USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 555 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 91 GLN : amide:sc= -4.73! C(o=-4.5!,f=-6!) USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= 0.221 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0539 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0.0549 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 162:sc= -0.834 (180deg=-1.86!) USER MOD Single : A 111 THR OG1 : rot 43:sc= 0.00175 USER MOD Single : A 116 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.0904) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 ASN : amide:sc= -1.39 K(o=-1.4,f=-7.5!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 GLN : amide:sc= -0.31 X(o=-0.31,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 80 177.440 15.857 -8.322 1.00 0.00 N ATOM 2 CA LYS A 80 176.141 16.405 -8.808 1.00 0.00 C ATOM 3 C LYS A 80 175.004 16.005 -7.861 1.00 0.00 C ATOM 4 O LYS A 80 174.021 16.705 -7.712 1.00 0.00 O ATOM 5 CB LYS A 80 175.937 15.777 -10.188 1.00 0.00 C ATOM 6 CG LYS A 80 174.890 16.579 -10.964 1.00 0.00 C ATOM 7 CD LYS A 80 175.133 16.421 -12.466 1.00 0.00 C ATOM 8 CE LYS A 80 174.448 15.149 -12.965 1.00 0.00 C ATOM 9 NZ LYS A 80 174.076 15.443 -14.378 1.00 0.00 N ATOM 0 HA LYS A 80 176.145 17.494 -8.852 1.00 0.00 H new ATOM 0 HB2 LYS A 80 176.879 15.763 -10.736 1.00 0.00 H new ATOM 0 HB3 LYS A 80 175.613 14.741 -10.084 1.00 0.00 H new ATOM 0 HG2 LYS A 80 173.889 16.232 -10.709 1.00 0.00 H new ATOM 0 HG3 LYS A 80 174.943 17.631 -10.685 1.00 0.00 H new ATOM 0 HD2 LYS A 80 174.746 17.288 -13.001 1.00 0.00 H new ATOM 0 HD3 LYS A 80 176.203 16.373 -12.669 1.00 0.00 H new ATOM 0 HE2 LYS A 80 175.116 14.290 -12.903 1.00 0.00 H new ATOM 0 HE3 LYS A 80 173.569 14.913 -12.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 173.600 14.616 -14.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 173.434 16.261 -14.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 174.934 15.658 -14.925 1.00 0.00 H new ATOM 23 N ALA A 81 175.148 14.873 -7.221 1.00 0.00 N ATOM 24 CA ALA A 81 174.107 14.384 -6.270 1.00 0.00 C ATOM 25 C ALA A 81 174.590 14.551 -4.826 1.00 0.00 C ATOM 26 O ALA A 81 175.770 14.711 -4.579 1.00 0.00 O ATOM 27 CB ALA A 81 173.956 12.898 -6.600 1.00 0.00 C ATOM 0 H ALA A 81 175.956 14.258 -7.319 1.00 0.00 H new ATOM 0 HA ALA A 81 173.170 14.932 -6.362 1.00 0.00 H new ATOM 0 HB1 ALA A 81 173.206 12.454 -5.945 1.00 0.00 H new ATOM 0 HB2 ALA A 81 173.643 12.786 -7.638 1.00 0.00 H new ATOM 0 HB3 ALA A 81 174.911 12.394 -6.452 1.00 0.00 H new ATOM 33 N LYS A 82 173.690 14.533 -3.874 1.00 0.00 N ATOM 34 CA LYS A 82 174.099 14.712 -2.452 1.00 0.00 C ATOM 35 C LYS A 82 173.959 13.406 -1.667 1.00 0.00 C ATOM 36 O LYS A 82 173.281 12.482 -2.071 1.00 0.00 O ATOM 37 CB LYS A 82 173.148 15.773 -1.899 1.00 0.00 C ATOM 38 CG LYS A 82 173.373 17.093 -2.641 1.00 0.00 C ATOM 39 CD LYS A 82 172.423 18.159 -2.090 1.00 0.00 C ATOM 40 CE LYS A 82 172.650 19.478 -2.832 1.00 0.00 C ATOM 41 NZ LYS A 82 172.259 20.537 -1.861 1.00 0.00 N ATOM 0 H LYS A 82 172.690 14.402 -4.023 1.00 0.00 H new ATOM 0 HA LYS A 82 175.145 15.008 -2.368 1.00 0.00 H new ATOM 0 HB2 LYS A 82 172.114 15.448 -2.017 1.00 0.00 H new ATOM 0 HB3 LYS A 82 173.319 15.909 -0.831 1.00 0.00 H new ATOM 0 HG2 LYS A 82 174.407 17.417 -2.523 1.00 0.00 H new ATOM 0 HG3 LYS A 82 173.202 16.956 -3.709 1.00 0.00 H new ATOM 0 HD2 LYS A 82 171.389 17.836 -2.209 1.00 0.00 H new ATOM 0 HD3 LYS A 82 172.593 18.296 -1.022 1.00 0.00 H new ATOM 0 HE2 LYS A 82 173.691 19.586 -3.136 1.00 0.00 H new ATOM 0 HE3 LYS A 82 172.046 19.530 -3.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 172.387 21.472 -2.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 171.261 20.413 -1.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 172.855 20.467 -1.012 1.00 0.00 H new ATOM 55 N THR A 83 174.620 13.345 -0.535 1.00 0.00 N ATOM 56 CA THR A 83 174.566 12.116 0.323 1.00 0.00 C ATOM 57 C THR A 83 173.105 11.705 0.550 1.00 0.00 C ATOM 58 O THR A 83 172.787 10.543 0.699 1.00 0.00 O ATOM 59 CB THR A 83 175.221 12.526 1.644 1.00 0.00 C ATOM 60 OG1 THR A 83 176.394 13.281 1.373 1.00 0.00 O ATOM 61 CG2 THR A 83 175.592 11.277 2.445 1.00 0.00 C ATOM 0 H THR A 83 175.199 14.099 -0.165 1.00 0.00 H new ATOM 0 HA THR A 83 175.073 11.265 -0.133 1.00 0.00 H new ATOM 0 HB THR A 83 174.522 13.130 2.223 1.00 0.00 H new ATOM 0 HG1 THR A 83 176.815 13.546 2.217 1.00 0.00 H new ATOM 0 HG21 THR A 83 176.058 11.573 3.385 1.00 0.00 H new ATOM 0 HG22 THR A 83 174.693 10.697 2.653 1.00 0.00 H new ATOM 0 HG23 THR A 83 176.290 10.670 1.869 1.00 0.00 H new ATOM 69 N GLU A 84 172.224 12.670 0.567 1.00 0.00 N ATOM 70 CA GLU A 84 170.768 12.384 0.774 1.00 0.00 C ATOM 71 C GLU A 84 170.268 11.322 -0.213 1.00 0.00 C ATOM 72 O GLU A 84 169.437 10.498 0.121 1.00 0.00 O ATOM 73 CB GLU A 84 170.072 13.717 0.494 1.00 0.00 C ATOM 74 CG GLU A 84 170.396 14.708 1.615 1.00 0.00 C ATOM 75 CD GLU A 84 169.720 16.049 1.322 1.00 0.00 C ATOM 76 OE1 GLU A 84 170.314 16.847 0.616 1.00 0.00 O ATOM 77 OE2 GLU A 84 168.620 16.254 1.808 1.00 0.00 O ATOM 0 H GLU A 84 172.451 13.657 0.445 1.00 0.00 H new ATOM 0 HA GLU A 84 170.570 12.000 1.775 1.00 0.00 H new ATOM 0 HB2 GLU A 84 170.401 14.117 -0.465 1.00 0.00 H new ATOM 0 HB3 GLU A 84 168.994 13.569 0.425 1.00 0.00 H new ATOM 0 HG2 GLU A 84 170.051 14.316 2.572 1.00 0.00 H new ATOM 0 HG3 GLU A 84 171.475 14.842 1.696 1.00 0.00 H new ATOM 84 N ASP A 85 170.769 11.339 -1.420 1.00 0.00 N ATOM 85 CA ASP A 85 170.323 10.332 -2.433 1.00 0.00 C ATOM 86 C ASP A 85 170.663 8.919 -1.949 1.00 0.00 C ATOM 87 O ASP A 85 169.830 8.033 -1.947 1.00 0.00 O ATOM 88 CB ASP A 85 171.102 10.669 -3.706 1.00 0.00 C ATOM 89 CG ASP A 85 170.584 9.817 -4.866 1.00 0.00 C ATOM 90 OD1 ASP A 85 169.392 9.556 -4.897 1.00 0.00 O ATOM 91 OD2 ASP A 85 171.387 9.440 -5.704 1.00 0.00 O ATOM 0 H ASP A 85 171.467 12.005 -1.750 1.00 0.00 H new ATOM 0 HA ASP A 85 169.247 10.363 -2.601 1.00 0.00 H new ATOM 0 HB2 ASP A 85 170.992 11.728 -3.942 1.00 0.00 H new ATOM 0 HB3 ASP A 85 172.165 10.485 -3.553 1.00 0.00 H new ATOM 96 N PHE A 86 171.887 8.712 -1.540 1.00 0.00 N ATOM 97 CA PHE A 86 172.309 7.364 -1.050 1.00 0.00 C ATOM 98 C PHE A 86 171.774 7.093 0.360 1.00 0.00 C ATOM 99 O PHE A 86 171.373 5.986 0.670 1.00 0.00 O ATOM 100 CB PHE A 86 173.843 7.404 -1.030 1.00 0.00 C ATOM 101 CG PHE A 86 174.399 7.020 -2.387 1.00 0.00 C ATOM 102 CD1 PHE A 86 173.937 5.869 -3.044 1.00 0.00 C ATOM 103 CD2 PHE A 86 175.382 7.817 -2.988 1.00 0.00 C ATOM 104 CE1 PHE A 86 174.456 5.519 -4.296 1.00 0.00 C ATOM 105 CE2 PHE A 86 175.899 7.466 -4.241 1.00 0.00 C ATOM 106 CZ PHE A 86 175.437 6.318 -4.895 1.00 0.00 C ATOM 0 H PHE A 86 172.618 9.423 -1.524 1.00 0.00 H new ATOM 0 HA PHE A 86 171.920 6.571 -1.689 1.00 0.00 H new ATOM 0 HB2 PHE A 86 174.184 8.404 -0.760 1.00 0.00 H new ATOM 0 HB3 PHE A 86 174.221 6.722 -0.269 1.00 0.00 H new ATOM 0 HD1 PHE A 86 173.180 5.252 -2.583 1.00 0.00 H new ATOM 0 HD2 PHE A 86 175.741 8.702 -2.485 1.00 0.00 H new ATOM 0 HE1 PHE A 86 174.100 4.633 -4.800 1.00 0.00 H new ATOM 0 HE2 PHE A 86 176.656 8.082 -4.704 1.00 0.00 H new ATOM 0 HZ PHE A 86 175.837 6.049 -5.861 1.00 0.00 H new ATOM 116 N VAL A 87 171.786 8.079 1.224 1.00 0.00 N ATOM 117 CA VAL A 87 171.301 7.854 2.623 1.00 0.00 C ATOM 118 C VAL A 87 169.821 7.442 2.616 1.00 0.00 C ATOM 119 O VAL A 87 169.438 6.472 3.242 1.00 0.00 O ATOM 120 CB VAL A 87 171.493 9.199 3.333 1.00 0.00 C ATOM 121 CG1 VAL A 87 170.995 9.102 4.779 1.00 0.00 C ATOM 122 CG2 VAL A 87 172.981 9.562 3.336 1.00 0.00 C ATOM 0 H VAL A 87 172.109 9.025 1.023 1.00 0.00 H new ATOM 0 HA VAL A 87 171.844 7.053 3.125 1.00 0.00 H new ATOM 0 HB VAL A 87 170.925 9.966 2.807 1.00 0.00 H new ATOM 0 HG11 VAL A 87 171.135 10.061 5.277 1.00 0.00 H new ATOM 0 HG12 VAL A 87 169.936 8.842 4.783 1.00 0.00 H new ATOM 0 HG13 VAL A 87 171.559 8.333 5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 87 173.121 10.518 3.840 1.00 0.00 H new ATOM 0 HG22 VAL A 87 173.543 8.789 3.861 1.00 0.00 H new ATOM 0 HG23 VAL A 87 173.339 9.637 2.309 1.00 0.00 H new ATOM 132 N LYS A 88 168.992 8.180 1.924 1.00 0.00 N ATOM 133 CA LYS A 88 167.532 7.848 1.883 1.00 0.00 C ATOM 134 C LYS A 88 167.309 6.429 1.350 1.00 0.00 C ATOM 135 O LYS A 88 166.372 5.752 1.728 1.00 0.00 O ATOM 136 CB LYS A 88 166.912 8.876 0.935 1.00 0.00 C ATOM 137 CG LYS A 88 165.390 8.728 0.944 1.00 0.00 C ATOM 138 CD LYS A 88 164.770 9.764 0.005 1.00 0.00 C ATOM 139 CE LYS A 88 164.905 11.158 0.621 1.00 0.00 C ATOM 140 NZ LYS A 88 163.911 11.998 -0.104 1.00 0.00 N ATOM 0 H LYS A 88 169.262 9.001 1.383 1.00 0.00 H new ATOM 0 HA LYS A 88 167.084 7.882 2.876 1.00 0.00 H new ATOM 0 HB2 LYS A 88 167.191 9.884 1.242 1.00 0.00 H new ATOM 0 HB3 LYS A 88 167.296 8.732 -0.075 1.00 0.00 H new ATOM 0 HG2 LYS A 88 165.110 7.723 0.629 1.00 0.00 H new ATOM 0 HG3 LYS A 88 165.007 8.863 1.955 1.00 0.00 H new ATOM 0 HD2 LYS A 88 165.266 9.734 -0.965 1.00 0.00 H new ATOM 0 HD3 LYS A 88 163.719 9.531 -0.167 1.00 0.00 H new ATOM 0 HE2 LYS A 88 164.699 11.138 1.691 1.00 0.00 H new ATOM 0 HE3 LYS A 88 165.916 11.548 0.