USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 770 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: B 155 HIS :FLIP no HE2:sc= -2.33! F(o=-4.8,f=-4.1!) USER MOD Set 1.2: B 161 HIS : no HD1:sc= -1.74 K(o=-4.1,f=-5.7) USER MOD Set 2.1: A 155 HIS : no HE2:sc= -0.682 K(o=-0.82,f=-3.4) USER MOD Set 2.2: A 161 HIS : no HD1:sc= -0.136 K(o=-0.82,f=-4!) USER MOD Set 3.1: A 130 THR OG1 : rot -130:sc= 0.379 USER MOD Set 3.2: A 145 GLN : amide:sc= -0.507 K(o=-0.13,f=-3.9!) USER MOD Single : A 119 SER OG : rot -58:sc= 1.11 USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 GLN : amide:sc=-0.00423 X(o=-0.0042,f=-0.087) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot -79:sc= 0.427 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN : amide:sc= -0.0952 K(o=-0.095,f=-0.98) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 119 SER OG : rot 180:sc= 0 USER MOD Single : B 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 126 GLN : amide:sc= -0.285 X(o=-0.28,f=0) USER MOD Single : B 130 THR OG1 : rot 180:sc= 0 USER MOD Single : B 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 135 SER OG : rot -66:sc= -0.457 USER MOD Single : B 145 GLN : amide:sc= -0.463 X(o=-0.46,f=0) USER MOD Single : B 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 156 GLN : amide:sc= -0.276 X(o=-0.28,f=0) USER MOD Single : B 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 118 59.463 5.464 -21.162 1.00 0.00 N ATOM 2 CA GLY A 118 59.713 5.793 -19.730 1.00 0.00 C ATOM 3 C GLY A 118 60.228 4.550 -19.004 1.00 0.00 C ATOM 4 O GLY A 118 61.082 3.839 -19.497 1.00 0.00 O ATOM 0 HA2 GLY A 118 60.441 6.600 -19.653 1.00 0.00 H new ATOM 0 HA3 GLY A 118 58.795 6.147 -19.261 1.00 0.00 H new ATOM 10 N SER A 119 59.717 4.280 -17.834 1.00 0.00 N ATOM 11 CA SER A 119 60.178 3.081 -17.076 1.00 0.00 C ATOM 12 C SER A 119 58.980 2.351 -16.462 1.00 0.00 C ATOM 13 O SER A 119 58.371 2.821 -15.522 1.00 0.00 O ATOM 14 CB SER A 119 61.089 3.633 -15.980 1.00 0.00 C ATOM 15 OG SER A 119 60.657 3.150 -14.717 1.00 0.00 O ATOM 0 H SER A 119 59.000 4.838 -17.370 1.00 0.00 H new ATOM 0 HA SER A 119 60.695 2.363 -17.712 1.00 0.00 H new ATOM 0 HB2 SER A 119 62.120 3.331 -16.163 1.00 0.00 H new ATOM 0 HB3 SER A 119 61.069 4.723 -15.991 1.00 0.00 H new ATOM 0 HG SER A 119 59.725 3.414 -14.567 1.00 0.00 H new ATOM 21 N ARG A 120 58.637 1.206 -16.988 1.00 0.00 N ATOM 22 CA ARG A 120 57.477 0.451 -16.433 1.00 0.00 C ATOM 23 C ARG A 120 57.948 -0.851 -15.776 1.00 0.00 C ATOM 24 O ARG A 120 57.166 -1.746 -15.524 1.00 0.00 O ATOM 25 CB ARG A 120 56.590 0.147 -17.640 1.00 0.00 C ATOM 26 CG ARG A 120 55.461 1.178 -17.716 1.00 0.00 C ATOM 27 CD ARG A 120 55.077 1.407 -19.179 1.00 0.00 C ATOM 28 NE ARG A 120 54.079 2.513 -19.141 1.00 0.00 N ATOM 29 CZ ARG A 120 53.290 2.645 -18.109 1.00 0.00 C ATOM 30 NH1 ARG A 120 53.680 3.338 -17.075 1.00 0.00 N1+ ATOM 31 NH2 ARG A 120 52.112 2.084 -18.113 1.00 0.00 N ATOM 0 H ARG A 120 59.108 0.762 -17.776 1.00 0.00 H new ATOM 0 HA ARG A 120 56.949 1.018 -15.666 1.00 0.00 H new ATOM 0 HB2 ARG A 120 57.182 0.172 -18.555 1.00 0.00 H new ATOM 0 HB3 ARG A 120 56.175 -0.857 -17.556 1.00 0.00 H new ATOM 0 HG2 ARG A 120 54.596 0.828 -17.152 1.00 0.00 H new ATOM 0 HG3 ARG A 120 55.780 2.116 -17.261 1.00 0.00 H new ATOM 0 HD2 ARG A 120 55.946 1.679 -19.778 1.00 0.00 H new ATOM 0 HD3 ARG A 120 54.653 0.506 -19.622 1.00 0.00 H new ATOM 0 HE ARG A 120 54.012 3.167 -19.921 1.00 0.00 H new ATOM 0 HH11 ARG A 120 54.601 3.777 -17.073 1.00 0.00 H new ATOM 0 HH12 ARG A 120 53.064 3.441 -16.269 1.00 0.00 H new ATOM 0 HH21 ARG A 120 51.808 1.543 -18.922 1.00 0.00 H new ATOM 0 HH22 ARG A 120 51.495 2.187 -17.307 1.00 0.00 H new ATOM 45 N GLN A 121 59.217 -0.966 -15.492 1.00 0.00 N ATOM 46 CA GLN A 121 59.725 -2.213 -14.850 1.00 0.00 C ATOM 47 C GLN A 121 60.569 -1.869 -13.619 1.00 0.00 C ATOM 48 O GLN A 121 60.145 -2.050 -12.494 1.00 0.00 O ATOM 49 CB GLN A 121 60.585 -2.888 -15.919 1.00 0.00 C ATOM 50 CG GLN A 121 59.715 -3.834 -16.749 1.00 0.00 C ATOM 51 CD GLN A 121 60.602 -4.636 -17.703 1.00 0.00 C ATOM 52 OE1 GLN A 121 61.033 -4.130 -18.721 1.00 0.00 O ATOM 53 NE2 GLN A 121 60.894 -5.875 -17.417 1.00 0.00 N ATOM 0 H GLN A 121 59.923 -0.253 -15.676 1.00 0.00 H new ATOM 0 HA GLN A 121 58.917 -2.860 -14.509 1.00 0.00 H new ATOM 0 HB2 GLN A 121 61.040 -2.136 -16.563 1.00 0.00 H new ATOM 0 HB3 GLN A 121 61.399 -3.442 -15.451 1.00 0.00 H new ATOM 0 HG2 GLN A 121 59.164 -4.509 -16.093 1.00 0.00 H new ATOM 0 HG3 GLN A 121 58.976 -3.265 -17.314 1.00 0.00 H new ATOM 0 HE21 GLN A 121 60.533 -6.300 -16.563 1.00 0.00 H new ATOM 0 HE22 GLN A 121 61.484 -6.419 -18.047 1.00 0.00 H new ATOM 62 N ILE A 122 61.759 -1.374 -13.821 1.00 0.00 N ATOM 63 CA ILE A 122 62.625 -1.019 -12.660 1.00 0.00 C ATOM 64 C ILE A 122 63.047 0.451 -12.744 1.00 0.00 C ATOM 65 O ILE A 122 62.888 1.095 -13.762 1.00 0.00 O ATOM 66 CB ILE A 122 63.845 -1.934 -12.780 1.00 0.00 C ATOM 67 CG1 ILE A 122 64.414 -1.847 -14.197 1.00 0.00 C ATOM 68 CG2 ILE A 122 63.430 -3.377 -12.485 1.00 0.00 C ATOM 69 CD1 ILE A 122 65.889 -2.254 -14.181 1.00 0.00 C ATOM 0 H ILE A 122 62.169 -1.200 -14.738 1.00 0.00 H new ATOM 0 HA ILE A 122 62.111 -1.148 -11.708 1.00 0.00 H new ATOM 0 HB ILE A 122 64.605 -1.620 -12.065 1.00 0.00 H new ATOM 0 HG12 ILE A 122 63.853 -2.499 -14.866 1.00 0.00 H new ATOM 0 HG13 ILE A 122 64.310 -0.832 -14.580 1.00 0.00 H new ATOM 0 HG21 ILE A 122 64.299 -4.030 -12.570 1.00 0.00 H new ATOM 0 HG22 ILE A 122 63.026 -3.440 -11.474 1.00 0.00 H new ATOM 0 HG23 ILE A 122 62.669 -3.690 -13.200 1.00 0.00 H new ATOM 0 HD11 ILE A 122 66.295 -2.192 -15.191 1.00 0.00 H new ATOM 0 HD12 ILE A 122 66.444 -1.584 -13.525 1.00 0.00 H new ATOM 0 HD13 ILE A 122 65.980 -3.277 -13.816 1.00 0.00 H new ATOM 81 N VAL A 123 63.581 0.986 -11.680 1.00 0.00 N ATOM 82 CA VAL A 123 64.010 2.414 -11.702 1.00 0.00 C ATOM 83 C VAL A 123 65.503 2.525 -11.383 1.00 0.00 C ATOM 84 O VAL A 123 65.999 1.903 -10.464 1.00 0.00 O ATOM 85 CB VAL A 123 63.179 3.093 -10.612 1.00 0.00 C ATOM 86 CG1 VAL A 123 62.935 4.554 -10.993 1.00 0.00 C ATOM 87 CG2 VAL A 123 61.837 2.372 -10.470 1.00 0.00 C ATOM 0 H VAL A 123 63.739 0.498 -10.798 1.00 0.00 H new ATOM 0 HA VAL A 123 63.859 2.874 -12.678 1.00 0.00 H new ATOM 0 HB VAL A 123 63.717 3.049 -9.665 1.00 0.00 H new ATOM 0 HG11 VAL A 123 62.343 5.038 -10.217 1.00 0.00 H new ATOM 0 HG12 VAL A 123 63.891 5.068 -11.094 1.00 0.00 H new ATOM 0 HG13 VAL A 123 62.397 4.598 -11.940 1.00 0.00 H new ATOM 0 HG21 VAL A 123 61.245 2.856 -9.693 1.00 0.00 H new ATOM 0 HG22 VAL A 123 61.299 2.415 -11.417 1.00 0.00 H new ATOM 0 HG23 VAL A 123 62.010 1.331 -10.199 1.00 0.00 H new ATOM 97 N ASP A 124 66.222 3.310 -12.136 1.00 0.00 N ATOM 98 CA ASP A 124 67.683 3.459 -11.877 1.00 0.00 C ATOM 99 C ASP A 124 68.363 2.088 -11.881 1.00 0.00 C ATOM 100 O ASP A 124 68.331 1.365 -10.906 1.00 0.00 O ATOM 101 CB ASP A 124 67.779 4.101 -10.492 1.00 0.00 C ATOM 102 CG ASP A 124 66.648 5.117 -10.321 1.00 0.00 C ATOM 103 OD1 ASP A 124 66.458 5.919 -11.221 1.00 0.00 O1- ATOM 104 OD2 ASP A 124 65.991 5.076 -9.294 1.00 0.00 O ATOM 0 H ASP A 124 65.862 3.855 -12.919 1.00 0.00 H new ATOM 0 HA ASP A 124 68.177 4.061 -12.639 1.00 0.00 H new ATOM 0 HB2 ASP A 124 67.714 3.335 -9.719 1.00 0.00 H new ATOM 0 HB3 ASP A 124 68.745 4.592 -10.373 1.00 0.00 H new ATOM 109 N ALA A 125 68.977 1.724 -12.974 1.00 0.00 N ATOM 110 CA ALA A 125 69.658 0.399 -13.042 1.00 0.00 C ATOM 111 C ALA A 125 71.157 0.559 -12.772 1.00 0.00 C ATOM 112 O ALA A 125 71.983 -0.047 -13.424 1.00 0.00 O ATOM 113 CB ALA A 125 69.420 -0.094 -14.469 1.00 0.00 C ATOM 0 H ALA A 125 69.037 2.287 -13.823 1.00 0.00 H new ATOM 0 HA ALA A 125 69.276 -0.301 -12.299 1.00 0.00 H new ATOM 0 HB1 ALA A 125 69.892 -1.068 -14.601 1.00 0.00 H new ATOM 0 HB2 ALA A 125 68.349 -0.182 -14.650 1.00 0.00 H new ATOM 0 HB3 ALA A 125 69.850 0.616 -15.176 1.00 0.00 H new ATOM 119 N GLN A 126 71.513 1.371 -11.813 1.00 0.00 N ATOM 120 CA GLN A 126 72.959 1.569 -11.503 1.00 0.00 C ATOM 121 C GLN A 126 73.367 0.712 -10.302 1.00 0.00 C ATOM 122 O GLN A 126 72.543 0.084 -9.667 1.00 0.00 O ATOM 123 CB GLN A 126 73.091 3.055 -11.168 1.00 0.00 C ATOM 124 CG GLN A 126 72.579 3.892 -12.341 1.00 0.00 C ATOM 125 CD GLN A 126 73.664 4.879 -12.774 1.00 0.00 C ATOM 126 OE1 GLN A 126 74.216 5.590 -11.956 1.00 0.00 O ATOM 127 NE2 GLN A 126 73.997 4.954 -14.033 1.00 0.00 N ATOM 0 H GLN A 126 70.867 1.905 -11.232 1.00 0.00 H new ATOM 0 HA GLN A 126 73.602 1.278 -12.333 1.00 0.00 H new ATOM 0 HB2 GLN A 126 72.523 3.287 -10.267 1.00 0.00 H new ATOM 0 HB3 GLN A 126 74.132 3.300 -10.960 1.00 0.00 H new ATOM 0 HG2 GLN A 126 72.309 3.243 -13.174 1.00 0.00 H new ATOM 0 HG3 GLN A 126 71.677 4.431 -12.051 1.00 0.00 H new ATOM 0 HE21 GLN A 126 73.534 4.358 -14.719 1.00 0.00 H new ATOM 0 HE22 GLN A 126 74.720 5.609 -14.331 1.00 0.00 H new ATOM 136 N ALA A 127 74.632 0.681 -9.987 1.00 0.00 N ATOM 137 CA ALA A 127 75.095 -0.134 -8.826 1.00 0.00 C ATOM 138 C ALA A 127 75.774 0.763 -7.787 1.00 0.00 C ATOM 139 O ALA A 127 76.858 0.478 -7.320 1.00 0.00 O ATOM 140 CB ALA A 127 76.095 -1.129 -9.414 1.00 0.00 C ATOM 0 H ALA A 127 75.367 1.185 -10.483 1.00 0.00 H new ATOM 0 HA ALA A 127 74.271 -0.637 -8.319 1.00 0.00 H new ATOM 0 HB1 ALA A 127 76.483 -1.767 -8.620 1.00 0.00 H new ATOM 0 HB2 ALA A 127 75.598 -1.744 -10.164 1.00 0.00 H new ATOM 0 HB3 ALA A 127 76.919 -0.586 -9.878 1.00 0.00 H new ATOM 146 N VAL A 128 75.143 1.847 -7.424 1.00 0.00 N ATOM 147 CA VAL A 128 75.749 2.765 -6.416 1.00 0.00 C ATOM 148 C VAL A 128 74.661 3.337 -5.505 1.00 0.00 C ATOM 149 O VAL A 128 73.490 3.312 -5.832 1.00 0.00 O ATOM 150 CB VAL A 128 76.411 3.878 -7.227 1.00 0.00 C ATOM 151 CG1 VAL A 128 77.724 3.363 -7.818 1.00 0.00 C ATOM 152 CG2 VAL A 128 75.474 4.316 -8.354 1.00 0.00 C ATOM 0 H VAL A 128 74.233 2.137 -7.782 1.00 0.00 H new ATOM 0 HA VAL A 128 76.467 2.254 -5.775 1.00 0.00 H new ATOM 0 HB VAL A 128 76.616 4.730 -6.579 1.00 0.00 H new ATOM 0 HG11 VAL A 128 78.198 4.156 -8.397 1.00 0.00 H new ATOM 0 HG12 VAL A 128 78.390 3.055 -7.012 1.00 0.00 H new ATOM 0 HG13 VAL A 128 77.521 2.511 -8.467 1.00 0.00 H new ATOM 0 HG21 VAL A 128 75.947 5.110 -8.932 1.00 0.00 H new ATOM 0 HG22 VAL A 128 75.267 3.467 -9.005 1.00 0.00 H new ATOM 0 HG23 VAL A 128 74.540 4.684 -7.929 1.00 0.00 H new ATOM 162 N CYS A 129 75.039 3.845 -4.363 1.00 0.00 N ATOM 163 CA CYS A 129 74.031 4.414 -3.419 1.00 0.00 C ATOM 164 C CYS A 129 73.051 5.322 -4.162 1.00 0.00 C ATOM 165 O CYS A 129 73.339 5.826 -5.229 1.00 0.00 O ATOM 166 CB CYS A 129 74.840 5.223 -2.406 1.00 0.00 C ATOM 167 SG CYS A 129 73.775 5.696 -1.022 1.00 0.00 S ATOM 0 H CYS A 129 76.006 3.891 -4.041 1.00 0.00 H new ATOM 0 HA CYS A 129 73.439 3.634 -2.941 1.00 0.00 H new ATOM 0 HB2 CYS A 129 75.683 4.634 -2.045 1.00 0.00 H new ATOM 0 HB3 CYS A 129 75.253 6.113 -2.882 1.00 0.00 H new ATOM 172 N THR A 130 71.893 5.532 -3.602 1.00 0.00 N ATOM 173 CA THR A 130 70.890 6.405 -4.270 1.00 0.00 C ATOM 174 C THR A 130 71.133 7.870 -3.894 1.00 0.00 C ATOM 175 O THR A 130 70.986 8.762 -4.706 1.00 0.00 O ATOM 176 CB THR A 130 69.538 5.928 -3.742 1.00 0.00 C ATOM 177 OG1 THR A 130 69.450 4.517 -3.883 1.00 0.00 O ATOM 178 CG2 THR A 130 68.412 6.594 -4.534 1.00 0.00 C ATOM 0 H THR A 130 71.598 5.136 -2.709 1.00 0.00 H new ATOM 0 HA THR A 130 70.945 6.345 -5.357 1.00 0.00 H new ATOM 0 HB THR A 130 69.443 6.196 -2.690 1.00 0.00 H new ATOM 0 HG1 THR