USER MOD reduce.3.24.130724 H: found=0, std=0, add=532, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 531 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 133 GLN : amide:sc= 0.177 K(o=-2.5,f=-4.2) USER MOD Set 1.2: A 135 HIS : no HD1:sc= -2.67! K(o=-2.5!,f=-3.2) USER MOD Single : A 103 SER OG : rot 180:sc= -0.0122 USER MOD Single : A 104 SER OG : rot 45:sc= 0.28 USER MOD Single : A 106 SER OG : rot 38:sc= 0.864 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 161:sc= -1.68 (180deg=-3.02!) USER MOD Single : A 122 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.15) USER MOD Single : A 123 HIS : no HD1:sc= -2.27 K(o=-2.3,f=-4.6!) USER MOD Single : A 125 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 THR OG1 : rot 180:sc= -1 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 159 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 163 SER OG : rot 58:sc= 0.607 USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 171 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 102 10.082 20.083 -9.861 1.00 0.00 N ATOM 2 CA GLY A 102 10.979 20.433 -8.776 1.00 0.00 C ATOM 3 C GLY A 102 10.977 19.402 -7.666 1.00 0.00 C ATOM 4 O GLY A 102 10.095 19.405 -6.807 1.00 0.00 O ATOM 0 HA2 GLY A 102 11.991 20.540 -9.166 1.00 0.00 H new ATOM 0 HA3 GLY A 102 10.690 21.402 -8.368 1.00 0.00 H new ATOM 8 N SER A 103 11.966 18.515 -7.683 1.00 0.00 N ATOM 9 CA SER A 103 12.073 17.468 -6.673 1.00 0.00 C ATOM 10 C SER A 103 11.688 18.001 -5.297 1.00 0.00 C ATOM 11 O SER A 103 10.866 17.408 -4.596 1.00 0.00 O ATOM 12 CB SER A 103 13.496 16.908 -6.636 1.00 0.00 C ATOM 13 OG SER A 103 14.448 17.946 -6.482 1.00 0.00 O ATOM 0 H SER A 103 12.705 18.500 -8.385 1.00 0.00 H new ATOM 0 HA SER A 103 11.383 16.668 -6.940 1.00 0.00 H new ATOM 0 HB2 SER A 103 13.590 16.199 -5.813 1.00 0.00 H new ATOM 0 HB3 SER A 103 13.698 16.358 -7.555 1.00 0.00 H new ATOM 0 HG SER A 103 15.350 17.562 -6.459 1.00 0.00 H new ATOM 19 N SER A 104 12.288 19.123 -4.914 1.00 0.00 N ATOM 20 CA SER A 104 12.012 19.735 -3.620 1.00 0.00 C ATOM 21 C SER A 104 10.524 19.661 -3.290 1.00 0.00 C ATOM 22 O SER A 104 9.696 20.268 -3.966 1.00 0.00 O ATOM 23 CB SER A 104 12.476 21.193 -3.612 1.00 0.00 C ATOM 24 OG SER A 104 11.928 21.908 -4.705 1.00 0.00 O ATOM 0 H SER A 104 12.969 19.627 -5.482 1.00 0.00 H new ATOM 0 HA SER A 104 12.563 19.182 -2.859 1.00 0.00 H new ATOM 0 HB2 SER A 104 12.178 21.668 -2.677 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.564 21.232 -3.657 1.00 0.00 H new ATOM 0 HG SER A 104 10.976 21.694 -4.792 1.00 0.00 H new ATOM 30 N GLY A 105 10.193 18.910 -2.243 1.00 0.00 N ATOM 31 CA GLY A 105 8.805 18.770 -1.840 1.00 0.00 C ATOM 32 C GLY A 105 8.163 17.517 -2.403 1.00 0.00 C ATOM 33 O GLY A 105 7.932 17.417 -3.608 1.00 0.00 O ATOM 0 H GLY A 105 10.860 18.397 -1.667 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.746 18.748 -0.752 1.00 0.00 H new ATOM 0 HA3 GLY A 105 8.243 19.643 -2.172 1.00 0.00 H new ATOM 37 N SER A 106 7.875 16.558 -1.529 1.00 0.00 N ATOM 38 CA SER A 106 7.261 15.303 -1.946 1.00 0.00 C ATOM 39 C SER A 106 5.756 15.326 -1.697 1.00 0.00 C ATOM 40 O SER A 106 5.305 15.263 -0.552 1.00 0.00 O ATOM 41 CB SER A 106 7.896 14.127 -1.202 1.00 0.00 C ATOM 42 OG SER A 106 7.695 14.241 0.197 1.00 0.00 O ATOM 0 H SER A 106 8.057 16.626 -0.528 1.00 0.00 H new ATOM 0 HA SER A 106 7.433 15.181 -3.015 1.00 0.00 H new ATOM 0 HB2 SER A 106 7.466 13.191 -1.559 1.00 0.00 H new ATOM 0 HB3 SER A 106 8.964 14.090 -1.418 1.00 0.00 H new ATOM 0 HG SER A 106 6.800 14.599 0.371 1.00 0.00 H new ATOM 48 N SER A 107 4.984 15.417 -2.775 1.00 0.00 N ATOM 49 CA SER A 107 3.530 15.452 -2.674 1.00 0.00 C ATOM 50 C SER A 107 3.007 14.218 -1.945 1.00 0.00 C ATOM 51 O SER A 107 2.144 14.318 -1.073 1.00 0.00 O ATOM 52 CB SER A 107 2.903 15.540 -4.066 1.00 0.00 C ATOM 53 OG SER A 107 3.313 16.719 -4.737 1.00 0.00 O ATOM 0 H SER A 107 5.342 15.468 -3.729 1.00 0.00 H new ATOM 0 HA SER A 107 3.251 16.337 -2.102 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.188 14.666 -4.652 1.00 0.00 H new ATOM 0 HB3 SER A 107 1.816 15.526 -3.980 1.00 0.00 H new ATOM 0 HG SER A 107 2.900 16.750 -5.625 1.00 0.00 H new ATOM 59 N GLY A 108 3.536 13.054 -2.308 1.00 0.00 N ATOM 60 CA GLY A 108 3.111 11.817 -1.679 1.00 0.00 C ATOM 61 C GLY A 108 1.714 11.404 -2.099 1.00 0.00 C ATOM 62 O GLY A 108 0.868 12.252 -2.384 1.00 0.00 O ATOM 0 H GLY A 108 4.252 12.945 -3.027 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.813 11.023 -1.934 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.142 11.934 -0.596 1.00 0.00 H new ATOM 66 N ARG A 109 1.472 10.097 -2.139 1.00 0.00 N ATOM 67 CA ARG A 109 0.169 9.574 -2.530 1.00 0.00 C ATOM 68 C ARG A 109 -0.395 8.657 -1.449 1.00 0.00 C ATOM 69 O ARG A 109 0.352 7.973 -0.749 1.00 0.00 O ATOM 70 CB ARG A 109 0.278 8.813 -3.853 1.00 0.00 C ATOM 71 CG ARG A 109 0.715 9.682 -5.021 1.00 0.00 C ATOM 72 CD ARG A 109 1.039 8.844 -6.248 1.00 0.00 C ATOM 73 NE ARG A 109 1.048 9.643 -7.470 1.00 0.00 N ATOM 74 CZ ARG A 109 -0.045 9.928 -8.169 1.00 0.00 C ATOM 75 NH1 ARG A 109 -1.227 9.482 -7.767 1.00 0.00 N ATOM 76 NH2 ARG A 109 0.043 10.662 -9.271 1.00 0.00 N ATOM 0 H ARG A 109 2.161 9.382 -1.905 1.00 0.00 H new ATOM 0 HA ARG A 109 -0.510 10.417 -2.658 1.00 0.00 H new ATOM 0 HB2 ARG A 109 0.988 7.995 -3.734 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.688 8.365 -4.086 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.075 10.393 -5.263 1.00 0.00 H new ATOM 0 HG3 ARG A 109 1.591 10.264 -4.735 1.00 0.00 H new ATOM 0 HD2 ARG A 109 2.012 8.371 -6.117 1.00 0.00 H new ATOM 0 HD3 ARG A 109 0.306 8.043 -6.344 1.00 0.00 H new ATOM 0 HE ARG A 109 1.942 10.002 -7.805 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -1.298 8.919 -6.920 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -2.065 9.702 -8.305 1.00 0.00 H new ATOM 0 HH21 ARG A 109 0.951 11.008 -9.582 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -0.797 10.880 -9.807 1.00 0.00 H new ATOM 90 N ARG A 110 -1.717 8.648 -1.319 1.00 0.00 N ATOM 91 CA ARG A 110 -2.382 7.817 -0.322 1.00 0.00 C ATOM 92 C ARG A 110 -2.091 6.339 -0.566 1.00 0.00 C ATOM 93 O ARG A 110 -1.988 5.896 -1.711 1.00 0.00 O ATOM 94 CB ARG A 110 -3.892 8.061 -0.347 1.00 0.00 C ATOM 95 CG ARG A 110 -4.271 9.494 -0.686 1.00 0.00 C ATOM 96 CD ARG A 110 -5.582 9.893 -0.028 1.00 0.00 C ATOM 97 NE ARG A 110 -6.733 9.603 -0.879 1.00 0.00 N ATOM 98 CZ ARG A 110 -7.987 9.590 -0.441 1.00 0.00 C ATOM 99 NH1 ARG A 110 -8.251 9.851 0.832 1.00 0.00 N ATOM 100 NH2 ARG A 110 -8.980 9.318 -1.277 1.00 0.00 N ATOM 0 H ARG A 110 -2.350 9.207 -1.892 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.994 8.090 0.659 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -4.348 7.391 -1.076 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -4.309 7.804 0.627 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -3.479 10.168 -0.360 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.357 9.603 -1.767 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -5.688 9.363 0.918 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -5.562 10.958 0.204 1.00 0.00 H new ATOM 0 HE ARG A 110 -6.565 9.399 -1.864 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -7.490 10.062 1.478 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -9.215 9.840 1.166 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -8.781 9.119 -2.257 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -9.943 9.308 -0.940 1.00 0.00 H new ATOM 114 N LEU A 111 -1.960 5.581 0.517 1.00 0.00 N ATOM 115 CA LEU A 111 -1.680 4.152 0.422 1.00 0.00 C ATOM 116 C LEU A 111 -2.763 3.438 -0.380 1.00 0.00 C ATOM 117 O LEU A 111 -2.487 2.565 -1.203 1.00 0.00 O ATOM 118 CB LEU A 111 -1.576 3.538 1.819 1.00 0.00 C ATOM 119 CG LEU A 111 -0.823 2.212 1.916 1.00 0.00 C ATOM 120 CD1 LEU A 111 0.594 2.362 1.383 1.00 0.00 C