 8.331 -19.914 -4.745 1.00 0.00 H new ATOM 0 HA LEU A 89 7.152 -19.093 -7.258 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.453 -20.730 -4.892 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.102 -19.822 -5.541 1.00 0.00 H new ATOM 0 HG LEU A 89 5.675 -20.819 -7.818 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.963 -22.919 -7.797 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.962 -21.527 -7.317 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.357 -22.656 -6.081 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.549 -22.953 -7.300 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.851 -22.686 -5.567 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.781 -21.583 -6.464 1.00 0.00 H new ATOM 1369 N GLN A 90 6.588 -17.405 -4.479 1.00 0.00 N ATOM 1370 CA GLN A 90 6.050 -16.143 -3.960 1.00 0.00 C ATOM 1371 C GLN A 90 6.592 -14.942 -4.737 1.00 0.00 C ATOM 1372 O GLN A 90 5.865 -13.977 -4.982 1.00 0.00 O ATOM 1373 CB GLN A 90 6.371 -15.993 -2.468 1.00 0.00 C ATOM 1374 CG GLN A 90 5.162 -16.181 -1.562 1.00 0.00 C ATOM 1375 CD GLN A 90 4.669 -17.617 -1.526 1.00 0.00 C ATOM 1376 OE1 GLN A 90 4.292 -18.181 -2.553 1.00 0.00 O ATOM 1377 NE2 GLN A 90 4.658 -18.214 -0.338 1.00 0.00 N ATOM 0 H GLN A 90 7.089 -17.965 -3.789 1.00 0.00 H new ATOM 0 HA GLN A 90 4.968 -16.169 -4.089 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.136 -16.720 -2.195 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.795 -15.004 -2.294 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.419 -15.865 -0.551 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.354 -15.533 -1.903 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.979 -17.710 0.489 1.00 0.00 H new ATOM 0 HE22 GLN A 90 4.328 -19.176 -0.253 1.00 0.00 H new ATOM 1386 N ARG A 91 7.867 -15.011 -5.130 1.00 0.00 N ATOM 1387 CA ARG A 91 8.500 -13.931 -5.889 1.00 0.00 C ATOM 1388 C ARG A 91 7.756 -13.688 -7.203 1.00 0.00 C ATOM 1389 O ARG A 91 7.539 -12.541 -7.598 1.00 0.00 O ATOM 1390 CB ARG A 91 9.970 -14.269 -6.165 1.00 0.00 C ATOM 1391 CG ARG A 91 10.730 -13.171 -6.896 1.00 0.00 C ATOM 1392 CD ARG A 91 12.026 -12.813 -6.182 1.00 0.00 C ATOM 1393 NE ARG A 91 13.173 -12.806 -7.090 1.00 0.00 N ATOM 1394 CZ ARG A 91 13.848 -13.898 -7.460 1.00 0.00 C ATOM 1395 NH1 ARG A 91 13.483 -15.099 -7.019 1.00 0.00 N ATOM 1396 NH2 ARG A 91 14.887 -13.788 -8.281 1.00 0.00 N ATOM 0 H ARG A 91 8.480 -15.803 -4.935 1.00 0.00 H new ATOM 0 HA ARG A 91 8.455 -13.018 -5.295 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.469 -14.474 -5.218 1.00 0.00 H new ATOM 0 HB3 ARG A 91 10.017 -15.184 -6.755 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.952 -13.497 -7.912 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.101 -12.284 -6.976 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.925 -11.831 -5.719 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.205 -13.527 -5.378 1.00 0.00 H new ATOM 0 HE ARG A 91 13.478 -11.908 -7.466 1.00 0.00 H new ATOM 0 HH11 ARG A 91 12.682 -15.191 -6.394 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.004 -15.928 -7.306 1.00 0.00 H new ATOM 0 HH21 ARG A 91 15.168 -12.871 -8.628 1.00 0.00 H new ATOM 0 HH22 ARG A 91 15.403 -14.621 -8.564 1.00 0.00 H new ATOM 1410 N ALA A 92 7.355 -14.775 -7.866 1.00 0.00 N ATOM 1411 CA ALA A 92 6.619 -14.683 -9.124 1.00 0.00 C ATOM 1412 C ALA A 92 5.214 -14.131 -8.890 1.00 0.00 C ATOM 1413 O ALA A 92 4.708 -13.343 -9.692 1.00 0.00 O ATOM 1414 CB ALA A 92 6.548 -16.045 -9.799 1.00 0.00 C ATOM 0 H ALA A 92 7.529 -15.729 -7.550 1.00 0.00 H new ATOM 0 HA ALA A 92 7.152 -13.996 -9.782 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.996 -15.959 -10.735 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.557 -16.402 -10.004 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.040 -16.751 -9.142 1.00 0.00 H new ATOM 1420 N LYS A 93 4.596 -14.549 -7.781 1.00 0.00 N ATOM 1421 CA LYS A 93 3.250 -14.100 -7.423 1.00 0.00 C ATOM 1422 C LYS A 93 3.158 -12.574 -7.422 1.00 0.00 C ATOM 1423 O LYS A 93 2.171 -12.008 -7.891 1.00 0.00 O ATOM 1424 CB LYS A 93 2.856 -14.648 -6.046 1.00 0.00 C ATOM 1425 CG LYS A 93 1.790 -15.732 -6.101 1.00 0.00 C ATOM 1426 CD LYS A 93 1.754 -16.552 -4.820 1.00 0.00 C ATOM 1427 CE LYS A 93 1.315 -17.985 -5.085 1.00 0.00 C ATOM 1428 NZ LYS A 93 -0.126 -18.068 -5.459 1.00 0.00 N ATOM 0 H LYS A 93 5.010 -15.200 -7.114 1.00 0.00 H new ATOM 0 HA LYS A 93 2.558 -14.483 -8.173 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.744 -15.048 -5.557 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.494 -13.826 -5.428 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.815 -15.275 -6.268 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.983 -16.390 -6.949 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.742 -16.553 -4.360 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.071 -16.087 -4.109 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.922 -18.408 -5.885 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.494 -18.589 -4.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.501 -19.001 -5.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.657 -17.326 -4.