A 130 68.604 4.284 -4.320 1.00 0.00 H new ATOM 0 HG21 THR A 130 67.449 6.252 -4.155 1.00 0.00 H new ATOM 0 HG22 THR A 130 68.481 7.676 -4.425 1.00 0.00 H new ATOM 0 HG23 THR A 130 68.502 6.329 -5.587 1.00 0.00 H new ATOM 186 N ARG A 131 71.506 8.123 -2.669 1.00 0.00 N ATOM 187 CA ARG A 131 71.760 9.529 -2.243 1.00 0.00 C ATOM 188 C ARG A 131 73.194 9.936 -2.598 1.00 0.00 C ATOM 189 O ARG A 131 73.438 11.016 -3.095 1.00 0.00 O ATOM 190 CB ARG A 131 71.559 9.530 -0.727 1.00 0.00 C ATOM 191 CG ARG A 131 70.103 9.185 -0.405 1.00 0.00 C ATOM 192 CD ARG A 131 69.257 10.460 -0.434 1.00 0.00 C ATOM 193 NE ARG A 131 68.254 10.277 0.653 1.00 0.00 N ATOM 194 CZ ARG A 131 66.978 10.301 0.374 1.00 0.00 C ATOM 195 NH1 ARG A 131 66.328 11.433 0.392 1.00 0.00 N ATOM 196 NH2 ARG A 131 66.354 9.194 0.078 1.00 0.00 N1+ ATOM 0 H ARG A 131 71.646 7.418 -1.945 1.00 0.00 H new ATOM 0 HA ARG A 131 71.096 10.237 -2.739 1.00 0.00 H new ATOM 0 HB2 ARG A 131 72.227 8.806 -0.260 1.00 0.00 H new ATOM 0 HB3 ARG A 131 71.812 10.508 -0.317 1.00 0.00 H new ATOM 0 HG2 ARG A 131 69.720 8.465 -1.129 1.00 0.00 H new ATOM 0 HG3 ARG A 131 70.038 8.715 0.576 1.00 0.00 H new ATOM 0 HD2 ARG A 131 69.870 11.345 -0.262 1.00 0.00 H new ATOM 0 HD3 ARG A 131 68.772 10.591 -1.401 1.00 0.00 H new ATOM 0 HE ARG A 131 68.564 10.133 1.614 1.00 0.00 H new ATOM 0 HH11 ARG A 131 66.816 12.298 0.624 1.00 0.00 H new ATOM 0 HH12 ARG A 131 65.332 11.453 0.174 1.00 0.00 H new ATOM 0 HH21 ARG A 131 66.862 8.310 0.064 1.00 0.00 H new ATOM 0 HH22 ARG A 131 65.358 9.213 -0.140 1.00 0.00 H new ATOM 210 N CYS A 132 74.144 9.075 -2.348 1.00 0.00 N ATOM 211 CA CYS A 132 75.560 9.413 -2.677 1.00 0.00 C ATOM 212 C CYS A 132 75.841 9.109 -4.151 1.00 0.00 C ATOM 213 O CYS A 132 76.699 9.708 -4.764 1.00 0.00 O ATOM 214 CB CYS A 132 76.404 8.514 -1.771 1.00 0.00 C ATOM 215 SG CYS A 132 75.765 8.592 -0.079 1.00 0.00 S ATOM 0 H CYS A 132 74.002 8.155 -1.931 1.00 0.00 H new ATOM 0 HA CYS A 132 75.783 10.468 -2.520 1.00 0.00 H new ATOM 0 HB2 CYS A 132 76.378 7.487 -2.134 1.00 0.00 H new ATOM 0 HB3 CYS A 132 77.446 8.833 -1.793 1.00 0.00 H new ATOM 220 N LYS A 133 75.111 8.184 -4.719 1.00 0.00 N ATOM 221 CA LYS A 133 75.310 7.830 -6.157 1.00 0.00 C ATOM 222 C LYS A 133 76.662 7.135 -6.373 1.00 0.00 C ATOM 223 O LYS A 133 77.081 6.911 -7.491 1.00 0.00 O ATOM 224 CB LYS A 133 75.204 9.171 -6.915 1.00 0.00 C ATOM 225 CG LYS A 133 76.570 9.662 -7.424 1.00 0.00 C ATOM 226 CD LYS A 133 76.790 9.170 -8.858 1.00 0.00 C ATOM 227 CE LYS A 133 78.284 8.948 -9.097 1.00 0.00 C ATOM 228 NZ LYS A 133 78.526 9.449 -10.480 1.00 0.00 N1+ ATOM 0 H LYS A 133 74.380 7.654 -4.245 1.00 0.00 H new ATOM 0 HA LYS A 133 74.569 7.117 -6.518 1.00 0.00 H new ATOM 0 HB2 LYS A 133 74.524 9.056 -7.759 1.00 0.00 H new ATOM 0 HB3 LYS A 133 74.771 9.925 -6.257 1.00 0.00 H new ATOM 0 HG2 LYS A 133 76.612 10.751 -7.392 1.00 0.00 H new ATOM 0 HG3 LYS A 133 77.365 9.293 -6.776 1.00 0.00 H new ATOM 0 HD2 LYS A 133 76.242 8.242 -9.024 1.00 0.00 H new ATOM 0 HD3 LYS A 133 76.402 9.900 -9.568 1.00 0.00 H new ATOM 0 HE2 LYS A 133 78.886 9.491 -8.368 1.00 0.00 H new ATOM 0 HE3 LYS A 133 78.547 7.894 -9.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 79.531 9.332 -10.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 77.944 8.909 -11.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 78.272 10.456 -10.534 1.00 0.00 H new ATOM 242 N GLU A 134 77.347 6.779 -5.320 1.00 0.00 N ATOM 243 CA GLU A 134 78.660 6.092 -5.493 1.00 0.00 C ATOM 244 C GLU A 134 79.192 5.585 -4.150 1.00 0.00 C ATOM 245 O GLU A 134 78.569 5.748 -3.119 1.00 0.00 O ATOM 246 CB GLU A 134 79.592 7.159 -6.068 1.00 0.00 C ATOM 247 CG GLU A 134 79.926 8.183 -4.983 1.00 0.00 C ATOM 248 CD GLU A 134 80.353 9.498 -5.636 1.00 0.00 C ATOM 249 OE1 GLU A 134 81.432 9.531 -6.206 1.00 0.00 O ATOM 250 OE2 GLU A 134 79.594 10.450 -5.556 1.00 0.00 O1- ATOM 0 H GLU A 134 77.057 6.932 -4.354 1.00 0.00 H new ATOM 0 HA GLU A 134 78.579 5.221 -6.143 1.00 0.00 H new ATOM 0 HB2 GLU A 134 80.506 6.696 -6.440 1.00 0.00 H new ATOM 0 HB3 GLU A 134 79.117 7.653 -6.916 1.00 0.00 H new ATOM 0 HG2 GLU A 134 79.059 8.347 -4.344 1.00 0.00 H new ATOM 0 HG3 GLU A 134 80.725 7.805 -4.345 1.00 0.00 H new ATOM 257 N SER A 135 80.346 4.973 -4.161 1.00 0.00 N ATOM 258 CA SER A 135 80.937 4.451 -2.895 1.00 0.00 C ATOM 259 C SER A 135 79.961 3.500 -2.195 1.00 0.00 C ATOM 260 O SER A 135 79.798 3.541 -0.991 1.00 0.00 O ATOM 261 CB SER A 135 81.196 5.689 -2.035 1.00 0.00 C ATOM 262 OG SER A 135 82.479 6.215 -2.337 1.00 0.00 O ATOM 0 H SER A 135 80.907 4.812 -4.997 1.00 0.00 H new ATOM 0 HA SER A 135 81.849 3.882 -3.075 1.00 0.00 H new ATOM 0 HB2 SER A 135 80.430 6.441 -2.222 1.00 0.00 H new ATOM 0 HB3 SER A 135 81.137 5.429 -0.978 1.00 0.00 H new ATOM 0 HG SER A 135 83.165 5.685 -1.880 1.00 0.00 H new ATOM 268 N ALA A 136 79.313 2.642 -2.935 1.00 0.00 N ATOM 269 CA ALA A 136 78.354 1.690 -2.304 1.00 0.00 C ATOM 270 C ALA A 136 78.437 0.322 -2.985 1.00 0.00 C ATOM 271 O ALA A 136 78.602 0.223 -4.185 1.00 0.00 O ATOM 272 CB ALA A 136 76.977 2.314 -2.519 1.00 0.00 C ATOM 0 H ALA A 136 79.406 2.559 -3.947 1.00 0.00 H new ATOM 0 HA ALA A 136 78.568 1.530 -1.247 1.00 0.00 H new ATOM 0 HB1 ALA A 136 76.214 1.671 -2.081 1.00 0.00 H new ATOM 0 HB2 ALA A 136 76.943 3.294 -2.042 1.00 0.00 H new ATOM 0 HB3 ALA A 136 76.790 2.424 -3.587 1.00 0.00 H new ATOM 278 N ASP A 137 78.321 -0.736 -2.228 1.00 0.00 N ATOM 279 CA ASP A 137 78.392 -2.098 -2.832 1.00 0.00 C ATOM 280 C ASP A 137 77.279 -2.985 -2.268 1.00 0.00 C ATOM 281 O ASP A 137 77.367 -4.197 -2.291 1.00 0.00 O ATOM 282 CB ASP A 137 79.764 -2.638 -2.429 1.00 0.00 C ATOM 283 CG ASP A 137 80.440 -3.271 -3.647 1.00 0.00 C ATOM 284 OD1 ASP A 137 79.732 -3.631 -4.572 1.00 0.00 O ATOM 285 OD2 ASP A 137 81.655 -3.382 -3.633 1.00 0.00 O1- ATOM 0 H ASP A 137 78.180 -0.716 -1.218 1.00 0.00 H new ATOM 0 HA ASP A 137 78.264 -2.078 -3.914 1.00 0.00 H new ATOM 0 HB2 ASP A 137 80.382 -1.832 -2.034 1.00 0.00 H new ATOM 0 HB3 ASP A 137 79.657 -3.376 -1.634 1.00 0.00 H new ATOM 290 N PHE A 138 76.231 -2.391 -1.765 1.00 0.00 N ATOM 291 CA PHE A 138 75.113 -3.202 -1.202 1.00 0.00 C ATOM 292 C PHE A 138 73.791 -2.441 -1.331 1.00 0.00 C ATOM 293 O PHE A 138 73.744 -1.232 -1.211 1.00 0.00 O ATOM 294 CB PHE A 138 75.469 -3.406 0.271 1.00 0.00 C ATOM 295 CG PHE A 138 76.286 -4.665 0.421 1.00 0.00 C ATOM 296 CD1 PHE A 138 75.654 -5.914 0.435 1.00 0.00 C ATOM 297 CD2 PHE A 138 77.677 -4.583 0.548 1.00 0.00 C ATOM 298 CE1 PHE A 138 76.415 -7.081 0.574 1.00 0.00 C ATOM 299 CE2 PHE A 138 78.438 -5.750 0.687 1.00 0.00 C ATOM 300 CZ PHE A 138 77.806 -7.000 0.701 1.00 0.00 C ATOM 0 H PHE A 138 76.100 -1.380 -1.719 1.00 0.00 H new ATOM 0 HA PHE A 138 74.989 -4.150 -1.726 1.00 0.00 H new ATOM 0 HB2 PHE A 138 76.031 -2.549 0.643 1.00 0.00 H new ATOM 0 HB3 PHE A 138 74.561 -3.476 0.869 1.00 0.00 H new ATOM 0 HD1 PHE A 138 74.580 -5.977 0.339 1.00 0.00 H new ATOM 0 HD2 PHE A 138 78.164 -3.619 0.539 1.00 0.00 H new ATOM 0 HE1 PHE A 138 75.928 -8.045 0.583 1.00 0.00 H new ATOM 0 HE2 PHE A 138 79.512 -5.686 0.783 1.00 0.00 H new ATOM 0 HZ PHE A 138 78.392 -7.901 0.810 1.00 0.00 H new ATOM 310 N TRP A 139 72.716 -3.140 -1.570 1.00 0.00 N ATOM 311 CA TRP A 139 71.397 -2.457 -1.704 1.00 0.00 C ATOM 312 C TRP A 139 70.305 -3.290 -1.027 1.00 0.00 C ATOM 313 O TRP A 139 70.393 -4.498 -0.946 1.00 0.00 O ATOM 314 CB TRP A 139 71.153 -2.361 -3.211 1.00 0.00 C ATOM 315 CG TRP A 139 70.146 -3.387 -3.626 1.00 0.00 C ATOM 316 CD1 TRP A 139 68.804 -3.242 -3.531 1.00 0.00 C ATOM 317 CD2 TRP A 139 70.376 -4.703 -4.204 1.00 0.00 C ATOM 318 NE1 TRP A 139 68.196 -4.389 -4.011 1.00 0.00 N ATOM 319 CE2 TRP A 139 69.124 -5.318 -4.439 1.00 0.00 C ATOM 320 CE3 TRP A 139 71.539 -5.417 -4.545 1.00 0.00 C ATOM 321 CZ2 TRP A 139 69.028 -6.596 -4.991 1.00 0.00 C ATOM 322 CZ3 TRP A 139 71.446 -6.704 -5.101 1.00 0.00 C ATOM 323 CH2 TRP A 139 70.193 -7.291 -5.323 1.00 0.00 C ATOM 0 H TRP A 139 72.693 -4.154 -1.678 1.00 0.00 H new ATOM 0 HA TRP A 139 71.385 -1.475 -1.230 1.00 0.00 H new ATOM 0 HB2 TRP A 139 70.797 -1.363 -3.469 1.00 0.00 H new ATOM 0 HB3 TRP A 139 72.087 -2.515 -3.751 1.00 0.00 H new ATOM 0 HD1 TRP A 139 68.291 -2.374 -3.144 1.00 0.00 H new ATOM 0 HE1 TRP A 139 67.186 -4.531 -4.045 1.00 0.00 H new ATOM 0 HE3 TRP A 139 72.509 -4.973 -4.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 68.060 -7.044 -5.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 72.345 -7.244 -5.359 1.00 0.00 H new ATOM 0 HH2 TRP A 139 70.128 -8.281 -5.751 1.00 0.00 H new ATOM 334 N CYS A 140 69.278 -2.651 -0.537 1.00 0.00 N ATOM 335 CA CYS A 140 68.184 -3.408 0.137 1.00 0.00 C ATOM 336 C CYS A 140 67.263 -4.050 -0.905 1.00 0.00 C ATOM 337 O CYS A 140 66.753 -3.391 -1.788 1.00 0.00 O ATOM 338 CB CYS A 140 67.424 -2.364 0.954 1.00 0.00 C ATOM 339 SG CYS A 140 67.998 -2.403 2.671 1.00 0.00 S ATOM 0 H CYS A 140 69.149 -1.640 -0.574 1.00 0.00 H new ATOM 0 HA CYS A 140 68.566 -4.215 0.762 1.00 0.00 H new ATOM 0 HB2 CYS A 140 67.579 -1.372 0.530 1.00 0.00 H new ATOM 0 HB3 CYS A 140 66.353 -2.564 0.913 1.00 0.00 H new ATOM 344 N PHE A 141 67.045 -5.333 -0.805 1.00 0.00 N ATOM 345 CA PHE A 141 66.157 -6.018 -1.787 1.00 0.00 C ATOM 346 C PHE A 141 64.713 -5.540 -1.615 1.00 0.00 C ATOM 347 O PHE A 141 63.999 -5.329 -2.576 1.00 0.00 O ATOM 348 CB PHE A 141 66.273 -7.505 -1.456 1.00 0.00 C ATOM 349 CG PHE A 141 65.168 -8.264 -2.152 1.00 0.00 C ATOM 350 CD1 PHE A 141 65.055 -8.216 -3.547 1.00 0.00 C ATOM 351 CD2 PHE A 141 64.256 -9.016 -1.402 1.00 0.00 C ATOM 352 CE1 PHE A 141 64.031 -8.919 -4.191 1.00 0.00 C ATOM 353 CE2 PHE A 141 63.231 -9.720 -2.047 1.00 0.00 C ATOM 354 CZ PHE A 141 63.119 -9.671 -3.442 1.00 0.00 C ATOM 0 H PHE A 141 67.443 -5.937 -0.086 1.00 0.00 H new ATOM 0 HA PHE A 141 66.441 -5.808 -2.818 1.00 0.00 H new ATOM 0 HB2 PHE A 141 67.245 -7.884 -1.773 1.00 0.00 H new ATOM 0 HB3 PHE A 141 66.208 -7.655 -0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 141 65.759 -7.636 -4.126 1.00 0.00 H new ATOM 0 HD2 PHE A 141 64.343 -9.053 -0.326 1.00 0.00 H new ATOM 0 HE1 PHE A 141 63.944 -8.881 -5.267 1.00 0.00 H new ATOM 0 HE2 PHE A 141 62.527 -10.300 -1.469 1.00 0.00 H new ATOM 0 HZ PHE A 141 62.329 -10.214 -3.940 1.00 0.00 H new ATOM 364 N GLU A 142 64.277 -5.370 -0.397 1.00 0.00 N ATOM 365 CA GLU A 142 62.879 -4.906 -0.164 1.00 0.00 C ATOM 366 C GLU A 142 62.764 -3.406 -0.448 1.00 0.00 C ATOM 367 O GLU A 142 61.836 -2.957 -1.092 1.00 0.00 O ATOM 368 CB GLU A 142 62.604 -5.198 1.312 1.00 0.00 C ATOM 369 CG GLU A 142 61.925 -6.563 1.443 1.00 0.00 C ATOM 370 CD GLU A 142 60.632 -6.416 2.248 1.00 0.00 C ATOM 371 OE1 GLU A 142 59.702 -5.816 1.734 1.00 0.00 O ATOM 372 OE2 GLU A 142 60.594 -6.905 3.365 1.00 0.00 O1- ATOM 0 H GLU A 142 64.827 -5.532 0.446 1.00 0.00 H new ATOM 0 HA GLU A 142 62.164 -5.406 -0.817 1.00 0.00 H new ATOM 0 HB2 GLU A 142 63.537 -5.188 1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 142 61.967 -4.421 1.735 1.00 0.00 H new ATOM 0 HG2 GLU A 142 61.706 -6.968 0.455 1.00 0.00 H new ATOM 0 HG3 GLU A 142 62.594 -7.268 1.936 1.00 0.00 H new ATOM 379 N CYS A 143 63.699 -2.628 0.026 1.00 0.00 N ATOM 380 CA CYS A 143 63.640 -1.158 -0.223 1.00 0.00 C ATOM 381 C CYS A 143 64.052 -0.847 -1.668 1.00 0.00 C ATOM 382 O CYS A 143 63.804 0.230 -2.174 1.00 0.00 O ATOM 383 CB CYS A 143 64.638 -0.544 0.761 1.00 0.00 C ATOM 384 SG CYS A 143 64.341 -1.204 2.422 1.00 