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 163.944 12.970 0.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 164.136 12.004 -1.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 162.958 11.607 0.037 1.00 0.00 H new ATOM 154 N ALA A 89 168.154 5.989 0.455 1.00 0.00 N ATOM 155 CA ALA A 89 167.994 4.624 -0.140 1.00 0.00 C ATOM 156 C ALA A 89 168.113 3.522 0.919 1.00 0.00 C ATOM 157 O ALA A 89 167.214 2.718 1.078 1.00 0.00 O ATOM 158 CB ALA A 89 169.122 4.499 -1.165 1.00 0.00 C ATOM 0 H ALA A 89 168.954 6.518 0.107 1.00 0.00 H new ATOM 0 HA ALA A 89 167.007 4.505 -0.587 1.00 0.00 H new ATOM 0 HB1 ALA A 89 169.071 3.522 -1.645 1.00 0.00 H new ATOM 0 HB2 ALA A 89 169.017 5.279 -1.919 1.00 0.00 H new ATOM 0 HB3 ALA A 89 170.083 4.607 -0.663 1.00 0.00 H new ATOM 164 N PHE A 90 169.216 3.452 1.618 1.00 0.00 N ATOM 165 CA PHE A 90 169.392 2.374 2.646 1.00 0.00 C ATOM 166 C PHE A 90 168.647 2.693 3.952 1.00 0.00 C ATOM 167 O PHE A 90 167.878 1.891 4.448 1.00 0.00 O ATOM 168 CB PHE A 90 170.901 2.308 2.895 1.00 0.00 C ATOM 169 CG PHE A 90 171.605 1.924 1.615 1.00 0.00 C ATOM 170 CD1 PHE A 90 171.617 0.588 1.197 1.00 0.00 C ATOM 171 CD2 PHE A 90 172.241 2.905 0.844 1.00 0.00 C ATOM 172 CE1 PHE A 90 172.265 0.234 0.008 1.00 0.00 C ATOM 173 CE2 PHE A 90 172.890 2.550 -0.345 1.00 0.00 C ATOM 174 CZ PHE A 90 172.902 1.214 -0.762 1.00 0.00 C ATOM 0 H PHE A 90 170.004 4.093 1.524 1.00 0.00 H new ATOM 0 HA PHE A 90 168.981 1.427 2.295 1.00 0.00 H new ATOM 0 HB2 PHE A 90 171.265 3.273 3.248 1.00 0.00 H new ATOM 0 HB3 PHE A 90 171.120 1.580 3.676 1.00 0.00 H new ATOM 0 HD1 PHE A 90 171.127 -0.169 1.791 1.00 0.00 H new ATOM 0 HD2 PHE A 90 172.231 3.936 1.167 1.00 0.00 H new ATOM 0 HE1 PHE A 90 172.274 -0.796 -0.316 1.00 0.00 H new ATOM 0 HE2 PHE A 90 173.381 3.306 -0.940 1.00 0.00 H new ATOM 0 HZ PHE A 90 173.403 0.939 -1.678 1.00 0.00 H new ATOM 184 N GLN A 91 168.925 3.827 4.543 1.00 0.00 N ATOM 185 CA GLN A 91 168.302 4.184 5.863 1.00 0.00 C ATOM 186 C GLN A 91 166.785 3.976 5.879 1.00 0.00 C ATOM 187 O GLN A 91 166.234 3.545 6.876 1.00 0.00 O ATOM 188 CB GLN A 91 168.626 5.664 6.069 1.00 0.00 C ATOM 189 CG GLN A 91 170.121 5.827 6.344 1.00 0.00 C ATOM 190 CD GLN A 91 170.364 7.155 7.062 1.00 0.00 C ATOM 191 OE1 GLN A 91 169.600 8.089 6.911 1.00 0.00 O ATOM 192 NE2 GLN A 91 171.403 7.281 7.843 1.00 0.00 N ATOM 0 H GLN A 91 169.562 4.530 4.168 1.00 0.00 H new ATOM 0 HA GLN A 91 168.694 3.544 6.653 1.00 0.00 H new ATOM 0 HB2 GLN A 91 168.344 6.235 5.184 1.00 0.00 H new ATOM 0 HB3 GLN A 91 168.047 6.061 6.903 1.00 0.00 H new ATOM 0 HG2 GLN A 91 170.482 4.999 6.955 1.00 0.00 H new ATOM 0 HG3 GLN A 91 170.679 5.800 5.408 1.00 0.00 H new ATOM 0 HE21 GLN A 91 172.044 6.498 7.970 1.00 0.00 H new ATOM 0 HE22 GLN A 91 171.574 8.163 8.326 1.00 0.00 H new ATOM 201 N VAL A 92 166.097 4.282 4.807 1.00 0.00 N ATOM 202 CA VAL A 92 164.607 4.100 4.802 1.00 0.00 C ATOM 203 C VAL A 92 164.248 2.642 5.140 1.00 0.00 C ATOM 204 O VAL A 92 163.303 2.381 5.863 1.00 0.00 O ATOM 205 CB VAL A 92 164.155 4.477 3.386 1.00 0.00 C ATOM 206 CG1 VAL A 92 164.823 3.557 2.364 1.00 0.00 C ATOM 207 CG2 VAL A 92 162.638 4.335 3.281 1.00 0.00 C ATOM 0 H VAL A 92 166.495 4.647 3.942 1.00 0.00 H new ATOM 0 HA VAL A 92 164.111 4.719 5.550 1.00 0.00 H new ATOM 0 HB VAL A 92 164.442 5.509 3.182 1.00 0.00 H new ATOM 0 HG11 VAL A 92 164.497 3.831 1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 92 165.906 3.660 2.435 1.00 0.00 H new ATOM 0 HG13 VAL A 92 164.543 2.523 2.567 1.00 0.00 H new ATOM 0 HG21 VAL A 92 162.316 4.603 2.275 1.00 0.00 H new ATOM 0 HG22 VAL A 92 162.354 3.304 3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 92 162.160 4.997 4.003 1.00 0.00 H new ATOM 217 N PHE A 93 165.011 1.700 4.646 1.00 0.00 N ATOM 218 CA PHE A 93 164.734 0.264 4.962 1.00 0.00 C ATOM 219 C PHE A 93 164.996 0.024 6.452 1.00 0.00 C ATOM 220 O PHE A 93 164.243 -0.667 7.108 1.00 0.00 O ATOM 221 CB PHE A 93 165.713 -0.535 4.101 1.00 0.00 C ATOM 222 CG PHE A 93 165.115 -0.749 2.732 1.00 0.00 C ATOM 223 CD1 PHE A 93 165.234 0.245 1.753 1.00 0.00 C ATOM 224 CD2 PHE A 93 164.440 -1.940 2.440 1.00 0.00 C ATOM 225 CE1 PHE A 93 164.677 0.048 0.483 1.00 0.00 C ATOM 226 CE2 PHE A 93 163.883 -2.137 1.171 1.00 0.00 C ATOM 227 CZ PHE A 93 164.002 -1.143 0.192 1.00 0.00 C ATOM 0 H PHE A 93 165.814 1.862 4.038 1.00 0.00 H new ATOM 0 HA PHE A 93 163.704 -0.026 4.757 1.00 0.00 H new ATOM 0 HB2 PHE A 93 166.660 -0.002 4.017 1.00 0.00 H new ATOM 0 HB3 PHE A 93 165.928 -1.495 4.570 1.00 0.00 H new ATOM 0 HD1 PHE A 93 165.755 1.164 1.977 1.00 0.00 H new ATOM 0 HD2 PHE A 93 164.349 -2.707 3.194 1.00 0.00 H new ATOM 0 HE1 PHE A 93 164.768 0.815 -0.272 1.00 0.00 H new ATOM 0 HE2 PHE A 93 163.361 -3.056 0.947 1.00 0.00 H new ATOM 0 HZ PHE A 93 163.573 -1.295 -0.787 1.00 0.00 H new ATOM 237 N ASP A 94 166.063 0.569 6.985 1.00 0.00 N ATOM 238 CA ASP A 94 166.384 0.356 8.436 1.00 0.00 C ATOM 239 C ASP A 94 165.260 0.870 9.344 1.00 0.00 C ATOM 240 O ASP A 94 165.317 1.972 9.856 1.00 0.00 O ATOM 241 CB ASP A 94 167.670 1.149 8.684 1.00 0.00 C ATOM 242 CG ASP A 94 168.885 0.246 8.456 1.00 0.00 C ATOM 243 OD1 ASP A 94 168.784 -0.937 8.739 1.00 0.00 O ATOM 244 OD2 ASP A 94 169.898 0.754 8.002 1.00 0.00 O ATOM 0 H ASP A 94 166.728 1.154 6.479 1.00 0.00 H new ATOM 0 HA ASP A 94 166.498 -0.704 8.662 1.00 0.00 H new ATOM 0 HB2 ASP A 94 167.713 2.009 8.015 1.00 0.00 H new ATOM 0 HB3 ASP A 94 167.679 1.537 9.703 1.00 0.00 H new ATOM 249 N LYS A 95 164.242 0.072 9.545 1.00 0.00 N ATOM 250 CA LYS A 95 163.106 0.492 10.422 1.00 0.00 C ATOM 251 C LYS A 95 163.555 0.576 11.889 1.00 0.00 C ATOM 252 O LYS A 95 162.893 1.189 12.706 1.00 0.00 O ATOM 253 CB LYS A 95 162.043 -0.596 10.253 1.00 0.00 C ATOM 254 CG LYS A 95 161.450 -0.519 8.846 1.00 0.00 C ATOM 255 CD LYS A 95 160.597 0.746 8.721 1.00 0.00 C ATOM 256 CE LYS A 95 159.821 0.710 7.403 1.00 0.00 C ATOM 257 NZ LYS A 95 159.302 2.095 7.226 1.00 0.00 N ATOM 0 H LYS A 95 164.148 -0.858 9.137 1.00 0.00 H new ATOM 0 HA LYS A 95 162.730 1.478 10.151 1.00 0.00 H new ATOM 0 HB2 LYS A 95 162.484 -1.579 10.419 1.00 0.00 H new ATOM 0 HB3 LYS A 95 161.257 -0.469 10.997 1.00 0.00 H new ATOM 0 HG2 LYS A 95 162.248 -0.507 8.104 1.00 0.00 H new ATOM 0 HG3 LYS A 95 160.842 -1.402 8.647 1.00 0.00 H new ATOM 0 HD2 LYS A 95 159.905 0.816 9.561 1.00 0.00 H new ATOM 0 HD3 LYS A 95 161.232 1.631 8.757 1.00 0.00 H new ATOM 0 HE2 LYS A 95 160.465 0.420 6.573 1.00 0.00 H new ATOM 0 HE3 LYS A 95 159.008 -0.015 7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 158.757 2.151 6.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 158.687 2.340 8.