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -0.226 -17.935 -6.486 1.00 0.00 H new ATOM 1442 N THR A 94 4.192 -11.915 -6.893 1.00 0.00 N ATOM 1443 CA THR A 94 4.230 -10.452 -6.830 1.00 0.00 C ATOM 1444 C THR A 94 3.966 -9.828 -8.201 1.00 0.00 C ATOM 1445 O THR A 94 3.171 -8.894 -8.319 1.00 0.00 O ATOM 1446 CB THR A 94 5.584 -9.974 -6.292 1.00 0.00 C ATOM 1447 OG1 THR A 94 6.049 -10.828 -5.259 1.00 0.00 O ATOM 1448 CG2 THR A 94 5.547 -8.565 -5.738 1.00 0.00 C ATOM 0 H THR A 94 5.015 -12.372 -6.502 1.00 0.00 H new ATOM 0 HA THR A 94 3.440 -10.130 -6.151 1.00 0.00 H new ATOM 0 HB THR A 94 6.254 -9.993 -7.151 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.915 -10.505 -4.932 1.00 0.00 H new ATOM 0 HG21 THR A 94 6.537 -8.291 -5.375 1.00 0.00 H new ATOM 0 HG22 THR A 94 5.244 -7.873 -6.524 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.833 -8.516 -4.916 1.00 0.00 H new ATOM 1456 N GLY A 95 4.638 -10.346 -9.230 1.00 0.00 N ATOM 1457 CA GLY A 95 4.461 -9.823 -10.575 1.00 0.00 C ATOM 1458 C GLY A 95 3.063 -10.058 -11.122 1.00 0.00 C ATOM 1459 O GLY A 95 2.443 -9.135 -11.657 1.00 0.00 O ATOM 0 H GLY A 95 5.301 -11.118 -9.155 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.670 -8.753 -10.574 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.189 -10.289 -11.239 1.00 0.00 H new ATOM 1463 N THR A 96 2.560 -11.289 -10.992 1.00 0.00 N ATOM 1464 CA THR A 96 1.225 -11.623 -11.484 1.00 0.00 C ATOM 1465 C THR A 96 0.153 -10.826 -10.743 1.00 0.00 C ATOM 1466 O THR A 96 -0.762 -10.279 -11.361 1.00 0.00 O ATOM 1467 CB THR A 96 0.946 -13.124 -11.344 1.00 0.00 C ATOM 1468 OG1 THR A 96 1.629 -13.671 -10.229 1.00 0.00 O ATOM 1469 CG2 THR A 96 1.347 -13.924 -12.567 1.00 0.00 C ATOM 0 H THR A 96 3.055 -12.065 -10.553 1.00 0.00 H new ATOM 0 HA THR A 96 1.191 -11.358 -12.541 1.00 0.00 H new ATOM 0 HB THR A 96 -0.134 -13.200 -11.214 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.590 -13.040 -9.480 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.123 -14.978 -12.402 1.00 0.00 H new ATOM 0 HG22 THR A 96 0.792 -13.566 -13.434 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.415 -13.804 -12.746 1.00 0.00 H new ATOM 1477 N ASP A 97 0.271 -10.764 -9.416 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.689 -10.033 -8.593 1.00 0.00 C ATOM 1479 C ASP A 97 -0.651 -8.536 -8.893 1.00 0.00 C ATOM 1480 O ASP A 97 -1.695 -7.883 -8.939 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.421 -10.281 -7.105 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.664 -11.724 -6.696 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -1.597 -12.349 -7.244 1.00 0.00 O ATOM 1484 OD2 ASP A 97 0.077 -12.227 -5.824 1.00 0.00 O ATOM 0 H ASP A 97 1.022 -11.211 -8.890 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.685 -10.402 -8.838 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.610 -10.012 -6.876 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.060 -9.627 -6.511 1.00 0.00 H new ATOM 1489 N LYS A 98 0.553 -7.999 -9.109 1.00 0.00 N ATOM 1490 CA LYS A 98 0.718 -6.579 -9.419 1.00 0.00 C ATOM 1491 C LYS A 98 -0.088 -6.198 -10.662 1.00 0.00 C ATOM 1492 O LYS A 98 -0.607 -5.084 -10.757 1.00 0.00 O ATOM 1493 CB LYS A 98 2.200 -6.249 -9.634 1.00 0.00 C ATOM 1494 CG LYS A 98 2.493 -4.757 -9.704 1.00 0.00 C ATOM 1495 CD LYS A 98 3.815 -4.412 -9.034 1.00 0.00 C ATOM 1496 CE LYS A 98 3.814 -2.991 -8.485 1.00 0.00 C ATOM 1497 NZ LYS A 98 5.131 -2.315 -8.670 1.00 0.00 N ATOM 0 H LYS A 98 1.425 -8.526 -9.075 1.00 0.00 H new ATOM 0 HA LYS A 98 0.345 -6.001 -8.573 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.781 -6.686 -8.822 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.537 -6.720 -10.557 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.519 -4.440 -10.746 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.686 -4.204 -9.223 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.007 -5.115 -8.224 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.627 -4.524 -9.752 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.037 -2.411 -8.983 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.565 -3.013 -7.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.147 -1.430 -8.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.892 -2.941 -8.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.273 -2.102 -9.678 1.00 0.00 H new ATOM 1511 N THR A 99 -0.196 -7.137 -11.604 1.00 0.00 N ATOM 1512 CA THR A 99 -0.946 -6.913 -12.837 1.00 0.00 C ATOM 1513 C THR A 99 -2.447 -6.877 -12.553 1.00 0.00 C ATOM 1514 O THR A 99 -3.146 -5.962 -12.990 1.00 0.00 O ATOM 1515 CB THR A 99 -0.623 -8.013 -13.855 1.00 0.00 C ATOM 1516 OG1 THR A 99 0.778 -8.129 -14.044 1.00 0.00 O ATOM 1517 CG2 THR A 99 -1.250 -7.785 -15.216 1.00 0.00 C ATOM 0 H THR A 99 0.229 -8.062 -11.534 1.00 0.00 H new ATOM 0 HA THR A 99 -0.652 -5.949 -13.253 1.00 0.00 H new ATOM 0 HB THR A 99 -1.044 -8.924 -13.430 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.188 -8.500 -13.235 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.978 -8.603 -15.883 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.335 -7.745 -15.115 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.889 -6.843 -15.630 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.930 -7.874 -11.809 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.343 -7.959 -11.455 1.00 0.00 C ATOM 1527 C LEU A 100 -4.808 -6.689 -10.746 1.00 0.00 C ATOM 1528 O LEU A 100 -5.805 -6.080 -11.138 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.587 -9.176 -10.559 1.00 0.00 C ATOM 1530 CG LEU A 100 -4.120 -10.517 -11.135 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -4.213 -11.614 -10.084 