USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=22 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 3 THR OG1 : rot 26:sc= 1.41 USER MOD Set 1.2: A 93 LYS NZ :NH3+ -172:sc= 0.958 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 73:sc= -0.467 USER MOD Single : A 14 TYR OH : rot 30:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -1.13 K(o=-1.1,f=-1.8) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.142 USER MOD Single : A 30 LYS NZ :NH3+ -154:sc= 1.25 (180deg=0.556) USER MOD Single : A 31 TYR OH : rot 30:sc= -0.0507 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 58:sc= 0.501 USER MOD Single : A 41 GLN : amide:sc= -1.75 K(o=-1.8,f=0) USER MOD Single : A 45 TYR OH : rot 115:sc= 0.481 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 47 HIS : no HD1:sc= -0.151 X(o=-0.15,f=-0.41) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.024) USER MOD Single : A 52 CYS SG : rot 117:sc= -1.78! USER MOD Single : A 53 THR OG1 : rot 138:sc= 1.29 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 USER MOD Single : A 85 ASN : amide:sc= 0.047 X(o=0.047,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.583 K(o=-0.58,f=-4.1!) USER MOD Single : A 94 THR OG1 : rot 66:sc= 0.562 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 69:sc= 0.0305 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0.0229 X(o=0.023,f=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 110 LYS NZ :NH3+ 147:sc= 0 (180deg=-1.27!) USER MOD Single : A 115 SER OG : rot -6:sc= 0.457 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -4.177 -18.110 -9.978 1.00 0.00 N ATOM 14 CA THR A 3 -3.994 -16.982 -9.068 1.00 0.00 C ATOM 15 C THR A 3 -4.672 -15.729 -9.618 1.00 0.00 C ATOM 16 O THR A 3 -4.032 -14.895 -10.260 1.00 0.00 O ATOM 17 CB THR A 3 -2.502 -16.714 -8.834 1.00 0.00 C ATOM 18 OG1 THR A 3 -1.744 -17.910 -8.939 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.212 -16.104 -7.477 1.00 0.00 C ATOM 0 HA THR A 3 -4.457 -17.238 -8.115 1.00 0.00 H new ATOM 0 HB THR A 3 -2.215 -16.002 -9.608 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.212 -18.544 -9.521 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.139 -15.939 -7.374 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.736 -15.152 -7.386 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.552 -16.781 -6.693 1.00 0.00 H new ATOM 27 N LYS A 4 -5.973 -15.605 -9.364 1.00 0.00 N ATOM 28 CA LYS A 4 -6.743 -14.455 -9.832 1.00 0.00 C ATOM 29 C LYS A 4 -7.022 -13.485 -8.687 1.00 0.00 C ATOM 30 O LYS A 4 -6.674 -13.753 -7.539 1.00 0.00 O ATOM 31 CB LYS A 4 -8.064 -14.918 -10.454 1.00 0.00 C ATOM 32 CG LYS A 4 -7.895 -15.686 -11.755 1.00 0.00 C ATOM 33 CD LYS A 4 -9.129 -16.516 -12.077 1.00 0.00 C ATOM 34 CE LYS A 4 -8.823 -17.602 -13.098 1.00 0.00 C ATOM 35 NZ LYS A 4 -9.187 -17.188 -14.481 1.00 0.00 N ATOM 0 H LYS A 4 -6.517 -16.288 -8.836 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.153 -13.938 -10.589 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.591 -15.548 -9.737 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.694 -14.047 -10.636 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.703 -14.987 -12.569 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -7.025 -16.339 -11.683 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.510 -16.972 -11.163 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.915 -15.866 -12.461 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.761 -17.846 -13.060 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.368 -18.509 -12.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -8.962 -17.957 -15.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.205 -16.980 -14.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.649 -16.337 -14.742 1.00 0.00 H new ATOM 49 N ILE A 5 -7.662 -12.362 -9.005 1.00 0.00 N ATOM 50 CA ILE A 5 -7.998 -11.360 -7.999 1.00 0.00 C ATOM 51 C ILE A 5 -9.510 -11.179 -7.902 1.00 0.00 C ATOM 52 O ILE A 5 -10.173 -10.880 -8.897 1.00 0.00 O ATOM 53 CB ILE A 5 -7.338 -9.993 -8.297 1.00 0.00 C ATOM 54 CG1 ILE A 5 -7.643 -8.998 -7.173 1.00 0.00 C ATOM 55 CG2 ILE A 5 -7.804 -9.444 -9.640 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.615 -7.894 -7.045 1.00 0.00 C ATOM 0 H ILE A 5 -7.958 -12.124 -9.952 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.610 -11.726 -7.049 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.259 -10.139 -8.349 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.622 -8.553 -7.349 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.704 -9.538 -6.228 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.326 -8.482 -9.826 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.534 -10.143 -10.432 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -8.886 -9.314 -9.624 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.896 -7.228 -6.229 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.638 -8.329 -6.837 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.570 -7.329 -7.976 1.00 0.00 H new ATOM 68 N ASP A 6 -10.050 -11.359 -6.700 1.00 0.00 N ATOM 69 CA ASP A 6 -11.484 -11.209 -6.485 1.00 0.00 C ATOM 70 C ASP A 6 -11.900 -9.754 -6.668 1.00 0.00 C ATOM 71 O ASP A 6 -11.545 -8.889 -5.862 1.00 0.00 O ATOM 72 CB ASP A 6 -11.880 -11.696 -5.090 1.00 0.00 C ATOM 73 CG ASP A 6 -13.357 -12.022 -4.996 1.00 0.00 C ATOM 74 OD1 ASP A 6 -14.164 -11.081 -4.843 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.707 -13.218 -5.081 1.00 0.00 O ATOM 0 H ASP A 6 -9.519 -11.607 -5.865 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.002 -11.820 -7.224 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.297 -12.582 -4.837 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.631 -10.930 -4.355 1.00 0.00 H new ATOM 80 N LYS A 7 -12.649 -9.488 -7.737 1.00 0.00 N ATOM 81 CA LYS A 7 -13.111 -8.136 -8.033 1.00 0.00 C ATOM 82 C LYS A 7 -14.059 -7.635 -6.947 1.00 0.00 C ATOM 83 O LYS A 7 -13.934 -6.503 -6.483 1.00 0.00 O ATOM 84 CB LYS A 7 -13.806 -8.092 -9.395 1.00 0.00 C ATOM 85 CG LYS A 7 -13.479 -6.847 -10.206 1.00 0.00 C ATOM 86 CD LYS A 7 -14.682 -6.361 -10.999 1.00 0.00 C ATOM 87 CE LYS A 7 -14.501 -6.596 -12.491 1.00 0.00 C ATOM 88 NZ LYS A 7 -13.626 -5.564 -13.116 1.00 0.00 N ATOM 0 H LYS A 7 -12.948 -10.192 -8.412 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.240 -7.482 -8.061 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.520 -8.974 -9.968 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.884 -8.145 -9.245 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.140 -6.056 -9.537 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.656 -7.062 -10.888 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.578 -6.877 -10.655 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.836 -5.298 -10.813 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -14.069 -7.584 -12.653 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.475 -6.590 -12.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -13.529 -5.761 -14.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -14.050 -4.624 -12.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -12.688 -5.587 -12.668 1.00 0.00 H new ATOM 102 N GLU A 8 -15.002 -8.489 -6.545 1.00 0.00 N ATOM 103 CA GLU A 8 -15.970 -8.137 -5.510 1.00 0.00 C ATOM 104 C GLU A 8 -15.267 -7.688 -4.231 1.00 0.00 C ATOM 105 O GLU A 8 -15.650 -6.688 -3.624 1.00 0.00 O ATOM 106 CB GLU A 8 -16.892 -9.324 -5.217 1.00 0.00 C ATOM 107 CG GLU A 8 -18.217 -9.255 -5.960 1.00 0.00 C ATOM 108 CD GLU A 8 -18.265 -10.180 -7.163 1.00 0.00 C ATOM 109 OE1 GLU A 8 -17.611 -9.867 -8.181 1.00 0.00 O ATOM 110 OE2 GLU A 8 -18.961 -11.214 -7.089 1.00 0.00 O ATOM 0 H GLU A 8 -15.114 -9.430 -6.922 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.570 -7.305 -5.879 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.380 -10.248 -5.487 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.086 -9.368 -4.145 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -19.026 -9.513 -5.276 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.392 -8.230 -6.288 1.00 0.00 H new ATOM 117 N ALA A 9 -14.232 -8.428 -3.833 1.00 0.00 N ATOM 118 CA ALA A 9 -13.469 -8.101 -2.633 1.00 0.00 C ATOM 119 C ALA A 9 -12.773 -6.751 -2.780 1.00 0.00 C ATOM 120 O ALA A 9 -12.952 -5.860 -1.948 1.00 0.00 O ATOM 121 CB ALA A 9 -12.451 -9.192 -2.334 1.00 0.00 C ATOM 0 H ALA A 9 -13.904 -9.258 -4.326 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.166 -8.036 -1.797 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.891 -8.931 -1.436 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.968 -10.139 -2.177 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.764 -9.289 -3.174 1.00 0.00 H new ATOM 127 N CYS A 10 -11.985 -6.609 -3.845 1.00 0.00 N ATOM 128 CA CYS A 10 -11.259 -5.367 -4.110 1.00 0.00 C ATOM 129 C CYS A 10 -12.219 -4.183 -4.228 1.00 0.00 C ATOM 130 O CYS A 10 -11.999 -3.135 -3.618 1.00 0.00 O ATOM 131 CB CYS A 10 -10.434 -5.503 -5.390 1.00 0.00 C ATOM 132 SG CYS A 10 -9.397 -4.068 -5.757 1.00 0.00 S ATOM 0 H CYS A 10 -11.833 -7.340 -4.540 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.590 -5.180 -3.270 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -9.799 -6.385 -5.308 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -11.109 -5.673 -6.228 1.00 0.00 H new ATOM 0 HG CYS A 10 -8.392 -4.036 -4.933 1.00 0.00 H new ATOM 138 N ARG A 11 -13.284 -4.359 -5.012 1.00 0.00 N ATOM 139 CA ARG A 11 -14.280 -3.307 -5.208 1.00 0.00 C ATOM 140 C ARG A 11 -14.966 -2.954 -3.890 1.00 0.00 C ATOM 141 O ARG A 11 -15.182 -1.778 -3.594 1.00 0.00 O ATOM 142 CB ARG A 11 -15.322 -3.742 -6.242 1.00 0.00 C ATOM 143 CG ARG A 11 -15.780 -2.617 -7.157 1.00 0.00 C ATOM 144 CD ARG A 11 -17.263 -2.322 -6.990 1.00 0.00 C ATOM 145 NE ARG A 11 -18.100 -3.342 -7.624 1.00 0.00 N ATOM 146 CZ ARG A 11 -18.719 -4.330 -6.968 1.00 0.00 C ATOM 147 NH1 ARG A 11 -18.610 -4.445 -5.647 1.00 0.00 N ATOM 148 NH2 ARG A 11 -19.454 -5.207 -7.642 1.00 0.00 N ATOM 0 H ARG A 11 -13.478 -5.221 -5.521 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.765 -2.420 -5.577 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.905 -4.546 -6.849 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.188 -4.151 -5.722 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -15.204 -1.717 -6.943 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -15.577 -2.886 -8.194 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.504 -2.264 -5.929 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.490 -1.347 -7.422 1.00 0.00 H new ATOM 0 HE ARG A 11 -18.220 -3.296 -8.636 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -18.049 -3.775 -5.121 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -19.088 -5.203 -5.160 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -19.544 -5.125 -8.655 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -19.928 -5.962 -7.147 1.00 0.00 H new ATOM 162 N ALA A 12 -15.297 -3.979 -3.097 1.00 0.00 N ATOM 163 CA ALA A 12 -15.949 -3.772 -1.807 1.00 0.00 C ATOM 164 C ALA A 12 -15.116 -2.850 -0.919 1.00 0.00 C ATOM 165 O ALA A 12 -15.630 -1.880 -0.364 1.00 0.00 O ATOM 166 CB ALA A 12 -16.189 -5.104 -1.109 1.00 0.00 C ATOM 0 H ALA A 12 -15.123 -4.957 -3.329 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.912 -3.295 -1.988 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.676 -4.929 -0.149 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.828 -5.731 -1.731 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.236 -5.606 -0.946 1.00 0.00 H new ATOM 172 N ALA A 13 -13.824 -3.156 -0.804 1.00 0.00 N ATOM 173 CA ALA A 13 -12.912 -2.353 0.003 1.00 0.00 C ATOM 174 C ALA A 13 -12.740 -0.954 -0.586 1.00 0.00 C ATOM 175 O ALA A 13 -12.555 0.016 0.149 1.00 0.00 O ATOM 176 CB ALA A 13 -11.564 -3.046 0.123 1.00 0.00 C ATOM 0 H ALA A 13 -13.387 -3.956 -1.261 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.345 -2.248 0.998 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.894 -2.435 0.728 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.696 -4.019 0.597 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.135 -3.181 -0.870 1.00 0.00 H new ATOM 182 N TYR A 14 -12.802 -0.859 -1.917 1.00 0.00 N ATOM 183 CA TYR A 14 -12.654 0.421 -2.608 1.00 0.00 C ATOM 184 C TYR A 14 -13.643 1.455 -2.071 1.00 0.00 C ATOM 185 O TYR A 14 -13.242 2.523 -1.609 1.00 0.00 O ATOM 186 CB TYR A 14 -12.856 0.240 -4.117 1.00 0.00 C ATOM 187 CG TYR A 14 -12.039 1.193 -4.963 1.00 0.00 C ATOM 188 CD1 TYR A 14 -11.941 2.539 -4.631 1.00 0.00 C ATOM 189 CD2 TYR A 14 -11.366 0.746 -6.094 1.00 0.00 C ATOM 190 CE1 TYR A 14 -11.196 3.412 -5.401 1.00 0.00 C ATOM 191 CE2 TYR A 14 -10.619 1.614 -6.868 1.00 0.00 C ATOM 192 CZ TYR A 14 -10.537 2.944 -6.517 1.00 0.00 C ATOM 193 OH TYR A 14 -9.793 3.812 -7.284 1.00 0.00 O ATOM 0 H TYR A 14 -12.954 -1.655 -2.536 1.00 0.00 H new ATOM 0 HA TYR A 14 -11.643 0.785 -2.424 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -12.598 -0.784 -4.388 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.912 0.375 -4.351 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -12.456 2.909 -3.757 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -11.428 -0.296 -6.372 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.131 4.455 -5.130 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -10.102 1.251 -7.744 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.439 4.528 -6.717 1.00 0.00 H new ATOM 203 N ASN A 15 -14.934 1.133 -2.138 1.00 0.00 N ATOM 204 CA ASN A 15 -15.975 2.036 -1.661 1.00 0.00 C ATOM 205 C ASN A 15 -15.938 2.183 -0.137 1.00 0.00 C ATOM 206 O ASN A 15 -16.283 3.239 0.396 1.00 0.00 O ATOM 207 CB ASN A 15 -17.352 1.543 -2.113 1.00 0.00 C ATOM 208 CG ASN A 15 -17.635 0.108 -1.701 1.00 0.00 C ATOM 209 OD1 ASN A 15 -17.821 -0.188 -0.521 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.670 -0.791 -2.679 1.00 0.00 N ATOM 0 H ASN A 15 -15.282 0.253 -2.518 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.787 3.018 -2.094 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -18.120 2.193 -1.694 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.423 1.624 -3.198 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.857 -1.771 -2.465 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -17.510 -0.501 -3.644 1.00 0.00 H new ATOM 217 N LEU A 16 -15.521 1.120 0.554 1.00 0.00 N ATOM 218 CA LEU A 16 -15.442 1.130 2.015 1.00 0.00 C ATOM 219 C LEU A 16 -14.355 2.089 2.502 1.00 0.00 C ATOM 220 O LEU A 16 -14.595 2.916 3.382 1.00 0.00 O ATOM 221 CB LEU A 16 -15.166 -0.283 2.534 1.00 0.00 C ATOM 222 CG LEU A 16 -15.943 -0.680 3.791 1.00 0.00 C ATOM 223 CD1 LEU A 16 -15.790 -2.167 4.064 1.00 0.00 C ATOM 224 CD2 LEU A 16 -15.472 0.132 4.988 1.00 0.00 C ATOM 0 H LEU A 16 -15.233 0.241 0.124 1.00 0.00 H new ATOM 0 HA LEU A 16 -16.399 1.476 