ATOM 121 CD2 LEU A 111 -0.805 1.711 3.353 1.00 0.00 C ATOM 0 H LEU A 111 -2.043 5.932 1.471 1.00 0.00 H new ATOM 0 HA LEU A 111 -0.728 4.027 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.088 4.259 2.475 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.585 3.389 2.204 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.343 1.476 1.303 1.00 0.00 H new ATOM 0 HD11 LEU A 111 1.115 1.408 1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.559 2.673 0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 111 1.125 3.113 1.968 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.264 0.766 3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.310 2.446 3.988 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -1.828 1.562 3.699 1.00 0.00 H new ATOM 133 N PRO A 112 -4.028 3.817 -0.138 1.00 0.00 N ATOM 134 CA PRO A 112 -5.177 3.228 -0.830 1.00 0.00 C ATOM 135 C PRO A 112 -5.040 3.302 -2.347 1.00 0.00 C ATOM 136 O PRO A 112 -5.346 2.342 -3.056 1.00 0.00 O ATOM 137 CB PRO A 112 -6.353 4.085 -0.356 1.00 0.00 C ATOM 138 CG PRO A 112 -5.920 4.629 0.960 1.00 0.00 C ATOM 139 CD PRO A 112 -4.430 4.852 0.829 1.00 0.00 C ATOM 0 HA PRO A 112 -5.288 2.167 -0.607 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -6.570 4.886 -1.063 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -7.262 3.491 -0.259 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -6.438 5.560 1.191 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -6.144 3.931 1.767 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -4.202 5.854 0.467 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -3.918 4.734 1.784 1.00 0.00 H new ATOM 147 N THR A 113 -4.580 4.447 -2.841 1.00 0.00 N ATOM 148 CA THR A 113 -4.404 4.645 -4.274 1.00 0.00 C ATOM 149 C THR A 113 -3.258 3.796 -4.810 1.00 0.00 C ATOM 150 O THR A 113 -3.377 3.169 -5.862 1.00 0.00 O ATOM 151 CB THR A 113 -4.131 6.125 -4.606 1.00 0.00 C ATOM 152 OG1 THR A 113 -5.166 6.950 -4.060 1.00 0.00 O ATOM 153 CG2 THR A 113 -4.048 6.335 -6.110 1.00 0.00 C ATOM 0 H THR A 113 -4.323 5.252 -2.269 1.00 0.00 H new ATOM 0 HA THR A 113 -5.334 4.338 -4.753 1.00 0.00 H new ATOM 0 HB THR A 113 -3.175 6.403 -4.163 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.983 7.889 -4.274 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.855 7.387 -6.320 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.239 5.729 -6.518 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.991 6.040 -6.571 1.00 0.00 H new ATOM 161 N VAL A 114 -2.148 3.779 -4.080 1.00 0.00 N ATOM 162 CA VAL A 114 -0.979 3.004 -4.481 1.00 0.00 C ATOM 163 C VAL A 114 -1.312 1.519 -4.577 1.00 0.00 C ATOM 164 O VAL A 114 -0.787 0.809 -5.435 1.00 0.00 O ATOM 165 CB VAL A 114 0.187 3.195 -3.494 1.00 0.00 C ATOM 166 CG1 VAL A 114 1.380 2.345 -3.906 1.00 0.00 C ATOM 167 CG2 VAL A 114 0.574 4.664 -3.406 1.00 0.00 C ATOM 0 H VAL A 114 -2.033 4.293 -3.207 1.00 0.00 H new ATOM 0 HA VAL A 114 -0.677 3.370 -5.462 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.138 2.868 -2.506 1.00 0.00 H new ATOM 0 HG11 VAL A 114 2.194 2.493 -3.197 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.092 1.294 -3.914 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.709 2.639 -4.903 1.00 0.00 H new ATOM 0 HG21 VAL A 114 1.400 4.781 -2.704 1.00 0.00 H new ATOM 0 HG22 VAL A 114 0.881 5.019 -4.390 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -0.281 5.245 -3.061 1.00 0.00 H new ATOM 177 N LEU A 115 -2.187 1.056 -3.691 1.00 0.00 N ATOM 178 CA LEU A 115 -2.591 -0.346 -3.675 1.00 0.00 C ATOM 179 C LEU A 115 -3.454 -0.677 -4.888 1.00 0.00 C ATOM 180 O LEU A 115 -3.234 -1.682 -5.565 1.00 0.00 O ATOM 181 CB LEU A 115 -3.355 -0.662 -2.389 1.00 0.00 C ATOM 182 CG LEU A 115 -2.510 -1.139 -1.207 1.00 0.00 C ATOM 183 CD1 LEU A 115 -3.265 -0.949 0.100 1.00 0.00 C ATOM 184 CD2 LEU A 115 -2.116 -2.597 -1.388 1.00 0.00 C ATOM 0 H LEU A 115 -2.630 1.631 -2.974 1.00 0.00 H new ATOM 0 HA LEU A 115 -1.691 -0.959 -3.715 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -3.899 0.232 -2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -4.099 -1.427 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 115 -1.601 -0.539 -1.169 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -2.648 -1.294 0.930 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -3.498 0.107 0.235 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -4.191 -1.524 0.072 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -1.515 -2.920 -0.538 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -3.014 -3.211 -1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -1.536 -2.706 -2.304 1.00 0.00 H new ATOM 196 N LEU A 116 -4.437 0.175 -5.159 1.00 0.00 N ATOM 197 CA LEU A 116 -5.334 -0.025 -6.292 1.00 0.00 C ATOM 198 C LEU A 116 -4.561 -0.009 -7.607 1.00 0.00 C ATOM 199 O LEU A 116 -4.851 -0.783 -8.520 1.00 0.00 O ATOM 200 CB LEU A 116 -6.416 1.056 -6.309 1.00 0.00 C ATOM 201 CG LEU A 116 -7.365 1.075 -5.111 1.00 0.00 C ATOM 202 CD1 LEU A 116 -8.269 2.296 -5.165 1.00 0.00 C ATOM 203 CD2 LEU A 116 -8.192 -0.202 -5.065 1.00 0.00 C ATOM 0 H LEU A 116 -4.633 1.011 -4.609 1.00 0.00 H new ATOM 0 HA LEU A 116 -5.807 -1.001 -6.182 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.929 2.029 -6.376 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -7.009 0.934 -7.215 1.00 0.00 H new ATOM 0 HG LEU A 116 -6.768 1.131 -4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -8.937 2.292 -4.304 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.661 3.200 -5.148 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -8.858 2.272 -6.082 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -8.862 -0.171 -4.206 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -8.779 -0.289 -5.980 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -7.528 -1.062 -4.977 1.00 0.00 H new ATOM 215 N LYS A 117 -3.574 0.876 -7.697 1.00 0.00 N ATOM 216 CA LYS A 117 -2.756 0.992 -8.898 1.00 0.00 C ATOM 217 C LYS A 117 -1.785 -0.179 -9.010 1.00 0.00 C ATOM 218 O LYS A 117 -1.523 -0.679 -10.105 1.00 0.00 O ATOM 219 CB LYS A 117 -1.981 2.312 -8.886 1.00 0.00 C ATOM 220 CG LYS A 117 -0.907 2.395 -9.957 1.00 0.00 C ATOM 221 CD LYS A 117 0.429 1.882 -9.448 1.00 0.00 C ATOM 222 CE LYS A 117 1.508 1.982 -10.516 1.00 0.00 C ATOM 223 NZ LYS A 117 2.002 3.378 -10.675 1.00 0.00 N ATOM 0 H LYS A 117 -3.321 1.524 -6.951 1.00 0.00 H new ATOM 0 HA LYS A 117 -3.419 0.975 -9.763 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.681 3.136 -9.021 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.518 2.443 -7.908 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -1.213 1.814 -10.827 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -0.799 3.429 -10.286 1.00 0.00 H new ATOM 0 HD2 LYS A 117 0.730 2.455 -8.571 1.00 0.00 H new ATOM 0 HD3 LYS A 117 0.325 0.844 -9.131 1.00 0.00 H new ATOM 0 HE2 LYS A 117 2.341 1.330 -10.253 1.00 0.00 H new ATOM 0 HE3 LYS A 117 1.112 1.626 -11.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 2.736 3.405 -11.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 1.212 3.996 -10.