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -4.939 -10.886 -12.362 1.00 0.00 C ATOM 0 H LEU A 100 -2.359 -8.635 -11.440 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.918 -8.067 -12.375 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.082 -9.013 -9.607 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.654 -9.242 -10.347 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.077 -10.415 -11.434 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.877 -12.558 -10.513 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.582 -11.357 -9.233 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.247 -11.714 -9.752 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.593 -11.841 -12.757 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.991 -10.967 -12.087 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.822 -10.115 -13.123 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.074 -6.293 -9.704 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.403 -5.090 -8.937 1.00 0.00 C ATOM 1546 C VAL A 101 -4.362 -3.843 -9.822 1.00 0.00 C ATOM 1547 O VAL A 101 -5.210 -2.957 -9.692 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.442 -4.900 -7.741 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -3.854 -3.702 -6.898 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.387 -6.158 -6.885 1.00 0.00 C ATOM 0 H VAL A 101 -3.247 -6.789 -9.372 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.415 -5.225 -8.556 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.445 -4.712 -8.140 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.162 -3.590 -6.063 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.832 -2.801 -7.511 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.863 -3.856 -6.515 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.705 -6.000 -6.050 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.383 -6.382 -6.503 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.034 -6.994 -7.489 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.377 -3.784 -10.724 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.228 -2.648 -11.636 1.00 0.00 C ATOM 1562 C LYS A 102 -4.515 -2.407 -12.426 1.00 0.00 C ATOM 1563 O LYS A 102 -4.931 -1.264 -12.613 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.064 -2.887 -12.603 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.640 -1.643 -13.371 1.00 0.00 C ATOM 1566 CD LYS A 102 -0.565 -1.962 -14.401 1.00 0.00 C ATOM 1567 CE LYS A 102 0.828 -1.676 -13.864 1.00 0.00 C ATOM 1568 NZ LYS A 102 1.136 -0.217 -13.855 1.00 0.00 N ATOM 0 H LYS A 102 -2.671 -4.511 -10.841 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.018 -1.763 -11.036 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.209 -3.266 -12.042 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.348 -3.663 -13.314 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.507 -1.210 -13.870 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.266 -0.893 -12.674 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.636 -3.011 -14.689 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.737 -1.372 -15.301 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.914 -2.071 -12.852 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.566 -2.198 -14.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.113 -0.070 -13.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 1.030 0.166 -14.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.480 0.272 -13.213 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.137 -3.492 -12.886 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.375 -3.397 -13.654 1.00 0.00 C ATOM 1584 C GLU A 103 -7.556 -3.017 -12.757 1.00 0.00 C ATOM 1585 O GLU A 103 -8.469 -2.312 -13.190 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.659 -4.724 -14.364 1.00 0.00 C ATOM 1587 CG GLU A 103 -5.962 -4.853 -15.709 1.00 0.00 C ATOM 1588 CD GLU A 103 -4.625 -5.563 -15.612 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -4.619 -6.807 -15.499 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -3.583 -4.875 -15.652 1.00 0.00 O ATOM 0 H GLU A 103 -4.804 -4.445 -12.740 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.250 -2.612 -14.399 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.345 -5.546 -13.721 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.734 -4.826 -14.510 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -6.608 -5.397 -16.397 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -5.811 -3.860 -16.132 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.531 -3.492 -11.510 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.600 -3.207 -10.552 1.00 0.00 C ATOM 1599 C VAL A 104 -8.625 -1.727 -10.162 1.00 0.00 C ATOM 1600 O VAL A 104 -9.688 -1.104 -10.150 1.00 0.00 O ATOM 1601 CB VAL A 104 -8.460 -4.064 -9.275 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -9.654 -3.865 -8.350 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -8.298 -5.537 -9.630 1.00 0.00 C ATOM 0 H VAL A 104 -6.781 -4.076 -11.140 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.537 -3.460 -11.049 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.564 -3.736 -8.747 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.530 -4.480 -7.459 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.720 -2.816 -8.061 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.568 -4.157 -8.868 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.201 -6.123 -8.716 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.172 -5.875 -10.187 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.405 -5.668 -10.241 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.455 -1.172 -9.839 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.356 0.231 -9.443 1.00 0.00 C ATOM 1615 C VAL A 105 -6.719 1.075 -10.544 1.00 0.00 C ATOM 1616 O VAL A 105 -5.546 0.897 -10.877 1.00 0.00 O ATOM 1617 CB VAL A 105 -6.544 0.401 -8.142 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -6.589 1.845 -7.664 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -7.058 -0.539 -7.061 1.00 0.00 C ATOM 0 H VAL A 105 -6.566 -1.672 -9.844 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.375 0.577 -9.270 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.506 0.144 -8.353 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -6.010 1.942 -6.746 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.166 2.495 -8.430 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -7.623 2.133 -7.474 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -6.472 -0.403 -6.152 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.105 -0.318 -6.854 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -6.966 -1.570 -7.402 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.503 1.998 -11.098 1.00 0.00 N ATOM 1630 CA GLN A 106 -7.029 2.882 -12.160 1.00 0.00 C ATOM 1631 C GLN A 106 -6.823 4.308 -11.645 1.00 0.00 C ATOM 1632 O GLN A 106 -5.979 5.044 -12.160 1.00 0.00 O ATOM 1633 CB GLN A 106 -8.021 2.888 -13.326 1.00 0.00 C ATOM 1634 CG GLN A 106 -7.591 2.020 -14.497 1.00 0.00 C ATOM 1635 CD GLN A 106 -8.761 1.579 -15.357 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -9.145 2.269 -16.301 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -9.336 0.425 -15.033 1.00 0.00 N ATOM 0 H GLN A 106 -8.474 2.153 -10.827 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.068 2.503 -12.506 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -8.992 2.545 -12.968 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -8.154 3.913 -13.674 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -6.880 2.572 -15.112 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -7.070 1.140 -14.120 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -8.985 -0.115 -14.242 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -10.128 0.080 -15.575 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.600 4.696 -10.630 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.501 6.034 -10.052 1.00 0.00 C ATOM 1648 C ASN A 107 -6.560 6.043 -8.848 1.00 0.00 C ATOM 1649 O ASN A 107 -6.995 5.869 -7.706 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.886 6.546 -9.641 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.731 6.960 -10.832 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.562 8.051 -11.375 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -10.647 6.091 -11.244 1.00 0.00 N ATOM 0 H ASN A 107 -8.304 4.101 -10.193 1.00 0.00 H new ATOM 0 HA ASN A 107 -7.091 6.698 -10.813 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.407 5.767 -9.084 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.770 7.396 -8.969 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.244 6.318 -12.040 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.754 5.197 -10.765 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.271 6.249 -9.110 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.264 6.285 -8.050 1.00 0.00 C ATOM 1662 C PHE A 108 -3.214 7.360 -8.333 1.00 0.00 C ATOM 1663 O PHE A 108 -3.162 7.913 -9.433 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.593 4.913 -7.897 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.969 4.391 -9.163 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.771 4.911 -9.626 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.580 3.379 -9.886 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -1.194 4.431 -10.787 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -3.007 2.895 -11.047 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.813 3.423 -11.497 1.00 0.00 C ATOM 0 H PHE A 108 -4.898 6.394 -10.048 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.766 6.534 -7.115 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.825 4.980 -7.127 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.334 4.195 -7.547 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.283 5.700 -9.074 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.514 2.964 -9.538 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.260 4.845 -11.138 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.492 2.105 -11.601 1.00 0.00 H new ATOM 0 HZ PHE A 108 -1.364 3.047 -12.404 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.377 7.651 -7.335 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.331 8.660 -7.484 1.00 0.00 C ATOM 1682 C ALA A 109 0.032 8.019 -7.730 1.00 0.00 C ATOM 1683 O ALA A 109 0.713 8.350 -8.701 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.278 9.561 -6.258 1.00 0.00 C ATOM 0 H ALA A 109 -2.404 7.203 -6.419 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.579 9.266 -8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.493 10.306 -6.388 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.238 10.063 -6.134 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.065 8.960 -5.374 1.00 0.00 H new ATOM 1690 N LYS A 110 