0.00 S ATOM 0 H CYS A 143 64.499 -2.945 0.573 1.00 0.00 H new ATOM 0 HA CYS A 143 62.635 -0.759 -0.085 1.00 0.00 H new ATOM 0 HB2 CYS A 143 65.658 -0.768 0.447 1.00 0.00 H new ATOM 0 HB3 CYS A 143 64.537 0.541 0.767 1.00 0.00 H new ATOM 389 N GLU A 144 64.680 -1.779 -2.335 1.00 0.00 N ATOM 390 CA GLU A 144 65.107 -1.530 -3.742 1.00 0.00 C ATOM 391 C GLU A 144 65.943 -0.250 -3.819 1.00 0.00 C ATOM 392 O GLU A 144 65.882 0.487 -4.783 1.00 0.00 O ATOM 393 CB GLU A 144 63.807 -1.372 -4.532 1.00 0.00 C ATOM 394 CG GLU A 144 62.957 -2.634 -4.373 1.00 0.00 C ATOM 395 CD GLU A 144 62.458 -3.091 -5.746 1.00 0.00 C ATOM 396 OE1 GLU A 144 63.289 -3.344 -6.602 1.00 0.00 O1- ATOM 397 OE2 GLU A 144 61.253 -3.181 -5.917 1.00 0.00 O ATOM 0 H GLU A 144 64.915 -2.701 -1.966 1.00 0.00 H new ATOM 0 HA GLU A 144 65.724 -2.338 -4.136 1.00 0.00 H new ATOM 0 HB2 GLU A 144 63.256 -0.502 -4.175 1.00 0.00 H new ATOM 0 HB3 GLU A 144 64.028 -1.200 -5.585 1.00 0.00 H new ATOM 0 HG2 GLU A 144 63.545 -3.425 -3.906 1.00 0.00 H new ATOM 0 HG3 GLU A 144 62.111 -2.435 -3.715 1.00 0.00 H new ATOM 404 N GLN A 145 66.722 0.019 -2.808 1.00 0.00 N ATOM 405 CA GLN A 145 67.562 1.251 -2.819 1.00 0.00 C ATOM 406 C GLN A 145 69.029 0.893 -2.569 1.00 0.00 C ATOM 407 O GLN A 145 69.340 -0.145 -2.020 1.00 0.00 O ATOM 408 CB GLN A 145 67.017 2.108 -1.675 1.00 0.00 C ATOM 409 CG GLN A 145 66.390 3.382 -2.243 1.00 0.00 C ATOM 410 CD GLN A 145 66.681 4.554 -1.305 1.00 0.00 C ATOM 411 OE1 GLN A 145 67.558 5.355 -1.567 1.00 0.00 O ATOM 412 NE2 GLN A 145 65.978 4.691 -0.215 1.00 0.00 N ATOM 0 H GLN A 145 66.814 -0.561 -1.974 1.00 0.00 H new ATOM 0 HA GLN A 145 67.522 1.772 -3.776 1.00 0.00 H new ATOM 0 HB2 GLN A 145 66.274 1.546 -1.108 1.00 0.00 H new ATOM 0 HB3 GLN A 145 67.820 2.363 -0.983 1.00 0.00 H new ATOM 0 HG2 GLN A 145 66.792 3.587 -3.235 1.00 0.00 H new ATOM 0 HG3 GLN A 145 65.314 3.251 -2.356 1.00 0.00 H new ATOM 0 HE21 GLN A 145 65.242 4.020 0.005 1.00 0.00 H new ATOM 0 HE22 GLN A 145 66.164 5.470 0.417 1.00 0.00 H new ATOM 421 N LEU A 146 69.933 1.745 -2.967 1.00 0.00 N ATOM 422 CA LEU A 146 71.379 1.455 -2.750 1.00 0.00 C ATOM 423 C LEU A 146 71.894 2.231 -1.535 1.00 0.00 C ATOM 424 O LEU A 146 71.434 3.317 -1.240 1.00 0.00 O ATOM 425 CB LEU A 146 72.075 1.930 -4.026 1.00 0.00 C ATOM 426 CG LEU A 146 71.438 1.247 -5.237 1.00 0.00 C ATOM 427 CD1 LEU A 146 70.481 2.222 -5.928 1.00 0.00 C ATOM 428 CD2 LEU A 146 72.532 0.822 -6.218 1.00 0.00 C ATOM 0 H LEU A 146 69.733 2.630 -3.433 1.00 0.00 H new ATOM 0 HA LEU A 146 71.565 0.399 -2.555 1.00 0.00 H new ATOM 0 HB2 LEU A 146 71.989 3.013 -4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 146 73.139 1.697 -3.981 1.00 0.00 H new ATOM 0 HG LEU A 146 70.885 0.367 -4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 146 70.027 1.736 -6.791 1.00 0.00 H new ATOM 0 HD12 LEU A 146 69.701 2.523 -5.229 1.00 0.00 H new ATOM 0 HD13 LEU A 146 71.033 3.102 -6.257 1.00 0.00 H new ATOM 0 HD21 LEU A 146 72.078 0.335 -7.081 1.00 0.00 H new ATOM 0 HD22 LEU A 146 73.087 1.701 -6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 146 73.212 0.127 -5.726 1.00 0.00 H new ATOM 440 N LEU A 147 72.842 1.684 -0.824 1.00 0.00 N ATOM 441 CA LEU A 147 73.380 2.395 0.371 1.00 0.00 C ATOM 442 C LEU A 147 74.905 2.272 0.417 1.00 0.00 C ATOM 443 O LEU A 147 75.458 1.206 0.229 1.00 0.00 O ATOM 444 CB LEU A 147 72.751 1.686 1.572 1.00 0.00 C ATOM 445 CG LEU A 147 71.242 1.945 1.591 1.00 0.00 C ATOM 446 CD1 LEU A 147 70.575 0.996 2.588 1.00 0.00 C ATOM 447 CD2 LEU A 147 70.977 3.393 2.011 1.00 0.00 C ATOM 0 H LEU A 147 73.267 0.777 -1.018 1.00 0.00 H new ATOM 0 HA LEU A 147 73.146 3.459 0.357 1.00 0.00 H new ATOM 0 HB2 LEU A 147 72.945 0.615 1.517 1.00 0.00 H new ATOM 0 HB3 LEU A 147 73.203 2.045 2.496 1.00 0.00 H new ATOM 0 HG LEU A 147 70.832 1.775 0.595 1.00 0.00 H new ATOM 0 HD11 LEU A 147 69.501 1.180 2.602 1.00 0.00 H new ATOM 0 HD12 LEU A 147 70.763 -0.036 2.290 1.00 0.00 H new ATOM 0 HD13 LEU A 147 70.985 1.167 3.583 1.00 0.00 H new ATOM 0 HD21 LEU A 147 69.903 3.577 2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 147 71.387 3.564 3.006 1.00 0.00 H new ATOM 0 HD23 LEU A 147 71.452 4.070 1.302 1.00 0.00 H new ATOM 459 N CYS A 148 75.589 3.354 0.667 1.00 0.00 N ATOM 460 CA CYS A 148 77.078 3.296 0.725 1.00 0.00 C ATOM 461 C CYS A 148 77.531 2.800 2.101 1.00 0.00 C ATOM 462 O CYS A 148 76.745 2.690 3.020 1.00 0.00 O ATOM 463 CB CYS A 148 77.542 4.734 0.492 1.00 0.00 C ATOM 464 SG CYS A 148 76.936 5.790 1.831 1.00 0.00 S ATOM 0 H CYS A 148 75.183 4.275 0.833 1.00 0.00 H new ATOM 0 HA CYS A 148 77.495 2.611 -0.014 1.00 0.00 H new ATOM 0 HB2 CYS A 148 78.630 4.773 0.448 1.00 0.00 H new ATOM 0 HB3 CYS A 148 77.171 5.096 -0.467 1.00 0.00 H new ATOM 469 N ALA A 149 78.792 2.499 2.249 1.00 0.00 N ATOM 470 CA ALA A 149 79.291 2.009 3.566 1.00 0.00 C ATOM 471 C ALA A 149 78.818 2.933 4.692 1.00 0.00 C ATOM 472 O ALA A 149 78.612 2.506 5.811 1.00 0.00 O ATOM 473 CB ALA A 149 80.815 2.043 3.449 1.00 0.00 C ATOM 0 H ALA A 149 79.498 2.571 1.516 1.00 0.00 H new ATOM 0 HA ALA A 149 78.921 1.011 3.801 1.00 0.00 H new ATOM 0 HB1 ALA A 149 81.259 1.695 4.382 1.00 0.00 H new ATOM 0 HB2 ALA A 149 81.132 1.394 2.632 1.00 0.00 H new ATOM 0 HB3 ALA A 149 81.142 3.064 3.250 1.00 0.00 H new ATOM 479 N LYS A 150 78.645 4.194 4.407 1.00 0.00 N ATOM 480 CA LYS A 150 78.186 5.142 5.464 1.00 0.00 C ATOM 481 C LYS A 150 76.711 4.894 5.794 1.00 0.00 C ATOM 482 O LYS A 150 76.272 5.096 6.909 1.00 0.00 O ATOM 483 CB LYS A 150 78.375 6.533 4.859 1.00 0.00 C ATOM 484 CG LYS A 150 79.511 7.254 5.586 1.00 0.00 C ATOM 485 CD LYS A 150 79.023 7.718 6.960 1.00 0.00 C ATOM 486 CE LYS A 150 80.026 7.284 8.031 1.00 0.00 C ATOM 487 NZ LYS A 150 79.318 7.492 9.325 1.00 0.00 N1+ ATOM 0 H LYS A 150 78.801 4.610 3.489 1.00 0.00 H new ATOM 0 HA LYS A 150 78.742 5.024 6.394 1.00 0.00 H new ATOM 0 HB2 LYS A 150 78.603 6.451 3.796 1.00 0.00 H new ATOM 0 HB3 LYS A 150 77.452 7.107 4.944 1.00 0.00 H new ATOM 0 HG2 LYS A 150 80.366 6.588 5.698 1.00 0.00 H new ATOM 0 HG3 LYS A 150 79.848 8.109 5.000 1.00 0.00 H new ATOM 0 HD2 LYS A 150 78.910 8.802 6.971 1.00 0.00 H new ATOM 0 HD3 LYS A 150 78.042 7.293 7.172 1.00 0.00 H new ATOM 0 HE2 LYS A 150 80.315 6.241 7.902 1.00 0.00 H new ATOM 0 HE3 LYS A 150 80.939 7.877 7.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 79.942 7.216 10.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 79.061 8.495 9.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 78.456 6.910 9.347 1.00 0.00 H new ATOM 501 N CYS A 151 75.942 4.460 4.834 1.00 0.00 N ATOM 502 CA CYS A 151 74.498 4.201 5.096 1.00 0.00 C ATOM 503 C CYS A 151 74.271 2.716 5.401 1.00 0.00 C ATOM 504 O CYS A 151 73.472 2.362 6.245 1.00 0.00 O ATOM 505 CB CYS A 151 73.783 4.599 3.804 1.00 0.00 C ATOM 506 SG CYS A 151 74.128 6.337 3.434 1.00 0.00 S ATOM 0 H CYS A 151 76.251 4.274 3.880 1.00 0.00 H new ATOM 0 HA CYS A 151 74.128 4.760 5.955 1.00 0.00 H new ATOM 0 HB2 CYS A 151 74.118 3.968 2.981 1.00 0.00 H new ATOM 0 HB3 CYS A 151 72.709 4.444 3.908 1.00 0.00 H new ATOM 511 N PHE A 152 74.969 1.848 4.723 1.00 0.00 N ATOM 512 CA PHE A 152 74.795 0.388 4.975 1.00 0.00 C ATOM 513 C PHE A 152 75.179 0.051 6.418 1.00 0.00 C ATOM 514 O PHE A 152 74.473 -0.656 7.109 1.00 0.00 O ATOM 515 CB PHE A 152 75.743 -0.300 3.992 1.00 0.00 C ATOM 516 CG PHE A 152 75.386 -1.764 3.888 1.00 0.00 C ATOM 517 CD1 PHE A 152 74.053 -2.148 3.700 1.00 0.00 C ATOM 518 CD2 PHE A 152 76.389 -2.737 3.980 1.00 0.00 C ATOM 519 CE1 PHE A 152 73.724 -3.506 3.604 1.00 0.00 C ATOM 520 CE2 PHE A 152 76.059 -4.094 3.885 1.00 0.00 C ATOM 521 CZ PHE A 152 74.726 -4.479 3.697 1.00 0.00 C ATOM 0 H PHE A 152 75.653 2.086 4.005 1.00 0.00 H new ATOM 0 HA PHE A 152 73.763 0.065 4.838 1.00 0.00 H new ATOM 0 HB2 PHE A 152 75.674 0.173 3.012 1.00 0.00 H new ATOM 0 HB3 PHE A 152 76.774 -0.189 4.327 1.00 0.00 H new ATOM 0 HD1 PHE A 152 73.279 -1.398 3.629 1.00 0.00 H new ATOM 0 HD2 PHE A 152 77.417 -2.440 4.124 1.00 0.00 H new ATOM 0 HE1 PHE A 152 72.696 -3.803 3.458 1.00 0.00 H new ATOM 0 HE2 PHE A 152 76.833 -4.844 3.957 1.00 0.00 H new ATOM 0 HZ PHE A 152 74.471 -5.526 3.624 1.00 0.00 H new ATOM 531 N GLU A 153 76.293 0.553 6.879 1.00 0.00 N ATOM 532 CA GLU A 153 76.719 0.263 8.276 1.00 0.00 C ATOM 533 C GLU A 153 75.701 0.831 9.267 1.00 0.00 C ATOM 534 O GLU A 153 75.279 0.164 10.190 1.00 0.00 O ATOM 535 CB GLU A 153 78.069 0.965 8.425 1.00 0.00 C ATOM 536 CG GLU A 153 78.589 0.772 9.849 1.00 0.00 C ATOM 537 CD GLU A 153 79.234 -0.610 9.973 1.00 0.00 C ATOM 538 OE1 GLU A 153 78.806 -1.508 9.265 1.00 0.00 O ATOM 539 OE2 GLU A 153 80.144 -0.748 10.774 1.00 0.00 O1- ATOM 0 H GLU A 153 76.926 1.151 6.348 1.00 0.00 H new ATOM 0 HA GLU A 153 76.790 -0.806 8.477 1.00 0.00 H new ATOM 0 HB2 GLU A 153 78.783 0.560 7.708 1.00 0.00 H new ATOM 0 HB3 GLU A 153 77.965 2.028 8.205 1.00 0.00 H new ATOM 0 HG2 GLU A 153 79.316 1.547 10.090 1.00 0.00 H new ATOM 0 HG3 GLU A 153 77.771 0.869 10.563 1.00 0.00 H new ATOM 546 N ALA A 154 75.301 2.060 9.080 1.00 0.00 N ATOM 547 CA ALA A 154 74.308 2.670 10.010 1.00 0.00 C ATOM 548 C ALA A 154 72.989 1.895 9.953 1.00 0.00 C ATOM 549 O ALA A 154 72.313 1.727 10.949 1.00 0.00 O ATOM 550 CB ALA A 154 74.113 4.098 9.501 1.00 0.00 C ATOM 0 H ALA A 154 75.619 2.667 8.324 1.00 0.00 H new ATOM 0 HA ALA A 154 74.645 2.650 11.046 1.00 0.00 H new ATOM 0 HB1 ALA A 154 73.393 4.615 10.135 1.00 0.00 H new ATOM 0 HB2 ALA A 154 75.066 4.627 9.527 1.00 0.00 H new ATOM 0 HB3 ALA A 154 73.741 4.072 8.477 1.00 0.00 H new ATOM 556 N HIS A 155 72.621 1.419 8.795 1.00 0.00 N ATOM 557 CA HIS A 155 71.348 0.651 8.675 1.00 0.00 C ATOM 558 C HIS A 155 71.415 -0.616 9.532 1.00 0.00 C ATOM 559 O HIS A 155 70.586 -0.840 10.390 1.00 0.00 O ATOM 560 CB HIS A 155 71.244 0.290 7.191 1.00 0.00 C ATOM 561 CG HIS A 155 69.797 0.138 6.808 1.00 0.00 C ATOM 562 ND1 HIS A 155 68.812 0.988 7.288 1.00 0.00 N ATOM 563 CD2 HIS A 155 69.153 -0.757 5.990 1.00 0.00 C ATOM 564 CE1 HIS A 155 67.641 0.590 6.758 1.00 0.00 C ATOM 565 NE2 HIS A 155 67.792 -0.470 5.959 1.00 0.00 N ATOM 0 H HIS A 155 73.146 1.528 7.927 1.00 0.00 H new ATOM 0 HA HIS A 155 70.485 1.222 9.018 1.00 0.00 H new ATOM 0 HB2 HIS A 155 71.712 1.065 6.584 1.00 0.00 H new ATOM 0 HB3 HIS A 155 71.782 -0.637 6.993 1.00 0.00 H new ATOM 0 HD1 HIS A 155 68.950 1.772 7.926 1.00 0.00 H new ATOM 0 HD2 HIS A 155 69.631 -1.562 5.452 1.00 0.00 H new ATOM 0 HE1 HIS A 155 66.694 1.070 6.955 1.00 0.00 H new ATOM 573 N GLN A 156 72.398 -1.444 9.306 1.00 0.00 N ATOM 574 CA GLN A 156 72.518 -2.697 10.107 1.00 0.00 C ATOM 575 C GLN A 156 72.574 -2.369 11.603 1.00 0.00 C ATOM 576 O GLN A 156 72.158 -3.150 12.434 1.00 0.00 O ATOM 577 CB GLN A 156 73.830 -3.338 9.649 1.00 0.00 C ATOM 578 CG GLN A 156 73.551 -4.740 9.100 1.00 0.00 C ATOM 579 CD GLN A 156 74.178 -4.878 7.712 1.00 0.00 C ATOM 580 OE1 GLN A 156 75.203 -4.288 7.434 1.00 0.00 O ATOM 581 NE2 GLN A 156 73.601 -5.638 6.821 1.00 0.00 N ATOM 0 H GLN A 156 73.123 -1.308 8.602 1.00 0.00 H new ATOM 0 HA GLN A 156 71.667 -3.362 9.960 1.00 0.00 H new ATOM 0 HB2 GLN A 156 74.299 -2.722 8.881 1.00 0.00 H new ATOM 0 HB3 GLN A 156 74.529 -3.395 10.483 1.00 0.00 H new ATOM 0 HG2 GLN A 156 73.961 -5.494 9.772 1.00 0.00 H new ATOM 0 HG3 GLN A 156 72.476 -4.913 9.044 1.00 0.00 H new ATOM 0 HE21 GLN A 156 72.740 -6.134 7.054 1.00 0.00 H new ATOM 0 HE22 GLN A 156 74.011 -5.736 5.892 1.00 0.00 H new ATOM 590 N TRP A 157 73.084 -1.219 11.951 1.00 0.00 N ATOM 591 CA TRP A 157 73.163 -0.848 13.393 1.00 0.00 C ATOM 592 C TRP A 157 71.858 -0.186 13.842 1.00 0.00 C ATOM 593 O TRP A 157 71.491 -0.240 14.999 1.00 0.00 O ATOM 594 CB TRP A 157 74.326 0.142 13.487 1.00 0.00 C ATOM 595 CG TRP A 157 75.223 -0.252 14.617 1.00 0.00 C ATOM 596 CD1 TRP A 157 74.803 -0.722 15.814 1.00 0.00 C ATOM 597 CD2 TRP A 157 76.679 -0.220 14.678 1.00 0.00 C ATOM 598 NE1 TRP A 157 75.908 -0.981 16.605 1.00 0.00 N ATOM 599 CE2 TRP A 157 77.087 -0.687 15.949 1.00 0.00 C ATOM 600 CE3 TRP A 157 77.675 0.165 13.762 1.00 0.00 C ATOM 601 CZ2 TRP A 157 78.435 -0.771 16.300 1.00 0.00 C ATOM 602 CZ3 TRP A 157 79.032 0.083 14.112 1.00 0.00 C ATOM 603 CH2 TRP A 157 79.412 -0.385 15.379 1.00 0.00 C ATOM 0 H TRP A 157 73.448 -0.522 11.302 1.00 0.00 H new ATOM 0 HA TRP A 157 73.315 -1.717 14.033 1.00 0.00 H new ATOM 0 HB2 TRP A 157 74.885 0.153 12.551 1.00 0.00 H new ATOM 0 HB3 TRP A 157 73.947 1.152 13.644 1.00 0.00 H new ATOM 0 HD1 TRP A 157 73.773 -0.871 16.105 1.00 0.00 H new ATOM 0 HE1 TRP A 157 75.858 -1.345 17.557 1.00 0.00 H new ATOM 0 HE3 TRP A 157 77.394 0.526 12.