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 160.099 2.762 7.185 1.00 0.00 H new ATOM 271 N GLU A 96 164.674 -0.022 12.227 1.00 0.00 N ATOM 272 CA GLU A 96 165.161 0.041 13.639 1.00 0.00 C ATOM 273 C GLU A 96 166.466 0.847 13.721 1.00 0.00 C ATOM 274 O GLU A 96 167.158 0.813 14.719 1.00 0.00 O ATOM 275 CB GLU A 96 165.399 -1.415 14.046 1.00 0.00 C ATOM 276 CG GLU A 96 164.083 -2.192 13.964 1.00 0.00 C ATOM 277 CD GLU A 96 164.258 -3.577 14.595 1.00 0.00 C ATOM 278 OE1 GLU A 96 165.059 -3.695 15.509 1.00 0.00 O ATOM 279 OE2 GLU A 96 163.589 -4.495 14.153 1.00 0.00 O ATOM 0 H GLU A 96 165.268 -0.549 11.587 1.00 0.00 H new ATOM 0 HA GLU A 96 164.446 0.534 14.297 1.00 0.00 H new ATOM 0 HB2 GLU A 96 166.143 -1.869 13.391 1.00 0.00 H new ATOM 0 HB3 GLU A 96 165.797 -1.460 15.060 1.00 0.00 H new ATOM 0 HG2 GLU A 96 163.294 -1.644 14.480 1.00 0.00 H new ATOM 0 HG3 GLU A 96 163.774 -2.293 12.924 1.00 0.00 H new ATOM 286 N SER A 97 166.782 1.601 12.689 1.00 0.00 N ATOM 287 CA SER A 97 168.013 2.462 12.665 1.00 0.00 C ATOM 288 C SER A 97 169.238 1.826 13.341 1.00 0.00 C ATOM 289 O SER A 97 170.015 2.515 13.977 1.00 0.00 O ATOM 290 CB SER A 97 167.609 3.744 13.389 1.00 0.00 C ATOM 291 OG SER A 97 168.292 4.846 12.807 1.00 0.00 O ATOM 0 H SER A 97 166.221 1.656 11.839 1.00 0.00 H new ATOM 0 HA SER A 97 168.331 2.625 11.635 1.00 0.00 H new ATOM 0 HB2 SER A 97 166.531 3.891 13.319 1.00 0.00 H new ATOM 0 HB3 SER A 97 167.852 3.669 14.449 1.00 0.00 H new ATOM 0 HG SER A 97 168.034 5.671 13.268 1.00 0.00 H new ATOM 297 N THR A 98 169.429 0.534 13.209 1.00 0.00 N ATOM 298 CA THR A 98 170.622 -0.100 13.854 1.00 0.00 C ATOM 299 C THR A 98 171.906 0.467 13.233 1.00 0.00 C ATOM 300 O THR A 98 172.911 0.623 13.901 1.00 0.00 O ATOM 301 CB THR A 98 170.492 -1.613 13.608 1.00 0.00 C ATOM 302 OG1 THR A 98 171.653 -2.265 14.100 1.00 0.00 O ATOM 303 CG2 THR A 98 170.340 -1.915 12.113 1.00 0.00 C ATOM 0 H THR A 98 168.821 -0.100 12.691 1.00 0.00 H new ATOM 0 HA THR A 98 170.670 0.105 14.924 1.00 0.00 H new ATOM 0 HB THR A 98 169.604 -1.975 14.126 1.00 0.00 H new ATOM 0 HG1 THR A 98 171.576 -3.230 13.948 1.00 0.00 H new ATOM 0 HG21 THR A 98 170.250 -2.991 11.967 1.00 0.00 H new ATOM 0 HG22 THR A 98 169.447 -1.421 11.731 1.00 0.00 H new ATOM 0 HG23 THR A 98 171.215 -1.548 11.577 1.00 0.00 H new ATOM 311 N GLY A 99 171.871 0.796 11.964 1.00 0.00 N ATOM 312 CA GLY A 99 173.076 1.377 11.298 1.00 0.00 C ATOM 313 C GLY A 99 173.899 0.288 10.596 1.00 0.00 C ATOM 314 O GLY A 99 175.029 0.521 10.209 1.00 0.00 O ATOM 0 H GLY A 99 171.056 0.686 11.360 1.00 0.00 H new ATOM 0 HA2 GLY A 99 172.767 2.128 10.571 1.00 0.00 H new ATOM 0 HA3 GLY A 99 173.695 1.885 12.038 1.00 0.00 H new ATOM 318 N LYS A 100 173.355 -0.895 10.425 1.00 0.00 N ATOM 319 CA LYS A 100 174.125 -1.982 9.748 1.00 0.00 C ATOM 320 C LYS A 100 173.260 -2.665 8.684 1.00 0.00 C ATOM 321 O LYS A 100 172.048 -2.687 8.786 1.00 0.00 O ATOM 322 CB LYS A 100 174.472 -2.968 10.863 1.00 0.00 C ATOM 323 CG LYS A 100 175.822 -2.587 11.483 1.00 0.00 C ATOM 324 CD LYS A 100 175.748 -2.739 13.004 1.00 0.00 C ATOM 325 CE LYS A 100 175.929 -4.211 13.383 1.00 0.00 C ATOM 326 NZ LYS A 100 174.955 -4.445 14.486 1.00 0.00 N ATOM 0 H LYS A 100 172.414 -1.152 10.725 1.00 0.00 H new ATOM 0 HA LYS A 100 175.012 -1.604 9.240 1.00 0.00 H new ATOM 0 HB2 LYS A 100 173.694 -2.958 11.626 1.00 0.00 H new ATOM 0 HB3 LYS A 100 174.516 -3.982 10.465 1.00 0.00 H new ATOM 0 HG2 LYS A 100 176.611 -3.223 11.082 1.00 0.00 H new ATOM 0 HG3 LYS A 100 176.077 -1.560 11.222 1.00 0.00 H new ATOM 0 HD2 LYS A 100 176.521 -2.133 13.478 1.00 0.00 H new ATOM 0 HD3 LYS A 100 174.788 -2.374 13.370 1.00 0.00 H new ATOM 0 HE2 LYS A 100 175.729 -4.865 12.534 1.00 0.00 H new ATOM 0 HE3 LYS A 100 176.950 -4.413 13.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 175.018 -5.434 14.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 175.174 -3.813 15.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 173.992 -4.251 14.145 1.00 0.00 H new ATOM 340 N VAL A 101 173.869 -3.234 7.672 1.00 0.00 N ATOM 341 CA VAL A 101 173.073 -3.931 6.612 1.00 0.00 C ATOM 342 C VAL A 101 173.890 -5.078 6.010 1.00 0.00 C ATOM 343 O VAL A 101 175.102 -5.104 6.103 1.00 0.00 O ATOM 344 CB VAL A 101 172.765 -2.865 5.551 1.00 0.00 C ATOM 345 CG1 VAL A 101 171.909 -1.759 6.169 1.00 0.00 C ATOM 346 CG2 VAL A 101 174.072 -2.262 5.027 1.00 0.00 C ATOM 0 H VAL A 101 174.880 -3.246 7.534 1.00 0.00 H new ATOM 0 HA VAL A 101 172.157 -4.366 7.011 1.00 0.00 H new ATOM 0 HB VAL A 101 172.224 -3.328 4.726 1.00 0.00 H new ATOM 0 HG11 VAL A 101 171.691 -1.003 5.415 1.00 0.00 H new ATOM 0 HG12 VAL A 101 170.975 -2.184 6.537 1.00 0.00 H new ATOM 0 HG13 VAL A 101 172.450 -1.300 6.997 1.00 0.00 H new ATOM 0 HG21 VAL A 101 173.848 -1.506 4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 101 174.617 -1.803 5.852 1.00 0.00 H new ATOM 0 HG23 VAL A 101 174.682 -3.048 4.582 1.00 0.00 H new ATOM 356 N SER A 102 173.232 -6.015 5.379 1.00 0.00 N ATOM 357 CA SER A 102 173.955 -7.158 4.746 1.00 0.00 C ATOM 358 C SER A 102 174.451 -6.748 3.359 1.00 0.00 C ATOM 359 O SER A 102 173.806 -5.974 2.676 1.00 0.00 O ATOM 360 CB SER A 102 172.910 -8.266 4.626 1.00 0.00 C ATOM 361 OG SER A 102 171.699 -7.716 4.124 1.00 0.00 O ATOM 0 H SER A 102 172.218 -6.038 5.274 1.00 0.00 H new ATOM 0 HA SER A 102 174.823 -7.475 5.324 1.00 0.00 H new ATOM 0 HB2 SER A 102 173.270 -9.051 3.961 1.00 0.00 H new ATOM 0 HB3 SER A 102 172.738 -8.727 5.599 1.00 0.00 H new ATOM 0 HG SER A 102 171.026 -8.424 4.044 1.00 0.00 H new ATOM 367 N VAL A 103 175.584 -7.249 2.934 1.00 0.00 N ATOM 368 CA VAL A 103 176.102 -6.867 1.583 1.00 0.00 C ATOM 369 C VAL A 103 175.118 -7.308 0.492 1.00 0.00 C ATOM 370 O VAL A 103 174.960 -6.634 -0.508 1.00 0.00 O ATOM 371 CB VAL A 103 177.465 -7.563 1.424 1.00 0.00 C ATOM 372 CG1 VAL A 103 178.389 -7.152 2.572 1.00 0.00 C ATOM 373 CG2 VAL A 103 177.302 -9.085 1.434 1.00 0.00 C ATOM 0 H VAL A 103 176.169 -7.900 3.458 1.00 0.00 H new ATOM 0 HA VAL A 103 176.212 -5.787 1.487 1.00 0.00 H new ATOM 0 HB VAL A 103 177.896 -7.260 0.470 1.00 0.00 H new ATOM 0 HG11 VAL A 103 179.354 -7.646 2.457 1.00 0.00 H new ATOM 0 HG12 VAL A 103 178.531 -6.071 2.556 1.00 0.00 H new ATOM 0 HG13 VAL A 103 177.942 -7.445 3.522 1.00 0.00 H new ATOM 0 HG21 VAL A 103 178.278 -9.556 1.320 1.00 0.00 H new ATOM 0 HG22 VAL A 103 176.856 -9.397 2.379 1.00 0.00 H new ATOM 0 HG23 VAL A 103 176.655 -9.387 0.610 1.00 0.00 H new ATOM 383 N GLY A 104 174.454 -8.428 0.670 1.00 0.00 N ATOM 384 CA GLY A 104 173.483 -8.898 -0.363 1.00 0.00 C ATOM 385 C GLY A 104 172.365 -7.865 -0.536 1.00 0.00 C ATOM 386 O GLY A 104 171.955 -7.559 -1.639 1.00 0.00 O ATOM 0 H GLY A 104 174.545 -9.033 1.486 1.00 0.00 H new ATOM 0 HA2 GLY A 104 173.996 -9.054 -1.312 1.00 0.00 H new ATOM 0 HA3 GLY A 104 173.060 -9.858 -0.067 1.00 0.00 H new ATOM 390 N ASP A 105 171.877 -7.325 0.555 1.00 0.00 N ATOM 391 CA ASP A 105 170.790 -6.303 0.474 1.00 0.00 C ATOM 392 C ASP A 105 171.384 -4.943 0.114 1.00 0.00 C ATOM 393 O ASP A 105 170.837 -4.201 -0.679 1.00 0.00 O ATOM 394 CB ASP A 105 170.169 -6.267 1.870 1.00 0.00 C ATOM 395 CG ASP A 105 168.892 -5.424 1.841 1.00 0.00 C ATOM 396 OD1 ASP A 105 168.201 -5.464 0.836 1.00 0.00 O ATOM 397 OD2 ASP A 105 168.626 -4.753 2.824 1.00 0.00 O ATOM 0 H ASP A 105 172.187 -7.550 1.500 1.00 0.00 H new ATOM 0 HA ASP A 105 170.050 -6.543 -0.289 1.00 0.00 H new ATOM 0 HB2 ASP A 105 169.941 -7.279 2.204 1.00 0.00 H new ATOM 0 HB3 ASP A 105 170.878 -5.848 2.584 1.00 0.00 H new ATOM 402 N LEU A 106 172.509 -4.618 0.700 1.00 0.00 N ATOM 403 CA LEU A 106 173.164 -3.306 0.406 1.00 0.00 C ATOM 404 C LEU A 106 173.494 -3.226 -1.088 1.00 0.00 C ATOM 405 O LEU A 106 173.202 -2.244 -1.744 1.00 0.00 O ATOM 406 CB LEU A 106 174.448 -3.302 1.243 1.00 0.00 C ATOM 407 CG LEU A 106 175.209 -1.993 1.019 1.00 0.00 C ATOM 408 CD1 LEU A 106 174.475 -0.848 1.721 1.00 0.00 C ATOM 409 CD2 LEU A 106 176.621 -2.120 1.594 1.00 0.00 C ATOM 0 H LEU A 106 173.003 -5.206 1.371 1.00 0.00 H new ATOM 0 HA LEU A 106 172.527 -2.455 0.647 1.00 0.00 H new ATOM 0 HB2 LEU A 106 174.205 -3.416 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 106 175.075 -4.150 0.967 1.00 0.00 H new ATOM 0 HG LEU A 106 175.268 -1.786 -0.050 1.00 0.00 H new ATOM 0 HD11 LEU A 106 175.017 0.084 1.561 1.00 0.00 H