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 2.403 3.709 -9.774 1.00 0.00 H new ATOM 237 N LEU A 118 -1.257 -0.614 -7.872 1.00 0.00 N ATOM 238 CA LEU A 118 -0.315 -1.728 -7.842 1.00 0.00 C ATOM 239 C LEU A 118 -1.050 -3.064 -7.914 1.00 0.00 C ATOM 240 O LEU A 118 -0.467 -4.117 -7.658 1.00 0.00 O ATOM 241 CB LEU A 118 0.536 -1.670 -6.572 1.00 0.00 C ATOM 242 CG LEU A 118 1.576 -0.550 -6.513 1.00 0.00 C ATOM 243 CD1 LEU A 118 2.276 -0.543 -5.162 1.00 0.00 C ATOM 244 CD2 LEU A 118 2.588 -0.703 -7.640 1.00 0.00 C ATOM 0 H LEU A 118 -1.465 -0.213 -6.958 1.00 0.00 H new ATOM 0 HA LEU A 118 0.336 -1.644 -8.712 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.131 -1.565 -5.716 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.051 -2.624 -6.460 1.00 0.00 H new ATOM 0 HG LEU A 118 1.064 0.404 -6.639 1.00 0.00 H new ATOM 0 HD11 LEU A 118 3.012 0.260 -5.138 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.541 -0.385 -4.372 1.00 0.00 H new ATOM 0 HD13 LEU A 118 2.776 -1.499 -5.007 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.321 0.102 -7.583 1.00 0.00 H new ATOM 0 HD22 LEU A 118 3.096 -1.663 -7.545 1.00 0.00 H new ATOM 0 HD23 LEU A 118 2.073 -0.658 -8.600 1.00 0.00 H new ATOM 256 N ARG A 119 -2.330 -3.010 -8.265 1.00 0.00 N ATOM 257 CA ARG A 119 -3.144 -4.215 -8.373 1.00 0.00 C ATOM 258 C ARG A 119 -3.019 -5.068 -7.113 1.00 0.00 C ATOM 259 O ARG A 119 -3.094 -6.295 -7.174 1.00 0.00 O ATOM 260 CB ARG A 119 -2.727 -5.031 -9.598 1.00 0.00 C ATOM 261 CG ARG A 119 -2.876 -4.278 -10.909 1.00 0.00 C ATOM 262 CD ARG A 119 -4.310 -4.313 -11.412 1.00 0.00 C ATOM 263 NE ARG A 119 -4.495 -3.481 -12.598 1.00 0.00 N ATOM 264 CZ ARG A 119 -4.661 -2.163 -12.551 1.00 0.00 C ATOM 265 NH1 ARG A 119 -4.663 -1.533 -11.386 1.00 0.00 N ATOM 266 NH2 ARG A 119 -4.823 -1.475 -13.674 1.00 0.00 N ATOM 0 H ARG A 119 -2.826 -2.145 -8.480 1.00 0.00 H new ATOM 0 HA ARG A 119 -4.185 -3.912 -8.485 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -1.688 -5.340 -9.482 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -3.327 -5.940 -9.640 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -2.562 -3.243 -10.773 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -2.216 -4.715 -11.658 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -4.588 -5.341 -11.644 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -4.980 -3.972 -10.622 1.00 0.00 H new ATOM 0 HE ARG A 119 -4.497 -3.936 -13.511 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -4.537 -2.059 -10.521 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -4.791 -0.522 -11.353 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -4.820 -1.958 -14.573 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -4.950 -0.464 -13.639 1.00 0.00 H new ATOM 280 N MET A 120 -2.829 -4.410 -5.975 1.00 0.00 N ATOM 281 CA MET A 120 -2.695 -5.109 -4.701 1.00 0.00 C ATOM 282 C MET A 120 -4.042 -5.213 -3.994 1.00 0.00 C ATOM 283 O MET A 120 -4.239 -6.075 -3.138 1.00 0.00 O ATOM 284 CB MET A 120 -1.688 -4.387 -3.804 1.00 0.00 C ATOM 285 CG MET A 120 -0.267 -4.405 -4.345 1.00 0.00 C ATOM 286 SD MET A 120 0.834 -3.301 -3.441 1.00 0.00 S ATOM 287 CE MET A 120 1.108 -4.247 -1.945 1.00 0.00 C ATOM 0 H MET A 120 -2.764 -3.394 -5.908 1.00 0.00 H new ATOM 0 HA MET A 120 -2.333 -6.117 -4.903 1.00 0.00 H new ATOM 0 HB2 MET A 120 -2.006 -3.352 -3.675 1.00 0.00 H new ATOM 0 HB3 MET A 120 -1.698 -4.849 -2.817 1.00 0.00 H new ATOM 0 HG2 MET A 120 0.123 -5.421 -4.296 1.00 0.00 H new ATOM 0 HG3 MET A 120 -0.279 -4.119 -5.397 1.00 0.00 H new ATOM 0 HE1 MET A 120 2.004 -3.882 -1.443 1.00 0.00 H new ATOM 0 HE2 MET A 120 0.250 -4.136 -1.282 1.00 0.00 H new ATOM 0 HE3 MET A 120 1.237 -5.299 -2.198 1.00 0.00 H new ATOM 297 N ALA A 121 -4.965 -4.329 -4.357 1.00 0.00 N ATOM 298 CA ALA A 121 -6.294 -4.323 -3.758 1.00 0.00 C ATOM 299 C ALA A 121 -7.375 -4.510 -4.817 1.00 0.00 C ATOM 300 O ALA A 121 -7.107 -4.405 -6.014 1.00 0.00 O ATOM 301 CB ALA A 121 -6.522 -3.028 -2.991 1.00 0.00 C ATOM 0 H ALA A 121 -4.817 -3.608 -5.063 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.355 -5.160 -3.062 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.518 -3.037 -2.549 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.776 -2.936 -2.202 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.435 -2.182 -3.672 1.00 0.00 H new ATOM 307 N GLN A 122 -8.595 -4.788 -4.369 1.00 0.00 N ATOM 308 CA GLN A 122 -9.716 -4.991 -5.279 1.00 0.00 C ATOM 309 C GLN A 122 -10.349 -3.660 -5.668 1.00 0.00 C ATOM 310 O GLN A 122 -10.377 -3.292 -6.842 1.00 0.00 O ATOM 311 CB GLN A 122 -10.764 -5.901 -4.638 1.00 0.00 C ATOM 312 CG GLN A 122 -11.775 -6.457 -5.627 1.00 0.00 C ATOM 313 CD GLN A 122 -11.147 -7.397 -6.637 1.00 0.00 C ATOM 314 OE1 GLN A 122 -10.556 -8.415 -6.272 1.00 0.00 O ATOM 315 NE2 GLN A 122 -11.272 -7.063 -7.916 1.00 0.00 N ATOM 0 H GLN A 122 -8.832 -4.878 -3.381 1.00 0.00 H new ATOM 0 HA GLN A 122 -9.336 -5.469 -6.182 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -10.259 -6.730 -4.143 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -11.293 -5.343 -3.865 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -12.558 -6.985 -5.082 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -12.254 -5.632 -6.153 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -11.770 -6.211 -8.174 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -10.871 -7.659 -8.640 1.00 0.00 H new ATOM 324 N HIS A 123 -10.859 -2.940 -4.673 1.00 0.00 N ATOM 325 CA HIS A 123 -11.493 -1.648 -4.911 1.00 0.00 C ATOM 326 C HIS A 123 -11.083 -0.637 -3.844 1.00 0.00 C ATOM 327 O HIS A 123 -10.394 -0.979 -2.882 1.00 0.00 O ATOM 328 CB HIS A 123 -13.014 -1.798 -4.928 1.00 0.00 C ATOM 329 CG HIS A 123 -13.534 -2.748 -3.893 1.00 0.00 C ATOM 330 ND1 HIS A 123 -13.991 -2.339 -2.658 1.00 0.00 N ATOM 331 CD2 HIS A 123 -13.671 -4.095 -3.916 1.00 0.00 C ATOM 332 CE1 HIS A 123 -14.384 -3.392 -1.965 1.00 0.00 C ATOM 333 NE2 HIS A 123 -14.201 -4.470 -2.705 1.00 0.00 N ATOM 0 H HIS A 123 -10.845 -3.229 -3.695 1.00 0.00 H new ATOM 0 HA HIS A 123 -11.160 -1.281 -5.882 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -13.469 -0.820 -4.773 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -13.326 -2.142 -5.914 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -13.412 -4.752 -4.733 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -14.787 -3.374 -0.963 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -14.418 -5.426 -2.423 1.00 0.00 H new ATOM 341 N LEU A 124 -11.509 0.608 -4.021 1.00 0.00 N ATOM 342 CA LEU A 124 -11.186 1.670 -3.074 1.00 0.00 C ATOM 343 C LEU A 124 -11.569 1.268 -1.654 1.00 0.00 C ATOM 344 O LEU A 124 -10.780 1.424 -0.722 1.00 0.00 O ATOM 345 CB LEU A 124 -11.906 2.963 -3.463 1.00 0.00 C ATOM 346 CG LEU A 124 -11.563 4.198 -2.628 1.00 0.00 C ATOM 347 CD1 LEU A 124 -10.095 4.558 -2.784 1.00 0.00 C ATOM 348 CD2 LEU A 124 -12.448 5.370 -3.025 1.00 0.00 C ATOM 0 H LEU A 124 -12.079 0.908 -4.812 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.109 1.837 -3.106 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.681 3.181 -4.507 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -12.980 2.791 -3.397 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.748 3.967 -1.579 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.870 5.439 -2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -9.478 3.724 -2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.882 4.770 -3.832 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -12.191 6.241 -2.422 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -12.295 5.601 -4.079 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -13.493 5.109 -2.859 1.00 0.00 H new ATOM 360 N GLN A 125 -12.782 0.748 -1.498 1.00 0.00 N ATOM 361 CA GLN A 125 -13.268 0.322 -0.191 1.00 0.00 C ATOM 362 C GLN A 125 -12.388 -0.783 0.383 1.00 0.00 C ATOM 363 O GLN A 125 -12.107 -0.807 1.581 1.00 0.00 O ATOM 364 CB GLN A 125 -14.714 -0.164 -0.295 1.00 0.00 C ATOM 365 CG GLN A 125 -15.503 -0.009 0.996 1.00 0.00 C ATOM 366 CD GLN A 125 -16.848 -0.704 0.945 1.00 0.00 C ATOM 367 OE1 GLN A 125 -17.264 -1.202 -0.103 1.00 0.00 O ATOM 368 NE2 GLN A 125 -17.540 -0.740 2.077 1.00 0.00 N ATOM 0 H GLN A 125 -13.446 0.612 -2.260 1.00 0.00 H new ATOM 0 HA GLN A 125 -13.228 1.179 0.481 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -15.218 0.389 -1.088 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -14.715 -1.214 -0.588 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -14.921 -0.413 1.824 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -15.654 1.051 1.200 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -17.158 -0.315 2.922 