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 78.721 -1.132 17.277 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 79.788 0.382 13.401 1.00 0.00 H new ATOM 0 HH2 TRP A 157 80.458 -0.447 15.642 1.00 0.00 H new ATOM 614 N PHE A 158 71.156 0.438 12.938 1.00 0.00 N ATOM 615 CA PHE A 158 69.875 1.103 13.315 1.00 0.00 C ATOM 616 C PHE A 158 68.781 0.056 13.543 1.00 0.00 C ATOM 617 O PHE A 158 67.930 0.212 14.395 1.00 0.00 O ATOM 618 CB PHE A 158 69.525 1.996 12.125 1.00 0.00 C ATOM 619 CG PHE A 158 69.984 3.407 12.401 1.00 0.00 C ATOM 620 CD1 PHE A 158 69.610 4.046 13.589 1.00 0.00 C ATOM 621 CD2 PHE A 158 70.785 4.077 11.469 1.00 0.00 C ATOM 622 CE1 PHE A 158 70.036 5.355 13.844 1.00 0.00 C ATOM 623 CE2 PHE A 158 71.211 5.386 11.724 1.00 0.00 C ATOM 624 CZ PHE A 158 70.837 6.025 12.912 1.00 0.00 C ATOM 0 H PHE A 158 71.413 0.517 11.954 1.00 0.00 H new ATOM 0 HA PHE A 158 69.964 1.674 14.239 1.00 0.00 H new ATOM 0 HB2 PHE A 158 70.002 1.618 11.221 1.00 0.00 H new ATOM 0 HB3 PHE A 158 68.449 1.980 11.949 1.00 0.00 H new ATOM 0 HD1 PHE A 158 68.993 3.529 14.309 1.00 0.00 H new ATOM 0 HD2 PHE A 158 71.075 3.584 10.553 1.00 0.00 H new ATOM 0 HE1 PHE A 158 69.746 5.848 14.760 1.00 0.00 H new ATOM 0 HE2 PHE A 158 71.828 5.903 11.004 1.00 0.00 H new ATOM 0 HZ PHE A 158 71.166 7.034 13.109 1.00 0.00 H new ATOM 634 N LEU A 159 68.797 -1.009 12.789 1.00 0.00 N ATOM 635 CA LEU A 159 67.754 -2.060 12.968 1.00 0.00 C ATOM 636 C LEU A 159 68.134 -3.325 12.192 1.00 0.00 C ATOM 637 O LEU A 159 69.204 -3.420 11.624 1.00 0.00 O ATOM 638 CB LEU A 159 66.466 -1.452 12.405 1.00 0.00 C ATOM 639 CG LEU A 159 66.788 -0.546 11.212 1.00 0.00 C ATOM 640 CD1 LEU A 159 67.524 -1.349 10.138 1.00 0.00 C ATOM 641 CD2 LEU A 159 65.486 0.006 10.628 1.00 0.00 C ATOM 0 H LEU A 159 69.484 -1.197 12.059 1.00 0.00 H new ATOM 0 HA LEU A 159 67.642 -2.350 14.013 1.00 0.00 H new ATOM 0 HB2 LEU A 159 65.785 -2.245 12.096 1.00 0.00 H new ATOM 0 HB3 LEU A 159 65.957 -0.879 13.180 1.00 0.00 H new ATOM 0 HG LEU A 159 67.420 0.277 11.545 1.00 0.00 H new ATOM 0 HD11 LEU A 159 67.751 -0.701 9.291 1.00 0.00 H new ATOM 0 HD12 LEU A 159 68.452 -1.745 10.551 1.00 0.00 H new ATOM 0 HD13 LEU A 159 66.894 -2.174 9.805 1.00 0.00 H new ATOM 0 HD21 LEU A 159 65.713 0.651 9.779 1.00 0.00 H new ATOM 0 HD22 LEU A 159 64.856 -0.820 10.298 1.00 0.00 H new ATOM 0 HD23 LEU A 159 64.960 0.581 11.390 1.00 0.00 H new ATOM 653 N LYS A 160 67.265 -4.298 12.165 1.00 0.00 N ATOM 654 CA LYS A 160 67.574 -5.555 11.426 1.00 0.00 C ATOM 655 C LYS A 160 66.983 -5.495 10.014 1.00 0.00 C ATOM 656 O LYS A 160 65.788 -5.608 9.827 1.00 0.00 O ATOM 657 CB LYS A 160 66.909 -6.667 12.238 1.00 0.00 C ATOM 658 CG LYS A 160 67.632 -6.824 13.577 1.00 0.00 C ATOM 659 CD LYS A 160 66.904 -7.864 14.431 1.00 0.00 C ATOM 660 CE LYS A 160 67.910 -8.891 14.952 1.00 0.00 C ATOM 661 NZ LYS A 160 68.440 -8.301 16.214 1.00 0.00 N1+ ATOM 0 H LYS A 160 66.354 -4.277 12.623 1.00 0.00 H new ATOM 0 HA LYS A 160 68.646 -5.717 11.316 1.00 0.00 H new ATOM 0 HB2 LYS A 160 65.858 -6.431 12.406 1.00 0.00 H new ATOM 0 HB3 LYS A 160 66.940 -7.605 11.684 1.00 0.00 H new ATOM 0 HG2 LYS A 160 68.664 -7.132 13.411 1.00 0.00 H new ATOM 0 HG3 LYS A 160 67.665 -5.868 14.099 1.00 0.00 H new ATOM 0 HD2 LYS A 160 66.401 -7.377 15.266 1.00 0.00 H new ATOM 0 HD3 LYS A 160 66.134 -8.361 13.840 1.00 0.00 H new ATOM 0 HE2 LYS A 160 67.433 -9.854 15.136 1.00 0.00 H new ATOM 0 HE3 LYS A 160 68.709 -9.063 14.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 69.138 -8.948 16.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 68.894 -7.389 16.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 67.658 -8.154 16.884 1.00 0.00 H new ATOM 675 N HIS A 161 67.809 -5.315 9.021 1.00 0.00 N ATOM 676 CA HIS A 161 67.291 -5.246 7.624 1.00 0.00 C ATOM 677 C HIS A 161 67.981 -6.294 6.748 1.00 0.00 C ATOM 678 O HIS A 161 68.910 -6.957 7.168 1.00 0.00 O ATOM 679 CB HIS A 161 67.636 -3.836 7.146 1.00 0.00 C ATOM 680 CG HIS A 161 66.387 -3.150 6.663 1.00 0.00 C ATOM 681 ND1 HIS A 161 65.665 -2.279 7.463 1.00 0.00 N ATOM 682 CD2 HIS A 161 65.719 -3.199 5.464 1.00 0.00 C ATOM 683 CE1 HIS A 161 64.617 -1.841 6.742 1.00 0.00 C ATOM 684 NE2 HIS A 161 64.603 -2.371 5.516 1.00 0.00 N ATOM 0 H HIS A 161 68.819 -5.213 9.115 1.00 0.00 H new ATOM 0 HA HIS A 161 66.221 -5.446 7.570 1.00 0.00 H new ATOM 0 HB2 HIS A 161 68.086 -3.265 7.958 1.00 0.00 H new ATOM 0 HB3 HIS A 161 68.372 -3.883 6.343 1.00 0.00 H new ATOM 0 HD2 HIS A 161 66.015 -3.791 4.610 1.00 0.00 H new ATOM 0 HE1 HIS A 161 63.877 -1.146 7.110 1.00 0.00 H new ATOM 0 HE2 HIS A 161 63.920 -2.204 4.777 1.00 0.00 H new ATOM 692 N GLU A 162 67.533 -6.450 5.532 1.00 0.00 N ATOM 693 CA GLU A 162 68.162 -7.454 4.626 1.00 0.00 C ATOM 694 C GLU A 162 68.571 -6.790 3.309 1.00 0.00 C ATOM 695 O GLU A 162 67.844 -5.991 2.753 1.00 0.00 O ATOM 696 CB GLU A 162 67.076 -8.503 4.383 1.00 0.00 C ATOM 697 CG GLU A 162 66.765 -9.227 5.695 1.00 0.00 C ATOM 698 CD GLU A 162 65.586 -10.179 5.483 1.00 0.00 C ATOM 699 OE1 GLU A 162 64.471 -9.696 5.379 1.00 0.00 O1- ATOM 700 OE2 GLU A 162 65.820 -11.375 5.429 1.00 0.00 O ATOM 0 H GLU A 162 66.758 -5.925 5.126 1.00 0.00 H new ATOM 0 HA GLU A 162 69.063 -7.893 5.055 1.00 0.00 H new ATOM 0 HB2 GLU A 162 66.175 -8.027 3.995 1.00 0.00 H new ATOM 0 HB3 GLU A 162 67.408 -9.218 3.630 1.00 0.00 H new ATOM 0 HG2 GLU A 162 67.640 -9.783 6.032 1.00 0.00 H new ATOM 0 HG3 GLU A 162 66.527 -8.504 6.475 1.00 0.00 H new ATOM 707 N ALA A 163 69.731 -7.112 2.806 1.00 0.00 N ATOM 708 CA ALA A 163 70.186 -6.497 1.526 1.00 0.00 C ATOM 709 C ALA A 163 71.132 -7.449 0.789 1.00 0.00 C ATOM 710 O ALA A 163 71.909 -8.160 1.395 1.00 0.00 O ATOM 711 CB ALA A 163 70.921 -5.223 1.939 1.00 0.00 C ATOM 0 H ALA A 163 70.384 -7.774 3.226 1.00 0.00 H new ATOM 0 HA ALA A 163 69.357 -6.288 0.850 1.00 0.00 H new ATOM 0 HB1 ALA A 163 71.288 -4.710 1.050 1.00 0.00 H new ATOM 0 HB2 ALA A 163 70.238 -4.568 2.479 1.00 0.00 H new ATOM 0 HB3 ALA A 163 71.762 -5.481 2.583 1.00 0.00 H new ATOM 717 N ARG A 164 71.071 -7.468 -0.514 1.00 0.00 N ATOM 718 CA ARG A 164 71.966 -8.373 -1.290 1.00 0.00 C ATOM 719 C ARG A 164 73.202 -7.610 -1.771 1.00 0.00 C ATOM 720 O ARG A 164 73.154 -6.414 -1.975 1.00 0.00 O ATOM 721 CB ARG A 164 71.126 -8.836 -2.480 1.00 0.00 C ATOM 722 CG ARG A 164 69.839 -9.492 -1.974 1.00 0.00 C ATOM 723 CD ARG A 164 70.172 -10.841 -1.331 1.00 0.00 C ATOM 724 NE ARG A 164 69.465 -11.848 -2.173 1.00 0.00 N ATOM 725 CZ ARG A 164 70.146 -12.756 -2.816 1.00 0.00 C ATOM 726 NH1 ARG A 164 70.659 -12.480 -3.984 1.00 0.00 N1+ ATOM 727 NH2 ARG A 164 70.316 -13.939 -2.292 1.00 0.00 N ATOM 0 H ARG A 164 70.440 -6.896 -1.075 1.00 0.00 H new ATOM 0 HA ARG A 164 72.323 -9.211 -0.692 1.00 0.00 H new ATOM 0 HB2 ARG A 164 70.886 -7.988 -3.121 1.00 0.00 H new ATOM 0 HB3 ARG A 164 71.693 -9.543 -3.086 1.00 0.00 H new ATOM 0 HG2 ARG A 164 69.348 -8.843 -1.249 1.00 0.00 H new ATOM 0 HG3 ARG A 164 69.141 -9.633 -2.799 1.00 0.00 H new ATOM 0 HD2 ARG A 164 71.247 -11.019 -1.320 1.00 0.00 H new ATOM 0 HD3 ARG A 164 69.831 -10.881 -0.296 1.00 0.00 H new ATOM 0 HE ARG A 164 68.448 -11.827 -2.246 1.00 0.00 H new ATOM 0 HH11 ARG A 164 70.527 -11.555 -4.393 1.00 0.00 H new ATOM 0 HH12 ARG A 164 71.192 -13.189 -4.488 1.00 0.00 H new ATOM 0 HH21 ARG A 164 69.916 -14.154 -1.379 1.00 0.00 H new ATOM 0 HH22 ARG A 164 70.849 -14.648 -2.796 1.00 0.00 H new ATOM 741 N PRO A 165 74.275 -8.335 -1.933 1.00 0.00 N ATOM 742 CA PRO A 165 75.546 -7.726 -2.393 1.00 0.00 C ATOM 743 C PRO A 165 75.465 -7.374 -3.882 1.00 0.00 C ATOM 744 O PRO A 165 74.852 -8.076 -4.662 1.00 0.00 O ATOM 745 CB PRO A 165 76.577 -8.825 -2.152 1.00 0.00 C ATOM 746 CG PRO A 165 75.797 -10.101 -2.178 1.00 0.00 C ATOM 747 CD PRO A 165 74.402 -9.779 -1.704 1.00 0.00 C ATOM 0 HA PRO A 165 75.788 -6.798 -1.874 1.00 0.00 H new ATOM 0 HB2 PRO A 165 77.348 -8.818 -2.922 1.00 0.00 H new ATOM 0 HB3 PRO A 165 77.081 -8.690 -1.195 1.00 0.00 H new ATOM 0 HG2 PRO A 165 75.775 -10.518 -3.185 1.00 0.00 H new ATOM 0 HG3 PRO A 165 76.260 -10.848 -1.533 1.00 0.00 H new ATOM 0 HD2 PRO A 165 73.651 -10.339 -2.262 1.00 0.00 H new ATOM 0 HD3 PRO A 165 74.270 -10.030 -0.651 1.00 0.00 H new ATOM 755 N LEU A 166 76.080 -6.295 -4.280 1.00 0.00 N ATOM 756 CA LEU A 166 76.040 -5.903 -5.718 1.00 0.00 C ATOM 757 C LEU A 166 76.690 -6.990 -6.579 1.00 0.00 C ATOM 758 O LEU A 166 76.350 -7.171 -7.731 1.00 0.00 O ATOM 759 CB LEU A 166 76.843 -4.603 -5.798 1.00 0.00 C ATOM 760 CG LEU A 166 75.886 -3.419 -5.939 1.00 0.00 C ATOM 761 CD1 LEU A 166 74.985 -3.342 -4.705 1.00 0.00 C ATOM 762 CD2 LEU A 166 76.690 -2.123 -6.065 1.00 0.00 C ATOM 0 H LEU A 166 76.608 -5.668 -3.673 1.00 0.00 H new ATOM 0 HA LEU A 166 75.021 -5.775 -6.083 1.00 0.00 H new ATOM 0 HB2 LEU A 166 77.454 -4.485 -4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 166 77.525 -4.636 -6.648 1.00 0.00 H new ATOM 0 HG LEU A 166 75.272 -3.553 -6.830 1.00 0.00 H new ATOM 0 HD11 LEU A 166 74.302 -2.498 -4.805 1.00 0.00 H new ATOM 0 HD12 LEU A 166 74.411 -4.264 -4.615 1.00 0.00 H new ATOM 0 HD13 LEU A 166 75.599 -3.209 -3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 166 76.007 -1.279 -6.166 1.00 0.00 H new ATOM 0 HD22 LEU A 166 77.305 -1.988 -5.175 1.00 0.00 H new ATOM 0 HD23 LEU A 166 77.332 -2.177 -6.944 1.00 0.00 H new ATOM 774 N ALA A 167 77.625 -7.716 -6.026 1.00 0.00 N ATOM 775 CA ALA A 167 78.296 -8.792 -6.812 1.00 0.00 C ATOM 776 C ALA A 167 77.253 -9.746 -7.400 1.00 0.00 C ATOM 777 O ALA A 167 76.241 -10.030 -6.789 1.00 0.00 O ATOM 778 CB ALA A 167 79.183 -9.523 -5.803 1.00 0.00 C ATOM 0 H ALA A 167 77.953 -7.611 -5.066 1.00 0.00 H new ATOM 0 HA ALA A 167 78.871 -8.396 -7.649 1.00 0.00 H new ATOM 0 HB1 ALA A 167 79.713 -10.333 -6.304 1.00 0.00 H new ATOM 0 HB2 ALA A 167 79.905 -8.824 -5.380 1.00 0.00 H new ATOM 0 HB3 ALA A 167 78.564 -9.934 -5.005 1.00 0.00 H new ATOM 784 N GLU A 168 77.491 -10.243 -8.582 1.00 0.00 N ATOM 785 CA GLU A 168 76.513 -11.178 -9.210 1.00 0.00 C ATOM 786 C GLU A 168 76.784 -12.613 -8.752 1.00 0.00 C ATOM 787 O GLU A 168 77.519 -12.780 -7.792 1.00 0.00 O ATOM 788 CB GLU A 168 76.746 -11.042 -10.715 1.00 0.00 C ATOM 789 CG GLU A 168 76.030 -9.793 -11.232 1.00 0.00 C ATOM 790 CD GLU A 168 75.445 -10.079 -12.617 1.00 0.00 C ATOM 791 OE1 GLU A 168 74.347 -10.609 -12.676 1.00 0.00 O ATOM 792 OE2 GLU A 168 76.104 -9.764 -13.593 1.00 0.00 O1- ATOM 793 OXT GLU A 168 76.251 -13.521 -9.369 1.00 0.00 O ATOM 0 H GLU A 168 78.320 -10.043 -9.141 1.00 0.00 H new ATOM 0 HA GLU A 168 75.484 -10.946 -8.934 1.00 0.00 H new ATOM 0 HB2 GLU A 168 77.814 -10.975 -10.924 1.00 0.00 H new ATOM 0 HB3 GLU A 168 76.375 -11.927 -11.232 1.00 0.00 H new ATOM 0 HG2 GLU A 168 75.237 -9.504 -10.543 1.00 0.00 H new ATOM 0 HG3 GLU A 168 76.727 -8.957 -11.285 1.00 0.00 H new TER 800 GLU A 168 ATOM 801 N GLY B 118 98.936 5.280 -23.480 1.00 0.00 N ATOM 802 CA GLY B 118 99.932 6.051 -22.683 1.00 0.00 C ATOM 803 C GLY B 118 100.414 5.198 -21.507 1.00 0.00 C ATOM 804 O GLY B 118 99.628 4.696 -20.729 1.00 0.00 O ATOM 0 HA2 GLY B 118 100.777 6.334 -23.312 1.00 0.00 H new ATOM 0 HA3 GLY B 118 99.484 6.975 -22.317 1.00 0.00 H new ATOM 810 N SER B 119 101.701 5.030 -21.371 1.00 0.00 N ATOM 811 CA SER B 119 102.229 4.207 -20.246 1.00 0.00 C ATOM 812 C SER B 119 101.920 4.883 -18.907 1.00 0.00 C ATOM 813 O SER B 119 101.778 4.233 -17.891 1.00 0.00 O ATOM 814 CB SER B 119 103.740 4.141 -20.477 1.00 0.00 C ATOM 815 OG SER B 119 104.341 3.358 -19.457 1.00 0.00 O ATOM 0 H SER B 119 102.409 5.426 -21.989 1.00 0.00 H new ATOM 0 HA SER B 119 101.779 3.215 -20.213 1.00 0.00 H new ATOM 0 HB2 SER B 119 103.951 3.707 -21.455 1.00 0.00 H new ATOM 0 HB3 SER B 119 104.163 5.146 -20.476 1.00 0.00 H new ATOM 0 HG SER B 119 105.309 3.314 -19.606 1.00 0.00 H new ATOM 821 N ARG B 120 101.814 6.184 -18.900 1.00 0.00 N ATOM 822 CA ARG B 120 101.511 6.900 -17.628 1.00 0.00 C ATOM 823 C ARG B 120 100.077 6.603 -17.181 1.00 0.00 C ATOM 824 O ARG B 120 99.130 6.851 -17.901 1.00 0.00 O ATOM 825 CB ARG B 120 101.674 8.384 -17.960 1.00 0.00 C ATOM 826 CG ARG B 120 103.124 8.807 -17.715 1.00 0.00 C ATOM 827 CD ARG B 120 103.148 10.069 -16.851 1.00 0.00 C ATOM 828 NE ARG B 120 104.462 10.707 -17.146 1.00 0.00 N ATOM 829 CZ ARG B 120 105.474 10.517 -16.343 1.00 0.00 C ATOM 830 NH1 ARG B 120 105.300 10.555 -15.051 1.00 0.00 N ATOM 831 NH2 ARG B 120 106.661 10.289 -16.835 1.00 0.00 N1+ ATOM 0 H ARG B 120 101.924 6.782 -19.719 1.00 0.00 H new ATOM 0 HA ARG B 120 102.166 6.590 -16.814 1.00 0.00 H new ATOM 0 HB2 ARG B 120 101.402 8.567 -18.999 1.00 0.00 H new ATOM 0 HB3 ARG B 120 101.001 8.981 -17.344 1.00 0.00 H new ATOM 0 HG2 ARG B 120 103.670 8.004 -17.220 1.00 0.00 H new ATOM 0 HG3 ARG B 120 103.625 8.994 -18.665 1.00 0.00 H new ATOM 0 HD2 ARG B 120 102.321 10.734 -17.099 1.00 0.00 H new ATOM 0 HD3 ARG B 120 103.055 9.826 -15.793 1.00 0.00 H new ATOM 0 HE ARG B 120 104.571 11.292 -17.975 1.00 0.00 H new ATOM 0 HH11 ARG B 120 104.372 10.733 -14.666 1.00 0.00 H new ATOM 0 HH12 ARG B 120 106.092 10.406 -14.425 1.00 0.00 H new ATOM 0 HH21 ARG B 120 106.797 10.259 -17.845 1.00 0.00 H new ATOM 0 HH22 ARG B 120 107.453 10.140 -16.209 1.00 0.00 H new ATOM 845 N GLN B 121 99.910 6.076 -16.000 1.00 0.00 N ATOM 846 CA GLN B 121 98.536 5.765 -15.509 1.00 0.00 C ATOM 847 C GLN B 121 98.010 6.913 -14.643 1.00 0.00 C ATOM 848 O GLN B 121 98.770 7.666 -14.066 1.00 0.00 O ATOM 849 CB GLN B 121 98.692 4.493 -14.674 1.00 0.00 C ATOM 850 CG GLN B 121 97.386 3.695 -14.711 1.00 0.00 C ATOM 851 CD GLN B 121 97.197 2.965 -13.380 1.00 0.00 C ATOM 852 OE1 GLN B 121 97.519 1.798 -13.262 1.00 0.00 O ATOM 853 NE2 GLN B 121 96.683 3.604 -12.364 1.00 0.00 N ATOM 0 H GLN B 121 100.664 5.847 -15.353 1.00 0.00 H new ATOM 0 HA GLN B 121 97.827 5.633 -16.326 1.00 0.00 H new ATOM 0 HB2 GLN B 121 99.511 3.888 -15.063 1.00 0.00 H new ATOM 0 HB3 GLN B 121 98.945 4.749 -13.645 1.00 0.00 H new ATOM 0 HG2 GLN B 121 96.544 4.363 -14.895 1.00 0.00 H new ATOM 0 HG3 GLN B 121 97.409 2.978 -15.531 1.00 0.00 H new ATOM 0 HE21 GLN B 121 96.412 4.583 -12.461 1.00 0.00 H new ATOM 0 HE22 GLN B 121 96.552 3.125 -11.473 1.00 0.00 H new ATOM 862 N ILE B 122 96.716 7.054 -14.549 1.00 0.00 N ATOM 863 CA ILE B 122 96.144 8.153 -13.720 1.00 0.00 C ATOM 864 C ILE B 122 94.959 7.634 -12.901 1.00 0.00 C ATOM 865 O ILE B 122 94.068 6.991 -13.418 1.00 0.00 O ATOM 866 CB ILE B 122 95.681 9.209 -14.726 1.00 0.00 C ATOM 867 CG1 ILE B 122 96.836 10.167 -15.028 1.00 0.00 C ATOM 868 CG2 ILE B 122 94.509 9.997 -14.136 1.00 0.00 C ATOM 869 CD1 ILE B 122 96.542 10.927 -16.323 1.00 0.00 C ATOM 0 H ILE B 122 96.030 6.456 -15.010 1.00 0.00 H new ATOM 0 HA ILE B 122 96.867 8.556 -13.011 1.00 0.00 H new ATOM 0 HB ILE B 122 95.364 8.719 -15.646 1.00 0.00 H new ATOM 0 HG12 ILE B 122 96.966 10.868 -14.204 1.00 0.00 H new ATOM 0 HG13 ILE B 122 97.769 9.611 -15.124 1.00 0.00 H new ATOM 0 HG21 ILE B 122 94.179 10.749 -14.852 1.00 0.00 H new ATOM 0 HG22 ILE B 122 93.686 9.317 -13.919 1.00 0.00 H new ATOM 0 HG23 ILE B 122 94.827 10.487 -13.216 1.00 0.00 H new ATOM 0 HD11 ILE B 122 97.364 11.610 -16.539 1.00 0.00 H new ATOM 0 HD12 ILE B 122 96.433 10.218 -17.144 1.00 0.00 H new ATOM 0 HD13 ILE B 122 95.619 11.495 -16.210 1.00 0.00 H new ATOM 881 N VAL B 123 94.943 7.908 -11.625 1.00 0.00 N ATOM 882 CA VAL B 123 93.816 7.429 -10.774 1.00 0.00 C ATOM 883 C VAL B 123 92.652 8.422 -10.826 1.00 0.00 C ATOM 884 O VAL B 123 91.514 8.049 -11.030 1.00 0.00 O ATOM 885 CB VAL B 123 94.392 7.351 -9.360 1.00 0.00 C ATOM 886 CG1 VAL B 123 93.380 6.675 -8.434 1.00 0.00 C ATOM 887 CG2 VAL B 123 95.687 6.536 -9.383 1.00 0.00 C ATOM 0 H VAL B 123 95.661 8.442 -11.135 1.00 0.00 H new ATOM 0 HA VAL B 123 93.427 6.468 -11.109 1.00 0.00 H new ATOM 0 HB VAL B 123 94.601 8.357 -8.996 1.00 0.00 H new ATOM 0 HG11 VAL B 123 93.790 6.619 -7.426 1.00 0.00 H new ATOM 0 HG12 VAL B 123 92.457 7.255 -8.419 1.00 0.00 H new ATOM 0 HG13 VAL B 123 93.170 5.669 -8.797 1.00 0.00 H new ATOM 0 HG21 VAL B 123 96.099 6.479 -8.376 1.00 0.00 H new ATOM 0 HG22 VAL B 123 95.477 5.530 -9.746 1.00 0.00 H new ATOM 0 HG23 VAL B 123 96.408 7.017 -10.043 1.00 0.00 H new ATOM 897 N ASP B 124 92.927 9.685 -10.641 1.00 0.00 N ATOM 898 CA ASP B 124 91.834 10.698 -10.679 1.00 0.00 C ATOM 899 C ASP B 124 90.795 10.394 -9.597 1.00 0.00 C ATOM 900 O ASP B 124 89.618 10.644 -9.765 1.00 0.00 O ATOM 901 CB ASP B 124 91.217 10.563 -12.070 1.00 0.00 C ATOM 902 CG ASP B 124 90.495 11.861 -12.435 1.00 0.00 C ATOM 903 OD1 ASP B 124 90.740 12.858 -11.775 1.00 0.00 O ATOM 904 OD2 ASP B 124 89.710 11.838 -13.369 1.00 0.00 O1- ATOM 0 H ASP B 124 93.860 10.058 -10.465 1.00 0.00 H new ATOM 0 HA ASP B 124 92.199 11.708 -10.493 1.00 0.00 H new ATOM 0 HB2 ASP B 124 91.993 10.347 -12.804 1.00 0.00 H new ATOM 0 HB3 ASP B 124 90.518 9.727 -12.090 1.00 0.00 H new ATOM 909 N ALA B 125 91.221 9.853 -8.488 1.00 0.00 N ATOM 910 CA ALA B 125 90.257 9.532 -7.397 1.00 0.00 C ATOM 911 C ALA B 125 91.002 8.978 -6.181 1.00 0.00 C ATOM 912 O ALA B 125 91.525 7.881 -6.207 1.00 0.00 O ATOM 913 CB ALA B 125 89.329 8.470 -7.990 1.00 0.00 C ATOM 0 H ALA B 125 92.194 9.620 -8.290 1.00 0.00 H new ATOM 0 HA ALA B 125 89.707 10.410 -7.058 1.00 0.00 H new ATOM 0 HB1 ALA B 125 88.587 8.179 -7.246 1.00 0.00 H new ATOM 0 HB2 ALA B 125 88.824 8.876 -8.866 1.00 0.00 H new ATOM 0 HB3 ALA B 125 89.914 7.597 -8.280 1.00 0.00 H new ATOM 919 N GLN B 126 91.055 9.727 -5.114 1.00 0.00 N ATOM 920 CA GLN B 126 91.768 9.242 -3.896 1.00 0.00 C ATOM 921 C GLN B 126 90.764 8.940 -2.782 1.00 0.00 C ATOM 922 O GLN B 126 91.014 9.196 -1.620 1.00 0.00 O ATOM 923 CB GLN B 126 92.689 10.394 -3.492 1.00 0.00 C ATOM 924 CG GLN B 126 93.882 10.452 -4.447 1.00 0.00 C ATOM 925 CD GLN B 126 93.772 11.700 -5.325 1.00 0.00 C ATOM 926 OE1 GLN B 126 94.250 12.756 -4.962 1.00 0.00 O ATOM 927 NE2 GLN B 126 93.156 11.623 -6.473 1.00 0.00 N ATOM 0 H GLN B 126 90.636 10.653 -5.032 1.00 0.00 H new ATOM 0 HA GLN B 126 92.323 8.322 -4.080 1.00 0.00 H new ATOM 0 HB2 GLN B 126 92.143 11.337 -3.518 1.00 0.00 H new ATOM 0 HB3 GLN B 126 93.036 10.255 -2.468 1.00 0.00 H new ATOM 0 HG2 GLN B 126 94.814 10.473 -3.881 1.00 0.00 H new ATOM 0 HG3 GLN B 126 93.907 9.557 -5.069 1.00 0.00 H new ATOM 0 HE21 GLN B 126 92.755 10.736 -6.778 1.00 0.00 H new ATOM 0 HE22 GLN B 126 93.076 12.450 -7.065 1.00 0.00 H new ATOM 936 N ALA B 127 89.629 8.394 -3.126 1.00 0.00 N ATOM 937 CA ALA B 127 88.609 8.072 -2.088 1.00 0.00 C ATOM 938 C ALA B 127 87.830 6.819 -2.492 1.00 0.00 C ATOM 939 O ALA B 127 86.623 6.757 -2.370 1.00 0.00 O ATOM 940 CB ALA B 127 87.683 9.289 -2.049 1.00 0.00 C ATOM 0 H ALA B 127 89.364 8.157 -4.082 1.00 0.00 H new ATOM 0 HA ALA B 127 89.057 7.872 -1.115 1.00 0.00 H new ATOM 0 HB1 ALA B 127 86.902 9.128 -1.306 1.00 0.00 H new ATOM 0 HB2 ALA B 127 88.259 10.176 -1.785 1.00 0.00 H new ATOM 0 HB3 ALA B 127 87.227 9.431 -3.029 1.00 0.00 H new ATOM 946 N VAL B 128 88.515 5.819 -2.974 1.00 0.00 N ATOM 947 CA VAL B 128 87.820 4.569 -3.391 1.00 0.00 C ATOM 948 C VAL B 128 88.710 3.354 -3.122 1.00 0.00 C ATOM 949 O VAL B 128 89.907 3.474 -2.951 1.00 0.00 O ATOM 950 CB VAL B 128 87.561 4.728 -4.886 1.00 0.00 C ATOM 951 CG1 VAL B 128 86.373 5.667 -5.099 1.00 0.00 C ATOM 952 CG2 VAL B 128 88.804 5.310 -5.562 1.00 0.00 C ATOM 0 H VAL B 128 89.528 5.814 -3.097 1.00 0.00 H new ATOM 0 HA VAL B 128 86.894 4.412 -2.838 1.00 0.00 H new ATOM 0 HB VAL B 128 87.336 3.755 -5.322 1.00 0.00 H new ATOM 0 HG11 VAL B 128 86.187 5.782 -6.167 1.00 0.00 H new ATOM 0 HG12 VAL B 128 85.488 5.249 -4.619 1.00 0.00 H new ATOM 0 HG13 VAL B 128 86.596 6.641 -4.663 1.00 0.00 H new ATOM 0 HG21 VAL B 128 88.618 5.423 -6.630 1.00 0.00 H new ATOM 0 HG22 VAL B 128 89.032 6.284 -5.128 1.00 0.00 H new ATOM 0 HG23 VAL B 128 89.649 4.638 -5.410 1.00 0.00 H new ATOM 962 N CYS B 129 88.129 2.187 -3.074 1.00 0.00 N ATOM 963 CA CYS B 129 88.932 0.956 -2.807 1.00 0.00 C ATOM 964 C CYS B 129 90.184 0.926 -3.681 1.00 0.00 C ATOM 965 O CYS B 129 90.170 1.344 -4.820 1.00 0.00 O ATOM 966 CB CYS B 129 88.010 -0.207 -3.167 1.00 0.00 C ATOM 967 SG CYS B 129 88.746 -1.759 -2.597 1.00 0.00 S ATOM 0 H CYS B 129 87.130 2.031 -3.208 1.00 0.00 H new ATOM 0 HA CYS B 129 89.269 0.911 -1.771 1.00 0.00 H new ATOM 0 HB2 CYS B 129 87.032 -0.065 -2.707 1.00 0.00 H new ATOM 0 HB3 CYS B 129 87.853 -0.241 -4.245 1.00 0.00 H new ATOM 972 N THR B 130 91.267 0.424 -3.158 1.00 0.00 N ATOM 973 CA THR B 130 92.517 0.359 -3.962 1.00 0.00 C ATOM 974 C THR B 130 92.425 -0.789 -4.973 1.00 0.00 C ATOM 975 O THR B 130 93.113 -0.804 -5.974 1.00 0.00 O ATOM 976 CB THR B 130 93.632 0.102 -2.948 1.00 0.00 C ATOM 977 OG1 THR B 130 94.841 0.679 -3.420 1.00 0.00 O ATOM 978 CG2 THR B 130 93.821 -1.404 -2.762 1.00 0.00 C ATOM 0 H THR B 130 91.340 0.056 -2.209 1.00 0.00 H new ATOM 0 HA THR B 130 92.696 1.272 -4.530 1.00 0.00 H new ATOM 0 HB THR B 130 93.363 0.551 -1.992 1.00 0.00 H new ATOM 0 HG1 THR B 130 95.556 0.517 -2.770 1.00 0.00 H new ATOM 0 HG21 THR B 130 94.616 -1.584 -2.039 1.00 0.00 H new ATOM 0 HG22 THR B 130 92.893 -1.845 -2.398 1.00 0.00 H new ATOM 0 HG23 THR B 130 94.089 -1.858 -3.716 1.00 0.00 H new ATOM 986 N ARG B 131 91.575 -1.748 -4.719 1.00 0.00 N ATOM 987 CA ARG B 131 91.432 -2.892 -5.665 1.00 0.00 C ATOM 988 C ARG B 131 90.270 -2.628 -6.628 1.00 0.00 C ATOM 989 O ARG B 131 90.431 -2.653 -7.831 1.00 0.00 O ATOM 990 CB ARG B 131 91.133 -4.103 -4.781 1.00 0.00 C ATOM 991 CG ARG B 131 90.937 -5.342 -5.658 1.00 0.00 C ATOM 992 CD ARG B 131 91.405 -6.584 -4.897 1.00 0.00 C ATOM 993 NE ARG B 131 90.220 -7.489 -4.878 1.00 0.00 N ATOM 994 CZ ARG B 131 89.693 -7.897 -6.000 1.00 0.00 C ATOM 995 NH1 ARG B 131 90.408 -8.593 -6.840 1.00 0.00 