2.405 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -15.399 -0.995 1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -14.100 -0.375 2.742 1.00 0.00 H new ATOM 0 HG LEU A 16 -16.999 -0.467 3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -16.349 -2.432 4.962 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.175 -2.734 3.216 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -14.736 -2.404 4.210 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -16.036 -0.164 5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.411 -0.050 5.156 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -15.632 1.193 4.794 1.00 0.00 H new ATOM 236 N VAL A 17 -13.160 1.972 1.920 1.00 0.00 N ATOM 237 CA VAL A 17 -12.036 2.830 2.289 1.00 0.00 C ATOM 238 C VAL A 17 -12.258 4.259 1.795 1.00 0.00 C ATOM 239 O VAL A 17 -11.851 5.218 2.452 1.00 0.00 O ATOM 240 CB VAL A 17 -10.705 2.293 1.718 1.00 0.00 C ATOM 241 CG1 VAL A 17 -9.540 3.183 2.128 1.00 0.00 C ATOM 242 CG2 VAL A 17 -10.468 0.860 2.175 1.00 0.00 C ATOM 0 H VAL A 17 -12.947 1.291 1.191 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.975 2.830 3.377 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.774 2.303 0.630 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.614 2.784 1.714 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.702 4.192 1.749 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.469 3.211 3.215 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.526 0.498 1.763 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.424 0.828 3.264 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.284 0.227 1.826 1.00 0.00 H new ATOM 252 N ARG A 18 -12.914 4.389 0.639 1.00 0.00 N ATOM 253 CA ARG A 18 -13.203 5.699 0.056 1.00 0.00 C ATOM 254 C ARG A 18 -13.928 6.596 1.058 1.00 0.00 C ATOM 255 O ARG A 18 -13.701 7.807 1.096 1.00 0.00 O ATOM 256 CB ARG A 18 -14.047 5.539 -1.210 1.00 0.00 C ATOM 257 CG ARG A 18 -13.225 5.503 -2.487 1.00 0.00 C ATOM 258 CD ARG A 18 -14.111 5.571 -3.719 1.00 0.00 C ATOM 259 NE ARG A 18 -13.354 5.910 -4.922 1.00 0.00 N ATOM 260 CZ ARG A 18 -13.843 5.831 -6.161 1.00 0.00 C ATOM 261 NH1 ARG A 18 -15.095 5.428 -6.369 1.00 0.00 N ATOM 262 NH2 ARG A 18 -13.079 6.159 -7.196 1.00 0.00 N ATOM 0 H ARG A 18 -13.255 3.601 0.089 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.256 6.171 -0.203 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.628 4.620 -1.136 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -14.759 6.362 -1.269 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.525 6.338 -2.494 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -12.632 4.589 -2.514 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -14.607 4.611 -3.862 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.893 6.314 -3.562 1.00 0.00 H new ATOM 0 HE ARG A 18 -12.391 6.227 -4.807 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.688 5.177 -5.578 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -15.461 5.370 -7.319 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -12.120 6.471 -7.043 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -13.451 6.099 -8.144 1.00 0.00 H new ATOM 276 N ASP A 19 -14.793 5.994 1.877 1.00 0.00 N ATOM 277 CA ASP A 19 -15.537 6.738 2.885 1.00 0.00 C ATOM 278 C ASP A 19 -14.593 7.251 3.966 1.00 0.00 C ATOM 279 O ASP A 19 -13.827 6.483 4.550 1.00 0.00 O ATOM 280 CB ASP A 19 -16.622 5.861 3.514 1.00 0.00 C ATOM 281 CG ASP A 19 -17.839 6.659 3.937 1.00 0.00 C ATOM 282 OD1 ASP A 19 -17.728 7.445 4.903 1.00 0.00 O ATOM 283 OD2 ASP A 19 -18.903 6.501 3.302 1.00 0.00 O ATOM 0 H ASP A 19 -14.993 4.994 1.859 1.00 0.00 H new ATOM 0 HA ASP A 19 -16.016 7.587 2.398 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.924 5.094 2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.210 5.345 4.381 1.00 0.00 H new ATOM 318 N ALA A 23 -12.776 5.766 10.331 1.00 0.00 N ATOM 319 CA ALA A 23 -11.429 5.671 10.899 1.00 0.00 C ATOM 320 C ALA A 23 -10.530 4.742 10.080 1.00 0.00 C ATOM 321 O ALA A 23 -9.652 4.073 10.629 1.00 0.00 O ATOM 322 CB ALA A 23 -11.497 5.198 12.346 1.00 0.00 C ATOM 0 HA ALA A 23 -10.989 6.668 10.868 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.489 5.132 12.755 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.081 5.906 12.933 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.970 4.217 12.386 1.00 0.00 H new ATOM 328 N VAL A 24 -10.758 4.696 8.766 1.00 0.00 N ATOM 329 CA VAL A 24 -9.975 3.840 7.881 1.00 0.00 C ATOM 330 C VAL A 24 -9.082 4.661 6.946 1.00 0.00 C ATOM 331 O VAL A 24 -9.541 5.612 6.309 1.00 0.00 O ATOM 332 CB VAL A 24 -10.892 2.918 7.042 1.00 0.00 C ATOM 333 CG1 VAL A 24 -11.808 3.728 6.133 1.00 0.00 C ATOM 334 CG2 VAL A 24 -10.066 1.934 6.229 1.00 0.00 C ATOM 0 H VAL A 24 -11.479 5.242 8.294 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.338 3.226 8.518 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.519 2.355 7.733 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -12.440 3.052 5.557 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -12.435 4.383 6.738 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.206 4.330 5.453 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -10.730 1.295 5.647 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -9.407 2.482 5.556 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.468 1.318 6.901 1.00 0.00 H new ATOM 344 N ILE A 25 -7.804 4.282 6.863 1.00 0.00 N ATOM 345 CA ILE A 25 -6.853 4.982 5.996 1.00 0.00 C ATOM 346 C ILE A 25 -6.086 4.007 5.098 1.00 0.00 C ATOM 347 O ILE A 25 -5.871 4.286 3.916 1.00 0.00 O ATOM 348 CB ILE A 25 -5.846 5.843 6.798 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.819 4.969 7.529 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.578 6.746 7.782 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.754 5.766 8.256 1.00 0.00 C ATOM 0 H ILE A 25 -7.406 3.499 7.382 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.451 5.647 5.373 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.305 6.468 6.088 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.339 4.334 8.246 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.338 4.308 6.808 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.854 7.343 8.336 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.252 7.407 7.237 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.153 6.135 8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.062 5.083 8.750 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.208 6.381 7.541 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.225 6.408 9.001 1.00 0.00 H new ATOM 363 N TRP A 26 -5.672 2.869 5.661 1.00 0.00 N ATOM 364 CA TRP A 26 -4.927 1.865 4.903 1.00 0.00 C ATOM 365 C TRP A 26 -5.637 0.513 4.902 1.00 0.00 C ATOM 366 O TRP A 26 -6.461 0.229 5.773 1.00 0.00 O ATOM 367 CB TRP A 26 -3.510 1.698 5.472 1.00 0.00 C ATOM 368 CG TRP A 26 -3.468 1.119 6.860 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.207 1.798 8.015 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.685 -0.253 7.243 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.249 0.942 9.088 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.542 -0.320 8.642 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.988 -1.429 6.544 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.691 -1.508 9.350 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.137 -2.610 7.253 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.991 -2.638 8.640 1.00 0.00 C ATOM 0 H TRP A 26 -5.840 2.622 6.636 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.867 2.221 3.875 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.936 1.055 4.805 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.017 2.670 5.481 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.998 2.856 8.076 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.088 1.204 10.061 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.103 -1.415 5.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.574 -1.537 10.423 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.370 -3.522 6.724 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.118 -3.573 9.165 1.00 0.00 H new ATOM 387 N VAL A 27 -5.279 -0.322 3.928 1.00 0.00 N ATOM 388 CA VAL A 27 -5.837 -1.666 3.803 1.00 0.00 C ATOM 389 C VAL A 27 -4.750 -2.630 3.329 1.00 0.00 C ATOM 390 O VAL A 27 -3.849 -2.221 2.591 1.00 0.00 O ATOM 391 CB VAL A 27 -7.027 -1.717 2.819 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.247 -1.037 3.417 1.00 0.00 C ATOM 393 CG2 VAL A 27 -6.658 -1.083 1.483 1.00 0.00 C ATOM 0 H VAL A 27 -4.597 -0.087 3.207 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.206 -1.959 4.786 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.271 -2.764 2.639 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.074 -1.084 2.708 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -8.531 -1.544 4.339 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.013 0.005 3.633 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.513 -1.132 0.809 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.378 -0.041 1.640 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.818 -1.622 1.044 1.00 0.00 H new ATOM 403 N THR A 28 -4.810 -3.898 3.747 1.00 0.00 N ATOM 404 CA THR A 28 -3.778 -4.860 3.327 1.00 0.00 C ATOM 405 C THR A 28 -4.358 -6.035 2.556 1.00 0.00 C ATOM 406 O THR A 28 -5.106 -6.842 3.097 1.00 0.00 O ATOM 407 CB THR A 28 -2.962 -5.362 4.519 1.00 0.00 C ATOM 408 OG1 THR A 28 -2.169 -6.482 4.154 1.00 0.00 O ATOM 409 CG2 THR A 28 -3.795 -5.762 5.719 1.00 0.00 C ATOM 0 H THR A 28 -5.535 -4.277 4.356 1.00 0.00 H new ATOM 0 HA THR A 28 -3.114 -4.319 2.653 1.00 0.00 H new ATOM 0 HB THR A 28 -2.345 -4.511 4.806 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.654 -6.786 4.931 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.139 -6.106 6.519 1.00 0.00 H new ATOM 0 HG22 THR A 28 -4.370 -4.903 6.065 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.476 -6.565 5.438 1.00 0.00 H new ATOM 417 N PHE A 29 -3.974 -6.131 1.292 1.00 0.00 N ATOM 418 CA PHE A 29 -4.432 -7.215 0.425 1.00 0.00 C ATOM 419 C PHE A 29 -3.640 -8.486 0.693 1.00 0.00 C ATOM 420 O PHE A 29 -2.416 -8.503 0.566 1.00 0.00 O ATOM 421 CB PHE A 29 -4.304 -6.820 -1.047 1.00 0.00 C ATOM 422 CG PHE A 29 -5.357 -5.850 -1.503 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.467 -4.601 -0.913 1.00 0.00 C ATOM 424 CD2 PHE A 29 -6.234 -6.187 -2.520 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.433 -3.706 -1.330 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.201 -5.296 -2.941 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.301 -4.054 -2.345 1.00 0.00 C ATOM 0 H PHE A 29 -3.343 -5.470 0.839 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.483 -7.403 0.646 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.321 -6.380 -1.212 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -4.359 -7.718 -1.662 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.790 -4.324 -0.118 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.161 -7.157 -2.989 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.509 -2.735 -0.862 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.879 -5.570 -3.736 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.057 -3.356 -2.673 1.00 0.00 H new ATOM 437 N LYS A 30 -4.346 -9.547 1.072 1.00 0.00 N ATOM 438 CA LYS A 30 -3.706 -10.824 1.371 1.00 0.00 C ATOM 439 C LYS A 30 -4.262 -11.957 0.505 1.00 0.00 C ATOM 440 O LYS A 30 -5.318 -11.820 -0.118 1.00 0.00 O ATOM 441 CB LYS A 30 -3.878 -11.163 2.856 1.00 0.00 C ATOM 442 CG LYS A 30 -5.314 -11.049 3.352 1.00 0.00 C ATOM 443 CD LYS A 30 -5.424 -11.370 4.837 1.00 0.00 C ATOM 444 CE LYS A 30 -5.586 -10.109 5.675 1.00 0.00 C ATOM 445 NZ LYS A 30 -4.373 -9.242 5.625 1.00 0.00 N ATOM 0 H LYS A 30 -5.360 -9.548 1.179 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.645 -10.724 1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -3.523 -12.179 3.030 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.246 -10.499 3.446 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.683 -10.040 3.169 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.950 -11.728 2.785 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -6.275 -12.030 5.005 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -4.534 -11.910 5.160 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.448 -9.546 5.319 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -5.791 -10.385 6.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.322 -8.667 6.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -3.523 -9.838 5.