USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 855 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 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 187 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 125 GLN : amide:sc= -2.49 K(o=-7,f=-8.1) USER MOD Set 2.2: A 162 HIS :FLIP no HD1:sc= -4.51 F(o=-8.8,f=-7) USER MOD Set 3.1: A 131 TYR OH : rot 118:sc= -2.42! USER MOD Set 3.2: A 140 TYR OH : rot -99:sc= 1.03 USER MOD Set 4.1: A 122 TYR OH : rot -38:sc= 0.0319 USER MOD Set 4.2: A 165 TYR OH : rot -87:sc= 1.27 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= -1.2 X(o=-1.2,f=-1.5) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 THR OG1 : rot -91:sc= 0.102 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 CYS SG : rot 68:sc= 0.693 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.015) USER MOD Single : A 111 CYS SG : rot 56:sc= 0.172 USER MOD Single : A 112 SER OG : rot 180:sc=-0.00882 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 74:sc= -1.21 USER MOD Single : A 123 THR OG1 : rot 67:sc= 1.22 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 136 HIS : no HD1:sc= -0.275 X(o=-0.27,f=0) USER MOD Single : A 142 SER OG : rot -25:sc= 0.181 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 GLN :FLIP amide:sc= -1.76 F(o=-3.3!,f=-1.8) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 MET CE :methyl 140:sc= -0.488 (180deg=-2.17) USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 SER OG : rot -27:sc= -0.148 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 168 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 169 THR OG1 : rot 180:sc= 0.0652 USER MOD Single : A 172 GLN :FLIP amide:sc= 0.949 F(o=-0.053,f=0.95) USER MOD Single : A 180 ASN : amide:sc= -0.433 X(o=-0.43,f=-0.25) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 SER OG : rot 180:sc= 0 USER MOD Single : A 186 MET CE :methyl 171:sc= 0 (180deg=-0.0762) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 79 10.321 24.435 -5.060 1.00 0.00 N ATOM 2 CA GLY A 79 10.741 23.371 -6.012 1.00 0.00 C ATOM 3 C GLY A 79 12.198 23.492 -6.411 1.00 0.00 C ATOM 4 O GLY A 79 12.568 23.171 -7.541 1.00 0.00 O ATOM 0 HA2 GLY A 79 10.572 22.394 -5.558 1.00 0.00 H new ATOM 0 HA3 GLY A 79 10.118 23.420 -6.905 1.00 0.00 H new ATOM 10 N SER A 80 13.028 23.958 -5.483 1.00 0.00 N ATOM 11 CA SER A 80 14.453 24.122 -5.743 1.00 0.00 C ATOM 12 C SER A 80 15.275 23.142 -4.912 1.00 0.00 C ATOM 13 O SER A 80 16.306 22.643 -5.362 1.00 0.00 O ATOM 14 CB SER A 80 14.887 25.557 -5.439 1.00 0.00 C ATOM 15 OG SER A 80 14.859 26.357 -6.608 1.00 0.00 O ATOM 0 H SER A 80 12.737 24.229 -4.544 1.00 0.00 H new ATOM 0 HA SER A 80 14.630 23.912 -6.798 1.00 0.00 H new ATOM 0 HB2 SER A 80 14.229 25.987 -4.684 1.00 0.00 H new ATOM 0 HB3 SER A 80 15.893 25.555 -5.020 1.00 0.00 H new ATOM 0 HG SER A 80 15.139 27.270 -6.387 1.00 0.00 H new ATOM 21 N HIS A 81 14.812 22.872 -3.695 1.00 0.00 N ATOM 22 CA HIS A 81 15.505 21.952 -2.801 1.00 0.00 C ATOM 23 C HIS A 81 15.000 20.524 -2.991 1.00 0.00 C ATOM 24 O HIS A 81 14.621 19.854 -2.030 1.00 0.00 O ATOM 25 CB HIS A 81 15.317 22.385 -1.345 1.00 0.00 C ATOM 26 CG HIS A 81 13.886 22.394 -0.904 1.00 0.00 C ATOM 27 ND1 HIS A 81 13.313 21.367 -0.184 1.00 0.00 N ATOM 28 CD2 HIS A 81 12.909 23.316 -1.082 1.00 0.00 C ATOM 29 CE1 HIS A 81 12.047 21.655 0.059 1.00 0.00 C ATOM 30 NE2 HIS A 81 11.777 22.832 -0.474 1.00 0.00 N ATOM 0 H HIS A 81 13.961 23.277 -3.306 1.00 0.00 H new ATOM 0 HA HIS A 81 16.567 21.977 -3.045 1.00 0.00 H new ATOM 0 HB2 HIS A 81 15.884 21.715 -0.699 1.00 0.00 H new ATOM 0 HB3 HIS A 81 15.735 23.383 -1.214 1.00 0.00 H new ATOM 0 HD2 HIS A 81 13.003 24.256 -1.605 1.00 0.00 H new ATOM 0 HE1 HIS A 81 11.351 21.033 0.602 1.00 0.00 H new ATOM 0 HE2 HIS A 81 10.874 23.305 -0.440 1.00 0.00 H new ATOM 39 N MET A 82 14.999 20.065 -4.239 1.00 0.00 N ATOM 40 CA MET A 82 14.542 18.717 -4.557 1.00 0.00 C ATOM 41 C MET A 82 15.700 17.852 -5.044 1.00 0.00 C ATOM 42 O MET A 82 16.370 18.187 -6.021 1.00 0.00 O ATOM 43 CB MET A 82 13.444 18.766 -5.621 1.00 0.00 C ATOM 44 CG MET A 82 12.349 17.733 -5.412 1.00 0.00 C ATOM 45 SD MET A 82 11.661 17.127 -6.965 1.00 0.00 S ATOM 46 CE MET A 82 11.249 15.442 -6.519 1.00 0.00 C ATOM 0 H MET A 82 15.309 20.607 -5.046 1.00 0.00 H new ATOM 0 HA MET A 82 14.137 18.273 -3.648 1.00 0.00 H new ATOM 0 HB2 MET A 82 12.998 19.761 -5.625 1.00 0.00 H new ATOM 0 HB3 MET A 82 13.893 18.614 -6.602 1.00 0.00 H new ATOM 0 HG2 MET A 82 12.750 16.893 -4.845 1.00 0.00 H new ATOM 0 HG3 MET A 82 11.551 18.171 -4.812 1.00 0.00 H new ATOM 0 HE1 MET A 82 10.812 14.935 -7.379 1.00 0.00 H new ATOM 0 HE2 MET A 82 12.152 14.917 -6.208 1.00 0.00 H new ATOM 0 HE3 MET A 82 10.532 15.448 -5.698 1.00 0.00 H new ATOM 56 N ASP A 83 15.929 16.737 -4.358 1.00 0.00 N ATOM 57 CA ASP A 83 17.006 15.824 -4.721 1.00 0.00 C ATOM 58 C ASP A 83 16.762 15.215 -6.102 1.00 0.00 C ATOM 59 O ASP A 83 15.841 14.418 -6.281 1.00 0.00 O ATOM 60 CB ASP A 83 17.133 14.713 -3.675 1.00 0.00 C ATOM 61 CG ASP A 83 18.547 14.578 -3.144 1.00 0.00 C ATOM 62 OD1 ASP A 83 19.179 15.619 -2.867 1.00 0.00 O ATOM 63 OD2 ASP A 83 19.023 13.431 -3.007 1.00 0.00 O ATOM 0 H ASP A 83 15.383 16.444 -3.548 1.00 0.00 H new ATOM 0 HA ASP A 83 17.936 16.392 -4.754 1.00 0.00 H new ATOM 0 HB2 ASP A 83 16.455 14.918 -2.847 1.00 0.00 H new ATOM 0 HB3 ASP A 83 16.821 13.766 -4.115 1.00 0.00 H new ATOM 68 N PRO A 84 17.584 15.581 -7.103 1.00 0.00 N ATOM 69 CA PRO A 84 17.444 15.062 -8.467 1.00 0.00 C ATOM 70 C PRO A 84 17.897 13.609 -8.591 1.00 0.00 C ATOM 71 O PRO A 84 17.660 12.962 -9.612 1.00 0.00 O ATOM 72 CB PRO A 84 18.355 15.976 -9.286 1.00 0.00 C ATOM 73 CG PRO A 84 19.397 16.428 -8.322 1.00 0.00 C ATOM 74 CD PRO A 84 18.712 16.527 -6.986 1.00 0.00 C ATOM 0 HA PRO A 84 16.405 15.061 -8.796 1.00 0.00 H new ATOM 0 HB2 PRO A 84 18.798 15.444 -10.128 1.00 0.00 H new ATOM 0 HB3 PRO A 84 17.803 16.821 -9.698 1.00 0.00 H new ATOM 0 HG2 PRO A 84 20.226 15.721 -8.284 1.00 0.00 H new ATOM 0 HG3 PRO A 84 19.812 17.391 -8.620 1.00 0.00 H new ATOM 0 HD2 PRO A 84 19.382 16.253 -6.171 1.00 0.00 H new ATOM 0 HD3 PRO A 84 18.366 17.541 -6.787 1.00 0.00 H new ATOM 82 N ALA A 85 18.551 13.101 -7.551 1.00 0.00 N ATOM 83 CA ALA A 85 19.036 11.726 -7.551 1.00 0.00 C ATOM 84 C ALA A 85 17.904 10.737 -7.289 1.00 0.00 C ATOM 85 O ALA A 85 17.973 9.579 -7.702 1.00 0.00 O ATOM 86 CB ALA A 85 20.137 11.557 -6.514 1.00 0.00 C ATOM 0 H ALA A 85 18.757 13.621 -6.698 1.00 0.00 H new ATOM 0 HA ALA A 85 19.443 11.513 -8.540 1.00 0.00 H new ATOM 0 HB1 ALA A 85 20.491 10.526 -6.524 1.00 0.00 H new ATOM 0 HB2 ALA A 85 20.964 12.227 -6.749 1.00 0.00 H new ATOM 0 HB3 ALA A 85 19.746 11.797 -5.525 1.00 0.00 H new ATOM 92 N GLN A 86 16.864 11.197 -6.599 1.00 0.00 N ATOM 93 CA GLN A 86 15.722 10.345 -6.284 1.00 0.00 C ATOM 94 C GLN A 86 14.694 10.343 -7.415 1.00 0.00 C ATOM 95 O GLN A 86 13.612 9.774 -7.276 1.00 0.00 O ATOM 96 CB GLN A 86 15.062 10.802 -4.982 1.00 0.00 C ATOM 97 CG GLN A 86 14.435 12.184 -5.067 1.00 0.00 C ATOM 98 CD GLN A 86 13.213 12.326 -4.180 1.00 0.00 C ATOM 99 OE1 GLN A 86 13.314 12.282 -2.954 1.00 0.00 O ATOM 100 NE2 GLN A 86 12.050 12.495 -4.798 1.00 0.00 N ATOM 0 H GLN A 86 16.789 12.152 -6.248 1.00 0.00 H new ATOM 0 HA GLN A 86 16.093 9.327 -6.163 1.00 0.00 H new ATOM 0 HB2 GLN A 86 14.294 10.081 -4.702 1.00 0.00 H new ATOM 0 HB3 GLN A 86 15.807 10.799 -4.187 1.00 0.00 H new ATOM 0 HG2 GLN A 86 15.175 12.932 -4.783 1.00 0.00 H new ATOM 0 HG3 GLN A 86 14.155 12.389 -6.100 1.00 0.00 H new ATOM 0 HE21 GLN A 86 12.014 12.525 -5.817 1.00 0.00 H new ATOM 0 HE22 GLN A 86 11.193 12.595 -4.254 1.00 0.00 H new ATOM 109 N LEU A 87 15.033 10.979 -8.535 1.00 0.00 N ATOM 110 CA LEU A 87 14.130 11.038 -9.679 1.00 0.00 C ATOM 111 C LEU A 87 13.810 9.636 -10.189 1.00 0.00 C ATOM 112 O LEU A 87 12.645 9.266 -10.330 1.00 0.00 O ATOM 113 CB LEU A 87 14.749 11.878 -10.800 1.00 0.00 C ATOM 114 CG LEU A 87 14.173 13.287 -10.948 1.00 0.00 C ATOM 115 CD1 LEU A 87 12.742 13.227 -11.461 1.00 0.00 C ATOM 116 CD2 LEU A 87 14.235 14.030 -9.621 1.00 0.00 C ATOM 0 H LEU A 87 15.923 11.458 -8.673 1.00 0.00 H new ATOM 0 HA LEU A 87 13.200 11.507 -9.357 1.00 0.00 H new ATOM 0 HB2 LEU A 87 15.822 11.957 -10.624 1.00 0.00 H new ATOM 0 HB3 LEU A 87 14.620 11.348 -11.744 1.00 0.00 H new ATOM 0 HG LEU A 87 14.776 13.831 -11.675 1.00 0.00 H new ATOM 0 HD11 LEU A 87 12.348 14.239 -11.560 1.00 0.00 H new ATOM 0 HD12 LEU A 87 12.724 12.734 -12.433 1.00 0.00 H new ATOM 0 HD13 LEU A 87 12.127 12.666 -10.758 1.00 0.00 H new ATOM 0 HD21 LEU A 87 13.821 15.031 -9.745 1.00 0.00 H new ATOM 0 HD22 LEU A 87 13.656 13.488 -8.873 1.00 0.00 H new ATOM 0 HD23 LEU A 87 15.272 14.104 -9.294 1.00 0.00 H new ATOM 128 N THR A 88 14.854 8.861 -10.459 1.00 0.00 N ATOM 129 CA THR A 88 14.689 7.498 -10.950 1.00 0.00 C ATOM 130 C THR A 88 14.025 6.619 -9.895 1.00 0.00 C ATOM 131 O THR A 88 13.069 5.901 -10.186 1.00 0.00 O ATOM 132 CB THR A 88 16.042 6.909 -11.349 1.00 0.00 C ATOM 133 OG1 THR A 88 17.085 7.481 -10.581 1.00 0.00 O ATOM 134 CG2 THR A 88 16.379 7.121 -12.810 1.00 0.00 C ATOM 0 H THR A 88 15.825 9.154 -10.346 1.00 0.00 H new ATOM 0 HA THR A 88 14.045 7.529 -11.829 1.00 0.00 H new ATOM 0 HB THR A 88 15.957 5.838 -11.163 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.440 8.267 -11.046 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.352 6.679 -13.027 1.00 0.00 H new ATOM 0 HG22 THR A 88 15.619 6.648 -13.431 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.410 8.189 -13.025 1.00 0.00 H new ATOM 142 N GLU A 89 14.534 6.683 -8.667 1.00 0.00 N ATOM 143 CA GLU A 89 13.983 5.894 -7.570 1.00 0.00 C ATOM 144 C GLU A 89 12.485 6.145 -7.424 1.00 0.00 C ATOM 145 O GLU A 89 11.735 5.265 -7.005 1.00 0.00 O ATOM 146 CB GLU A 89 14.697 6.223 -6.259 1.00 0.00 C ATOM 147 CG GLU A 89 16.208 6.320 -6.394 1.00 0.00 C ATOM 148 CD GLU A 89 16.921 6.191 -5.062 1.00 0.00 C ATOM 149 OE1 GLU A 89 17.122 7.227 -4.394 1.00 0.00 O ATOM 150 OE2 GLU A 89 17.278 5.055 -4.687 1.00 0.00 O ATOM 0 H GLU A 89 15.325 7.272 -8.408 1.00 0.00 H new ATOM 0 HA GLU A 89 14.140 4.840 -7.801 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.314 7.168 -5.874 1.00 0.00 H new ATOM 0 HB3 GLU A 89 14.455 5.457 -5.522 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.560 5.539 -7.068 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.468 7.275 -6.850 1.00 0.00 H new ATOM 157 N ASP A 90 12.057 7.349 -7.782 1.00 0.00 N ATOM 158 CA ASP A 90 10.647 7.708 -7.703 1.00 0.00 C ATOM 159 C ASP A 90 9.866 6.986 -8.795 1.00 0.00 C ATOM 160 O ASP A 90 8.818 6.392 -8.540 1.00 0.00 O ATOM 161 CB ASP A 90 10.470 9.221 -7.841 1.00 0.00 C ATOM 162 CG ASP A 90 9.417 9.769 -6.898 1.00 0.00 C ATOM 163 OD1 ASP A 90 9.437 9.398 -5.706 1.00 0.00 O ATOM 164 OD2 ASP A 90 8.572 10.570 -7.351 1.00 0.00 O ATOM 0 H ASP A 90 12.664 8.092 -8.129 1.00 0.00 H new ATOM 0 HA ASP A 90 10.263 7.404 -6.729 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.422 9.715 -7.645 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.193 9.459 -8.868 1.00 0.00 H new ATOM 169 N ILE A 91 10.393 7.043 -10.012 1.00 0.00 N ATOM 170 CA ILE A 91 9.764 6.399 -11.157 1.00 0.00 C ATOM 171 C ILE A 91 9.654 4.890 -10.954 1.00 0.00 C ATOM 172 O ILE A 91 8.605 4.294 -11.205 1.00 0.00 O ATOM 173 CB ILE A 91 10.557 6.676 -12.452 1.00 0.00 C ATOM 174 CG1 ILE A 91 10.666 8.181 -12.700 1.00 0.00 C ATOM 175 CG2 ILE A 91 9.903 5.985 -13.640 1.00 0.00 C ATOM 176 CD1 ILE A 91 9.329 8.886 -12.755 1.00 0.00 C ATOM 0 H ILE A 91 11.261 7.532 -10.231 1.00 0.00 H new ATOM 0 HA ILE A 91 8.763 6.820 -11.249 1.00 0.00 H new ATOM 0 HB ILE A 91 11.562 6.272 -12.332 1.00 0.00 H new ATOM 0 HG12 ILE A 91 11.270 8.628 -11.910 1.00 0.00 H new ATOM 0 HG13 ILE A 91 11.194 8.348 -13.639 1.00 0.00 H new ATOM 0 HG21 ILE A 91 10.477 6.193 -14.543 1.00 0.00 H new ATOM 0 HG22 ILE A 91 9.877 4.909 -13.466 1.00 0.00 H new ATOM 0 HG23 ILE A 91 8.886 6.358 -13.763 1.00 0.00 H new ATOM 0 HD11 ILE A 91 9.486 9.950 -12.934 1.00 0.00 H new ATOM 0 HD12 ILE A 91 8.730 8.467 -13.563 1.00 0.00 H new ATOM 0 HD13 ILE A 91 8.807 8.750 -11.808 1.00 0.00 H new ATOM 188 N THR A 92 10.744 4.276 -10.505 1.00 0.00 N ATOM 189 CA THR A 92 10.767 2.835 -10.281 1.00 0.00 C ATOM 190 C THR A 92 9.763 2.426 -9.204 1.00 0.00 C ATOM 191 O THR A 92 8.976 1.504 -9.403 1.00 0.00 O ATOM 192 CB THR A 92 12.180 2.370 -9.903 1.00 0.00 C ATOM 193 OG1 THR A 92 12.277 0.959 -9.974 1.00 0.00 O ATOM 194 CG2 THR A 92 12.607 2.787 -8.515 1.00 0.00 C ATOM 0 H THR A 92 11.620 4.752 -10.290 1.00 0.00 H new ATOM 0 HA THR A 92 10.478 2.348 -11.212 1.00 0.00 H new ATOM 0 HB THR A 92 12.840 2.853 -10.624 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.185 0.681 -9.731 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.616 2.422 -8.320 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.594 3.874 -8.442 1.00 0.00 H new ATOM 0 HG23 THR A 92 