new ATOM 0 HD12 LEU A 106 173.468 -0.757 1.313 1.00 0.00 H new ATOM 0 HD13 LEU A 106 174.416 -1.055 2.790 1.00 0.00 H new ATOM 0 HD21 LEU A 106 177.164 -1.188 1.435 1.00 0.00 H new ATOM 0 HD22 LEU A 106 176.561 -2.327 2.662 1.00 0.00 H new ATOM 0 HD23 LEU A 106 177.145 -2.935 1.095 1.00 0.00 H new ATOM 421 N ARG A 107 174.106 -4.250 -1.626 1.00 0.00 N ATOM 422 CA ARG A 107 174.464 -4.236 -3.076 1.00 0.00 C ATOM 423 C ARG A 107 173.204 -4.198 -3.943 1.00 0.00 C ATOM 424 O ARG A 107 173.213 -3.655 -5.033 1.00 0.00 O ATOM 425 CB ARG A 107 175.252 -5.526 -3.317 1.00 0.00 C ATOM 426 CG ARG A 107 175.933 -5.466 -4.687 1.00 0.00 C ATOM 427 CD ARG A 107 176.385 -6.872 -5.093 1.00 0.00 C ATOM 428 NE ARG A 107 177.468 -7.231 -4.131 1.00 0.00 N ATOM 429 CZ ARG A 107 178.102 -8.363 -4.259 1.00 0.00 C ATOM 430 NH1 ARG A 107 178.956 -8.527 -5.233 1.00 0.00 N ATOM 431 NH2 ARG A 107 177.883 -9.333 -3.414 1.00 0.00 N ATOM 0 H ARG A 107 174.373 -5.096 -1.123 1.00 0.00 H new ATOM 0 HA ARG A 107 175.049 -3.354 -3.339 1.00 0.00 H new ATOM 0 HB2 ARG A 107 175.999 -5.659 -2.534 1.00 0.00 H new ATOM 0 HB3 ARG A 107 174.584 -6.386 -3.269 1.00 0.00 H new ATOM 0 HG2 ARG A 107 175.244 -5.065 -5.430 1.00 0.00 H new ATOM 0 HG3 ARG A 107 176.790 -4.793 -4.650 1.00 0.00 H new ATOM 0 HD2 ARG A 107 175.559 -7.582 -5.038 1.00 0.00 H new ATOM 0 HD3 ARG A 107 176.750 -6.886 -6.120 1.00 0.00 H new ATOM 0 HE ARG A 107 177.712 -6.592 -3.375 1.00 0.00 H new ATOM 0 HH11 ARG A 107 179.127 -7.769 -5.894 1.00 0.00 H new ATOM 0 HH12 ARG A 107 179.452 -9.413 -5.333 1.00 0.00 H new ATOM 0 HH21 ARG A 107 177.216 -9.206 -2.653 1.00 0.00 H new ATOM 0 HH22 ARG A 107 178.379 -10.219 -3.514 1.00 0.00 H new ATOM 445 N TYR A 108 172.123 -4.782 -3.477 1.00 0.00 N ATOM 446 CA TYR A 108 170.872 -4.783 -4.297 1.00 0.00 C ATOM 447 C TYR A 108 170.345 -3.355 -4.456 1.00 0.00 C ATOM 448 O TYR A 108 170.017 -2.935 -5.547 1.00 0.00 O ATOM 449 CB TYR A 108 169.876 -5.667 -3.544 1.00 0.00 C ATOM 450 CG TYR A 108 168.602 -5.789 -4.346 1.00 0.00 C ATOM 451 CD1 TYR A 108 167.573 -4.857 -4.170 1.00 0.00 C ATOM 452 CD2 TYR A 108 168.451 -6.833 -5.266 1.00 0.00 C ATOM 453 CE1 TYR A 108 166.392 -4.969 -4.915 1.00 0.00 C ATOM 454 CE2 TYR A 108 167.271 -6.945 -6.010 1.00 0.00 C ATOM 455 CZ TYR A 108 166.241 -6.014 -5.834 1.00 0.00 C ATOM 456 OH TYR A 108 165.077 -6.125 -6.569 1.00 0.00 O ATOM 0 H TYR A 108 172.055 -5.252 -2.574 1.00 0.00 H new ATOM 0 HA TYR A 108 171.043 -5.165 -5.303 1.00 0.00 H new ATOM 0 HB2 TYR A 108 170.306 -6.654 -3.373 1.00 0.00 H new ATOM 0 HB3 TYR A 108 169.662 -5.239 -2.565 1.00 0.00 H new ATOM 0 HD1 TYR A 108 167.689 -4.052 -3.460 1.00 0.00 H new ATOM 0 HD2 TYR A 108 169.245 -7.552 -5.402 1.00 0.00 H new ATOM 0 HE1 TYR A 108 165.598 -4.249 -4.780 1.00 0.00 H new ATOM 0 HE2 TYR A 108 167.155 -7.750 -6.720 1.00 0.00 H new ATOM 0 HH TYR A 108 165.137 -6.904 -7.160 1.00 0.00 H new ATOM 466 N MET A 109 170.245 -2.609 -3.383 1.00 0.00 N ATOM 467 CA MET A 109 169.727 -1.218 -3.510 1.00 0.00 C ATOM 468 C MET A 109 170.747 -0.346 -4.226 1.00 0.00 C ATOM 469 O MET A 109 170.393 0.498 -5.028 1.00 0.00 O ATOM 470 CB MET A 109 169.523 -0.730 -2.081 1.00 0.00 C ATOM 471 CG MET A 109 168.071 -0.973 -1.660 1.00 0.00 C ATOM 472 SD MET A 109 167.256 0.607 -1.291 1.00 0.00 S ATOM 473 CE MET A 109 167.612 1.430 -2.869 1.00 0.00 C ATOM 0 H MET A 109 170.497 -2.901 -2.439 1.00 0.00 H new ATOM 0 HA MET A 109 168.803 -1.176 -4.087 1.00 0.00 H new ATOM 0 HB2 MET A 109 170.201 -1.253 -1.407 1.00 0.00 H new ATOM 0 HB3 MET A 109 169.760 0.332 -2.011 1.00 0.00 H new ATOM 0 HG2 MET A 109 167.535 -1.490 -2.456 1.00 0.00 H new ATOM 0 HG3 MET A 109 168.042 -1.620 -0.783 1.00 0.00 H new ATOM 0 HE1 MET A 109 166.944 2.282 -2.994 1.00 0.00 H new ATOM 0 HE2 MET A 109 168.646 1.775 -2.874 1.00 0.00 H new ATOM 0 HE3 MET A 109 167.460 0.727 -3.688 1.00 0.00 H new ATOM 483 N LEU A 110 172.011 -0.520 -3.930 1.00 0.00 N ATOM 484 CA LEU A 110 173.058 0.326 -4.579 1.00 0.00 C ATOM 485 C LEU A 110 172.944 0.267 -6.104 1.00 0.00 C ATOM 486 O LEU A 110 173.088 1.274 -6.769 1.00 0.00 O ATOM 487 CB LEU A 110 174.393 -0.271 -4.123 1.00 0.00 C ATOM 488 CG LEU A 110 175.528 0.705 -4.433 1.00 0.00 C ATOM 489 CD1 LEU A 110 175.615 1.755 -3.325 1.00 0.00 C ATOM 490 CD2 LEU A 110 176.849 -0.063 -4.510 1.00 0.00 C ATOM 0 H LEU A 110 172.362 -1.211 -3.267 1.00 0.00 H new ATOM 0 HA LEU A 110 172.956 1.375 -4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 110 174.362 -0.480 -3.054 1.00 0.00 H new ATOM 0 HB3 LEU A 110 174.569 -1.221 -4.628 1.00 0.00 H new ATOM 0 HG LEU A 110 175.335 1.198 -5.386 1.00 0.00 H new ATOM 0 HD11 LEU A 110 176.424 2.451 -3.546 1.00 0.00 H new ATOM 0 HD12 LEU A 110 174.673 2.301 -3.266 1.00 0.00 H new ATOM 0 HD13 LEU A 110 175.810 1.263 -2.372 1.00 0.00 H new ATOM 0 HD21 LEU A 110 177.661 0.630 -4.731 1.00 0.00 H new ATOM 0 HD22 LEU A 110 177.041 -0.554 -3.556 1.00 0.00 H new ATOM 0 HD23 LEU A 110 176.788 -0.813 -5.298 1.00 0.00 H new ATOM 502 N THR A 111 172.660 -0.887 -6.667 1.00 0.00 N ATOM 503 CA THR A 111 172.530 -0.965 -8.158 1.00 0.00 C ATOM 504 C THR A 111 171.223 -0.301 -8.619 1.00 0.00 C ATOM 505 O THR A 111 171.073 0.070 -9.766 1.00 0.00 O ATOM 506 CB THR A 111 172.553 -2.460 -8.507 1.00 0.00 C ATOM 507 OG1 THR A 111 172.491 -2.611 -9.918 1.00 0.00 O ATOM 508 CG2 THR A 111 171.366 -3.186 -7.870 1.00 0.00 C ATOM 0 H THR A 111 172.515 -1.764 -6.167 1.00 0.00 H new ATOM 0 HA THR A 111 173.339 -0.436 -8.663 1.00 0.00 H new ATOM 0 HB THR A 111 173.475 -2.894 -8.120 1.00 0.00 H new ATOM 0 HG1 THR A 111 173.084 -1.957 -10.343 1.00 0.00 H new ATOM 0 HG21 THR A 111 171.404 -4.244 -8.131 1.00 0.00 H new ATOM 0 HG22 THR A 111 171.412 -3.078 -6.786 1.00 0.00 H new ATOM 0 HG23 THR A 111 170.435 -2.754 -8.238 1.00 0.00 H new ATOM 516 N GLY A 112 170.297 -0.116 -7.713 1.00 0.00 N ATOM 517 CA GLY A 112 169.012 0.559 -8.047 1.00 0.00 C ATOM 518 C GLY A 112 169.169 2.082 -7.906 1.00 0.00 C ATOM 519 O GLY A 112 168.322 2.843 -8.332 1.00 0.00 O ATOM 0 H GLY A 112 170.381 -0.410 -6.740 1.00 0.00 H new ATOM 0 HA2 GLY A 112 168.713 0.308 -9.065 1.00 0.00 H new ATOM 0 HA3 GLY A 112 168.222 0.203 -7.386 1.00 0.00 H new ATOM 523 N LEU A 113 170.232 2.528 -7.274 1.00 0.00 N ATOM 524 CA LEU A 113 170.450 3.987 -7.049 1.00 0.00 C ATOM 525 C LEU A 113 171.340 4.618 -8.137 1.00 0.00 C ATOM 526 O LEU A 113 171.759 5.753 -8.004 1.00 0.00 O ATOM 527 CB LEU A 113 171.165 4.054 -5.693 1.00 0.00 C ATOM 528 CG LEU A 113 170.605 5.204 -4.841 1.00 0.00 C ATOM 529 CD1 LEU A 113 170.783 6.539 -5.571 1.00 0.00 C ATOM 530 CD2 LEU A 113 169.116 4.968 -4.569 1.00 0.00 C ATOM 0 H LEU A 113 170.967 1.928 -6.900 1.00 0.00 H new ATOM 0 HA LEU A 113 169.509 4.537 -7.077 1.00 0.00 H new ATOM 0 HB2 LEU A 113 171.042 3.109 -5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 113 172.235 4.196 -5.847 1.00 0.00 H new ATOM 0 HG LEU A 113 171.149 5.238 -3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 113 170.382 7.346 -4.957 1.00 0.00 H new ATOM 0 HD12 LEU A 113 171.843 6.715 -5.755 1.00 0.00 H new ATOM 0 HD13 LEU A 113 170.251 6.508 -6.522 1.00 0.00 H new ATOM 0 HD21 LEU A 113 168.723 5.785 -3.965 1.00 0.00 H new ATOM 0 HD22 LEU A 113 168.576 4.923 -5.515 1.00 0.00 H new ATOM 0 HD23 LEU A 113 168.989 4.027 -4.034 1.00 0.00 H new ATOM 542 N GLY A 114 171.657 3.904 -9.190 1.00 0.00 N ATOM 543 CA GLY A 114 172.548 4.481 -10.251 1.00 0.00 C ATOM 544 C GLY A 114 173.953 3.878 -10.117 1.00 0.00 C ATOM 545 O GLY A 114 174.943 4.491 -10.470 1.00 0.00 O ATOM 0 H GLY A 114 171.340 2.950 -9.362 1.00 0.00 H new ATOM 0 HA2 GLY A 114 172.141 4.268 -11.239 1.00 0.00 H new ATOM 0 HA3 GLY A 114 172.594 5.566 -10.153 1.00 0.00 H new ATOM 549 N GLU A 115 174.028 2.665 -9.643 1.00 0.00 N ATOM 550 CA GLU A 115 175.348 1.975 -9.516 1.00 0.00 C ATOM 551 C GLU A 115 175.412 0.774 -10.463 1.00 0.00 C ATOM 552 O GLU A 115 174.610 -0.134 -10.372 1.00 0.00 O ATOM 553 CB GLU A 115 175.435 1.511 -8.064 1.00 0.00 C ATOM 554 CG GLU A 115 176.900 1.257 -7.700 1.00 0.00 C ATOM 555 CD GLU A 