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -4.427 -8.617 4.796 1.00 0.00 H new ATOM 459 N TYR A 31 -3.536 -13.076 0.477 1.00 0.00 N ATOM 460 CA TYR A 31 -3.935 -14.244 -0.302 1.00 0.00 C ATOM 461 C TYR A 31 -5.025 -15.033 0.419 1.00 0.00 C ATOM 462 O TYR A 31 -4.782 -15.618 1.477 1.00 0.00 O ATOM 463 CB TYR A 31 -2.724 -15.153 -0.549 1.00 0.00 C ATOM 464 CG TYR A 31 -1.778 -14.650 -1.619 1.00 0.00 C ATOM 465 CD1 TYR A 31 -0.886 -13.616 -1.361 1.00 0.00 C ATOM 466 CD2 TYR A 31 -1.775 -15.216 -2.885 1.00 0.00 C ATOM 467 CE1 TYR A 31 -0.022 -13.160 -2.337 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.912 -14.767 -3.867 1.00 0.00 C ATOM 469 CZ TYR A 31 -0.039 -13.739 -3.588 1.00 0.00 C ATOM 470 OH TYR A 31 0.824 -13.292 -4.562 1.00 0.00 O ATOM 0 H TYR A 31 -2.662 -13.196 0.990 1.00 0.00 H new ATOM 0 HA TYR A 31 -4.329 -13.895 -1.257 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.172 -15.266 0.384 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.079 -16.144 -0.831 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -0.868 -13.162 -0.381 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.459 -16.022 -3.108 1.00 0.00 H new ATOM 0 HE1 TYR A 31 0.664 -12.354 -2.121 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -0.922 -15.220 -4.847 1.00 0.00 H new ATOM 0 HH TYR A 31 1.644 -12.956 -4.143 1.00 0.00 H new ATOM 480 N ASP A 32 -6.224 -15.051 -0.160 1.00 0.00 N ATOM 481 CA ASP A 32 -7.348 -15.776 0.423 1.00 0.00 C ATOM 482 C ASP A 32 -8.049 -16.624 -0.635 1.00 0.00 C ATOM 483 O ASP A 32 -8.714 -16.094 -1.523 1.00 0.00 O ATOM 484 CB ASP A 32 -8.342 -14.802 1.063 1.00 0.00 C ATOM 485 CG ASP A 32 -9.103 -15.427 2.217 1.00 0.00 C ATOM 486 OD1 ASP A 32 -8.450 -15.944 3.148 1.00 0.00 O ATOM 487 OD2 ASP A 32 -10.350 -15.401 2.190 1.00 0.00 O ATOM 0 H ASP A 32 -6.441 -14.571 -1.033 1.00 0.00 H new ATOM 0 HA ASP A 32 -6.960 -16.438 1.197 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.806 -13.922 1.419 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.049 -14.460 0.307 1.00 0.00 H new ATOM 492 N GLY A 33 -7.888 -17.943 -0.536 1.00 0.00 N ATOM 493 CA GLY A 33 -8.506 -18.848 -1.494 1.00 0.00 C ATOM 494 C GLY A 33 -7.831 -18.806 -2.852 1.00 0.00 C ATOM 495 O GLY A 33 -8.500 -18.890 -3.884 1.00 0.00 O ATOM 0 H GLY A 33 -7.340 -18.402 0.192 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -8.468 -19.865 -1.104 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.559 -18.589 -1.607 1.00 0.00 H new ATOM 499 N SER A 34 -6.502 -18.673 -2.850 1.00 0.00 N ATOM 500 CA SER A 34 -5.724 -18.613 -4.088 1.00 0.00 C ATOM 501 C SER A 34 -6.077 -17.366 -4.904 1.00 0.00 C ATOM 502 O SER A 34 -5.935 -17.354 -6.129 1.00 0.00 O ATOM 503 CB SER A 34 -5.949 -19.877 -4.927 1.00 0.00 C ATOM 504 OG SER A 34 -6.020 -21.033 -4.108 1.00 0.00 O ATOM 0 H SER A 34 -5.941 -18.605 -2.001 1.00 0.00 H new ATOM 0 HA SER A 34 -4.670 -18.554 -3.817 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.871 -19.777 -5.499 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.138 -19.988 -5.647 1.00 0.00 H new ATOM 0 HG SER A 34 -6.166 -21.823 -4.669 1.00 0.00 H new ATOM 510 N THR A 35 -6.532 -16.313 -4.217 1.00 0.00 N ATOM 511 CA THR A 35 -6.899 -15.065 -4.877 1.00 0.00 C ATOM 512 C THR A 35 -6.587 -13.867 -3.981 1.00 0.00 C ATOM 513 O THR A 35 -6.561 -13.983 -2.754 1.00 0.00 O ATOM 514 CB THR A 35 -8.385 -15.075 -5.265 1.00 0.00 C ATOM 515 OG1 THR A 35 -8.797 -13.801 -5.728 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.309 -15.463 -4.129 1.00 0.00 C ATOM 0 H THR A 35 -6.653 -16.304 -3.204 1.00 0.00 H new ATOM 0 HA THR A 35 -6.306 -14.975 -5.787 1.00 0.00 H new ATOM 0 HB THR A 35 -8.462 -15.829 -6.049 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.246 -13.538 -6.495 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.341 -15.448 -4.478 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.058 -16.465 -3.782 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.193 -14.755 -3.308 1.00 0.00 H new ATOM 524 N ILE A 36 -6.347 -12.720 -4.608 1.00 0.00 N ATOM 525 CA ILE A 36 -6.030 -11.495 -3.881 1.00 0.00 C ATOM 526 C ILE A 36 -7.298 -10.783 -3.419 1.00 0.00 C ATOM 527 O ILE A 36 -8.209 -10.538 -4.212 1.00 0.00 O ATOM 528 CB ILE A 36 -5.198 -10.527 -4.747 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.069 -11.280 -5.452 1.00 0.00 C ATOM 530 CG2 ILE A 36 -4.638 -9.396 -3.897 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.390 -11.654 -6.884 1.00 0.00 C ATOM 0 H ILE A 36 -6.366 -12.613 -5.622 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.444 -11.788 -3.010 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.850 -10.094 -5.505 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.170 -10.664 -5.439 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.843 -12.187 -4.891 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.054 -8.723 -4.525 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.459 -8.844 -3.439 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.999 -9.809 -3.116 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.544 -12.185 -7.320 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.271 -12.296 -6.904 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.587 -10.750 -7.461 1.00 0.00 H new ATOM 543 N VAL A 37 -7.344 -10.450 -2.132 1.00 0.00 N ATOM 544 CA VAL A 37 -8.491 -9.760 -1.554 1.00 0.00 C ATOM 545 C VAL A 37 -8.047 -8.782 -0.465 1.00 0.00 C ATOM 546 O VAL A 37 -7.091 -9.052 0.265 1.00 0.00 O ATOM 547 CB VAL A 37 -9.513 -10.755 -0.963 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.169 -11.571 -2.068 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.850 -11.670 0.060 1.00 0.00 C ATOM 0 H VAL A 37 -6.596 -10.648 -1.468 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.971 -9.207 -2.361 1.00 0.00 H new ATOM 0 HB VAL A 37 -10.288 -10.182 -0.454 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.886 -12.266 -1.631 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.686 -10.902 -2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.406 -12.130 -2.610 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -9.590 -12.362 0.462 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.050 -12.233 -0.420 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -8.436 -11.070 0.870 1.00 0.00 H new ATOM 559 N PRO A 38 -8.734 -7.630 -0.340 1.00 0.00 N ATOM 560 CA PRO A 38 -8.400 -6.615 0.668 1.00 0.00 C ATOM 561 C PRO A 38 -8.433 -7.180 2.086 1.00 0.00 C ATOM 562 O PRO A 38 -9.196 -8.104 2.379 1.00 0.00 O ATOM 563 CB PRO A 38 -9.485 -5.550 0.490 1.00 0.00 C ATOM 564 CG PRO A 38 -9.996 -5.751 -0.894 1.00 0.00 C ATOM 565 CD PRO A 38 -9.886 -7.224 -1.164 1.00 0.00 C ATOM 0 HA PRO A 38 -7.389 -6.230 0.535 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -10.280 -5.669 1.226 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.079 -4.547 0.619 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.029 -5.414 -0.982 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -9.411 -5.177 -1.613 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.794 -7.755 -0.877 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.717 -7.428 -2.221 1.00 0.00 H new ATOM 573 N GLY A 39 -7.597 -6.623 2.960 1.00 0.00 N ATOM 574 CA GLY A 39 -7.533 -7.078 4.328 1.00 0.00 C ATOM 575 C GLY A 39 -7.619 -5.939 5.321 1.00 0.00 C ATOM 576 O GLY A 39 -8.194 -4.894 5.021 1.00 0.00 O ATOM 0 H GLY A 39 -6.960 -5.858 2.736 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.347 -7.779 4.513 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.601 -7.622 4.484 1.00 0.00 H new ATOM 580 N GLU A 40 -7.039 -6.162 6.501 1.00 0.00 N ATOM 581 CA GLU A 40 -7.034 -5.193 7.605 1.00 0.00 C ATOM 582 C GLU A 40 -7.214 -3.757 7.129 1.00 0.00 C ATOM 583 O GLU A 40 -6.557 -3.317 6.191 1.00 0.00 O ATOM 584 CB GLU A 40 -5.745 -5.311 8.424 1.00 0.00 C ATOM 585 CG GLU A 40 -5.736 -6.485 9.393 1.00 0.00 C ATOM 586 CD GLU A 40 -5.494 -7.815 8.702 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.453 -7.948 8.021 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.348 -8.718 8.831 1.00 0.00 O ATOM 0 H GLU A 40 -6.553 -7.031 6.723 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.890 -5.438 8.234 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.900 -5.409 7.742 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.597 -4.388 8.985 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.962 -6.325 10.144 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.689 -6.523 9.920 1.00 0.00 H new ATOM 595 N GLN A 41 -8.113 -3.037 7.794 1.00 0.00 N ATOM 596 CA GLN A 41 -8.398 -1.646 7.458 1.00 0.00 C ATOM 597 C GLN A 41 -8.444 -0.798 8.725 1.00 0.00 C ATOM 598 O GLN A 41 -9.452 -0.778 9.436 1.00 0.00 O ATOM 599 CB GLN A 41 -9.723 -1.534 6.698 1.00 0.00 C ATOM 600 CG GLN A 41 -10.860 -2.335 7.320 1.00 0.00 C ATOM 601 CD GLN A 41 -12.224 -1.754 6.998 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.862 -1.134 7.849 1.00 0.00 O ATOM 603 NE2 GLN A 41 -12.679 -1.950 5.766 1.00 0.00 N ATOM 0 H GLN A 41 -8.661 -3.398 8.575 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.600 -1.276 6.814 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.015 -0.485 6.649 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.572 -1.871 5.673 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.813 -3.364 6.963 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -10.728 -2.367 8.402 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -12.117 -2.470 5.092 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -13.590 -1.581 5.494 1.00 0.00 H new ATOM 612 N GLY A 42 -7.342 -0.112 9.008 1.00 0.00 N ATOM 613 CA GLY A 42 -7.274 0.716 10.202 1.00 0.00 C ATOM 614 C GLY A 42 -6.633 2.068 9.963 1.00 0.00 C ATOM 615 O GLY A 42 -5.971 2.282 8.946 1.00 0.00 O ATOM 0 H GLY A 42 -6.497 -0.113 8.436 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.282 0.864 10.590 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.711 0.186 10.970 1.00 0.00 H new ATOM 619 N ALA A 43 -6.826 2.976 10.918 1.00 0.00 N ATOM 620 CA ALA A 43 -6.258 4.320 10.839 1.00 0.00 C ATOM 621 C ALA A 43 -4.855 4.353 11.445 1.00 0.00 C ATOM 622 O ALA A 43 -4.064 5.249 11.147 1.00 0.00 O ATOM 623 CB ALA A 43 -7.162 5.322 11.547 1.00 0.00 C ATOM 0 H ALA A 43 -7.375 2.803 11.760 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.184 4.597 9.787 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.725 6.318 11.479 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.144 5.324 11.074 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.265 5.042 12.595 1.00 0.00 H new ATOM 629 N GLU A 44 -4.556 3.370 12.298 1.00 0.00 N ATOM 630 CA GLU A 44 -3.253 3.285 12.946 1.00 0.00 C ATOM 631 C GLU A 44 -2.307 2.399 12.142 1.00 0.00 C ATOM 632 O GLU A 44 -2.540 1.197 12.000 1.00 0.00 O ATOM 633 CB GLU A 44 -3.404 2.737 14.366 1.00 0.00 C ATOM 634 CG GLU A 44 -3.645 3.813 15.413 1.00 0.00 C ATOM 635 CD GLU A 44 -2.808 3.608 16.661 1.00 0.00 C ATOM 636 OE1 GLU A 44 -1.586 3.859 16.605 1.00 0.00 O ATOM 637 OE2 GLU A 44 -3.375 3.194 17.694 1.00 0.00 O ATOM 0 H GLU A 44 -5.202 2.623 12.554 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.829 4.288 12.995 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -4.233 2.030 14.387 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -2.504 2.181 14.629 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -3.419 4.789 14.984 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.701 3.821 15.685 1.00 0.00 H new ATOM 644 N TYR A 45 -1.239 2.999 11.619 1.00 0.00 N ATOM 645 CA TYR A 45 -0.257 2.259 10.830 1.00 0.00 C ATOM 646 C TYR A 45 0.527 1.273 11.697 1.00 0.00 C ATOM 647 O TYR A 45 1.147 0.344 11.175 1.00 0.00 O ATOM 648 CB TYR A 45 0.704 3.219 10.127 1.00 0.00 C ATOM 649 CG TYR A 45 1.484 2.576 9.002 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.898 2.352 7.763 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.807 2.196 9.178 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.609 1.766 6.733 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.526 1.611 8.154 1.00 0.00 C ATOM 654 CZ TYR A 45 2.923 1.398 6.933 1.00 0.00 C ATOM 655 OH TYR A 45 3.636 0.814 5.909 1.00 0.00 O ATOM 0 H TYR A 45 -1.032 3.992 11.727 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.802 1.690 10.077 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.138 4.062 9.730 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.403 3.622 10.860 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.130 2.640 7.602 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.283 2.361 10.133 1.00 0.00 H new ATOM 0 HE1 TYR A 45 1.138 1.597 5.776 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.555 1.322 8.309 1.00 0.00 H new ATOM 0 HH TYR A 45 4.368 1.407 5.641 1.00 0.00 H new ATOM 665 N GLN A 46 0.494 1.468 13.021 1.00 0.00 N ATOM 666 CA GLN A 46 1.197 0.580 13.948 1.00 0.00 C ATOM 667 C GLN A 46 0.894 -0.885 13.628 1.00 0.00 C ATOM 668 O GLN A 46 1.787 -1.733 13.661 1.00 0.00 O ATOM 669 CB GLN A 46 0.798 0.892 15.394 1.00 0.00 C ATOM 670 CG GLN A 46 1.803 0.402 16.425 1.00 0.00 C ATOM 671 CD GLN A 46 1.149 -0.348 17.571 1.00 0.00 C ATOM 672 OE1 GLN A 46 0.196 0.136 18.181 1.00 0.00 O ATOM 673 NE2 GLN A 46 1.659 -1.539 17.869 1.00 0.00 N ATOM 0 H GLN A 46 -0.011 2.231 13.471 1.00 0.00 H new ATOM 0 HA GLN A 46 2.268 0.748 13.833 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.675 1.970 15.503 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -0.171 0.438 15.600 1.00 0.00 H new ATOM 0 HG2 GLN A 46 2.529 -0.249 15.938 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.355 1.254 16.822 1.00 0.00 H new ATOM 0 HE21 GLN A 46 2.450 -1.903 17.337 1.00 0.00 H new ATOM 0 HE22 GLN A 46 1.259 -2.089 18.629 1.00 0.00 H new ATOM 682 N HIS A 47 -0.369 -1.166 13.306 1.00 0.00 N ATOM 683 CA HIS A 47 -0.799 -2.520 12.963 1.00 0.00 C ATOM 684 C HIS A 47 -0.112 -3.006 11.689 1.00 0.00 C ATOM 685 O HIS A 47 0.243 -4.180 11.575 1.00 0.00 O ATOM 686 CB HIS A 47 -2.317 -2.564 12.773 1.00 0.00 C ATOM 687 CG HIS A 47 -3.076 -2.925 14.012 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.498 -2.997 15.264 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.382 -3.234 14.184 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.416 -3.340 16.150 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.567 -3.489 15.521 1.00 0.00 N ATOM 0 H HIS A 47 -1.114 -0.470 13.276 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.518 -3.178 13.785 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.657 -1.590 12.422 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.554 -3.285 11.991 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.138 -3.273 13.414 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.253 -3.475 17.209 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.451 -3.751 15.957 1.00 0.00 H new ATOM 700 N PHE A 48 0.072 -2.093 10.733 1.00 0.00 N ATOM 701 CA PHE A 48 0.714 -2.427 9.469 1.00 0.00 C ATOM 702 C PHE A 48 2.191 -2.757 9.674 1.00 0.00 C ATOM 703 O PHE A 48 2.717 -3.680 9.053 1.00 0.00 O ATOM 704 CB PHE A 48 0.561 -1.272 8.476 1.00 0.00 C ATOM 705 CG PHE A 48 0.553 -1.724 7.047 1.00 0.00 C ATOM 706 CD1 PHE A 48 -0.633 -2.072 6.425 1.00 0.00 C ATOM 707 CD2 PHE A 48 1.735 -1.813 6.331 1.00 0.00 C ATOM 708 CE1 PHE A 48 -0.643 -2.498 5.112 1.00 0.00 C ATOM 709 CE2 PHE A 48 1.732 -2.241 5.019 1.00 0.00 C ATOM 710 CZ PHE A 48 0.543 -2.584 4.408 1.00 0.00 C ATOM 0 H PHE A 48 -0.216 -1.118 10.814 1.00 0.00 H new ATOM 0 HA PHE A 48 0.223 -3.311 9.062 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.366 -0.739 8.688 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.377 -0.564 8.623 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -1.562 -2.010 6.973 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.668 -1.545 6.804 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -1.575 -2.763 4.636 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.660 -2.308 4.470 1.00 0.00 H new ATOM 0 HZ PHE A 48 0.539 -2.919 3.381 1.00 0.00 H new ATOM 720 N ILE A 49 2.850 -2.003 10.554 1.00 0.00 N ATOM 721 CA ILE A 49 4.267 -2.217 10.847 1.00 0.00 C ATOM 722 C ILE A 49 4.480 -3.538 11.584 1.00 0.00 C ATOM 723 O ILE A 49 5.354 -4.328 11.224 1.00 0.00 O ATOM 724 CB ILE A 49 4.848 -1.070 11.704 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.558 0.286 11.055 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.346 -1.257 11.902 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.885 1.466 11.945 1.00 0.00 C ATOM 0 H ILE A 49 2.424 -1.238 11.077 1.00 0.00 H new ATOM 0 HA ILE A 49 4.786 -2.244 9.889 1.00 0.00 H new ATOM 0 HB ILE A 49 4.366 -1.094 12.681 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.132 0.368 10.132 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.504 0.330 10.780 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.738 -0.440 12.508 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.531 -2.205 12.408 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.844 -1.261 10.932 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.654 2.393 11.420 1.00 0.00 H new ATOM 0 HD12 ILE A 49 4.292 1.409 12.858 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.945 1.447 12.199 1.00 0.00 H new ATOM 739 N GLN A 50 3.676 -3.764 12.623 1.00 0.00 N ATOM 740 CA GLN A 50 3.767 -4.979 13.428 1.00 0.00 C ATOM 741 C GLN A 50 3.530 -6.234 12.586 1.00 0.00 C ATOM 742 O GLN A 50 4.156 -7.270 12.818 1.00 0.00 O ATOM 743 CB GLN A 50 2.756 -4.917 14.575 1.00 0.00 C ATOM 744 CG GLN A 50 3.145 -5.749 15.786 1.00 0.00 C ATOM 745 CD GLN A 50 2.372 -5.356 17.030 1.00 0.00 C ATOM 746 OE1 GLN A 50 1.261 -5.833 17.261 1.00 0.00 O ATOM 747 NE2 GLN A 50 2.955 -4.476 17.838 1.00 0.00 N ATOM 0 H GLN A 50 2.950 -3.116 12.927 1.00 0.00 H new ATOM 0 HA GLN A 50 4.777 -5.039 13.833 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.635 -3.879 14.884 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.786 -5.256 14.210 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.970 -6.803 15.571 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.213 -5.635 15.974 1.00 0.00 H new ATOM 0 HE21 GLN A 50 3.877 -4.106 17.608 1.00 0.00 H new ATOM 0 HE22 GLN A 50 2.480 -4.171 18.688 1.00 0.00 H new ATOM 756 N GLN A 51 2.624 -6.138 11.612 1.00 0.00 N ATOM 757 CA GLN A 51 2.310 -7.271 10.744 1.00 0.00 C ATOM 758 C GLN A 51 3.279 -7.363 9.562 1.00 0.00 C ATOM 759 O GLN A 51 3.471 -8.441 8.996 1.00 0.00 O ATOM 760 CB GLN A 51 0.870 -7.169 10.234 1.00 0.00 C ATOM 761 CG GLN A 51 -0.139 -7.889 11.117 1.00 0.00 C ATOM 762 CD GLN A 51 -0.490 -7.102 12.367 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.478 -6.368 12.394 1.00 0.00 O ATOM 764 NE2 GLN A 51 0.320 -7.248 13.414 1.00 0.00 N ATOM 0 H GLN A 51 2.097 -5.290 11.406 1.00 0.00 H new ATOM 0 HA GLN A 51 2.418 -8.179 11.338 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.592 -6.117 10.161 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.820 -7.582 9.227 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.047 -8.078 10.545 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.264 -8.860 11.405 1.00 0.00 H new ATOM 0 HE21 GLN A 51 1.129 -7.866 13.351 1.00 0.00 H new ATOM 0 HE22 GLN A 51 0.132 -6.741 14.279 1.00 0.00 H new ATOM 773 N CYS A 52 3.883 -6.231 9.188 1.00 0.00 N ATOM 774 CA CYS A 52 4.823 -6.191 8.071 1.00 0.00 C ATOM 775 C CYS A 52 6.167 -6.812 8.449 1.00 0.00 C ATOM 776 O CYS A 52 7.119 -6.103 8.784 1.00 0.00 O ATOM 777 CB CYS A 52 5.032 -4.750 7.594 1.00 0.00 C ATOM 778 SG CYS A 52 3.995 -4.280 6.190 1.00 0.00 S ATOM 0 H CYS A 52 3.736 -5.331 9.645 1.00 0.00 H new ATOM 0 HA CYS A 52 4.392 -6.778 7.260 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.832 -4.071 8.423 1.00 0.00 H new ATOM 0 HB3 CYS A 52 6.079 -4.618 7.319 1.00 0.00 H new ATOM 0 HG CYS A 52 3.192 -3.321 6.545 1.00 0.00 H new ATOM 784 N THR A 53 6.241 -8.138 8.376 1.00 0.00 N ATOM 785 CA THR A 53 7.474 -8.854 8.693 1.00 0.00 C ATOM 786 C THR A 53 8.306 -9.063 7.426 1.00 0.00 C ATOM 787 O THR A 53 7.838 -8.791 6.318 1.00 0.00 O ATOM 788 CB THR A 53 7.162 -10.207 9.348 1.00 0.00 C ATOM 789 OG1 THR A 53 6.249 -10.950 8.561 1.00 0.00 O ATOM 790 CG2 THR A 53 6.572 -10.085 10.738 1.00 0.00 C ATOM 0 H THR A 53 5.463 -8.738 8.101 1.00 0.00 H new ATOM 0 HA THR A 53 8.048 -8.253 9.398 1.00 0.00 H new ATOM 0 HB THR A 53 8.124 -10.713 9.423 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.534 -11.887 8.526 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.377 -11.080 11.139 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.275 -9.563 11.387 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.639 -9.524 10.689 1.00 0.00 H new ATOM 798 N ASP A 54 9.535 -9.550 7.592 1.00 0.00 N ATOM 799 CA ASP A 54 10.418 -9.797 6.455 1.00 0.00 C ATOM 800 C ASP A 54 10.183 -11.184 5.851 1.00 0.00 C ATOM 801 O ASP A 54 11.039 -11.708 5.140 1.00 0.00 O ATOM 802 CB ASP A 54 11.883 -9.647 6.880 1.00 0.00 C ATOM 803 CG ASP A 54 12.365 -8.211 6.802 1.00 0.00 C ATOM 804 OD1 ASP A 54 12.192 -7.581 5.736 1.00 0.00 O ATOM 805 OD2 ASP A 54 12.914 -7.715 7.809 1.00 0.00 O ATOM 0 H ASP A 54 9.940 -9.780 8.499 1.00 0.00 H new ATOM 0 HA ASP A 54 10.189 -9.056 5.689 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.001 -10.012 7.900 1.00 0.00 H new ATOM 0 HB3 ASP A 54 12.509 -10.272 6.243 1.00 0.00 H new ATOM 810 N ASP A 55 9.023 -11.779 6.140 1.00 0.00 N ATOM 811 CA ASP A 55 8.681 -13.097 5.635 1.00 0.00 C ATOM 812 C ASP A 55 7.250 -13.114 5.108 1.00 0.00 C ATOM 813 O ASP A 55 6.358 -13.693 5.730 1.00 0.00 O ATOM 814 CB ASP A 55 8.840 -14.137 6.743 1.00 0.00 C ATOM 815 CG ASP A 55 8.666 -13.555 8.136 1.00 0.00 C ATOM 816 OD1 ASP A 55 7.507 -13.339 8.549 1.00 0.00 O ATOM 817 OD2 ASP A 55 9.689 -13.318 8.812 1.00 0.00 O ATOM 0 H ASP A 55 8.303 -11.358 6.727 1.00 0.00 H new ATOM 0 HA ASP A 55 9.356 -13.340 4.815 1.00 0.00 H new ATOM 0 HB2 ASP A 55 8.110 -14.932 6.594 1.00 0.00 H new ATOM 0 HB3 ASP A 55 9.827 -14.592 6.667 1.00 0.00 H new ATOM 822 N VAL A 56 7.031 -12.468 3.965 1.00 0.00 N ATOM 823 CA VAL A 56 5.695 -12.405 3.371 1.00 0.00 C ATOM 824 C VAL A 56 5.721 -11.725 2.003 1.00 0.00 C ATOM 825 O VAL A 56 6.785 -11.433 1.463 1.00 0.00 O ATOM 826 CB VAL A 56 4.698 -11.654 4.292 1.00 0.00 C ATOM 827 CG1 VAL A 56 3.874 -12.640 5.105 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.424 -10.677 5.211 1.00 0.00 C ATOM 0 H VAL A 56 7.755 -11.984 3.434 1.00 0.00 H new ATOM 0 HA VAL A 56 5.361 -13.435 3.250 1.00 0.00 H new ATOM 0 HB VAL A 56 4.024 -11.079 3.657 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.181 -12.094 5.745 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.313 -13.288 4.431 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.537 -13.246 5.722 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.699 -10.166 5.844 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.131 -11.222 5.836 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.962 -9.944 4.610 1.00 0.00 H new ATOM 838 N ARG A 57 4.536 -11.475 1.448 1.00 0.00 N ATOM 839 CA ARG A 57 4.410 -10.827 0.148 1.00 0.00 C ATOM 840 C ARG A 57 2.955 -10.447 -0.112 1.00 0.00 C ATOM 841 O ARG A 57 2.128 -11.301 -0.437 1.00 0.00 O ATOM 842 CB ARG A 57 4.933 -11.746 -0.962 1.00 0.00 C ATOM 843 CG ARG A 57 4.385 -13.164 -0.896 1.00 0.00 C ATOM 844 CD ARG A 57 3.460 -13.459 -2.066 1.00 0.00 C ATOM 845 NE ARG A 57 3.375 -14.891 -2.353 1.00 0.00 N ATOM 846 CZ ARG A 57 2.641 -15.752 -1.645 1.00 0.00 C ATOM 847 NH1 ARG A 57 1.949 -15.339 -0.589 1.00 0.00 N ATOM 848 NH2 ARG A 57 2.606 -17.034 -1.994 1.00 0.00 N ATOM 0 H ARG A 57 3.645 -11.714 1.884 1.00 0.00 H new ATOM 0 HA ARG A 57 5.011 -9.918 0.151 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.678 -11.313 -1.929 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.021 -11.784 -0.906 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.211 -13.875 -0.896 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.845 -13.303 0.040 1.00 0.00 H new ATOM 0 HD2 ARG A 57 2.464 -13.074 -1.846 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.817 -12.933 -2.951 1.00 0.00 H new ATOM 0 HE ARG A 57 3.909 -15.254 -3.143 1.00 0.00 H new ATOM 0 HH11 ARG A 57 1.976 -14.357 -0.314 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.391 -16.004 -0.053 1.00 0.00 H new ATOM 0 HH21 ARG A 57 3.139 -17.358 -2.801 1.00 0.00 H new ATOM 0 HH22 ARG A 57 2.046 -17.694 -1.455 1.00 0.00 H new ATOM 862 N LEU A 58 2.645 -9.164 0.055 1.00 0.00 N ATOM 863 CA LEU A 58 1.282 -8.674 -0.140 1.00 0.00 C ATOM 864 C LEU A 58 1.272 -7.225 -0.629 1.00 0.00 C ATOM 865 O LEU A 58 2.323 -6.598 -0.771 1.00 0.00 O ATOM 866 CB LEU A 58 0.492 -8.789 1.168 1.00 0.00 C ATOM 867 CG LEU A 58 1.251 -8.370 2.431 1.00 0.00 C ATOM 868 CD1 LEU A 58 0.988 -6.908 2.753 1.00 0.00 C ATOM 869 CD2 LEU A 58 0.861 -9.257 3.606 1.00 0.00 C ATOM 0 H LEU A 58 3.317 -8.446 0.324 1.00 0.00 H new ATOM 0 HA LEU A 58 0.811 -9.290 -0.906 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.407 -8.178 1.085 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.166 -9.822 1.286 1.00 0.00 H new ATOM 0 HG LEU A 58 2.318 -8.492 2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.536 -6.629 3.653 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.318 -6.287 1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.079 -6.758 2.917 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.410 -8.945 4.495 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.210 -9.167 3.790 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.104 -10.294 3.375 1.00 0.00 H new ATOM 881 N PHE A 59 0.072 -6.701 -0.884 1.00 0.00 N ATOM 882 CA PHE A 59 -0.083 -5.327 -1.356 1.00 0.00 C ATOM 883 C PHE A 59 -0.717 -4.444 -0.281 1.00 0.00 C ATOM 884 O PHE A 59 -1.160 -4.937 0.759 1.00 0.00 O ATOM 885 CB PHE A 59 -0.935 -5.290 -2.628 1.00 0.00 C ATOM 886 CG PHE A 59 -0.530 -6.313 -3.654 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.584 -6.108 -4.453 1.00 0.00 C ATOM 888 CD2 PHE A 59 -1.261 -7.478 -3.815 1.00 0.00 C ATOM 889 CE1 PHE A 59 0.959 -7.047 -5.395 1.00 0.00 C ATOM 890 CE2 PHE A 59 -0.890 -8.422 -4.755 1.00 0.00 C ATOM 891 CZ PHE A 59 0.221 -8.206 -5.546 1.00 0.00 C ATOM 0 H PHE A 59 -0.806 -7.208 -0.771 1.00 0.00 H new ATOM 0 HA PHE A 59 0.910 -4.938 -1.581 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.980 -5.450 -2.360 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -0.868 -4.297 -3.071 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.165 -5.205 -4.338 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -2.131 -7.651 -3.199 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.828 -6.875 -6.013 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.468 -9.327 -4.870 1.00 0.00 H new ATOM 0 HZ PHE A 59 0.513 -8.941 -6.281 1.00 0.00 H new ATOM 901 N ALA A 60 -0.751 -3.137 -0.538 1.00 0.00 N ATOM 902 CA ALA A 60 -1.323 -2.184 0.408 1.00 0.00 C ATOM 903 C ALA A 60 -1.889 -0.960 -0.308 1.00 0.00 C ATOM 904 O ALA A 60 -1.584 -0.716 -1.477 1.00 0.00 O ATOM 905 CB ALA A 60 -0.270 -1.759 1.421 1.00 0.00 C ATOM 0 H ALA A 60 -0.389 -2.716 -1.393 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.144 -2.677 0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.706 -1.048 2.123 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.086 -2.634 1.965 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.566 -1.290 0.902 1.00 0.00 H new ATOM 911 N PHE A 61 -2.713 -0.193 0.404 1.00 0.00 N ATOM 912 CA PHE A 61 -3.323 1.010 -0.156 1.00 0.00 C ATOM 913 C PHE A 61 -3.660 2.011 0.946 1.00 0.00 C ATOM 914 O PHE A 61 -4.582 1.790 1.735 1.00 0.00 O ATOM 915 CB PHE A 61 -4.587 0.652 -0.942 1.00 0.00 C ATOM 916 CG PHE A 61 -4.838 1.555 -2.117 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.307 1.255 -3.361 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.604 2.701 -1.976 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.536 2.081 -4.444 1.00 0.00 C ATOM 920 CE2 PHE A 61 -5.835 3.533 -3.057 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.300 3.221 -4.293 1.00 0.00 C ATOM 0 H PHE A 61 -2.973 -0.384 1.371 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.603 1.470 -0.833 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.507 -0.376 -1.295 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.446 0.693 -0.272 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.707 0.365 -3.485 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.025 2.947 -1.012 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.117 1.835 -5.409 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.432 4.425 -2.935 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.479 3.868 -5.139 1.00 0.00 H new ATOM 931 N VAL A 62 -2.908 3.110 0.997 1.00 0.00 N ATOM 932 CA VAL A 62 -3.128 4.144 2.005 1.00 0.00 C ATOM 933 C VAL A 62 -3.473 5.482 1.361 1.00 0.00 C ATOM 934 O VAL A 62 -2.878 5.868 0.350 1.00 0.00 O ATOM 935 CB VAL A 62 -1.891 4.333 2.908 1.00 0.00 C ATOM 936 CG1 VAL A 62 -2.233 5.204 4.109 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.337 2.986 3.356 1.00 0.00 C ATOM 0 H VAL A 62 -2.142 3.306 0.352 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.966 3.806 2.614 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.119 4.839 2.328 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.348 5.326 4.734 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.572 6.181 3.765 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.024 4.729 4.689 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.466 3.144 3.991 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.101 2.446 3.916 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.048 2.403 2.482 1.00 0.00 H new ATOM 947 N ARG A 63 -4.429 6.193 1.955 1.00 0.00 N ATOM 948 CA ARG A 63 -4.846 7.496 1.445 1.00 0.00 C ATOM 949 C ARG A 63 -4.075 8.613 2.142 1.00 0.00 C ATOM 950 O ARG A 63 -4.337 8.932 3.303 1.00 0.00 O ATOM 951 CB ARG A 63 -6.352 7.692 1.638 1.00 0.00 C ATOM 952 CG ARG A 63 -7.197 6.674 0.889 1.00 0.00 C ATOM 953 CD ARG A 63 -8.642 7.131 0.768 1.00 0.00 C ATOM 954 NE ARG A 63 -9.323 7.151 2.062 1.00 0.00 N ATOM 955 CZ ARG A 63 -10.445 7.831 2.304 1.00 0.00 C ATOM 956 NH1 ARG A 63 -11.018 8.550 1.343 1.00 0.00 N ATOM 957 NH2 ARG A 63 -10.997 7.791 3.511 1.00 0.00 N ATOM 0 H ARG A 63 -4.929 5.888 2.790 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.625 7.533 0.378 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.585 7.634 2.701 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.625 8.694 1.306 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.780 6.515 -0.105 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.159 5.716 1.408 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.671 8.128 0.328 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -9.176 6.467 0.088 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.915 6.612 2.826 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -10.600 8.584 0.413 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -11.876 9.067 1.536 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.563 7.241 4.252 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.855 8.311 3.697 1.00 0.00 H new ATOM 971 N PHE A 64 -3.115 9.198 1.428 1.00 0.00 N ATOM 972 CA PHE A 64 -2.295 10.274 1.977 1.00 0.00 C ATOM 973 C PHE A 64 -2.984 11.624 1.824 1.00 0.00 C ATOM 974 O PHE A 64 -3.625 11.892 0.808 1.00 0.00 O ATOM 975 CB PHE A 64 -0.929 10.307 1.291 1.00 0.00 C ATOM 976 CG PHE A 64 0.014 9.246 1.785 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.219 7.909 1.507 1.00 0.00 C ATOM 978 CD2 PHE A 64 1.131 9.587 2.530 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.644 6.932 1.964 1.00 0.00 C ATOM 980 CE2 PHE A 64 1.997 8.615 2.988 1.00 0.00 C ATOM 981 CZ PHE A 64 1.753 7.286 2.705 1.00 0.00 C ATOM 0 H PHE A 64 -2.886 