0.431 7.105 -6.844 1.00 0.00 N ATOM 1691 CA LYS A 110 1.720 6.430 -6.973 1.00 0.00 C ATOM 1692 C LYS A 110 1.680 5.022 -6.379 1.00 0.00 C ATOM 1693 O LYS A 110 0.969 4.766 -5.404 1.00 0.00 O ATOM 1694 CB LYS A 110 2.817 7.251 -6.292 1.00 0.00 C ATOM 1695 CG LYS A 110 4.125 7.275 -7.064 1.00 0.00 C ATOM 1696 CD LYS A 110 5.323 7.270 -6.128 1.00 0.00 C ATOM 1697 CE LYS A 110 6.623 7.491 -6.887 1.00 0.00 C ATOM 1698 NZ LYS A 110 7.673 8.112 -6.031 1.00 0.00 N ATOM 0 H LYS A 110 -0.118 6.817 -6.034 1.00 0.00 H new ATOM 0 HA LYS A 110 1.941 6.340 -8.037 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.464 8.274 -6.159 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.999 6.845 -5.297 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.175 6.410 -7.725 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.159 8.162 -7.697 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.202 8.050 -5.376 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.367 6.319 -5.597 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.985 6.537 -7.270 1.00 0.00 H new ATOM 0 HE3 LYS A 110 6.435 8.130 -7.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.371 8.594 -6.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.234 8.802 -5.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.148 7.374 -5.473 1.00 0.00 H new ATOM 1712 N GLU A 111 2.454 4.119 -6.979 1.00 0.00 N ATOM 1713 CA GLU A 111 2.527 2.731 -6.529 1.00 0.00 C ATOM 1714 C GLU A 111 3.952 2.196 -6.664 1.00 0.00 C ATOM 1715 O GLU A 111 4.506 2.163 -7.765 1.00 0.00 O ATOM 1716 CB GLU A 111 1.563 1.857 -7.338 1.00 0.00 C ATOM 1717 CG GLU A 111 1.556 2.168 -8.830 1.00 0.00 C ATOM 1718 CD GLU A 111 0.712 1.194 -9.630 1.00 0.00 C ATOM 1719 OE1 GLU A 111 -0.509 1.117 -9.375 1.00 0.00 O ATOM 1720 OE2 GLU A 111 1.271 0.508 -10.513 1.00 0.00 O ATOM 0 H GLU A 111 3.044 4.327 -7.785 1.00 0.00 H new ATOM 0 HA GLU A 111 2.239 2.697 -5.478 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.830 0.810 -7.196 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.554 1.985 -6.945 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.179 3.179 -8.984 1.00 0.00 H new ATOM 0 HG3 GLU A 111 2.579 2.148 -9.205 1.00 0.00 H new ATOM 1727 N PHE A 112 4.542 1.780 -5.544 1.00 0.00 N ATOM 1728 CA PHE A 112 5.904 1.248 -5.551 1.00 0.00 C ATOM 1729 C PHE A 112 6.072 0.142 -4.511 1.00 0.00 C ATOM 1730 O PHE A 112 5.427 0.158 -3.461 1.00 0.00 O ATOM 1731 CB PHE A 112 6.925 2.363 -5.303 1.00 0.00 C ATOM 1732 CG PHE A 112 6.711 3.123 -4.021 1.00 0.00 C ATOM 1733 CD1 PHE A 112 5.801 4.166 -3.967 1.00 0.00 C ATOM 1734 CD2 PHE A 112 7.424 2.799 -2.877 1.00 0.00 C ATOM 1735 CE1 PHE A 112 5.606 4.873 -2.796 1.00 0.00 C ATOM 1736 CE2 PHE A 112 7.232 3.503 -1.702 1.00 0.00 C ATOM 1737 CZ PHE A 112 6.322 4.542 -1.662 1.00 0.00 C ATOM 0 H PHE A 112 4.101 1.801 -4.625 1.00 0.00 H new ATOM 0 HA PHE A 112 6.084 0.820 -6.537 1.00 0.00 H new ATOM 0 HB2 PHE A 112 7.925 1.929 -5.292 1.00 0.00 H new ATOM 0 HB3 PHE A 112 6.891 3.064 -6.137 1.00 0.00 H new ATOM 0 HD1 PHE A 112 5.238 4.429 -4.850 1.00 0.00 H new ATOM 0 HD2 PHE A 112 8.137 1.988 -2.904 1.00 0.00 H new ATOM 0 HE1 PHE A 112 4.894 5.684 -2.767 1.00 0.00 H new ATOM 0 HE2 PHE A 112 7.793 3.241 -0.817 1.00 0.00 H new ATOM 0 HZ PHE A 112 6.171 5.094 -0.746 1.00 0.00 H new ATOM 1747 N VAL A 113 6.944 -0.816 -4.818 1.00 0.00 N ATOM 1748 CA VAL A 113 7.208 -1.936 -3.927 1.00 0.00 C ATOM 1749 C VAL A 113 8.193 -1.553 -2.824 1.00 0.00 C ATOM 1750 O VAL A 113 8.924 -0.568 -2.943 1.00 0.00 O ATOM 1751 CB VAL A 113 7.761 -3.146 -4.703 1.00 0.00 C ATOM 1752 CG1 VAL A 113 6.655 -3.823 -5.499 1.00 0.00 C ATOM 1753 CG2 VAL A 113 8.906 -2.730 -5.618 1.00 0.00 C ATOM 0 H VAL A 113 7.482 -0.836 -5.685 1.00 0.00 H new ATOM 0 HA VAL A 113 6.256 -2.208 -3.471 1.00 0.00 H new ATOM 0 HB VAL A 113 8.151 -3.862 -3.980 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.066 -4.675 -6.040 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.875 -4.166 -4.819 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.231 -3.113 -6.209 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.279 -3.603 -6.154 1.00 0.00 H new ATOM 0 HG22 VAL A 113 8.549 -1.989 -6.334 1.00 0.00 H new ATOM 0 HG23 VAL A 113 9.711 -2.300 -5.021 1.00 0.00 H new ATOM 1763 N ILE A 114 8.198 -2.341 -1.749 1.00 0.00 N ATOM 1764 CA ILE A 114 9.081 -2.096 -0.615 1.00 0.00 C ATOM 1765 C ILE A 114 9.628 -3.407 -0.050 1.00 0.00 C ATOM 1766 O ILE A 114 8.877 -4.360 0.168 1.00 0.00 O ATOM 1767 CB ILE A 114 8.350 -1.330 0.507 1.00 0.00 C ATOM 1768 CG1 ILE A 114 7.837 0.019 -0.010 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.269 -1.130 1.703 1.00 0.00 C ATOM 1770 CD1 ILE A 114 6.847 0.691 0.917 1.00 0.00 C ATOM 0 H ILE A 114 7.596 -3.158 -1.642 1.00 0.00 H new ATOM 0 HA ILE A 114 9.909 -1.489 -0.981 1.00 0.00 H new ATOM 0 HB ILE A 114 7.494 -1.923 0.828 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.686 0.685 -0.165 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.367 -0.130 -0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.736 -0.588 2.484 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.585 -2.101 2.085 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.145 -0.558 1.397 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.529 1.640 0.484 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.979 0.045 1.053 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.318 