115 177.532 2.547 -7.169 1.00 0.00 C ATOM 556 OE1 GLU A 115 177.122 3.611 -7.604 1.00 0.00 O ATOM 557 OE2 GLU A 115 178.416 2.449 -6.334 1.00 0.00 O ATOM 0 H GLU A 115 173.226 2.116 -9.335 1.00 0.00 H new ATOM 0 HA GLU A 115 176.175 2.636 -9.777 1.00 0.00 H new ATOM 0 HB2 GLU A 115 175.010 2.266 -7.403 1.00 0.00 H new ATOM 0 HB3 GLU A 115 174.851 0.601 -7.926 1.00 0.00 H new ATOM 0 HG2 GLU A 115 176.967 0.472 -6.947 1.00 0.00 H new ATOM 0 HG3 GLU A 115 177.447 0.907 -8.575 1.00 0.00 H new ATOM 564 N LYS A 116 176.366 0.747 -11.358 1.00 0.00 N ATOM 565 CA LYS A 116 176.481 -0.417 -12.285 1.00 0.00 C ATOM 566 C LYS A 116 177.865 -1.050 -12.163 1.00 0.00 C ATOM 567 O LYS A 116 178.613 -1.146 -13.116 1.00 0.00 O ATOM 568 CB LYS A 116 176.201 0.104 -13.695 1.00 0.00 C ATOM 569 CG LYS A 116 174.713 0.436 -13.833 1.00 0.00 C ATOM 570 CD LYS A 116 174.435 0.955 -15.244 1.00 0.00 C ATOM 571 CE LYS A 116 172.941 1.252 -15.394 1.00 0.00 C ATOM 572 NZ LYS A 116 172.750 2.592 -14.772 1.00 0.00 N ATOM 0 H LYS A 116 177.067 1.477 -11.486 1.00 0.00 H new ATOM 0 HA LYS A 116 175.764 -1.200 -12.040 1.00 0.00 H new ATOM 0 HB2 LYS A 116 176.802 0.992 -13.892 1.00 0.00 H new ATOM 0 HB3 LYS A 116 176.487 -0.645 -14.434 1.00 0.00 H new ATOM 0 HG2 LYS A 116 174.112 -0.451 -13.635 1.00 0.00 H new ATOM 0 HG3 LYS A 116 174.427 1.186 -13.095 1.00 0.00 H new ATOM 0 HD2 LYS A 116 175.017 1.857 -15.432 1.00 0.00 H new ATOM 0 HD3 LYS A 116 174.746 0.216 -15.983 1.00 0.00 H new ATOM 0 HE2 LYS A 116 172.643 1.257 -16.442 1.00 0.00 H new ATOM 0 HE3 LYS A 116 172.336 0.495 -14.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 171.917 2.570 -14.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 173.593 2.839 -14.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 172.607 3.303 -15.517 1.00 0.00 H new ATOM 586 N LEU A 117 178.179 -1.527 -10.986 1.00 0.00 N ATOM 587 CA LEU A 117 179.479 -2.213 -10.751 1.00 0.00 C ATOM 588 C LEU A 117 179.275 -3.710 -10.995 1.00 0.00 C ATOM 589 O LEU A 117 178.199 -4.233 -10.761 1.00 0.00 O ATOM 590 CB LEU A 117 179.828 -1.938 -9.286 1.00 0.00 C ATOM 591 CG LEU A 117 179.950 -0.429 -9.059 1.00 0.00 C ATOM 592 CD1 LEU A 117 179.979 -0.139 -7.558 1.00 0.00 C ATOM 593 CD2 LEU A 117 181.244 0.080 -9.698 1.00 0.00 C ATOM 0 H LEU A 117 177.576 -1.467 -10.165 1.00 0.00 H new ATOM 0 HA LEU A 117 180.278 -1.867 -11.407 1.00 0.00 H new ATOM 0 HB2 LEU A 117 179.058 -2.352 -8.635 1.00 0.00 H new ATOM 0 HB3 LEU A 117 180.765 -2.431 -9.026 1.00 0.00 H new ATOM 0 HG LEU A 117 179.096 0.075 -9.511 1.00 0.00 H new ATOM 0 HD11 LEU A 117 180.066 0.935 -7.397 1.00 0.00 H new ATOM 0 HD12 LEU A 117 179.059 -0.502 -7.100 1.00 0.00 H new ATOM 0 HD13 LEU A 117 180.833 -0.644 -7.106 1.00 0.00 H new ATOM 0 HD21 LEU A 117 181.331 1.154 -9.537 1.00 0.00 H new ATOM 0 HD22 LEU A 117 182.097 -0.425 -9.245 1.00 0.00 H new ATOM 0 HD23 LEU A 117 181.227 -0.126 -10.768 1.00 0.00 H new ATOM 605 N THR A 118 180.281 -4.408 -11.452 1.00 0.00 N ATOM 606 CA THR A 118 180.121 -5.874 -11.699 1.00 0.00 C ATOM 607 C THR A 118 180.930 -6.675 -10.676 1.00 0.00 C ATOM 608 O THR A 118 181.991 -6.250 -10.268 1.00 0.00 O ATOM 609 CB THR A 118 180.664 -6.100 -13.107 1.00 0.00 C ATOM 610 OG1 THR A 118 180.214 -5.059 -13.962 1.00 0.00 O ATOM 611 CG2 THR A 118 180.173 -7.448 -13.636 1.00 0.00 C ATOM 0 H THR A 118 181.204 -4.029 -11.665 1.00 0.00 H new ATOM 0 HA THR A 118 179.084 -6.197 -11.606 1.00 0.00 H new ATOM 0 HB THR A 118 181.754 -6.099 -13.079 1.00 0.00 H new ATOM 0 HG1 THR A 118 180.564 -5.204 -14.866 1.00 0.00 H new ATOM 0 HG21 THR A 118 180.562 -7.608 -14.642 1.00 0.00 H new ATOM 0 HG22 THR A 118 180.523 -8.245 -12.981 1.00 0.00 H new ATOM 0 HG23 THR A 118 179.083 -7.453 -13.663 1.00 0.00 H new ATOM 619 N ASP A 119 180.418 -7.809 -10.224 1.00 0.00 N ATOM 620 CA ASP A 119 181.129 -8.642 -9.179 1.00 0.00 C ATOM 621 C ASP A 119 182.649 -8.667 -9.386 1.00 0.00 C ATOM 622 O ASP A 119 183.413 -8.708 -8.443 1.00 0.00 O ATOM 623 CB ASP A 119 180.536 -10.045 -9.347 1.00 0.00 C ATOM 624 CG ASP A 119 180.951 -10.651 -10.695 1.00 0.00 C ATOM 625 OD1 ASP A 119 180.622 -10.064 -11.712 1.00 0.00 O ATOM 626 OD2 ASP A 119 181.586 -11.693 -10.684 1.00 0.00 O ATOM 0 H ASP A 119 179.528 -8.197 -10.538 1.00 0.00 H new ATOM 0 HA ASP A 119 180.986 -8.234 -8.179 1.00 0.00 H new ATOM 0 HB2 ASP A 119 180.874 -10.688 -8.534 1.00 0.00 H new ATOM 0 HB3 ASP A 119 179.449 -9.996 -9.284 1.00 0.00 H new ATOM 631 N ALA A 120 183.077 -8.582 -10.612 1.00 0.00 N ATOM 632 CA ALA A 120 184.546 -8.531 -10.897 1.00 0.00 C ATOM 633 C ALA A 120 185.143 -7.299 -10.202 1.00 0.00 C ATOM 634 O ALA A 120 186.074 -7.400 -9.423 1.00 0.00 O ATOM 635 CB ALA A 120 184.649 -8.376 -12.416 1.00 0.00 C ATOM 0 H ALA A 120 182.476 -8.545 -11.435 1.00 0.00 H new ATOM 0 HA ALA A 120 185.079 -9.413 -10.542 1.00 0.00 H new ATOM 0 HB1 ALA A 120 185.699 -8.331 -12.707 1.00 0.00 H new ATOM 0 HB2 ALA A 120 184.174 -9.229 -12.902 1.00 0.00 H new ATOM 0 HB3 ALA A 120 184.148 -7.458 -12.723 1.00 0.00 H new ATOM 641 N GLU A 121 184.587 -6.143 -10.462 1.00 0.00 N ATOM 642 CA GLU A 121 185.083 -4.896 -9.808 1.00 0.00 C ATOM 643 C GLU A 121 184.583 -4.819 -8.358 1.00 0.00 C ATOM 644 O GLU A 121 185.312 -4.451 -7.457 1.00 0.00 O ATOM 645 CB GLU A 121 184.501 -3.753 -10.639 1.00 0.00 C ATOM 646 CG GLU A 121 185.293 -3.614 -11.940 1.00 0.00 C ATOM 647 CD GLU A 121 184.747 -2.435 -12.748 1.00 0.00 C ATOM 648 OE1 GLU A 121 185.224 -1.331 -12.545 1.00 0.00 O ATOM 649 OE2 GLU A 121 183.859 -2.657 -13.556 1.00 0.00 O ATOM 0 H GLU A 121 183.805 -6.010 -11.104 1.00 0.00 H new ATOM 0 HA GLU A 121 186.172 -4.857 -9.769 1.00 0.00 H new ATOM 0 HB2 GLU A 121 183.451 -3.947 -10.859 1.00 0.00 H new ATOM 0 HB3 GLU A 121 184.542 -2.821 -10.075 1.00 0.00 H new ATOM 0 HG2 GLU A 121 186.349 -3.459 -11.720 1.00 0.00 H new ATOM 0 HG3 GLU A 121 185.220 -4.532 -12.522 1.00 0.00 H new ATOM 656 N VAL A 122 183.338 -5.166 -8.135 1.00 0.00 N ATOM 657 CA VAL A 122 182.769 -5.121 -6.749 1.00 0.00 C ATOM 658 C VAL A 122 183.530 -6.076 -5.822 1.00 0.00 C ATOM 659 O VAL A 122 183.736 -5.773 -4.660 1.00 0.00 O ATOM 660 CB VAL A 122 181.301 -5.547 -6.887 1.00 0.00 C ATOM 661 CG1 VAL A 122 180.623 -5.534 -5.512 1.00 0.00 C ATOM 662 CG2 VAL A 122 180.570 -4.571 -7.812 1.00 0.00 C ATOM 0 H VAL A 122 182.688 -5.480 -8.856 1.00 0.00 H new ATOM 0 HA VAL A 122 182.855 -4.127 -6.311 1.00 0.00 H new ATOM 0 HB VAL A 122 181.261 -6.553 -7.304 1.00 0.00 H new ATOM 0 HG11 VAL A 122 179.581 -5.837 -5.617 1.00 0.00 H new ATOM 0 HG12 VAL A 122 181.137 -6.227 -4.846 1.00 0.00 H new ATOM 0 HG13 VAL A 122 180.668 -4.528 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 122 179.528 -4.874 -7.910 1.00 0.00 H new ATOM 0 HG22 VAL A 122 180.618 -3.566 -7.392 1.00 0.00 H new ATOM 0 HG23 VAL A 122 181.043 -4.577 -8.794 1.00 0.00 H new ATOM 672 N ASP A 123 183.959 -7.219 -6.311 1.00 0.00 N ATOM 673 CA ASP A 123 184.715 -8.167 -5.426 1.00 0.00 C ATOM 674 C ASP A 123 185.978 -7.469 -4.914 1.00 0.00 C ATOM 675 O ASP A 123 186.347 -7.593 -3.762 1.00 0.00 O ATOM 676 CB ASP A 123 185.062 -9.374 -6.302 1.00 0.00 C ATOM 677 CG ASP A 123 185.840 -10.401 -5.476 1.00 0.00 C ATOM 678 OD1 ASP A 123 185.555 -10.521 -4.296 1.00 0.00 O ATOM 679 OD2 ASP A 123 186.706 -11.050 -6.039 1.00 0.00 O ATOM 0 H ASP A 123 183.821 -7.533 -7.271 1.00 0.00 H new ATOM 0 HA ASP A 123 184.139 -8.482 -4.556 1.00 0.00 H new ATOM 0 HB2 ASP A 123 184.151 -9.824 -6.696 1.00 0.00 H new ATOM 0 HB3 ASP A 123 185.656 -9.056 -7.158 1.00 0.00 H new ATOM 684 N GLU A 124 186.627 -6.713 -5.766 1.00 0.00 N ATOM 685 CA GLU A 124 187.857 -5.971 -5.340 1.00 0.00 C ATOM 686 C GLU A 124 187.525 -5.070 -4.142 1.00 0.00 C ATOM 687 O GLU A 124 188.265 -4.999 -3.181 1.00 0.00 O ATOM 688 CB GLU A 124 188.252 -5.116 -6.548 1.00 0.00 C ATOM 689 CG GLU A 124 188.538 -6.023 -7.747 1.00 0.00 C ATOM 690 CD GLU A 124 189.443 -5.290 -8.740 1.00 0.00 C ATOM 691 OE1 GLU A 124 190.286 -4.529 -8.293 1.00 0.00 O ATOM 692 OE2 GLU A 124 189.277 -5.500 -9.930 1.00 0.00 O ATOM 0 H GLU A 124 