N1+ ATOM 996 NH2 ARG B 131 88.452 -7.610 -6.279 1.00 0.00 N ATOM 0 H ARG B 131 90.973 -1.788 -3.896 1.00 0.00 H new ATOM 0 HA ARG B 131 92.324 -3.045 -6.272 1.00 0.00 H new ATOM 0 HB2 ARG B 131 91.952 -4.266 -4.081 1.00 0.00 H new ATOM 0 HB3 ARG B 131 90.238 -3.920 -4.187 1.00 0.00 H new ATOM 0 HG2 ARG B 131 89.887 -5.444 -5.932 1.00 0.00 H new ATOM 0 HG3 ARG B 131 91.500 -5.237 -6.586 1.00 0.00 H new ATOM 0 HD2 ARG B 131 92.254 -7.055 -5.392 1.00 0.00 H new ATOM 0 HD3 ARG B 131 91.726 -6.331 -3.886 1.00 0.00 H new ATOM 0 HE ARG B 131 89.821 -7.789 -3.988 1.00 0.00 H new ATOM 0 HH11 ARG B 131 91.378 -8.818 -6.620 1.00 0.00 H new ATOM 0 HH12 ARG B 131 89.997 -8.912 -7.717 1.00 0.00 H new ATOM 0 HH21 ARG B 131 87.894 -7.067 -5.620 1.00 0.00 H new ATOM 0 HH22 ARG B 131 88.040 -7.929 -7.156 1.00 0.00 H new ATOM 1010 N CYS B 132 89.101 -2.373 -6.104 1.00 0.00 N ATOM 1011 CA CYS B 132 87.931 -2.102 -6.988 1.00 0.00 C ATOM 1012 C CYS B 132 88.014 -0.679 -7.547 1.00 0.00 C ATOM 1013 O CYS B 132 87.442 -0.371 -8.573 1.00 0.00 O ATOM 1014 CB CYS B 132 86.708 -2.251 -6.082 1.00 0.00 C ATOM 1015 SG CYS B 132 86.759 -3.863 -5.261 1.00 0.00 S ATOM 0 H CYS B 132 88.906 -2.341 -5.103 1.00 0.00 H new ATOM 0 HA CYS B 132 87.890 -2.779 -7.842 1.00 0.00 H new ATOM 0 HB2 CYS B 132 86.693 -1.453 -5.340 1.00 0.00 H new ATOM 0 HB3 CYS B 132 85.794 -2.158 -6.669 1.00 0.00 H new ATOM 1020 N LYS B 133 88.728 0.186 -6.876 1.00 0.00 N ATOM 1021 CA LYS B 133 88.864 1.592 -7.357 1.00 0.00 C ATOM 1022 C LYS B 133 87.526 2.337 -7.245 1.00 0.00 C ATOM 1023 O LYS B 133 87.366 3.425 -7.759 1.00 0.00 O ATOM 1024 CB LYS B 133 89.360 1.467 -8.814 1.00 0.00 C ATOM 1025 CG LYS B 133 88.269 1.833 -9.834 1.00 0.00 C ATOM 1026 CD LYS B 133 88.381 3.317 -10.194 1.00 0.00 C ATOM 1027 CE LYS B 133 86.981 3.897 -10.411 1.00 0.00 C ATOM 1028 NZ LYS B 133 87.095 4.708 -11.655 1.00 0.00 N1+ ATOM 0 H LYS B 133 89.226 -0.023 -6.010 1.00 0.00 H new ATOM 0 HA LYS B 133 89.563 2.178 -6.760 1.00 0.00 H new ATOM 0 HB2 LYS B 133 90.223 2.117 -8.959 1.00 0.00 H new ATOM 0 HB3 LYS B 133 89.696 0.446 -8.995 1.00 0.00 H new ATOM 0 HG2 LYS B 133 88.375 1.222 -10.730 1.00 0.00 H new ATOM 0 HG3 LYS B 133 87.283 1.622 -9.419 1.00 0.00 H new ATOM 0 HD2 LYS B 133 88.891 3.858 -9.397 1.00 0.00 H new ATOM 0 HD3 LYS B 133 88.981 3.439 -11.096 1.00 0.00 H new ATOM 0 HE2 LYS B 133 86.238 3.107 -10.520 1.00 0.00 H new ATOM 0 HE3 LYS B 133 86.672 4.511 -9.565 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 86.175 5.141 -11.873 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 87.805 5.455 -11.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 87.385 4.095 -12.444 1.00 0.00 H new ATOM 1042 N GLU B 134 86.565 1.771 -6.563 1.00 0.00 N ATOM 1043 CA GLU B 134 85.253 2.465 -6.420 1.00 0.00 C ATOM 1044 C GLU B 134 84.356 1.724 -5.425 1.00 0.00 C ATOM 1045 O GLU B 134 84.737 0.720 -4.855 1.00 0.00 O ATOM 1046 CB GLU B 134 84.636 2.438 -7.819 1.00 0.00 C ATOM 1047 CG GLU B 134 84.455 0.986 -8.268 1.00 0.00 C ATOM 1048 CD GLU B 134 84.301 0.939 -9.790 1.00 0.00 C ATOM 1049 OE1 GLU B 134 83.231 1.280 -10.268 1.00 0.00 O1- ATOM 1050 OE2 GLU B 134 85.254 0.561 -10.450 1.00 0.00 O ATOM 0 H GLU B 134 86.632 0.864 -6.102 1.00 0.00 H new ATOM 0 HA GLU B 134 85.368 3.481 -6.041 1.00 0.00 H new ATOM 0 HB2 GLU B 134 83.674 2.951 -7.814 1.00 0.00 H new ATOM 0 HB3 GLU B 134 85.278 2.970 -8.522 1.00 0.00 H new ATOM 0 HG2 GLU B 134 85.313 0.389 -7.960 1.00 0.00 H new ATOM 0 HG3 GLU B 134 83.577 0.553 -7.789 1.00 0.00 H new ATOM 1057 N SER B 135 83.164 2.214 -5.218 1.00 0.00 N ATOM 1058 CA SER B 135 82.226 1.549 -4.268 1.00 0.00 C ATOM 1059 C SER B 135 82.877 1.377 -2.891 1.00 0.00 C ATOM 1060 O SER B 135 82.751 0.348 -2.258 1.00 0.00 O ATOM 1061 CB SER B 135 81.919 0.187 -4.896 1.00 0.00 C ATOM 1062 OG SER B 135 81.315 -0.658 -3.929 1.00 0.00 O ATOM 0 H SER B 135 82.797 3.052 -5.669 1.00 0.00 H new ATOM 0 HA SER B 135 81.322 2.138 -4.110 1.00 0.00 H new ATOM 0 HB2 SER B 135 81.254 0.311 -5.751 1.00 0.00 H new ATOM 0 HB3 SER B 135 82.837 -0.268 -5.269 1.00 0.00 H new ATOM 0 HG SER B 135 81.961 -0.857 -3.220 1.00 0.00 H new ATOM 1068 N ALA B 136 83.566 2.381 -2.418 1.00 0.00 N ATOM 1069 CA ALA B 136 84.215 2.272 -1.078 1.00 0.00 C ATOM 1070 C ALA B 136 84.237 3.638 -0.389 1.00 0.00 C ATOM 1071 O ALA B 136 84.654 4.626 -0.963 1.00 0.00 O ATOM 1072 CB ALA B 136 85.637 1.792 -1.359 1.00 0.00 C ATOM 0 H ALA B 136 83.708 3.269 -2.899 1.00 0.00 H new ATOM 0 HA ALA B 136 83.680 1.590 -0.417 1.00 0.00 H new ATOM 0 HB1 ALA B 136 86.178 1.688 -0.419 1.00 0.00 H new ATOM 0 HB2 ALA B 136 85.602 0.828 -1.866 1.00 0.00 H new ATOM 0 HB3 ALA B 136 86.147 2.517 -1.993 1.00 0.00 H new ATOM 1078 N ASP B 137 83.794 3.703 0.836 1.00 0.00 N ATOM 1079 CA ASP B 137 83.793 5.007 1.560 1.00 0.00 C ATOM 1080 C ASP B 137 84.485 4.857 2.917 1.00 0.00 C ATOM 1081 O ASP B 137 84.221 5.594 3.845 1.00 0.00 O ATOM 1082 CB ASP B 137 82.316 5.356 1.748 1.00 0.00 C ATOM 1083 CG ASP B 137 82.146 6.876 1.725 1.00 0.00 C ATOM 1084 OD1 ASP B 137 82.929 7.550 2.374 1.00 0.00 O1- ATOM 1085 OD2 ASP B 137 81.235 7.341 1.059 1.00 0.00 O ATOM 0 H ASP B 137 83.433 2.911 1.367 1.00 0.00 H new ATOM 0 HA ASP B 137 84.328 5.783 1.013 1.00 0.00 H new ATOM 0 HB2 ASP B 137 81.720 4.900 0.957 1.00 0.00 H new ATOM 0 HB3 ASP B 137 81.953 4.953 2.693 1.00 0.00 H new ATOM 1090 N PHE B 138 85.373 3.907 3.038 1.00 0.00 N ATOM 1091 CA PHE B 138 86.082 3.709 4.335 1.00 0.00 C ATOM 1092 C PHE B 138 87.532 3.289 4.084 1.00 0.00 C ATOM 1093 O PHE B 138 87.834 2.597 3.131 1.00 0.00 O ATOM 1094 CB PHE B 138 85.315 2.590 5.038 1.00 0.00 C ATOM 1095 CG PHE B 138 84.253 3.190 5.928 1.00 0.00 C ATOM 1096 CD1 PHE B 138 83.056 3.657 5.371 1.00 0.00 C ATOM 1097 CD2 PHE B 138 84.464 3.281 7.308 1.00 0.00 C ATOM 1098 CE1 PHE B 138 82.071 4.214 6.195 1.00 0.00 C ATOM 1099 CE2 PHE B 138 83.479 3.838 8.132 1.00 0.00 C ATOM 1100 CZ PHE B 138 82.283 4.304 7.576 1.00 0.00 C ATOM 0 H PHE B 138 85.638 3.260 2.295 1.00 0.00 H new ATOM 0 HA PHE B 138 86.113 4.620 4.933 1.00 0.00 H new ATOM 0 HB2 PHE B 138 84.857 1.930 4.301 1.00 0.00 H new ATOM 0 HB3 PHE B 138 85.999 1.981 5.629 1.00 0.00 H new ATOM 0 HD1 PHE B 138 82.893 3.587 4.306 1.00 0.00 H new ATOM 0 HD2 PHE B 138 85.387 2.921 7.738 1.00 0.00 H new ATOM 0 HE1 PHE B 138 81.148 4.574 5.766 1.00 0.00 H new ATOM 0 HE2 PHE B 138 83.642 3.908 9.197 1.00 0.00 H new ATOM 0 HZ PHE B 138 81.523 4.733 8.212 1.00 0.00 H new ATOM 1110 N TRP B 139 88.434 3.704 4.931 1.00 0.00 N ATOM 1111 CA TRP B 139 89.863 3.328 4.739 1.00 0.00 C ATOM 1112 C TRP B 139 90.471 2.861 6.064 1.00 0.00 C ATOM 1113 O TRP B 139 90.147 3.367 7.119 1.00 0.00 O ATOM 1114 CB TRP B 139 90.545 4.609 4.254 1.00 0.00 C ATOM 1115 CG TRP B 139 91.297 5.234 5.385 1.00 0.00 C ATOM 1116 CD1 TRP B 139 92.557 4.911 5.754 1.00 0.00 C ATOM 1117 CD2 TRP B 139 90.860 6.285 6.297 1.00 0.00 C ATOM 1118 NE1 TRP B 139 92.922 5.695 6.833 1.00 0.00 N ATOM 1119 CE2 TRP B 139 91.911 6.557 7.205 1.00 0.00 C ATOM 1120 CE3 TRP B 139 89.668 7.019 6.423 1.00 0.00 C ATOM 1121 CZ2 TRP B 139 91.782 7.524 8.202 1.00 0.00 C ATOM 1122 CZ3 TRP B 139 89.535 7.993 7.426 1.00 0.00 C ATOM 1123 CH2 TRP B 139 90.591 8.245 8.313 1.00 0.00 C ATOM 0 H TRP B 139 88.243 4.286 5.746 1.00 0.00 H new ATOM 0 HA TRP B 139 89.984 2.508 4.031 1.00 0.00 H new ATOM 0 HB2 TRP B 139 91.225 4.383 3.433 1.00 0.00 H new ATOM 0 HB3 TRP B 139 89.801 5.306 3.869 1.00 0.00 H new ATOM 0 HD1 TRP B 139 93.177 4.163 5.283 1.00 0.00 H new ATOM 0 HE1 TRP B 139 93.829 5.642 7.297 1.00 0.00 H new ATOM 0 HE3 TRP B 139 88.849 6.833 5.744 1.00 0.00 H new ATOM 0 HZ2 TRP B 139 92.598 7.714 8.884 1.00 0.00 H new ATOM 0 HZ3 TRP B 139 88.614 8.551 7.514 1.00 0.00 H new ATOM 0 HH2 TRP B 139 90.484 8.996 9.082 1.00 0.00 H new ATOM 1134 N CYS B 140 91.347 1.896 6.017 1.00 0.00 N ATOM 1135 CA CYS B 140 91.974 1.394 7.275 1.00 0.00 C ATOM 1136 C CYS B 140 93.045 2.374 7.762 1.00 0.00 C ATOM 1137 O CYS B 140 93.923 2.766 7.021 1.00 0.00 O ATOM 1138 CB CYS B 140 92.605 0.055 6.896 1.00 0.00 C ATOM 1139 SG CYS B 140 91.408 -1.275 7.167 1.00 0.00 S ATOM 0 H CYS B 140 91.657 1.432 5.163 1.00 0.00 H new ATOM 0 HA CYS B 140 91.250 1.289 8.083 1.00 0.00 H new ATOM 0 HB2 CYS B 140 92.917 0.071 5.852 1.00 0.00 H new ATOM 0 HB3 CYS B 140 93.500 -0.119 7.493 1.00 0.00 H new ATOM 1144 N PHE B 141 92.978 2.771 9.005 1.00 0.00 N ATOM 1145 CA PHE B 141 93.993 3.725 9.537 1.00 0.00 C ATOM 1146 C PHE B 141 95.370 3.056 9.598 1.00 0.00 C ATOM 1147 O PHE B 141 96.377 3.657 9.283 1.00 0.00 O ATOM 1148 CB PHE B 141 93.507 4.078 10.943 1.00 0.00 C ATOM 1149 CG PHE B 141 94.268 5.281 11.451 1.00 0.00 C ATOM 1150 CD1 PHE B 141 95.629 5.168 11.758 1.00 0.00 C ATOM 1151 CD2 PHE B 141 93.613 6.506 11.612 1.00 0.00 C ATOM 1152 CE1 PHE B 141 96.336 6.283 12.228 1.00 0.00 C ATOM 1153 CE2 PHE B 141 94.319 7.621 12.081 1.00 0.00 C ATOM 1154 CZ PHE B 141 95.681 7.509 12.389 1.00 0.00 C ATOM 0 H PHE B 141 92.266 2.476 9.673 1.00 0.00 H new ATOM 0 HA PHE B 141 94.097 4.609 8.907 1.00 0.00 H new ATOM 0 HB2 PHE B 141 92.438 4.290 10.927 1.00 0.00 H new ATOM 0 HB3 PHE B 141 93.654 3.231 11.614 1.00 0.00 H new ATOM 0 HD1 PHE B 141 96.134 4.222 11.633 1.00 0.00 H new ATOM 0 HD2 PHE B 141 92.563 6.592 11.375 1.00 0.00 H new ATOM 0 HE1 PHE B 141 97.386 6.196 12.466 1.00 0.00 H new ATOM 0 HE2 PHE B 141 93.813 8.567 12.205 1.00 0.00 H new ATOM 0 HZ PHE B 141 96.225 8.369 12.751 1.00 0.00 H new ATOM 1164 N GLU B 142 95.421 1.815 10.000 1.00 0.00 N ATOM 1165 CA GLU B 142 96.733 1.111 10.079 1.00 0.00 C ATOM 1166 C GLU B 142 97.233 0.767 8.673 1.00 0.00 C ATOM 1167 O GLU B 142 98.383 0.981 8.344 1.00 0.00 O ATOM 1168 CB GLU B 142 96.453 -0.163 10.877 1.00 0.00 C ATOM 1169 CG GLU B 142 97.242 -0.126 12.188 1.00 0.00 C ATOM 1170 CD GLU B 142 98.450 -1.060 12.084 1.00 0.00 C ATOM 1171 OE1 GLU B 142 99.329 -0.774 11.288 1.00 0.00 O ATOM 1172 OE2 GLU B 142 98.475 -2.045 12.802 1.00 0.00 O1- ATOM 0 H GLU B 142 94.612 1.259 10.277 1.00 0.00 H new ATOM 0 HA GLU B 142 97.503 1.723 10.549 1.00 0.00 H new ATOM 0 HB2 GLU B 142 95.386 -0.248 11.084 1.00 0.00 H new ATOM 0 HB3 GLU B 142 96.736 -1.040 10.294 1.00 0.00 H new ATOM 0 HG2 GLU B 142 97.573 0.891 12.397 1.00 0.00 H new ATOM 0 HG3 GLU B 142 96.604 -0.431 13.017 1.00 0.00 H new ATOM 1179 N CYS B 143 96.378 0.236 7.842 1.00 0.00 N ATOM 1180 CA CYS B 143 96.807 -0.120 6.458 1.00 0.00 C ATOM 1181 C CYS B 143 96.868 1.136 5.582 1.00 0.00 C ATOM 1182 O CYS B 143 97.499 1.147 4.543 1.00 0.00 O ATOM 1183 CB CYS B 143 95.731 -1.079 5.945 1.00 0.00 C ATOM 1184 SG CYS B 143 95.633 -2.517 7.039 1.00 0.00 S ATOM 0 H CYS B 143 95.402 0.033 8.060 1.00 0.00 H new ATOM 0 HA CYS B 143 97.799 -0.570 6.436 1.00 0.00 H new ATOM 0 HB2 CYS B 143 94.767 -0.573 5.905 1.00 0.00 H new ATOM 0 HB3 CYS B 143 95.966 -1.397 4.929 1.00 0.00 H new ATOM 1189 N GLU B 144 96.218 2.191 5.990 1.00 0.00 N ATOM 1190 CA GLU B 144 96.242 3.441 5.176 1.00 0.00 C ATOM 1191 C GLU B 144 95.738 3.159 3.757 1.00 0.00 C ATOM 1192 O GLU B 144 96.001 3.904 2.834 1.00 0.00 O ATOM 1193 CB GLU B 144 97.709 3.871 5.149 1.00 0.00 C ATOM 1194 CG GLU B 144 98.278 3.832 6.569 1.00 0.00 C ATOM 1195 CD GLU B 144 99.540 4.695 6.637 1.00 0.00 C ATOM 1196 OE1 GLU B 144 99.404 5.897 6.794 1.00 0.00 O1- ATOM 1197 OE2 GLU B 144 100.621 4.138 6.529 1.00 0.00 O ATOM 0 H GLU B 144 95.672 2.243 6.850 1.00 0.00 H new ATOM 0 HA GLU B 144 95.599 4.216 5.593 1.00 