0.873 1.883 1.00 0.00 H new ATOM 1782 N SER A 115 10.938 -3.442 0.184 1.00 0.00 N ATOM 1783 CA SER A 115 11.596 -4.631 0.725 1.00 0.00 C ATOM 1784 C SER A 115 12.214 -4.364 2.104 1.00 0.00 C ATOM 1785 O SER A 115 12.520 -5.304 2.838 1.00 0.00 O ATOM 1786 CB SER A 115 12.677 -5.116 -0.242 1.00 0.00 C ATOM 1787 OG SER A 115 12.125 -5.950 -1.247 1.00 0.00 O ATOM 0 H SER A 115 11.567 -2.659 0.007 1.00 0.00 H new ATOM 0 HA SER A 115 10.836 -5.403 0.844 1.00 0.00 H new ATOM 0 HB2 SER A 115 13.167 -4.259 -0.705 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.443 -5.662 0.308 1.00 0.00 H new ATOM 0 HG SER A 115 12.836 -6.246 -1.854 1.00 0.00 H new ATOM 1793 N ASP A 116 12.402 -3.086 2.451 1.00 0.00 N ATOM 1794 CA ASP A 116 12.990 -2.715 3.736 1.00 0.00 C ATOM 1795 C ASP A 116 11.979 -1.974 4.613 1.00 0.00 C ATOM 1796 O ASP A 116 11.064 -1.319 4.109 1.00 0.00 O ATOM 1797 CB ASP A 116 14.238 -1.856 3.516 1.00 0.00 C ATOM 1798 CG ASP A 116 13.957 -0.603 2.710 1.00 0.00 C ATOM 1799 OD1 ASP A 116 13.814 -0.708 1.474 1.00 0.00 O ATOM 1800 OD2 ASP A 116 13.883 0.484 3.316 1.00 0.00 O ATOM 0 H ASP A 116 12.155 -2.294 1.858 1.00 0.00 H new ATOM 0 HA ASP A 116 13.277 -3.629 4.256 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.654 -1.574 4.483 1.00 0.00 H new ATOM 0 HB3 ASP A 116 14.996 -2.449 3.004 1.00 0.00 H new ATOM 1805 N ARG A 117 12.152 -2.092 5.931 1.00 0.00 N ATOM 1806 CA ARG A 117 11.260 -1.442 6.893 1.00 0.00 C ATOM 1807 C ARG A 117 11.336 0.083 6.791 1.00 0.00 C ATOM 1808 O ARG A 117 10.376 0.783 7.126 1.00 0.00 O ATOM 1809 CB ARG A 117 11.604 -1.882 8.319 1.00 0.00 C ATOM 1810 CG ARG A 117 10.458 -1.712 9.305 1.00 0.00 C ATOM 1811 CD ARG A 117 10.867 -2.103 10.717 1.00 0.00 C ATOM 1812 NE ARG A 117 11.824 -1.158 11.297 1.00 0.00 N ATOM 1813 CZ ARG A 117 12.162 -1.137 12.588 1.00 0.00 C ATOM 1814 NH1 ARG A 117 11.625 -2.003 13.443 1.00 0.00 N ATOM 1815 NH2 ARG A 117 13.042 -0.244 13.027 1.00 0.00 N ATOM 0 H ARG A 117 12.904 -2.633 6.357 1.00 0.00 H new ATOM 0 HA ARG A 117 10.241 -1.748 6.654 1.00 0.00 H new ATOM 0 HB2 ARG A 117 11.906 -2.929 8.304 1.00 0.00 H new ATOM 0 HB3 ARG A 117 12.462 -1.308 8.670 1.00 0.00 H new ATOM 0 HG2 ARG A 117 10.122 -0.675 9.297 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.612 -2.323 8.989 1.00 0.00 H new ATOM 0 HD2 ARG A 117 9.981 -2.154 11.349 1.00 0.00 H new ATOM 0 HD3 ARG A 117 11.307 -3.100 10.703 1.00 0.00 H new ATOM 0 HE ARG A 117 12.258 -0.475 10.677 1.00 0.00 H new ATOM 0 HH11 ARG A 117 10.948 -2.692 13.114 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.890 -1.979 14.428 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.458 0.424 12.378 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.302 -0.226 14.013 1.00 0.00 H new ATOM 1829 N LYS A 118 12.475 0.594 6.328 1.00 0.00 N ATOM 1830 CA LYS A 118 12.670 2.035 6.185 1.00 0.00 C ATOM 1831 C LYS A 118 11.778 2.602 5.077 1.00 0.00 C ATOM 1832 O LYS A 118 11.245 3.705 5.203 1.00 0.00 O ATOM 1833 CB LYS A 118 14.142 2.335 5.887 1.00 0.00 C ATOM 1834 CG LYS A 118 14.445 3.811 5.702 1.00 0.00 C ATOM 1835 CD LYS A 118 15.257 4.362 6.864 1.00 0.00 C ATOM 1836 CE LYS A 118 16.000 5.630 6.476 1.00 0.00 C ATOM 1837 NZ LYS A 118 15.095 6.649 5.870 1.00 0.00 N ATOM 0 H LYS A 118 13.277 0.031 6.045 1.00 0.00 H new ATOM 0 HA LYS A 118 12.390 2.515 7.123 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.753 1.948 6.702 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.436 1.798 4.985 1.00 0.00 H new ATOM 0 HG2 LYS A 118 14.993 3.957 4.771 1.00 0.00 H new ATOM 0 HG3 LYS A 118 13.512 4.367 5.613 1.00 0.00 H new ATOM 0 HD2 LYS A 118 14.595 4.570 7.705 1.00 0.00 H new ATOM 0 HD3 LYS A 118 15.971 3.609 7.199 1.00 0.00 H new ATOM 0 HE2 LYS A 118 16.481 6.052 7.359 1.00 0.00 H new ATOM 0 HE3 LYS A 118 16.792 5.383 5.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 15.591 7.561 5.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 14.815 6.342 4.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 14.247 6.756 6.462 1.00 0.00 H new ATOM 1851 N GLU A 119 11.625 1.838 3.996 1.00 0.00 N ATOM 1852 CA GLU A 119 10.807 2.254 2.860 1.00 0.00 C ATOM 1853 C GLU A 119 9.314 2.175 3.181 1.00 0.00 C ATOM 1854 O GLU A 119 8.542 3.046 2.776 1.00 0.00 O ATOM 1855 CB GLU A 119 11.123 1.390 1.638 1.00 0.00 C ATOM 1856 CG GLU A 119 12.125 2.023 0.688 1.00 0.00 C ATOM 1857 CD GLU A 119 11.724 1.868 -0.765 1.00 0.00 C ATOM 1858 OE1 GLU A 119 10.718 2.490 -1.171 1.00 0.00 O ATOM 1859 OE2 GLU A 119 12.412 1.125 -1.496 1.00 0.00 O ATOM 0 H GLU A 119 12.060 0.922 3.884 1.00 0.00 H new ATOM 0 HA GLU A 119 11.049 3.294 2.642 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.511 0.428 1.974 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.199 1.189 1.097 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.225 3.083 0.923 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.104 1.569 0.842 1.00 0.00 H new ATOM 1866 N LEU A 120 8.911 1.130 3.906 1.00 0.00 N ATOM 1867 CA LEU A 120 7.505 0.950 4.273 1.00 0.00 C ATOM 1868 C LEU A 120 7.094 1.917 5.384 1.00 0.00 C ATOM 1869 O LEU A 120 5.903 2.126 5.622 1.00 0.00 O ATOM 1870 CB LEU A 120 7.233 -0.497 4.701 1.00 0.00 C ATOM 1871 CG LEU A 120 7.928 -0.949 5.987 1.00 0.00 C ATOM 1872 CD1 LEU A 120 7.163 -0.469 7.213 1.00 0.00 C ATOM 1873 CD2 LEU A 120 8.073 -2.463 6.007 1.00 0.00 C ATOM 0 H LEU A 120 9.534 0.399 4.249 1.00 0.00 H