186.358 -6.577 -6.740 1.00 0.00 H new ATOM 0 HA GLU A 124 188.661 -6.642 -5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 124 187.450 -4.418 -6.790 1.00 0.00 H new ATOM 0 HB3 GLU A 124 189.133 -4.520 -6.312 1.00 0.00 H new ATOM 0 HG2 GLU A 124 189.017 -6.943 -7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 124 187.604 -6.307 -8.232 1.00 0.00 H new ATOM 699 N LEU A 125 186.409 -4.389 -4.205 1.00 0.00 N ATOM 700 CA LEU A 125 186.001 -3.490 -3.079 1.00 0.00 C ATOM 701 C LEU A 125 185.799 -4.304 -1.797 1.00 0.00 C ATOM 702 O LEU A 125 186.365 -4.010 -0.762 1.00 0.00 O ATOM 703 CB LEU A 125 184.665 -2.878 -3.527 1.00 0.00 C ATOM 704 CG LEU A 125 184.891 -1.508 -4.186 1.00 0.00 C ATOM 705 CD1 LEU A 125 185.529 -0.546 -3.180 1.00 0.00 C ATOM 706 CD2 LEU A 125 185.811 -1.659 -5.403 1.00 0.00 C ATOM 0 H LEU A 125 185.759 -4.416 -4.991 1.00 0.00 H new ATOM 0 HA LEU A 125 186.755 -2.732 -2.865 1.00 0.00 H new ATOM 0 HB2 LEU A 125 184.169 -3.548 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 125 184.002 -2.770 -2.668 1.00 0.00 H new ATOM 0 HG LEU A 125 183.930 -1.108 -4.509 1.00 0.00 H new ATOM 0 HD11 LEU A 125 185.687 0.423 -3.653 1.00 0.00 H new ATOM 0 HD12 LEU A 125 184.869 -0.427 -2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 125 186.486 -0.948 -2.849 1.00 0.00 H new ATOM 0 HD21 LEU A 125 185.966 -0.684 -5.865 1.00 0.00 H new ATOM 0 HD22 LEU A 125 186.770 -2.067 -5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 125 185.351 -2.333 -6.125 1.00 0.00 H new ATOM 718 N LEU A 126 184.986 -5.328 -1.872 1.00 0.00 N ATOM 719 CA LEU A 126 184.719 -6.187 -0.674 1.00 0.00 C ATOM 720 C LEU A 126 186.003 -6.874 -0.192 1.00 0.00 C ATOM 721 O LEU A 126 186.089 -7.323 0.934 1.00 0.00 O ATOM 722 CB LEU A 126 183.722 -7.246 -1.162 1.00 0.00 C ATOM 723 CG LEU A 126 182.327 -6.623 -1.287 1.00 0.00 C ATOM 724 CD1 LEU A 126 181.606 -7.226 -2.494 1.00 0.00 C ATOM 725 CD2 LEU A 126 181.516 -6.905 -0.014 1.00 0.00 C ATOM 0 H LEU A 126 184.491 -5.609 -2.718 1.00 0.00 H new ATOM 0 HA LEU A 126 184.339 -5.600 0.162 1.00 0.00 H new ATOM 0 HB2 LEU A 126 184.041 -7.643 -2.126 1.00 0.00 H new ATOM 0 HB3 LEU A 126 183.696 -8.083 -0.465 1.00 0.00 H new ATOM 0 HG LEU A 126 182.425 -5.546 -1.420 1.00 0.00 H new ATOM 0 HD11 LEU A 126 180.614 -6.784 -2.584 1.00 0.00 H new ATOM 0 HD12 LEU A 126 182.178 -7.021 -3.399 1.00 0.00 H new ATOM 0 HD13 LEU A 126 181.512 -8.304 -2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 126 180.525 -6.460 -0.108 1.00 0.00 H new ATOM 0 HD22 LEU A 126 181.419 -7.982 0.124 1.00 0.00 H new ATOM 0 HD23 LEU A 126 182.028 -6.473 0.846 1.00 0.00 H new ATOM 737 N LYS A 127 186.985 -6.990 -1.054 1.00 0.00 N ATOM 738 CA LYS A 127 188.252 -7.687 -0.671 1.00 0.00 C ATOM 739 C LYS A 127 188.898 -7.035 0.557 1.00 0.00 C ATOM 740 O LYS A 127 189.699 -7.645 1.240 1.00 0.00 O ATOM 741 CB LYS A 127 189.172 -7.524 -1.883 1.00 0.00 C ATOM 742 CG LYS A 127 190.410 -8.405 -1.705 1.00 0.00 C ATOM 743 CD LYS A 127 191.333 -8.247 -2.915 1.00 0.00 C ATOM 744 CE LYS A 127 192.568 -9.131 -2.732 1.00 0.00 C ATOM 745 NZ LYS A 127 193.122 -9.306 -4.104 1.00 0.00 N ATOM 0 H LYS A 127 186.963 -6.631 -2.008 1.00 0.00 H new ATOM 0 HA LYS A 127 188.068 -8.730 -0.413 1.00 0.00 H new ATOM 0 HB2 LYS A 127 188.643 -7.802 -2.795 1.00 0.00 H new ATOM 0 HB3 LYS A 127 189.468 -6.480 -1.991 1.00 0.00 H new ATOM 0 HG2 LYS A 127 190.939 -8.126 -0.793 1.00 0.00 H new ATOM 0 HG3 LYS A 127 190.113 -9.448 -1.595 1.00 0.00 H new ATOM 0 HD2 LYS A 127 190.805 -8.525 -3.827 1.00 0.00 H new ATOM 0 HD3 LYS A 127 191.632 -7.204 -3.025 1.00 0.00 H new ATOM 0 HE2 LYS A 127 193.295 -8.661 -2.069 1.00 0.00 H new ATOM 0 HE3 LYS A 127 192.304 -10.091 -2.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 193.973 -9.902 -4.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 192.410 -9.761 -4.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 193.370 -8.377 -4.499 1.00 0.00 H new ATOM 759 N GLY A 128 188.561 -5.800 0.838 1.00 0.00 N ATOM 760 CA GLY A 128 189.159 -5.105 2.014 1.00 0.00 C ATOM 761 C GLY A 128 188.080 -4.797 3.060 1.00 0.00 C ATOM 762 O GLY A 128 188.389 -4.470 4.191 1.00 0.00 O ATOM 0 H GLY A 128 187.896 -5.244 0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 128 189.936 -5.729 2.457 1.00 0.00 H new ATOM 0 HA3 GLY A 128 189.638 -4.180 1.693 1.00 0.00 H new ATOM 766 N VAL A 129 186.818 -4.895 2.702 1.00 0.00 N ATOM 767 CA VAL A 129 185.736 -4.602 3.694 1.00 0.00 C ATOM 768 C VAL A 129 185.734 -5.662 4.799 1.00 0.00 C ATOM 769 O VAL A 129 185.680 -6.850 4.553 1.00 0.00 O ATOM 770 CB VAL A 129 184.425 -4.621 2.900 1.00 0.00 C ATOM 771 CG1 VAL A 129 183.250 -4.326 3.836 1.00 0.00 C ATOM 772 CG2 VAL A 129 184.477 -3.554 1.804 1.00 0.00 C ATOM 0 H VAL A 129 186.495 -5.163 1.772 1.00 0.00 H new ATOM 0 HA VAL A 129 185.879 -3.639 4.185 1.00 0.00 H new ATOM 0 HB VAL A 129 184.292 -5.605 2.449 1.00 0.00 H new ATOM 0 HG11 VAL A 129 182.320 -4.340 3.268 1.00 0.00 H new ATOM 0 HG12 VAL A 129 183.209 -5.084 4.619 1.00 0.00 H new ATOM 0 HG13 VAL A 129 183.383 -3.344 4.289 1.00 0.00 H new ATOM 0 HG21 VAL A 129 183.545 -3.567 1.239 1.00 0.00 H new ATOM 0 HG22 VAL A 129 184.612 -2.572 2.258 1.00 0.00 H new ATOM 0 HG23 VAL A 129 185.311 -3.762 1.133 1.00 0.00 H new ATOM 782 N GLU A 130 185.804 -5.207 6.021 1.00 0.00 N ATOM 783 CA GLU A 130 185.822 -6.131 7.191 1.00 0.00 C ATOM 784 C GLU A 130 184.407 -6.371 7.726 1.00 0.00 C ATOM 785 O GLU A 130 183.852 -5.556 8.439 1.00 0.00 O ATOM 786 CB GLU A 130 186.667 -5.408 8.240 1.00 0.00 C ATOM 787 CG GLU A 130 186.846 -6.309 9.464 1.00 0.00 C ATOM 788 CD GLU A 130 187.701 -5.591 10.509 1.00 0.00 C ATOM 789 OE1 GLU A 130 187.585 -4.380 10.611 1.00 0.00 O ATOM 790 OE2 GLU A 130 188.458 -6.263 11.190 1.00 0.00 O ATOM 0 H GLU A 130 185.850 -4.217 6.261 1.00 0.00 H new ATOM 0 HA GLU A 130 186.223 -7.110 6.929 1.00 0.00 H new ATOM 0 HB2 GLU A 130 187.639 -5.148 7.822 1.00 0.00 H new ATOM 0 HB3 GLU A 130 186.185 -4.475 8.530 1.00 0.00 H new ATOM 0 HG2 GLU A 130 185.874 -6.563 9.887 1.00 0.00 H new ATOM 0 HG3 GLU A 130 187.321 -7.246 9.172 1.00 0.00 H new ATOM 797 N VAL A 131 183.840 -7.504 7.403 1.00 0.00 N ATOM 798 CA VAL A 131 182.478 -7.844 7.901 1.00 0.00 C ATOM 799 C VAL A 131 182.601 -8.505 9.280 1.00 0.00 C ATOM 800 O VAL A 131 183.654 -8.998 9.643 1.00 0.00 O ATOM 801 CB VAL A 131 181.904 -8.820 6.864 1.00 0.00 C ATOM 802 CG1 VAL A 131 182.793 -10.066 6.744 1.00 0.00 C ATOM 803 CG2 VAL A 131 180.500 -9.239 7.292 1.00 0.00 C ATOM 0 H VAL A 131 184.268 -8.214 6.809 1.00 0.00 H new ATOM 0 HA VAL A 131 181.833 -6.973 8.016 1.00 0.00 H new ATOM 0 HB VAL A 131 181.867 -8.323 5.895 1.00 0.00 H new ATOM 0 HG11 VAL A 131 182.369 -10.745 6.004 1.00 0.00 H new ATOM 0 HG12 VAL A 131 183.795 -9.770 6.433 1.00 0.00 H new ATOM 0 HG13 VAL A 131 182.847 -10.569 7.710 1.00 0.00 H new ATOM 0 HG21 VAL A 131 180.088 -9.932 6.559 1.00 0.00 H new ATOM 0 HG22 VAL A 131 180.547 -9.726 8.266 1.00 0.00 H new ATOM 0 HG23 VAL A 131 179.861 -8.358 7.357 1.00 0.00 H new ATOM 813 N ASP A 132 181.547 -8.503 10.054 1.00 0.00 N ATOM 814 CA ASP A 132 181.613 -9.113 11.416 1.00 0.00 C ATOM 815 C ASP A 132 181.102 -10.558 11.402 1.00 0.00 C ATOM 816 O ASP A 132 180.828 -11.126 10.362 1.00 0.00 O ATOM 817 CB ASP A 132 180.703 -8.239 12.278 1.00 0.00 C ATOM 818 CG ASP A 132 181.326 -6.850 12.434 1.00 0.00 C ATOM 819 OD1 ASP A 132 182.536 -6.777 12.560 1.00 0.00 O ATOM 820 OD2 ASP A 132 180.580 -5.884 12.421 1.00 0.00 O ATOM 0 H ASP A 132 180.642 -8.105 9.802 1.00 0.00 H new ATOM 0 HA ASP A 132 182.636 -9.152 11.791 1.00 0.00 H new ATOM 0 HB2 ASP A 132 179.718 -8.158 11.819 1.00 0.00 H new ATOM 0 HB3 ASP A 132 180.561 -8.698 13.257 1.00 0.00 H new ATOM 825 N SER A 133 180.985 -11.149 12.564 1.00 0.00 N ATOM 826 CA SER A 133 180.501 -12.564 12.663 1.00 0.00 C ATOM 827 C SER A 133 179.000 -12.683 12.333 1.00 0.00 C ATOM 828 O SER A 133 178.457 -13.771 12.329 1.00 0.00 O ATOM 829 CB SER A 133 180.764 -12.974 14.111 1.00 0.00 C ATOM 830 OG SER A 133 182.095 -13.459 14.227 1.00 