0.00 H new ATOM 0 HB2 GLU B 144 98.281 3.210 4.498 1.00 0.00 H new ATOM 0 HB3 GLU B 144 97.797 4.877 4.738 1.00 0.00 H new ATOM 0 HG2 GLU B 144 97.536 4.197 7.280 1.00 0.00 H new ATOM 0 HG3 GLU B 144 98.511 2.805 6.851 1.00 0.00 H new ATOM 1204 N GLN B 145 95.012 2.089 3.576 1.00 0.00 N ATOM 1205 CA GLN B 145 94.491 1.760 2.219 1.00 0.00 C ATOM 1206 C GLN B 145 92.963 1.854 2.207 1.00 0.00 C ATOM 1207 O GLN B 145 92.327 1.898 3.242 1.00 0.00 O ATOM 1208 CB GLN B 145 94.946 0.323 1.959 1.00 0.00 C ATOM 1209 CG GLN B 145 96.393 0.331 1.464 1.00 0.00 C ATOM 1210 CD GLN B 145 96.821 -1.096 1.111 1.00 0.00 C ATOM 1211 OE1 GLN B 145 97.518 -1.310 0.139 1.00 0.00 O ATOM 1212 NE2 GLN B 145 96.431 -2.087 1.864 1.00 0.00 N ATOM 0 H GLN B 145 94.757 1.428 4.310 1.00 0.00 H new ATOM 0 HA GLN B 145 94.857 2.446 1.455 1.00 0.00 H new ATOM 0 HB2 GLN B 145 94.866 -0.267 2.872 1.00 0.00 H new ATOM 0 HB3 GLN B 145 94.299 -0.147 1.218 1.00 0.00 H new ATOM 0 HG2 GLN B 145 96.486 0.976 0.590 1.00 0.00 H new ATOM 0 HG3 GLN B 145 97.049 0.739 2.233 1.00 0.00 H new ATOM 0 HE21 GLN B 145 95.846 -1.908 2.680 1.00 0.00 H new ATOM 0 HE22 GLN B 145 96.711 -3.041 1.637 1.00 0.00 H new ATOM 1221 N LEU B 146 92.368 1.889 1.045 1.00 0.00 N ATOM 1222 CA LEU B 146 90.881 1.984 0.973 1.00 0.00 C ATOM 1223 C LEU B 146 90.269 0.594 0.782 1.00 0.00 C ATOM 1224 O LEU B 146 90.879 -0.289 0.212 1.00 0.00 O ATOM 1225 CB LEU B 146 90.598 2.866 -0.243 1.00 0.00 C ATOM 1226 CG LEU B 146 91.235 4.240 -0.036 1.00 0.00 C ATOM 1227 CD1 LEU B 146 92.472 4.368 -0.926 1.00 0.00 C ATOM 1228 CD2 LEU B 146 90.225 5.330 -0.404 1.00 0.00 C ATOM 0 H LEU B 146 92.846 1.856 0.144 1.00 0.00 H new ATOM 0 HA LEU B 146 90.450 2.397 1.885 1.00 0.00 H new ATOM 0 HB2 LEU B 146 90.997 2.400 -1.144 1.00 0.00 H new ATOM 0 HB3 LEU B 146 89.523 2.970 -0.388 1.00 0.00 H new ATOM 0 HG LEU B 146 91.527 4.352 1.008 1.00 0.00 H new ATOM 0 HD11 LEU B 146 92.926 5.348 -0.779 1.00 0.00 H new ATOM 0 HD12 LEU B 146 93.191 3.591 -0.664 1.00 0.00 H new ATOM 0 HD13 LEU B 146 92.182 4.256 -1.971 1.00 0.00 H new ATOM 0 HD21 LEU B 146 90.678 6.310 -0.257 1.00 0.00 H new ATOM 0 HD22 LEU B 146 89.933 5.218 -1.448 1.00 0.00 H new ATOM 0 HD23 LEU B 146 89.344 5.239 0.231 1.00 0.00 H new ATOM 1240 N LEU B 147 89.069 0.395 1.253 1.00 0.00 N ATOM 1241 CA LEU B 147 88.417 -0.937 1.099 1.00 0.00 C ATOM 1242 C LEU B 147 86.922 -0.760 0.824 1.00 0.00 C ATOM 1243 O LEU B 147 86.241 -0.016 1.503 1.00 0.00 O ATOM 1244 CB LEU B 147 88.636 -1.645 2.437 1.00 0.00 C ATOM 1245 CG LEU B 147 90.132 -1.886 2.649 1.00 0.00 C ATOM 1246 CD1 LEU B 147 90.702 -0.788 3.549 1.00 0.00 C ATOM 1247 CD2 LEU B 147 90.341 -3.248 3.314 1.00 0.00 C ATOM 0 H LEU B 147 88.511 1.097 1.738 1.00 0.00 H new ATOM 0 HA LEU B 147 88.830 -1.506 0.267 1.00 0.00 H new ATOM 0 HB2 LEU B 147 88.236 -1.040 3.250 1.00 0.00 H new ATOM 0 HB3 LEU B 147 88.099 -2.593 2.451 1.00 0.00 H new ATOM 0 HG LEU B 147 90.642 -1.870 1.686 1.00 0.00 H new ATOM 0 HD11 LEU B 147 91.768 -0.959 3.701 1.00 0.00 H new ATOM 0 HD12 LEU B 147 90.554 0.183 3.077 1.00 0.00 H new ATOM 0 HD13 LEU B 147 90.191 -0.805 4.512 1.00 0.00 H new ATOM 0 HD21 LEU B 147 91.407 -3.419 3.465 1.00 0.00 H new ATOM 0 HD22 LEU B 147 89.831 -3.265 4.277 1.00 0.00 H new ATOM 0 HD23 LEU B 147 89.934 -4.031 2.674 1.00 0.00 H new ATOM 1259 N CYS B 148 86.405 -1.437 -0.164 1.00 0.00 N ATOM 1260 CA CYS B 148 84.954 -1.307 -0.479 1.00 0.00 C ATOM 1261 C CYS B 148 84.121 -2.068 0.555 1.00 0.00 C ATOM 1262 O CYS B 148 84.646 -2.807 1.363 1.00 0.00 O ATOM 1263 CB CYS B 148 84.793 -1.931 -1.864 1.00 0.00 C ATOM 1264 SG CYS B 148 85.122 -3.708 -1.767 1.00 0.00 S ATOM 0 H CYS B 148 86.925 -2.075 -0.767 1.00 0.00 H new ATOM 0 HA CYS B 148 84.616 -0.271 -0.458 1.00 0.00 H new ATOM 0 HB2 CYS B 148 83.784 -1.757 -2.238 1.00 0.00 H new ATOM 0 HB3 CYS B 148 85.479 -1.461 -2.568 1.00 0.00 H new ATOM 1269 N ALA B 149 82.828 -1.895 0.536 1.00 0.00 N ATOM 1270 CA ALA B 149 81.967 -2.612 1.519 1.00 0.00 C ATOM 1271 C ALA B 149 82.315 -4.103 1.533 1.00 0.00 C ATOM 1272 O ALA B 149 82.225 -4.763 2.549 1.00 0.00 O ATOM 1273 CB ALA B 149 80.537 -2.400 1.024 1.00 0.00 C ATOM 0 H ALA B 149 82.331 -1.289 -0.117 1.00 0.00 H new ATOM 0 HA ALA B 149 82.104 -2.243 2.535 1.00 0.00 H new ATOM 0 HB1 ALA B 149 79.841 -2.900 1.698 1.00 0.00 H new ATOM 0 HB2 ALA B 149 80.315 -1.333 0.999 1.00 0.00 H new ATOM 0 HB3 ALA B 149 80.434 -2.816 0.022 1.00 0.00 H new ATOM 1279 N LYS B 150 82.711 -4.639 0.411 1.00 0.00 N ATOM 1280 CA LYS B 150 83.065 -6.087 0.358 1.00 0.00 C ATOM 1281 C LYS B 150 84.435 -6.326 1.000 1.00 0.00 C ATOM 1282 O LYS B 150 84.757 -7.426 1.402 1.00 0.00 O ATOM 1283 CB LYS B 150 83.104 -6.429 -1.132 1.00 0.00 C ATOM 1284 CG LYS B 150 82.515 -7.824 -1.351 1.00 0.00 C ATOM 1285 CD LYS B 150 83.446 -8.633 -2.257 1.00 0.00 C ATOM 1286 CE LYS B 150 82.923 -8.591 -3.694 1.00 0.00 C ATOM 1287 NZ LYS B 150 83.936 -9.341 -4.489 1.00 0.00 N1+ ATOM 0 H LYS B 150 82.805 -4.137 -0.472 1.00 0.00 H new ATOM 0 HA LYS B 150 82.351 -6.705 0.902 1.00 0.00 H new ATOM 0 HB2 LYS B 150 82.539 -5.691 -1.700 1.00 0.00 H new ATOM 0 HB3 LYS B 150 84.130 -6.395 -1.497 1.00 0.00 H new ATOM 0 HG2 LYS B 150 82.389 -8.332 -0.395 1.00 0.00 H new ATOM 0 HG3 LYS B 150 81.526 -7.746 -1.804 1.00 0.00 H new ATOM 0 HD2 LYS B 150 84.456 -8.226 -2.214 1.00 0.00 H new ATOM 0 HD3 LYS B 150 83.503 -9.665 -1.909 1.00 0.00 H new ATOM 0 HE2 LYS B 150 81.939 -9.053 -3.771 1.00 0.00 H new ATOM 0 HE3 LYS B 150 82.822 -7.565 -4.049 1.00 0.00 H new ATOM 0 HZ1 LYS B 150 83.650 -9.358 -5.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 150 84.861 -8.874 -4.402 1.00 0.00 H new ATOM 0 HZ3 LYS B 150 84.005 -10.315 -4.132 1.00 0.00 H new ATOM 1301 N CYS B 151 85.245 -5.306 1.095 1.00 0.00 N ATOM 1302 CA CYS B 151 86.593 -5.481 1.708 1.00 0.00 C ATOM 1303 C CYS B 151 86.604 -4.935 3.139 1.00 0.00 C ATOM 1304 O CYS B 151 87.166 -5.531 4.037 1.00 0.00 O ATOM 1305 CB CYS B 151 87.540 -4.674 0.818 1.00 0.00 C ATOM 1306 SG CYS B 151 87.702 -5.491 -0.789 1.00 0.00 S ATOM 0 H CYS B 151 85.032 -4.361 0.775 1.00 0.00 H new ATOM 0 HA CYS B 151 86.884 -6.530 1.769 1.00 0.00 H new ATOM 0 HB2 CYS B 151 87.158 -3.662 0.686 1.00 0.00 H new ATOM 0 HB3 CYS B 151 88.517 -4.587 1.294 1.00 0.00 H new ATOM 1311 N PHE B 152 85.986 -3.808 3.359 1.00 0.00 N ATOM 1312 CA PHE B 152 85.961 -3.225 4.732 1.00 0.00 C ATOM 1313 C PHE B 152 85.209 -4.155 5.688 1.00 0.00 C ATOM 1314 O PHE B 152 85.731 -4.571 6.706 1.00 0.00 O ATOM 1315 CB PHE B 152 85.219 -1.897 4.584 1.00 0.00 C ATOM 1316 CG PHE B 152 84.618 -1.504 5.912 1.00 0.00 C ATOM 1317 CD1 PHE B 152 85.432 -1.405 7.046 1.00 0.00 C ATOM 1318 CD2 PHE B 152 83.246 -1.241 6.009 1.00 0.00 C ATOM 1319 CE1 PHE B 152 84.874 -1.041 8.277 1.00 0.00 C ATOM 1320 CE2 PHE B 152 82.689 -0.877 7.239 1.00 0.00 C ATOM 1321 CZ PHE B 152 83.503 -0.777 8.375 1.00 0.00 C ATOM 0 H PHE B 152 85.497 -3.264 2.648 1.00 0.00 H new ATOM 0 HA PHE B 152 86.962 -3.090 5.142 1.00 0.00 H new ATOM 0 HB2 PHE B 152 85.904 -1.122 4.239 1.00 0.00 H new ATOM 0 HB3 PHE B 152 84.436 -1.988 3.831 1.00 0.00 H new ATOM 0 HD1 PHE B 152 86.490 -1.609 6.971 1.00 0.00 H new ATOM 0 HD2 PHE B 152 82.618 -1.319 5.134 1.00 0.00 H new ATOM 0 HE1 PHE B 152 85.502 -0.964 9.152 1.00 0.00 H new ATOM 0 HE2 PHE B 152 81.631 -0.673 7.313 1.00 0.00 H new ATOM 0 HZ PHE B 152 83.073 -0.497 9.325 1.00 0.00 H new ATOM 1331 N GLU B 153 83.988 -4.484 5.370 1.00 0.00 N ATOM 1332 CA GLU B 153 83.205 -5.387 6.260 1.00 0.00 C ATOM 1333 C GLU B 153 83.941 -6.716 6.439 1.00 0.00 C ATOM 1334 O GLU B 153 84.038 -7.241 7.529 1.00 0.00 O ATOM 1335 CB GLU B 153 81.874 -5.597 5.538 1.00 0.00 C ATOM 1336 CG GLU B 153 80.997 -4.356 5.715 1.00 0.00 C ATOM 1337 CD GLU B 153 80.089 -4.544 6.933 1.00 0.00 C ATOM 1338 OE1 GLU B 153 80.548 -4.288 8.034 1.00 0.00 O1- ATOM 1339 OE2 GLU B 153 78.951 -4.939 6.744 1.00 0.00 O ATOM 0 H GLU B 153 83.498 -4.167 4.533 1.00 0.00 H new ATOM 0 HA GLU B 153 83.063 -4.968 7.256 1.00 0.00 H new ATOM 0 HB2 GLU B 153 82.048 -5.784 4.478 1.00 0.00 H new ATOM 0 HB3 GLU B 153 81.366 -6.475 5.937 1.00 0.00 H new ATOM 0 HG2 GLU B 153 81.621 -3.472 5.846 1.00 0.00 H new ATOM 0 HG3 GLU B 153 80.395 -4.192 4.821 1.00 0.00 H new ATOM 1346 N ALA B 154 84.465 -7.262 5.375 1.00 0.00 N ATOM 1347 CA ALA B 154 85.198 -8.555 5.488 1.00 0.00 C ATOM 1348 C ALA B 154 86.336 -8.425 6.502 1.00 0.00 C ATOM 1349 O ALA B 154 86.544 -9.288 7.331 1.00 0.00 O ATOM 1350 CB ALA B 154 85.751 -8.821 4.088 1.00 0.00 C ATOM 0 H ALA B 154 84.417 -6.870 4.435 1.00 0.00 H new ATOM 0 HA ALA B 154 84.557 -9.367 5.831 1.00 0.00 H new ATOM 0 HB1 ALA B 154 86.306 -9.759 4.088 1.00 0.00 H new ATOM 0 HB2 ALA B 154 84.927 -8.887 3.378 1.00 0.00 H new ATOM 0 HB3 ALA B 154 86.415 -8.007 3.798 1.00 0.00 H new ATOM 1356 N HIS B 155 87.076 -7.350 6.443 1.00 0.00 N ATOM 1357 CA HIS B 155 88.201 -7.162 7.404 1.00 0.00 C ATOM 1358 C HIS B 155 87.674 -7.172 8.842 1.00 0.00 C ATOM 1359 O HIS B 155 88.135 -7.925 9.679 1.00 0.00 O ATOM 1360 CB HIS B 155 88.792 -5.796 7.057 1.00 0.00 C ATOM 1361 CG HIS B 155 90.278 -5.820 7.287 1.00 0.00 C ATOM 1362 ND1 HIS B 155 91.308 -5.123 6.705 1.00 0.00 N flip ATOM 1363 CD2 HIS B 155 90.867 -6.647 8.231 1.00 0.00 C flip ATOM 1364 CE1 HIS B 155 92.517 -5.509 7.277 1.00 0.00 C flip ATOM 1365 NE2 HIS B 155 92.194 -6.429 8.189 1.00 0.00 N flip ATOM 0 H HIS B 155 86.950 -6.594 5.770 1.00 0.00 H new ATOM 0 HA HIS B 155 88.944 -7.957 7.334 1.00 0.00 H new ATOM 0 HB2 HIS B 155 88.578 -5.549 6.017 1.00 0.00 H new ATOM 0 HB3 HIS B 155 88.331 -5.022 7.670 1.00 0.00 H new ATOM 0 HD1 HIS B 155 91.203 -4.428 5.966 1.00 0.00 H new ATOM 0 HD2 HIS B 155 90.354 -7.340 8.882 1.00 0.00 H new ATOM 0 HE1 HIS B 155 93.504 -5.143 7.035 1.00 0.00 H new ATOM 1373 N GLN B 156 86.711 -6.341 9.136 1.00 0.00 N ATOM 1374 CA GLN B 156 86.153 -6.303 10.519 1.00 0.00 C ATOM 1375 C GLN B 156 85.652 -7.691 10.929 1.00 0.00 C ATOM 1376 O GLN B 156 85.492 -7.982 12.098 1.00 0.00 O ATOM 1377 CB GLN B 156 84.991 -5.312 10.452 1.00 0.00 C ATOM 1378 CG GLN B 156 85.141 -4.274 11.565 1.00 0.00 C ATOM 1379 CD GLN B 156 83.889 -3.396 11.617 1.00 0.00 C ATOM 1380 OE1 GLN B 156 82.850 -3.824 12.079 1.00 0.00 O ATOM 1381 NE2 GLN B 156 83.944 -2.175 11.159 1.00 0.00 N ATOM 0 H GLN B 156 86.286 -5.687 8.479 1.00 0.00 H new ATOM 0 HA GLN B 156 86.900 -6.006 11.255 1.00 0.00 H new ATOM 0 HB2 GLN B 156 84.975 -4.819 9.480 1.00 0.00 H new ATOM 0 HB3 GLN B 156 84.043 -5.839 10.557 1.00 0.00 H new ATOM 0 HG2 GLN B 156 85.289 -4.772 12.523 1.00 0.00 H new ATOM 0 HG3 GLN B 156 86.023 -3.658 11.386 1.00 0.00 H new ATOM 0 HE21 GLN B 156 84.816 -1.815 10.771 1.00 0.00 H new ATOM 0 HE22 GLN B 156 83.115 -1.581 11.189 1.00 0.00 H new ATOM 1390 N TRP B 157 85.406 -8.550 9.978 1.00 0.00 N ATOM 1391 CA TRP B 157 84.919 -9.916 10.318 1.00 0.00 C ATOM 1392 C TRP B 157 86.074 -10.917 10.243 1.00 0.00 C ATOM 1393 O TRP B 157 86.083 -11.923 10.926 1.00 0.00 O ATOM 1394 CB TRP B 157 83.860 -10.234 9.263 1.00 0.00 C ATOM 1395 CG TRP B 157 82.600 -10.671 9.939 1.00 0.00 C ATOM 1396 CD1 TRP B 157 81.439 -9.978 9.938 1.00 0.00 C ATOM 1397 CD2 TRP B 157 82.355 -11.881 10.713 1.00 0.00 C ATOM 1398 NE1 TRP B 157 80.496 -10.686 10.662 1.00 0.00 N ATOM 1399 CE2 TRP B 157 81.012 -11.865 11.160 1.00 0.00 C ATOM 1400 CE3 TRP B 157 83.159 -12.979 11.068 1.00 0.00 C ATOM 1401 CZ2 TRP B 157 80.486 -12.903 11.930 1.00 0.00 C ATOM 1402 