new ATOM 0 HA LEU A 120 6.904 1.170 3.391 1.00 0.00 H new ATOM 0 HB2 LEU A 120 6.158 -0.623 4.827 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.539 -1.160 3.892 1.00 0.00 H new ATOM 0 HG LEU A 120 8.923 -0.505 6.013 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.676 -0.802 8.115 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.111 0.620 7.206 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.154 -0.880 7.196 1.00 0.00 H new ATOM 0 HD21 LEU A 120 8.569 -2.769 6.928 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.086 -2.924 5.956 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.667 -2.783 5.151 1.00 0.00 H new ATOM 1885 N GLU A 121 8.086 2.506 6.059 1.00 0.00 N ATOM 1886 CA GLU A 121 7.832 3.452 7.136 1.00 0.00 C ATOM 1887 C GLU A 121 6.864 4.542 6.680 1.00 0.00 C ATOM 1888 O GLU A 121 7.043 5.148 5.619 1.00 0.00 O ATOM 1889 CB GLU A 121 9.152 4.068 7.605 1.00 0.00 C ATOM 1890 CG GLU A 121 9.042 4.841 8.909 1.00 0.00 C ATOM 1891 CD GLU A 121 10.340 5.529 9.286 1.00 0.00 C ATOM 1892 OE1 GLU A 121 11.164 4.899 9.983 1.00 0.00 O ATOM 1893 OE2 GLU A 121 10.534 6.693 8.880 1.00 0.00 O ATOM 0 H GLU A 121 9.075 2.339 5.873 1.00 0.00 H new ATOM 0 HA GLU A 121 7.373 2.921 7.970 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.889 3.274 7.726 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.526 4.736 6.829 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.252 5.586 8.821 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.750 4.160 9.708 1.00 0.00 H new ATOM 1900 N GLU A 122 5.832 4.772 7.488 1.00 0.00 N ATOM 1901 CA GLU A 122 4.809 5.777 7.189 1.00 0.00 C ATOM 1902 C GLU A 122 5.431 7.114 6.782 1.00 0.00 C ATOM 1903 O GLU A 122 4.999 7.736 5.809 1.00 0.00 O ATOM 1904 CB GLU A 122 3.900 5.968 8.405 1.00 0.00 C ATOM 1905 CG GLU A 122 2.560 6.602 8.075 1.00 0.00 C ATOM 1906 CD GLU A 122 2.456 8.023 8.586 1.00 0.00 C ATOM 1907 OE1 GLU A 122 2.130 8.205 9.777 1.00 0.00 O ATOM 1908 OE2 GLU A 122 2.708 8.955 7.796 1.00 0.00 O ATOM 0 H GLU A 122 5.679 4.272 8.364 1.00 0.00 H new ATOM 0 HA GLU A 122 4.221 5.417 6.345 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.727 4.999 8.874 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.415 6.589 9.138 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.413 6.595 6.995 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.760 6.002 8.509 1.00 0.00 H new ATOM 1915 N ASN A 123 6.451 7.545 7.525 1.00 0.00 N ATOM 1916 CA ASN A 123 7.135 8.802 7.239 1.00 0.00 C ATOM 1917 C ASN A 123 7.805 8.759 5.867 1.00 0.00 C ATOM 1918 O ASN A 123 7.758 9.736 5.115 1.00 0.00 O ATOM 1919 CB ASN A 123 8.181 9.096 8.319 1.00 0.00 C ATOM 1920 CG ASN A 123 7.586 9.773 9.541 1.00 0.00 C ATOM 1921 OD1 ASN A 123 7.602 9.219 10.638 1.00 0.00 O ATOM 1922 ND2 ASN A 123 7.055 10.977 9.355 1.00 0.00 N ATOM 0 H ASN A 123 6.821 7.040 8.330 1.00 0.00 H new ATOM 0 HA ASN A 123 6.390 9.598 7.236 1.00 0.00 H new ATOM 0 HB2 ASN A 123 8.658 8.163 8.621 1.00 0.00 H new ATOM 0 HB3 ASN A 123 8.961 9.732 7.900 1.00 0.00 H new ATOM 0 HD21 ASN A 123 6.639 11.478 10.140 1.00 0.00 H new ATOM 0 HD22 ASN A 123 7.063 11.400 8.427 1.00 0.00 H new ATOM 1929 N PHE A 124 8.424 7.621 5.544 1.00 0.00 N ATOM 1930 CA PHE A 124 9.101 7.451 4.262 1.00 0.00 C ATOM 1931 C PHE A 124 8.132 7.634 3.097 1.00 0.00 C ATOM 1932 O PHE A 124 8.395 8.418 2.183 1.00 0.00 O ATOM 1933 CB PHE A 124 9.756 6.070 4.179 1.00 0.00 C ATOM 1934 CG PHE A 124 10.555 5.865 2.922 1.00 0.00 C ATOM 1935 CD1 PHE A 124 9.922 5.545 1.729 1.00 0.00 C ATOM 1936 CD2 PHE A 124 11.932 6.005 2.928 1.00 0.00 C ATOM 1937 CE1 PHE A 124 10.650 5.366 0.570 1.00 0.00 C ATOM 1938 CE2 PHE A 124 12.666 5.828 1.771 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.023 5.508 0.589 1.00 0.00 C ATOM 0 H PHE A 124 8.469 6.805 6.155 1.00 0.00 H new ATOM 0 HA PHE A 124 9.873 8.217 4.192 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.408 5.932 5.042 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.982 5.304 4.238 1.00 0.00 H new ATOM 0 HD1 PHE A 124 8.848 5.435 1.707 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.439 6.256 3.848 1.00 0.00 H new ATOM 0 HE1 PHE A 124 10.146 5.115 -0.351 1.00 0.00 H new ATOM 0 HE2 PHE A 124 13.740 5.939 1.789 1.00 0.00 H new ATOM 0 HZ PHE A 124 12.594 5.370 -0.317 1.00 0.00 H new ATOM 1949 N ILE A 125 7.013 6.907 3.134 1.00 0.00 N ATOM 1950 CA ILE A 125 6.006 6.995 2.078 1.00 0.00 C ATOM 1951 C ILE A 125 5.547 8.439 1.881 1.00 0.00 C ATOM 1952 O ILE A 125 5.409 8.905 0.749 1.00 0.00 O ATOM 1953 CB ILE A 125 4.777 6.108 2.377 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.209 4.670 2.680 1.00 0.00 C ATOM 1955 CG2 ILE A 125 3.808 6.132 1.203 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.280 3.945 3.629 1.00 0.00 C ATOM 0 H ILE A 125 6.783 6.253 3.882 1.00 0.00 H new ATOM 0 HA ILE A 125 6.479 6.634 1.164 1.00 0.00 H new ATOM 0 HB ILE A 125 4.271 6.508 3.256 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.267 4.112 1.745 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.212 4.683 3.106 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.947 5.502 1.429 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.474 7.155 1.028 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.308 5.756 0.311 1.00 0.00 H new ATOM 0 HD11 ILE A 125 4.649 2.933 3.797 1.00 0.00 H new ATOM 0 HD12 ILE A 125 4.240 4.479 4.578 1.00 0.00 H new ATOM 0 HD13 ILE