8.944 0.467 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.157 10.078 3.040 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.068 10.187 0.216 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.476 11.286 1.447 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.085 7.627 0.926 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.326 10.625 2.755 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.451 5.893 1.742 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.865 8.894 3.567 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.429 6.524 3.063 1.00 0.00 H new ATOM 991 N THR A 65 -2.841 12.473 2.838 1.00 0.00 N ATOM 992 CA THR A 65 -3.444 13.802 2.814 1.00 0.00 C ATOM 993 C THR A 65 -2.397 14.875 3.086 1.00 0.00 C ATOM 994 O THR A 65 -1.742 14.868 4.131 1.00 0.00 O ATOM 995 CB THR A 65 -4.575 13.908 3.839 1.00 0.00 C ATOM 996 OG1 THR A 65 -5.218 12.658 4.019 1.00 0.00 O ATOM 997 CG2 THR A 65 -5.635 14.916 3.452 1.00 0.00 C ATOM 0 H THR A 65 -2.313 12.265 3.686 1.00 0.00 H new ATOM 0 HA THR A 65 -3.860 13.960 1.819 1.00 0.00 H new ATOM 0 HB THR A 65 -4.096 14.237 4.761 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.936 12.751 4.680 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.408 14.944 4.220 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.182 15.903 3.358 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.080 14.629 2.499 1.00 0.00 H new ATOM 1122 N SER A 74 -6.005 15.061 -1.089 1.00 0.00 N ATOM 1123 CA SER A 74 -5.849 13.627 -0.868 1.00 0.00 C ATOM 1124 C SER A 74 -5.109 12.969 -2.029 1.00 0.00 C ATOM 1125 O SER A 74 -5.199 13.420 -3.173 1.00 0.00 O ATOM 1126 CB SER A 74 -7.215 12.965 -0.674 1.00 0.00 C ATOM 1127 OG SER A 74 -7.120 11.846 0.189 1.00 0.00 O ATOM 0 HA SER A 74 -5.256 13.490 0.037 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.918 13.688 -0.261 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.611 12.651 -1.640 1.00 0.00 H new ATOM 0 HG SER A 74 -8.006 11.441 0.299 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.375 11.904 -1.721 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.609 11.175 -2.728 1.00 0.00 C ATOM 1135 C LYS A 75 -3.717 9.668 -2.504 1.00 0.00 C ATOM 1136 O LYS A 75 -3.681 9.197 -1.366 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.142 11.604 -2.689 1.00 0.00 C ATOM 1138 CG LYS A 75 -1.920 13.056 -3.085 1.00 0.00 C ATOM 1139 CD LYS A 75 -0.685 13.215 -3.959 1.00 0.00 C ATOM 1140 CE LYS A 75 0.482 13.801 -3.178 1.00 0.00 C ATOM 1141 NZ LYS A 75 0.338 15.271 -2.971 1.00 0.00 N ATOM 0 H LYS A 75 -4.294 11.525 -0.778 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.023 11.410 -3.708 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.753 11.447 -1.683 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.567 10.962 -3.357 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.795 13.426 -3.620 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.813 13.666 -2.188 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.400 12.245 -4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -0.918 13.861 -4.805 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.555 13.305 -2.210 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.411 13.600 -3.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.155 15.628 -2.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.294 15.749 -3.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.535 15.463 -2.440 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.849 8.919 -3.596 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.964 7.464 -3.520 1.00 0.00 C ATOM 1157 C PHE A 76 -2.661 6.793 -3.942 1.00 0.00 C ATOM 1158 O PHE A 76 -2.166 7.019 -5.048 1.00 0.00 O ATOM 1159 CB PHE A 76 -5.112 6.970 -4.406 1.00 0.00 C ATOM 1160 CG PHE A 76 -6.417 7.665 -4.144 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -7.058 7.531 -2.922 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -7.004 8.454 -5.120 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -8.259 8.170 -2.679 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -8.205 9.095 -4.884 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.833 8.953 -3.662 1.00 0.00 C ATOM 0 H PHE A 76 -3.879 9.295 -4.544 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.174 7.198 -2.484 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.839 7.111 -5.452 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.243 5.899 -4.252 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.613 6.920 -2.151 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.517 8.569 -6.077 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.748 8.058 -1.723 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.652 9.706 -5.654 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.772 9.453 -3.475 1.00 0.00 H new ATOM 1175 N ALA A 77 -2.112 5.966 -3.056 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.868 5.258 -3.334 1.00 0.00 C ATOM 1177 C ALA A 77 -0.951 3.804 -2.886 1.00 0.00 C ATOM 1178 O ALA A 77 -1.439 3.508 -1.793 1.00 0.00 O ATOM 1179 CB ALA A 77 0.305 5.954 -2.657 1.00 0.00 C ATOM 0 H ALA A 77 -2.511 5.770 -2.138 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.709 5.271 -4.412 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.225 5.412 -2.875 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.388 6.974 -3.031 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.143 5.975 -1.579 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.467 2.902 -3.736 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.479 1.476 -3.429 1.00 0.00 C ATOM 1187 C LEU A 78 0.931 0.989 -3.113 1.00 0.00 C ATOM 1188 O LEU A 78 1.774 0.864 -4.005 1.00 0.00 O ATOM 1189 CB LEU A 78 -1.076 0.673 -4.590 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.538 1.026 -5.980 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -0.340 -0.230 -6.812 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -1.479 1.993 -6.687 1.00 0.00 C ATOM 0 H LEU A 78 -0.062 3.134 -4.643 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.106 1.321 -2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.895 -0.386 -4.407 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.157 0.816 -4.590 1.00 0.00 H new ATOM 0 HG LEU A 78 0.430 1.513 -5.860 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.043 0.042 -7.796 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.373 -0.887 -6.314 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.293 -0.747 -6.924 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.081 2.233 -7.673 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.461 1.532 -6.794 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.569 2.907 -6.100 1.00 0.00 H new ATOM 1204 N ILE A 79 1.182 0.728 -1.834 1.00 0.00 N ATOM 1205 CA ILE A 79 2.491 0.265 -1.386 1.00 0.00 C ATOM 1206 C ILE A 79 2.570 -1.258 -1.398 1.00 0.00 C ATOM 1207 O ILE A 79 1.780 -1.935 -0.739 1.00 0.00 O ATOM 1208 CB ILE A 79 2.816 0.778 0.033 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.542 2.283 0.139 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.263 0.474 0.392 1.00 0.00 C ATOM 1211 CD1 ILE A 79 1.557 2.643 1.231 1.00 0.00 C ATOM 0 H ILE A 79 0.494 0.830 -1.088 1.00 0.00 H new ATOM 0 HA ILE A 79 3.224 0.668 -2.084 1.00 0.00 H new ATOM 0 HB ILE A 79 2.169 0.260 0.741 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.482 2.803 0.323 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.160 2.643 -0.816 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.474 0.843 1.396 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.427 -0.603 0.359 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.926 0.964 -0.321 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.411 3.723 1.248 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.604 2.151 1.038 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.946 2.314 2.195 1.00 0.00 H new ATOM 1223 N THR A 80 3.531 -1.787 -2.150 1.00 0.00 N ATOM 1224 CA THR A 80 3.726 -3.231 -2.246 1.00 0.00 C ATOM 1225 C THR A 80 4.808 -3.686 -1.273 1.00 0.00 C ATOM 1226 O THR A 80 5.937 -3.195 -1.320 1.00 0.00 O ATOM 1227 CB THR A 80 4.109 -3.627 -3.677 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.427 -2.826 -4.626 1.00 0.00 O ATOM 1229 CG2 THR A 80 3.809 -5.076 -4.001 1.00 0.00 C ATOM 0 H THR A 80 4.188 -1.236 -2.703 1.00 0.00 H new ATOM 0 HA THR A 80 2.788 -3.722 -1.986 1.00 0.00 H new ATOM 0 HB THR A 80 5.187 -3.473 -3.734 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.689 -3.096 -5.531 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.105 -5.288 -5.029 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.365 -5.723 -3.323 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.741 -5.261 -3.885 1.00 0.00 H new ATOM 1237 N TRP A 81 4.463 -4.623 -0.393 1.00 0.00 N ATOM 1238 CA TRP A 81 5.415 -5.134 0.587 1.00 0.00 C ATOM 1239 C TRP A 81 5.787 -6.582 0.285 1.00 0.00 C ATOM 1240 O TRP A 81 4.921 -7.413 0.010 1.00 0.00 O ATOM 1241 CB TRP A 81 4.844 -5.028 2.003 1.00 0.00 C ATOM 1242 CG TRP A 81 5.704 -5.698 3.033 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.449 -6.874 3.676 1.00 0.00 C ATOM 1244 CD2 TRP A 81 6.965 -5.234 3.524 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.476 -7.172 4.540 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.419 -6.177 4.466 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.757 -4.112 3.260 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.626 -6.032 5.143 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 8.955 -3.970 3.933 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.379 -4.925 4.864 1.00 0.00 C ATOM 0 H TRP A 81 3.535 -5.042 -0.339 1.00 0.00 H new ATOM 0 HA TRP A 81 6.316 -4.524 0.523 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.727 -3.976 2.264 1.00 0.00 H new ATOM 0 HB3 TRP A 81 3.850 -5.474 2.022 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.569 -7.482 3.528 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.529 -7.997 5.138 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.438 -3.370 2.543 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 8.956 -6.767 5.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.575 -3.107 3.737 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.321 -4.785 5.373 1.00 0.00 H new ATOM 1261 N ILE A 82 7.083 -6.876 0.346 1.00 0.00 N ATOM 1262 CA ILE A 82 7.576 -8.223 0.088 1.00 0.00 C ATOM 1263 C ILE A 82 8.658 -8.613 1.094 1.00 0.00 C ATOM 1264 O ILE A 82 9.795 -8.145 1.012 1.00 0.00 O ATOM 1265 CB ILE A 82 8.142 -8.359 -1.343 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.141 -7.825 -2.372 1.00 0.00 C ATOM 1267 CG2 ILE A 82 8.489 -9.813 -1.640 1.00 0.00 C ATOM 1268 CD1 ILE A 82 7.654 -7.863 -3.795 1.00 0.00 C ATOM 0 H ILE A 82 7.810 -6.198 0.572 1.00 0.00 H new ATOM 0 HA ILE A 82 6.724 -8.895 0.193 1.00 0.00 H new ATOM 0 HB ILE A 82 9.053 -7.764 -1.412 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.223 -8.409 -2.310 1.00 0.00 H new ATOM 0 HG13 ILE A 82 6.883 -6.798 -2.115 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.887 -9.893 -2.652 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.237 -10.161 -0.928 1.00 0.00 H new ATOM 0 HG23 ILE A 82 7.592 -10.426 -1.553 1.00 0.00 H new ATOM 0 HD11 ILE A 82 6.891 -7.470 -4.467 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.555 -7.255 -3.873 1.00 0.00 H new ATOM 0 HD13 ILE A 82 7.885 -8.892 -4.071 1.00 0.00 H new ATOM 1280 N GLY A 83 8.297 -9.481 2.036 1.00 0.00 N ATOM 1281 CA GLY A 83 9.245 -9.935 3.037 1.00 0.00 C ATOM 1282 C GLY A 83 10.322 -10.815 2.429 1.00 0.00 C ATOM 1283 O GLY A 83 10.024 -11.886 1.896 1.00 0.00 O ATOM 0 H GLY A 83 7.362 -9.878 2.123 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.707 -9.073 3.518 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.718 -10.489 3.814 1.00 0.00 H new ATOM 1287 N GLU A 84 11.570 -10.339 2.500 1.00 0.00 N ATOM 1288 CA GLU A 84 12.738 -11.041 1.940 1.00 0.00 C ATOM 1289 C GLU A 84 12.701 -12.557 2.103 1.00 0.00 C ATOM 1290 O GLU A 84 13.254 -13.274 1.268 1.00 0.00 O ATOM 1291 CB GLU A 84 14.029 -10.534 2.567 1.00 0.00 C ATOM 1292 CG GLU A 84 13.881 -10.058 4.007 1.00 0.00 C ATOM 1293 CD GLU A 84 15.159 -10.202 4.809 1.00 0.00 C ATOM 1294 OE1 GLU A 84 16.106 -9.424 4.564 1.00 0.00 O ATOM 1295 OE2 GLU A 84 15.215 -11.093 5.682 1.00 0.00 O ATOM 0 H GLU A 84 11.803 -9.453 2.948 1.00 0.00 H new ATOM 0 HA GLU A 84 12.701 -10.822 0.873 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.772 -11.330 2.534 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.415 -9.713 1.963 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.572 -9.013 4.009 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.087 -10.626 4.492 1.00 0.00 H new ATOM 1302 N ASN A 85 12.071 -13.059 3.164 1.00 0.00 N ATOM 1303 CA ASN A 85 12.004 -14.502 3.392 1.00 0.00 C ATOM 1304 C ASN A 85 11.042 -15.192 2.419 1.00 0.00 C ATOM 1305 O ASN A 85 10.366 -16.159 2.773 1.00 0.00 O ATOM 1306 CB ASN A 85 11.603 -14.788 4.841 1.00 0.00 C ATOM 1307 CG ASN A 85 12.781 -14.676 5.781 1.00 0.00 C ATOM 1308 OD1 ASN A 85 13.207 -15.662 6.386 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.315 -13.469 5.910 1.00 0.00 N ATOM 0 H ASN A 85 11.604 -12.494 3.873 1.00 0.00 H new ATOM 0 HA ASN A 85 12.997 -14.913 3.209 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.825 -14.089 5.148 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.177 -15.789 4.910 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.112 -13.328 6.530 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.929 -12.682 5.389 1.00 0.00 H new ATOM 1316 N VAL A 86 11.009 -14.702 1.183 1.00 0.00 N ATOM 1317 CA VAL A 86 10.157 -15.280 0.145 1.00 0.00 C ATOM 1318 C VAL A 86 11.002 -16.002 -0.901 1.00 0.00 C ATOM 1319 O VAL A 86 11.945 -15.430 -1.451 1.00 0.00 O ATOM 1320 CB VAL A 86 9.289 -14.216 -0.562 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.135 -13.781 0.329 1.00 0.00 C ATOM 1322 CG2 VAL A 86 10.130 -13.019 -0.982 1.00 0.00 C ATOM 0 H VAL A 86 11.564 -13.904 0.874 1.00 0.00 H new ATOM 0 HA VAL A 86 9.494 -15.986 0.645 1.00 0.00 H new ATOM 0 HB VAL A 86 8.871 -14.666 -1.463 1.00 0.00 H new ATOM 0 HG11 VAL A 86 7.537 -13.031 -0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 86 7.511 -14.644 0.564 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.528 -13.356 1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.495 -12.284 -1.478 1.00 0.00 H new ATOM 0 HG22 VAL A 86 10.587 -12.568 -0.101 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.911 -13.346 -1.669 1.00 0.00 H new ATOM 1332 N SER A 87 10.660 -17.258 -1.175 1.00 0.00 N ATOM 1333 CA SER A 87 11.397 -18.045 -2.159 1.00 0.00 C ATOM 1334 C SER A 87 11.144 -17.524 -3.571 1.00 0.00 C ATOM 1335 O SER A 87 10.272 -16.677 -3.783 1.00 0.00 O ATOM 