0.00 O ATOM 0 H SER A 133 181.206 -10.709 13.458 1.00 0.00 H new ATOM 0 HA SER A 133 181.014 -13.206 11.947 1.00 0.00 H new ATOM 0 HB2 SER A 133 180.616 -12.122 14.775 1.00 0.00 H new ATOM 0 HB3 SER A 133 180.056 -13.744 14.417 1.00 0.00 H new ATOM 0 HG SER A 133 182.268 -13.721 15.155 1.00 0.00 H new ATOM 836 N ASN A 134 178.332 -11.594 12.029 1.00 0.00 N ATOM 837 CA ASN A 134 176.884 -11.667 11.670 1.00 0.00 C ATOM 838 C ASN A 134 176.699 -11.461 10.157 1.00 0.00 C ATOM 839 O ASN A 134 175.619 -11.661 9.630 1.00 0.00 O ATOM 840 CB ASN A 134 176.221 -10.535 12.456 1.00 0.00 C ATOM 841 CG ASN A 134 174.702 -10.718 12.431 1.00 0.00 C ATOM 842 OD1 ASN A 134 174.016 -10.095 11.644 1.00 0.00 O ATOM 843 ND2 ASN A 134 174.143 -11.552 13.264 1.00 0.00 N ATOM 0 H ASN A 134 178.732 -10.656 12.015 1.00 0.00 H new ATOM 0 HA ASN A 134 176.448 -12.636 11.911 1.00 0.00 H new ATOM 0 HB2 ASN A 134 176.581 -10.533 13.485 1.00 0.00 H new ATOM 0 HB3 ASN A 134 176.489 -9.571 12.023 1.00 0.00 H new ATOM 0 HD21 ASN A 134 173.131 -11.681 13.255 1.00 0.00 H new ATOM 0 HD22 ASN A 134 174.718 -12.075 13.925 1.00 0.00 H new ATOM 850 N GLY A 135 177.737 -11.067 9.453 1.00 0.00 N ATOM 851 CA GLY A 135 177.615 -10.855 7.979 1.00 0.00 C ATOM 852 C GLY A 135 177.040 -9.465 7.697 1.00 0.00 C ATOM 853 O GLY A 135 176.428 -9.235 6.671 1.00 0.00 O ATOM 0 H GLY A 135 178.663 -10.884 9.840 1.00 0.00 H new ATOM 0 HA2 GLY A 135 178.592 -10.956 7.506 1.00 0.00 H new ATOM 0 HA3 GLY A 135 176.970 -11.619 7.545 1.00 0.00 H new ATOM 857 N GLU A 136 177.220 -8.541 8.608 1.00 0.00 N ATOM 858 CA GLU A 136 176.671 -7.168 8.405 1.00 0.00 C ATOM 859 C GLU A 136 177.795 -6.149 8.198 1.00 0.00 C ATOM 860 O GLU A 136 178.842 -6.219 8.812 1.00 0.00 O ATOM 861 CB GLU A 136 175.897 -6.858 9.686 1.00 0.00 C ATOM 862 CG GLU A 136 174.638 -7.726 9.745 1.00 0.00 C ATOM 863 CD GLU A 136 173.862 -7.416 11.025 1.00 0.00 C ATOM 864 OE1 GLU A 136 174.493 -7.299 12.063 1.00 0.00 O ATOM 865 OE2 GLU A 136 172.650 -7.301 10.948 1.00 0.00 O ATOM 0 H GLU A 136 177.724 -8.680 9.484 1.00 0.00 H new ATOM 0 HA GLU A 136 176.041 -7.113 7.517 1.00 0.00 H new ATOM 0 HB2 GLU A 136 176.524 -7.048 10.557 1.00 0.00 H new ATOM 0 HB3 GLU A 136 175.626 -5.803 9.713 1.00 0.00 H new ATOM 0 HG2 GLU A 136 174.012 -7.536 8.873 1.00 0.00 H new ATOM 0 HG3 GLU A 136 174.910 -8.781 9.719 1.00 0.00 H new ATOM 872 N ILE A 137 177.562 -5.195 7.338 1.00 0.00 N ATOM 873 CA ILE A 137 178.580 -4.139 7.066 1.00 0.00 C ATOM 874 C ILE A 137 177.921 -2.764 7.247 1.00 0.00 C ATOM 875 O ILE A 137 176.718 -2.662 7.396 1.00 0.00 O ATOM 876 CB ILE A 137 179.030 -4.394 5.613 1.00 0.00 C ATOM 877 CG1 ILE A 137 179.969 -5.604 5.589 1.00 0.00 C ATOM 878 CG2 ILE A 137 179.781 -3.180 5.046 1.00 0.00 C ATOM 879 CD1 ILE A 137 179.157 -6.896 5.483 1.00 0.00 C ATOM 0 H ILE A 137 176.698 -5.101 6.805 1.00 0.00 H new ATOM 0 HA ILE A 137 179.438 -4.162 7.738 1.00 0.00 H new ATOM 0 HB ILE A 137 178.144 -4.575 5.004 1.00 0.00 H new ATOM 0 HG12 ILE A 137 180.655 -5.526 4.745 1.00 0.00 H new ATOM 0 HG13 ILE A 137 180.577 -5.620 6.493 1.00 0.00 H new ATOM 0 HG21 ILE A 137 180.087 -3.388 4.020 1.00 0.00 H new ATOM 0 HG22 ILE A 137 179.127 -2.308 5.060 1.00 0.00 H new ATOM 0 HG23 ILE A 137 180.663 -2.981 5.654 1.00 0.00 H new ATOM 0 HD11 ILE A 137 179.833 -7.751 5.467 1.00 0.00 H new ATOM 0 HD12 ILE A 137 178.490 -6.978 6.341 1.00 0.00 H new ATOM 0 HD13 ILE A 137 178.568 -6.882 4.566 1.00 0.00 H new ATOM 891 N ASP A 138 178.699 -1.711 7.235 1.00 0.00 N ATOM 892 CA ASP A 138 178.116 -0.345 7.408 1.00 0.00 C ATOM 893 C ASP A 138 177.841 0.294 6.042 1.00 0.00 C ATOM 894 O ASP A 138 178.743 0.505 5.253 1.00 0.00 O ATOM 895 CB ASP A 138 179.183 0.446 8.167 1.00 0.00 C ATOM 896 CG ASP A 138 178.604 1.789 8.616 1.00 0.00 C ATOM 897 OD1 ASP A 138 177.772 2.325 7.902 1.00 0.00 O ATOM 898 OD2 ASP A 138 179.005 2.262 9.667 1.00 0.00 O ATOM 0 H ASP A 138 179.711 -1.738 7.113 1.00 0.00 H new ATOM 0 HA ASP A 138 177.166 -0.366 7.942 1.00 0.00 H new ATOM 0 HB2 ASP A 138 179.524 -0.122 9.033 1.00 0.00 H new ATOM 0 HB3 ASP A 138 180.052 0.608 7.529 1.00 0.00 H new ATOM 903 N TYR A 139 176.596 0.581 5.755 1.00 0.00 N ATOM 904 CA TYR A 139 176.241 1.184 4.430 1.00 0.00 C ATOM 905 C TYR A 139 176.773 2.617 4.297 1.00 0.00 C ATOM 906 O TYR A 139 177.182 3.032 3.229 1.00 0.00 O ATOM 907 CB TYR A 139 174.702 1.168 4.372 1.00 0.00 C ATOM 908 CG TYR A 139 174.103 2.058 5.443 1.00 0.00 C ATOM 909 CD1 TYR A 139 173.921 3.425 5.194 1.00 0.00 C ATOM 910 CD2 TYR A 139 173.716 1.513 6.673 1.00 0.00 C ATOM 911 CE1 TYR A 139 173.355 4.244 6.177 1.00 0.00 C ATOM 912 CE2 TYR A 139 173.153 2.334 7.655 1.00 0.00 C ATOM 913 CZ TYR A 139 172.971 3.700 7.408 1.00 0.00 C ATOM 914 OH TYR A 139 172.414 4.508 8.377 1.00 0.00 O ATOM 0 H TYR A 139 175.807 0.424 6.382 1.00 0.00 H new ATOM 0 HA TYR A 139 176.689 0.622 3.611 1.00 0.00 H new ATOM 0 HB2 TYR A 139 174.369 1.503 3.390 1.00 0.00 H new ATOM 0 HB3 TYR A 139 174.341 0.147 4.500 1.00 0.00 H new ATOM 0 HD1 TYR A 139 174.217 3.846 4.244 1.00 0.00 H new ATOM 0 HD2 TYR A 139 173.852 0.459 6.863 1.00 0.00 H new ATOM 0 HE1 TYR A 139 173.214 5.298 5.986 1.00 0.00 H new ATOM 0 HE2 TYR A 139 172.858 1.914 8.605 1.00 0.00 H new ATOM 0 HH TYR A 139 172.204 3.971 9.170 1.00 0.00 H new ATOM 924 N LYS A 140 176.753 3.381 5.360 1.00 0.00 N ATOM 925 CA LYS A 140 177.236 4.796 5.274 1.00 0.00 C ATOM 926 C LYS A 140 178.745 4.835 5.009 1.00 0.00 C ATOM 927 O LYS A 140 179.230 5.647 4.245 1.00 0.00 O ATOM 928 CB LYS A 140 176.915 5.425 6.640 1.00 0.00 C ATOM 929 CG LYS A 140 175.909 6.565 6.463 1.00 0.00 C ATOM 930 CD LYS A 140 175.597 7.185 7.827 1.00 0.00 C ATOM 931 CE LYS A 140 174.640 8.365 7.644 1.00 0.00 C ATOM 932 NZ LYS A 140 175.020 9.336 8.708 1.00 0.00 N ATOM 0 H LYS A 140 176.425 3.089 6.281 1.00 0.00 H new ATOM 0 HA LYS A 140 176.757 5.335 4.457 1.00 0.00 H new ATOM 0 HB2 LYS A 140 176.508 4.669 7.312 1.00 0.00 H new ATOM 0 HB3 LYS A 140 177.828 5.802 7.101 1.00 0.00 H new ATOM 0 HG2 LYS A 140 176.315 7.322 5.792 1.00 0.00 H new ATOM 0 HG3 LYS A 140 174.994 6.189 6.004 1.00 0.00 H new ATOM 0 HD2 LYS A 140 175.150 6.439 8.484 1.00 0.00 H new ATOM 0 HD3 LYS A 140 176.517 7.520 8.305 1.00 0.00 H new ATOM 0 HE2 LYS A 140 174.742 8.806 6.652 1.00 0.00 H new ATOM 0 HE3 LYS A 140 173.601 8.051 7.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 174.407 10.174 8.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 174.907 8.891 9.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 176.012 9.622 8.579 1.00 0.00 H new ATOM 946 N LYS A 141 179.483 3.973 5.655 1.00 0.00 N ATOM 947 CA LYS A 141 180.966 3.959 5.470 1.00 0.00 C ATOM 948 C LYS A 141 181.351 3.455 4.077 1.00 0.00 C ATOM 949 O LYS A 141 182.246 3.983 3.444 1.00 0.00 O ATOM 950 CB LYS A 141 181.500 3.011 6.546 1.00 0.00 C ATOM 951 CG LYS A 141 181.377 3.676 7.918 1.00 0.00 C ATOM 952 CD LYS A 141 182.402 3.065 8.876 1.00 0.00 C ATOM 953 CE LYS A 141 182.573 3.977 10.096 1.00 0.00 C ATOM 954 NZ LYS A 141 184.043 4.039 10.329 1.00 0.00 N ATOM 0 H LYS A 141 179.123 3.275 6.306 1.00 0.00 H new ATOM 0 HA LYS A 141 181.384 4.962 5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 141 180.941 2.076 6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 141 182.542 2.763 6.342 1.00 0.00 H new ATOM 0 HG2 LYS A 141 181.542 4.750 7.829 1.00 0.00 H new ATOM 0 HG3 LYS A 141 180.370 3.539 8.311 1.00 0.00 H new ATOM 0 HD2 LYS A 141 182.074 2.075 9.193 1.00 0.00 H new ATOM 0 HD3 LYS A 141 183.358 2.937 8.368 1.00 0.00 H new ATOM 0 HE2 LYS A 141 182.161 4.969 9.908 1.00 0.00 H new ATOM 0 HE3 LYS A 141 182.052 3.575 10.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 184.239 4.646 11.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 184.406 3.082 10.