11.920 2.365 -7.781 1.00 0.00 H new ATOM 202 N ARG A 93 9.806 3.103 -8.058 1.00 0.00 N ATOM 203 CA ARG A 93 8.914 2.791 -6.947 1.00 0.00 C ATOM 204 C ARG A 93 7.450 2.815 -7.379 1.00 0.00 C ATOM 205 O ARG A 93 6.706 1.869 -7.124 1.00 0.00 O ATOM 206 CB ARG A 93 9.142 3.787 -5.810 1.00 0.00 C ATOM 207 CG ARG A 93 9.423 3.128 -4.469 1.00 0.00 C ATOM 208 CD ARG A 93 10.778 3.542 -3.916 1.00 0.00 C ATOM 209 NE ARG A 93 10.834 4.972 -3.617 1.00 0.00 N ATOM 210 CZ ARG A 93 10.396 5.513 -2.481 1.00 0.00 C ATOM 211 NH1 ARG A 93 9.868 4.749 -1.533 1.00 0.00 N ATOM 212 NH2 ARG A 93 10.487 6.822 -2.294 1.00 0.00 N ATOM 0 H ARG A 93 10.451 3.872 -7.876 1.00 0.00 H new ATOM 0 HA ARG A 93 9.141 1.782 -6.602 1.00 0.00 H new ATOM 0 HB2 ARG A 93 9.979 4.435 -6.069 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.263 4.424 -5.715 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.641 3.398 -3.759 1.00 0.00 H new ATOM 0 HG3 ARG A 93 9.391 2.044 -4.581 1.00 0.00 H new ATOM 0 HD2 ARG A 93 10.989 2.974 -3.010 1.00 0.00 H new ATOM 0 HD3 ARG A 93 11.556 3.292 -4.637 1.00 0.00 H new ATOM 0 HE ARG A 93 11.233 5.593 -4.321 1.00 0.00 H new ATOM 0 HH11 ARG A 93 9.796 3.741 -1.672 1.00 0.00 H new ATOM 0 HH12 ARG A 93 9.535 5.170 -0.666 1.00 0.00 H new ATOM 0 HH21 ARG A 93 10.892 7.414 -3.019 1.00 0.00 H new ATOM 0 HH22 ARG A 93 10.152 7.237 -1.425 1.00 0.00 H new ATOM 226 N TYR A 94 7.039 3.897 -8.031 1.00 0.00 N ATOM 227 CA TYR A 94 5.661 4.030 -8.492 1.00 0.00 C ATOM 228 C TYR A 94 5.256 2.840 -9.358 1.00 0.00 C ATOM 229 O TYR A 94 4.234 2.197 -9.113 1.00 0.00 O ATOM 230 CB TYR A 94 5.488 5.330 -9.278 1.00 0.00 C ATOM 231 CG TYR A 94 4.047 5.657 -9.600 1.00 0.00 C ATOM 232 CD1 TYR A 94 3.068 5.613 -8.615 1.00 0.00 C ATOM 233 CD2 TYR A 94 3.666 6.008 -10.889 1.00 0.00 C ATOM 234 CE1 TYR A 94 1.750 5.911 -8.906 1.00 0.00 C ATOM 235 CE2 TYR A 94 2.351 6.308 -11.187 1.00 0.00 C ATOM 236 CZ TYR A 94 1.397 6.257 -10.193 1.00 0.00 C ATOM 237 OH TYR A 94 0.086 6.555 -10.487 1.00 0.00 O ATOM 0 H TYR A 94 7.638 4.693 -8.252 1.00 0.00 H new ATOM 0 HA TYR A 94 5.013 4.053 -7.616 1.00 0.00 H new ATOM 0 HB2 TYR A 94 5.919 6.151 -8.705 1.00 0.00 H new ATOM 0 HB3 TYR A 94 6.052 5.260 -10.208 1.00 0.00 H new ATOM 0 HD1 TYR A 94 3.341 5.342 -7.606 1.00 0.00 H new ATOM 0 HD2 TYR A 94 4.410 6.047 -11.671 1.00 0.00 H new ATOM 0 HE1 TYR A 94 1.001 5.873 -8.129 1.00 0.00 H new ATOM 0 HE2 TYR A 94 2.072 6.581 -12.194 1.00 0.00 H new ATOM 0 HH TYR A 94 0.007 6.780 -11.438 1.00 0.00 H new ATOM 247 N TYR A 95 6.066 2.553 -10.373 1.00 0.00 N ATOM 248 CA TYR A 95 5.793 1.442 -11.278 1.00 0.00 C ATOM 249 C TYR A 95 5.894 0.102 -10.556 1.00 0.00 C ATOM 250 O TYR A 95 5.234 -0.867 -10.933 1.00 0.00 O ATOM 251 CB TYR A 95 6.763 1.473 -12.460 1.00 0.00 C ATOM 252 CG TYR A 95 6.309 2.368 -13.591 1.00 0.00 C ATOM 253 CD1 TYR A 95 6.088 3.723 -13.382 1.00 0.00 C ATOM 254 CD2 TYR A 95 6.101 1.857 -14.866 1.00 0.00 C ATOM 255 CE1 TYR A 95 5.671 4.545 -14.412 1.00 0.00 C ATOM 256 CE2 TYR A 95 5.684 2.672 -15.901 1.00 0.00 C ATOM 257 CZ TYR A 95 5.471 4.015 -15.669 1.00 0.00 C ATOM 258 OH TYR A 95 5.056 4.830 -16.698 1.00 0.00 O ATOM 0 H TYR A 95 6.916 3.074 -10.589 1.00 0.00 H new ATOM 0 HA TYR A 95 4.773 1.553 -11.647 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.739 1.810 -12.110 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.893 0.459 -12.839 1.00 0.00 H new ATOM 0 HD1 TYR A 95 6.245 4.141 -12.399 1.00 0.00 H new ATOM 0 HD2 TYR A 95 6.268 0.806 -15.051 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.503 5.597 -14.233 1.00 0.00 H new ATOM 0 HE2 TYR A 95 5.526 2.260 -16.887 1.00 0.00 H new ATOM 0 HH TYR A 95 4.964 4.301 -17.518 1.00 0.00 H new ATOM 268 N LEU A 96 6.721 0.050 -9.515 1.00 0.00 N ATOM 269 CA LEU A 96 6.902 -1.175 -8.744 1.00 0.00 C ATOM 270 C LEU A 96 5.642 -1.510 -7.954 1.00 0.00 C ATOM 271 O LEU A 96 5.092 -2.604 -8.076 1.00 0.00 O ATOM 272 CB LEU A 96 8.090 -1.031 -7.789 1.00 0.00 C ATOM 273 CG LEU A 96 8.967 -2.275 -7.652 1.00 0.00 C ATOM 274 CD1 LEU A 96 9.521 -2.689 -9.007 1.00 0.00 C ATOM 275 CD2 LEU A 96 10.098 -2.022 -6.667 1.00 0.00 C ATOM 0 H LEU A 96 7.275 0.841 -9.187 1.00 0.00 H new ATOM 0 HA LEU A 96 7.101 -1.988 -9.442 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.712 -0.203 -8.130 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.713 -0.761 -6.803 1.00 0.00 H new ATOM 0 HG LEU A 96 8.353 -3.090 -7.269 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.143 -3.576 -8.890 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.697 -2.910 -9.685 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.121 -1.877 -9.418 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.713 -2.918 -6.581 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.711 -1.194 -7.022 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.682 -1.773 -5.691 1.00 0.00 H new ATOM 287 N CYS A 97 5.191 -0.557 -7.145 1.00 0.00 N ATOM 288 CA CYS A 97 3.994 -0.746 -6.333 1.00 0.00 C ATOM 289 C CYS A 97 2.803 -1.133 -7.203 1.00 0.00 C ATOM 290 O CYS A 97 2.044 -2.040 -6.865 1.00 0.00 O ATOM 291 CB CYS A 97 3.676 0.530 -5.551 1.00 0.00 C ATOM 292 SG CYS A 97 5.050 1.143 -4.550 1.00 0.00 S ATOM 0 H CYS A 97 5.636 0.354 -7.034 1.00 0.00 H new ATOM 0 HA CYS A 97 4.186 -1.556 -5.630 1.00 0.00 H new ATOM 0 HB2 CYS A 97 3.376 1.308 -6.253 1.00 0.00 H new ATOM 0 HB3 CYS A 97 2.822 0.341 -4.900 1.00 0.00 H new ATOM 0 HG CYS A 97 6.003 1.561 -5.330 1.00 0.00 H new ATOM 298 N LEU A 98 2.647 -0.440 -8.327 1.00 0.00 N ATOM 299 CA LEU A 98 1.548 -0.712 -9.247 1.00 0.00 C ATOM 300 C LEU A 98 1.569 -2.166 -9.710 1.00 0.00 C ATOM 301 O LEU A 98 0.553 -2.859 -9.660 1.00 0.00 O ATOM 302 CB LEU A 98 1.625 0.221 -10.457 1.00 0.00 C ATOM 303 CG LEU A 98 1.291 1.685 -10.167 1.00 0.00 C ATOM 304 CD1 LEU A 98 1.677 2.564 -11.347 1.00 0.00 C ATOM 305 CD2 LEU A 98 -0.188 1.839 -9.847 1.00 0.00 C ATOM 0 H LEU A 98 3.268 0.314 -8.622 1.00 0.00 H new ATOM 0 HA LEU A 98 0.613 -0.533 -8.717 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.631 0.169 -10.873 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.943 -0.146 -11.224 1.00 0.00 H new ATOM 0 HG LEU A 98 1.867 2.005 -9.298 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.432 3.602 -11.123 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.748 2.475 -11.532 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.128 2.245 -12.233 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.409 2.887 -9.643 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.781 1.502 -10.697 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.435 1.239 -8.971 1.00 0.00 H new ATOM 317 N GLN A 99 2.733 -2.622 -10.163 1.00 0.00 N ATOM 318 CA GLN A 99 2.886 -3.993 -10.637 1.00 0.00 C ATOM 319 C GLN A 99 2.633 -4.995 -9.513 1.00 0.00 C ATOM 320 O GLN A 99 1.917 -5.979 -9.695 1.00 0.00 O ATOM 321 CB GLN A 99 4.286 -4.200 -11.218 1.00 0.00 C ATOM 322 CG GLN A 99 4.347 -4.045 -12.729 1.00 0.00 C ATOM 323 CD GLN A 99 5.072 -5.192 -13.405 1.00 0.00 C ATOM 324 OE1 GLN A 99 4.480 -6.232 -13.694 1.00 0.00 O ATOM 325 NE2 GLN A 99 6.362 -5.009 -13.660 1.00 0.00 N ATOM 0 H GLN A 99 3.584 -2.062 -10.212 1.00 0.00 H new ATOM 0 HA GLN A 99 2.146 -4.163 -11.419 1.00 0.00 H new ATOM 0 HB2 GLN A 99 4.970 -3.485 -10.760 1.00 0.00 H new ATOM 0 HB3 GLN A 99 4.638 -5.196 -10.949 1.00 0.00 H new ATOM 0 HG2 GLN A 99 3.334 -3.977 -13.125 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.848 -3.109 -12.974 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.813 -4.131 -13.403 1.00 0.00 H new ATOM 0 HE22 GLN A 99 6.902 -5.747 -14.113 1.00 0.00 H new ATOM 334 N LEU A 100 3.228 -4.738 -8.353 1.00 0.00 N ATOM 335 CA LEU A 100 3.068 -5.618 -7.200 1.00 0.00 C ATOM 336 C LEU A 100 1.603 -5.711 -6.783 1.00 0.00 C ATOM 337 O LEU A 100 1.085 -6.799 -6.535 1.00 0.00 O ATOM 338 CB LEU A 100 3.916 -5.115 -6.029 1.00 0.00 C ATOM 339 CG LEU A 100 5.213 -5.888 -5.788 1.00 0.00 C ATOM 340 CD1 LEU A 100 6.126 -5.116 -4.847 1.00 0.00 C ATOM 341 CD2 LEU A 100 4.913 -7.271 -5.228 1.00 0.00 C ATOM 0 H LEU A 100 3.825 -3.928 -8.186 1.00 0.00 H new ATOM 0 HA LEU A 100 3.407 -6.614 -7.484 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.163 -4.068 -6.203 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.314 -5.154 -5.121 1.00 0.00 H new ATOM 0 HG LEU A 100 5.726 -6.008 -6.742 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.044 -5.681 -4.686 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.367 -4.148 -5.287 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.621 -4.965 -3.893 1.00 0.00 H new ATOM 0 HD21 LEU A 100 5.848 -7.807 -5.063 1.00 0.00 H new ATOM 0 HD22 LEU A 100 4.379 -7.173 -4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.298 -7.825 -5.937 1.00 0.00 H new ATOM 353 N ARG A 101 0.943 -4.561 -6.708 1.00 0.00 N ATOM 354 CA ARG A 101 -0.462 -4.505 -6.320 1.00 0.00 C ATOM 355 C ARG A 101 -1.347 -5.205 -7.348 1.00 0.00 C ATOM 356 O ARG A 101 -2.414 -5.720 -7.012 1.00 0.00 O ATOM 357 CB ARG A 101 -0.909 -3.051 -6.147 1.00 0.00 C ATOM 358 CG ARG A 101 -1.362 -2.719 -4.734 1.00 0.00 C ATOM 359 CD ARG A 101 -2.692 -1.983 -4.730 1.00 0.00 C ATOM 360 NE ARG A 101 -2.652 -0.776 -5.552 1.00 0.00 N ATOM 361 CZ ARG A 101 -3.656 0.094 -5.641 1.00 0.00 C ATOM 362 NH1 ARG A 101 -4.778 -0.106 -4.962 1.00 0.00 N ATOM 363 NH2 ARG A 101 -3.537 1.166 -6.412 1.00 0.00 N ATOM 0 H ARG A 101 1.359 -3.652 -6.911 1.00 0.00 H new ATOM 0 HA ARG A 101 -0.567 -5.026 -5.369 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -0.086 -2.391 -6.420 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.725 -2.845 -6.839 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -1.453 -3.638 -4.155 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.605 -2.107 -4.243 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -3.475 -2.646 -5.098 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.956 -1.716 -3.707 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.805 -0.589 -6.089 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -4.875 -0.930 -4.368 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -5.544 0.564 -5.034 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.677 1.324 -6.937 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -4.306 1.833 -6.481 1.00 0.00 H new ATOM 377 N GLN A 102 -0.901 -5.220 -8.600 1.00 0.00 N ATOM 378 CA GLN A 102 -1.656 -5.857 -9.673 1.00 0.00 C ATOM 379 C GLN A 102 -1.628 -7.378 -9.539 1.00 0.00 C ATOM 380 O GLN A 102 -2.639 -8.048 -9.753 1.00 0.00 O ATOM 381 CB GLN A 102 -1.095 -5.441 -11.035 1.00 0.00 C ATOM 382 CG GLN A 102 -1.938 -4.395 -11.745 1.00 0.00 C ATOM 383 CD GLN A 102 -2.078 -4.669 -13.230 1.00 0.00 C ATOM 384 OE1 GLN A 102 -1.751 -3.824 -14.063 1.00 0.00 O ATOM 385 NE2 GLN A 102 -2.567 -5.857 -13.568 1.00 0.00 N ATOM 0 H GLN A 102 -0.021 -4.798 -8.896 1.00 0.00 H new ATOM 0 HA GLN A 102 -2.692 -5.527 -9.597 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -0.086 -5.052 -10.900 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -1.014 -6.323 -11.670 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -2.928 -4.362 -11.290 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -1.488 -3.413 -11.601 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -2.825 -6.527 -12.844 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -2.684 -6.099 -14.552 1.00 0.00 H new ATOM 394 N ASP A 103 -0.464 -7.917 -9.193 1.00 0.00 N ATOM 395 CA ASP A 103 -0.303 -9.359 -9.040 1.00 0.00 C ATOM 396 C ASP A 103 -1.028 -9.869 -7.798 1.00 0.00 C ATOM 397 O ASP A 103 -1.659 -10.925 -7.825 1.00 0.00 O ATOM 398 CB ASP A 103 1.181 -9.721 -8.959 1.00 0.00 C ATOM 399 CG ASP A 103 1.866 -9.662 -10.311 1.00 0.00 C ATOM 400 OD1 ASP A 103 1.758 -8.616 -10.985 1.00 0.00 O ATOM 401 OD2 ASP A 103 2.509 -10.661 -10.696 1.00 0.00 O ATOM 0 H ASP A 103 0.382 -7.377 -9.013 1.00 0.00 H new ATOM 0 HA ASP A 103 -0.744 -9.838 -9.914 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.681 -9.039 -8.271 1.00 0.00 H new ATOM 0 HB3 ASP A 103 1.285 -10.724 -8.546 1.00 0.00 H new ATOM 406 N ILE A 104 -0.928 -9.116 -6.708 1.00 0.00 N ATOM 407 CA ILE A 104 -1.569 -9.497 -5.456 1.00 0.00 C ATOM 408 C ILE A 104 -3.088 -9.537 -5.598 1.00 0.00 C ATOM 409 O ILE A 104 -3.731 -10.514 -5.213 1.00 0.00 O ATOM 410 CB ILE A 104 -1.194 -8.531 -4.314 1.00 0.00 C ATOM 411 CG1 ILE A 104 0.327 -8.404 -4.204 1.00 0.00 C ATOM 412 CG2 ILE A 104 -1.787 -9.007 -2.996 1.00 0.00 C ATOM 413 CD1 ILE A 104 0.785 -7.059 -3.685 1.00 0.00 C ATOM 0 H ILE A 104 -0.409 -8.239 -6.667 1.00 0.00 H new ATOM 0 HA ILE A 104 -1.207 -10.496 -5.211 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.608 -7.549 -4.541 1.00 0.00 H new ATOM 0 HG12 ILE A 104 0.702 -9.186 -3.544 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.770 -8.576 -5.185 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.512 -8.313 -2.202 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -2.873 -9.050 -3.080 