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -18.454 -1.193 2.102 1.00 0.00 H new ATOM 377 N ALA A 126 -11.955 -1.697 -0.479 1.00 0.00 N ATOM 378 CA ALA A 126 -11.105 -2.803 -0.057 1.00 0.00 C ATOM 379 C ALA A 126 -9.729 -2.306 0.372 1.00 0.00 C ATOM 380 O ALA A 126 -9.221 -2.689 1.425 1.00 0.00 O ATOM 381 CB ALA A 126 -10.974 -3.825 -1.178 1.00 0.00 C ATOM 0 H ALA A 126 -12.179 -1.693 -1.474 1.00 0.00 H new ATOM 0 HA ALA A 126 -11.573 -3.281 0.803 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -10.336 -4.646 -0.849 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -11.960 -4.212 -1.435 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.531 -3.350 -2.054 1.00 0.00 H new ATOM 387 N ALA A 127 -9.130 -1.453 -0.453 1.00 0.00 N ATOM 388 CA ALA A 127 -7.813 -0.903 -0.157 1.00 0.00 C ATOM 389 C ALA A 127 -7.833 -0.092 1.134 1.00 0.00 C ATOM 390 O ALA A 127 -6.924 -0.195 1.958 1.00 0.00 O ATOM 391 CB ALA A 127 -7.329 -0.043 -1.315 1.00 0.00 C ATOM 0 H ALA A 127 -9.536 -1.128 -1.331 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.122 -1.735 -0.021 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -6.344 0.362 -1.081 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -7.267 -0.650 -2.218 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.029 0.777 -1.477 1.00 0.00 H new ATOM 397 N VAL A 128 -8.876 0.714 1.305 1.00 0.00 N ATOM 398 CA VAL A 128 -9.015 1.543 2.497 1.00 0.00 C ATOM 399 C VAL A 128 -9.178 0.684 3.746 1.00 0.00 C ATOM 400 O VAL A 128 -8.496 0.894 4.749 1.00 0.00 O ATOM 401 CB VAL A 128 -10.220 2.495 2.381 1.00 0.00 C ATOM 402 CG1 VAL A 128 -10.502 3.166 3.718 1.00 0.00 C ATOM 403 CG2 VAL A 128 -9.976 3.532 1.296 1.00 0.00 C ATOM 0 H VAL A 128 -9.637 0.811 0.633 1.00 0.00 H new ATOM 0 HA VAL A 128 -8.103 2.133 2.581 1.00 0.00 H new ATOM 0 HB VAL A 128 -11.097 1.911 2.103 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -11.357 3.835 3.616 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -10.723 2.406 4.467 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -9.628 3.739 4.029 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -10.837 4.196 1.227 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -9.088 4.114 1.542 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -9.828 3.030 0.340 1.00 0.00 H new ATOM 413 N ALA A 129 -10.086 -0.283 3.679 1.00 0.00 N ATOM 414 CA ALA A 129 -10.338 -1.176 4.803 1.00 0.00 C ATOM 415 C ALA A 129 -9.086 -1.969 5.165 1.00 0.00 C ATOM 416 O ALA A 129 -8.751 -2.118 6.340 1.00 0.00 O ATOM 417 CB ALA A 129 -11.489 -2.118 4.484 1.00 0.00 C ATOM 0 H ALA A 129 -10.660 -0.468 2.857 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.612 -0.567 5.664 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -11.665 -2.778 5.333 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -12.389 -1.537 4.283 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -11.239 -2.714 3.606 1.00 0.00 H new ATOM 423 N PHE A 130 -8.400 -2.479 4.146 1.00 0.00 N ATOM 424 CA PHE A 130 -7.187 -3.259 4.357 1.00 0.00 C ATOM 425 C PHE A 130 -6.129 -2.435 5.086 1.00 0.00 C ATOM 426 O PHE A 130 -5.476 -2.919 6.009 1.00 0.00 O ATOM 427 CB PHE A 130 -6.633 -3.752 3.018 1.00 0.00 C ATOM 428 CG PHE A 130 -7.429 -4.874 2.416 1.00 0.00 C ATOM 429 CD1 PHE A 130 -7.830 -5.950 3.192 1.00 0.00 C ATOM 430 CD2 PHE A 130 -7.775 -4.853 1.075 1.00 0.00 C ATOM 431 CE1 PHE A 130 -8.563 -6.984 2.641 1.00 0.00 C ATOM 432 CE2 PHE A 130 -8.508 -5.885 0.519 1.00 0.00 C ATOM 433 CZ PHE A 130 -8.902 -6.952 1.303 1.00 0.00 C ATOM 0 H PHE A 130 -8.664 -2.366 3.167 1.00 0.00 H new ATOM 0 HA PHE A 130 -7.442 -4.119 4.976 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -6.607 -2.919 2.316 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -5.604 -4.082 3.159 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -7.567 -5.981 4.239 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -7.469 -4.022 0.457 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -8.870 -7.816 3.257 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -8.772 -5.857 -0.528 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.474 -7.759 0.870 1.00 0.00 H new ATOM 443 N VAL A 131 -5.965 -1.185 4.661 1.00 0.00 N ATOM 444 CA VAL A 131 -4.988 -0.293 5.272 1.00 0.00 C ATOM 445 C VAL A 131 -5.288 -0.081 6.753 1.00 0.00 C ATOM 446 O VAL A 131 -4.416 -0.257 7.603 1.00 0.00 O ATOM 447 CB VAL A 131 -4.959 1.075 4.566 1.00 0.00 C ATOM 448 CG1 VAL A 131 -4.177 2.087 5.390 1.00 0.00 C ATOM 449 CG2 VAL A 131 -4.365 0.942 3.171 1.00 0.00 C ATOM 0 H VAL A 131 -6.496 -0.769 3.896 1.00 0.00 H new ATOM 0 HA VAL A 131 -4.014 -0.770 5.165 1.00 0.00 H new ATOM 0 HB VAL A 131 -5.983 1.434 4.469 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -4.168 3.047 4.874 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -4.648 2.204 6.366 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -3.153 1.736 5.521 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -4.352 1.918 2.686 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -3.347 0.560 3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -4.970 0.253 2.582 1.00 0.00 H new ATOM 459 N GLU A 132 -6.525 0.298 7.052 1.00 0.00 N ATOM 460 CA GLU A 132 -6.939 0.533 8.430 1.00 0.00 C ATOM 461 C GLU A 132 -6.899 -0.760 9.239 1.00 0.00 C ATOM 462 O GLU A 132 -6.752 -0.735 10.460 1.00 0.00 O ATOM 463 CB GLU A 132 -8.348 1.129 8.469 1.00 0.00 C ATOM 464 CG GLU A 132 -8.425 2.548 7.929 1.00 0.00 C ATOM 465 CD GLU A 132 -9.630 3.305 8.451 1.00 0.00 C ATOM 466 OE1 GLU A 132 -10.743 3.078 7.932 1.00 0.00 O ATOM 467 OE2 GLU A 132 -9.461 4.126 9.376 1.00 0.00 O ATOM 0 H GLU A 132 -7.258 0.449 6.359 1.00 0.00 H new ATOM 0 HA GLU A 132 -6.241 1.241 8.876 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -9.018 0.493 7.891 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -8.708 1.121 9.498 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -7.517 3.086 8.201 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -8.464 2.517 6.840 1.00 0.00 H new ATOM 474 N GLN A 133 -7.033 -1.888 8.548 1.00 0.00 N ATOM 475 CA GLN A 133 -7.014 -3.190 9.202 1.00 0.00 C ATOM 476 C GLN A 133 -5.582 -3.666 9.427 1.00 0.00 C ATOM 477 O GLN A 133 -5.343 -4.842 9.694 1.00 0.00 O ATOM 478 CB GLN A 133 -7.779 -4.216 8.364 1.00 0.00 C ATOM 479 CG GLN A 133 -9.274 -4.236 8.642 1.00 0.00 C ATOM 480 CD GLN A 133 -9.939 -5.511 8.162 1.00 0.00 C ATOM 481 OE1 GLN A 133 -9.467 -6.614 8.442 1.00 0.00 O ATOM 482 NE2 GLN A 133 -11.041 -5.367 7.436 1.00 0.00 N ATOM 0 H GLN A 133 -7.156 -1.926 7.536 1.00 0.00 H new ATOM 0 HA GLN A 133 -7.500 -3.088 10.172 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -7.617 -4.003 7.307 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -7.369 -5.208 8.556 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -9.442 -4.124 9.713 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -9.742 -3.381 8.155 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -11.396 -4.434 7.228 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -11.532 -6.190 7.086 1.00 0.00 H new ATOM 491 N GLY A 134 -4.633 -2.741 9.318 1.00 0.00 N ATOM 492 CA GLY A 134 -3.237 -3.085 9.511 1.00 0.00 C ATOM 493 C GLY A 134 -2.817 -4.289 8.692 1.00 0.00 C ATOM 494 O GLY A 134 -1.917 -5.032 9.083 1.00 0.00 O ATOM 0 H GLY A 134 -4.806 -1.760 9.100 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -2.615 -2.231 9.241 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -3.059 -3.288 10.567 1.00 0.00 H new ATOM 498 N HIS A 135 -3.471 -4.485 7.551 1.00 0.00 N ATOM 499 CA HIS A 135 -3.162 -5.608 6.674 1.00 0.00 C ATOM 500 C HIS A 135 -1.991 -5.273 5.756 1.00 0.00 C ATOM 501 O HIS A 135 -1.360 -6.165 5.187 1.00 0.00 O ATOM 502 CB HIS A 135 -4.387 -5.986 5.841 1.00 0.00 C ATOM 503 CG HIS A 135 -5.339 -6.896 6.555 1.00 0.00 C ATOM 504 ND1 HIS A 135 -4.980 -8.141 7.024 1.00 0.00 N ATOM 505 CD2 HIS A 135 -6.644 -6.735 6.878 1.00 0.00 C ATOM 506 CE1 HIS A 135 -6.022 -8.708 7.605 1.00 0.00 C ATOM 507 NE2 HIS A 135 -7.045 -7.875 7.530 1.00 0.00 N ATOM 0 H HIS A 135 -4.219 -3.880 7.212 1.00 0.00 H new ATOM 0 HA HIS A 135 -2.881 -6.457 7.297 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -4.914 -5.077 5.552 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -4.056 -6.469 4.922 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -7.255 -5.871 6.663 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -6.036 -9.686 8.063 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -7.980 -8.050 7.897 1.00 0.00 H new ATOM 515 N VAL A 136 -1.706 -3.983 5.614 1.00 0.00 N ATOM 516 CA VAL A 136 -0.610 -3.531 4.765 1.00 0.00 C ATOM 517 C VAL A 136 0.352 -2.636 5.539 1.00 0.00 C ATOM 518 O VAL A 136 -0.070 -1.783 6.320 1.00 0.00 O ATOM 519 CB VAL A 136 -1.133 -2.764 3.536 1.00 0.00 C ATOM 520 CG1 VAL A 136 0.022 -2.318 2.654 1.00 0.00 C ATOM 521 CG2 VAL A 136 -2.114 -3.621 2.751 1.00 0.00 C ATOM 0 H VAL A 136 -2.219 -3.232 6.076 1.00 0.00 H new ATOM 0 HA VAL A 136 -0.080 -4.423 4.429 1.00 0.00 H new ATOM 0 HB VAL A 136 -1.659 -1.874 3.882 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.367 -1.778 1.791 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.683 -1.665 3.223 1.00 0.00 H new ATOM 0 HG13 VAL A 136 0.579 -3.191 2.315 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.473 -3.063 1.886 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.615 -4.530 2.415 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.958 -3.885 3.389 1.00 0.00 H new ATOM 531 N ARG A 137 1.646 -2.836 5.315 1.00 0.00 N ATOM 532 CA ARG A 137 2.668 -2.047 5.992 1.00 0.00 C ATOM 533 C ARG A 137 3.659 -1.465 4.988 1.00 0.00 C ATOM 534 O ARG A 137 3.804 -1.973 3.876 1.00 0.00 O ATOM 535 CB ARG A 137 3.411 -2.907 7.017 1.00 0.00 C ATOM 536 CG ARG A 137 4.401 -3.877 6.395 1.00 0.00 C ATOM 537 CD ARG A 137 5.494 -4.265 7.378 1.00 0.00 C ATOM 538 NE ARG A 137 6.306 -5.375 6.885 1.00 0.00 N ATOM 539 CZ ARG A 137 7.309 -5.226 6.027 1.00 0.00 C ATOM 540 NH1 ARG A 137 7.624 -4.021 5.570 1.00 0.00 N ATOM 541 NH2 ARG A 137 8.002 -6.284 5.625 1.00 0.00 N ATOM 0 H ARG A 137 2.012 -3.537 4.671 1.00 0.00 H new ATOM 0 HA ARG A 137 2.173 -1.224 6.508 1.00 0.00 H new ATOM 0 HB2 ARG A 137 3.942 -2.254 7.710 1.00 0.00 H new ATOM 0 HB3 ARG A 137 2.683 -3.469 7.602 1.00 0.00 H new ATOM 0 HG2 ARG A 137 3.875 -4.772 6.062 1.00 0.00 H new ATOM 0 HG3 ARG A 137 4.849 -3.424 5.511 1.00 0.00 H new ATOM 0 HD2 ARG A 137 6.134 -3.403 7.566 1.00 0.00 H new ATOM 0 HD3 ARG A 137 5.043 -4.541 8.331 1.00 0.00 H new ATOM 0 HE ARG A 137 6.091 -6.315 7.218 1.00 0.00 H new ATOM 0 HH11 ARG A 137 7.095 -3.205 5.877 1.00 0.00 H new ATOM 0 HH12 ARG A 137 8.395 -3.911 4.911 1.00 0.00 H new ATOM 0 HH21 ARG A 137 7.765 -7.212 5.975 1.00 0.00 H new ATOM 0 HH22 ARG A 137 8.772 -6.169 4.966 1.00 0.00 H new ATOM 555 N VAL A 138 4.339 -0.394 5.387 1.00 0.00 N ATOM 556 CA VAL A 138 5.316 0.257 4.523 1.00 0.00 C ATOM 557 C VAL A 138 6.701 0.252 5.159 1.00 0.00 C ATOM 558 O VAL A 138 6.939 0.926 6.161 1.00 0.00 O ATOM 559 CB VAL A 138 4.910 1.711 4.213 1.00 0.00 C ATOM 560 CG1 VAL A 138 5.957 2.382 3.337 1.00 0.00 C ATOM 561 CG2 VAL A 138 3.542 1.751 3.549 1.00 0.00 C ATOM 0 H VAL A 138 4.231 0.041 6.303 1.00 0.00 H new ATOM 0 HA VAL A 138 5.345 -0.311 3.593 1.00 0.00 H new ATOM 0 HB VAL A 138 4.849 2.262 5.152 1.00 0.00 H new ATOM 0 HG11 VAL A 138 5.654 3.408 3.128 1.00 0.00 H new ATOM 0 HG12 VAL A 138 6.916 2.385 3.854 1.00 0.00 H new ATOM 0 HG13 VAL A 138 6.052 1.834 2.400 1.00 0.00 H new ATOM 0 HG21 VAL A 138 3.271 2.785 3.337 1.00 0.00 H new ATOM 0 HG22 VAL A 138 3.573 1.186 2.618 1.00 0.00 H new ATOM 0 HG23 VAL A 138 2.801 1.311 4.216 1.00 0.00 H new ATOM 571 N GLY A 139 7.615 -0.512 4.569 1.00 0.00 N ATOM 572 CA GLY A 139 8.967 -0.590 5.091 1.00 0.00 C ATOM 573 C GLY A 139 9.001 -0.988 6.553 1.00 0.00 C ATOM 574 O GLY A 139 8.143 -1.727 7.039 1.00 0.00 O ATOM 0 H GLY A 139 7.443 -1.079 3.738 1.00 0.00 H new ATOM 0 HA2 GLY A 139 9.538 -1.313 4.507 1.00 0.00 H new ATOM 0 HA3 GLY A 139 9.457 0.376 4.969 1.00 0.00 H new ATOM 578 N PRO A 140 10.014 -0.495 7.282 1.00 0.00 N ATOM 579 CA PRO A 140 10.182 -0.792 8.707 1.00 0.00 C ATOM 580 C PRO A 140 9.111 -0.129 9.567 1.00 0.00 C ATOM 581 O PRO A 140 9.141 -0.224 10.794 1.00 0.00 O ATOM 582 CB PRO A 140 11.562 -0.214 9.029 1.00 0.00 C ATOM 583 CG PRO A 140 11.769 0.859 8.016 1.00 0.00 C ATOM 584 CD PRO A 140 11.073 0.390 6.769 1.00 0.00 C ATOM 0 HA PRO A 140 10.093 -1.858 8.915 1.00 0.00 H new ATOM 0 HB2 PRO A 140 11.597 0.186 10.042 1.00 0.00 H new ATOM 0 HB3 PRO A 140 12.337 -0.978 8.961 1.00 0.00 H new ATOM 0 HG2 PRO A 140 11.355 1.807 8.361 1.00 0.00 H new ATOM 0 HG3 PRO A 140 12.831 1.023 7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 140 10.660 1.224 6.202 1.00 0.00 H new ATOM 0 HD3 PRO A 140 11.754 -0.142 6.104 1.00 0.00 H new ATOM 592 N ASP A 141 8.168 0.542 8.916 1.00 0.00 N ATOM 593 CA ASP A 141 7.087 1.220 9.621 1.00 0.00 C ATOM 594 C ASP A 141 5.729 0.674 9.190 1.00 0.00 C ATOM 595 O ASP A 141 5.431 0.594 7.998 1.00 0.00 O ATOM 596 CB ASP A 141 7.149 2.726 9.367 1.00 0.00 C ATOM 597 CG ASP A 141 8.347 3.377 10.029 1.00 0.00 C ATOM 598 OD1 ASP A 141 9.422 3.426 9.395 1.00 0.00 O ATOM 599 OD2 ASP A 141 8.212 3.836 11.183 1.00 0.00 O ATOM 0 H ASP A 141 8.130 0.631 7.901 1.00 0.00 H new ATOM 0 HA ASP A 141 7.211 1.034 10.688 1.00 0.00 H new ATOM 0 HB2 ASP A 141 7.187 2.909 8.293 1.00 0.00 H new ATOM 0 HB3 ASP A 141 6.236 3.192 9.737 1.00 0.00 H new ATOM 604 N VAL A 142 4.910 0.298 10.167 1.00 0.00 N ATOM 605 CA VAL A 142 3.584 -0.241 9.888 1.00 0.00 C ATOM 606 C VAL A 142 2.536 0.866 9.858 1.00 0.00 C ATOM 607 O VAL A 142 2.268 1.509 10.873 1.00 0.00 O ATOM 608 CB VAL A 142 3.174 -1.293 10.935 1.00 0.00 C ATOM 609 CG1 VAL A 142 1.711 -1.673 10.766 1.00 0.00 C ATOM 610 CG2 VAL A 142 4.068 -2.520 10.834 1.00 0.00 C ATOM 0 H VAL A 142 5.141 0.357 11.159 1.00 0.00 H new ATOM 0 HA VAL A 142 3.635 -0.716 8.908 1.00 0.00 H new ATOM 0 HB VAL A 142 3.299 -0.861 11.928 1.00 0.00 H new ATOM 0 HG11 VAL A 142 1.440 -2.417 11.515 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.088 -0.787 10.892 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.555 -2.087 9.770 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.765 -3.254 11.581 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.977 -2.956 9.839 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.104 -2.231 11.009 1.00 0.00 H new ATOM 620 N VAL A 143 1.946 1.083 8.687 1.00 0.00 N ATOM 621 CA VAL A 143 0.926 2.112 8.525 1.00 0.00 C ATOM 622 C VAL A 143 -0.474 1.523 8.655 1.00 0.00 C ATOM 623 O VAL A 143 -0.777 0.478 8.076 1.00 0.00 O ATOM 624 CB VAL A 143 1.050 2.816 7.161 1.00 0.00 C ATOM 625 CG1 VAL A 143 0.070 3.976 7.067 1.00 0.00 C ATOM 626 CG2 VAL A 143 2.477 3.293 6.937 1.00 0.00 C ATOM 0 H VAL A 143 2.157 0.560 7.837 1.00 0.00 H new ATOM 0 HA VAL A 143 1.085 2.843 9.318 1.00 0.00 H new ATOM 0 HB VAL A 143 0.803 2.100 6.378 1.00 0.00 H new ATOM 0 HG11 VAL A 143 0.172 4.461 6.096 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -0.948 3.603 7.180 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.282 4.697 7.857 1.00 0.00 H new ATOM 0 HG21 VAL A 143 2.547 3.788 5.969 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.754 3.994 7.724 1.00 0.00 H new ATOM 0 HG23 VAL A 143 3.154 2.439 6.958 1.00 0.00 H new ATOM 636 N THR A 144 -1.327 2.199 9.417 1.00 0.00 N ATOM 637 CA THR A 144 -2.696 1.742 9.624 1.00 0.00 C ATOM 638 C THR A 144 -3.700 2.829 9.255 1.00 0.00 C ATOM 639 O THR A 144 -4.768 2.930 9.857 1.00 0.00 O ATOM 640 CB THR A 144 -2.932 1.316 11.085 1.00 0.00 C ATOM 641 OG1 THR A 144 -2.507 2.356 11.973 1.00 0.00 O ATOM 642 CG2 THR A 144 -2.180 0.032 11.402 1.00 0.00 C ATOM 0 H THR A 144 -1.094 3.066 9.902 1.00 0.00 H