USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 871 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 68 TYR OH : rot 180:sc= 0.0629 USER MOD Set 1.2: A 101 LYS NZ :NH3+ 178:sc= 0.068 (180deg=0.00276) USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.33 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 172:sc= -1.78! USER MOD Single : A 13 SER OG : rot 50:sc= -1 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 37:sc= -0.0599 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.645 K(o=-0.64,f=-4.1) USER MOD Single : A 46 SER OG : rot -90:sc= 0.629 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.322 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 150:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -1.56 K(o=-1.6,f=-2.1) USER MOD Single : A 72 ASN : amide:sc= -0.321 K(o=-0.32,f=-1.7) USER MOD Single : A 76 SER OG : rot -55:sc= 0.0927 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.209 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.0583 X(o=-0.058,f=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -152:sc= -0.418 (180deg=-1.73!) USER MOD Single : A 130 SER OG : rot -55:sc= 0.0156 USER MOD ----------------------------------------------------------------- ATOM 18 N LEU A 2 3.753 0.101 -1.968 1.00 0.00 N ATOM 19 CA LEU A 2 5.203 0.180 -1.836 1.00 0.00 C ATOM 20 C LEU A 2 5.656 1.627 -1.663 1.00 0.00 C ATOM 21 O LEU A 2 4.838 2.547 -1.652 1.00 0.00 O ATOM 22 CB LEU A 2 5.881 -0.435 -3.061 1.00 0.00 C ATOM 23 CG LEU A 2 6.461 -1.838 -2.873 1.00 0.00 C ATOM 24 CD1 LEU A 2 6.673 -2.512 -4.220 1.00 0.00 C ATOM 25 CD2 LEU A 2 7.768 -1.775 -2.095 1.00 0.00 C ATOM 0 HA LEU A 2 5.493 -0.381 -0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.156 -0.469 -3.874 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.685 0.229 -3.379 1.00 0.00 H new ATOM 0 HG LEU A 2 5.748 -2.432 -2.300 1.00 0.00 H new ATOM 0 HD11 LEU A 2 7.086 -3.509 -4.067 1.00 0.00 H new ATOM 0 HD12 LEU A 2 5.719 -2.591 -4.742 1.00 0.00 H new ATOM 0 HD13 LEU A 2 7.366 -1.920 -4.818 1.00 0.00 H new ATOM 0 HD21 LEU A 2 8.166 -2.782 -1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 2 8.488 -1.165 -2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 2 7.587 -1.333 -1.115 1.00 0.00 H new ATOM 37 N LEU A 3 6.964 1.820 -1.530 1.00 0.00 N ATOM 38 CA LEU A 3 7.526 3.155 -1.360 1.00 0.00 C ATOM 39 C LEU A 3 8.914 3.245 -1.987 1.00 0.00 C ATOM 40 O LEU A 3 9.720 4.098 -1.615 1.00 0.00 O ATOM 41 CB LEU A 3 7.601 3.514 0.125 1.00 0.00 C ATOM 42 CG LEU A 3 6.324 4.083 0.743 1.00 0.00 C ATOM 43 CD1 LEU A 3 5.388 2.961 1.164 1.00 0.00 C ATOM 44 CD2 LEU A 3 6.657 4.975 1.930 1.00 0.00 C ATOM 0 H LEU A 3 7.654 1.069 -1.537 1.00 0.00 H new ATOM 0 HA LEU A 3 6.871 3.865 -1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.882 2.620 0.681 1.00 0.00 H new ATOM 0 HB3 LEU A 3 8.402 4.240 0.263 1.00 0.00 H new ATOM 0 HG LEU A 3 5.818 4.687 -0.010 1.00 0.00 H new ATOM 0 HD11 LEU A 3 4.485 3.386 1.602 1.00 0.00 H new ATOM 0 HD12 LEU A 3 5.122 2.363 0.293 1.00 0.00 H new ATOM 0 HD13 LEU A 3 5.885 2.329 1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 3 5.736 5.371 2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 3 7.186 4.394 2.685 1.00 0.00 H new ATOM 0 HD23 LEU A 3 7.288 5.800 1.599 1.00 0.00 H new ATOM 56 N ILE A 4 9.185 2.361 -2.942 1.00 0.00 N ATOM 57 CA ILE A 4 10.473 2.343 -3.622 1.00 0.00 C ATOM 58 C ILE A 4 10.399 3.073 -4.959 1.00 0.00 C ATOM 59 O ILE A 4 9.320 3.454 -5.413 1.00 0.00 O ATOM 60 CB ILE A 4 10.963 0.903 -3.863 1.00 0.00 C ATOM 61 CG1 ILE A 4 9.952 0.134 -4.718 1.00 0.00 C ATOM 62 CG2 ILE A 4 11.193 0.192 -2.538 1.00 0.00 C ATOM 63 CD1 ILE A 4 10.582 -0.935 -5.583 1.00 0.00 C ATOM 0 H ILE A 4 8.529 1.648 -3.262 1.00 0.00 H new ATOM 0 HA ILE A 4 11.181 2.854 -2.970 1.00 0.00 H new ATOM 0 HB ILE A 4 11.911 0.943 -4.400 1.00 0.00 H new ATOM 0 HG12 ILE A 4 9.212 -0.328 -4.064 1.00 0.00 H new ATOM 0 HG13 ILE A 4 9.418 0.838 -5.356 1.00 0.00 H new ATOM 0 HG21 ILE A 4 11.539 -0.824 -2.726 1.00 0.00 H new ATOM 0 HG22 ILE A 4 11.945 0.731 -1.962 1.00 0.00 H new ATOM 0 HG23 ILE A 4 10.260 0.160 -1.976 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.807 -1.439 -6.161 1.00 0.00 H new ATOM 0 HD12 ILE A 4 11.301 -0.477 -6.262 1.00 0.00 H new ATOM 0 HD13 ILE A 4 11.092 -1.661 -4.950 1.00 0.00 H new ATOM 75 N THR A 5 11.555 3.265 -5.587 1.00 0.00 N ATOM 76 CA THR A 5 11.622 3.949 -6.872 1.00 0.00 C ATOM 77 C THR A 5 11.963 2.976 -7.995 1.00 0.00 C ATOM 78 O THR A 5 12.753 2.047 -7.826 1.00 0.00 O ATOM 79 CB THR A 5 12.668 5.080 -6.853 1.00 0.00 C ATOM 80 OG1 THR A 5 12.627 5.806 -8.086 1.00 0.00 O ATOM 81 CG2 THR A 5 14.066 4.521 -6.634 1.00 0.00 C ATOM 0 H THR A 5 12.458 2.956 -5.226 1.00 0.00 H new ATOM 0 HA THR A 5 10.637 4.379 -7.053 1.00 0.00 H new ATOM 0 HB THR A 5 12.429 5.752 -6.028 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.294 6.524 -8.065 1.00 0.00 H new ATOM 0 HG21 THR A 5 14.787 5.338 -6.624 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.102 3.994 -5.680 1.00 0.00 H new ATOM 0 HG23 THR A 5 14.312 3.830 -7.440 1.00 0.00 H new ATOM 89 N PRO A 6 11.355 3.193 -9.171 1.00 0.00 N ATOM 90 CA PRO A 6 11.580 2.346 -10.346 1.00 0.00 C ATOM 91 C PRO A 6 12.980 2.519 -10.927 1.00 0.00 C ATOM 92 O PRO A 6 13.413 1.735 -11.771 1.00 0.00 O ATOM 93 CB PRO A 6 10.524 2.833 -11.342 1.00 0.00 C ATOM 94 CG PRO A 6 10.244 4.239 -10.939 1.00 0.00 C ATOM 95 CD PRO A 6 10.402 4.281 -9.444 1.00 0.00 C ATOM 0 HA PRO A 6 11.502 1.286 -10.105 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.892 2.781 -12.367 1.00 0.00 H new ATOM 0 HB3 PRO A 6 9.623 2.221 -11.295 1.00 0.00 H new ATOM 0 HG2 PRO A 6 10.935 4.929 -11.424 1.00 0.00 H new ATOM 0 HG3 PRO A 6 9.238 4.536 -11.233 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.785 5.244 -9.107 1.00 0.00 H new ATOM 0 HD3 PRO A 6 9.452 4.120 -8.935 1.00 0.00 H new ATOM 103 N ASP A 7 13.681 3.549 -10.468 1.00 0.00 N ATOM 104 CA ASP A 7 15.033 3.825 -10.941 1.00 0.00 C ATOM 105 C ASP A 7 16.043 2.901 -10.268 1.00 0.00 C ATOM 106 O ASP A 7 17.071 2.558 -10.852 1.00 0.00 O ATOM 107 CB ASP A 7 15.402 5.285 -10.675 1.00 0.00 C ATOM 108 CG ASP A 7 16.623 5.726 -11.459 1.00 0.00 C ATOM 109 OD1 ASP A 7 17.217 4.879 -12.159 1.00 0.00 O ATOM 110 OD2 ASP A 7 16.983 6.918 -11.374 1.00 0.00 O ATOM 0 H ASP A 7 13.336 4.207 -9.769 1.00 0.00 H new ATOM 0 HA ASP A 7 15.060 3.642 -12.015 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.557 5.923 -10.934 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.589 5.421 -9.610 1.00 0.00 H new ATOM 115 N GLU A 8 15.743 2.502 -9.035 1.00 0.00 N ATOM 116 CA GLU A 8 16.626 1.620 -8.282 1.00 0.00 C ATOM 117 C GLU A 8 16.551 0.191 -8.815 1.00 0.00 C ATOM 118 O GLU A 8 17.528 -0.557 -8.756 1.00 0.00 O ATOM 119 CB GLU A 8 16.260 1.642 -6.797 1.00 0.00 C ATOM 120 CG GLU A 8 17.307 2.309 -5.922 1.00 0.00 C ATOM 121 CD GLU A 8 18.637 1.580 -5.942 1.00 0.00 C ATOM 122 OE1 GLU A 8 18.662 0.406 -6.370 1.00 0.00 O ATOM 123 OE2 GLU A 8 19.651 2.181 -5.532 1.00 0.00 O ATOM 0 H GLU A 8 14.896 2.776 -8.538 1.00 0.00 H new ATOM 0 HA GLU A 