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 184.512 4.432 9.488 1.00 0.00 H new ATOM 968 N PHE A 142 180.701 2.417 3.609 1.00 0.00 N ATOM 969 CA PHE A 142 181.054 1.853 2.269 1.00 0.00 C ATOM 970 C PHE A 142 180.618 2.807 1.160 1.00 0.00 C ATOM 971 O PHE A 142 181.219 2.860 0.106 1.00 0.00 O ATOM 972 CB PHE A 142 180.304 0.521 2.180 1.00 0.00 C ATOM 973 CG PHE A 142 180.842 -0.302 1.034 1.00 0.00 C ATOM 974 CD1 PHE A 142 182.209 -0.597 0.964 1.00 0.00 C ATOM 975 CD2 PHE A 142 179.971 -0.784 0.048 1.00 0.00 C ATOM 976 CE1 PHE A 142 182.705 -1.371 -0.092 1.00 0.00 C ATOM 977 CE2 PHE A 142 180.467 -1.560 -1.006 1.00 0.00 C ATOM 978 CZ PHE A 142 181.834 -1.853 -1.077 1.00 0.00 C ATOM 0 H PHE A 142 179.944 1.937 4.096 1.00 0.00 H new ATOM 0 HA PHE A 142 182.128 1.713 2.151 1.00 0.00 H new ATOM 0 HB2 PHE A 142 180.412 -0.029 3.115 1.00 0.00 H new ATOM 0 HB3 PHE A 142 179.239 0.703 2.038 1.00 0.00 H new ATOM 0 HD1 PHE A 142 182.881 -0.227 1.725 1.00 0.00 H new ATOM 0 HD2 PHE A 142 178.917 -0.557 0.101 1.00 0.00 H new ATOM 0 HE1 PHE A 142 183.760 -1.596 -0.147 1.00 0.00 H new ATOM 0 HE2 PHE A 142 179.795 -1.933 -1.765 1.00 0.00 H new ATOM 0 HZ PHE A 142 182.217 -2.451 -1.891 1.00 0.00 H new ATOM 988 N ILE A 143 179.580 3.564 1.392 1.00 0.00 N ATOM 989 CA ILE A 143 179.098 4.524 0.357 1.00 0.00 C ATOM 990 C ILE A 143 179.872 5.845 0.457 1.00 0.00 C ATOM 991 O ILE A 143 180.391 6.345 -0.523 1.00 0.00 O ATOM 992 CB ILE A 143 177.614 4.730 0.684 1.00 0.00 C ATOM 993 CG1 ILE A 143 176.870 3.402 0.531 1.00 0.00 C ATOM 994 CG2 ILE A 143 177.006 5.756 -0.271 1.00 0.00 C ATOM 995 CD1 ILE A 143 175.472 3.527 1.139 1.00 0.00 C ATOM 0 H ILE A 143 179.042 3.559 2.259 1.00 0.00 H new ATOM 0 HA ILE A 143 179.244 4.157 -0.659 1.00 0.00 H new ATOM 0 HB ILE A 143 177.523 5.091 1.708 1.00 0.00 H new ATOM 0 HG12 ILE A 143 176.797 3.133 -0.523 1.00 0.00 H new ATOM 0 HG13 ILE A 143 177.423 2.604 1.026 1.00 0.00 H new ATOM 0 HG21 ILE A 143 175.952 5.896 -0.032 1.00 0.00 H new ATOM 0 HG22 ILE A 143 177.531 6.706 -0.167 1.00 0.00 H new ATOM 0 HG23 ILE A 143 177.101 5.399 -1.297 1.00 0.00 H new ATOM 0 HD11 ILE A 143 174.942 2.581 1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 143 175.556 3.776 2.197 1.00 0.00 H new ATOM 0 HD13 ILE A 143 174.920 4.313 0.624 1.00 0.00 H new ATOM 1007 N GLU A 144 179.948 6.409 1.633 1.00 0.00 N ATOM 1008 CA GLU A 144 180.684 7.701 1.811 1.00 0.00 C ATOM 1009 C GLU A 144 182.168 7.533 1.477 1.00 0.00 C ATOM 1010 O GLU A 144 182.824 8.482 1.089 1.00 0.00 O ATOM 1011 CB GLU A 144 180.516 8.059 3.288 1.00 0.00 C ATOM 1012 CG GLU A 144 179.057 8.429 3.563 1.00 0.00 C ATOM 1013 CD GLU A 144 178.891 8.784 5.042 1.00 0.00 C ATOM 1014 OE1 GLU A 144 179.132 9.929 5.387 1.00 0.00 O ATOM 1015 OE2 GLU A 144 178.525 7.904 5.804 1.00 0.00 O ATOM 0 H GLU A 144 179.531 6.031 2.484 1.00 0.00 H new ATOM 0 HA GLU A 144 180.297 8.477 1.150 1.00 0.00 H new ATOM 0 HB2 GLU A 144 180.812 7.216 3.913 1.00 0.00 H new ATOM 0 HB3 GLU A 144 181.168 8.893 3.547 1.00 0.00 H new ATOM 0 HG2 GLU A 144 178.761 9.273 2.940 1.00 0.00 H new ATOM 0 HG3 GLU A 144 178.404 7.596 3.302 1.00 0.00 H new ATOM 1022 N ASP A 145 182.707 6.347 1.618 1.00 0.00 N ATOM 1023 CA ASP A 145 184.154 6.151 1.298 1.00 0.00 C ATOM 1024 C ASP A 145 184.343 5.804 -0.189 1.00 0.00 C ATOM 1025 O ASP A 145 185.436 5.914 -0.713 1.00 0.00 O ATOM 1026 CB ASP A 145 184.640 5.021 2.206 1.00 0.00 C ATOM 1027 CG ASP A 145 186.162 4.904 2.105 1.00 0.00 C ATOM 1028 OD1 ASP A 145 186.823 5.924 2.203 1.00 0.00 O ATOM 1029 OD2 ASP A 145 186.640 3.794 1.933 1.00 0.00 O ATOM 0 H ASP A 145 182.213 5.514 1.938 1.00 0.00 H new ATOM 0 HA ASP A 145 184.729 7.060 1.471 1.00 0.00 H new ATOM 0 HB2 ASP A 145 184.347 5.218 3.237 1.00 0.00 H new ATOM 0 HB3 ASP A 145 184.172 4.080 1.916 1.00 0.00 H new ATOM 1034 N VAL A 146 183.294 5.424 -0.882 1.00 0.00 N ATOM 1035 CA VAL A 146 183.430 5.121 -2.340 1.00 0.00 C ATOM 1036 C VAL A 146 183.034 6.371 -3.142 1.00 0.00 C ATOM 1037 O VAL A 146 183.682 6.740 -4.104 1.00 0.00 O ATOM 1038 CB VAL A 146 182.473 3.946 -2.599 1.00 0.00 C ATOM 1039 CG1 VAL A 146 182.346 3.681 -4.104 1.00 0.00 C ATOM 1040 CG2 VAL A 146 183.030 2.692 -1.922 1.00 0.00 C ATOM 0 H VAL A 146 182.354 5.312 -0.501 1.00 0.00 H new ATOM 0 HA VAL A 146 184.445 4.858 -2.638 1.00 0.00 H new ATOM 0 HB VAL A 146 181.491 4.194 -2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 146 181.665 2.846 -4.270 1.00 0.00 H new ATOM 0 HG12 VAL A 146 181.957 4.571 -4.599 1.00 0.00 H new ATOM 0 HG13 VAL A 146 183.326 3.437 -4.514 1.00 0.00 H new ATOM 0 HG21 VAL A 146 182.357 1.853 -2.100 1.00 0.00 H new ATOM 0 HG22 VAL A 146 184.013 2.463 -2.333 1.00 0.00 H new ATOM 0 HG23 VAL A 146 183.117 2.866 -0.849 1.00 0.00 H new ATOM 1050 N LEU A 147 181.977 7.025 -2.734 1.00 0.00 N ATOM 1051 CA LEU A 147 181.517 8.262 -3.441 1.00 0.00 C ATOM 1052 C LEU A 147 182.575 9.374 -3.386 1.00 0.00 C ATOM 1053 O LEU A 147 182.511 10.331 -4.135 1.00 0.00 O ATOM 1054 CB LEU A 147 180.240 8.700 -2.709 1.00 0.00 C ATOM 1055 CG LEU A 147 178.996 8.354 -3.545 1.00 0.00 C ATOM 1056 CD1 LEU A 147 179.054 9.080 -4.893 1.00 0.00 C ATOM 1057 CD2 LEU A 147 178.930 6.838 -3.780 1.00 0.00 C ATOM 0 H LEU A 147 181.406 6.753 -1.933 1.00 0.00 H new ATOM 0 HA LEU A 147 181.340 8.065 -4.498 1.00 0.00 H new ATOM 0 HB2 LEU A 147 180.182 8.207 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 147 180.272 9.773 -2.520 1.00 0.00 H new ATOM 0 HG LEU A 147 178.106 8.674 -3.003 1.00 0.00 H new ATOM 0 HD11 LEU A 147 178.170 8.830 -5.479 1.00 0.00 H new ATOM 0 HD12 LEU A 147 179.086 10.157 -4.725 1.00 0.00 H new ATOM 0 HD13 LEU A 147 179.948 8.771 -5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 147 178.047 6.600 -4.373 1.00 0.00 H new ATOM 0 HD22 LEU A 147 179.823 6.513 -4.314 1.00 0.00 H new ATOM 0 HD23 LEU A 147 178.873 6.323 -2.821 1.00 0.00 H new ATOM 1069 N ARG A 148 183.550 9.256 -2.516 1.00 0.00 N ATOM 1070 CA ARG A 148 184.613 10.309 -2.427 1.00 0.00 C ATOM 1071 C ARG A 148 185.333 10.444 -3.773 1.00 0.00 C ATOM 1072 O ARG A 148 185.585 9.466 -4.450 1.00 0.00 O ATOM 1073 CB ARG A 148 185.589 9.808 -1.359 1.00 0.00 C ATOM 1074 CG ARG A 148 185.222 10.416 -0.004 1.00 0.00 C ATOM 1075 CD ARG A 148 186.336 10.130 1.005 1.00 0.00 C ATOM 1076 NE ARG A 148 187.425 11.084 0.657 1.00 0.00 N ATOM 1077 CZ ARG A 148 188.655 10.830 1.013 1.00 0.00 C ATOM 1078 NH1 ARG A 148 188.969 10.779 2.278 1.00 0.00 N ATOM 1079 NH2 ARG A 148 189.570 10.628 0.104 1.00 0.00 N ATOM 0 H ARG A 148 183.656 8.478 -1.865 1.00 0.00 H new ATOM 0 HA ARG A 148 184.200 11.286 -2.178 1.00 0.00 H new ATOM 0 HB2 ARG A 148 185.555 8.720 -1.302 1.00 0.00 H new ATOM 0 HB3 ARG A 148 186.609 10.081 -1.627 1.00 0.00 H new ATOM 0 HG2 ARG A 148 185.076 11.491 -0.104 1.00 0.00 H new ATOM 0 HG3 ARG A 148 184.280 9.998 0.351 1.00 0.00 H new ATOM 0 HD2 ARG A 148 185.991 10.281 2.028 1.00 0.00 H new ATOM 0 HD3 ARG A 148 186.678 9.097 0.933 1.00 0.00 H new ATOM 0 HE ARG A 148 187.210 11.937 0.140 1.00 0.00 H new ATOM 0 HH11 ARG A 148 188.254 10.937 2.988 1.00 0.00 H new ATOM 0 HH12 ARG A 148 189.930 10.581 2.557 1.00 0.00 H new ATOM 0 HH21 ARG A 148 189.324 10.669 -0.885 1.00 0.00 H new ATOM 0 HH22 ARG A 148 190.531 10.430 0.383 1.00 0.00 H new ATOM 1093 N GLN A 149 185.663 11.650 -4.161 1.00 0.00 N ATOM 1094 CA GLN A 149 186.368 11.858 -5.465 1.00 0.00 C ATOM 1095 C GLN A 149 187.708 11.116 -5.467 1.00 0.00 C ATOM 1096 O GLN A 149 188.246 10.902 -4.394 1.00 0.00 O ATOM 1097 CB GLN A 149 186.592 13.368 -5.568 1.00 0.00 C ATOM 1098 CG GLN A 149 186.924 13.738 -7.015 1.00 0.00 C ATOM 1099 CD GLN A 149 185.705 13.476 -7.902 1.00 0.00 C ATOM 1100 OE1 GLN A 149 184.648 14.034 -7.682 1.00 0.00 O ATOM 1101 NE2 GLN A 149 185.808 12.644 -8.902 1.00 0.00 N ATOM 1102 OXT GLN A 149 188.172 10.776 -6.544 1.00 0.00 O ATOM 0 H GLN A 149 185.475 12.501 -3.631 1.00 0.00 H new ATOM 0 HA GLN A 149 185.791 11.477 -6.307 1.00 0.00 H new ATOM 0 HB2 GLN A 149 185.700 13.902 -5.241 1.00 0.00 H new ATOM 0 HB3 GLN A 149 187.405 13.671 -4.908 1.00 0.00 H new ATOM 0 HG2 GLN A 149 187.213 14.787 -7.076 1.00 0.00 H new ATOM 0 HG3 GLN A 149 187.774 13.153 -7.365 1.00 0.00 H new ATOM 0 HE21 GLN A 149 186.695 12.176 -9.087 1.00 0.00 H new ATOM 0 HE22 GLN A 149 185.001 12.462 -9.499 1.00 0.00 H new TER 1111 GLN A 149