new ATOM 0 HA THR A 144 -2.843 0.879 8.974 1.00 0.00 H new ATOM 0 HB THR A 144 -3.999 1.137 11.221 1.00 0.00 H new ATOM 0 HG1 THR A 144 -2.662 2.078 12.900 1.00 0.00 H new ATOM 0 HG21 THR A 144 -2.362 -0.249 12.439 1.00 0.00 H new ATOM 0 HG22 THR A 144 -2.527 -0.765 10.744 1.00 0.00 H new ATOM 0 HG23 THR A 144 -1.112 0.189 11.250 1.00 0.00 H new ATOM 650 N ASP A 145 -3.350 3.638 8.262 1.00 0.00 N ATOM 651 CA ASP A 145 -4.221 4.717 7.811 1.00 0.00 C ATOM 652 C ASP A 145 -4.109 4.913 6.302 1.00 0.00 C ATOM 653 O ASP A 145 -3.017 4.920 5.733 1.00 0.00 O ATOM 654 CB ASP A 145 -3.874 6.019 8.535 1.00 0.00 C ATOM 655 CG ASP A 145 -5.060 6.956 8.642 1.00 0.00 C ATOM 656 OD1 ASP A 145 -6.125 6.513 9.119 1.00 0.00 O ATOM 657 OD2 ASP A 145 -4.924 8.134 8.249 1.00 0.00 O ATOM 0 H ASP A 145 -2.469 3.567 7.753 1.00 0.00 H new ATOM 0 HA ASP A 145 -5.249 4.442 8.047 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -3.506 5.788 9.535 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -3.065 6.521 8.005 1.00 0.00 H new ATOM 662 N PRO A 146 -5.262 5.077 5.639 1.00 0.00 N ATOM 663 CA PRO A 146 -5.319 5.275 4.187 1.00 0.00 C ATOM 664 C PRO A 146 -4.771 6.635 3.766 1.00 0.00 C ATOM 665 O PRO A 146 -4.307 6.805 2.640 1.00 0.00 O ATOM 666 CB PRO A 146 -6.814 5.180 3.874 1.00 0.00 C ATOM 667 CG PRO A 146 -7.492 5.566 5.144 1.00 0.00 C ATOM 668 CD PRO A 146 -6.600 5.079 6.254 1.00 0.00 C ATOM 0 HA PRO A 146 -4.711 4.546 3.652 1.00 0.00 H new ATOM 0 HB2 PRO A 146 -7.091 5.848 3.058 1.00 0.00 H new ATOM 0 HB3 PRO A 146 -7.091 4.171 3.568 1.00 0.00 H new ATOM 0 HG2 PRO A 146 -7.631 6.646 5.200 1.00 0.00 H new ATOM 0 HG3 PRO A 146 -8.481 5.114 5.211 1.00 0.00 H new ATOM 0 HD2 PRO A 146 -6.643 5.737 7.122 1.00 0.00 H new ATOM 0 HD3 PRO A 146 -6.888 4.084 6.594 1.00 0.00 H new ATOM 676 N ALA A 147 -4.828 7.599 4.679 1.00 0.00 N ATOM 677 CA ALA A 147 -4.336 8.942 4.403 1.00 0.00 C ATOM 678 C ALA A 147 -2.811 8.973 4.375 1.00 0.00 C ATOM 679 O ALA A 147 -2.204 10.032 4.218 1.00 0.00 O ATOM 680 CB ALA A 147 -4.866 9.922 5.439 1.00 0.00 C ATOM 0 H ALA A 147 -5.210 7.474 5.616 1.00 0.00 H new ATOM 0 HA ALA A 147 -4.698 9.239 3.419 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -4.490 10.921 5.220 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -5.956 9.929 5.409 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -4.533 9.618 6.431 1.00 0.00 H new ATOM 686 N PHE A 148 -2.197 7.804 4.529 1.00 0.00 N ATOM 687 CA PHE A 148 -0.743 7.698 4.523 1.00 0.00 C ATOM 688 C PHE A 148 -0.179 8.029 3.144 1.00 0.00 C ATOM 689 O PHE A 148 -0.543 7.405 2.146 1.00 0.00 O ATOM 690 CB PHE A 148 -0.312 6.289 4.938 1.00 0.00 C ATOM 691 CG PHE A 148 1.172 6.070 4.865 1.00 0.00 C ATOM 692 CD1 PHE A 148 2.037 6.834 5.632 1.00 0.00 C ATOM 693 CD2 PHE A 148 1.702 5.101 4.028 1.00 0.00 C ATOM 694 CE1 PHE A 148 3.403 6.635 5.565 1.00 0.00 C ATOM 695 CE2 PHE A 148 3.067 4.898 3.957 1.00 0.00 C ATOM 696 CZ PHE A 148 3.919 5.664 4.728 1.00 0.00 C ATOM 0 H PHE A 148 -2.684 6.917 4.659 1.00 0.00 H new ATOM 0 HA PHE A 148 -0.348 8.418 5.240 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -0.649 6.100 5.957 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -0.810 5.562 4.297 1.00 0.00 H new ATOM 0 HD1 PHE A 148 1.639 7.593 6.289 1.00 0.00 H new ATOM 0 HD2 PHE A 148 1.041 4.497 3.424 1.00 0.00 H new ATOM 0 HE1 PHE A 148 4.067 7.238 6.167 1.00 0.00 H new ATOM 0 HE2 PHE A 148 3.467 4.141 3.299 1.00 0.00 H new ATOM 0 HZ PHE A 148 4.986 5.505 4.677 1.00 0.00 H new ATOM 706 N LEU A 149 0.712 9.013 3.097 1.00 0.00 N ATOM 707 CA LEU A 149 1.326 9.429 1.841 1.00 0.00 C ATOM 708 C LEU A 149 2.573 8.600 1.545 1.00 0.00 C ATOM 709 O LEU A 149 3.378 8.332 2.436 1.00 0.00 O ATOM 710 CB LEU A 149 1.689 10.914 1.894 1.00 0.00 C ATOM 711 CG LEU A 149 0.513 11.887 1.994 1.00 0.00 C ATOM 712 CD1 LEU A 149 0.991 13.321 1.816 1.00 0.00 C ATOM 713 CD2 LEU A 149 -0.551 11.546 0.962 1.00 0.00 C ATOM 0 H LEU A 149 1.025 9.538 3.914 1.00 0.00 H new ATOM 0 HA LEU A 149 0.604 9.267 1.041 1.00 0.00 H new ATOM 0 HB2 LEU A 149 2.344 11.077 2.750 1.00 0.00 H new ATOM 0 HB3 LEU A 149 2.264 11.160 1.001 1.00 0.00 H new ATOM 0 HG LEU A 149 0.071 11.793 2.986 1.00 0.00 H new ATOM 0 HD11 LEU A 149 0.141 14.000 1.890 1.00 0.00 H new ATOM 0 HD12 LEU A 149 1.717 13.562 2.593 1.00 0.00 H new ATOM 0 HD13 LEU A 149 1.458 13.430 0.837 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.380 12.249 1.048 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.122 11.611 -0.038 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.915 10.533 1.135 1.00 0.00 H new ATOM 725 N VAL A 150 2.726 8.200 0.287 1.00 0.00 N ATOM 726 CA VAL A 150 3.876 7.405 -0.128 1.00 0.00 C ATOM 727 C VAL A 150 4.515 7.979 -1.387 1.00 0.00 C ATOM 728 O VAL A 150 3.833 8.245 -2.378 1.00 0.00 O ATOM 729 CB VAL A 150 3.481 5.940 -0.389 1.00 0.00 C ATOM 730 CG1 VAL A 150 4.685 5.138 -0.859 1.00 0.00 C ATOM 731 CG2 VAL A 150 2.874 5.321 0.863 1.00 0.00 C ATOM 0 H VAL A 150 2.068 8.413 -0.463 1.00 0.00 H new ATOM 0 HA VAL A 150 4.596 7.439 0.690 1.00 0.00 H new ATOM 0 HB VAL A 150 2.730 5.919 -1.179 1.00 0.00 H new ATOM 0 HG11 VAL A 150 4.387 4.105 -1.038 1.00 0.00 H new ATOM 0 HG12 VAL A 150 5.072 5.570 -1.782 1.00 0.00 H new ATOM 0 HG13 VAL A 150 5.461 5.164 -0.094 1.00 0.00 H new ATOM 0 HG21 VAL A 150 2.600 4.285 0.661 1.00 0.00 H new ATOM 0 HG22 VAL A 150 3.602 5.352 1.674 1.00 0.00 H new ATOM 0 HG23 VAL A 150 1.985 5.881 1.152 1.00 0.00 H new ATOM 741 N THR A 151 5.830 8.168 -1.344 1.00 0.00 N ATOM 742 CA THR A 151 6.563 8.710 -2.481 1.00 0.00 C ATOM 743 C THR A 151 6.919 7.616 -3.479 1.00 0.00 C ATOM 744 O THR A 151 7.066 6.450 -3.111 1.00 0.00 O ATOM 745 CB THR A 151 7.855 9.420 -2.030 1.00 0.00 C ATOM 746 OG1 THR A 151 8.701 8.498 -1.334 1.00 0.00 O ATOM 747 CG2 THR A 151 7.537 10.604 -1.131 1.00 0.00 C ATOM 0 H THR A 151 6.410 7.953 -0.533 1.00 0.00 H new ATOM 0 HA THR A 151 5.907 9.436 -2.962 1.00 0.00 H new ATOM 0 HB THR A 151 8.371 9.788 -2.917 1.00 0.00 H new ATOM 0 HG1 THR A 151 9.521 8.955 -1.052 1.00 0.00 H new ATOM 0 HG21 THR A 151 8.464 11.089 -0.826 1.00 0.00 H new ATOM 0 HG22 THR A 151 6.917 11.317 -1.674 1.00 0.00 H new ATOM 0 HG23 THR A 151 7.002 10.257 -0.247 1.00 0.00 H new ATOM 755 N ARG A 152 7.058 7.997 -4.744 1.00 0.00 N ATOM 756 CA ARG A 152 7.396 7.047 -5.797 1.00 0.00 C ATOM 757 C ARG A 152 8.504 6.102 -5.339 1.00 0.00 C ATOM 758 O ARG A 152 8.492 4.913 -5.661 1.00 0.00 O ATOM 759 CB ARG A 152 7.834 7.788 -7.062 1.00 0.00 C ATOM 760 CG ARG A 152 8.044 6.876 -8.259 1.00 0.00 C ATOM 761 CD ARG A 152 6.738 6.602 -8.988 1.00 0.00 C ATOM 762 NE ARG A 152 6.947 6.347 -10.410 1.00 0.00 N ATOM 763 CZ ARG A 152 7.414 5.200 -10.891 1.00 0.00 C ATOM 764 NH1 ARG A 152 7.719 4.207 -10.067 1.00 0.00 N ATOM 765 NH2 ARG A 152 7.578 5.045 -12.198 1.00 0.00 N ATOM 0 H ARG A 152 6.942 8.958 -5.065 1.00 0.00 H new ATOM 0 HA ARG A 152 6.507 6.458 -6.020 1.00 0.00 H new ATOM 0 HB2 ARG A 152 7.082 8.536 -7.313 1.00 0.00 H new ATOM 0 HB3 ARG A 152 8.761 8.324 -6.857 1.00 0.00 H new ATOM 0 HG2 ARG A 152 8.756 7.334 -8.946 1.00 0.00 H new ATOM 0 HG3 ARG A 152 8.481 5.934 -7.928 1.00 0.00 H new ATOM 0 HD2 ARG A 152 6.243 5.743 -8.535 1.00 0.00 H new ATOM 0 HD3 ARG A 152 6.070 7.455 -8.867 1.00 0.00 H new ATOM 0 HE ARG A 152 6.722 7.091 -11.071 1.00 0.00 H new ATOM 0 HH11 ARG A 152 7.595 4.323 -9.061 1.00 0.00 H new ATOM 0 HH12 ARG A 152 8.077 3.327 -10.439 1.00 0.00 H new ATOM 0 HH21 ARG A 152 7.346 5.807 -12.835 1.00 0.00 H new ATOM 0 HH22 ARG A 152 7.937 4.164 -12.566 1.00 0.00 H new ATOM 779 N SER A 153 9.460 6.638 -4.588 1.00 0.00 N ATOM 780 CA SER A 153 10.577 5.844 -4.090 1.00 0.00 C ATOM 781 C SER A 153 10.150 4.991 -2.900 1.00 0.00 C ATOM 782 O SER A 153 10.703 3.918 -2.662 1.00 0.00 O ATOM 783 CB SER A 153 11.739 6.755 -3.688 1.00 0.00 C ATOM 784 OG SER A 153 12.793 6.010 -3.103 1.00 0.00 O ATOM 0 H SER A 153 9.484 7.619 -4.311 1.00 0.00 H new ATOM 0 HA SER A 153 10.904 5.181 -4.891 1.00 0.00 H new ATOM 0 HB2 SER A 153 12.108 7.287 -4.565 1.00 0.00 H new ATOM 0 HB3 SER A 153 11.387 7.508 -2.983 1.00 0.00 H new ATOM 0 HG SER A 153 13.524 6.615 -2.856 1.00 0.00 H new ATOM 790 N MET A 154 9.161 5.476 -2.157 1.00 0.00 N ATOM 791 CA MET A 154 8.657 4.758 -0.992 1.00 0.00 C ATOM 792 C MET A 154 7.700 3.647 -1.410 1.00 0.00 C ATOM 793 O MET A 154 7.558 2.643 -0.714 1.00 0.00 O ATOM 794 CB MET A 154 7.951 5.723 -0.037 1.00 0.00 C ATOM 795 CG MET A 154 7.891 5.223 1.398 1.00 0.00 C ATOM 796 SD MET A 154 9.456 5.429 2.269 1.00 0.00 S ATOM 797 CE MET A 154 9.289 4.196 3.559 1.00 0.00 C ATOM 0 H MET A 154 8.693 6.363 -2.341 1.00 0.00 H new ATOM 0 HA MET A 154 9.507 4.307 -0.479 1.00 0.00 H new ATOM 0 HB2 MET A 154 8.466 6.683 -0.057 1.00 0.00 H new ATOM 0 HB3 MET A 154 6.936 5.898 -0.395 1.00 0.00 H new ATOM 0 HG2 MET A 154 7.108 5.760 1.934 1.00 0.00 H new ATOM 0 HG3 MET A 154 7.614 4.169 1.400 1.00 0.00 H new ATOM 0 HE1 MET A 154 10.182 4.201 4.185 1.00 0.00 H new ATOM 0 HE2 MET A 154 8.416 4.425 4.170 1.00 0.00 H new ATOM 0 HE3 MET A 154 9.168 3.211 3.108 1.00 0.00 H new ATOM 807 N GLU A 155 7.044 3.835 -2.551 1.00 0.00 N ATOM 808 CA GLU A 155 6.099 2.848 -3.061 1.00 0.00 C ATOM 809 C GLU A 155 6.759 1.479 -3.189 1.00 0.00 C ATOM 810 O GLU A 155 6.093 0.446 -3.110 1.00 0.00 O ATOM 811 CB GLU A 155 5.548 3.290 -4.418 1.00 0.00 C ATOM 812 CG GLU A 155 4.727 4.567 -4.354 1.00 0.00 C ATOM 813 CD GLU A 155 4.153 4.960 -5.702 1.00 0.00 C ATOM 814 OE1 GLU A 155 4.936 5.076 -6.669 1.00 0.00 O ATOM 815 OE2 GLU A 155 2.922 5.151 -5.791 1.00 0.00 O ATOM 0 H GLU A 155 7.150 4.661 -3.140 1.00 0.00 H new ATOM 0 HA GLU A 155 5.276 2.770 -2.351 1.00 0.00 H new ATOM 0 HB2 GLU A 155 6.379 3.436 -5.108 1.00 0.00 H new ATOM 0 HB3 GLU A 155 4.930 2.491 -4.828 1.00 0.00 H new ATOM 0 HG2 GLU A 155 3.913 4.436 -3.641 1.00 0.00 H new ATOM 0 HG3 GLU A 155 5.352 5.378 -3.979 1.00 0.00 H new ATOM 822 N ASP A 156 8.073 1.479 -3.389 1.00 0.00 N ATOM 823 CA ASP A 156 8.825 0.237 -3.528 1.00 0.00 C ATOM 824 C ASP A 156 8.924 -0.492 -2.191 1.00 0.00 C ATOM 825 O ASP A 156 9.079 -1.712 -2.148 1.00 0.00 O ATOM 826 CB ASP A 156 10.225 0.522 -4.074 1.00 0.00 C ATOM 827 CG ASP A 156 10.235 0.703 -5.579 1.00 0.00 C ATOM 828 OD1 ASP A 156 9.502 -0.036 -6.269 1.00 0.00 O ATOM 829 OD2 ASP A 156 10.976 1.582 -6.066 1.00 0.00 O ATOM 0 H ASP A 156 8.639 2.325 -3.458 1.00 0.00 H new ATOM 0 HA ASP A 156 8.293 -0.404 -4.231 1.00 0.00 H new ATOM 0 HB2 ASP A 156 10.620 1.421 -3.601 1.00 0.00 H new ATOM 0 HB3 ASP A 156 10.890 -0.299 -3.805 1.00 0.00 H new ATOM 834 N PHE A 157 8.834 0.265 -1.103 1.00 0.00 N ATOM 835 CA PHE A 157 8.916 -0.308 0.236 1.00 0.00 C ATOM 836 C PHE A 157 7.528 -0.662 0.761 1.00 0.00 C ATOM 837 O PHE A 157 7.257 -0.551 1.956 1.00 0.00 O ATOM 838 CB PHE A 157 9.600 0.672 1.192 1.00 0.00 C ATOM 839 CG PHE A 157 11.051 0.901 0.878 1.00 0.00 C ATOM 840 CD1 PHE A 157 11.991 -0.088 1.125 1.00 0.00 C ATOM 841 CD2 PHE A 157 11.476 2.102 0.336 1.00 0.00 C ATOM 842 CE1 PHE A 157 13.327 0.120 0.838 1.00 0.00 C ATOM 843 CE2 PHE A 157 12.811 2.316 0.046 1.00 0.00 C ATOM 844 CZ PHE A 157 13.737 1.323 0.297 1.00 0.00 C ATOM 0 H PHE A 157 8.704 1.277 -1.122 1.00 0.00 H new ATOM 0 HA PHE A 157 9.508 -1.221 0.178 1.00 0.00 H new ATOM 0 HB2 PHE A 157 9.074 1.626 1.159 1.00 0.00 H new ATOM 0 HB3 PHE A 157 9.512 0.295 2.211 1.00 0.00 H new ATOM 0 HD1 PHE A 157 11.676 -1.031 1.546 1.00 0.00 H new ATOM 0 HD2 PHE A 157 10.756 2.882 0.137 1.00 0.00 H new ATOM 0 HE1 PHE A 157 14.050 -0.658 1.037 1.00 0.00 H new ATOM 0 HE2 PHE A 157 13.129 3.258 -0.376 1.00 0.00 H new ATOM 0 HZ PHE A 157 14.780 1.487 0.071 1.00 0.00 H new ATOM 854 N VAL A 158 6.651 -1.089 -0.142 1.00 0.00 N ATOM 855 CA VAL A 158 5.291 -1.461 0.229 1.00 0.00 C ATOM 856 C VAL A 158 5.098 -2.973 0.169 1.00 0.00 C ATOM 857 O VAL A 158 5.281 -3.593 -0.880 1.00 0.00 O ATOM 858 CB VAL A 158 4.254 -0.786 -0.689 1.00 0.00 C ATOM 859 CG1 VAL A 158 2.842 -1.139 -0.248 1.00 0.00 C ATOM 860 CG2 VAL A 158 4.457 0.721 -0.702 1.00 0.00 C ATOM 0 H VAL A 158 6.858 -1.186 -1.136 1.00 0.00 H new ATOM 0 HA VAL A 158 5.138 -1.118 1.252 1.00 0.00 H new ATOM 0 HB VAL A 158 4.395 -1.157 -1.704 1.00 0.00 H new ATOM 0 HG11 VAL A 158 2.123 -0.654 -0.908 1.00 0.00 H new ATOM 0 HG12 VAL A 158 2.706 -2.219 -0.295 1.00 0.00 H new ATOM 0 HG13 VAL A 158 2.684 -0.797 0.775 1.00 0.00 H new ATOM 0 HG21 VAL A 158 3.716 1.182 -1.355 1.00 0.00 H new ATOM 0 HG22 VAL A 158 4.343 1.112 0.309 1.00 0.00 H new ATOM 0 HG23 VAL A 158 5.457 0.950 -1.069 1.00 0.00 H new ATOM 870 N THR A 159 4.728 -3.563 1.301 1.00 0.00 N ATOM 871 CA THR A 159 4.512 -5.001 1.378 1.00 0.00 C ATOM 872 C THR A 159 3.325 -5.331 2.276 1.00 0.00 C ATOM 873 O THR A 159 2.939 -4.532 3.128 1.00 0.00 O ATOM 874 CB THR A 159 5.761 -5.730 1.908 1.00 0.00 C ATOM 875 OG1 THR A 159 5.486 -7.128 2.059 1.00 0.00 O ATOM 876 CG2 THR A 159 6.202 -5.148 3.243 1.00 0.00 C ATOM 0 H THR A 159 4.572 -3.066 2.178 1.00 0.00 H new ATOM 0 HA THR A 159 4.304 -5.344 0.364 1.00 0.00 H new ATOM 0 HB THR A 159 6.567 -5.594 1.186 1.00 0.00 H new ATOM 0 HG1 THR A 159 6.286 -7.584 2.395 1.00 0.00 H new ATOM 0 HG21 THR A 159 7.086 -5.679 3.597 1.00 0.00 H new ATOM 0 HG22 THR A 159 6.439 -4.091 3.119 1.00 0.00 H new ATOM 0 HG23 THR A 159 5.398 -5.256 3.971 1.00 0.00 H new ATOM 884 N TRP A 160 2.752 -6.513 2.080 1.00 0.00 N ATOM 885 CA TRP A 160 1.608 -6.949 2.875 1.00 0.00 C ATOM 886 C TRP A 160 2.065 -7.588 4.181 1.00 0.00 C ATOM 887 O TRP A 160 2.985 -8.405 4.196 1.00 0.00 O ATOM 888 CB TRP A 160 0.757 -7.939 2.079 1.00 0.00 C ATOM 889 CG TRP A 160 -0.032 -7.295 0.979 1.00 0.00 C ATOM 890 CD1 TRP A 160 0.347 -7.148 -0.324 1.00 0.00 C ATOM 891 CD2 TRP A 160 -1.335 -6.710 1.089 1.00 0.00 C ATOM 892 NE1 TRP A 160 -0.641 -6.507 -1.031 1.00 0.00 N ATOM 893 CE2 TRP A 160 -1.683 -6.228 -0.188 1.00 0.00 C ATOM 894 CE3 TRP A 160 -2.241 -6.549 2.140 1.00 0.00 C ATOM 895 CZ2 TRP A 160 -2.898 -5.595 -0.438 1.00 0.00 C ATOM 896 CZ3 TRP A 160 -3.446 -5.921 1.890 1.00 0.00 C ATOM 897 CH2 TRP A 160 -3.767 -5.451 0.609 1.00 0.00 C ATOM 0 H TRP A 160 3.060 -7.186 1.379 1.00 0.00 H new ATOM 0 HA TRP A 160 1.006 -6.072 3.113 1.00 0.00 H new ATOM 0 HB2 TRP A 160 1.406 -8.703 1.651 1.00 0.00 H new ATOM 0 HB3 TRP A 160 0.072 -8.446 2.758 1.00 0.00 H new ATOM 0 HD1 TRP A 160 1.285 -7.486 -0.738 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -0.604 -6.276 -2.024 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -2.004 -6.909 3.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -3.146 -5.230 -1.