8 17.647 1.981 -8.402 1.00 0.00 H new ATOM 0 HB2 GLU A 8 15.310 2.162 -6.673 1.00 0.00 H new ATOM 0 HB3 GLU A 8 16.110 0.619 -6.453 1.00 0.00 H new ATOM 0 HG2 GLU A 8 17.455 3.335 -6.258 1.00 0.00 H new ATOM 0 HG3 GLU A 8 16.940 2.359 -4.897 1.00 0.00 H new ATOM 130 N LEU A 9 15.386 -0.180 -9.333 1.00 0.00 N ATOM 131 CA LEU A 9 15.182 -1.518 -9.876 1.00 0.00 C ATOM 132 C LEU A 9 16.178 -1.810 -10.994 1.00 0.00 C ATOM 133 O LEU A 9 16.795 -2.875 -11.029 1.00 0.00 O ATOM 134 CB LEU A 9 13.752 -1.665 -10.400 1.00 0.00 C ATOM 135 CG LEU A 9 13.548 -2.690 -11.516 1.00 0.00 C ATOM 136 CD1 LEU A 9 13.964 -4.076 -11.050 1.00 0.00 C ATOM 137 CD2 LEU A 9 12.098 -2.694 -11.978 1.00 0.00 C ATOM 0 H LEU A 9 14.568 0.427 -9.389 1.00 0.00 H new ATOM 0 HA LEU A 9 15.344 -2.237 -9.073 1.00 0.00 H new ATOM 0 HB2 LEU A 9 13.106 -1.934 -9.564 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.417 -0.693 -10.761 1.00 0.00 H new ATOM 0 HG LEU A 9 14.177 -2.409 -12.361 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.812 -4.792 -11.857 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.017 -4.064 -10.769 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.362 -4.366 -10.189 1.00 0.00 H new ATOM 0 HD21 LEU A 9 11.971 -3.429 -12.773 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.450 -2.950 -11.140 1.00 0.00 H new ATOM 0 HD23 LEU A 9 11.833 -1.705 -12.353 1.00 0.00 H new ATOM 149 N LYS A 10 16.331 -0.856 -11.906 1.00 0.00 N ATOM 150 CA LYS A 10 17.255 -1.008 -13.025 1.00 0.00 C ATOM 151 C LYS A 10 18.702 -0.924 -12.550 1.00 0.00 C ATOM 152 O LYS A 10 19.572 -1.636 -13.053 1.00 0.00 O ATOM 153 CB LYS A 10 16.990 0.068 -14.081 1.00 0.00 C ATOM 154 CG LYS A 10 17.057 1.484 -13.536 1.00 0.00 C ATOM 155 CD LYS A 10 16.851 2.514 -14.635 1.00 0.00 C ATOM 156 CE LYS A 10 15.400 2.562 -15.089 1.00 0.00 C ATOM 157 NZ LYS A 10 15.090 3.821 -15.821 1.00 0.00 N ATOM 0 H LYS A 10 15.827 0.031 -11.893 1.00 0.00 H new ATOM 0 HA LYS A 10 17.093 -1.991 -13.468 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.718 -0.037 -14.886 1.00 0.00 H new ATOM 0 HB3 LYS A 10 16.005 -0.098 -14.518 1.00 0.00 H new ATOM 0 HG2 LYS A 10 16.297 1.615 -12.766 1.00 0.00 H new ATOM 0 HG3 LYS A 10 18.024 1.647 -13.060 1.00 0.00 H new ATOM 0 HD2 LYS A 10 17.153 3.497 -14.275 1.00 0.00 H new ATOM 0 HD3 LYS A 10 17.491 2.275 -15.484 1.00 0.00 H new ATOM 0 HE2 LYS A 10 15.192 1.707 -15.732 1.00 0.00 H new ATOM 0 HE3 LYS A 10 14.745 2.475 -14.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 14.092 3.816 -16.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 15.264 4.636 -15.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 15.697 3.892 -16.662 1.00 0.00 H new ATOM 171 N SER A 11 18.952 -0.052 -11.579 1.00 0.00 N ATOM 172 CA SER A 11 20.295 0.126 -11.038 1.00 0.00 C ATOM 173 C SER A 11 20.751 -1.126 -10.295 1.00 0.00 C ATOM 174 O SER A 11 21.934 -1.469 -10.301 1.00 0.00 O ATOM 175 CB SER A 11 20.334 1.332 -10.099 1.00 0.00 C ATOM 176 OG SER A 11 21.477 2.133 -10.344 1.00 0.00 O ATOM 0 H SER A 11 18.243 0.542 -11.150 1.00 0.00 H new ATOM 0 HA SER A 11 20.975 0.302 -11.871 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.432 1.930 -10.232 1.00 0.00 H new ATOM 0 HB3 SER A 11 20.340 0.991 -9.064 1.00 0.00 H new ATOM 0 HG SER A 11 21.477 2.898 -9.732 1.00 0.00 H new ATOM 182 N TYR A 12 19.805 -1.805 -9.657 1.00 0.00 N ATOM 183 CA TYR A 12 20.109 -3.018 -8.907 1.00 0.00 C ATOM 184 C TYR A 12 20.095 -4.241 -9.819 1.00 0.00 C ATOM 185 O TYR A 12 21.025 -5.048 -9.809 1.00 0.00 O ATOM 186 CB TYR A 12 19.104 -3.205 -7.769 1.00 0.00 C ATOM 187 CG TYR A 12 19.214 -4.545 -7.077 1.00 0.00 C ATOM 188 CD1 TYR A 12 18.452 -5.629 -7.494 1.00 0.00 C ATOM 189 CD2 TYR A 12 20.080 -4.726 -6.006 1.00 0.00 C ATOM 190 CE1 TYR A 12 18.549 -6.855 -6.864 1.00 0.00 C ATOM 191 CE2 TYR A 12 20.185 -5.948 -5.371 1.00 0.00 C ATOM 192 CZ TYR A 12 19.417 -7.010 -5.804 1.00 0.00 C ATOM 193 OH TYR A 12 19.518 -8.229 -5.173 1.00 0.00 O ATOM 0 H TYR A 12 18.821 -1.536 -9.644 1.00 0.00 H new ATOM 0 HA TYR A 12 21.109 -2.913 -8.486 1.00 0.00 H new ATOM 0 HB2 TYR A 12 19.249 -2.413 -7.034 1.00 0.00 H new ATOM 0 HB3 TYR A 12 18.095 -3.092 -8.165 1.00 0.00 H new ATOM 0 HD1 TYR A 12 17.772 -5.512 -8.325 1.00 0.00 H new ATOM 0 HD2 TYR A 12 20.682 -3.897 -5.664 1.00 0.00 H new ATOM 0 HE1 TYR A 12 17.948 -7.687 -7.200 1.00 0.00 H new ATOM 0 HE2 TYR A 12 20.864 -6.072 -4.540 1.00 0.00 H new ATOM 0 HH TYR A 12 20.261 -8.206 -4.534 1.00 0.00 H new ATOM 203 N SER A 13 19.033 -4.370 -10.607 1.00 0.00 N ATOM 204 CA SER A 13 18.894 -5.496 -11.524 1.00 0.00 C ATOM 205 C SER A 13 19.808 -5.327 -12.734 1.00 0.00 C ATOM 206 O SER A 13 19.966 -4.224 -13.258 1.00 0.00 O ATOM 207 CB SER A 13 17.441 -5.631 -11.983 1.00 0.00 C ATOM 208 OG SER A 13 17.310 -6.639 -12.971 1.00 0.00 O ATOM 0 H SER A 13 18.256 -3.709 -10.629 1.00 0.00 H new ATOM 0 HA SER A 13 19.186 -6.403 -10.994 1.00 0.00 H new ATOM 0 HB2 SER A 13 16.807 -5.870 -11.129 1.00 0.00 H new ATOM 0 HB3 SER A 13 17.092 -4.679 -12.382 1.00 0.00 H new ATOM 0 HG SER A 13 17.749 -7.459 -12.662 1.00 0.00 H new ATOM 214 N VAL A 14 20.408 -6.428 -13.173 1.00 0.00 N ATOM 215 CA VAL A 14 21.306 -6.404 -14.322 1.00 0.00 C ATOM 216 C VAL A 14 20.560 -6.739 -15.609 1.00 0.00 C ATOM 217 O VAL A 14 21.170 -7.097 -16.617 1.00 0.00 O ATOM 218 CB VAL A 14 22.472 -7.395 -14.144 1.00 0.00 C ATOM 219 CG1 VAL A 14 23.220 -7.113 -12.850 1.00 0.00 C ATOM 220 CG2 VAL A 14 21.962 -8.828 -14.175 1.00 0.00 C ATOM 0 H VAL A 14 20.289 -7.349 -12.750 1.00 0.00 H new ATOM 0 HA VAL A 14 21.706 -5.392 -14.390 1.00 0.00 H new ATOM 0 HB VAL A 14 23.168 -7.264 -14.973 1.00 0.00 H new ATOM 0 HG11 VAL A 14 24.040 -7.823 -12.742 1.00 0.00 H new ATOM 0 HG12 VAL A 14 23.619 -6.099 -12.874 1.00 0.00 H new ATOM 0 HG13 VAL A 14 22.538 -7.215 -12.006 1.00 0.00 H new ATOM 0 HG21 VAL A 14 22.799 -9.515 -14.048 1.00 0.00 H new ATOM 0 HG22 VAL A 14 21.245 -8.976 -13.368 1.00 0.00 H new ATOM 0 HG23 VAL A 14 21.476 -9.021 -15.132 1.00 0.00 H new ATOM 230 N PHE A 15 19.237 -6.620 -15.568 1.00 0.00 N ATOM 231 CA PHE A 15 18.407 -6.911 -16.731 1.00 0.00 C ATOM 232 C PHE A 15 18.348 -5.710 -17.671 1.00 0.00 C ATOM 233 O PHE A 15 17.738 -4.690 -17.353 1.00 0.00 O ATOM 234 CB PHE A 15 16.994 -7.299 -16.292 1.00 0.00 C ATOM 235 CG PHE A 15 16.741 -8.779 -16.326 1.00 0.00 C ATOM 236 CD1 PHE A 15 16.117 -9.363 -17.416 1.00 0.00 C ATOM 237 CD2 PHE A 15 17.127 -9.586 -15.268 1.00 0.00 C ATOM 238 CE1 PHE A 15 15.883 -10.725 -17.451 1.00 0.00 C ATOM 239 CE2 PHE A 15 16.896 -10.948 -15.297 1.00 0.00 C ATOM 240 CZ PHE A 15 16.272 -11.518 -16.390 1.00 0.00 C ATOM 0 H PHE A 15 18.717 -6.324 -14.742 1.00 0.00 H new ATOM 0 HA PHE A 15 18.856 -7.748 -17.266 1.00 0.00 H new ATOM 0 HB2 PHE A 15 16.823 -6.932 -15.280 1.00 0.00 H new ATOM 0 HB3 PHE A 15 16.272 -6.800 -16.938 1.00 0.00 H new ATOM 0 HD1 PHE A 15 15.810 -8.747 -18.248 1.00 0.00 H new ATOM 0 HD2 PHE A 15 17.614 -9.145 -14.411 1.00 0.00 H new ATOM 0 HE1 PHE A 15 15.396 -11.168 -18.307 1.00 0.00 H new ATOM 0 HE2 PHE A 15 17.203 -11.566 -14.466 1.00 0.00 H new ATOM 0 HZ PHE A 15 