A 125 3.281 3.900 3.196 1.00 0.00 H new ATOM 1968 N LYS A 126 5.327 9.145 2.993 1.00 0.00 N ATOM 1969 CA LYS A 126 4.902 10.542 2.947 1.00 0.00 C ATOM 1970 C LYS A 126 5.910 11.380 2.162 1.00 0.00 C ATOM 1971 O LYS A 126 5.531 12.245 1.371 1.00 0.00 O ATOM 1972 CB LYS A 126 4.746 11.099 4.365 1.00 0.00 C ATOM 1973 CG LYS A 126 3.365 11.670 4.651 1.00 0.00 C ATOM 1974 CD LYS A 126 3.110 11.787 6.146 1.00 0.00 C ATOM 1975 CE LYS A 126 1.623 11.792 6.467 1.00 0.00 C ATOM 1976 NZ LYS A 126 1.021 10.434 6.355 1.00 0.00 N ATOM 0 H LYS A 126 5.437 8.770 3.935 1.00 0.00 H new ATOM 0 HA LYS A 126 3.937 10.592 2.443 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.957 10.306 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.491 11.878 4.523 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.273 12.652 4.187 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.605 11.032 4.200 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.591 10.956 6.663 1.00 0.00 H new ATOM 0 HD3 LYS A 126 3.566 12.703 6.522 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.472 12.173 7.477 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.109 12.473 5.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 0.226 10.351 7.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 0.678 10.285 5.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 1.739 9.716 6.582 1.00 0.00 H new ATOM 1990 N SER A 127 7.197 11.104 2.383 1.00 0.00 N ATOM 1991 CA SER A 127 8.269 11.816 1.695 1.00 0.00 C ATOM 1992 C SER A 127 8.299 11.451 0.212 1.00 0.00 C ATOM 1993 O SER A 127 8.478 12.321 -0.642 1.00 0.00 O ATOM 1994 CB SER A 127 9.620 11.494 2.339 1.00 0.00 C ATOM 1995 OG SER A 127 10.663 12.248 1.746 1.00 0.00 O ATOM 0 H SER A 127 7.520 10.390 3.036 1.00 0.00 H new ATOM 0 HA SER A 127 8.078 12.885 1.785 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.576 11.706 3.407 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.832 10.430 2.234 1.00 0.00 H new ATOM 0 HG SER A 127 11.514 12.024 2.177 1.00 0.00 H new ATOM 2001 N GLU A 128 8.120 10.162 -0.086 1.00 0.00 N ATOM 2002 CA GLU A 128 8.122 9.676 -1.464 1.00 0.00 C ATOM 2003 C GLU A 128 7.039 10.364 -2.296 1.00 0.00 C ATOM 2004 O GLU A 128 7.294 10.797 -3.421 1.00 0.00 O ATOM 2005 CB GLU A 128 7.911 8.159 -1.487 1.00 0.00 C ATOM 2006 CG GLU A 128 8.323 7.504 -2.796 1.00 0.00 C ATOM 2007 CD GLU A 128 9.683 6.838 -2.713 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.682 7.553 -2.490 1.00 0.00 O ATOM 2009 OE2 GLU A 128 9.747 5.602 -2.875 1.00 0.00 O ATOM 0 H GLU A 128 7.971 9.435 0.613 1.00 0.00 H new ATOM 0 HA GLU A 128 9.091 9.914 -1.903 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.478 7.710 -0.672 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.859 7.945 -1.299 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.576 6.762 -3.077 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.338 8.256 -3.585 1.00 0.00 H new ATOM 2016 N LEU A 129 5.834 10.460 -1.734 1.00 0.00 N ATOM 2017 CA LEU A 129 4.710 11.096 -2.421 1.00 0.00 C ATOM 2018 C LEU A 129 4.894 12.613 -2.514 1.00 0.00 C ATOM 2019 O LEU A 129 4.457 13.237 -3.484 1.00 0.00 O ATOM 2020 CB LEU A 129 3.396 10.781 -1.700 1.00 0.00 C ATOM 2021 CG LEU A 129 2.602 9.610 -2.283 1.00 0.00 C ATOM 2022 CD1 LEU A 129 3.231 8.285 -1.882 1.00 0.00 C ATOM 2023 CD2 LEU A 129 1.151 9.672 -1.830 1.00 0.00 C ATOM 0 H LEU A 129 5.611 10.105 -0.804 1.00 0.00 H new ATOM 0 HA LEU A 129 4.675 10.693 -3.433 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.616 10.566 -0.654 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.767 11.671 -1.718 1.00 0.00 H new ATOM 0 HG LEU A 129 2.626 9.685 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 129 2.652 7.464 -2.306 1.00 0.00 H new ATOM 0 HD12 LEU A 129 4.254 8.239 -2.257 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.239 8.200 -0.795 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.601 8.832 -2.254 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.107 9.622 -0.742 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.704 10.606 -2.169 1.00 0.00 H new ATOM 2035 N LYS A 130 5.533 13.201 -1.500 1.00 0.00 N ATOM 2036 CA LYS A 130 5.764 14.644 -1.468 1.00 0.00 C ATOM 2037 C LYS A 130 6.897 15.047 -2.413 1.00 0.00 C ATOM 2038 O LYS A 130 6.750 15.981 -3.204 1.00 0.00 O ATOM 2039 CB LYS A 130 6.087 15.098 -0.043 1.00 0.00 C ATOM 2040 CG LYS A 130 5.705 16.542 0.237 1.00 0.00 C ATOM 2041 CD LYS A 130 6.379 17.061 1.496 1.00 0.00 C ATOM 2042 CE LYS A 130 6.154 18.554 1.673 1.00 0.00 C ATOM 2043 NZ LYS A 130 7.106 19.153 2.650 1.00 0.00 N ATOM 0 H LYS A 130 5.899 12.699 -0.691 1.00 0.00 H new ATOM 0 HA LYS A 130 4.851 15.135 -1.803 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.567 14.450 0.662 1.00 0.00 H new ATOM 0 HB3 LYS A 130 7.155 14.972 0.136 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.987 17.165 -0.612 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.623 16.619 0.344 1.00 0.00 H new ATOM 0 HD2 LYS A 130 5.991 16.528 2.364 1.00 0.00 H new ATOM 0 HD3 LYS A 130 7.449 16.856 1.448 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.262 19.053 0.710 1.00 0.00 H new ATOM 0 HE3 LYS A 130 5.132 18.729 2.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.916 20.172 2.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.986 18.696 3.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 8.081 19.010 2.317 1.00 0.00 H new