1336 CB SER A 87 11.012 -19.525 -2.065 1.00 0.00 C ATOM 1337 OG SER A 87 11.977 -20.253 -1.326 1.00 0.00 O ATOM 0 H SER A 87 9.883 -17.750 -0.733 1.00 0.00 H new ATOM 0 HA SER A 87 12.460 -17.946 -1.940 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.036 -19.621 -1.590 1.00 0.00 H new ATOM 0 HB3 SER A 87 10.922 -19.946 -3.067 1.00 0.00 H new ATOM 0 HG SER A 87 11.710 -21.195 -1.277 1.00 0.00 H new ATOM 1343 N GLY A 88 11.913 -18.034 -4.534 1.00 0.00 N ATOM 1344 CA GLY A 88 11.760 -17.611 -5.917 1.00 0.00 C ATOM 1345 C GLY A 88 10.323 -17.687 -6.396 1.00 0.00 C ATOM 1346 O GLY A 88 9.843 -16.780 -7.077 1.00 0.00 O ATOM 0 H GLY A 88 12.639 -18.733 -4.380 1.00 0.00 H new ATOM 0 HA2 GLY A 88 12.120 -16.588 -6.022 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.385 -18.236 -6.555 1.00 0.00 H new ATOM 1350 N LEU A 89 9.633 -18.768 -6.032 1.00 0.00 N ATOM 1351 CA LEU A 89 8.238 -18.959 -6.420 1.00 0.00 C ATOM 1352 C LEU A 89 7.351 -17.873 -5.813 1.00 0.00 C ATOM 1353 O LEU A 89 6.501 -17.299 -6.497 1.00 0.00 O ATOM 1354 CB LEU A 89 7.749 -20.343 -5.982 1.00 0.00 C ATOM 1355 CG LEU A 89 6.904 -21.094 -7.013 1.00 0.00 C ATOM 1356 CD1 LEU A 89 7.732 -21.433 -8.244 1.00 0.00 C ATOM 1357 CD2 LEU A 89 6.321 -22.356 -6.398 1.00 0.00 C ATOM 0 H LEU A 89 10.019 -19.525 -5.468 1.00 0.00 H new ATOM 0 HA LEU A 89 8.175 -18.888 -7.506 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.616 -20.954 -5.732 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.164 -20.231 -5.069 1.00 0.00 H new ATOM 0 HG LEU A 89 6.083 -20.447 -7.323 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.112 -21.967 -8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.104 -20.514 -8.697 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.574 -22.062 -7.954 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.722 -22.880 -7.143 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.130 -23.004 -6.061 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.692 -22.090 -5.549 1.00 0.00 H new ATOM 1369 N GLN A 90 7.563 -17.590 -4.527 1.00 0.00 N ATOM 1370 CA GLN A 90 6.793 -16.567 -3.822 1.00 0.00 C ATOM 1371 C GLN A 90 7.005 -15.192 -4.456 1.00 0.00 C ATOM 1372 O GLN A 90 6.055 -14.424 -4.616 1.00 0.00 O ATOM 1373 CB GLN A 90 7.192 -16.528 -2.345 1.00 0.00 C ATOM 1374 CG GLN A 90 6.303 -17.377 -1.450 1.00 0.00 C ATOM 1375 CD GLN A 90 6.848 -18.778 -1.239 1.00 0.00 C ATOM 1376 OE1 GLN A 90 7.984 -18.954 -0.799 1.00 0.00 O ATOM 1377 NE2 GLN A 90 6.040 -19.785 -1.555 1.00 0.00 N ATOM 0 H GLN A 90 8.264 -18.057 -3.952 1.00 0.00 H new ATOM 0 HA GLN A 90 5.736 -16.824 -3.900 1.00 0.00 H new ATOM 0 HB2 GLN A 90 8.223 -16.869 -2.247 1.00 0.00 H new ATOM 0 HB3 GLN A 90 7.163 -15.495 -1.997 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.193 -16.885 -0.483 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.308 -17.442 -1.890 1.00 0.00 H new ATOM 0 HE21 GLN A 90 5.105 -19.595 -1.917 1.00 0.00 H new ATOM 0 HE22 GLN A 90 6.354 -20.748 -1.436 1.00 0.00 H new ATOM 1386 N ARG A 91 8.254 -14.893 -4.817 1.00 0.00 N ATOM 1387 CA ARG A 91 8.592 -13.615 -5.440 1.00 0.00 C ATOM 1388 C ARG A 91 7.849 -13.448 -6.764 1.00 0.00 C ATOM 1389 O ARG A 91 7.274 -12.390 -7.032 1.00 0.00 O ATOM 1390 CB ARG A 91 10.103 -13.517 -5.665 1.00 0.00 C ATOM 1391 CG ARG A 91 10.590 -12.106 -5.945 1.00 0.00 C ATOM 1392 CD ARG A 91 12.109 -12.046 -6.012 1.00 0.00 C ATOM 1393 NE ARG A 91 12.576 -11.241 -7.139 1.00 0.00 N ATOM 1394 CZ ARG A 91 12.468 -9.912 -7.208 1.00 0.00 C ATOM 1395 NH1 ARG A 91 11.908 -9.228 -6.214 1.00 0.00 N ATOM 1396 NH2 ARG A 91 12.920 -9.267 -8.277 1.00 0.00 N ATOM 0 H ARG A 91 9.048 -15.520 -4.688 1.00 0.00 H new ATOM 0 HA ARG A 91 8.284 -12.814 -4.768 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.618 -13.901 -4.784 1.00 0.00 H new ATOM 0 HB3 ARG A 91 10.379 -14.159 -6.501 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.169 -11.754 -6.887 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.232 -11.434 -5.165 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.497 -11.628 -5.083 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.508 -13.057 -6.098 1.00 0.00 H new ATOM 0 HE ARG A 91 13.012 -11.726 -7.923 1.00 0.00 H new ATOM 0 HH11 ARG A 91 11.557 -9.719 -5.391 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.829 -8.213 -6.274 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.348 -9.787 -9.043 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.839 -8.252 -8.332 1.00 0.00 H new ATOM 1410 N ALA A 92 7.860 -14.501 -7.583 1.00 0.00 N ATOM 1411 CA ALA A 92 7.181 -14.480 -8.878 1.00 0.00 C ATOM 1412 C ALA A 92 5.681 -14.243 -8.713 1.00 0.00 C ATOM 1413 O ALA A 92 5.060 -13.564 -9.533 1.00 0.00 O ATOM 1414 CB ALA A 92 7.433 -15.780 -9.626 1.00 0.00 C ATOM 0 H ALA A 92 8.333 -15.380 -7.371 1.00 0.00 H new ATOM 0 HA ALA A 92 7.589 -13.653 -9.459 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.922 -15.751 -10.588 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.504 -15.905 -9.787 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.054 -16.617 -9.039 1.00 0.00 H new ATOM 1420 N LYS A 93 5.106 -14.806 -7.647 1.00 0.00 N ATOM 1421 CA LYS A 93 3.680 -14.657 -7.368 1.00 0.00 C ATOM 1422 C LYS A 93 3.292 -13.183 -7.294 1.00 0.00 C ATOM 1423 O LYS A 93 2.394 -12.734 -8.007 1.00 0.00 O ATOM 1424 CB LYS A 93 3.320 -15.353 -6.054 1.00 0.00 C ATOM 1425 CG LYS A 93 3.027 -16.836 -6.206 1.00 0.00 C ATOM 1426 CD LYS A 93 1.766 -17.075 -7.021 1.00 0.00 C ATOM 1427 CE LYS A 93 2.090 -17.662 -8.387 1.00 0.00 C ATOM 1428 NZ LYS A 93 1.023 -17.371 -9.386 1.00 0.00 N ATOM 0 H LYS A 93 5.610 -15.370 -6.963 1.00 0.00 H new ATOM 0 HA LYS A 93 3.126 -15.122 -8.183 1.00 0.00 H new ATOM 0 HB2 LYS A 93 4.141 -15.225 -5.349 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.448 -14.862 -5.621 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.872 -17.327 -6.689 1.00 0.00 H new ATOM 0 HG3 LYS A 93 2.916 -17.289 -5.221 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.104 -17.752 -6.480 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.228 -16.135 -7.146 1.00 0.00 H new ATOM 0 HE2 LYS A 93 3.038 -17.257 -8.740 1.00 0.00 H new ATOM 0 HE3 LYS A 93 2.218 -18.741 -8.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.214 -17.899 -10.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.100 -17.659 -9.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.009 -16.352 -9.593 1.00 0.00 H new ATOM 1442 N THR A 94 3.982 -12.436 -6.429 1.00 0.00 N ATOM 1443 CA THR A 94 3.717 -11.007 -6.260 1.00 0.00 C ATOM 1444 C THR A 94 3.843 -10.270 -7.592 1.00 0.00 C ATOM 1445 O THR A 94 3.061 -9.364 -7.881 1.00 0.00 O ATOM 1446 CB THR A 94 4.678 -10.391 -5.232 1.00 0.00 C ATOM 1447 OG1 THR A 94 5.604 -11.353 -4.753 1.00 0.00 O ATOM 1448 CG2 THR A 94 3.966 -9.802 -4.032 1.00 0.00 C ATOM 0 H THR A 94 4.728 -12.798 -5.835 1.00 0.00 H new ATOM 0 HA THR A 94 2.696 -10.900 -5.894 1.00 0.00 H new ATOM 0 HB THR A 94 5.191 -9.591 -5.766 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.196 -11.629 -5.483 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.700 -9.383 -3.343 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.287 -9.016 -4.362 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.398 -10.583 -3.526 1.00 0.00 H new ATOM 1456 N GLY A 95 4.825 -10.669 -8.403 1.00 0.00 N ATOM 1457 CA GLY A 95 5.027 -10.040 -9.696 1.00 0.00 C ATOM 1458 C GLY A 95 3.805 -10.136 -10.596 1.00 0.00 C ATOM 1459 O GLY A 95 3.406 -9.147 -11.212 1.00 0.00 O ATOM 0 H GLY A 95 5.483 -11.417 -8.185 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.282 -8.991 -9.548 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.877 -10.508 -10.194 1.00 0.00 H new ATOM 1463 N THR A 96 3.207 -11.325 -10.668 1.00 0.00 N ATOM 1464 CA THR A 96 2.020 -11.543 -11.499 1.00 0.00 C ATOM 1465 C THR A 96 0.774 -10.948 -10.846 1.00 0.00 C ATOM 1466 O THR A 96 -0.025 -10.284 -11.509 1.00 0.00 O ATOM 1467 CB THR A 96 1.803 -13.039 -11.763 1.00 0.00 C ATOM 1468 OG1 THR A 96 2.466 -13.834 -10.790 1.00 0.00 O ATOM 1469 CG2 THR A 96 2.286 -13.480 -13.128 1.00 0.00 C ATOM 0 H THR A 96 3.524 -12.152 -10.162 1.00 0.00 H new ATOM 0 HA THR A 96 2.190 -11.038 -12.450 1.00 0.00 H new ATOM 0 HB THR A 96 0.724 -13.183 -11.711 1.00 0.00 H new ATOM 0 HG1 THR A 96 2.310 -14.782 -10.981 1.00 0.00 H new ATOM 0 HG21 THR A 96 2.103 -14.548 -13.251 1.00 0.00 H new ATOM 0 HG22 THR A 96 1.749 -12.929 -13.900 1.00 0.00 H new ATOM 0 HG23 THR A 96 3.354 -13.282 -13.218 1.00 0.00 H new ATOM 1477 N ASP A 97 0.614 -11.196 -9.545 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.538 -10.690 -8.801 1.00 0.00 C ATOM 1479 C ASP A 97 -0.599 -9.162 -8.843 1.00 0.00 C ATOM 1480 O ASP A 97 -1.682 -8.581 -8.955 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.493 -11.181 -7.350 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.942 -12.627 -7.200 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -0.456 -13.487 -7.967 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -1.769 -12.903 -6.307 1.00 0.00 O ATOM 0 H ASP A 97 1.268 -11.744 -8.986 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.440 -11.075 -9.277 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.523 -11.080 -6.969 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.129 -10.543 -6.736 1.00 0.00 H new ATOM 1489 N LYS A 98 0.568 -8.516 -8.766 1.00 0.00 N ATOM 1490 CA LYS A 98 0.643 -7.054 -8.809 1.00 0.00 C ATOM 1491 C LYS A 98 0.038 -6.516 -10.104 1.00 0.00 C ATOM 1492 O LYS A 98 -0.548 -5.433 -10.121 1.00 0.00 O ATOM 1493 CB LYS A 98 2.097 -6.587 -8.683 1.00 0.00 C ATOM 1494 CG LYS A 98 2.240 -5.110 -8.341 1.00 0.00 C ATOM 1495 CD LYS A 98 2.458 -4.262 -9.585 1.00 0.00 C ATOM 1496 CE LYS A 98 3.594 -3.268 -9.392 1.00 0.00 C ATOM 1497 NZ LYS A 98 4.674 -3.450 -10.402 1.00 0.00 N ATOM 0 H LYS A 98 1.471 -8.981 -8.674 1.00 0.00 H new ATOM 0 HA LYS A 98 0.070 -6.664 -7.968 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.593 -7.178 -7.914 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.615 -6.785 -9.621 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.345 -4.769 -7.821 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.078 -4.974 -7.657 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.680 -4.909 -10.433 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.541 -3.725 -9.826 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.203 -2.253 -9.459 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.010 -3.384 -8.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.427 -2.753 -10.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.066 -4.410 -10.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.283 -3.314 -11.356 1.00 0.00 H new ATOM 1511 N THR A 99 0.175 -7.285 -11.185 1.00 0.00 N ATOM 1512 CA THR A 99 -0.368 -6.891 -12.482 1.00 0.00 C ATOM 1513 C THR A 99 -1.894 -6.967 -12.467 1.00 0.00 C ATOM 1514 O THR A 99 -2.574 -6.073 -12.975 1.00 0.00 O ATOM 1515 CB THR A 99 0.197 -7.787 -13.591 1.00 0.00 C ATOM 1516 OG1 THR A 99 1.613 -7.814 -13.542 1.00 0.00 O ATOM 1517 CG2 THR A 99 -0.204 -7.348 -14.985 1.00 0.00 C ATOM 0 H THR A 99 0.657 -8.184 -11.186 1.00 0.00 H new ATOM 0 HA THR A 99 -0.073 -5.861 -12.681 1.00 0.00 H new ATOM 0 HB THR A 99 -0.226 -8.774 -13.404 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.903 -8.291 -12.737 1.00 0.00 H new ATOM 0 HG21 THR A 99 0.231 -8.026 -15.719 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.290 -7.365 -15.073 1.00 0.00 H new ATOM 0 HG23 THR A 99 0.159 -6.336 -15.166 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.421 -8.038 -11.874 1.00 0.00 N ATOM 1526 CA LEU A 100 -3.860 -8.242 -11.779 1.00 0.00 C ATOM 1527 C LEU A 100 -4.522 -7.124 -10.973 1.00 0.00 C ATOM 1528 O LEU A 100 -5.506 -6.529 -11.414 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.153 -9.596 -11.131 1.00 0.00 C ATOM 1530 CG LEU A 100 -3.499 -10.801 -11.817 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -3.201 -11.897 -10.807 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -4.390 -11.333 -12.929 1.00 0.00 C ATOM 0 H LEU A 100 -1.865 -8.781 -11.450 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.274 -8.226 -12.787 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.821 -9.564 -10.093 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.232 -9.748 -11.116 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.557 -10.472 -12.256 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.737 -12.743 -11.314 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.522 -11.515 -10.045 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.130 -12.221 -10.337 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.908 -12.188 -13.404 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.348 -11.642 -12.511 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.553 -10.551 -13.670 1.00 0.00 H new ATOM 1544 N VAL A 101 -3.973 -6.844 -9.788 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.508 -5.795 -8.919 1.00 0.00 C ATOM 1546 C VAL A 101 -4.414 -4.419 -9.586 1.00 0.00 C ATOM 1547 O VAL A 101 -5.299 -3.577 -9.414 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.778 -5.768 -7.553 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -2.316 -5.376 -7.719 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -4.482 -4.829 -6.581 1.00 0.00 C ATOM 0 H VAL A 101 -3.159 -7.329 -9.410 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.559 -6.028 -8.747 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.810 -6.775 -7.138 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -1.829 -5.365 -6.744 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -1.817 -6.098 -8.366 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.254 -4.384 -8.166 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.952 -4.826 -5.629 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.493 -3.820 -6.993 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -5.506 -5.168 -6.425 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.345 -4.202 -10.354 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.143 -2.935 -11.055 1.00 0.00 C ATOM 1562 C LYS A 102 -4.258 -2.696 -12.071 1.00 0.00 C ATOM 1563 O LYS A 102 -4.767 -1.580 -12.196 1.00 0.00 O ATOM 1564 CB LYS A 102 -1.783 -2.928 -11.762 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.216 -1.534 -11.992 1.00 0.00 C ATOM 1566 CD LYS A 102 -1.830 -0.875 -13.218 1.00 0.00 C ATOM 1567 CE LYS A 102 -0.825 0.012 -13.940 1.00 0.00 C ATOM 1568 NZ LYS A 102 -1.495 1.030 -14.798 1.00 0.00 N ATOM 0 H LYS A 102 -2.606 -4.888 -10.506 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.165 -2.132 -10.318 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.073 -3.505 -11.169 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.881 -3.433 -12.723 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.402 -0.915 -11.114 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.135 -1.596 -12.115 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.195 -1.643 -13.900 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.692 -0.279 -12.918 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.193 0.514 -13.208 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.171 -0.607 -14.