16.089 -12.582 -16.414 1.00 0.00 H new ATOM 250 N GLU A 16 18.988 -5.840 -18.829 1.00 0.00 N ATOM 251 CA GLU A 16 19.009 -4.765 -19.814 1.00 0.00 C ATOM 252 C GLU A 16 17.594 -4.406 -20.259 1.00 0.00 C ATOM 253 O GLU A 16 17.337 -3.289 -20.706 1.00 0.00 O ATOM 254 CB GLU A 16 19.848 -5.172 -21.027 1.00 0.00 C ATOM 255 CG GLU A 16 19.179 -6.210 -21.911 1.00 0.00 C ATOM 256 CD GLU A 16 20.150 -7.257 -22.421 1.00 0.00 C ATOM 257 OE1 GLU A 16 20.133 -8.389 -21.893 1.00 0.00 O ATOM 258 OE2 GLU A 16 20.928 -6.944 -23.346 1.00 0.00 O ATOM 0 H GLU A 16 19.498 -6.678 -19.108 1.00 0.00 H new ATOM 0 HA GLU A 16 19.458 -3.888 -19.347 1.00 0.00 H new ATOM 0 HB2 GLU A 16 20.064 -4.285 -21.623 1.00 0.00 H new ATOM 0 HB3 GLU A 16 20.804 -5.564 -20.681 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.383 -6.701 -21.350 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.710 -5.711 -22.759 1.00 0.00 H new ATOM 265 N SER A 17 16.680 -5.363 -20.133 1.00 0.00 N ATOM 266 CA SER A 17 15.292 -5.151 -20.525 1.00 0.00 C ATOM 267 C SER A 17 14.557 -4.307 -19.488 1.00 0.00 C ATOM 268 O SER A 17 13.726 -3.466 -19.831 1.00 0.00 O ATOM 269 CB SER A 17 14.579 -6.493 -20.705 1.00 0.00 C ATOM 270 OG SER A 17 15.467 -7.479 -21.202 1.00 0.00 O ATOM 0 H SER A 17 16.876 -6.293 -19.762 1.00 0.00 H new ATOM 0 HA SER A 17 15.287 -4.615 -21.474 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.165 -6.819 -19.751 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.741 -6.374 -21.392 1.00 0.00 H new ATOM 0 HG SER A 17 14.988 -8.328 -21.307 1.00 0.00 H new ATOM 276 N VAL A 18 14.869 -4.539 -18.217 1.00 0.00 N ATOM 277 CA VAL A 18 14.240 -3.801 -17.128 1.00 0.00 C ATOM 278 C VAL A 18 14.778 -2.376 -17.048 1.00 0.00 C ATOM 279 O VAL A 18 14.061 -1.451 -16.666 1.00 0.00 O ATOM 280 CB VAL A 18 14.464 -4.499 -15.774 1.00 0.00 C ATOM 281 CG1 VAL A 18 13.864 -3.677 -14.643 1.00 0.00 C ATOM 282 CG2 VAL A 18 13.875 -5.902 -15.795 1.00 0.00 C ATOM 0 H VAL A 18 15.554 -5.232 -17.916 1.00 0.00 H new ATOM 0 HA VAL A 18 13.171 -3.772 -17.341 1.00 0.00 H new ATOM 0 HB VAL A 18 15.537 -4.582 -15.601 1.00 0.00 H new ATOM 0 HG11 VAL A 18 14.032 -4.186 -13.694 1.00 0.00 H new ATOM 0 HG12 VAL A 18 14.336 -2.695 -14.617 1.00 0.00 H new ATOM 0 HG13 VAL A 18 12.793 -3.560 -14.807 1.00 0.00 H new ATOM 0 HG21 VAL A 18 14.042 -6.381 -14.830 1.00 0.00 H new ATOM 0 HG22 VAL A 18 12.804 -5.844 -15.991 1.00 0.00 H new ATOM 0 HG23 VAL A 18 14.356 -6.487 -16.579 1.00 0.00 H new ATOM 292 N LYS A 19 16.044 -2.206 -17.411 1.00 0.00 N ATOM 293 CA LYS A 19 16.680 -0.894 -17.383 1.00 0.00 C ATOM 294 C LYS A 19 16.356 -0.105 -18.647 1.00 0.00 C ATOM 295 O LYS A 19 16.794 1.034 -18.810 1.00 0.00 O ATOM 296 CB LYS A 19 18.196 -1.042 -17.235 1.00 0.00 C ATOM 297 CG LYS A 19 18.904 -1.378 -18.536 1.00 0.00 C ATOM 298 CD LYS A 19 20.390 -1.608 -18.319 1.00 0.00 C ATOM 299 CE LYS A 19 20.641 -2.765 -17.364 1.00 0.00 C ATOM 300 NZ LYS A 19 21.278 -2.310 -16.097 1.00 0.00 N ATOM 0 H LYS A 19 16.651 -2.961 -17.729 1.00 0.00 H new ATOM 0 HA LYS A 19 16.289 -0.347 -16.525 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.606 -0.114 -16.837 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.407 -1.823 -16.504 1.00 0.00 H new ATOM 0 HG2 LYS A 19 18.457 -2.270 -18.975 1.00 0.00 H new ATOM 0 HG3 LYS A 19 18.761 -0.566 -19.249 1.00 0.00 H new ATOM 0 HD2 LYS A 19 20.871 -1.813 -19.275 1.00 0.00 H new ATOM 0 HD3 LYS A 19 20.845 -0.701 -17.921 1.00 0.00 H new ATOM 0 HE2 LYS A 19 19.697 -3.261 -17.138 1.00 0.00 H new ATOM 0 HE3 LYS A 19 21.281 -3.503 -17.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 21.433 -3.128 -15.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 22.191 -1.859 -16.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 20.656 -1.625 -15.622 1.00 0.00 H new ATOM 314 N THR A 20 15.585 -0.718 -19.541 1.00 0.00 N ATOM 315 CA THR A 20 15.203 -0.073 -20.790 1.00 0.00 C ATOM 316 C THR A 20 13.732 0.327 -20.775 1.00 0.00 C ATOM 317 O THR A 20 13.230 0.920 -21.730 1.00 0.00 O ATOM 318 CB THR A 20 15.460 -0.992 -21.999 1.00 0.00 C ATOM 319 OG1 THR A 20 15.120 -2.343 -21.668 1.00 0.00 O ATOM 320 CG2 THR A 20 16.917 -0.922 -22.432 1.00 0.00 C ATOM 0 H THR A 20 15.213 -1.660 -19.422 1.00 0.00 H new ATOM 0 HA THR A 20 15.819 0.821 -20.885 1.00 0.00 H new ATOM 0 HB THR A 20 14.835 -0.652 -22.825 1.00 0.00 H new ATOM 0 HG1 THR A 20 14.325 -2.349 -21.095 1.00 0.00 H new ATOM 0 HG21 THR A 20 17.074 -1.579 -23.287 1.00 0.00 H new ATOM 0 HG22 THR A 20 17.165 0.102 -22.711 1.00 0.00 H new ATOM 0 HG23 THR A 20 17.557 -1.239 -21.608 1.00 0.00 H new ATOM 328 N ARG A 21 13.046 0.000 -19.685 1.00 0.00 N ATOM 329 CA ARG A 21 11.631 0.325 -19.546 1.00 0.00 C ATOM 330 C ARG A 21 11.450 1.724 -18.964 1.00 0.00 C ATOM 331 O ARG A 21 12.310 2.244 -18.252 1.00 0.00 O ATOM 332 CB ARG A 21 10.935 -0.704 -18.653 1.00 0.00 C ATOM 333 CG ARG A 21 11.585 -2.077 -18.686 1.00 0.00 C ATOM 334 CD ARG A 21 10.752 -3.106 -17.937 1.00 0.00 C ATOM 335 NE ARG A 21 10.759 -4.405 -18.603 1.00 0.00 N ATOM 336 CZ ARG A 21 10.175 -4.634 -19.775 1.00 0.00 C ATOM 337 NH1 ARG A 21 9.543 -3.655 -20.406 1.00 0.00 N ATOM 338 NH2 ARG A 21 10.225 -5.844 -20.317 1.00 0.00 N ATOM 0 H ARG A 21 13.447 -0.490 -18.885 1.00 0.00 H new ATOM 0 HA ARG A 21 11.179 0.301 -20.537 1.00 0.00 H new ATOM 0 HB2 ARG A 21 10.931 -0.338 -17.626 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.894 -0.797 -18.963 1.00 0.00 H new ATOM 0 HG2 ARG A 21 11.714 -2.395 -19.721 1.00 0.00 H new ATOM 0 HG3 ARG A 21 12.580 -2.021 -18.244 1.00 0.00 H new ATOM 0 HD2 ARG A 21 11.138 -3.216 -16.923 1.00 0.00 H new ATOM 0 HD3 ARG A 21 9.726 -2.748 -17.851 1.00 0.00 H new ATOM 0 HE ARG A 21 11.238 -5.179 -18.144 1.00 0.00 H new ATOM 0 HH11 ARG A 21 9.504 -2.723 -19.993 1.00 0.00 H new ATOM 0 HH12 ARG A 21 9.096 -3.833 -21.305 1.00 0.00 H new ATOM 0 HH21 ARG A 21 10.712 -6.599 -19.834 1.00 0.00 H new ATOM 0 HH22 ARG A 21 9.777 -6.019 -21.216 1.00 0.00 H new ATOM 352 N PRO A 22 10.305 2.350 -19.273 1.00 0.00 N ATOM 353 CA PRO A 22 9.983 3.697 -18.792 1.00 0.00 C ATOM 354 C PRO A 22 9.709 3.726 -17.292 1.00 0.00 C ATOM 355 O PRO A 22 9.938 2.741 -16.590 1.00 0.00 O ATOM 356 CB PRO A 22 8.719 4.061 -19.575 1.00 0.00 C ATOM 357 CG PRO A 22 8.096 2.752 -19.918 1.00 0.00 C ATOM 358 CD PRO A 22 9.235 1.791 -20.117 1.00 0.00 C ATOM 0 HA PRO A 22 10.809 4.392 -18.943 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.046 4.675 -18.977 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.959 4.632 -20.472 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.435 2.414 -19.120 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.491 2.832 -20.821 1.00 0.00 H new ATOM 0 HD2 PRO A 22 8.967 0.781 -19.809 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.536 1.736 -21.163 1.00 0.00 H new ATOM 366 N ASP A 23 9.217 4.861 -16.808 1.00 0.00 N ATOM 367 CA ASP A 23 8.909 5.018 -15.391 1.00 0.00 C ATOM 368 C ASP A 23 7.511 4.496 -15.077 1.00 0.00 C ATOM 369 O ASP A 23 7.239 4.055 -13.961 1.00 0.00 O ATOM 370 CB ASP A 23 9.022 6.488 -14.983 1.00 0.00 C ATOM 371 CG ASP A 23 10.423 7.036 -15.174 