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.401 -9.999 -2.761 1.00 0.00 H new ATOM 0 HD11 ILE A 104 1.874 -7.040 -3.633 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.440 -6.273 -4.357 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.372 -6.893 -2.690 1.00 0.00 H new ATOM 425 N VAL A 105 -3.659 -8.468 -6.144 1.00 0.00 N ATOM 426 CA VAL A 105 -5.103 -8.382 -6.328 1.00 0.00 C ATOM 427 C VAL A 105 -5.620 -9.493 -7.236 1.00 0.00 C ATOM 428 O VAL A 105 -6.743 -9.970 -7.069 1.00 0.00 O ATOM 429 CB VAL A 105 -5.514 -7.020 -6.918 1.00 0.00 C ATOM 430 CG1 VAL A 105 -5.108 -5.891 -5.984 1.00 0.00 C ATOM 431 CG2 VAL A 105 -4.901 -6.825 -8.297 1.00 0.00 C ATOM 0 H VAL A 105 -3.143 -7.649 -6.467 1.00 0.00 H new ATOM 0 HA VAL A 105 -5.549 -8.494 -5.340 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.599 -7.004 -7.024 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.406 -4.936 -6.417 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.599 -6.022 -5.020 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -4.027 -5.905 -5.845 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -5.204 -5.857 -8.696 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -3.814 -6.862 -8.221 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.245 -7.616 -8.963 1.00 0.00 H new ATOM 441 N ALA A 106 -4.799 -9.901 -8.198 1.00 0.00 N ATOM 442 CA ALA A 106 -5.183 -10.955 -9.130 1.00 0.00 C ATOM 443 C ALA A 106 -4.992 -12.343 -8.519 1.00 0.00 C ATOM 444 O ALA A 106 -5.295 -13.353 -9.154 1.00 0.00 O ATOM 445 CB ALA A 106 -4.385 -10.832 -10.419 1.00 0.00 C ATOM 0 H ALA A 106 -3.866 -9.519 -8.353 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.243 -10.834 -9.352 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.680 -11.624 -11.107 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.581 -9.862 -10.877 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -3.321 -10.921 -10.198 1.00 0.00 H new ATOM 451 N GLY A 107 -4.488 -12.390 -7.288 1.00 0.00 N ATOM 452 CA GLY A 107 -4.269 -13.664 -6.629 1.00 0.00 C ATOM 453 C GLY A 107 -3.147 -14.456 -7.268 1.00 0.00 C ATOM 454 O GLY A 107 -3.186 -15.686 -7.303 1.00 0.00 O ATOM 0 H GLY A 107 -4.229 -11.571 -6.738 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -4.037 -13.492 -5.578 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.188 -14.250 -6.660 1.00 0.00 H new ATOM 458 N ARG A 108 -2.145 -13.747 -7.777 1.00 0.00 N ATOM 459 CA ARG A 108 -1.004 -14.387 -8.423 1.00 0.00 C ATOM 460 C ARG A 108 0.040 -14.834 -7.399 1.00 0.00 C ATOM 461 O ARG A 108 1.093 -15.355 -7.767 1.00 0.00 O ATOM 462 CB ARG A 108 -0.365 -13.433 -9.433 1.00 0.00 C ATOM 463 CG ARG A 108 -1.000 -13.491 -10.812 1.00 0.00 C ATOM 464 CD ARG A 108 -0.187 -12.712 -11.833 1.00 0.00 C ATOM 465 NE ARG A 108 0.990 -13.456 -12.277 1.00 0.00 N ATOM 466 CZ ARG A 108 0.953 -14.435 -13.178 1.00 0.00 C ATOM 467 NH1 ARG A 108 -0.199 -14.791 -13.733 1.00 0.00 N ATOM 468 NH2 ARG A 108 2.070 -15.059 -13.526 1.00 0.00 N ATOM 0 H ARG A 108 -2.100 -12.728 -7.755 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.370 -15.272 -8.943 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -0.436 -12.414 -9.052 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.696 -13.668 -9.521 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -1.087 -14.530 -11.130 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -2.011 -13.087 -10.765 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -0.814 -12.478 -12.693 1.00 0.00 H new ATOM 0 HD3 ARG A 108 0.126 -11.763 -11.399 1.00 0.00 H new ATOM 0 HE ARG A 108 1.894 -13.210 -11.872 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -1.061 -14.314 -13.470 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -0.222 -15.542 -14.423 1.00 0.00 H new ATOM 0 HH21 ARG A 108 2.958 -14.789 -13.103 1.00 0.00 H new ATOM 0 HH22 ARG A 108 2.041 -15.809 -14.216 1.00 0.00 H new ATOM 482 N LEU A 109 -0.252 -14.630 -6.116 1.00 0.00 N ATOM 483 CA LEU A 109 0.669 -15.016 -5.055 1.00 0.00 C ATOM 484 C LEU A 109 -0.084 -15.243 -3.744 1.00 0.00 C ATOM 485 O LEU A 109 -0.942 -14.443 -3.369 1.00 0.00 O ATOM 486 CB LEU A 109 1.740 -13.938 -4.864 1.00 0.00 C ATOM 487 CG LEU A 109 3.161 -14.464 -4.656 1.00 0.00 C ATOM 488 CD1 LEU A 109 4.183 -13.470 -5.190 1.00 0.00 C ATOM 489 CD2 LEU A 109 3.410 -14.754 -3.183 1.00 0.00 C ATOM 0 H LEU A 109 -1.117 -14.201 -5.789 1.00 0.00 H new ATOM 0 HA LEU A 109 1.153 -15.949 -5.344 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.735 -13.285 -5.737 1.00 0.00 H new ATOM 0 HB3 LEU A 109 1.467 -13.325 -4.005 1.00 0.00 H new ATOM 0 HG LEU A 109 3.270 -15.395 -5.212 1.00 0.00 H new ATOM 0 HD11 LEU A 109 5.188 -13.862 -5.033 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.017 -13.314 -6.256 1.00 0.00 H new ATOM 0 HD13 LEU A 109 4.077 -12.521 -4.664 1.00 0.00 H new ATOM 0 HD21 LEU A 109 4.426 -15.128 -3.052 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.283 -13.838 -2.605 1.00 0.00 H new ATOM 0 HD23 LEU A 109 2.700 -15.504 -2.835 1.00 0.00 H new ATOM 501 N PRO A 110 0.223 -16.339 -3.026 1.00 0.00 N ATOM 502 CA PRO A 110 -0.437 -16.656 -1.755 1.00 0.00 C ATOM 503 C PRO A 110 -0.035 -15.700 -0.637 1.00 0.00 C ATOM 504 O PRO A 110 1.150 -15.518 -0.360 1.00 0.00 O ATOM 505 CB PRO A 110 0.047 -18.074 -1.446 1.00 0.00 C ATOM 506 CG PRO A 110 1.355 -18.188 -2.150 1.00 0.00 C ATOM 507 CD PRO A 110 1.232 -17.351 -3.393 1.00 0.00 C ATOM 0 HA PRO A 110 -1.521 -16.568 -1.827 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.160 -18.229 -0.373 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.662 -18.821 -1.803 1.00 0.00 H new ATOM 0 HG2 PRO A 110 2.170 -17.832 -1.519 1.00 0.00 H new ATOM 0 HG3 PRO A 110 1.575 -19.226 -2.399 1.00 0.00 H new ATOM 0 HD2 PRO A 110 2.183 -16.891 -3.663 1.00 0.00 H new ATOM 0 HD3 PRO A 110 0.911 -17.946 -4.248 1.00 0.00 H new ATOM 515 N CYS A 111 -1.030 -15.094 0.003 1.00 0.00 N ATOM 516 CA CYS A 111 -0.781 -14.158 1.093 1.00 0.00 C ATOM 517 C CYS A 111 -1.792 -14.359 2.218 1.00 0.00 C ATOM 518 O CYS A 111 -2.787 -15.063 2.051 1.00 0.00 O ATOM 519 CB CYS A 111 -0.846 -12.717 0.583 1.00 0.00 C ATOM 520 SG CYS A 111 0.061 -12.436 -0.956 1.00 0.00 S ATOM 0 H CYS A 111 -2.017 -15.235 -0.215 1.00 0.00 H new ATOM 0 HA CYS A 111 0.218 -14.350 1.485 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -1.890 -12.443 0.432 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -0.451 -12.053 1.352 1.00 0.00 H new ATOM 0 HG CYS A 111 -0.372 -13.253 -1.870 1.00 0.00 H new ATOM 526 N SER A 112 -1.529 -13.739 3.363 1.00 0.00 N ATOM 527 CA SER A 112 -2.418 -13.855 4.513 1.00 0.00 C ATOM 528 C SER A 112 -3.280 -12.606 4.669 1.00 0.00 C ATOM 529 O SER A 112 -2.972 -11.553 4.110 1.00 0.00 O ATOM 530 CB SER A 112 -1.607 -14.092 5.788 1.00 0.00 C ATOM 531 OG SER A 112 -2.454 -14.397 6.883 1.00 0.00 O ATOM 0 H SER A 112 -0.709 -13.152 3.519 1.00 0.00 H new ATOM 0 HA SER A 112 -3.077 -14.707 4.344 1.00 0.00 H new ATOM 0 HB2 SER A 112 -0.905 -14.910 5.629 1.00 0.00 H new ATOM 0 HB3 SER A 112 -1.017 -13.205 6.017 1.00 0.00 H new ATOM 0 HG SER A 112 -1.911 -14.546 7.685 1.00 0.00 H new ATOM 537 N PHE A 113 -4.361 -12.732 5.433 1.00 0.00 N ATOM 538 CA PHE A 113 -5.272 -11.616 5.667 1.00 0.00 C ATOM 539 C PHE A 113 -4.531 -10.420 6.259 1.00 0.00 C ATOM 540 O PHE A 113 -4.715 -9.285 5.819 1.00 0.00 O ATOM 541 CB PHE A 113 -6.406 -12.049 6.602 1.00 0.00 C ATOM 542 CG PHE A 113 -7.326 -10.929 7.001 1.00 0.00 C ATOM 543 CD1 PHE A 113 -6.948 -10.020 7.977 1.00 0.00 C ATOM 544 CD2 PHE A 113 -8.567 -10.786 6.402 1.00 0.00 C ATOM 545 CE1 PHE A 113 -7.791 -8.990 8.348 1.00 0.00 C ATOM 546 CE2 PHE A 113 -9.415 -9.757 6.769 1.00 0.00 C ATOM 547 CZ PHE A 113 -9.026 -8.858 7.743 1.00 0.00 C ATOM 0 H PHE A 113 -4.628 -13.598 5.902 1.00 0.00 H new ATOM 0 HA PHE A 113 -5.695 -11.314 4.709 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.990 -12.829 6.113 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.975 -12.490 7.501 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -5.983 -10.118 8.453 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.876 -11.486 5.640 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -7.485 -8.289 9.110 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.380 -9.656 6.295 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.686 -8.053 8.031 1.00 0.00 H new ATOM 557 N ALA A 114 -3.709 -10.677 7.271 1.00 0.00 N ATOM 558 CA ALA A 114 -2.963 -9.616 7.935 1.00 0.00 C ATOM 559 C ALA A 114 -2.111 -8.826 6.949 1.00 0.00 C ATOM 560 O ALA A 114 -2.141 -7.595 6.948 1.00 0.00 O ATOM 561 CB ALA A 114 -2.087 -10.191 9.034 1.00 0.00 C ATOM 0 H ALA A 114 -3.543 -11.610 7.648 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.688 -8.932 8.376 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.537 -9.385 9.520 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -2.712 -10.698 9.769 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.383 -10.903 8.603 1.00 0.00 H new ATOM 567 N THR A 115 -1.354 -9.523 6.107 1.00 0.00 N ATOM 568 CA THR A 115 -0.508 -8.858 5.125 1.00 0.00 C ATOM 569 C THR A 115 -1.358 -8.102 4.113 1.00 0.00 C ATOM 570 O THR A 115 -1.023 -6.988 3.717 1.00 0.00 O ATOM 571 CB THR A 115 0.376 -9.879 4.406 1.00 0.00 C ATOM 572 OG1 THR A 115 1.178 -10.589 5.334 1.00 0.00 O ATOM 573 CG2 THR A 115 1.301 -9.256 3.382 1.00 0.00 C ATOM 0 H THR A 115 -1.310 -10.542 6.086 1.00 0.00 H new ATOM 0 HA THR A 115 0.130 -8.145 5.648 1.00 0.00 H new ATOM 0 HB THR A 115 -0.315 -10.545 3.889 1.00 0.00 H new ATOM 0 HG1 THR A 115 1.735 -11.238 4.856 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.899 -10.036 2.910 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.711 -8.742 2.623 1.00 0.00 H new ATOM 0 HG23 THR A 115 1.960 -8.541 3.874 1.00 0.00 H new ATOM 581 N LEU A 116 -2.465 -8.712 3.706 1.00 0.00 N ATOM 582 CA LEU A 116 -3.368 -8.087 2.748 1.00 0.00 C ATOM 583 C LEU A 116 -3.853 -6.746 3.283 1.00 0.00 C ATOM 584 O LEU A 116 -3.849 -5.741 2.572 1.00 0.00 O ATOM 585 CB LEU A 116 -4.562 -9.000 2.463 1.00 0.00 C ATOM 586 CG LEU A 116 -4.276 -10.163 1.511 1.00 0.00 C ATOM 587 CD1 LEU A 116 -5.529 -10.997 1.297 1.00 0.00 C ATOM 588 CD2 LEU A 116 -3.744 -9.644 0.183 1.00 0.00 C ATOM 0 H LEU A 116 -2.758 -9.636 4.023 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.825 -7.923 1.817 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.924 -9.405 3.408 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.368 -8.398 2.044 1.00 0.00 H new ATOM 0 HG LEU A 116 -3.514 -10.799 1.961 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.307 -11.820 0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -5.867 -11.397 2.253 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -6.313 -10.373 0.867 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.546 -10.484 -0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.484 -8.986 -0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.821 -9.090 0.352 1.00 0.00 H new ATOM 600 N ALA A 117 -4.270 -6.742 4.544 1.00 0.00 N ATOM 601 CA ALA A 117 -4.761 -5.534 5.189 1.00 0.00 C ATOM 602 C ALA A 117 -3.630 -4.542 5.446 1.00 0.00 C ATOM 603 O ALA A 117 -3.828 -3.330 5.364 1.00 0.00 O ATOM 604 CB ALA A 117 -5.455 -5.896 6.493 1.00 0.00 C ATOM 0 H ALA A 117 -4.277 -7.569 5.142 1.00 0.00 H new ATOM 0 HA ALA A 117 -5.475 -5.054 4.520 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.822 -4.989 6.974 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -6.293 -6.562 6.287 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -4.748 -6.397 7.154 1.00 0.00 H new ATOM 610 N LEU A 118 -2.445 -5.059 5.759 1.00 0.00 N ATOM 611 CA LEU A 118 -1.290 -4.207 6.026 1.00 0.00 C ATOM 612 C LEU A 118 -0.833 -3.494 4.756 1.00 0.00 C ATOM 613 O LEU A 118 -0.682 -2.271 4.738 1.00 0.00 O ATOM 614 CB LEU A 118 -0.141 -5.037 6.603 1.00 0.00 C ATOM 615 CG LEU A 118 1.168 -4.275 6.816 1.00 0.00 C ATOM 616 CD1 LEU A 118 1.885 -4.780 8.059 1.00 0.00 C ATOM 617 CD2 LEU A 118 2.064 -4.404 5.593 1.00 0.00 C ATOM 0 H LEU A 118 -2.260 -6.059 5.834 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.586 -3.453 6.756 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.459 -5.455 7.558 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.050 -5.877 5.935 1.00 0.00 H new ATOM 0 HG LEU A 118 0.932 -3.221 6.961 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.814 -4.226 8.194 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.247 -4.636 8.931 1.00 0.00 H new ATOM 0 HD13 LEU A 118 2.109 -5.841 7.944 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.991 -3.856 5.762 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.291 -5.456 5.418 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.553 -3.993 4.722 1.00 0.00 H new ATOM 629 N LEU A 119 -0.621 -4.265 3.695 1.00 0.00 N ATOM 630 CA LEU A 119 -0.188 -3.708 2.419 1.00 0.00 C ATOM 631 C LEU A 119 -1.231 -2.738 1.880 1.00 0.00 C ATOM 632 O LEU A 119 -0.899 -1.726 