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.153 -5.790 2.696 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.718 -4.966 0.445 1.00 0.00 H new ATOM 908 N VAL A 161 1.417 -7.210 5.278 1.00 0.00 N ATOM 909 CA VAL A 161 1.756 -7.746 6.591 1.00 0.00 C ATOM 910 C VAL A 161 1.680 -9.269 6.597 1.00 0.00 C ATOM 911 O VAL A 161 2.629 -9.945 6.995 1.00 0.00 O ATOM 912 CB VAL A 161 0.822 -7.192 7.683 1.00 0.00 C ATOM 913 CG1 VAL A 161 1.203 -7.749 9.045 1.00 0.00 C ATOM 914 CG2 VAL A 161 0.855 -5.671 7.691 1.00 0.00 C ATOM 0 H VAL A 161 0.653 -6.534 5.284 1.00 0.00 H new ATOM 0 HA VAL A 161 2.778 -7.434 6.807 1.00 0.00 H new ATOM 0 HB VAL A 161 -0.197 -7.509 7.460 1.00 0.00 H new ATOM 0 HG11 VAL A 161 0.532 -7.346 9.804 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.122 -8.836 9.029 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.229 -7.465 9.280 1.00 0.00 H new ATOM 0 HG21 VAL A 161 0.189 -5.297 8.469 1.00 0.00 H new ATOM 0 HG22 VAL A 161 1.871 -5.330 7.888 1.00 0.00 H new ATOM 0 HG23 VAL A 161 0.528 -5.295 6.722 1.00 0.00 H new ATOM 924 N ASP A 162 0.547 -9.801 6.154 1.00 0.00 N ATOM 925 CA ASP A 162 0.348 -11.245 6.107 1.00 0.00 C ATOM 926 C ASP A 162 0.163 -11.722 4.670 1.00 0.00 C ATOM 927 O ASP A 162 -0.949 -11.714 4.142 1.00 0.00 O ATOM 928 CB ASP A 162 -0.866 -11.641 6.950 1.00 0.00 C ATOM 929 CG ASP A 162 -0.797 -13.080 7.423 1.00 0.00 C ATOM 930 OD1 ASP A 162 0.274 -13.492 7.918 1.00 0.00 O ATOM 931 OD2 ASP A 162 -1.814 -13.794 7.301 1.00 0.00 O ATOM 0 H ASP A 162 -0.248 -9.255 5.822 1.00 0.00 H new ATOM 0 HA ASP A 162 1.237 -11.723 6.517 1.00 0.00 H new ATOM 0 HB2 ASP A 162 -0.936 -10.980 7.814 1.00 0.00 H new ATOM 0 HB3 ASP A 162 -1.774 -11.497 6.364 1.00 0.00 H new ATOM 936 N SER A 163 1.260 -12.135 4.043 1.00 0.00 N ATOM 937 CA SER A 163 1.219 -12.611 2.666 1.00 0.00 C ATOM 938 C SER A 163 1.559 -14.096 2.593 1.00 0.00 C ATOM 939 O SER A 163 2.564 -14.486 1.998 1.00 0.00 O ATOM 940 CB SER A 163 2.193 -11.810 1.798 1.00 0.00 C ATOM 941 OG SER A 163 3.530 -12.000 2.225 1.00 0.00 O ATOM 0 H SER A 163 2.188 -12.149 4.467 1.00 0.00 H new ATOM 0 HA SER A 163 0.206 -12.470 2.289 1.00 0.00 H new ATOM 0 HB2 SER A 163 2.093 -12.116 0.757 1.00 0.00 H new ATOM 0 HB3 SER A 163 1.940 -10.751 1.844 1.00 0.00 H new ATOM 0 HG SER A 163 3.752 -12.954 2.191 1.00 0.00 H new ATOM 947 N SER A 164 0.713 -14.921 3.203 1.00 0.00 N ATOM 948 CA SER A 164 0.926 -16.364 3.212 1.00 0.00 C ATOM 949 C SER A 164 -0.069 -17.064 2.292 1.00 0.00 C ATOM 950 O SER A 164 0.293 -17.971 1.541 1.00 0.00 O ATOM 951 CB SER A 164 0.795 -16.911 4.634 1.00 0.00 C ATOM 952 OG SER A 164 1.381 -18.197 4.743 1.00 0.00 O ATOM 0 H SER A 164 -0.125 -14.615 3.697 1.00 0.00 H new ATOM 0 HA SER A 164 1.934 -16.561 2.847 1.00 0.00 H new ATOM 0 HB2 SER A 164 1.276 -16.229 5.335 1.00 0.00 H new ATOM 0 HB3 SER A 164 -0.258 -16.963 4.911 1.00 0.00 H new ATOM 0 HG SER A 164 1.285 -18.523 5.662 1.00 0.00 H new ATOM 958 N LYS A 165 -1.326 -16.638 2.355 1.00 0.00 N ATOM 959 CA LYS A 165 -2.375 -17.222 1.528 1.00 0.00 C ATOM 960 C LYS A 165 -3.165 -16.137 0.805 1.00 0.00 C ATOM 961 O LYS A 165 -4.358 -15.956 1.051 1.00 0.00 O ATOM 962 CB LYS A 165 -3.318 -18.068 2.386 1.00 0.00 C ATOM 963 CG LYS A 165 -4.333 -18.858 1.578 1.00 0.00 C ATOM 964 CD LYS A 165 -5.132 -19.805 2.457 1.00 0.00 C ATOM 965 CE LYS A 165 -6.114 -20.629 1.640 1.00 0.00 C ATOM 966 NZ LYS A 165 -5.481 -21.856 1.082 1.00 0.00 N ATOM 0 H LYS A 165 -1.643 -15.889 2.971 1.00 0.00 H new ATOM 0 HA LYS A 165 -1.901 -17.860 0.782 1.00 0.00 H new ATOM 0 HB2 LYS A 165 -2.727 -18.759 2.986 1.00 0.00 H new ATOM 0 HB3 LYS A 165 -3.848 -17.415 3.080 1.00 0.00 H new ATOM 0 HG2 LYS A 165 -5.011 -18.170 1.072 1.00 0.00 H new ATOM 0 HG3 LYS A 165 -3.819 -19.426 0.803 1.00 0.00 H new ATOM 0 HD2 LYS A 165 -4.452 -20.470 2.989 1.00 0.00 H new ATOM 0 HD3 LYS A 165 -5.674 -19.234 3.211 1.00 0.00 H new ATOM 0 HE2 LYS A 165 -6.961 -20.910 2.266 1.00 0.00 H new ATOM 0 HE3 LYS A 165 -6.508 -20.021 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 -6.184 -22.390 0.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 -4.689 -21.588 0.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 -5.128 -22.449 1.860 1.00 0.00 H new ATOM 980 N ILE A 166 -2.494 -15.418 -0.088 1.00 0.00 N ATOM 981 CA ILE A 166 -3.134 -14.352 -0.848 1.00 0.00 C ATOM 982 C ILE A 166 -3.628 -14.860 -2.199 1.00 0.00 C ATOM 983 O ILE A 166 -4.802 -14.711 -2.539 1.00 0.00 O ATOM 984 CB ILE A 166 -2.176 -13.168 -1.077 1.00 0.00 C ATOM 985 CG1 ILE A 166 -1.697 -12.606 0.262 1.00 0.00 C ATOM 986 CG2 ILE A 166 -2.858 -12.086 -1.900 1.00 0.00 C ATOM 987 CD1 ILE A 166 -0.665 -11.509 0.123 1.00 0.00 C ATOM 0 H ILE A 166 -1.506 -15.555 -0.303 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.984 -14.011 -0.257 1.00 0.00 H new ATOM 0 HB ILE A 166 -1.308 -13.524 -1.631 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -2.555 -12.219 0.812 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -1.276 -13.416 0.857 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -2.168 -11.256 -2.053 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -3.153 -12.495 -2.866 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -3.742 -11.730 -1.371 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -0.371 -11.158 1.112 1.00 0.00 H new ATOM 0 HD12 ILE A 166 0.210 -11.897 -0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -1.089 -10.681 -0.445 1.00 0.00 H new ATOM 999 N SER A 167 -2.724 -15.463 -2.964 1.00 0.00 N ATOM 1000 CA SER A 167 -3.066 -15.992 -4.279 1.00 0.00 C ATOM 1001 C SER A 167 -2.683 -17.465 -4.389 1.00 0.00 C ATOM 1002 O SER A 167 -1.689 -17.904 -3.811 1.00 0.00 O ATOM 1003 CB SER A 167 -2.365 -15.187 -5.375 1.00 0.00 C ATOM 1004 OG SER A 167 -0.959 -15.348 -5.303 1.00 0.00 O ATOM 0 H SER A 167 -1.749 -15.597 -2.696 1.00 0.00 H new ATOM 0 HA SER A 167 -4.145 -15.905 -4.409 1.00 0.00 H new ATOM 0 HB2 SER A 167 -2.722 -15.510 -6.353 1.00 0.00 H new ATOM 0 HB3 SER A 167 -2.619 -14.132 -5.275 1.00 0.00 H new ATOM 0 HG SER A 167 -0.533 -14.826 -6.014 1.00 0.00 H new ATOM 1010 N GLY A 168 -3.480 -18.224 -5.136 1.00 0.00 N ATOM 1011 CA GLY A 168 -3.208 -19.639 -5.309 1.00 0.00 C ATOM 1012 C GLY A 168 -1.893 -19.895 -6.017 1.00 0.00 C ATOM 1013 O GLY A 168 -1.442 -19.099 -6.841 1.00 0.00 O ATOM 0 H GLY A 168 -4.309 -17.884 -5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -3.192 -20.125 -4.333 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -4.018 -20.094 -5.878 1.00 0.00 H new ATOM 1017 N PRO A 169 -1.253 -21.028 -5.693 1.00 0.00 N ATOM 1018 CA PRO A 169 0.028 -21.413 -6.292 1.00 0.00 C ATOM 1019 C PRO A 169 -0.110 -21.794 -7.762 1.00 0.00 C ATOM 1020 O PRO A 169 0.876 -21.838 -8.498 1.00 0.00 O ATOM 1021 CB PRO A 169 0.458 -22.626 -5.463 1.00 0.00 C ATOM 1022 CG PRO A 169 -0.815 -23.194 -4.937 1.00 0.00 C ATOM 1023 CD PRO A 169 -1.732 -22.024 -4.719 1.00 0.00 C ATOM 0 HA PRO A 169 0.747 -20.594 -6.277 1.00 0.00 H new ATOM 0 HB2 PRO A 169 0.994 -23.353 -6.073 1.00 0.00 H new ATOM 0 HB3 PRO A 169 1.127 -22.335 -4.653 1.00 0.00 H new ATOM 0 HG2 PRO A 169 -1.248 -23.902 -5.644 1.00 0.00 H new ATOM 0 HG3 PRO A 169 -0.645 -23.736 -4.006 1.00 0.00 H new ATOM 0 HD2 PRO A 169 -2.774 -22.291 -4.897 1.00 0.00 H new ATOM 0 HD3 PRO A 169 -1.669 -21.649 -3.697 1.00 0.00 H new ATOM 1031 N SER A 170 -1.340 -22.069 -8.184 1.00 0.00 N ATOM 1032 CA SER A 170 -1.607 -22.451 -9.566 1.00 0.00 C ATOM 1033 C SER A 170 -2.915 -21.836 -10.057 1.00 0.00 C ATOM 1034 O SER A 170 -3.888 -21.742 -9.310 1.00 0.00 O ATOM 1035 CB SER A 170 -1.666 -23.973 -9.695 1.00 0.00 C ATOM 1036 OG SER A 170 -2.837 -24.491 -9.088 1.00 0.00 O ATOM 0 H SER A 170 -2.168 -22.034 -7.589 1.00 0.00 H new ATOM 0 HA SER A 170 -0.793 -22.073 -10.185 1.00 0.00 H new ATOM 0 HB2 SER A 170 -1.644 -24.253 -10.748 1.00 0.00 H new ATOM 0 HB3 SER A 170 -0.785 -24.415 -9.229 1.00 0.00 H new ATOM 0 HG SER A 170 -2.852 -25.466 -9.186 1.00 0.00 H new ATOM 1042 N SER A 171 -2.928 -21.418 -11.319 1.00 0.00 N ATOM 1043 CA SER A 171 -4.114 -20.809 -11.910 1.00 0.00 C ATOM 1044 C SER A 171 -5.381 -21.515 -11.437 1.00 0.00 C ATOM 1045 O SER A 171 -5.429 -22.742 -11.360 1.00 0.00 O ATOM 1046 CB SER A 171 -4.031 -20.855 -13.436 1.00 0.00 C ATOM 1047 OG SER A 171 -5.164 -20.244 -14.027 1.00 0.00 O ATOM 0 H SER A 171 -2.131 -21.490 -11.951 1.00 0.00 H new ATOM 0 HA SER A 171 -4.156 -19.769 -11.587 1.00 0.00 H new ATOM 0 HB2 SER A 171 -3.125 -20.348 -13.769 1.00 0.00 H new ATOM 0 HB3 SER A 171 -3.958 -21.891 -13.768 1.00 0.00 H new ATOM 0 HG SER A 171 -5.086 -20.285 -15.003 1.00 0.00 H new ATOM 1053 N GLY A 172 -6.406 -20.730 -11.118 1.00 0.00 N ATOM 1054 CA GLY A 172 -7.660 -21.297 -10.656 1.00 0.00 C ATOM 1055 C GLY A 172 -8.240 -20.539 -9.480 1.00 0.00 C ATOM 1056 O GLY A 172 -8.631 -19.379 -9.612 1.00 0.00 O ATOM 0 H GLY A 172 -6.390 -19.712 -11.171 1.00 0.00 H new ATOM 0 HA2 GLY A 172 -8.379 -21.296 -11.475 1.00 0.00 H new ATOM 0 HA3 GLY A 172 -7.502 -22.337 -10.372 1.00 0.00 H new TER 1060 GLY A 172