1.00 0.00 C ATOM 372 OD1 ASP A 23 10.562 8.268 -15.327 1.00 0.00 O ATOM 373 OD2 ASP A 23 11.379 6.233 -15.171 1.00 0.00 O ATOM 0 H ASP A 23 9.023 5.686 -17.376 1.00 0.00 H new ATOM 0 HA ASP A 23 9.631 4.434 -14.821 1.00 0.00 H new ATOM 0 HB2 ASP A 23 8.320 7.080 -15.570 1.00 0.00 H new ATOM 0 HB3 ASP A 23 8.732 6.595 -13.938 1.00 0.00 H new ATOM 378 N GLU A 24 6.627 4.551 -16.070 1.00 0.00 N ATOM 379 CA GLU A 24 5.256 4.086 -15.898 1.00 0.00 C ATOM 380 C GLU A 24 5.202 2.562 -15.844 1.00 0.00 C ATOM 381 O GLU A 24 4.493 1.983 -15.020 1.00 0.00 O ATOM 382 CB GLU A 24 4.373 4.598 -17.037 1.00 0.00 C ATOM 383 CG GLU A 24 4.874 4.209 -18.418 1.00 0.00 C ATOM 384 CD GLU A 24 4.646 5.296 -19.450 1.00 0.00 C ATOM 385 OE1 GLU A 24 5.624 5.694 -20.117 1.00 0.00 O ATOM 386 OE2 GLU A 24 3.491 5.750 -19.589 1.00 0.00 O ATOM 0 H GLU A 24 6.836 4.913 -17.000 1.00 0.00 H new ATOM 0 HA GLU A 24 4.882 4.480 -14.953 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.363 4.211 -16.904 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.309 5.684 -16.976 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.939 3.983 -18.363 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.371 3.297 -18.739 1.00 0.00 H new ATOM 393 N LEU A 25 5.956 1.917 -16.728 1.00 0.00 N ATOM 394 CA LEU A 25 5.994 0.460 -16.783 1.00 0.00 C ATOM 395 C LEU A 25 6.652 -0.115 -15.532 1.00 0.00 C ATOM 396 O LEU A 25 6.065 -0.944 -14.835 1.00 0.00 O ATOM 397 CB LEU A 25 6.751 -0.003 -18.029 1.00 0.00 C ATOM 398 CG LEU A 25 5.947 -0.032 -19.330 1.00 0.00 C ATOM 399 CD1 LEU A 25 6.823 -0.486 -20.488 1.00 0.00 C ATOM 400 CD2 LEU A 25 4.734 -0.939 -19.188 1.00 0.00 C ATOM 0 H LEU A 25 6.549 2.380 -17.416 1.00 0.00 H new ATOM 0 HA LEU A 25 4.968 0.096 -16.832 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.611 0.651 -18.171 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.139 -1.004 -17.843 1.00 0.00 H new ATOM 0 HG LEU A 25 5.596 0.978 -19.541 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.235 -0.501 -21.405 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.659 0.204 -20.604 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.204 -1.487 -20.285 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.174 -0.947 -20.123 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.062 -1.951 -18.953 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.095 -0.569 -18.386 1.00 0.00 H new ATOM 412 N LEU A 26 7.871 0.332 -15.253 1.00 0.00 N ATOM 413 CA LEU A 26 8.608 -0.136 -14.084 1.00 0.00 C ATOM 414 C LEU A 26 7.748 -0.049 -12.827 1.00 0.00 C ATOM 415 O LEU A 26 7.817 -0.913 -11.953 1.00 0.00 O ATOM 416 CB LEU A 26 9.886 0.684 -13.900 1.00 0.00 C ATOM 417 CG LEU A 26 11.050 0.330 -14.826 1.00 0.00 C ATOM 418 CD1 LEU A 26 12.262 1.195 -14.515 1.00 0.00 C ATOM 419 CD2 LEU A 26 11.400 -1.146 -14.703 1.00 0.00 C ATOM 0 H LEU A 26 8.370 1.018 -15.820 1.00 0.00 H new ATOM 0 HA LEU A 26 8.875 -1.180 -14.247 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.642 1.737 -14.042 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.221 0.571 -12.869 1.00 0.00 H new ATOM 0 HG LEU A 26 10.744 0.526 -15.854 1.00 0.00 H new ATOM 0 HD11 LEU A 26 13.080 0.929 -15.184 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.005 2.245 -14.656 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.570 1.032 -13.482 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.230 -1.380 -15.369 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.686 -1.368 -13.675 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.534 -1.749 -14.977 1.00 0.00 H new ATOM 431 N LYS A 27 6.937 1.000 -12.743 1.00 0.00 N ATOM 432 CA LYS A 27 6.061 1.201 -11.596 1.00 0.00 C ATOM 433 C LYS A 27 5.069 0.050 -11.461 1.00 0.00 C ATOM 434 O LYS A 27 4.901 -0.513 -10.380 1.00 0.00 O ATOM 435 CB LYS A 27 5.306 2.525 -11.729 1.00 0.00 C ATOM 436 CG LYS A 27 5.975 3.682 -11.007 1.00 0.00 C ATOM 437 CD LYS A 27 5.698 5.006 -11.699 1.00 0.00 C ATOM 438 CE LYS A 27 4.588 5.778 -11.001 1.00 0.00 C ATOM 439 NZ LYS A 27 5.038 7.130 -10.571 1.00 0.00 N ATOM 0 H LYS A 27 6.869 1.725 -13.457 1.00 0.00 H new ATOM 0 HA LYS A 27 6.680 1.232 -10.700 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.210 2.774 -12.786 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.296 2.399 -11.338 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.617 3.726 -9.978 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.051 3.511 -10.963 1.00 0.00 H new ATOM 0 HD2 LYS A 27 6.607 5.607 -11.714 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.419 4.824 -12.737 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.736 5.876 -11.673 1.00 0.00 H new ATOM 0 HE3 LYS A 27 4.246 5.216 -10.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 4.253 7.624 -10.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.835 7.036 -9.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.341 7.676 -11.403 1.00 0.00 H new ATOM 453 N GLN A 28 4.416 -0.295 -12.566 1.00 0.00 N ATOM 454 CA GLN A 28 3.441 -1.379 -12.571 1.00 0.00 C ATOM 455 C GLN A 28 4.058 -2.667 -12.034 1.00 0.00 C ATOM 456 O GLN A 28 3.451 -3.366 -11.223 1.00 0.00 O ATOM 457 CB GLN A 28 2.906 -1.607 -13.985 1.00 0.00 C ATOM 458 CG GLN A 28 1.627 -0.841 -14.283 1.00 0.00 C ATOM 459 CD GLN A 28 0.731 -1.562 -15.270 1.00 0.00 C ATOM 460 OE1 GLN A 28 -0.390 -1.951 -14.940 1.00 0.00 O ATOM 461 NE2 GLN A 28 1.221 -1.745 -16.491 1.00 0.00 N ATOM 0 H GLN A 28 4.545 0.161 -13.469 1.00 0.00 H new ATOM 0 HA GLN A 28 2.615 -1.094 -11.920 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.670 -1.315 -14.705 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.723 -2.672 -14.128 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.081 -0.678 -13.354 1.00 0.00 H new ATOM 0 HG3 GLN A 28 1.881 0.142 -14.680 1.00 0.00 H new ATOM 0 HE21 GLN A 28 2.155 -1.406 -16.722 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.663 -2.224 -17.198 1.00 0.00 H new ATOM 470 N ASP A 29 5.266 -2.974 -12.493 1.00 0.00 N ATOM 471 CA ASP A 29 5.965 -4.178 -12.058 1.00 0.00 C ATOM 472 C ASP A 29 6.272 -4.119 -10.565 1.00 0.00 C ATOM 473 O ASP A 29 6.256 -5.141 -9.878 1.00 0.00 O ATOM 474 CB ASP A 29 7.262 -4.355 -12.851 1.00 0.00 C ATOM 475 CG ASP A 29 7.091 -4.023 -14.320 1.00 0.00 C ATOM 476 OD1 ASP A 29 5.980 -4.231 -14.851 1.00 0.00 O ATOM 477 OD2 ASP A 29 8.069 -3.554 -14.939 1.00 0.00 O ATOM 0 H ASP A 29 5.782 -2.406 -13.166 1.00 0.00 H new ATOM 0 HA ASP A 29 5.315 -5.033 -12.243 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.035 -3.716 -12.425 1.00 0.00 H new ATOM 0 HB3 ASP A 29 7.608 -5.384 -12.752 1.00 0.00 H new ATOM 482 N ILE A 30 6.551 -2.918 -10.070 1.00 0.00 N ATOM 483 CA ILE A 30 6.861 -2.727 -8.659 1.00 0.00 C ATOM 484 C ILE A 30 5.617 -2.903 -7.794 1.00 0.00 C ATOM 485 O ILE A 30 5.666 -3.537 -6.739 1.00 0.00 O ATOM 486 CB ILE A 30 7.461 -1.333 -8.398 1.00 0.00 C ATOM 487 CG1 ILE A 30 8.775 -1.168 -9.164 1.00 0.00 C ATOM 488 CG2 ILE A 30 7.680 -1.121 -6.907 1.00 0.00 C ATOM 489 CD1 ILE A 30 9.045 0.255 -9.600 1.00 0.00 C ATOM 0 H ILE A 30 6.569 -2.063 -10.625 1.00 0.00 H new ATOM 0 HA ILE A 30 7.597 -3.486 -8.392 1.00 0.00 H new ATOM 0 HB ILE A 30 6.758 -0.579 -8.753 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.598 -1.509 -8.536 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.757 -1.812 -10.043 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.105 -0.131 -6.739 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.727 -1.201 -6.384 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.366 -1.879 -6.529 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.993 0.297 -10.137 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.242 0.594 -10.254 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.096 0.901 -8.723 1.00 0.00 H new ATOM 501 N LEU A 31 4.503 -2.340 -8.248 1.00 0.00 N ATOM 502 CA LEU A 31 3.244 -2.436 -7.517 1.00 0.00 C ATOM 503 C LEU A 31 2.650 -3.835 -7.639 1.00 0.00 C ATOM 504 O LEU A 31 1.934 -4.295 -6.749 1.00 0.00 O ATOM 505 CB LEU A 31 2.248 -1.399 -8.040 1.00 0.00 C ATOM 506 CG LEU A 31 2.637 0.066 -7.838 1.00 0.00 C ATOM 507 CD1 LEU A 31 1.491 0.982 -8.238 1.00 0.00 C ATOM 508 CD2 LEU A 31 3.042 0.316 -6.393 1.00 0.00 C ATOM 0 H LEU A 31 4.446 -1.812 -9.119 1.00 0.00 H new ATOM 0 HA LEU A 31 3.447 -2.238 -6.465 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.101 -1.571 -9.106 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.287 -1.570 -7.554 1.00 0.00 H new ATOM 0 HG LEU A 31 3.492 0.287 -8.477 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.786 2.021 -8.088 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.247 0.822 -9.288 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.617 0.760 -7.625 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.316 1.364 -6.268 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.207 0.078 -5.735 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.894 -0.314 -6.140 1.00 0.00 H new ATOM 520 N GLU A 32 2.953 -4.508 -8.744 1.00 0.00 N ATOM 521 CA GLU A 32 2.449 -5.856 -8.980 1.00 0.00 C ATOM 522 C GLU A 32 3.271 -6.886 -8.211 1.00 0.00 C ATOM 523 O GLU A 32 2.788 -7.975 -7.901 1.00 0.00 O ATOM 524 CB GLU A 32 2.476 -6.180 -10.475 1.00 0.00 C ATOM 525 CG GLU A 32 1.528 -7.299 -10.873 1.00 0.00 C ATOM 526 CD GLU A 32 0.690 -6.950 -12.087 1.00 0.00 C ATOM 527 OE1 GLU A 32 1.249 -6.385 -13.050 1.00 0.00 O ATOM 528 OE2 GLU A 32 -0.524 -7.242 -12.074 1.00 0.00 O ATOM 0 H GLU A 32 3.545 -4.142 -9.490 1.00 0.00 H new ATOM 0 HA GLU A 32 1.419 -5.899 -8.625 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.221 -5.282 -11.037 1.00 0.00 H new ATOM 0 HB3 GLU A 32 3.491 -6.457 -10.760 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.104 -8.201 -11.081 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.869 -7.527 -10.035 1.00 0.00 H new ATOM 535 N ALA A 33 4.515 -6.534 -7.905 1.00 0.00 N ATOM 536 CA ALA A 33 5.404 -7.426 -7.171 1.00 0.00 C ATOM 537 C ALA A 33 5.015 -7.498 -5.698 1.00 0.00 C ATOM 538 O ALA A 33 5.007 -8.573 -5.098 1.00 0.00 O ATOM 539 CB ALA A 33 6.848 -6.970 -7.316 1.00 0.00 C ATOM 0 H ALA A 33 4.931 -5.636 -8.154 1.00 0.00 H new ATOM 0 HA ALA A 33 5.307 -8.425 -7.595 1.00 0.00 H new ATOM 0 HB1 ALA A 33 7.500 -7.646 -6.763 1.00 0.00 H new ATOM 0 HB2 ALA A 33 7.128 -6.977 -8.369 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.952 -5.960 -6.920 1.00 0.00 H new ATOM 545 N THR A 34 4.694 -6.345 -5.119 1.00 0.00 N ATOM 546 CA THR A 34 4.307 -6.277 -3.716 1.00 0.00 C ATOM 547 C THR A 34 3.122 -7.192 -3.427 1.00 0.00 C ATOM 548 O THR A 34 2.903 -7.598 -2.286 1.00 0.00 O ATOM 549 CB THR A 34 3.942 -4.838 -3.303 1.00 0.00 C ATOM 550 OG1 THR A 34 3.836 -4.749 -1.878 1.00 0.00 O ATOM 551 CG2 THR A 34 2.630 -4.408 -3.942 1.00 0.00 C ATOM 0 H THR A 34 4.695 -5.446 -5.601 1.00 0.00 H new ATOM 0 HA THR A 34 5.168 -6.607 -3.135 1.00 0.00 H new ATOM 0 HB THR A 34 4.732 -4.172 -3.650 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.605 -3.831 -1.624 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.393 -3.389 -3.636 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.723 -4.448 -5.027 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.832 -5.078 -3.621 1.00 0.00 H new ATOM 559 N ALA A 35 2.362 -7.514 -4.468 1.00 0.00 N ATOM 560 CA ALA A 35 1.201 -8.384 -4.326 1.00 0.00 C ATOM 561 C ALA A 35 1.620 -9.802 -3.953 1.00 0.00 C ATOM 562 O ALA A 35 0.874 -10.527 -3.294 1.00 0.00 O ATOM 563 CB ALA A 35 0.388 -8.393 -5.612 1.00 0.00 C ATOM 0 H ALA A 35 2.529 -7.186 -5.419 1.00 0.00 H new ATOM 0 HA ALA A 35 0.581 -7.992 -3.520 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -0.476 -9.047 -5.492 1.00 0.00 H new ATOM 0 HB2 ALA A 35 0.049 -7.381 -5.835 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.007 -8.757 -6.432 1.00 0.00 H new ATOM 569 N ASP A 36 2.817 -10.191 -4.378 1.00 0.00 N ATOM 570 CA ASP A 36 3.336 -11.523 -4.087 1.00 0.00 C ATOM 571 C ASP A 36 3.813 -11.617 -2.642 1.00 0.00 C ATOM 572 O ASP A 36 3.410 -12.515 -1.902 1.00 0.00 O ATOM 573 CB ASP A 36 4.482 -11.866 -5.040 1.00 0.00 C ATOM 574 CG ASP A 36 4.665 -13.361 -5.211 1.00 0.00 C ATOM 575 OD1 ASP A 36 3.723 -14.115 -4.889 1.00 0.00 O ATOM 576 OD2 ASP A 36 5.751 -13.777 -5.667 1.00 0.00 O ATOM 0 H ASP A 36 3.446 -9.603 -4.925 1.00 0.00 H new ATOM 0 HA ASP A 36 2.528 -12.240 -4.230 1.00 0.00 H new ATOM 0 HB2 ASP A 36 4.290 -11.413 -6.013 1.00 0.00 H new ATOM 0 HB3 ASP A 36 5.407 -11.430 -4.663 1.00 0.00 H new ATOM 581 N ILE A 37 4.674 -10.685 -2.247 1.00 0.00 N ATOM 582 CA ILE A 37 5.206 -10.663 -0.890 1.00 0.00 C ATOM 583 C ILE A 37 4.084 -10.594 0.140 1.00 0.00 C ATOM 584 O ILE A 37 4.000 -11.431 1.039 1.00 0.00 O ATOM 585 CB ILE A 37 6.157 -9.471 -0.677 1.00 0.00 C ATOM 586 CG1 ILE A 37 7.316 -9.530 -1.675 1.00 0.00 C ATOM 587 CG2 ILE A 37 6.681 -9.459 0.751 1.00 0.00 C ATOM 588 CD1 ILE A 37 8.294 -8.385 -1.534 1.00 0.00 C ATOM 0 H ILE A 37 5.018 -9.935 -2.847 1.00 0.00 H new ATOM 0 HA ILE A 37 5.763 -11.590 -0.755 1.00 0.00 H new ATOM 0 HB ILE A 37 5.602 -8.548 -0.847 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.850 -10.471 -1.544 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.913 -9.530 -2.688 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.352 -8.610 0.885 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.845 -9.374 1.445 1.00 0.00 H new ATOM 0 HG23 ILE A 37 7.223 -10.384 0.948 1.00 0.00 H new ATOM 0 HD11 ILE A 37 9.088 -8.492 -2.273 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.774 -7.441 -1.694 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.725 -8.396 -0.533 1.00 0.00 H new ATOM 600 N ILE A 38 3.222 -9.591 0.001 1.00 0.00 N ATOM 601 CA ILE A 38 2.103 -9.415 0.917 1.00 0.00 C ATOM 602 C ILE A 38 1.249 -10.676 0.992 1.00 0.00 C ATOM 603 O ILE A 38 0.710 -11.012 2.048 1.00 0.00 O ATOM 604 CB ILE A 38 1.212 -8.230 0.496 1.00 0.00 C ATOM 605 CG1 ILE A 38 2.021 -6.931 0.495 1.00 0.00 C ATOM 606 CG2 ILE A 38 0.013 -8.114 1.425 1.00 0.00 C ATOM 607 CD1 ILE A 38 1.297 -5.769 -0.148 1.00 0.00 C ATOM 0 H ILE A 38 3.278 -8.889 -0.737 1.00 0.00 H new ATOM 0 HA ILE A 38 2.529 -9.209 1.899 1.00 0.00 H new ATOM 0 HB ILE A 38 0.847 -8.409 -0.515 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.272 -6.668 1.523 