1.262 1.00 0.00 O ATOM 633 CB LEU A 119 0.058 -4.828 1.406 1.00 0.00 C ATOM 634 CG LEU A 119 1.052 -5.901 1.854 1.00 0.00 C ATOM 635 CD1 LEU A 119 0.863 -7.174 1.045 1.00 0.00 C ATOM 636 CD2 LEU A 119 2.480 -5.392 1.723 1.00 0.00 C ATOM 0 H LEU A 119 -0.742 -5.278 3.694 1.00 0.00 H new ATOM 0 HA LEU A 119 0.744 -3.166 2.579 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.894 -5.308 1.180 1.00 0.00 H new ATOM 0 HB3 LEU A 119 0.419 -4.385 0.478 1.00 0.00 H new ATOM 0 HG LEU A 119 0.863 -6.129 2.903 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.579 -7.926 1.377 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.150 -7.549 1.188 1.00 0.00 H new ATOM 0 HD13 LEU A 119 1.025 -6.961 -0.012 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.174 -6.168 2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.681 -5.136 0.683 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.610 -4.507 2.346 1.00 0.00 H new ATOM 648 N GLY A 120 -2.497 -3.052 2.131 1.00 0.00 N ATOM 649 CA GLY A 120 -3.577 -2.199 1.680 1.00 0.00 C ATOM 650 C GLY A 120 -3.645 -0.902 2.461 1.00 0.00 C ATOM 651 O GLY A 120 -3.680 0.181 1.879 1.00 0.00 O ATOM 0 H GLY A 120 -2.794 -3.885 2.640 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.445 -1.977 0.621 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -4.523 -2.731 1.779 1.00 0.00 H new ATOM 655 N SER A 121 -3.665 -1.017 3.785 1.00 0.00 N ATOM 656 CA SER A 121 -3.734 0.150 4.659 1.00 0.00 C ATOM 657 C SER A 121 -2.627 1.152 4.343 1.00 0.00 C ATOM 658 O SER A 121 -2.832 2.363 4.433 1.00 0.00 O ATOM 659 CB SER A 121 -3.638 -0.281 6.124 1.00 0.00 C ATOM 660 OG SER A 121 -4.681 -1.177 6.462 1.00 0.00 O ATOM 0 H SER A 121 -3.634 -1.909 4.278 1.00 0.00 H new ATOM 0 HA SER A 121 -4.693 0.638 4.485 1.00 0.00 H new ATOM 0 HB2 SER A 121 -2.674 -0.756 6.304 1.00 0.00 H new ATOM 0 HB3 SER A 121 -3.686 0.597 6.768 1.00 0.00 H new ATOM 0 HG SER A 121 -4.498 -2.056 6.068 1.00 0.00 H new ATOM 666 N TYR A 122 -1.456 0.646 3.968 1.00 0.00 N ATOM 667 CA TYR A 122 -0.328 1.510 3.641 1.00 0.00 C ATOM 668 C TYR A 122 -0.534 2.184 2.289 1.00 0.00 C ATOM 669 O TYR A 122 -0.302 3.384 2.142 1.00 0.00 O ATOM 670 CB TYR A 122 0.973 0.707 3.636 1.00 0.00 C ATOM 671 CG TYR A 122 1.502 0.409 5.022 1.00 0.00 C ATOM 672 CD1 TYR A 122 1.607 1.413 5.975 1.00 0.00 C ATOM 673 CD2 TYR A 122 1.893 -0.876 5.377 1.00 0.00 C ATOM 674 CE1 TYR A 122 2.087 1.147 7.243 1.00 0.00 C ATOM 675 CE2 TYR A 122 2.375 -1.151 6.643 1.00 0.00 C ATOM 676 CZ TYR A 122 2.470 -0.137 7.572 1.00 0.00 C ATOM 677 OH TYR A 122 2.949 -0.407 8.834 1.00 0.00 O ATOM 0 H TYR A 122 -1.264 -0.352 3.883 1.00 0.00 H new ATOM 0 HA TYR A 122 -0.262 2.285 4.405 1.00 0.00 H new ATOM 0 HB2 TYR A 122 0.809 -0.233 3.108 1.00 0.00 H new ATOM 0 HB3 TYR A 122 1.729 1.259 3.078 1.00 0.00 H new ATOM 0 HD1 TYR A 122 1.308 2.419 5.721 1.00 0.00 H new ATOM 0 HD2 TYR A 122 1.819 -1.673 4.652 1.00 0.00 H new ATOM 0 HE1 TYR A 122 2.162 1.940 7.973 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.676 -2.155 6.903 1.00 0.00 H new ATOM 0 HH TYR A 122 3.504 0.340 9.140 1.00 0.00 H new ATOM 687 N THR A 123 -0.978 1.408 1.305 1.00 0.00 N ATOM 688 CA THR A 123 -1.219 1.940 -0.031 1.00 0.00 C ATOM 689 C THR A 123 -2.258 3.053 0.016 1.00 0.00 C ATOM 690 O THR A 123 -2.100 4.091 -0.626 1.00 0.00 O ATOM 691 CB THR A 123 -1.683 0.828 -0.973 1.00 0.00 C ATOM 692 OG1 THR A 123 -0.729 -0.218 -1.024 1.00 0.00 O ATOM 693 CG2 THR A 123 -1.918 1.303 -2.391 1.00 0.00 C ATOM 0 H THR A 123 -1.177 0.413 1.407 1.00 0.00 H new ATOM 0 HA THR A 123 -0.283 2.352 -0.409 1.00 0.00 H new ATOM 0 HB THR A 123 -2.630 0.479 -0.562 1.00 0.00 H new ATOM 0 HG1 THR A 123 -0.688 -0.666 -0.153 1.00 0.00 H new ATOM 0 HG21 THR A 123 -2.245 0.465 -3.006 1.00 0.00 H new ATOM 0 HG22 THR A 123 -2.686 2.076 -2.393 1.00 0.00 H new ATOM 0 HG23 THR A 123 -0.992 1.711 -2.796 1.00 0.00 H new ATOM 701 N ILE A 124 -3.317 2.837 0.790 1.00 0.00 N ATOM 702 CA ILE A 124 -4.370 3.833 0.928 1.00 0.00 C ATOM 703 C ILE A 124 -3.813 5.108 1.551 1.00 0.00 C ATOM 704 O ILE A 124 -4.056 6.208 1.059 1.00 0.00 O ATOM 705 CB ILE A 124 -5.539 3.310 1.789 1.00 0.00 C ATOM 706 CG1 ILE A 124 -6.105 2.016 1.193 1.00 0.00 C ATOM 707 CG2 ILE A 124 -6.631 4.365 1.909 1.00 0.00 C ATOM 708 CD1 ILE A 124 -6.899 2.225 -0.080 1.00 0.00 C ATOM 0 H ILE A 124 -3.467 1.984 1.329 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.749 4.047 -0.071 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.161 3.094 2.788 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.282 1.331 0.989 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.744 1.535 1.934 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -7.446 3.977 2.520 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.222 5.261 2.376 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.008 4.613 0.917 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.267 1.265 -0.441 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -7.743 2.884 0.122 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.259 2.677 -0.838 1.00 0.00 H new ATOM 720 N GLN A 125 -3.058 4.951 2.635 1.00 0.00 N ATOM 721 CA GLN A 125 -2.459 6.087 3.324 1.00 0.00 C ATOM 722 C GLN A 125 -1.555 6.877 2.381 1.00 0.00 C ATOM 723 O GLN A 125 -1.505 8.104 2.435 1.00 0.00 O ATOM 724 CB GLN A 125 -1.657 5.606 4.537 1.00 0.00 C ATOM 725 CG GLN A 125 -0.991 6.729 5.316 1.00 0.00 C ATOM 726 CD GLN A 125 -1.780 7.135 6.545 1.00 0.00 C ATOM 727 OE1 GLN A 125 -2.369 6.293 7.224 1.00 0.00 O ATOM 728 NE2 GLN A 125 -1.797 8.430 6.838 1.00 0.00 N ATOM 0 H GLN A 125 -2.847 4.046 3.055 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.261 6.742 3.664 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -2.320 5.057 5.205 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -0.892 4.906 4.201 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.008 6.414 5.618 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -0.869 7.595 4.665 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -1.295 9.093 6.248 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -2.312 8.762 7.653 1.00 0.00 H new ATOM 737 N SER A 126 -0.842 6.164 1.516 1.00 0.00 N ATOM 738 CA SER A 126 0.059 6.800 0.561 1.00 0.00 C ATOM 739 C SER A 126 -0.713 7.375 -0.625 1.00 0.00 C ATOM 740 O SER A 126 -0.259 8.314 -1.278 1.00 0.00 O ATOM 741 CB SER A 126 1.102 5.796 0.067 1.00 0.00 C ATOM 742 OG SER A 126 2.372 6.408 -0.076 1.00 0.00 O ATOM 0 H SER A 126 -0.870 5.146 1.456 1.00 0.00 H new ATOM 0 HA SER A 126 0.564 7.620 1.071 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.172 4.965 0.769 1.00 0.00 H new ATOM 0 HB3 SER A 126 0.786 5.379 -0.889 1.00 0.00 H new ATOM 0 HG SER A 126 3.021 5.745 -0.391 1.00 0.00 H new ATOM 748 N GLU A 127 -1.874 6.792 -0.906 1.00 0.00 N ATOM 749 CA GLU A 127 -2.700 7.233 -2.023 1.00 0.00 C ATOM 750 C GLU A 127 -3.508 8.471 -1.660 1.00 0.00 C ATOM 751 O GLU A 127 -3.664 9.383 -2.472 1.00 0.00 O ATOM 752 CB GLU A 127 -3.645 6.111 -2.460 1.00 0.00 C ATOM 753 CG GLU A 127 -3.216 5.420 -3.744 1.00 0.00 C ATOM 754 CD GLU A 127 -3.497 6.256 -4.978 1.00 0.00 C ATOM 755 OE1 GLU A 127 -2.787 7.261 -5.188 1.00 0.00 O ATOM 756 OE2 GLU A 127 -4.429 5.905 -5.733 1.00 0.00 O ATOM 0 H GLU A 127 -2.264 6.013 -0.375 1.00 0.00 H new ATOM 0 HA GLU A 127 -2.034 7.488 -2.847 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -3.710 5.370 -1.663 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -4.645 6.522 -2.595 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -2.150 5.199 -3.695 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -3.736 4.466 -3.830 1.00 0.00 H new ATOM 763 N LEU A 128 -4.047 8.484 -0.449 1.00 0.00 N ATOM 764 CA LEU A 128 -4.871 9.592 0.009 1.00 0.00 C ATOM 765 C LEU A 128 -4.201 10.387 1.130 1.00 0.00 C ATOM 766 O LEU A 128 -4.777 11.348 1.641 1.00 0.00 O ATOM 767 CB LEU A 128 -6.209 9.042 0.489 1.00 0.00 C ATOM 768 CG LEU A 128 -6.966 8.212 -0.551 1.00 0.00 C ATOM 769 CD1 LEU A 128 -7.493 6.928 0.068 1.00 0.00 C ATOM 770 CD2 LEU A 128 -8.102 9.019 -1.158 1.00 0.00 C ATOM 0 H LEU A 128 -3.928 7.737 0.235 1.00 0.00 H new ATOM 0 HA LEU A 128 -5.015 10.278 -0.826 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.038 8.426 1.372 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.840 9.875 0.799 1.00 0.00 H new ATOM 0 HG LEU A 128 -6.271 7.947 -1.348 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.028 6.353 -0.688 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -6.659 6.339 0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -8.171 7.170 0.887 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.627 8.411 -1.895 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.796 9.318 -0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.698 9.908 -1.643 1.00 0.00 H new ATOM 782 N GLY A 129 -2.989 9.995 1.510 1.00 0.00 N ATOM 783 CA GLY A 129 -2.284 10.703 2.565 1.00 0.00 C ATOM 784 C GLY A 129 -2.739 10.292 3.953 1.00 0.00 C ATOM 785 O GLY A 129 -2.382 9.219 4.437 1.00 0.00 O ATOM 0 H GLY A 129 -2.484 9.204 1.109 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -1.214 10.518 2.469 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -2.435 11.775 2.441 1.00 0.00 H new ATOM 789 N ASP A 130 -3.526 11.148 4.597 1.00 0.00 N ATOM 790 CA ASP A 130 -4.025 10.863 5.938 1.00 0.00 C ATOM 791 C ASP A 130 -5.487 10.430 5.895 1.00 0.00 C ATOM 792 O ASP A 130 -6.087 10.337 4.824 1.00 0.00 O ATOM 793 CB ASP A 130 -3.866 12.094 6.835 1.00 0.00 C ATOM 794 CG ASP A 130 -3.128 11.780 8.122 1.00 0.00 C ATOM 795 OD1 ASP A 130 -2.048 11.156 8.051 1.00 0.00 O ATOM 796 OD2 ASP A 130 -3.630 12.159 9.202 1.00 0.00 O ATOM 0 H ASP A 130 -3.831 12.042 4.213 1.00 0.00 H new ATOM 0 HA ASP A 130 -3.438 10.043 6.352 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -3.328 12.870 6.291 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -4.851 12.496 7.073 1.00 0.00 H new ATOM 801 N TYR A 131 -6.055 10.163 7.068 1.00 0.00 N ATOM 802 CA TYR A 131 -7.447 9.737 7.164 1.00 0.00 C ATOM 803 C TYR A 131 -8.352 10.908 7.534 1.00 0.00 C ATOM 804 O TYR A 131 -8.120 11.594 8.530 1.00 0.00 O ATOM 805 CB TYR A 131 -7.589 8.621 8.200 1.00 0.00 C ATOM 806 CG TYR A 131 -8.784 7.723 7.967 1.00 0.00 C ATOM 807 CD1 TYR A 131 -10.067 8.248 7.892 1.00 0.00 C ATOM 808 CD2 TYR A 131 -8.628 6.350 7.825 1.00 0.00 C ATOM 809 CE1 TYR A 131 -11.162 7.431 7.681 1.00 0.00 C ATOM 810 CE2 TYR A 131 -9.717 5.526 7.614 1.00 0.00 C ATOM 811 CZ TYR A 131 -10.981 6.072 7.543 1.00 0.00 C ATOM 812 OH TYR A 131 -12.069 5.255 7.334 1.00 0.00 O ATOM 0 H TYR A 131 -5.573 10.234 7.964 1.00 0.00 H new ATOM 0 HA TYR A 131 -7.753 9.360 6.188 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -6.683 8.014 8.194 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -7.668 9.066 9.192 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -10.212 9.313 8.000 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -7.639 5.919 7.880 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -12.154 7.855 7.625 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -9.579 4.460 7.505 1.00 0.00 H new ATOM 0 HH TYR A 131 -11.981 4.809 6.466 1.00 0.00 H new ATOM 822 N ASP A 132 -9.385 11.130 6.727 1.00 0.00 N ATOM 823 CA ASP A 132 -10.327 12.217 6.970 1.00 0.00 C ATOM 824 C ASP A 132 -11.737 11.826 6.527 1.00 0.00 C ATOM 825 O ASP A 132 -12.094 11.982 5.360 1.00 0.00 O ATOM 826 CB ASP A 132 -9.881 13.479 6.232 1.00 0.00 C ATOM 827 CG ASP A 132 -8.529 13.979 6.703 1.00 0.00 C ATOM 828 OD1 ASP A 132 -8.366 14.187 7.924 1.00 0.00 O ATOM 829 OD2 ASP A 132 -7.634 14.161 5.852 1.00 0.00 O ATOM 0 H ASP A 132 -9.591 10.571 5.899 1.00 0.00 H new ATOM 0 HA ASP A 132 -10.344 12.417 8.041 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -9.837 13.274 5.162 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -10.625 14.262 6.376 1.00 0.00 H new ATOM 834 N PRO A 133 -12.559 11.305 7.456 1.00 0.00 N ATOM 835 CA PRO A 133 -13.934 10.887 7.154 1.00 0.00 C ATOM 836 C PRO A 133 -14.817 12.053 6.723 1.00 0.00 C ATOM 837 O PRO A 133 -15.717 11.891 5.899 1.00 0.00 O ATOM 838 CB PRO A 133 -14.440 10.299 8.480 1.00 0.00 C ATOM 839 CG PRO A 133 -13.214 10.039 9.289 1.00 0.00 C ATOM 840 CD PRO A 133 -12.217 11.078 8.868 1.00 0.00 C ATOM 0 HA PRO A 133 -13.963 10.182 6.323 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -15.107 10.994 8.989 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -15.003 9.381 8.314 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -13.427 10.111 10.356 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -12.832 9.034 9.108 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -12.309 11.990 9.458 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -11.192 10.726 8.984 1.00 0.00 H new ATOM 848 N GLU A 134 -14.557 13.228 7.288 1.00 0.00 N ATOM 849 CA GLU A 134 -15.334 14.420 6.963 1.00 0.00 C ATOM 850 C GLU A 134 -14.946 14.976 5.596 1.00 0.00 C ATOM 851 O GLU A 134 -15.766 