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -0.775 1.613 -15.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.078 0.551 -15.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.099 1.637 -14.209 1.00 0.00 H new ATOM 1582 N GLU A 103 -4.639 -3.754 -12.788 1.00 0.00 N ATOM 1583 CA GLU A 103 -5.702 -3.667 -13.787 1.00 0.00 C ATOM 1584 C GLU A 103 -7.033 -3.294 -13.134 1.00 0.00 C ATOM 1585 O GLU A 103 -7.819 -2.533 -13.702 1.00 0.00 O ATOM 1586 CB GLU A 103 -5.839 -4.996 -14.534 1.00 0.00 C ATOM 1587 CG GLU A 103 -4.971 -5.085 -15.779 1.00 0.00 C ATOM 1588 CD GLU A 103 -5.610 -4.422 -16.985 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -5.626 -3.173 -17.037 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -6.093 -5.150 -17.877 1.00 0.00 O ATOM 0 H GLU A 103 -4.226 -4.682 -12.694 1.00 0.00 H new ATOM 0 HA GLU A 103 -5.436 -2.885 -14.499 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.577 -5.811 -13.859 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -6.882 -5.139 -14.817 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -4.007 -4.616 -15.580 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -4.775 -6.133 -16.007 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.274 -3.832 -11.938 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.506 -3.555 -11.201 1.00 0.00 C ATOM 1599 C VAL A 104 -8.599 -2.076 -10.830 1.00 0.00 C ATOM 1600 O VAL A 104 -9.649 -1.453 -10.991 1.00 0.00 O ATOM 1601 CB VAL A 104 -8.603 -4.411 -9.916 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -9.944 -4.202 -9.227 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -8.391 -5.886 -10.233 1.00 0.00 C ATOM 0 H VAL A 104 -6.631 -4.463 -11.459 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.336 -3.815 -11.858 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.815 -4.089 -9.236 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.989 -4.814 -8.326 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -10.055 -3.152 -8.958 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.749 -4.491 -9.903 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.463 -6.469 -9.315 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.154 -6.220 -10.937 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.404 -6.025 -10.674 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.491 -1.518 -10.338 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.446 -0.112 -9.950 1.00 0.00 C ATOM 1615 C VAL A 105 -6.369 0.633 -10.733 1.00 0.00 C ATOM 1616 O VAL A 105 -5.186 0.576 -10.392 1.00 0.00 O ATOM 1617 CB VAL A 105 -7.184 0.053 -8.437 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -7.328 1.511 -8.022 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -8.125 -0.830 -7.632 1.00 0.00 C ATOM 0 H VAL A 105 -6.614 -2.021 -10.200 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.422 0.314 -10.182 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.160 -0.260 -8.231 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -7.139 1.605 -6.953 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.609 2.119 -8.572 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.338 1.854 -8.244 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.925 -0.700 -6.568 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -9.157 -0.550 -7.844 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.968 -1.873 -7.906 1.00 0.00 H new ATOM 1629 N GLN A 106 -6.789 1.326 -11.789 1.00 0.00 N ATOM 1630 CA GLN A 106 -5.863 2.082 -12.630 1.00 0.00 C ATOM 1631 C GLN A 106 -5.786 3.550 -12.203 1.00 0.00 C ATOM 1632 O GLN A 106 -4.781 4.220 -12.451 1.00 0.00 O ATOM 1633 CB GLN A 106 -6.282 1.980 -14.100 1.00 0.00 C ATOM 1634 CG GLN A 106 -5.772 0.721 -14.788 1.00 0.00 C ATOM 1635 CD GLN A 106 -6.578 0.359 -16.022 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -6.184 0.670 -17.146 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -7.711 -0.305 -15.819 1.00 0.00 N ATOM 0 H GLN A 106 -7.764 1.380 -12.083 1.00 0.00 H new ATOM 0 HA GLN A 106 -4.871 1.648 -12.508 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.370 2.004 -14.163 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -5.913 2.854 -14.637 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -4.729 0.863 -15.070 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -5.801 -0.110 -14.083 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -8.000 -0.543 -14.870 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -8.292 -0.577 -16.612 1.00 0.00 H new ATOM 1646 N ASN A 107 -6.846 4.046 -11.560 1.00 0.00 N ATOM 1647 CA ASN A 107 -6.886 5.432 -11.100 1.00 0.00 C ATOM 1648 C ASN A 107 -6.115 5.594 -9.790 1.00 0.00 C ATOM 1649 O ASN A 107 -6.701 5.570 -8.706 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.335 5.894 -10.914 1.00 0.00 C ATOM 1651 CG ASN A 107 -8.922 6.500 -12.175 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -8.383 7.460 -12.724 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -10.033 5.941 -12.640 1.00 0.00 N ATOM 0 H ASN A 107 -7.686 3.508 -11.347 1.00 0.00 H new ATOM 0 HA ASN A 107 -6.412 6.052 -11.860 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.946 5.046 -10.605 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.378 6.628 -10.109 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.473 6.307 -13.484 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.446 5.146 -12.153 1.00 0.00 H new ATOM 1660 N PHE A 108 -4.799 5.759 -9.900 1.00 0.00 N ATOM 1661 CA PHE A 108 -3.943 5.928 -8.726 1.00 0.00 C ATOM 1662 C PHE A 108 -2.925 7.046 -8.950 1.00 0.00 C ATOM 1663 O PHE A 108 -2.736 7.508 -10.077 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.224 4.616 -8.392 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.484 4.013 -9.554 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.267 4.534 -9.964 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.006 2.925 -10.234 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -0.586 3.983 -11.031 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.328 2.369 -11.302 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.118 2.898 -11.701 1.00 0.00 C ATOM 0 H PHE A 108 -4.301 5.779 -10.790 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.577 6.205 -7.883 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.520 4.796 -7.580 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.955 3.895 -8.026 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.846 5.381 -9.443 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.953 2.507 -9.926 1.00 0.00 H new ATOM 0 HE1 PHE A 108 0.361 4.399 -11.341 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -2.745 1.521 -11.824 1.00 0.00 H new ATOM 0 HZ PHE A 108 -0.587 2.465 -12.536 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.271 7.478 -7.871 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.276 8.544 -7.955 1.00 0.00 C ATOM 1682 C ALA A 109 0.142 7.979 -7.979 1.00 0.00 C ATOM 1683 O ALA A 109 0.919 8.273 -8.889 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.438 9.517 -6.795 1.00 0.00 C ATOM 0 H ALA A 109 -2.413 7.106 -6.932 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.440 9.080 -8.890 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.689 10.305 -6.873 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.434 9.959 -6.827 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.308 8.985 -5.853 1.00 0.00 H new ATOM 1690 N LYS A 110 0.476 7.175 -6.970 1.00 0.00 N ATOM 1691 CA LYS A 110 1.804 6.577 -6.875 1.00 0.00 C ATOM 1692 C LYS A 110 1.719 5.086 -6.567 1.00 0.00 C ATOM 1693 O LYS A 110 0.802 4.636 -5.877 1.00 0.00 O ATOM 1694 CB LYS A 110 2.626 7.288 -5.797 1.00 0.00 C ATOM 1695 CG LYS A 110 3.285 8.569 -6.288 1.00 0.00 C ATOM 1696 CD LYS A 110 4.550 8.886 -5.505 1.00 0.00 C ATOM 1697 CE LYS A 110 5.800 8.511 -6.287 1.00 0.00 C ATOM 1698 NZ LYS A 110 6.862 9.552 -6.175 1.00 0.00 N ATOM 0 H LYS A 110 -0.155 6.924 -6.209 1.00 0.00 H new ATOM 0 HA LYS A 110 2.296 6.696 -7.840 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.979 7.522 -4.952 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.396 6.609 -5.431 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.527 8.471 -7.346 1.00 0.00 H new ATOM 0 HG3 LYS A 110 2.583 9.398 -6.197 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.574 9.949 -5.267 1.00 0.00 H new ATOM 0 HD3 LYS A 110 4.537 8.347 -4.558 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.185 7.559 -5.921 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.542 8.368 -7.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.797 9.098 -6.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 6.781 10.218 -6.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 6.750 10.067 -5.279 1.00 0.00 H new ATOM 1712 N GLU A 111 2.681 4.326 -7.084 1.00 0.00 N ATOM 1713 CA GLU A 111 2.722 2.884 -6.867 1.00 0.00 C ATOM 1714 C GLU A 111 4.154 2.363 -6.927 1.00 0.00 C ATOM 1715 O GLU A 111 4.862 2.577 -7.915 1.00 0.00 O ATOM 1716 CB GLU A 111 1.854 2.161 -7.903 1.00 0.00 C ATOM 1717 CG GLU A 111 2.237 2.451 -9.347 1.00 0.00 C ATOM 1718 CD GLU A 111 2.277 1.196 -10.201 1.00 0.00 C ATOM 1719 OE1 GLU A 111 3.202 0.379 -10.013 1.00 0.00 O ATOM 1720 OE2 GLU A 111 1.379 1.031 -11.054 1.00 0.00 O ATOM 0 H GLU A 111 3.444 4.687 -7.657 1.00 0.00 H new ATOM 0 HA GLU A 111 2.325 2.682 -5.872 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.920 1.087 -7.730 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.813 2.445 -7.751 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.523 3.155 -9.775 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.214 2.934 -9.370 1.00 0.00 H new ATOM 1727 N PHE A 112 4.578 1.682 -5.866 1.00 0.00 N ATOM 1728 CA PHE A 112 5.929 1.129 -5.804 1.00 0.00 C ATOM 1729 C PHE A 112 6.018 -0.011 -4.792 1.00 0.00 C ATOM 1730 O PHE A 112 5.167 -0.144 -3.911 1.00 0.00 O ATOM 1731 CB PHE A 112 6.949 2.220 -5.457 1.00 0.00 C ATOM 1732 CG PHE A 112 6.519 3.139 -4.346 1.00 0.00 C ATOM 1733 CD1 PHE A 112 6.699 2.781 -3.020 1.00 0.00 C ATOM 1734 CD2 PHE A 112 5.943 4.367 -4.633 1.00 0.00 C ATOM 1735 CE1 PHE A 112 6.312 3.630 -2.000 1.00 0.00 C ATOM 1736 CE2 PHE A 112 5.552 5.219 -3.617 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.738 4.850 -2.300 1.00 0.00 C ATOM 0 H PHE A 112 4.008 1.500 -5.040 1.00 0.00 H new ATOM 0 HA PHE A 112 6.163 0.729 -6.790 1.00 0.00 H new ATOM 0 HB2 PHE A 112 7.890 1.746 -5.177 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.145 2.815 -6.349 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.147 1.828 -2.780 1.00 0.00 H new ATOM 0 HD2 PHE A 112 5.798 4.661 -5.662 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.458 3.340 -0.970 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.102 6.172 -3.853 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.435 5.515 -1.505 1.00 0.00 H new ATOM 1747 N VAL A 113 7.061 -0.828 -4.929 1.00 0.00 N ATOM 1748 CA VAL A 113 7.280 -1.959 -4.034 1.00 0.00 C ATOM 1749 C VAL A 113 8.477 -1.704 -3.122 1.00 0.00 C ATOM 1750 O VAL A 113 9.489 -1.147 -3.553 1.00 0.00 O ATOM 1751 CB VAL A 113 7.501 -3.270 -4.826 1.00 0.00 C ATOM 1752 CG1 VAL A 113 8.716 -3.159 -5.736 1.00 0.00 C ATOM 1753 CG2 VAL A 113 7.641 -4.457 -3.881 1.00 0.00 C ATOM 0 H VAL A 113 7.770 -0.725 -5.655 1.00 0.00 H new ATOM 0 HA VAL A 113 6.383 -2.069 -3.425 1.00 0.00 H new ATOM 0 HB VAL A 113 6.624 -3.435 -5.452 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.849 -4.094 -6.281 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.567 -2.344 -6.444 1.00 0.00 H new ATOM 0 HG13 VAL A 113 9.604 -2.960 -5.135 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.795 -5.367 -4.460 1.00 0.00 H new ATOM 0 HG22 VAL A 113 8.494 -4.298 -3.221 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.734 -4.556 -3.285 1.00 0.00 H new ATOM 1763 N ILE A 114 8.354 -2.107 -1.860 1.00 0.00 N ATOM 1764 CA ILE A 114 9.425 -1.916 -0.889 1.00 0.00 C ATOM 1765 C ILE A 114 9.706 -3.199 -0.113 1.00 0.00 C ATOM 1766 O ILE A 114 8.784 -3.917 0.279 1.00 0.00 O ATOM 1767 CB ILE A 114 9.092 -0.786 0.111 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.731 0.505 -0.630 1.00 0.00 C ATOM 1769 CG2 ILE A 114 10.266 -0.544 1.051 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.682 1.334 0.078 1.00 0.00 C ATOM 0 H ILE A 114 7.524 -2.567 -1.487 1.00 0.00 H new ATOM 0 HA ILE A 114 10.313 -1.637 -1.457 1.00 0.00 H new ATOM 0 HB ILE A 114 8.230 -1.097 0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.632 1.105 -0.758 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.371 0.253 -1.628 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.015 0.255 1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.481 -1.457 1.607 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.143 -0.257 0.471 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.476 2.233 -0.503 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.767 0.751 0.182 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.047 1.616 1.066 1.00 0.00 H new ATOM 1782 N SER A 115 10.989 -3.469 0.113 1.00 0.00 N ATOM 1783 CA SER A 115 11.413 -4.655 0.853 1.00 0.00 C ATOM 1784 C SER A 115 11.954 -4.274 2.235 1.00 0.00 C ATOM 1785 O SER A 115 11.902 -5.075 3.168 1.00 0.00 O ATOM 1786 CB SER A 115 12.473 -5.426 0.061 1.00 0.00 C ATOM 1787 OG SER A 115 12.107 -6.788 -0.091 1.00 0.00 O ATOM 0 H SER A 115 11.757 -2.879 -0.208 1.00 0.00 H new ATOM 0 HA SER A 115 10.543 -5.297 0.993 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.602 -4.969 -0.920 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.433 -5.359 0.572 1.00 0.00 H new ATOM 0 HG SER A 115 11.293 -6.967 0.424 1.00 0.00 H new ATOM 1793 N ASP A 116 12.463 -3.044 2.361 1.00 0.00 N ATOM 1794 CA ASP A 116 13.001 -2.560 3.631 1.00 0.00 C ATOM 1795 C ASP A 116 11.882 -2.020 4.519 1.00 0.00 C ATOM 1796 O ASP A 116 10.968 -1.340 4.045 1.00 0.00 O ATOM 1797 CB ASP A 116 14.054 -1.474 3.389 1.00 0.00 C ATOM 1798 CG ASP A 116 14.724 -1.015 4.670 1.00 0.00 C ATOM 1799 OD1 ASP A 116 15.410 -1.838 5.314 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.562 0.168 5.029 1.00 0.00 O ATOM 0 H ASP A 116 12.512 -2.368 1.599 1.00 0.00 H new ATOM 0 HA ASP A 116 13.475 -3.398 4.142 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.811 -1.854 2.703 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.584 -0.619 2.903 1.00 0.00 H new ATOM 1805 N ARG A 