CZ3 TRP B 157 82.633 -14.024 11.844 1.00 0.00 C ATOM 1403 CH2 TRP B 157 81.299 -13.987 12.274 1.00 0.00 C ATOM 0 H TRP B 157 85.521 -8.365 8.982 1.00 0.00 H new ATOM 0 HA TRP B 157 84.513 -9.973 11.328 1.00 0.00 H new ATOM 0 HB2 TRP B 157 83.669 -9.355 8.647 1.00 0.00 H new ATOM 0 HB3 TRP B 157 84.219 -11.018 8.597 1.00 0.00 H new ATOM 0 HD1 TRP B 157 81.275 -9.028 9.452 1.00 0.00 H new ATOM 0 HE1 TRP B 157 79.536 -10.374 10.810 1.00 0.00 H new ATOM 0 HE3 TRP B 157 84.188 -13.018 10.742 1.00 0.00 H new ATOM 0 HZ2 TRP B 157 79.458 -12.869 12.258 1.00 0.00 H new ATOM 0 HZ3 TRP B 157 83.260 -14.862 12.111 1.00 0.00 H new ATOM 0 HH2 TRP B 157 80.900 -14.795 12.870 1.00 0.00 H new ATOM 1414 N PHE B 158 87.051 -10.647 9.421 1.00 0.00 N ATOM 1415 CA PHE B 158 88.207 -11.581 9.307 1.00 0.00 C ATOM 1416 C PHE B 158 89.067 -11.510 10.570 1.00 0.00 C ATOM 1417 O PHE B 158 89.824 -12.412 10.866 1.00 0.00 O ATOM 1418 CB PHE B 158 88.997 -11.093 8.092 1.00 0.00 C ATOM 1419 CG PHE B 158 89.524 -12.281 7.324 1.00 0.00 C ATOM 1420 CD1 PHE B 158 90.458 -13.138 7.916 1.00 0.00 C ATOM 1421 CD2 PHE B 158 89.079 -12.525 6.018 1.00 0.00 C ATOM 1422 CE1 PHE B 158 90.948 -14.240 7.204 1.00 0.00 C ATOM 1423 CE2 PHE B 158 89.569 -13.627 5.306 1.00 0.00 C ATOM 1424 CZ PHE B 158 90.503 -14.484 5.899 1.00 0.00 C ATOM 0 H PHE B 158 87.099 -9.821 8.824 1.00 0.00 H new ATOM 0 HA PHE B 158 87.890 -12.618 9.195 1.00 0.00 H new ATOM 0 HB2 PHE B 158 88.359 -10.485 7.450 1.00 0.00 H new ATOM 0 HB3 PHE B 158 89.823 -10.458 8.413 1.00 0.00 H new ATOM 0 HD1 PHE B 158 90.801 -12.950 8.923 1.00 0.00 H new ATOM 0 HD2 PHE B 158 88.358 -11.863 5.560 1.00 0.00 H new ATOM 0 HE1 PHE B 158 91.669 -14.901 7.661 1.00 0.00 H new ATOM 0 HE2 PHE B 158 89.226 -13.815 4.299 1.00 0.00 H new ATOM 0 HZ PHE B 158 90.881 -15.334 5.350 1.00 0.00 H new ATOM 1434 N LEU B 159 88.960 -10.442 11.311 1.00 0.00 N ATOM 1435 CA LEU B 159 89.779 -10.312 12.548 1.00 0.00 C ATOM 1436 C LEU B 159 89.377 -9.040 13.306 1.00 0.00 C ATOM 1437 O LEU B 159 88.209 -8.715 13.405 1.00 0.00 O ATOM 1438 CB LEU B 159 91.213 -10.227 12.035 1.00 0.00 C ATOM 1439 CG LEU B 159 91.316 -9.048 11.075 1.00 0.00 C ATOM 1440 CD1 LEU B 159 92.356 -8.051 11.589 1.00 0.00 C ATOM 1441 CD2 LEU B 159 91.729 -9.562 9.702 1.00 0.00 C ATOM 0 H LEU B 159 88.342 -9.655 11.114 1.00 0.00 H new ATOM 0 HA LEU B 159 89.646 -11.139 13.246 1.00 0.00 H new ATOM 0 HB2 LEU B 159 91.906 -10.099 12.867 1.00 0.00 H new ATOM 0 HB3 LEU B 159 91.489 -11.152 11.529 1.00 0.00 H new ATOM 0 HG LEU B 159 90.351 -8.546 11.004 1.00 0.00 H new ATOM 0 HD11 LEU B 159 92.426 -7.210 10.899 1.00 0.00 H new ATOM 0 HD12 LEU B 159 92.058 -7.689 12.573 1.00 0.00 H new ATOM 0 HD13 LEU B 159 93.326 -8.542 11.662 1.00 0.00 H new ATOM 0 HD21 LEU B 159 91.805 -8.725 9.008 1.00 0.00 H new ATOM 0 HD22 LEU B 159 92.695 -10.061 9.776 1.00 0.00 H new ATOM 0 HD23 LEU B 159 90.983 -10.268 9.338 1.00 0.00 H new ATOM 1453 N LYS B 160 90.323 -8.317 13.840 1.00 0.00 N ATOM 1454 CA LYS B 160 89.980 -7.070 14.583 1.00 0.00 C ATOM 1455 C LYS B 160 90.646 -5.866 13.914 1.00 0.00 C ATOM 1456 O LYS B 160 91.846 -5.687 13.993 1.00 0.00 O ATOM 1457 CB LYS B 160 90.537 -7.282 15.990 1.00 0.00 C ATOM 1458 CG LYS B 160 89.919 -8.542 16.599 1.00 0.00 C ATOM 1459 CD LYS B 160 89.512 -8.261 18.047 1.00 0.00 C ATOM 1460 CE LYS B 160 90.745 -7.848 18.851 1.00 0.00 C ATOM 1461 NZ LYS B 160 90.404 -8.171 20.266 1.00 0.00 N1+ ATOM 0 H LYS B 160 91.318 -8.535 13.794 1.00 0.00 H new ATOM 0 HA LYS B 160 88.908 -6.874 14.598 1.00 0.00 H new ATOM 0 HB2 LYS B 160 91.622 -7.378 15.952 1.00 0.00 H new ATOM 0 HB3 LYS B 160 90.315 -6.417 16.615 1.00 0.00 H new ATOM 0 HG2 LYS B 160 89.049 -8.851 16.019 1.00 0.00 H new ATOM 0 HG3 LYS B 160 90.634 -9.364 16.564 1.00 0.00 H new ATOM 0 HD2 LYS B 160 88.762 -7.470 18.079 1.00 0.00 H new ATOM 0 HD3 LYS B 160 89.058 -9.149 18.487 1.00 0.00 H new ATOM 0 HE2 LYS B 160 91.631 -8.392 18.524 1.00 0.00 H new ATOM 0 HE3 LYS B 160 90.960 -6.786 18.728 1.00 0.00 H new ATOM 0 HZ1 LYS B 160 91.202 -7.916 20.882 1.00 0.00 H new ATOM 0 HZ2 LYS B 160 89.561 -7.633 20.551 1.00 0.00 H new ATOM 0 HZ3 LYS B 160 90.211 -9.189 20.353 1.00 0.00 H new ATOM 1475 N HIS B 161 89.882 -5.043 13.251 1.00 0.00 N ATOM 1476 CA HIS B 161 90.482 -3.857 12.574 1.00 0.00 C ATOM 1477 C HIS B 161 89.594 -2.626 12.763 1.00 0.00 C ATOM 1478 O HIS B 161 88.390 -2.729 12.896 1.00 0.00 O ATOM 1479 CB HIS B 161 90.552 -4.243 11.097 1.00 0.00 C ATOM 1480 CG HIS B 161 91.816 -3.694 10.494 1.00 0.00 C ATOM 1481 ND1 HIS B 161 92.963 -4.459 10.363 1.00 0.00 N ATOM 1482 CD2 HIS B 161 92.127 -2.459 9.982 1.00 0.00 C ATOM 1483 CE1 HIS B 161 93.903 -3.684 9.792 1.00 0.00 C ATOM 1484 NE2 HIS B 161 93.445 -2.455 9.539 1.00 0.00 N ATOM 0 H HIS B 161 88.872 -5.139 13.148 1.00 0.00 H new ATOM 0 HA HIS B 161 91.461 -3.603 12.981 1.00 0.00 H new ATOM 0 HB2 HIS B 161 90.528 -5.328 10.992 1.00 0.00 H new ATOM 0 HB3 HIS B 161 89.684 -3.852 10.566 1.00 0.00 H new ATOM 0 HD2 HIS B 161 91.451 -1.618 9.931 1.00 0.00 H new ATOM 0 HE1 HIS B 161 94.906 -4.015 9.566 1.00 0.00 H new ATOM 0 HE2 HIS B 161 93.953 -1.680 9.112 1.00 0.00 H new ATOM 1492 N GLU B 162 90.179 -1.460 12.772 1.00 0.00 N ATOM 1493 CA GLU B 162 89.371 -0.221 12.946 1.00 0.00 C ATOM 1494 C GLU B 162 89.555 0.700 11.737 1.00 0.00 C ATOM 1495 O GLU B 162 90.595 1.300 11.555 1.00 0.00 O ATOM 1496 CB GLU B 162 89.919 0.439 14.213 1.00 0.00 C ATOM 1497 CG GLU B 162 88.779 1.139 14.955 1.00 0.00 C ATOM 1498 CD GLU B 162 89.025 1.059 16.463 1.00 0.00 C ATOM 1499 OE1 GLU B 162 90.158 0.819 16.846 1.00 0.00 O ATOM 1500 OE2 GLU B 162 88.076 1.241 17.209 1.00 0.00 O1- ATOM 0 H GLU B 162 91.183 -1.312 12.666 1.00 0.00 H new ATOM 0 HA GLU B 162 88.305 -0.431 13.028 1.00 0.00 H new ATOM 0 HB2 GLU B 162 90.380 -0.310 14.856 1.00 0.00 H new ATOM 0 HB3 GLU B 162 90.696 1.159 13.955 1.00 0.00 H new ATOM 0 HG2 GLU B 162 88.713 2.181 14.642 1.00 0.00 H new ATOM 0 HG3 GLU B 162 87.827 0.670 14.706 1.00 0.00 H new ATOM 1507 N ALA B 163 88.554 0.813 10.909 1.00 0.00 N ATOM 1508 CA ALA B 163 88.673 1.693 9.711 1.00 0.00 C ATOM 1509 C ALA B 163 87.757 2.910 9.860 1.00 0.00 C ATOM 1510 O ALA B 163 86.667 2.819 10.387 1.00 0.00 O ATOM 1511 CB ALA B 163 88.223 0.824 8.536 1.00 0.00 C ATOM 0 H ALA B 163 87.659 0.335 11.009 1.00 0.00 H new ATOM 0 HA ALA B 163 89.686 2.071 9.573 1.00 0.00 H new ATOM 0 HB1 ALA B 163 88.282 1.401 7.613 1.00 0.00 H new ATOM 0 HB2 ALA B 163 88.871 -0.049 8.460 1.00 0.00 H new ATOM 0 HB3 ALA B 163 87.195 0.500 8.696 1.00 0.00 H new ATOM 1517 N ARG B 164 88.192 4.051 9.400 1.00 0.00 N ATOM 1518 CA ARG B 164 87.344 5.271 9.518 1.00 0.00 C ATOM 1519 C ARG B 164 86.669 5.579 8.178 1.00 0.00 C ATOM 1520 O ARG B 164 87.095 5.104 7.144 1.00 0.00 O ATOM 1521 CB ARG B 164 88.310 6.392 9.902 1.00 0.00 C ATOM 1522 CG ARG B 164 88.729 6.224 11.364 1.00 0.00 C ATOM 1523 CD ARG B 164 87.549 6.570 12.275 1.00 0.00 C ATOM 1524 NE ARG B 164 88.161 6.829 13.610 1.00 0.00 N ATOM 1525 CZ ARG B 164 87.467 7.421 14.542 1.00 0.00 C ATOM 1526 NH1 ARG B 164 87.189 8.692 14.441 1.00 0.00 N ATOM 1527 NH2 ARG B 164 87.052 6.741 15.575 1.00 0.00 N1+ ATOM 0 H ARG B 164 89.096 4.191 8.949 1.00 0.00 H new ATOM 0 HA ARG B 164 86.549 5.150 10.253 1.00 0.00 H new ATOM 0 HB2 ARG B 164 89.187 6.368 9.256 1.00 0.00 H new ATOM 0 HB3 ARG B 164 87.834 7.362 9.758 1.00 0.00 H new ATOM 0 HG2 ARG B 164 89.054 5.199 11.545 1.00 0.00 H new ATOM 0 HG3 ARG B 164 89.577 6.872 11.587 1.00 0.00 H new ATOM 0 HD2 ARG B 164 87.011 7.445 11.910 1.00 0.00 H new ATOM 0 HD3 ARG B 164 86.831 5.751 12.321 1.00 0.00 H new ATOM 0 HE ARG B 164 89.123 6.543 13.794 1.00 0.00 H new ATOM 0 HH11 ARG B 164 87.515 9.223 13.633 1.00 0.00 H new ATOM 0 HH12 ARG B 164 86.646 9.155 15.170 1.00 0.00 H new ATOM 0 HH21 ARG B 164 87.270 5.748 15.653 1.00 0.00 H new ATOM 0 HH22 ARG B 164 86.509 7.203 16.305 1.00 0.00 H new ATOM 1541 N PRO B 165 85.633 6.368 8.247 1.00 0.00 N ATOM 1542 CA PRO B 165 84.881 6.751 7.026 1.00 0.00 C ATOM 1543 C PRO B 165 85.699 7.729 6.178 1.00 0.00 C ATOM 1544 O PRO B 165 86.540 8.449 6.681 1.00 0.00 O ATOM 1545 CB PRO B 165 83.627 7.424 7.576 1.00 0.00 C ATOM 1546 CG PRO B 165 84.016 7.916 8.935 1.00 0.00 C ATOM 1547 CD PRO B 165 85.069 6.974 9.458 1.00 0.00 C ATOM 0 HA PRO B 165 84.655 5.904 6.378 1.00 0.00 H new ATOM 0 HB2 PRO B 165 83.307 8.246 6.935 1.00 0.00 H new ATOM 0 HB3 PRO B 165 82.795 6.722 7.634 1.00 0.00 H new ATOM 0 HG2 PRO B 165 84.401 8.934 8.881 1.00 0.00 H new ATOM 0 HG3 PRO B 165 83.152 7.937 9.600 1.00 0.00 H new ATOM 0 HD2 PRO B 165 85.830 7.504 10.031 1.00 0.00 H new ATOM 0 HD3 PRO B 165 84.639 6.221 10.119 1.00 0.00 H new ATOM 1555 N LEU B 166 85.459 7.762 4.896 1.00 0.00 N ATOM 1556 CA LEU B 166 86.224 8.693 4.016 1.00 0.00 C ATOM 1557 C LEU B 166 85.570 10.080 4.012 1.00 0.00 C ATOM 1558 O LEU B 166 86.170 11.055 3.602 1.00 0.00 O ATOM 1559 CB LEU B 166 86.159 8.066 2.623 1.00 0.00 C ATOM 1560 CG LEU B 166 87.045 6.820 2.581 1.00 0.00 C ATOM 1561 CD1 LEU B 166 86.914 6.146 1.213 1.00 0.00 C ATOM 1562 CD2 LEU B 166 88.503 7.221 2.813 1.00 0.00 C ATOM 0 H LEU B 166 84.766 7.185 4.419 1.00 0.00 H new ATOM 0 HA LEU B 166 87.251 8.829 4.355 1.00 0.00 H new ATOM 0 HB2 LEU B 166 85.130 7.802 2.380 1.00 0.00 H new ATOM 0 HB3 LEU B 166 86.489 8.785 1.873 1.00 0.00 H new ATOM 0 HG LEU B 166 86.731 6.126 3.360 1.00 0.00 H new ATOM 0 HD11 LEU B 166 87.545 5.258 1.183 1.00 0.00 H new ATOM 0 HD12 LEU B 166 85.876 5.859 1.047 1.00 0.00 H new ATOM 0 HD13 LEU B 166 87.227 6.841 0.434 1.00 0.00 H new ATOM 0 HD21 LEU B 166 89.134 6.333 2.783 1.00 0.00 H new ATOM 0 HD22 LEU B 166 88.818 7.916 2.034 1.00 0.00 H new ATOM 0 HD23 LEU B 166 88.598 7.701 3.787 1.00 0.00 H new ATOM 1574 N ALA B 167 84.348 10.177 4.461 1.00 0.00 N ATOM 1575 CA ALA B 167 83.662 11.501 4.480 1.00 0.00 C ATOM 1576 C ALA B 167 84.537 12.542 5.184 1.00 0.00 C ATOM 1577 O ALA B 167 85.622 12.247 5.643 1.00 0.00 O ATOM 1578 CB ALA B 167 82.372 11.266 5.265 1.00 0.00 C ATOM 0 H ALA B 167 83.795 9.397 4.816 1.00 0.00 H new ATOM 0 HA ALA B 167 83.466 11.879 3.477 1.00 0.00 H new ATOM 0 HB1 ALA B 167 81.808 12.197 5.324 1.00 0.00 H new ATOM 0 HB2 ALA B 167 81.772 10.509 4.760 1.00 0.00 H new ATOM 0 HB3 ALA B 167 82.615 10.925 6.271 1.00 0.00 H new ATOM 1584 N GLU B 168 84.071 13.757 5.273 1.00 0.00 N ATOM 1585 CA GLU B 168 84.876 14.816 5.948 1.00 0.00 C ATOM 1586 C GLU B 168 83.953 15.849 6.599 1.00 0.00 C ATOM 1587 O GLU B 168 83.728 16.881 5.988 1.00 0.00 O ATOM 1588 CB GLU B 168 85.700 15.458 4.832 1.00 0.00 C ATOM 1589 CG GLU B 168 87.080 14.802 4.773 1.00 0.00 C ATOM 1590 CD GLU B 168 87.974 15.580 3.806 1.00 0.00 C ATOM 1591 OE1 GLU B 168 87.915 15.302 2.620 1.00 0.00 O ATOM 1592 OE2 GLU B 168 88.704 16.442 4.268 1.00 0.00 O1- ATOM 1593 OXT GLU B 168 83.488 15.591 7.697 1.00 0.00 O ATOM 0 H GLU B 168 83.169 14.063 4.908 1.00 0.00 H new ATOM 0 HA GLU B 168 85.507 14.413 6.740 1.00 0.00 H new ATOM 0 HB2 GLU B 168 85.189 15.342 3.876 1.00 0.00 H new ATOM 0 HB3 GLU B 168 85.802 16.528 5.011 1.00 0.00 H new ATOM 0 HG2 GLU B 168 87.529 14.785 5.766 1.00 0.00 H new ATOM 0 HG3 GLU B 168 86.988 13.766 4.447 1.00 0.00 H new TER 1600 GLU B 168 HETATM 1601 ZN ZN A 201 74.712 6.541 0.907 1.00 0.00 ZN HETATM 1602 ZN ZN A 202 66.265 -1.208 4.216 1.00 0.00 ZN HETATM 1603 ZN ZN B 201 87.389 -3.897 -2.808 1.00 0.00 ZN HETATM 1604 ZN ZN B 202 93.146 -3.197 7.401 1.00 0.00 ZN