15.584 4.908 1.00 0.00 O ATOM 852 CB GLU A 134 -15.141 15.493 8.037 1.00 0.00 C ATOM 853 CG GLU A 134 -13.691 15.697 8.445 1.00 0.00 C ATOM 854 CD GLU A 134 -13.425 15.286 9.880 1.00 0.00 C ATOM 855 OE1 GLU A 134 -13.699 14.117 10.224 1.00 0.00 O ATOM 856 OE2 GLU A 134 -12.942 16.134 10.661 1.00 0.00 O ATOM 0 H GLU A 134 -13.816 13.381 7.972 1.00 0.00 H new ATOM 0 HA GLU A 134 -16.385 14.133 6.930 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -15.542 16.438 7.670 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -15.722 15.221 8.918 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -13.046 15.121 7.781 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -13.426 16.746 8.316 1.00 0.00 H new ATOM 863 N LEU A 135 -13.692 14.768 5.208 1.00 0.00 N ATOM 864 CA LEU A 135 -13.202 15.254 3.923 1.00 0.00 C ATOM 865 C LEU A 135 -13.577 14.298 2.795 1.00 0.00 C ATOM 866 O LEU A 135 -14.040 14.723 1.737 1.00 0.00 O ATOM 867 CB LEU A 135 -11.684 15.434 3.968 1.00 0.00 C ATOM 868 CG LEU A 135 -11.203 16.739 4.604 1.00 0.00 C ATOM 869 CD1 LEU A 135 -11.865 17.933 3.933 1.00 0.00 C ATOM 870 CD2 LEU A 135 -11.483 16.740 6.101 1.00 0.00 C ATOM 0 H LEU A 135 -12.998 14.267 5.763 1.00 0.00 H new ATOM 0 HA LEU A 135 -13.672 16.218 3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -11.251 14.599 4.518 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.297 15.380 2.950 1.00 0.00 H new ATOM 0 HG LEU A 135 -10.126 16.817 4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -11.512 18.854 4.398 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.612 17.941 2.873 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.947 17.861 4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -11.134 17.676 6.536 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -12.555 16.639 6.271 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.961 15.906 6.569 1.00 0.00 H new ATOM 882 N HIS A 136 -13.373 13.006 3.027 1.00 0.00 N ATOM 883 CA HIS A 136 -13.690 11.992 2.028 1.00 0.00 C ATOM 884 C HIS A 136 -14.823 11.089 2.507 1.00 0.00 C ATOM 885 O HIS A 136 -15.978 11.268 2.121 1.00 0.00 O ATOM 886 CB HIS A 136 -12.449 11.156 1.707 1.00 0.00 C ATOM 887 CG HIS A 136 -11.404 11.906 0.938 1.00 0.00 C ATOM 888 ND1 HIS A 136 -10.955 11.511 -0.304 1.00 0.00 N ATOM 889 CD2 HIS A 136 -10.720 13.035 1.242 1.00 0.00 C ATOM 890 CE1 HIS A 136 -10.039 12.363 -0.730 1.00 0.00 C ATOM 891 NE2 HIS A 136 -9.879 13.297 0.189 1.00 0.00 N ATOM 0 H HIS A 136 -12.990 12.636 3.897 1.00 0.00 H new ATOM 0 HA HIS A 136 -14.018 12.501 1.122 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -12.013 10.795 2.639 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -12.750 10.279 1.134 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -10.818 13.620 2.145 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -9.511 12.305 -1.670 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -9.235 14.086 0.127 1.00 0.00 H new ATOM 900 N GLY A 137 -14.485 10.121 3.351 1.00 0.00 N ATOM 901 CA GLY A 137 -15.485 9.207 3.869 1.00 0.00 C ATOM 902 C GLY A 137 -14.876 8.032 4.606 1.00 0.00 C ATOM 903 O GLY A 137 -13.870 8.178 5.300 1.00 0.00 O ATOM 0 H GLY A 137 -13.536 9.953 3.686 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -16.151 9.747 4.542 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -16.095 8.837 3.045 1.00 0.00 H new ATOM 907 N VAL A 138 -15.491 6.864 4.457 1.00 0.00 N ATOM 908 CA VAL A 138 -15.007 5.658 5.118 1.00 0.00 C ATOM 909 C VAL A 138 -15.102 4.438 4.204 1.00 0.00 C ATOM 910 O VAL A 138 -14.257 3.545 4.261 1.00 0.00 O ATOM 911 CB VAL A 138 -15.794 5.375 6.411 1.00 0.00 C ATOM 912 CG1 VAL A 138 -15.126 4.264 7.204 1.00 0.00 C ATOM 913 CG2 VAL A 138 -15.919 6.638 7.250 1.00 0.00 C ATOM 0 H VAL A 138 -16.324 6.727 3.885 1.00 0.00 H new ATOM 0 HA VAL A 138 -13.960 5.838 5.363 1.00 0.00 H new ATOM 0 HB VAL A 138 -16.798 5.048 6.141 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -15.694 4.075 8.115 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -15.094 3.356 6.602 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -14.111 4.563 7.465 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -16.478 6.417 8.159 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -14.925 6.999 7.514 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -16.443 7.404 6.679 1.00 0.00 H new ATOM 923 N ASP A 139 -16.137 4.399 3.369 1.00 0.00 N ATOM 924 CA ASP A 139 -16.336 3.280 2.454 1.00 0.00 C ATOM 925 C ASP A 139 -15.695 3.548 1.094 1.00 0.00 C ATOM 926 O ASP A 139 -16.164 3.049 0.071 1.00 0.00 O ATOM 927 CB ASP A 139 -17.830 3.003 2.277 1.00 0.00 C ATOM 928 CG ASP A 139 -18.495 2.572 3.569 1.00 0.00 C ATOM 929 OD1 ASP A 139 -18.447 3.345 4.549 1.00 0.00 O ATOM 930 OD2 ASP A 139 -19.065 1.461 3.601 1.00 0.00 O ATOM 0 H ASP A 139 -16.849 5.127 3.307 1.00 0.00 H new ATOM 0 HA ASP A 139 -15.853 2.405 2.890 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -18.321 3.900 1.901 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -17.966 2.226 1.525 1.00 0.00 H new ATOM 935 N TYR A 140 -14.621 4.332 1.085 1.00 0.00 N ATOM 936 CA TYR A 140 -13.923 4.649 -0.158 1.00 0.00 C ATOM 937 C TYR A 140 -12.939 3.543 -0.538 1.00 0.00 C ATOM 938 O TYR A 140 -12.403 3.534 -1.646 1.00 0.00 O ATOM 939 CB TYR A 140 -13.185 5.988 -0.043 1.00 0.00 C ATOM 940 CG TYR A 140 -12.500 6.210 1.289 1.00 0.00 C ATOM 941 CD1 TYR A 140 -11.673 5.239 1.843 1.00 0.00 C ATOM 942 CD2 TYR A 140 -12.681 7.394 1.992 1.00 0.00 C ATOM 943 CE1 TYR A 140 -11.048 5.442 3.058 1.00 0.00 C ATOM 944 CE2 TYR A 140 -12.059 7.605 3.207 1.00 0.00 C ATOM 945 CZ TYR A 140 -11.244 6.627 3.736 1.00 0.00 C ATOM 946 OH TYR A 140 -10.623 6.834 4.946 1.00 0.00 O ATOM 0 H TYR A 140 -14.216 4.758 1.919 1.00 0.00 H new ATOM 0 HA TYR A 140 -14.674 4.727 -0.944 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -12.440 6.048 -0.836 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -13.896 6.797 -0.212 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -11.517 4.310 1.314 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -13.319 8.163 1.582 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -10.409 4.677 3.475 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -12.210 8.532 3.740 1.00 0.00 H new ATOM 0 HH TYR A 140 -11.256 6.656 5.673 1.00 0.00 H new ATOM 956 N VAL A 141 -12.703 2.613 0.386 1.00 0.00 N ATOM 957 CA VAL A 141 -11.784 1.509 0.139 1.00 0.00 C ATOM 958 C VAL A 141 -12.356 0.538 -0.890 1.00 0.00 C ATOM 959 O VAL A 141 -11.614 -0.188 -1.552 1.00 0.00 O ATOM 960 CB VAL A 141 -11.464 0.741 1.436 1.00 0.00 C ATOM 961 CG1 VAL A 141 -10.287 -0.196 1.223 1.00 0.00 C ATOM 962 CG2 VAL A 141 -11.183 1.709 2.576 1.00 0.00 C ATOM 0 H VAL A 141 -13.136 2.604 1.310 1.00 0.00 H new ATOM 0 HA VAL A 141 -10.863 1.944 -0.250 1.00 0.00 H new ATOM 0 HB VAL A 141 -12.334 0.142 1.705 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -10.075 -0.730 2.149 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -10.530 -0.913 0.438 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.411 0.382 0.929 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -10.959 1.148 3.483 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -10.330 2.337 2.318 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -12.058 2.337 2.744 1.00 0.00 H new ATOM 972 N SER A 142 -13.679 0.536 -1.024 1.00 0.00 N ATOM 973 CA SER A 142 -14.361 -0.337 -1.974 1.00 0.00 C ATOM 974 C SER A 142 -13.968 -0.013 -3.415 1.00 0.00 C ATOM 975 O SER A 142 -14.227 -0.800 -4.325 1.00 0.00 O ATOM 976 CB SER A 142 -15.877 -0.215 -1.810 1.00 0.00 C ATOM 977 OG SER A 142 -16.555 -1.151 -2.629 1.00 0.00 O ATOM 0 H SER A 142 -14.304 1.134 -0.483 1.00 0.00 H new ATOM 0 HA SER A 142 -14.054 -1.361 -1.761 1.00 0.00 H new ATOM 0 HB2 SER A 142 -16.147 -0.377 -0.767 1.00 0.00 H new ATOM 0 HB3 SER A 142 -16.194 0.796 -2.068 1.00 0.00 H new ATOM 0 HG SER A 142 -15.987 -1.391 -3.390 1.00 0.00 H new ATOM 983 N ASP A 143 -13.339 1.141 -3.620 1.00 0.00 N ATOM 984 CA ASP A 143 -12.911 1.549 -4.952 1.00 0.00 C ATOM 985 C ASP A 143 -11.489 1.073 -5.233 1.00 0.00 C ATOM 986 O ASP A 143 -11.112 0.856 -6.384 1.00 0.00 O ATOM 987 CB ASP A 143 -12.991 3.070 -5.093 1.00 0.00 C ATOM 988 CG ASP A 143 -14.415 3.584 -5.016 1.00 0.00 C ATOM 989 OD1 ASP A 143 -15.173 3.107 -4.145 1.00 0.00 O ATOM 990 OD2 ASP A 143 -14.774 4.463 -5.827 1.00 0.00 O ATOM 0 H ASP A 143 -13.115 1.808 -2.881 1.00 0.00 H new ATOM 0 HA ASP A 143 -13.580 1.090 -5.680 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -12.396 3.537 -4.308 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -12.551 3.367 -6.045 1.00 0.00 H new ATOM 995 N PHE A 144 -10.703 0.913 -4.171 1.00 0.00 N ATOM 996 CA PHE A 144 -9.322 0.462 -4.302 1.00 0.00 C ATOM 997 C PHE A 144 -9.237 -1.059 -4.221 1.00 0.00 C ATOM 998 O PHE A 144 -9.738 -1.669 -3.276 1.00 0.00 O ATOM 999 CB PHE A 144 -8.453 1.092 -3.213 1.00 0.00 C ATOM 1000 CG PHE A 144 -8.316 2.582 -3.345 1.00 0.00 C ATOM 1001 CD1 PHE A 144 -9.322 3.426 -2.901 1.00 0.00 C ATOM 1002 CD2 PHE A 144 -7.182 3.139 -3.913 1.00 0.00 C ATOM 1003 CE1 PHE A 144 -9.200 4.797 -3.022 1.00 0.00 C ATOM 1004 CE2 PHE A 144 -7.053 4.510 -4.037 1.00 0.00 C ATOM 1005 CZ PHE A 144 -8.064 5.339 -3.591 1.00 0.00 C ATOM 0 H PHE A 144 -11.000 1.089 -3.211 1.00 0.00 H new ATOM 0 HA PHE A 144 -8.954 0.777 -5.278 1.00 0.00 H new ATOM 0 HB2 PHE A 144 -8.880 0.859 -2.238 1.00 0.00 H new ATOM 0 HB3 PHE A 144 -7.462 0.640 -3.243 1.00 0.00 H new ATOM 0 HD1 PHE A 144 -10.212 3.007 -2.455 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -6.389 2.495 -4.263 1.00 0.00 H new ATOM 0 HE1 PHE A 144 -9.991 5.444 -2.672 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -6.164 4.932 -4.482 1.00 0.00 H new ATOM 0 HZ PHE A 144 -7.966 6.410 -3.687 1.00 0.00 H new ATOM 1015 N LYS A 145 -8.602 -1.665 -5.219 1.00 0.00 N ATOM 1016 CA LYS A 145 -8.453 -3.116 -5.262 1.00 0.00 C ATOM 1017 C LYS A 145 -7.275 -3.571 -4.408 1.00 0.00 C ATOM 1018 O LYS A 145 -6.140 -3.634 -4.880 1.00 0.00 O ATOM 1019 CB LYS A 145 -8.261 -3.585 -6.705 1.00 0.00 C ATOM 1020 CG LYS A 145 -9.363 -3.126 -7.646 1.00 0.00 C ATOM 1021 CD LYS A 145 -8.843 -2.137 -8.677 1.00 0.00 C ATOM 1022 CE LYS A 145 -9.490 -2.358 -10.035 1.00 0.00 C ATOM 1023 NZ LYS A 145 -8.801 -3.424 -10.812 1.00 0.00 N ATOM 0 H LYS A 145 -8.182 -1.174 -6.009 1.00 0.00 H new ATOM 0 HA LYS A 145 -9.362 -3.561 -4.858 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -7.303 -3.217 -7.073 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -8.211 -4.674 -6.721 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -9.792 -3.990 -8.154 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -10.165 -2.664 -7.070 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -9.041 -1.120 -8.339 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -7.761 -2.238 -8.767 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -10.537 -2.628 -9.898 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -9.472 -1.427 -10.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -9.273 -3.544 -11.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -7.808 -3.155 -10.