1.00 0.00 H new ATOM 0 HG13 ILE A 38 2.961 -7.098 -0.030 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.607 -7.273 1.115 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.572 -9.032 1.380 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.358 -7.954 2.446 1.00 0.00 H new ATOM 0 HD11 ILE A 38 1.930 -4.882 -0.113 1.00 0.00 H new ATOM 0 HD12 ILE A 38 1.069 -6.012 -1.186 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.370 -5.575 0.391 1.00 0.00 H new ATOM 619 N LEU A 39 1.132 -11.372 -0.133 1.00 0.00 N ATOM 620 CA LEU A 39 0.345 -12.599 -0.195 1.00 0.00 C ATOM 621 C LEU A 39 0.980 -13.696 0.654 1.00 0.00 C ATOM 622 O LEU A 39 0.302 -14.624 1.097 1.00 0.00 O ATOM 623 CB LEU A 39 0.214 -13.071 -1.644 1.00 0.00 C ATOM 624 CG LEU A 39 -1.141 -12.828 -2.309 1.00 0.00 C ATOM 625 CD1 LEU A 39 -1.001 -12.832 -3.824 1.00 0.00 C ATOM 626 CD2 LEU A 39 -2.150 -13.876 -1.863 1.00 0.00 C ATOM 0 H LEU A 39 1.572 -11.108 -1.015 1.00 0.00 H new ATOM 0 HA LEU A 39 -0.647 -12.386 0.202 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.982 -12.575 -2.238 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.426 -14.140 -1.678 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.504 -11.848 -2.000 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -1.976 -12.658 -4.280 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.312 -12.044 -4.128 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -0.615 -13.797 -4.151 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.109 -13.687 -2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -1.792 -14.867 -2.141 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.273 -13.825 -0.781 1.00 0.00 H new ATOM 638 N LYS A 40 2.285 -13.584 0.878 1.00 0.00 N ATOM 639 CA LYS A 40 3.011 -14.563 1.677 1.00 0.00 C ATOM 640 C LYS A 40 2.882 -14.256 3.165 1.00 0.00 C ATOM 641 O LYS A 40 2.600 -15.143 3.971 1.00 0.00 O ATOM 642 CB LYS A 40 4.488 -14.584 1.276 1.00 0.00 C ATOM 643 CG LYS A 40 4.799 -15.554 0.149 1.00 0.00 C ATOM 644 CD LYS A 40 6.145 -15.254 -0.489 1.00 0.00 C ATOM 645 CE LYS A 40 6.140 -15.574 -1.976 1.00 0.00 C ATOM 646 NZ LYS A 40 6.297 -17.032 -2.231 1.00 0.00 N ATOM 0 H LYS A 40 2.862 -12.824 0.517 1.00 0.00 H new ATOM 0 HA LYS A 40 2.575 -15.544 1.488 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.788 -13.581 0.974 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.088 -14.847 2.147 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.797 -16.574 0.534 1.00 0.00 H new ATOM 0 HG3 LYS A 40 4.016 -15.498 -0.607 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.392 -14.202 -0.343 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.922 -15.836 0.007 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.207 -15.227 -2.419 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.947 -15.031 -2.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.289 -17.208 -3.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.199 -17.359 -1.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.513 -17.549 -1.785 1.00 0.00 H new ATOM 660 N VAL A 41 3.089 -12.992 3.524 1.00 0.00 N ATOM 661 CA VAL A 41 2.992 -12.567 4.915 1.00 0.00 C ATOM 662 C VAL A 41 1.543 -12.555 5.387 1.00 0.00 C ATOM 663 O VAL A 41 1.263 -12.738 6.571 1.00 0.00 O ATOM 664 CB VAL A 41 3.598 -11.166 5.117 1.00 0.00 C ATOM 665 CG1 VAL A 41 5.042 -11.134 4.639 1.00 0.00 C ATOM 666 CG2 VAL A 41 2.766 -10.117 4.395 1.00 0.00 C ATOM 0 H VAL A 41 3.325 -12.245 2.870 1.00 0.00 H new ATOM 0 HA VAL A 41 3.557 -13.288 5.506 1.00 0.00 H new ATOM 0 HB VAL A 41 3.588 -10.935 6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 41 5.453 -10.136 4.790 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.629 -11.857 5.205 1.00 0.00 H new ATOM 0 HG13 VAL A 41 5.080 -11.386 3.579 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.209 -9.133 4.548 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.742 -10.342 3.329 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.750 -10.123 4.790 1.00 0.00 H new ATOM 676 N GLY A 42 0.623 -12.338 4.452 1.00 0.00 N ATOM 677 CA GLY A 42 -0.787 -12.306 4.791 1.00 0.00 C ATOM 678 C GLY A 42 -1.209 -10.980 5.393 1.00 0.00 C ATOM 679 O GLY A 42 -2.075 -10.934 6.267 1.00 0.00 O ATOM 0 H GLY A 42 0.830 -12.184 3.465 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.377 -12.499 3.895 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.006 -13.108 5.496 1.00 0.00 H new ATOM 683 N HIS A 43 -0.595 -9.897 4.925 1.00 0.00 N ATOM 684 CA HIS A 43 -0.911 -8.564 5.423 1.00 0.00 C ATOM 685 C HIS A 43 -0.168 -7.496 4.627 1.00 0.00 C ATOM 686 O HIS A 43 1.025 -7.628 4.354 1.00 0.00 O ATOM 687 CB HIS A 43 -0.553 -8.452 6.906 1.00 0.00 C ATOM 688 CG HIS A 43 0.920 -8.495 7.171 1.00 0.00 C ATOM 689 ND1 HIS A 43 1.739 -7.392 7.051 1.00 0.00 N ATOM 690 CD2 HIS A 43 1.722 -9.516 7.553 1.00 0.00 C ATOM 691 CE1 HIS A 43 2.980 -7.733 7.347 1.00 0.00 C ATOM 692 NE2 HIS A 43 2.997 -9.017 7.656 1.00 0.00 N ATOM 0 H HIS A 43 0.124 -9.917 4.202 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.982 -8.403 5.302 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -0.958 -7.520 7.300 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.036 -9.264 7.450 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.416 -10.534 7.742 1.00 0.00 H new ATOM 0 HE1 HIS A 43 3.836 -7.074 7.338 1.00 0.00 H new ATOM 0 HE2 HIS A 43 3.823 -9.551 7.927 1.00 0.00 H new ATOM 700 N ASP A 44 -0.881 -6.438 4.256 1.00 0.00 N ATOM 701 CA ASP A 44 -0.290 -5.347 3.490 1.00 0.00 C ATOM 702 C ASP A 44 0.110 -4.195 4.407 1.00 0.00 C ATOM 703 O ASP A 44 -0.357 -4.100 5.542 1.00 0.00 O ATOM 704 CB ASP A 44 -1.270 -4.852 2.426 1.00 0.00 C ATOM 705 CG ASP A 44 -2.428 -4.076 3.021 1.00 0.00 C ATOM 706 OD1 ASP A 44 -2.885 -4.445 4.124 1.00 0.00 O ATOM 707 OD2 ASP A 44 -2.878 -3.101 2.385 1.00 0.00 O ATOM 0 H ASP A 44 -1.870 -6.313 4.474 1.00 0.00 H new ATOM 0 HA ASP A 44 0.606 -5.725 2.998 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.740 -4.219 1.714 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.657 -5.705 1.868 1.00 0.00 H new ATOM 712 N PHE A 45 0.978 -3.321 3.906 1.00 0.00 N ATOM 713 CA PHE A 45 1.442 -2.176 4.681 1.00 0.00 C ATOM 714 C PHE A 45 0.703 -0.906 4.270 1.00 0.00 C ATOM 715 O PHE A 45 1.299 0.025 3.728 1.00 0.00 O ATOM 716 CB PHE A 45 2.949 -1.985 4.495 1.00 0.00 C ATOM 717 CG PHE A 45 3.733 -3.261 4.607 1.00 0.00 C ATOM 718 CD1 PHE A 45 4.243 -3.671 5.829 1.00 0.00 C ATOM 719 CD2 PHE A 45 3.960 -4.051 3.492 1.00 0.00 C ATOM 720 CE1 PHE A 45 4.965 -4.845 5.936 1.00 0.00 C ATOM 721 CE2 PHE A 45 4.681 -5.226 3.593 1.00 0.00 C ATOM 722 CZ PHE A 45 5.185 -5.623 4.816 1.00 0.00 C ATOM 0 H PHE A 45 1.374 -3.384 2.968 1.00 0.00 H new ATOM 0 HA PHE A 45 1.234 -2.372 5.733 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.133 -1.540 3.517 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.312 -1.278 5.241 1.00 0.00 H new ATOM 0 HD1 PHE A 45 4.074 -3.066 6.708 1.00 0.00 H new ATOM 0 HD2 PHE A 45 3.569 -3.745 2.533 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.357 -5.154 6.894 1.00 0.00 H new ATOM 0 HE2 PHE A 45 4.850 -5.833 2.716 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.750 -6.540 4.897 1.00 0.00 H new ATOM 732 N SER A 46 -0.600 -0.876 4.532 1.00 0.00 N ATOM 733 CA SER A 46 -1.423 0.277 4.186 1.00 0.00 C ATOM 734 C SER A 46 -1.115 1.459 5.102 1.00 0.00 C ATOM 735 O SER A 46 -0.816 2.558 4.635 1.00 0.00 O ATOM 736 CB SER A 46 -2.907 -0.082 4.280 1.00 0.00 C ATOM 737 OG SER A 46 -3.082 -1.465 4.532 1.00 0.00 O ATOM 0 H SER A 46 -1.108 -1.637 4.983 1.00 0.00 H new ATOM 0 HA SER A 46 -1.190 0.564 3.160 1.00 0.00 H new ATOM 0 HB2 SER A 46 -3.375 0.498 5.076 1.00 0.00 H new ATOM 0 HB3 SER A 46 -3.409 0.188 3.351 1.00 0.00 H new ATOM 0 HG SER A 46 -3.134 -1.949 3.681 1.00 0.00 H new ATOM 743 N ASP A 47 -1.190 1.223 6.407 1.00 0.00 N ATOM 744 CA ASP A 47 -0.919 2.266 7.389 1.00 0.00 C ATOM 745 C ASP A 47 0.424 2.935 7.115 1.00 0.00 C ATOM 746 O ASP A 47 1.474 2.297 7.193 1.00 0.00 O ATOM 747 CB ASP A 47 -0.932 1.681 8.802 1.00 0.00 C ATOM 748 CG ASP A 47 -2.177 2.067 9.577 1.00 0.00 C ATOM 749 OD1 ASP A 47 -2.377 3.276 9.815 1.00 0.00 O ATOM 750 OD2 ASP A 47 -2.951 1.159 9.945 1.00 0.00 O ATOM 0 H ASP A 47 -1.436 0.319 6.809 1.00 0.00 H new ATOM 0 HA ASP A 47 -1.703 3.019 7.308 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -0.867 0.595 8.743 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -0.050 2.025 9.342 1.00 0.00 H new ATOM 755 N ALA A 48 0.383 4.223 6.791 1.00 0.00 N ATOM 756 CA ALA A 48 1.596 4.978 6.506 1.00 0.00 C ATOM 757 C ALA A 48 2.539 4.976 7.705 1.00 0.00 C ATOM 758 O ALA A 48 3.734 5.233 7.566 1.00 0.00 O ATOM 759 CB ALA A 48 1.248 6.405 6.109 1.00 0.00 C ATOM 0 H ALA A 48 -0.478 4.765 6.719 1.00 0.00 H new ATOM 0 HA ALA A 48 2.108 4.495 5.674 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.164 6.958 5.899 1.00 0.00 H new ATOM 0 HB2 ALA A 48 0.620 6.392 5.219 1.00 0.00 H new ATOM 0 HB3 ALA A 48 0.711 6.889 6.925 1.00 0.00 H new ATOM 765 N GLU A 49 1.993 4.684 8.881 1.00 0.00 N ATOM 766 CA GLU A 49 2.786 4.650 10.104 1.00 0.00 C ATOM 767 C GLU A 49 3.250 3.230 10.412 1.00 0.00 C ATOM 768 O GLU A 49 3.517 2.888 11.564 1.00 0.00 O ATOM 769 CB GLU A 49 1.976 5.200 11.280 1.00 0.00 C ATOM 770 CG GLU A 49 0.649 4.490 11.490 1.00 0.00 C ATOM 771 CD GLU A 49 0.029 4.799 12.838 1.00 0.00 C ATOM 772 OE1 GLU A 49 0.586 4.352 13.863 1.00 0.00 O ATOM 773 OE2 GLU A 49 -1.012 5.487 12.869 1.00 0.00 O ATOM 0 H GLU A 49 1.005 4.468 9.013 1.00 0.00 H new ATOM 0 HA GLU A 49 3.665 5.277 9.954 1.00 0.00 H new ATOM 0 HB2 GLU A 49 2.571 5.118 12.190 1.00 0.00 H new ATOM 0 HB3 GLU A 49 1.789 6.261 11.117 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.044 4.781 10.700 1.00 0.00 H new ATOM 0 HG3 GLU A 49 0.799 3.414 11.401 1.00 0.00 H new ATOM 780 N TYR A 50 3.344 2.406 9.374 1.00 0.00 N ATOM 781 CA TYR A 50 3.773 1.022 9.532 1.00 0.00 C ATOM 782 C TYR A 50 4.214 0.431 8.197 1.00 0.00 C ATOM 783 O TYR A 50 3.723 -0.617 7.777 1.00 0.00 O ATOM 784 CB TYR A 50 2.642 0.181 10.126 1.00 0.00 C ATOM 785 CG TYR A 50 3.068 -1.216 10.518 1.00 0.00 C ATOM 786 CD1 TYR A 50 2.525 -2.331 9.891 1.00 0.00 C ATOM 787 CD2 TYR A 50 4.013 -1.422 11.516 1.00 0.00 C ATOM 788 CE1 TYR A 50 2.910 -3.609 10.246 1.00 0.00 C ATOM 789 CE2 TYR A 50 4.405 -2.696 11.876 1.00 0.00 C ATOM 790 CZ TYR A 50 3.851 -3.787 11.239 1.00 0.00 C ATOM 791 OH TYR A 50 4.238 -5.058 11.596 1.00 0.00 O ATOM 0 H TYR A 50 3.129 2.673 8.414 1.00 0.00 H new ATOM 0 HA TYR A 50 4.624 1.008 10.213 1.00 0.00 H new ATOM 0 HB2 TYR A 50 2.244 0.690 11.004 1.00 0.00 H new ATOM 0 HB3 TYR A 50 1.831 0.114 9.401 1.00 0.00 H new ATOM 0 HD1 TYR A 50 1.789 -2.196 9.112 1.00 0.00 H new ATOM 0 HD2 TYR A 50 4.448 -0.571 12.019 1.00 0.00 H new ATOM 0 HE1 TYR A 50 2.477 -4.464 9.749 1.00 0.00 H new ATOM 0 HE2 TYR A 50 5.142 -2.838 12.653 1.00 0.00 H new ATOM 0 HH TYR A 50 4.908 -5.008 12.309 1.00 0.00 H new ATOM 801 N ILE A 51 5.143 1.112 7.534 1.00 0.00 N ATOM 802 CA ILE A 51 5.652 0.655 6.247 1.00 0.00 C ATOM 803 C ILE A 51 7.169 0.501 6.279 1.00 0.00 C ATOM 804 O ILE A 51 7.907 1.242 5.630 1.00 0.00 O ATOM 805 CB ILE A 51 5.270 1.625 5.114 1.00 0.00 C ATOM 806 CG1 ILE A 51 3.761 1.876 5.115 1.00 0.00 C ATOM 807 CG2 ILE A 51 5.720 1.073 3.769 1.00 0.00 C ATOM 808 CD1 ILE A 51 3.306 2.830 4.033 1.00 0.00 C ATOM 0 H ILE A 51 5.558 1.982 7.867 1.00 0.00 H new ATOM 0 HA ILE A 51 5.194 -0.315 6.053 1.00 0.00 H new ATOM 0 HB ILE A 51 5.777 2.575 5.283 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.243 0.925 4.991 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.468 2.275 6.086 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.443 1.770 2.978 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.802 0.941 3.773 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.238 0.112 3.591 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.226 2.961 4.094 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.796 3.794 4.168 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.568 2.424 3.056 1.00 0.00 H new ATOM 820 N PRO A 52 7.647 -0.487 7.051 1.00 0.00 N ATOM 821 CA PRO A 52 9.081 -0.763 7.184 1.00 0.00 C ATOM 822 C PRO A 52 9.681 -1.338 5.906 1.00 0.00 C ATOM 823 O PRO A 52 9.086 -2.204 5.263 1.00 0.00 O ATOM 824 CB PRO A 52 9.139 -1.795 8.314 1.00 0.00 C ATOM 825 CG PRO A 52 7.807 -2.462 8.287 1.00 0.00 C ATOM 826 CD PRO A 52 6.825 -1.409 7.852 1.00 0.00 C ATOM 0 HA PRO A 52 9.654 0.142 7.385 1.00 0.00 H new ATOM 0 HB2 PRO A 52 9.944 -2.512 8.154 1.00 0.00 H new ATOM 0 HB3 PRO A 52 9.323 -1.318 9.277 1.00 0.00 H new ATOM 0 HG2 PRO A 52 7.807 -3.305 7.596 1.00 0.00 H new ATOM 0 HG3 PRO A 52 7.548 -2.855 9.270 1.00 0.00 H new ATOM 0 HD2 PRO A 52 6.012 -1.836 7.265 1.00 0.00 H new ATOM 0 HD3 PRO A 52 6.372 -0.905 8.706 1.00 0.00 H new ATOM 834 N LEU A 53 10.864 -0.853 5.544 1.00 0.00 N ATOM 835 CA LEU A 53 11.546 -1.320 4.342 1.00 0.00 C ATOM 836 C LEU A 53 12.954 -1.807 4.669 1.00 0.00 C ATOM 837 O LEU A 53 13.953 -1.203 4.278 1.00 0.00 O ATOM 838 CB LEU A 53 11.611 -0.201 3.301 1.00 0.00 C ATOM 839 CG LEU A 53 10.531 -0.228 2.218 1.00 0.00 C ATOM 840 CD1 LEU A 53 9.174 -0.545 2.826 1.00 0.00 C ATOM 841 CD2 LEU A 53 10.488 1.100 1.475 1.00 0.00 C ATOM 0 H LEU A 53 11.370 -0.137 6.065 1.00 0.00 H new ATOM 0 HA LEU A 53 10.978 -2.156 3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.552 0.755 3.821 1.00 0.00 H new ATOM 0 HB3 LEU A 53 12.586 -0.240 2.815 1.00 0.00 H new ATOM 0 HG LEU A 53 10.778 -1.013 1.504 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.418 -0.560 2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.212 -1.520 3.312 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.918 0.217 3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 53 9.714 1.063 0.708 1.00 0.00 H new ATOM 0 HD22 LEU A 53 10.265 1.903 2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 53 11.454 1.286 1.006 1.00 0.00 H new ATOM 853 N PRO A 54 13.037 -2.927 5.402 1.00 0.00 N ATOM 854 CA PRO A 54 14.318 -3.522 5.796 1.00 0.00 C ATOM 855 C PRO A 54 15.066 -4.125 4.612 1.00 0.00 C ATOM 856 O PRO A 54 14.532 -4.207 3.506 1.00 0.00 O ATOM 857 CB PRO A 54 13.911 -4.617 6.785 1.00 0.00 C ATOM 858 