117 11.960 -2.334 5.809 1.00 0.00 N ATOM 1806 CA ARG A 117 10.956 -1.893 6.778 1.00 0.00 C ATOM 1807 C ARG A 117 10.945 -0.371 6.921 1.00 0.00 C ATOM 1808 O ARG A 117 9.886 0.233 7.108 1.00 0.00 O ATOM 1809 CB ARG A 117 11.220 -2.541 8.138 1.00 0.00 C ATOM 1810 CG ARG A 117 9.955 -2.925 8.890 1.00 0.00 C ATOM 1811 CD ARG A 117 10.030 -4.347 9.422 1.00 0.00 C ATOM 1812 NE ARG A 117 10.279 -4.381 10.865 1.00 0.00 N ATOM 1813 CZ ARG A 117 11.495 -4.420 11.419 1.00 0.00 C ATOM 1814 NH1 ARG A 117 12.587 -4.443 10.659 1.00 0.00 N ATOM 1815 NH2 ARG A 117 11.617 -4.440 12.740 1.00 0.00 N ATOM 0 H ARG A 117 12.711 -2.895 6.211 1.00 0.00 H new ATOM 0 HA ARG A 117 9.978 -2.204 6.410 1.00 0.00 H new ATOM 0 HB2 ARG A 117 11.830 -3.432 7.993 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.802 -1.853 8.751 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.799 -2.234 9.718 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.094 -2.828 8.228 1.00 0.00 H new ATOM 0 HD2 ARG A 117 9.097 -4.866 9.203 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.823 -4.886 8.904 1.00 0.00 H new ATOM 0 HE ARG A 117 9.471 -4.374 11.488 1.00 0.00 H new ATOM 0 HH11 ARG A 117 12.501 -4.431 9.643 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.510 -4.473 11.093 1.00 0.00 H new ATOM 0 HH21 ARG A 117 10.785 -4.426 13.329 1.00 0.00 H new ATOM 0 HH22 ARG A 117 12.543 -4.470 13.166 1.00 0.00 H new ATOM 1829 N LYS A 118 12.125 0.244 6.831 1.00 0.00 N ATOM 1830 CA LYS A 118 12.244 1.696 6.953 1.00 0.00 C ATOM 1831 C LYS A 118 11.599 2.400 5.757 1.00 0.00 C ATOM 1832 O LYS A 118 10.827 3.344 5.928 1.00 0.00 O ATOM 1833 CB LYS A 118 13.716 2.107 7.076 1.00 0.00 C ATOM 1834 CG LYS A 118 13.938 3.346 7.931 1.00 0.00 C ATOM 1835 CD LYS A 118 15.047 4.221 7.366 1.00 0.00 C ATOM 1836 CE LYS A 118 16.424 3.645 7.666 1.00 0.00 C ATOM 1837 NZ LYS A 118 16.880 3.967 9.049 1.00 0.00 N ATOM 0 H LYS A 118 13.009 -0.240 6.674 1.00 0.00 H new ATOM 0 HA LYS A 118 11.717 2.001 7.857 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.281 1.277 7.501 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.118 2.288 6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.013 3.920 7.988 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.191 3.047 8.948 1.00 0.00 H new ATOM 0 HD2 LYS A 118 14.920 4.319 6.288 1.00 0.00 H new ATOM 0 HD3 LYS A 118 14.971 5.223 7.788 1.00 0.00 H new ATOM 0 HE2 LYS A 118 16.400 2.563 7.536 1.00 0.00 H new ATOM 0 HE3 LYS A 118 17.144 4.036 6.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 17.821 3.555 9.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 16.929 4.999 9.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 16.208 3.572 9.737 1.00 0.00 H new ATOM 1851 N GLU A 119 11.917 1.928 4.551 1.00 0.00 N ATOM 1852 CA GLU A 119 11.363 2.506 3.326 1.00 0.00 C ATOM 1853 C GLU A 119 9.854 2.270 3.236 1.00 0.00 C ATOM 1854 O GLU A 119 9.132 3.058 2.621 1.00 0.00 O ATOM 1855 CB GLU A 119 12.057 1.912 2.096 1.00 0.00 C ATOM 1856 CG GLU A 119 13.171 2.788 1.541 1.00 0.00 C ATOM 1857 CD GLU A 119 13.355 2.617 0.044 1.00 0.00 C ATOM 1858 OE1 GLU A 119 12.541 3.175 -0.721 1.00 0.00 O ATOM 1859 OE2 GLU A 119 14.312 1.925 -0.361 1.00 0.00 O ATOM 0 H GLU A 119 12.555 1.147 4.396 1.00 0.00 H new ATOM 0 HA GLU A 119 11.541 3.581 3.354 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.469 0.937 2.357 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.314 1.745 1.316 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.950 3.833 1.759 1.00 0.00 H new ATOM 0 HG3 GLU A 119 14.105 2.547 2.048 1.00 0.00 H new ATOM 1866 N LEU A 120 9.381 1.186 3.856 1.00 0.00 N ATOM 1867 CA LEU A 120 7.962 0.854 3.852 1.00 0.00 C ATOM 1868 C LEU A 120 7.197 1.749 4.829 1.00 0.00 C ATOM 1869 O LEU A 120 6.010 2.020 4.635 1.00 0.00 O ATOM 1870 CB LEU A 120 7.766 -0.630 4.205 1.00 0.00 C ATOM 1871 CG LEU A 120 6.466 -0.970 4.936 1.00 0.00 C ATOM 1872 CD1 LEU A 120 5.301 -1.034 3.960 1.00 0.00 C ATOM 1873 CD2 LEU A 120 6.608 -2.286 5.688 1.00 0.00 C ATOM 0 H LEU A 120 9.965 0.524 4.367 1.00 0.00 H new ATOM 0 HA LEU A 120 7.564 1.029 2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.807 -1.212 3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.604 -0.952 4.823 1.00 0.00 H new ATOM 0 HG LEU A 120 6.261 -0.180 5.658 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.386 -1.277 4.501 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.186 -0.069 3.467 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.495 -1.802 3.212 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.675 -2.513 6.203 1.00 0.00 H new ATOM 0 HD22 LEU A 120 6.838 -3.085 4.983 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.414 -2.203 6.417 1.00 0.00 H new ATOM 1885 N GLU A 121 7.887 2.202 5.879 1.00 0.00 N ATOM 1886 CA GLU A 121 7.289 3.065 6.889 1.00 0.00 C ATOM 1887 C GLU A 121 6.576 4.253 6.247 1.00 0.00 C ATOM 1888 O GLU A 121 7.099 4.890 5.330 1.00 0.00 O ATOM 1889 CB GLU A 121 8.362 3.557 7.863 1.00 0.00 C ATOM 1890 CG GLU A 121 7.815 3.989 9.215 1.00 0.00 C ATOM 1891 CD GLU A 121 8.876 4.615 10.101 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.883 3.936 10.394 1.00 0.00 O ATOM 1893 OE2 GLU A 121 8.700 5.785 10.501 1.00 0.00 O ATOM 0 H GLU A 121 8.868 1.980 6.048 1.00 0.00 H new ATOM 0 HA GLU A 121 6.548 2.483 7.437 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.093 2.763 8.015 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.892 4.396 7.411 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.006 4.703 9.064 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.387 3.125 9.723 1.00 0.00 H new ATOM 1900 N GLU A 122 5.373 4.533 6.738 1.00 0.00 N ATOM 1901 CA GLU A 122 4.556 5.633 6.226 1.00 0.00 C ATOM 1902 C GLU A 122 5.314 6.963 6.227 1.00 0.00 C ATOM 1903 O GLU A 122 5.079 7.813 5.369 1.00 0.00 O ATOM 1904 CB GLU A 122 3.274 5.768 7.049 1.00 0.00 C ATOM 1905 CG GLU A 122 2.169 6.522 6.326 1.00 0.00 C ATOM 1906 CD GLU A 122 1.008 5.629 5.932 1.00 0.00 C ATOM 1907 OE1 GLU A 122 1.085 4.995 4.858 1.00 0.00 O ATOM 1908 OE2 GLU A 122 0.021 5.566 6.697 1.00 0.00 O ATOM 0 H GLU A 122 4.937 4.009 7.497 1.00 0.00 H new ATOM 0 HA GLU A 122 4.305 5.395 5.192 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.913 4.774 7.312 1.00 0.00 H new ATOM 0 HB3 GLU A 122 3.503 6.281 7.983 1.00 0.00 H new ATOM 0 HG2 GLU A 122 1.803 7.324 6.967 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.580 6.991 5.432 1.00 0.00 H new ATOM 1915 N ASN A 123 6.221 7.135 7.190 1.00 0.00 N ATOM 1916 CA ASN A 123 7.008 8.364 7.292 1.00 0.00 C ATOM 1917 C ASN A 123 7.819 8.589 6.020 1.00 0.00 C ATOM 1918 O ASN A 123 7.881 9.705 5.500 1.00 0.00 O ATOM 1919 CB ASN A 123 7.940 8.302 8.506 1.00 0.00 C ATOM 1920 CG ASN A 123 7.629 9.375 9.533 1.00 0.00 C ATOM 1921 OD1 ASN A 123 8.291 10.411 9.584 1.00 0.00 O ATOM 1922 ND2 ASN A 123 6.616 9.133 10.358 1.00 0.00 N ATOM 0 H ASN A 123 6.428 6.441 7.908 1.00 0.00 H new ATOM 0 HA ASN A 123 6.321 9.201 7.419 1.00 0.00 H new ATOM 0 HB2 ASN A 123 7.857 7.321 8.974 1.00 0.00 H new ATOM 0 HB3 ASN A 123 8.972 8.410 8.173 1.00 0.00 H new ATOM 0 HD21 ASN A 123 6.361 9.820 11.068 1.00 0.00 H new ATOM 0 HD22 ASN A 123 6.093 8.261 10.281 1.00 0.00 H new ATOM 1929 N PHE A 124 8.434 7.517 5.524 1.00 0.00 N ATOM 1930 CA PHE A 124 9.239 7.581 4.309 1.00 0.00 C ATOM 1931 C PHE A 124 8.367 7.887 3.093 1.00 0.00 C ATOM 1932 O PHE A 124 8.684 8.775 2.299 1.00 0.00 O ATOM 1933 CB PHE A 124 9.981 6.259 4.103 1.00 0.00 C ATOM 1934 CG PHE A 124 11.001 6.310 3.002 1.00 0.00 C ATOM 1935 CD1 PHE A 124 12.308 6.689 3.267 1.00 0.00 C ATOM 1936 CD2 PHE A 124 10.652 5.983 1.702 1.00 0.00 C ATOM 1937 CE1 PHE A 124 13.247 6.739 2.255 1.00 0.00 C ATOM 1938 CE2 PHE A 124 11.587 6.034 0.686 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.886 6.411 0.963 1.00 0.00 C ATOM 0 H PHE A 124 8.389 6.590 5.948 1.00 0.00 H new ATOM 0 HA PHE A 124 9.965 8.386 4.421 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.476 5.980 5.033 1.00 0.00 H new ATOM 0 HB3 PHE A 124 9.256 5.476 3.880 1.00 0.00 H new ATOM 0 HD1 PHE A 124 12.595 6.948 4.275 1.00 0.00 H new ATOM 0 HD2 PHE A 124 9.638 5.685 1.480 1.00 0.00 H new ATOM 0 HE1 PHE A 124 14.262 7.034 2.474 1.00 0.00 H new ATOM 0 HE2 PHE A 124 11.302 5.779 -0.324 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.619 6.449 0.170 1.00 0.00 H new ATOM 1949 N ILE A 125 7.268 7.145 2.956 1.00 0.00 N ATOM 1950 CA ILE A 125 6.344 7.331 1.838 1.00 0.00 C ATOM 1951 C ILE A 125 5.731 8.731 1.853 1.00 0.00 C ATOM 1952 O ILE A 125 5.524 9.334 0.800 1.00 0.00 O ATOM 1953 CB ILE A 125 5.210 6.283 1.857 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.789 4.865 1.913 1.00 0.00 C ATOM 1955 CG2 ILE A 125 4.316 6.441 0.635 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.869 3.862 2.574 1.00 0.00 C ATOM 0 H ILE A 125 6.996 6.408 3.607 1.00 0.00 H new ATOM 0 HA ILE A 125 6.928 7.203 0.926 1.00 0.00 H new ATOM 0 HB ILE A 125 4.608 6.447 2.751 1.00 0.00 H new ATOM 0 HG12 ILE A 125 6.009 4.531 0.899 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.735 4.889 2.453 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.523 5.694 0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.876 7.438 0.633 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.909 6.304 -0.270 1.00 0.00 H new ATOM 0 HD11 ILE A 125 5.343 2.881 2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 125 4.669 4.173 3.599 1.00 0.00 H new ATOM 0 HD13 ILE A 125 3.931 3.809 2.021 1.00 0.00 H new ATOM 1968 N LYS A 126 5.442 9.240 3.052 1.00 0.00 N ATOM 1969 CA LYS A 126 4.853 10.570 3.208 1.00 0.00 C ATOM 1970 C LYS A 126 5.673 11.626 2.469 1.00 0.00 C ATOM 1971 O LYS A 126 5.115 12.529 1.842 1.00 0.00 O ATOM 1972 CB LYS A 126 4.752 10.937 4.692 1.00 0.00 C ATOM 1973 CG LYS A 126 3.350 10.798 5.264 1.00 0.00 C ATOM 1974 CD LYS A 126 3.224 11.497 6.609 1.00 0.00 C ATOM 1975 CE LYS A 126 2.629 12.890 6.464 1.00 0.00 C ATOM 1976 NZ LYS A 126 1.199 12.935 6.882 1.00 0.00 N ATOM 0 H LYS A 126 5.607 8.749 3.931 1.00 0.00 H new ATOM 0 HA LYS A 126 3.853 10.545 2.775 1.00 0.00 H new ATOM 0 HB2 LYS A 126 5.431 10.302 5.261 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.089 11.965 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.627 11.219 4.565 1.00 0.00 H new ATOM 0 HG3 LYS A 126 3.105 9.742 5.377 1.00 0.00 H new ATOM 0 HD2 LYS A 126 2.597 10.901 7.272 1.00 0.00 H new ATOM 0 HD3 LYS A 126 4.206 11.567 7.076 1.00 0.00 H new ATOM 0 HE2 LYS A 126 3.204 13.594 7.065 1.00 0.00 H new ATOM 0 HE3 LYS A 126 2.713 13.214 5.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 0.834 13.902 6.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 0.644 12.283 6.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 1.120 12.651 7.879 1.00 0.00 H new ATOM 1990 N SER A 127 6.998 11.504 2.548 1.00 0.00 N ATOM 1991 CA SER A 127 7.899 12.442 1.887 1.00 0.00 C ATOM 1992 C SER A 127 7.904 12.221 0.376 1.00 0.00 C ATOM 1993 O SER A 127 7.875 13.178 -0.399 1.00 0.00 O ATOM 1994 CB SER A 127 9.317 12.301 2.446 1.00 0.00 C ATOM 1995 OG SER A 127 10.037 13.517 2.332 1.00 0.00 O ATOM 0 H SER A 127 7.470 10.762 3.065 1.00 0.00 H new ATOM 0 HA SER A 127 7.541 13.452 2.084 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.270 12.000 3.493 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.845 11.511 1.911 1.00 0.00 H new ATOM 0 HG SER A 127 10.938 13.399 2.698 1.00 0.00 H new ATOM 2001 N GLU A 128 7.942 10.952 -0.034 1.00 0.00 N ATOM 2002 CA GLU A 128 7.951 10.597 -1.452 1.00 0.00 C ATOM 2003 C GLU A 128 6.662 11.045 -2.142 1.00 0.00 C ATOM 2004 O GLU A 128 6.704 11.680 -3.198 1.00 0.00 O ATOM 2005 CB GLU A 128 8.132 9.085 -1.615 1.00 0.00 C ATOM 2006 CG GLU A 128 8.599 8.671 -3.002 1.00 0.00 C ATOM 2007 CD GLU A 128 10.088 8.876 -3.201 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.863 7.956 -2.868 1.00 0.00 O ATOM 2009 OE2 GLU A 128 10.479 9.958 -3.689 1.00 0.00 O ATOM 0 H GLU A 128 7.967 10.152 0.598 1.00 0.00 H new ATOM 0 HA GLU A 128 8.787 11.113 -1.924 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.854 8.733 -0.878 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.186 8.589 -1.397 1.00 0.00 H new ATOM 0 HG2 GLU A 128 8.356 7.621 -3.165 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.054 9.245 -3.751 1.00 0.00 H new ATOM 2016 N LEU A 129 5.520 10.711 -1.539 1.00 0.00 N ATOM 2017 CA LEU A 129 4.218 11.077 -2.094 1.00 0.00 C ATOM 2018 C LEU A 129 4.050 12.593 -2.159 1.00 0.00 C ATOM 2019 O LEU A 129 3.606 13.130 -3.174 1.00 0.00 O ATOM 2020 CB LEU A 129 3.089 10.461 -1.265 1.00 0.00 C ATOM 2021 CG LEU A 129 2.171 9.510 -2.036 1.00 0.00 C ATOM 2022 CD1 LEU A 129 2.641 8.073 -1.880 1.00 0.00 C ATOM 2023 CD2 LEU A 129 0.732 9.657 -1.565 1.00 0.00 C ATOM 0 H LEU A 129 5.471 10.187 -0.665 1.00 0.00 H new ATOM 0 HA LEU A 129 4.169 10.684 -3.110 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.527 9.920 -0.426 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.485 11.265 -0.845 1.00 0.00 H new ATOM 0 HG LEU A 129 2.213 9.772 -3.093 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.977 7.411 -2.435 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.655 7.978 -2.268 1.00 0.00 H new ATOM 0 HD13 LEU A 129 2.629 7.799 -0.825 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.094 8.973 -2.125 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.671 9.422 -0.502 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.398 10.681 -1.730 1.00 0.00 H new ATOM 2035 N LYS A 130 4.414 13.280 -1.075 1.00 0.00 N ATOM 2036 CA LYS A 130 4.306 14.737 -1.021 1.00 0.00 C ATOM 2037 C LYS A 130 5.248 15.391 -2.031 1.00 0.00 C ATOM 2038 O LYS A 130 4.935 16.444 -2.589 1.00 0.00 O ATOM 2039 CB LYS A 130 4.615 15.248 0.388 1.00 0.00 C ATOM 2040 CG LYS A 130 4.123 16.666 0.639 1.00 0.00 C ATOM 2041 CD LYS A 130 4.692 17.235 1.928 1.00 0.00 C ATOM 2042 CE LYS A 130 4.282 18.687 2.124 1.00 0.00 C ATOM 2043 NZ LYS A 130 4.263 19.074 3.563 1.00 0.00 N ATOM 0 H LYS A 130 4.785 12.852 -0.226 1.00 0.00 H new ATOM 0 HA LYS A 130 3.281 15.007 -1.277 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.158 14.579 1.117 1.00 0.00 H new ATOM 0 HB3 LYS A 130 5.692 15.211 0.552 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.407 17.304 -0.198 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.034 16.671 0.688 1.00 0.00 H new ATOM 0 HD2 LYS A 130 4.346 16.641 2.774 1.00 0.00 H new ATOM 0 HD3 LYS A 130 5.779 17.162 1.911 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.973 19.334 1.584 1.00 0.00 H new ATOM 0 HE3 LYS A 130 3.293 18.846 1.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 3.979 20.070 3.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 3.585 18.474 4.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 5.212 18.948 3.969 1.00 0.00 H new