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -8.840 -4.319 -10.284 1.00 0.00 H new ATOM 1037 N LEU A 146 -7.552 -3.885 -3.147 1.00 0.00 N ATOM 1038 CA LEU A 146 -6.515 -4.333 -2.225 1.00 0.00 C ATOM 1039 C LEU A 146 -6.330 -5.847 -2.294 1.00 0.00 C ATOM 1040 O LEU A 146 -5.279 -6.369 -1.921 1.00 0.00 O ATOM 1041 CB LEU A 146 -6.864 -3.915 -0.796 1.00 0.00 C ATOM 1042 CG LEU A 146 -7.365 -2.477 -0.650 1.00 0.00 C ATOM 1043 CD1 LEU A 146 -8.426 -2.388 0.437 1.00 0.00 C ATOM 1044 CD2 LEU A 146 -6.207 -1.538 -0.349 1.00 0.00 C ATOM 0 H LEU A 146 -8.486 -3.837 -2.740 1.00 0.00 H new ATOM 0 HA LEU A 146 -5.577 -3.862 -2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -7.627 -4.591 -0.411 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -5.981 -4.042 -0.170 1.00 0.00 H new ATOM 0 HG LEU A 146 -7.817 -2.172 -1.594 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -8.770 -1.358 0.526 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -9.267 -3.030 0.178 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -8.002 -2.712 1.387 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -6.581 -0.519 -0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -5.725 -1.841 0.580 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -5.484 -1.580 -1.163 1.00 0.00 H new ATOM 1056 N ALA A 147 -7.354 -6.548 -2.773 1.00 0.00 N ATOM 1057 CA ALA A 147 -7.297 -8.001 -2.889 1.00 0.00 C ATOM 1058 C ALA A 147 -8.419 -8.524 -3.782 1.00 0.00 C ATOM 1059 O ALA A 147 -9.374 -7.805 -4.075 1.00 0.00 O ATOM 1060 CB ALA A 147 -7.370 -8.643 -1.512 1.00 0.00 C ATOM 0 H ALA A 147 -8.232 -6.134 -3.087 1.00 0.00 H new ATOM 0 HA ALA A 147 -6.347 -8.268 -3.351 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -7.326 -9.727 -1.613 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -6.531 -8.301 -0.906 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -8.305 -8.361 -1.028 1.00 0.00 H new ATOM 1066 N PRO A 148 -8.318 -9.788 -4.228 1.00 0.00 N ATOM 1067 CA PRO A 148 -9.332 -10.401 -5.092 1.00 0.00 C ATOM 1068 C PRO A 148 -10.647 -10.644 -4.358 1.00 0.00 C ATOM 1069 O PRO A 148 -11.721 -10.324 -4.867 1.00 0.00 O ATOM 1070 CB PRO A 148 -8.695 -11.731 -5.503 1.00 0.00 C ATOM 1071 CG PRO A 148 -7.729 -12.042 -4.414 1.00 0.00 C ATOM 1072 CD PRO A 148 -7.212 -10.716 -3.927 1.00 0.00 C ATOM 0 HA PRO A 148 -9.590 -9.760 -5.935 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -9.446 -12.515 -5.602 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -8.192 -11.648 -6.466 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -8.214 -12.592 -3.607 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -6.915 -12.667 -4.781 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.986 -10.740 -2.861 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.295 -10.429 -4.441 1.00 0.00 H new ATOM 1080 N ASN A 149 -10.554 -11.210 -3.159 1.00 0.00 N ATOM 1081 CA ASN A 149 -11.737 -11.494 -2.355 1.00 0.00 C ATOM 1082 C ASN A 149 -11.830 -10.536 -1.170 1.00 0.00 C ATOM 1083 O ASN A 149 -11.719 -10.946 -0.014 1.00 0.00 O ATOM 1084 CB ASN A 149 -11.706 -12.942 -1.861 1.00 0.00 C ATOM 1085 CG ASN A 149 -13.078 -13.587 -1.875 1.00 0.00 C ATOM 1086 OD1 ASN A 149 -13.348 -14.481 -2.676 1.00 0.00 O ATOM 1087 ND2 ASN A 149 -13.954 -13.134 -0.985 1.00 0.00 N ATOM 0 H ASN A 149 -9.672 -11.481 -2.723 1.00 0.00 H new ATOM 0 HA ASN A 149 -12.618 -11.352 -2.981 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -11.028 -13.522 -2.487 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -11.305 -12.969 -0.848 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -14.893 -13.529 -0.947 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -13.687 -12.391 -0.339 1.00 0.00 H new ATOM 1094 N GLN A 150 -12.033 -9.257 -1.466 1.00 0.00 N ATOM 1095 CA GLN A 150 -12.140 -8.240 -0.426 1.00 0.00 C ATOM 1096 C GLN A 150 -13.379 -8.467 0.434 1.00 0.00 C ATOM 1097 O GLN A 150 -14.507 -8.397 -0.054 1.00 0.00 O ATOM 1098 CB GLN A 150 -12.187 -6.844 -1.049 1.00 0.00 C ATOM 1099 CG GLN A 150 -12.021 -5.723 -0.038 1.00 0.00 C ATOM 1100 CD GLN A 150 -11.817 -4.372 -0.695 1.00 0.00 C ATOM 1101 OE1 GLN A 150 -11.493 -3.366 0.109 1.00 0.00 O flip ATOM 1102 NE2 GLN A 150 -11.949 -4.234 -1.911 1.00 0.00 N flip ATOM 0 H GLN A 150 -12.127 -8.900 -2.417 1.00 0.00 H new ATOM 0 HA GLN A 150 -11.259 -8.316 0.211 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -11.402 -6.764 -1.801 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -13.138 -6.718 -1.567 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -12.902 -5.682 0.602 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -11.169 -5.942 0.606 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -12.199 -5.035 -2.491 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -11.808 -3.319 -2.339 1.00 0.00 H new ATOM 1111 N THR A 151 -13.159 -8.739 1.715 1.00 0.00 N ATOM 1112 CA THR A 151 -14.257 -8.976 2.645 1.00 0.00 C ATOM 1113 C THR A 151 -14.349 -7.856 3.674 1.00 0.00 C ATOM 1114 O THR A 151 -13.377 -7.140 3.913 1.00 0.00 O ATOM 1115 CB THR A 151 -14.075 -10.320 3.352 1.00 0.00 C ATOM 1116 OG1 THR A 151 -15.034 -10.479 4.382 1.00 0.00 O ATOM 1117 CG2 THR A 151 -12.704 -10.489 3.971 1.00 0.00 C ATOM 0 H THR A 151 -12.231 -8.801 2.133 1.00 0.00 H new ATOM 0 HA THR A 151 -15.185 -8.998 2.073 1.00 0.00 H new ATOM 0 HB THR A 151 -14.201 -11.074 2.576 1.00 0.00 H new ATOM 0 HG1 THR A 151 -14.902 -11.345 4.821 1.00 0.00 H new ATOM 0 HG21 THR A 151 -12.641 -11.463 4.456 1.00 0.00 H new ATOM 0 HG22 THR A 151 -11.943 -10.421 3.194 1.00 0.00 H new ATOM 0 HG23 THR A 151 -12.539 -9.705 4.710 1.00 0.00 H new ATOM 1125 N LYS A 152 -15.527 -7.704 4.278 1.00 0.00 N ATOM 1126 CA LYS A 152 -15.752 -6.665 5.280 1.00 0.00 C ATOM 1127 C LYS A 152 -14.596 -6.590 6.274 1.00 0.00 C ATOM 1128 O LYS A 152 -14.151 -5.503 6.642 1.00 0.00 O ATOM 1129 CB LYS A 152 -17.064 -6.924 6.024 1.00 0.00 C ATOM 1130 CG LYS A 152 -18.285 -6.358 5.317 1.00 0.00 C ATOM 1131 CD LYS A 152 -19.567 -6.691 6.064 1.00 0.00 C ATOM 1132 CE LYS A 152 -20.789 -6.121 5.359 1.00 0.00 C ATOM 1133 NZ LYS A 152 -21.444 -5.050 6.160 1.00 0.00 N ATOM 0 H LYS A 152 -16.341 -8.289 4.090 1.00 0.00 H new ATOM 0 HA LYS A 152 -15.814 -5.709 4.761 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -17.194 -7.999 6.152 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -16.998 -6.490 7.022 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -18.186 -5.276 5.227 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -18.338 -6.758 4.305 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -19.668 -7.773 6.151 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -19.512 -6.293 7.077 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -20.494 -5.720 4.389 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -21.504 -6.921 5.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -22.272 -4.688 5.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -21.748 -5.438 7.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -20.770 -4.274 6.320 1.00 0.00 H new ATOM 1147 N GLU A 153 -14.110 -7.751 6.702 1.00 0.00 N ATOM 1148 CA GLU A 153 -13.002 -7.811 7.649 1.00 0.00 C ATOM 1149 C GLU A 153 -11.780 -7.084 7.097 1.00 0.00 C ATOM 1150 O GLU A 153 -11.155 -6.283 7.792 1.00 0.00 O ATOM 1151 CB GLU A 153 -12.646 -9.265 7.963 1.00 0.00 C ATOM 1152 CG GLU A 153 -13.689 -9.979 8.806 1.00 0.00 C ATOM 1153 CD GLU A 153 -13.814 -9.394 10.199 1.00 0.00 C ATOM 1154 OE1 GLU A 153 -12.955 -9.704 11.052 1.00 0.00 O ATOM 1155 OE2 GLU A 153 -14.769 -8.626 10.438 1.00 0.00 O ATOM 0 H GLU A 153 -14.465 -8.661 6.409 1.00 0.00 H new ATOM 0 HA GLU A 153 -13.315 -7.317 8.569 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -12.514 -9.808 7.027 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -11.689 -9.291 8.485 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -14.655 -9.924 8.305 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -13.429 -11.035 8.881 1.00 0.00 H new ATOM 1162 N LEU A 154 -11.449 -7.365 5.841 1.00 0.00 N ATOM 1163 CA LEU A 154 -10.307 -6.734 5.194 1.00 0.00 C ATOM 1164 C LEU A 154 -10.551 -5.237 5.029 1.00 0.00 C ATOM 1165 O LEU A 154 -9.662 -4.421 5.265 1.00 0.00 O ATOM 1166 CB LEU A 154 -10.048 -7.383 3.831 1.00 0.00 C ATOM 1167 CG LEU A 154 -8.964 -6.714 2.984 1.00 0.00 C ATOM 1168 CD1 LEU A 154 -7.647 -6.658 3.745 1.00 0.00 C ATOM 1169 CD2 LEU A 154 -8.789 -7.453 1.666 1.00 0.00 C ATOM 0 H LEU A 154 -11.956 -8.026 5.252 1.00 0.00 H new ATOM 0 HA LEU A 154 -9.428 -6.875 5.822 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -9.770 -8.425 3.990 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -10.979 -7.384 3.265 1.00 0.00 H new ATOM 0 HG LEU A 154 -9.277 -5.692 2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.889 -6.179 3.126 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -7.781 -6.085 4.663 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.327 -7.670 3.993 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -8.014 -6.964 1.075 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -8.498 -8.485 1.863 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -9.729 -7.440 1.114 1.00 0.00 H new ATOM 1181 N GLU A 155 -11.770 -4.888 4.629 1.00 0.00 N ATOM 1182 CA GLU A 155 -12.141 -3.490 4.437 1.00 0.00 C ATOM 1183 C GLU A 155 -11.981 -2.707 5.737 1.00 0.00 C ATOM 1184 O GLU A 155 -11.302 -1.680 5.777 1.00 0.00 O ATOM 1185 CB GLU A 155 -13.585 -3.387 3.941 1.00 0.00 C ATOM 1186 CG GLU A 155 -13.843 -4.157 2.656 1.00 0.00 C ATOM 1187 CD GLU A 155 -15.290 -4.080 2.211 1.00 0.00 C ATOM 1188 OE1 GLU A 155 -16.183 -4.310 3.054 1.00 0.00 O ATOM 1189 OE2 GLU A 155 -15.531 -3.790 1.021 1.00 0.00 O ATOM 0 H GLU A 155 -12.517 -5.554 4.432 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.476 -3.061 3.687 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -14.254 -3.757 4.717 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -13.832 -2.337 3.782 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -13.203 -3.764 1.866 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -13.566 -5.201 2.801 1.00 0.00 H new ATOM 1196 N GLU A 156 -12.612 -3.200 6.799 1.00 0.00 N ATOM 1197 CA GLU A 156 -12.544 -2.551 8.104 1.00 0.00 C ATOM 1198 C GLU A 156 -11.095 -2.358 8.545 1.00 0.00 C ATOM 1199 O GLU A 156 -10.695 -1.261 8.933 1.00 0.00 O ATOM 1200 CB GLU A 156 -13.300 -3.376 9.147 1.00 0.00 C ATOM 1201 CG GLU A 156 -14.807 -3.378 8.944 1.00 0.00 C ATOM 1202 CD GLU A 156 -15.561 -3.819 10.182 1.00 0.00 C ATOM 1203 OE1 GLU A 156 -15.091 -4.755 10.862 1.00 0.00 O ATOM 1204 OE2 GLU A 156 -16.623 -3.229 10.472 1.00 0.00 O ATOM 0 H GLU A 156 -13.177 -4.049 6.781 1.00 0.00 H new ATOM 0 HA GLU A 156 -13.011 -1.570 8.017 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -12.936 -4.403 9.119 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -13.076 -2.985 10.140 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -15.133 -2.377 8.662 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -15.057 -4.040 8.115 1.00 0.00 H new ATOM 1211 N LYS A 157 -10.319 -3.436 8.498 1.00 0.00 N ATOM 1212 CA LYS A 157 -8.920 -3.390 8.910 1.00 0.00 C ATOM 1213 C LYS A 157 -8.143 -2.349 8.108 1.00 0.00 C ATOM 1214 O LYS A 157 -7.198 -1.745 8.616 1.00 0.00 O ATOM 1215 CB LYS A 157 -8.273 -4.766 8.742 1.00 0.00 C ATOM 1216 CG LYS A 157 -7.150 -5.034 9.730 1.00 0.00 C ATOM 1217 CD LYS A 157 -7.691 -5.440 11.092 1.00 0.00 C ATOM 1218 CE LYS A 157 -6.881 -4.822 12.220 1.00 0.00 C ATOM 1219 NZ LYS A 157 -6.707 -5.764 13.360 1.00 0.00 N ATOM 0 H LYS A 157 -10.635 -4.352 8.179 1.00 0.00 H new ATOM 0 HA LYS A 157 -8.889 -3.105 9.961 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -9.038 -5.534 8.856 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -7.882 -4.853 7.728 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -6.505 -5.823 9.344 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -6.534 -4.141 9.834 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -8.732 -5.130 11.178 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -7.673 -6.526 11.183 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -5.903 -4.524 11.843 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -7.377 -3.917 12.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -6.149 -5.304 14.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -7.639 -6.029 13.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -6.210 -6.617 13.033 1.00 0.00 H new ATOM 1233 N VAL A 158 -8.548 -2.132 6.862 1.00 0.00 N ATOM 1234 CA VAL A 158 -7.885 -1.150 6.012 1.00 0.00 C ATOM 1235 C VAL A 158 -8.114 0.262 6.544 1.00 0.00 C ATOM 1236 O VAL A 158 -7.172 1.037 6.704 1.00 0.00 O ATOM 1237 CB VAL A 158 -8.383 -1.231 4.553 1.00 0.00 C ATOM 1238 CG1 VAL A 158 -7.731 -0.152 3.698 1.00 0.00 C ATOM 1239 CG2 VAL A 158 -8.113 -2.612 3.972 1.00 0.00 C ATOM 0 H VAL A 158 -9.327 -2.619 6.420 1.00 0.00 H new ATOM 0 HA VAL A 158 -6.819 -1.379 6.028 1.00 0.00 H new ATOM 0 HB VAL A 158 -9.460 -1.061 4.551 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.097 -0.229 2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -7.980 0.830 4.100 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -6.649 -0.285 3.707 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -8.471 -2.650 2.943 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -7.042 -2.812 3.991 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -8.633 -3.364 4.565 1.00 0.00 H new ATOM 1249 N MET A 159 -9.373 0.584 6.818 1.00 0.00 N ATOM 1250 CA MET A 159 -9.733 1.899 7.336 1.00 0.00 C ATOM 1251 C MET A 159 -9.210 2.091 8.756 1.00 0.00 C ATOM 1252 O MET A 159 -8.717 3.162 9.108 1.00 0.00 O ATOM 1253 CB MET A 159 -11.252 2.080 7.311 1.00 0.00 C ATOM 1254 CG MET A 159 -11.880 1.761 5.965 1.00 0.00 C ATOM 1255 SD MET A 159 -13.632 1.352 6.096 1.00 0.00 S ATOM 1256 CE MET A 159 -13.815 0.202 4.736 1.00 0.00 C ATOM 0 H MET A 159 -10.163 -0.049 6.690 1.00 0.00 H new ATOM 0 HA MET A 159 -9.272 2.651 6.696 1.00 0.00 H new ATOM 0 HB2 MET A 159 -11.698 1.440 8.072 1.00 0.00 H new ATOM 0 HB3 MET A 159 -11.491 3.109 7.580 1.00 0.00 H new ATOM 0 HG2 MET A 159 -11.759 2.616 5.300 1.00 0.00 H new ATOM 0 HG3 MET A 159 -11.349 0.925 5.509 1.00 0.00 H new ATOM 0 HE1 MET A 159 -14.468 -0.617 5.037 1.00 0.00 H new ATOM 0 HE2 MET A 159 -14.251 0.717 3.880 1.00 0.00 H new ATOM 0 HE3 MET A 159 -12.838 -0.195 4.461 1.00 0.00 H new ATOM 1266 N GLU A 160 -9.326 1.046 9.569 1.00 0.00 N ATOM 1267 CA GLU A 160 -8.870 1.100 10.954 1.00 0.00 C ATOM 1268 C GLU A 160 -7.368 1.355 11.028 1.00 0.00 C ATOM 1269 O GLU A 160 -6.922 2.301 11.677 1.00 0.00 O ATOM 1270 CB GLU A 160 -9.213 -0.204 11.676 1.00 0.00 C ATOM 1271 CG GLU A 160 -9.105 -0.107 13.189 1.00 0.00 C ATOM 1272 CD GLU A 160 -10.457 0.034 13.861 1.00 0.00 C ATOM 1273 OE1 GLU A 160 -11.386 -0.712 13.488 1.00 0.00 O ATOM 1274 OE2 GLU A 160 -10.586 0.891 14.761 1.00 0.00 O ATOM 0 H GLU A 160 -9.732 0.152 9.293 1.00 0.00 H new ATOM 0 HA GLU A 160 -9.383 1.927 11.445 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -10.228 -0.501 11.411 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -8.548 -0.992 11.322 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -8.604 -0.996 13.572 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -8.482 0.748 13.451 1.00 0.00 H new ATOM 1281 N LEU A 161 -6.593 0.506 10.361 1.00 0.00 N ATOM 1282 CA LEU A 161 -5.140 0.641 10.353 1.00 0.00 C ATOM 1283 C LEU A 161 -4.722 2.014 9.836 1.00 0.00 C ATOM 1284 O LEU A 161 -3.807 2.639 10.372 1.00 0.00 O ATOM 1285 CB LEU A 161 -4.511 -0.453 9.490 1.00 0.00 C ATOM 1286 CG LEU A 161 -4.495 -1.847 10.119 1.00 0.00 C ATOM 1287 CD1 LEU A 161 -4.053 -2.888 9.100 1.00 0.00 C ATOM 1288 CD2 LEU A 161 -3.587 -1.869 11.340 1.00 0.00 C ATOM 0 H LEU A 161 -6.946 -0.283 9.819 1.00 0.00 H new ATOM 0 HA LEU A 161 -4.786 0.536 11.378 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.051 -0.504 8.545 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -3.486 -0.165 9.256 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.507 -2.093 10.440 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.048 -3.874 9.566 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.744 -2.889 8.257 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.050 -2.648 8.747 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -3.587 -2.868 11.776 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.572 -1.602 11.044 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -3.950 -1.152 12.076 1.00 0.00 H new ATOM 1300 N HIS A 162 -5.398 2.475 8.789 1.00 0.00 N ATOM 1301 CA HIS A 162 -5.099 3.773 8.194 1.00 0.00 C ATOM 1302 C HIS A 162 -5.224 4.890 9.226 1.00 0.00 C ATOM 1303 O HIS A 162 -4.276 5.639 9.463 1.00 0.00 O ATOM 1304 CB HIS A 162 -6.042 4.038 7.018 1.00 0.00 C ATOM 1305 CG HIS A 162 -5.712 5.274 6.236 1.00 0.00 C ATOM 1306 ND1 HIS A 162 -5.104 6.428 6.606 1.00 0.00 N flip ATOM 1307 CD2 HIS A 162 -6.018 5.417 4.900 1.00 0.00 C flip ATOM 1308 CE1 HIS A 162 -5.055 7.235 5.495 1.00 0.00 C flip ATOM 1309 NE2 HIS A 162 -5.612 6.602 4.480 1.00 0.00 N flip ATOM 0 H HIS A 162 -6.158 1.968 8.334 1.00 0.00 H new ATOM 0 HA HIS A 162 -4.070 3.755 7.834 1.00 0.00 H new ATOM 0 HB2 HIS A 162 -6.019 3.179 6.347 1.00 0.00 H new ATOM 0 HB3 HIS A 162 -7.061 4.121 7.395 1.00 0.00 H new ATOM 0 HD2 HIS A 162 -6.513 4.675 4.291 1.00 0.00 H new ATOM 0 HE1 HIS A 162 -4.629 8.227 5.458 1.00 0.00 H new ATOM 0 HE2 HIS A 162 -5.712 6.966 3.532 1.00 0.00 H new ATOM 1318 N LYS A 163 -6.398 4.995 9.840 1.00 0.00 N ATOM 1319 CA LYS A 163 -6.646 6.021 10.847 1.00 0.00 C ATOM 1320 C LYS A 163 -5.814 5.771 12.100 1.00 0.00 C ATOM 1321 O LYS A 163 -5.438 6.709 12.805 1.00 0.00 O ATOM 1322 CB LYS A 163 -8.132 6.060 11.209 1.00 0.00 C ATOM 1323 CG LYS A 163 -8.484 7.134 12.225 1.00 0.00 C ATOM 1324 CD LYS A 163 -9.857 6.899 12.834 1.00 0.00 C ATOM 1325 CE LYS A 163 -9.857 7.175 14.329 1.00 0.00 C ATOM 1326 NZ LYS A 163 -9.601 5.941 15.122 1.00 0.00 N ATOM 0 H LYS A 163 -7.193 4.382 9.658 1.00 0.00 H new ATOM 0 HA LYS A 163 -6.354 6.983 10.426 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -8.714 6.225 10.302 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -8.427 5.088 11.604 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -7.733 7.149 13.015 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -8.461 8.112 11.744 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -10.588 7.542 12.344 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -10.165 5.869 12.653 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -9.095 7.920 14.561 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -10.818 7.600 14.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -9.609 6.172 16.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -10.342 5.239 14.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -8.673 5.549 14.864 1.00 0.00 H new ATOM 1340 N SER A 164 -5.533 4.502 12.375 1.00 0.00 N ATOM 1341 CA SER A 164 -4.748 4.129 13.546 1.00 0.00 C ATOM 1342 C SER A 164 -3.310 4.628 13.432 1.00 0.00 C ATOM 1343 O SER A 164 -2.614 4.770 14.437 1.00 0.00 O ATOM 1344 CB SER A 164 -4.757 2.611 13.729 1.00 0.00 C ATOM 1345 OG SER A 164 -3.890 1.981 12.803 1.00 0.00 O ATOM 0 H SER A 164 -5.837 3.714 11.803 1.00 0.00 H new ATOM 0 HA SER A 164 -5.205 4.600 14.416 1.00 0.00 H new ATOM 0 HB2 SER A 164 -4.452 2.362 14.745 1.00 0.00 H new ATOM 0 HB3 SER A 164 -5.771 2.232 13.599 1.00 0.00 H new ATOM 0 HG SER A 164 -3.807 2.539 12.001 1.00 0.00 H new ATOM 1351 N TYR A 165 -2.866 4.891 12.205 1.00 0.00 N ATOM 1352 CA TYR A 165 -1.508 5.370 11.974 1.00 0.00 C ATOM 1353 C TYR A 165 -1.363 6.829 12.393 1.00 0.00 C ATOM 1354 O TYR A 165 -2.120 7.693 11.950 1.00 0.00 O ATOM 1355 CB TYR A 165 -1.132 5.210 10.500 1.00 0.00 C ATOM 1356 CG TYR A 165 -0.931 3.771 10.079 1.00 0.00 C ATOM 1357 CD1 TYR A 165 -0.219 2.886 10.880 1.00 0.00 C ATOM 1358 CD2 TYR A 165 -1.452 3.298 8.881 1.00 0.00 C ATOM 1359 CE1 TYR A 165 -0.033 1.571 10.499 1.00 0.00 C ATOM 1360 CE2 TYR A 165 -1.271 1.984 8.494 1.00 0.00 C ATOM 1361 CZ TYR A 165 -0.561 1.125 9.306 1.00 0.00 C ATOM 1362 OH TYR A 165 -0.378 -0.184 8.923 1.00 0.00 O ATOM 0 H TYR A 165 -3.425 4.781 11.359 1.00 0.00 H new ATOM 0 HA TYR A 165 -0.831 4.770 12.582 1.00 0.00 H new ATOM 0 HB2 TYR A 165 -1.914 5.654 9.884 1.00 0.00 H new ATOM 0 HB3 TYR A 165 -0.216 5.768 10.305 1.00 0.00 H new ATOM 0 HD1 TYR A 165 0.196 3.232 11.815 1.00 0.00 H new ATOM 0 HD2 TYR A 165 -2.008 3.968 8.242 1.00 0.00 H new ATOM 0 HE1 TYR A 165 0.523 0.896 11.132 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -1.684 1.632 7.560 1.00 0.00 H new ATOM 0 HH TYR A 165 0.472 -0.268 8.442 1.00 0.00 H new ATOM 1372 N ARG A 166 -0.382 7.095 13.249 1.00 0.00 N ATOM 1373 CA ARG A 166 -0.129 8.448 13.733 1.00 0.00 C ATOM 1374 C ARG A 166 0.310 9.360 12.587 1.00 0.00 C ATOM 1375 O ARG A 166 0.063 9.060 11.419 1.00 0.00 O ATOM 1376 CB ARG A 166 0.936 8.420 14.834 1.00 0.00 C ATOM 1377 CG ARG A 166 0.728 7.310 15.853 1.00 0.00 C ATOM 1378 CD ARG A 166 1.657 7.461 17.047 1.00 0.00 C ATOM 1379 NE ARG A 166 0.963 7.225 18.311 1.00 0.00 N ATOM 1380 CZ ARG A 166 1.563 6.805 19.424 1.00 0.00 C ATOM 1381 NH1 ARG A 166 2.871 6.582 19.440 1.00 0.00 N ATOM 1382 NH2 ARG A 166 0.851 6.611 20.525 1.00 0.00 N ATOM 0 H ARG A 166 0.253 6.390 13.623 1.00 0.00 H new ATOM 0 HA ARG A 166 -1.054 8.847 14.148 1.00 0.00 H new ATOM 0 HB2 ARG A 166 1.918 8.302 14.376 1.00 0.00 H new ATOM 0 HB3 ARG A 166 0.939 9.380 15.350 1.00 0.00 H new ATOM 0 HG2 ARG A 166 -0.307 7.319 16.194 1.00 0.00 H new ATOM 0 HG3 ARG A 166 0.899 6.344 15.379 1.00 0.00 H new ATOM 0 HD2 ARG A 166 2.487 6.761 16.952 1.00 0.00 H new ATOM 0 HD3 ARG A 166 2.085 8.464 17.049 1.00 0.00 H new ATOM 0 HE ARG A 166 -0.043 7.392 18.343 1.00 0.00 H new ATOM 0 HH11 ARG A 166 3.424 6.732 18.596 1.00 0.00 H new ATOM 0 HH12 ARG A 166 3.323 6.261 20.296 1.00 0.00 H new ATOM 0 HH21 ARG A 166 -0.154 6.783 20.519 1.00 0.00 H new ATOM 0 HH22 ARG A 166 1.308 6.289 21.378 1.00 0.00 H new ATOM 1396 N SER A 167 0.957 10.473 12.927 1.00 0.00 N ATOM 1397 CA SER A 167 1.425 11.424 11.924 1.00 0.00 C ATOM 1398 C SER A 167 2.531 10.813 11.068 1.00 0.00 C ATOM 1399 O SER A 167 3.703 11.167 11.200 1.00 0.00 O ATOM 1400 CB SER A 167 1.931 12.700 12.600 1.00 0.00 C ATOM 1401 OG SER A 167 0.949 13.242 13.466 1.00 0.00 O ATOM 0 H SER A 167 1.168 10.737 13.889 1.00 0.00 H new ATOM 0 HA SER A 167 0.586 11.673 11.275 1.00 0.00 H new ATOM 0 HB2 SER A 167 2.837 12.481 13.165 1.00 0.00 H new ATOM 0 HB3 SER A 167 2.198 13.436 11.841 1.00 0.00 H new ATOM 0 HG SER A 167 1.297 14.056 13.887 1.00 0.00 H new ATOM 1407 N MET A 168 2.146 9.893 10.192 1.00 0.00 N ATOM 1408 CA MET A 168 3.096 9.226 9.311 1.00 0.00 C ATOM 1409 C MET A 168 3.306 10.025 8.027 1.00 0.00 C ATOM 1410 O MET A 168 2.389 10.686 7.539 1.00 0.00 O ATOM 1411 CB MET A 168 2.604 7.818 8.974 1.00 0.00 C ATOM 1412 CG MET A 168 3.673 6.930 8.361 1.00 0.00 C ATOM 1413 SD MET A 168 4.220 5.622 9.476 1.00 0.00 S ATOM 1414 CE MET A 168 2.841 4.485 9.367 1.00 0.00 C ATOM 0 H MET A 168 1.179 9.591 10.073 1.00 0.00 H new ATOM 0 HA MET A 168 4.051 9.157 9.833 1.00 0.00 H new ATOM 0 HB2 MET A 168 2.229 7.346 9.882 1.00 0.00 H new ATOM 0 HB3 MET A 168 1.764 7.891 8.283 1.00 0.00 H new ATOM 0 HG2 MET A 168 3.286 6.482 7.446 1.00 0.00 H new ATOM 0 HG3 MET A 168 4.530 7.542 8.079 1.00 0.00 H new ATOM 0 HE1 MET A 168 3.031 3.621 10.004 1.00 0.00 H new ATOM 0 HE2 MET A 168 1.930 4.985 9.696 1.00 0.00 H new ATOM 0 HE3 MET A 168 2.722 4.156 8.335 1.00 0.00 H new ATOM 1424 N THR A 169 4.517 9.955 7.483 1.00 0.00 N ATOM 1425 CA THR A 169 4.848 10.668 6.254 1.00 0.00 C ATOM 1426 C THR A 169 4.664 9.764 5.039 1.00 0.00 C ATOM 1427 O THR A 169 4.564 8.545 5.172 1.00 0.00 O ATOM 1428 CB THR A 169 6.289 11.179 6.310 1.00 0.00 C ATOM 1429 OG1 THR A 169 7.074 10.374 7.172 1.00 0.00 O ATOM 1430 CG2 THR A 169 6.398 12.609 6.791 1.00 0.00 C ATOM 0 H THR A 169 5.286 9.411 7.874 1.00 0.00 H new ATOM 0 HA THR A 169 4.172 11.518 6.160 1.00 0.00 H new ATOM 0 HB THR A 169 6.653 11.129 5.284 1.00 0.00 H new ATOM 0 HG1 THR A 169 7.992 10.716 7.193 1.00 0.00 H new ATOM 0 HG21 THR A 169 7.446 12.909 6.807 1.00 0.00 H new ATOM 0 HG22 THR A 169 5.844 13.263 6.117 1.00 0.00 H new ATOM 0 HG23 THR A 169 5.983 12.688 7.796 1.00 0.00 H new ATOM 1438 N PRO A 170 4.620 10.350 3.831 1.00 0.00 N ATOM 1439 CA PRO A 170 4.453 9.586 2.593 1.00 0.00 C ATOM 1440 C PRO A 170 5.533 8.524 2.434 1.00 0.00 C ATOM 1441 O PRO A 170 5.237 7.356 2.182 1.00 0.00 O ATOM 1442 CB PRO A 170 4.568 10.644 1.485 1.00 0.00 C ATOM 1443 CG PRO A 170 5.177 11.838 2.139 1.00 0.00 C ATOM 1444 CD PRO A 170 4.737 11.793 3.573 1.00 0.00 C ATOM 0 HA PRO A 170 3.507 9.045 2.572 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.189 10.287 0.663 1.00 0.00 H new ATOM 0 HB3 PRO A 170 3.590 10.882 1.066 1.00 0.00 H new ATOM 0 HG2 PRO A 170 6.264 11.812 2.063 1.00 0.00 H new ATOM 0 HG3 PRO A 170 4.846 12.758 1.658 1.00 0.00 H new ATOM 0 HD2 PRO A 170 5.464 12.265 4.234 1.00 0.00 H new ATOM 0 HD3 PRO A 170 3.788 12.309 3.722 1.00 0.00 H new ATOM 1452 N ALA A 171 6.788 8.938 2.581 1.00 0.00 N ATOM 1453 CA ALA A 171 7.917 8.022 2.452 1.00 0.00 C ATOM 1454 C ALA A 171 7.783 6.843 3.409 1.00 0.00 C ATOM 1455 O ALA A 171 8.120 5.710 3.064 1.00 0.00 O ATOM 1456 CB ALA A 171 9.224 8.760 2.701 1.00 0.00 C ATOM 0 H ALA A 171 7.049 9.902 2.790 1.00 0.00 H new ATOM 0 HA ALA A 171 7.920 7.630 1.435 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.058 8.066 2.602 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.332 9.564 1.973 1.00 0.00 H new ATOM 0 HB3 ALA A 171 9.219 9.180 3.707 1.00 0.00 H new ATOM 1462 N GLN A 172 7.287 7.114 4.613 1.00 0.00 N ATOM 1463 CA GLN A 172 7.107 6.071 5.616 1.00 0.00 C ATOM 1464 C GLN A 172 6.200 4.967 5.085 1.00 0.00 C ATOM 1465 O GLN A 172 6.473 3.781 5.269 1.00 0.00 O ATOM 1466 CB GLN A 172 6.519 6.661 6.898 1.00 0.00 C ATOM 1467 CG GLN A 172 7.569 7.209 7.851 1.00 0.00 C ATOM 1468 CD GLN A 172 8.052 6.170 8.843 1.00 0.00 C ATOM 1469 OE1 GLN A 172 9.279 5.699 8.655 1.00 0.00 O flip ATOM 1470 NE2 GLN A 172 7.332 5.795 9.768 1.00 0.00 N flip ATOM 0 H GLN A 172 7.003 8.046 4.917 1.00 0.00 H new ATOM 0 HA GLN A 172 8.083 5.641 5.841 1.00 0.00 H new ATOM 0 HB2 GLN A 172 5.825 7.460 6.636 1.00 0.00 H new ATOM 0 HB3 GLN A 172 5.941 5.892 7.410 1.00 0.00 H new ATOM 0 HG2 GLN A 172 8.418 7.580 7.277 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.155 8.059 8.393 1.00 0.00 H new ATOM 0 HE21 GLN A 172 6.395 6.184 9.875 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.672 5.095 10.428 1.00 0.00 H new ATOM 1479 N ALA A 173 5.123 5.367 4.417 1.00 0.00 N ATOM 1480 CA ALA A 173 4.179 4.414 3.848 1.00 0.00 C ATOM 1481 C ALA A 173 4.815 3.657 2.688 1.00 0.00 C ATOM 1482 O ALA A 173 4.694 2.435 2.586 1.00 0.00 O ATOM 1483 CB ALA A 173 2.919 5.131 3.390 1.00 0.00 C ATOM 0 H ALA A 173 4.883 6.345 4.257 1.00 0.00 H new ATOM 0 HA ALA A 173 3.908 3.692 4.619 1.00 0.00 H new ATOM 0 HB1 ALA A 173 2.222 4.408 2.967 1.00 0.00 H new ATOM 0 HB2 ALA A 173 2.454 5.628 4.241 1.00 0.00 H new ATOM 0 HB3 ALA A 173 3.177 5.872 2.633 1.00 0.00 H new ATOM 1489 N ASP A 174 5.500 4.395 1.819 1.00 0.00 N ATOM 1490 CA ASP A 174 6.167 3.802 0.666 1.00 0.00 C ATOM 1491 C ASP A 174 7.163 2.735 1.113 1.00 0.00 C ATOM 1492 O ASP A 174 7.268 1.667 0.507 1.00 0.00 O ATOM 1493 CB ASP A 174 6.891 4.882 -0.139 1.00 0.00 C ATOM 1494 CG ASP A 174 5.970 5.591 -1.113 1.00 0.00 C ATOM 1495 OD1 ASP A 174 5.059 4.931 -1.656 1.00 0.00 O ATOM 1496 OD2 ASP A 174 6.160 6.805 -1.333 1.00 0.00 O ATOM 0 H ASP A 174 5.607 5.407 1.893 1.00 0.00 H new ATOM 0 HA ASP A 174 5.411 3.334 0.036 1.00 0.00 H new ATOM 0 HB2 ASP A 174 7.324 5.612 0.545 1.00 0.00 H new ATOM 0 HB3 ASP A 174 7.717 4.430 -0.688 1.00 0.00 H new ATOM 1501 N LEU A 175 7.883 3.035 2.188 1.00 0.00 N ATOM 1502 CA LEU A 175 8.868 2.114 2.742 1.00 0.00 C ATOM 1503 C LEU A 175 8.193 0.934 3.438 1.00 0.00 C ATOM 1504 O LEU A 175 8.727 -0.174 3.461 1.00 0.00 O ATOM 1505 CB LEU A 175 9.780 2.848 3.727 1.00 0.00 C ATOM 1506 CG LEU A 175 11.097 2.138 4.048 1.00 0.00 C ATOM 1507 CD1 LEU A 175 11.838 1.781 2.768 1.00 0.00 C ATOM 1508 CD2 LEU A 175 11.965 3.009 4.943 1.00 0.00 C ATOM 0 H LEU A 175 7.802 3.916 2.696 1.00 0.00 H new ATOM 0 HA LEU A 175 9.466 1.726 1.917 1.00 0.00 H new ATOM 0 HB2 LEU A 175 10.007 3.834 3.322 1.00 0.00 H new ATOM 0 HB3 LEU A 175 9.233 3.003 4.657 1.00 0.00 H new ATOM 0 HG LEU A 175 10.870 1.214 4.581 1.00 0.00 H new ATOM 0 HD11 LEU A 175 12.772 1.277 3.017 1.00 0.00 H new ATOM 0 HD12 LEU A 175 11.219 1.120 2.162 1.00 0.00 H new ATOM 0 HD13 LEU A 175 12.055 2.690 2.207 1.00 0.00 H new ATOM 0 HD21 LEU A 175 12.898 2.490 5.162 1.00 0.00 H new ATOM 0 HD22 LEU A 175 12.183 3.948 4.435 1.00 0.00 H new ATOM 0 HD23 LEU A 175 11.437 3.214 5.874 1.00 0.00 H new ATOM 1520 N GLU A 176 7.026 1.187 4.022 1.00 0.00 N ATOM 1521 CA GLU A 176 6.285 0.153 4.739 1.00 0.00 C ATOM 1522 C GLU A 176 5.896 -1.007 3.826 1.00 0.00 C ATOM 1523 O GLU A 176 6.206 -2.164 4.114 1.00 0.00 O ATOM 1524 CB GLU A 176 5.031 0.753 5.378 1.00 0.00 C ATOM 1525 CG GLU A 176 5.288 1.401 6.728 1.00 0.00 C ATOM 1526 CD GLU A 176 5.550 0.384 7.822 1.00 0.00 C ATOM 1527 OE1 GLU A 176 5.887 -0.772 7.490 1.00 0.00 O ATOM 1528 OE2 GLU A 176 5.419 0.744 9.011 1.00 0.00 O ATOM 0 H GLU A 176 6.572 2.100 4.013 1.00 0.00 H new ATOM 0 HA GLU A 176 6.941 -0.241 5.516 1.00 0.00 H new ATOM 0 HB2 GLU A 176 4.609 1.496 4.702 1.00 0.00 H new ATOM 0 HB3 GLU A 176 4.283 -0.031 5.497 1.00 0.00 H new ATOM 0 HG2 GLU A 176 6.143 2.072 6.648 1.00 0.00 H new ATOM 0 HG3 GLU A 176 4.428 2.012 7.003 1.00 0.00 H new ATOM 1535 N PHE A 177 5.219 -0.698 2.724 1.00 0.00 N ATOM 1536 CA PHE A 177 4.797 -1.732 1.785 1.00 0.00 C ATOM 1537 C PHE A 177 5.997 -2.300 1.035 1.00 0.00 C ATOM 1538 O PHE A 177 6.081 -3.507 0.808 1.00 0.00 O ATOM 1539 CB PHE A 177 3.764 -1.174 0.800 1.00 0.00 C ATOM 1540 CG PHE A 177 3.490 -2.074 -0.373 1.00 0.00 C ATOM 1541 CD1 PHE A 177 4.352 -2.099 -1.458 1.00 0.00 C ATOM 1542 CD2 PHE A 177 2.373 -2.892 -0.389 1.00 0.00 C ATOM 1543 CE1 PHE A 177 4.105 -2.924 -2.537 1.00 0.00 C ATOM 1544 CE2 PHE A 177 2.120 -3.720 -1.467 1.00 0.00 C ATOM 1545 CZ PHE A 177 2.987 -3.736 -2.542 1.00 0.00 C ATOM 0 H PHE A 177 4.953 0.251 2.461 1.00 0.00 H new ATOM 0 HA PHE A 177 4.333 -2.540 2.351 1.00 0.00 H new ATOM 0 HB2 PHE A 177 2.830 -0.993 1.332 1.00 0.00 H new ATOM 0 HB3 PHE A 177 4.113 -0.209 0.431 1.00 0.00 H new ATOM 0 HD1 PHE A 177 5.227 -1.466 -1.459 1.00 0.00 H new ATOM 0 HD2 PHE A 177 1.692 -2.883 0.449 1.00 0.00 H new ATOM 0 HE1 PHE A 177 4.785 -2.935 -3.376 1.00 0.00 H new ATOM 0 HE2 PHE A 177 1.245 -4.354 -1.468 1.00 0.00 H new ATOM 0 HZ PHE A 177 2.791 -4.382 -3.385 1.00 0.00 H new ATOM 1555 N LEU A 178 6.925 -1.429 0.656 1.00 0.00 N ATOM 1556 CA LEU A 178 8.117 -1.859 -0.062 1.00 0.00 C ATOM 1557 C LEU A 178 8.952 -2.799 0.800 1.00 0.00 C ATOM 1558 O LEU A 178 9.448 -3.818 0.322 1.00 0.00 O ATOM 1559 CB LEU A 178 8.951 -0.649 -0.485 1.00 0.00 C ATOM 1560 CG LEU A 178 8.413 0.115 -1.696 1.00 0.00 C ATOM 1561 CD1 LEU A 178 9.381 1.214 -2.107 1.00 0.00 C ATOM 1562 CD2 LEU A 178 8.156 -0.837 -2.857 1.00 0.00 C ATOM 0 H LEU A 178 6.875 -0.426 0.833 1.00 0.00 H new ATOM 0 HA LEU A 178 7.803 -2.397 -0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 178 9.020 0.038 0.358 1.00 0.00 H new ATOM 0 HB3 LEU A 178 9.964 -0.984 -0.707 1.00 0.00 H new ATOM 0 HG LEU A 178 7.467 0.579 -1.418 1.00 0.00 H new ATOM 0 HD11 LEU A 178 8.982 1.747 -2.970 1.00 0.00 H new ATOM 0 HD12 LEU A 178 9.513 1.911 -1.279 1.00 0.00 H new ATOM 0 HD13 LEU A 178 10.343 0.773 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 178 7.774 -0.276 -3.710 1.00 0.00 H new ATOM 0 HD22 LEU A 178 9.087 -1.331 -3.136 1.00 0.00 H new ATOM 0 HD23 LEU A 178 7.423 -1.586 -2.558 1.00 0.00 H new ATOM 1574 N GLU A 179 9.094 -2.453 2.075 1.00 0.00 N ATOM 1575 CA GLU A 179 9.860 -3.269 3.010 1.00 0.00 C ATOM 1576 C GLU A 179 9.160 -4.597 3.265 1.00 0.00 C ATOM 1577 O GLU A 179 9.805 -5.624 3.478 1.00 0.00 O ATOM 1578 CB GLU A 179 10.059 -2.523 4.330 1.00 0.00 C ATOM 1579 CG GLU A 179 11.051 -1.377 4.237 1.00 0.00 C ATOM 1580 CD GLU A 179 12.491 -1.849 4.277 1.00 0.00 C ATOM 1581 OE1 GLU A 179 12.750 -3.002 3.873 1.00 0.00 O ATOM 1582 OE2 GLU A 179 13.360 -1.065 4.714 1.00 0.00 O ATOM 0 H GLU A 179 8.688 -1.612 2.485 1.00 0.00 H new ATOM 0 HA GLU A 179 10.835 -3.469 2.566 1.00 0.00 H new ATOM 0 HB2 GLU A 179 9.098 -2.134 4.666 1.00 0.00 H new ATOM 0 HB3 GLU A 179 10.401 -3.228 5.088 1.00 0.00 H new ATOM 0 HG2 GLU A 179 10.879 -0.826 3.313 1.00 0.00 H new ATOM 0 HG3 GLU A 179 10.877 -0.683 5.059 1.00 0.00 H new ATOM 1589 N ASN A 180 7.835 -4.568 3.228 1.00 0.00 N ATOM 1590 CA ASN A 180 7.042 -5.769 3.442 1.00 0.00 C ATOM 1591 C ASN A 180 7.142 -6.693 2.231 1.00 0.00 C ATOM 1592 O ASN A 180 7.408 -7.887 2.366 1.00 0.00 O ATOM 1593 CB ASN A 180 5.583 -5.394 3.701 1.00 0.00 C ATOM 1594 CG ASN A 180 5.204 -5.524 5.163 1.00 0.00 C ATOM 1595 OD1 ASN A 180 4.802 -6.594 5.619 1.00 0.00 O ATOM 1596 ND2 ASN A 180 5.331 -4.431 5.907 1.00 0.00 N ATOM 0 H ASN A 180 7.287 -3.726 3.052 1.00 0.00 H new ATOM 0 HA ASN A 180 7.431 -6.295 4.314 1.00 0.00 H new ATOM 0 HB2 ASN A 180 5.411 -4.369 3.373 1.00 0.00 H new ATOM 0 HB3 ASN A 180 4.934 -6.033 3.102 1.00 0.00 H new ATOM 0 HD21 ASN A 180 5.091 -4.458 6.898 1.00 0.00 H new ATOM 0 HD22 ASN A 180 5.668 -3.565 5.487 1.00 0.00 H new ATOM 1603 N ALA A 181 6.929 -6.125 1.049 1.00 0.00 N ATOM 1604 CA ALA A 181 6.996 -6.887 -0.192 1.00 0.00 C ATOM 1605 C ALA A 181 8.393 -7.457 -0.413 1.00 0.00 C ATOM 1606 O ALA A 181 8.547 -8.579 -0.896 1.00 0.00 O ATOM 1607 CB ALA A 181 6.587 -6.014 -1.368 1.00 0.00 C ATOM 0 H ALA A 181 6.708 -5.137 0.924 1.00 0.00 H new ATOM 0 HA ALA A 181 6.301 -7.723 -0.115 1.00 0.00 H new ATOM 0 HB1 ALA A 181 6.641 -6.595 -2.289 1.00 0.00 H new ATOM 0 HB2 ALA A 181 5.566 -5.661 -1.221 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.260 -5.159 -1.438 1.00 0.00 H new ATOM 1613 N LYS A 182 9.410 -6.678 -0.056 1.00 0.00 N ATOM 1614 CA LYS A 182 10.794 -7.110 -0.216 1.00 0.00 C ATOM 1615 C LYS A 182 11.133 -8.222 0.770 1.00 0.00 C ATOM 1616 O LYS A 182 11.899 -9.132 0.454 1.00 0.00 O ATOM 1617 CB LYS A 182 11.750 -5.931 -0.025 1.00 0.00 C ATOM 1618 CG LYS A 182 12.909 -5.930 -1.006 1.00 0.00 C ATOM 1619 CD LYS A 182 13.940 -4.873 -0.652 1.00 0.00 C ATOM 1620 CE LYS A 182 13.515 -3.495 -1.132 1.00 0.00 C ATOM 1621 NZ LYS A 182 13.946 -3.238 -2.534 1.00 0.00 N ATOM 0 H LYS A 182 9.302 -5.746 0.345 1.00 0.00 H new ATOM 0 HA LYS A 182 10.911 -7.497 -1.228 1.00 0.00 H new ATOM 0 HB2 LYS A 182 11.193 -5.000 -0.131 1.00 0.00 H new ATOM 0 HB3 LYS A 182 12.144 -5.953 0.991 1.00 0.00 H new ATOM 0 HG2 LYS A 182 13.382 -6.912 -1.013 1.00 0.00 H new ATOM 0 HG3 LYS A 182 12.534 -5.750 -2.013 1.00 0.00 H new ATOM 0 HD2 LYS A 182 14.086 -4.854 0.428 1.00 0.00 H new ATOM 0 HD3 LYS A 182 14.899 -5.135 -1.099 1.00 0.00 H new ATOM 0 HE2 LYS A 182 12.431 -3.405 -1.063 1.00 0.00 H new ATOM 0 HE3 LYS A 182 13.940 -2.735 -0.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 13.637 -2.288 -2.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 14.982 -3.299 -2.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 13.520 -3.948 -3.164 1.00 0.00 H new ATOM 1635 N LYS A 183 10.556 -8.145 1.966 1.00 0.00 N ATOM 1636 CA LYS A 183 10.797 -9.151 2.994 1.00 0.00 C ATOM 1637 C LYS A 183 10.063 -10.451 2.672 1.00 0.00 C ATOM 1638 O LYS A 183 10.416 -11.515 3.181 1.00 0.00 O ATOM 1639 CB LYS A 183 10.356 -8.625 4.363 1.00 0.00 C ATOM 1640 CG LYS A 183 11.504 -8.097 5.208 1.00 0.00 C ATOM 1641 CD LYS A 183 11.051 -7.764 6.622 1.00 0.00 C ATOM 1642 CE LYS A 183 11.069 -6.265 6.878 1.00 0.00 C ATOM 1643 NZ LYS A 183 12.164 -5.874 7.807 1.00 0.00 N ATOM 0 H LYS A 183 9.920 -7.398 2.246 1.00 0.00 H new ATOM 0 HA LYS A 183 11.867 -9.360 3.019 1.00 0.00 H new ATOM 0 HB2 LYS A 183 9.625 -7.829 4.219 1.00 0.00 H new ATOM 0 HB3 LYS A 183 9.853 -9.425 4.906 1.00 0.00 H new ATOM 0 HG2 LYS A 183 12.301 -8.840 5.246 1.00 0.00 H new ATOM 0 HG3 LYS A 183 11.922 -7.206 4.740 1.00 0.00 H new ATOM 0 HD2 LYS A 183 10.044 -8.149 6.782 1.00 0.00 H new ATOM 0 HD3 LYS A 183 11.701 -8.264 7.340 1.00 0.00 H new ATOM 0 HE2 LYS A 183 11.189 -5.737 5.932 1.00 0.00 H new ATOM 0 HE3 LYS A 183 10.111 -5.956 7.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 12.142 -4.845 7.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 12.036 -6.358 8.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 13.081 -6.145 7.397 1.00 0.00 H new ATOM 1657 N LEU A 184 9.042 -10.360 1.825 1.00 0.00 N ATOM 1658 CA LEU A 184 8.263 -11.531 1.436 1.00 0.00 C ATOM 1659 C LEU A 184 8.785 -12.138 0.135 1.00 0.00 C ATOM 1660 O LEU A 184 8.379 -13.234 -0.252 1.00 0.00 O ATOM 1661 CB LEU A 184 6.786 -11.158 1.281 1.00 0.00 C ATOM 1662 CG LEU A 184 6.072 -10.702 2.563 1.00 0.00 C ATOM 1663 CD1 LEU A 184 4.638 -11.204 2.573 1.00 0.00 C ATOM 1664 CD2 LEU A 184 6.807 -11.183 3.808 1.00 0.00 C ATOM 0 H LEU A 184 8.735 -9.488 1.395 1.00 0.00 H new ATOM 0 HA LEU A 184 8.365 -12.276 2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 184 6.708 -10.361 0.541 1.00 0.00 H new ATOM 0 HB3 LEU A 184 6.254 -12.020 0.878 1.00 0.00 H new ATOM 0 HG LEU A 184 6.068 -9.612 2.575 1.00 0.00 H new ATOM 0 HD11 LEU A 184 4.143 -10.874 3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 184 4.107 -10.805 1.709 1.00 0.00 H new ATOM 0 HD13 LEU A 184 4.633 -12.293 2.531 1.00 0.00 H new ATOM 0 HD21 LEU A 184 6.276 -10.844 4.698 1.00 0.00 H new ATOM 0 HD22 LEU A 184 6.852 -12.272 3.806 1.00 0.00 H new ATOM 0 HD23 LEU A 184 7.819 -10.778 3.813 1.00 0.00 H new ATOM 1676 N SER A 185 9.686 -11.424 -0.537 1.00 0.00 N ATOM 1677 CA SER A 185 10.257 -11.901 -1.792 1.00 0.00 C ATOM 1678 C SER A 185 9.174 -12.070 -2.853 1.00 0.00 C ATOM 1679 O SER A 185 8.714 -13.182 -3.113 1.00 0.00 O ATOM 1680 CB SER A 185 10.989 -13.227 -1.576 1.00 0.00 C ATOM 1681 OG SER A 185 11.396 -13.792 -2.810 1.00 0.00 O ATOM 0 H SER A 185 10.035 -10.515 -0.233 1.00 0.00 H new ATOM 0 HA SER A 185 10.971 -11.156 -2.143 1.00 0.00 H new ATOM 0 HB2 SER A 185 11.860 -13.066 -0.941 1.00 0.00 H new ATOM 0 HB3 SER A 185 10.337 -13.925 -1.051 1.00 0.00 H new ATOM 0 HG SER A 185 11.863 -14.638 -2.644 1.00 0.00 H new ATOM 1687 N MET A 186 8.772 -10.959 -3.461 1.00 0.00 N ATOM 1688 CA MET A 186 7.743 -10.982 -4.494 1.00 0.00 C ATOM 1689 C MET A 186 8.322 -10.584 -5.848 1.00 0.00 C ATOM 1690 O MET A 186 7.926 -11.116 -6.885 1.00 0.00 O ATOM 1691 CB MET A 186 6.596 -10.039 -4.122 1.00 0.00 C ATOM 1692 CG MET A 186 6.159 -10.155 -2.671 1.00 0.00 C ATOM 1693 SD MET A 186 4.900 -8.943 -2.228 1.00 0.00 S ATOM 1694 CE MET A 186 3.406 -9.895 -2.489 1.00 0.00 C ATOM 0 H MET A 186 9.143 -10.031 -3.256 1.00 0.00 H new ATOM 0 HA MET A 186 7.360 -12.000 -4.567 1.00 0.00 H new ATOM 0 HB2 MET A 186 6.903 -9.012 -4.319 1.00 0.00 H new ATOM 0 HB3 MET A 186 5.742 -10.246 -4.767 1.00 0.00 H new ATOM 0 HG2 MET A 186 5.772 -11.158 -2.491 1.00 0.00 H new ATOM 0 HG3 MET A 186 7.026 -10.027 -2.023 1.00 0.00 H new ATOM 0 HE1 MET A 186 2.549 -9.340 -2.107 1.00 0.00 H new ATOM 0 HE2 MET A 186 3.273 -10.079 -3.555 1.00 0.00 H new ATOM 0 HE3 MET A 186 3.485 -10.847 -1.964 1.00 0.00 H new ATOM 1704 N TYR A 187 9.260 -9.643 -5.830 1.00 0.00 N ATOM 1705 CA TYR A 187 9.894 -9.171 -7.056 1.00 0.00 C ATOM 1706 C TYR A 187 11.412 -9.282 -6.961 1.00 0.00 C ATOM 1707 O TYR A 187 12.086 -9.064 -7.991 1.00 0.00 O ATOM 1708 CB TYR A 187 9.493 -7.722 -7.337 1.00 0.00 C ATOM 1709 CG TYR A 187 9.806 -6.774 -6.201 1.00 0.00 C ATOM 1710 CD1 TYR A 187 9.070 -6.803 -5.022 1.00 0.00 C ATOM 1711 CD2 TYR A 187 10.838 -5.850 -6.307 1.00 0.00 C ATOM 1712 CE1 TYR A 187 9.354 -5.938 -3.983 1.00 0.00 C ATOM 1713 CE2 TYR A 187 11.127 -4.981 -5.271 1.00 0.00 C ATOM 1714 CZ TYR A 187 10.383 -5.029 -4.112 1.00 0.00 C ATOM 1715 OH TYR A 187 10.667 -4.166 -3.079 1.00 0.00 O ATOM 1716 OXT TYR A 187 11.916 -9.583 -5.859 1.00 0.00 O ATOM 0 H TYR A 187 9.598 -9.192 -4.980 1.00 0.00 H new ATOM 0 HA TYR A 187 9.553 -9.801 -7.878 1.00 0.00 H new ATOM 0 HB2 TYR A 187 10.006 -7.380 -8.236 1.00 0.00 H new ATOM 0 HB3 TYR A 187 8.424 -7.684 -7.546 1.00 0.00 H new ATOM 0 HD1 TYR A 187 8.263 -7.513 -4.917 1.00 0.00 H new ATOM 0 HD2 TYR A 187 11.424 -5.810 -7.213 1.00 0.00 H new ATOM 0 HE1 TYR A 187 8.773 -5.973 -3.074 1.00 0.00 H new ATOM 0 HE2 TYR A 187 11.932 -4.268 -5.370 1.00 0.00 H new ATOM 0 HH TYR A 187 11.420 -3.592 -3.330 1.00 0.00 H new TER 1726 TYR A 187