CG PRO A 54 12.514 -4.970 6.406 1.00 0.00 C ATOM 859 CD PRO A 54 11.888 -3.699 5.903 1.00 0.00 C ATOM 0 HA PRO A 54 14.999 -2.782 6.215 1.00 0.00 H new ATOM 0 HB2 PRO A 54 14.571 -5.481 6.712 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.964 -4.261 7.814 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.502 -5.742 5.637 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.965 -5.363 7.262 1.00 0.00 H new ATOM 0 HD2 PRO A 54 11.161 -3.894 5.115 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.363 -3.168 6.697 1.00 0.00 H new ATOM 867 N GLU A 55 16.304 -4.546 4.852 1.00 0.00 N ATOM 868 CA GLU A 55 17.124 -5.141 3.803 1.00 0.00 C ATOM 869 C GLU A 55 16.447 -6.377 3.218 1.00 0.00 C ATOM 870 O GLU A 55 16.690 -6.748 2.069 1.00 0.00 O ATOM 871 CB GLU A 55 18.503 -5.513 4.353 1.00 0.00 C ATOM 872 CG GLU A 55 19.627 -5.337 3.347 1.00 0.00 C ATOM 873 CD GLU A 55 20.979 -5.732 3.908 1.00 0.00 C ATOM 874 OE1 GLU A 55 21.928 -4.929 3.789 1.00 0.00 O ATOM 875 OE2 GLU A 55 21.089 -6.845 4.465 1.00 0.00 O ATOM 0 H GLU A 55 16.761 -4.486 5.762 1.00 0.00 H new ATOM 0 HA GLU A 55 17.244 -4.404 3.009 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.712 -4.900 5.230 1.00 0.00 H new ATOM 0 HB3 GLU A 55 18.484 -6.551 4.686 1.00 0.00 H new ATOM 0 HG2 GLU A 55 19.415 -5.938 2.462 1.00 0.00 H new ATOM 0 HG3 GLU A 55 19.661 -4.296 3.025 1.00 0.00 H new ATOM 882 N THR A 56 15.595 -7.012 4.018 1.00 0.00 N ATOM 883 CA THR A 56 14.884 -8.207 3.581 1.00 0.00 C ATOM 884 C THR A 56 13.753 -7.854 2.622 1.00 0.00 C ATOM 885 O THR A 56 13.638 -8.433 1.542 1.00 0.00 O ATOM 886 CB THR A 56 14.302 -8.983 4.778 1.00 0.00 C ATOM 887 OG1 THR A 56 13.248 -8.228 5.386 1.00 0.00 O ATOM 888 CG2 THR A 56 15.382 -9.277 5.808 1.00 0.00 C ATOM 0 H THR A 56 15.381 -6.718 4.971 1.00 0.00 H new ATOM 0 HA THR A 56 15.610 -8.836 3.067 1.00 0.00 H new ATOM 0 HB THR A 56 13.905 -9.929 4.411 1.00 0.00 H new ATOM 0 HG1 THR A 56 12.883 -8.729 6.145 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.948 -9.825 6.644 1.00 0.00 H new ATOM 0 HG22 THR A 56 16.168 -9.877 5.350 1.00 0.00 H new ATOM 0 HG23 THR A 56 15.805 -8.340 6.170 1.00 0.00 H new ATOM 896 N VAL A 57 12.920 -6.898 3.022 1.00 0.00 N ATOM 897 CA VAL A 57 11.799 -6.466 2.196 1.00 0.00 C ATOM 898 C VAL A 57 12.285 -5.776 0.926 1.00 0.00 C ATOM 899 O VAL A 57 11.921 -6.166 -0.183 1.00 0.00 O ATOM 900 CB VAL A 57 10.872 -5.507 2.965 1.00 0.00 C ATOM 901 CG1 VAL A 57 9.750 -5.012 2.065 1.00 0.00 C ATOM 902 CG2 VAL A 57 10.311 -6.188 4.204 1.00 0.00 C ATOM 0 H VAL A 57 13.001 -6.408 3.913 1.00 0.00 H new ATOM 0 HA VAL A 57 11.240 -7.363 1.928 1.00 0.00 H new ATOM 0 HB VAL A 57 11.456 -4.644 3.285 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.105 -4.335 2.626 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.175 -4.484 1.211 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.165 -5.861 1.712 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.658 -5.496 4.735 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.742 -7.069 3.909 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.131 -6.488 4.857 1.00 0.00 H new ATOM 912 N ARG A 58 13.111 -4.749 1.097 1.00 0.00 N ATOM 913 CA ARG A 58 13.648 -4.004 -0.035 1.00 0.00 C ATOM 914 C ARG A 58 14.263 -4.947 -1.065 1.00 0.00 C ATOM 915 O ARG A 58 14.113 -4.750 -2.272 1.00 0.00 O ATOM 916 CB ARG A 58 14.697 -2.997 0.440 1.00 0.00 C ATOM 917 CG ARG A 58 14.287 -1.548 0.238 1.00 0.00 C ATOM 918 CD ARG A 58 15.146 -0.605 1.065 1.00 0.00 C ATOM 919 NE ARG A 58 16.517 -0.535 0.567 1.00 0.00 N ATOM 920 CZ ARG A 58 17.348 0.465 0.840 1.00 0.00 C ATOM 921 NH1 ARG A 58 16.949 1.473 1.602 1.00 0.00 N ATOM 922 NH2 ARG A 58 18.581 0.457 0.350 1.00 0.00 N ATOM 0 H ARG A 58 13.423 -4.414 2.009 1.00 0.00 H new ATOM 0 HA ARG A 58 12.825 -3.466 -0.506 1.00 0.00 H new ATOM 0 HB2 ARG A 58 14.896 -3.165 1.498 1.00 0.00 H new ATOM 0 HB3 ARG A 58 15.630 -3.179 -0.093 1.00 0.00 H new ATOM 0 HG2 ARG A 58 14.372 -1.288 -0.817 1.00 0.00 H new ATOM 0 HG3 ARG A 58 13.240 -1.423 0.513 1.00 0.00 H new ATOM 0 HD2 ARG A 58 14.705 0.392 1.053 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.154 -0.938 2.103 1.00 0.00 H new ATOM 0 HE ARG A 58 16.855 -1.295 -0.023 1.00 0.00 H new ATOM 0 HH11 ARG A 58 16.002 1.482 1.981 1.00 0.00 H new ATOM 0 HH12 ARG A 58 17.589 2.239 1.810 1.00 0.00 H new ATOM 0 HH21 ARG A 58 18.892 -0.317 -0.237 1.00 0.00 H new ATOM 0 HH22 ARG A 58 19.218 1.225 0.560 1.00 0.00 H new ATOM 936 N LEU A 59 14.955 -5.973 -0.581 1.00 0.00 N ATOM 937 CA LEU A 59 15.594 -6.947 -1.459 1.00 0.00 C ATOM 938 C LEU A 59 14.557 -7.864 -2.101 1.00 0.00 C ATOM 939 O LEU A 59 14.541 -8.043 -3.318 1.00 0.00 O ATOM 940 CB LEU A 59 16.611 -7.779 -0.675 1.00 0.00 C ATOM 941 CG LEU A 59 17.518 -8.687 -1.507 1.00 0.00 C ATOM 942 CD1 LEU A 59 18.204 -7.893 -2.607 1.00 0.00 C ATOM 943 CD2 LEU A 59 18.547 -9.370 -0.618 1.00 0.00 C ATOM 0 H LEU A 59 15.088 -6.152 0.414 1.00 0.00 H new ATOM 0 HA LEU A 59 16.111 -6.403 -2.250 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.240 -7.100 -0.099 1.00 0.00 H new ATOM 0 HB3 LEU A 59 16.070 -8.397 0.041 1.00 0.00 H new ATOM 0 HG LEU A 59 16.902 -9.456 -1.973 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.845 -8.556 -3.188 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.452 -7.451 -3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.808 -7.102 -2.162 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.184 -10.012 -1.226 1.00 0.00 H new ATOM 0 HD22 LEU A 59 19.159 -8.615 -0.124 1.00 0.00 H new ATOM 0 HD23 LEU A 59 18.036 -9.972 0.133 1.00 0.00 H new ATOM 955 N ALA A 60 13.690 -8.439 -1.274 1.00 0.00 N ATOM 956 CA ALA A 60 12.647 -9.333 -1.761 1.00 0.00 C ATOM 957 C ALA A 60 11.853 -8.686 -2.890 1.00 0.00 C ATOM 958 O ALA A 60 11.555 -9.325 -3.900 1.00 0.00 O ATOM 959 CB ALA A 60 11.721 -9.733 -0.623 1.00 0.00 C ATOM 0 H ALA A 60 13.689 -8.301 -0.263 1.00 0.00 H new ATOM 0 HA ALA A 60 13.126 -10.229 -2.156 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.947 -10.401 -1.001 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.295 -10.244 0.150 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.257 -8.842 -0.201 1.00 0.00 H new ATOM 965 N LEU A 61 11.511 -7.414 -2.713 1.00 0.00 N ATOM 966 CA LEU A 61 10.749 -6.680 -3.717 1.00 0.00 C ATOM 967 C LEU A 61 11.613 -6.367 -4.934 1.00 0.00 C ATOM 968 O LEU A 61 11.166 -6.496 -6.075 1.00 0.00 O ATOM 969 CB LEU A 61 10.199 -5.383 -3.120 1.00 0.00 C ATOM 970 CG LEU A 61 8.883 -4.877 -3.712 1.00 0.00 C ATOM 971 CD1 LEU A 61 9.002 -4.717 -5.220 1.00 0.00 C ATOM 972 CD2 LEU A 61 7.743 -5.821 -3.362 1.00 0.00 C ATOM 0 H LEU A 61 11.749 -6.870 -1.884 1.00 0.00 H new ATOM 0 HA LEU A 61 9.917 -7.307 -4.037 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.060 -5.530 -2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 61 10.952 -4.604 -3.240 1.00 0.00 H new ATOM 0 HG LEU A 61 8.665 -3.900 -3.280 1.00 0.00 H new ATOM 0 HD11 LEU A 61 8.056 -4.356 -5.623 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.791 -4.000 -5.449 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.245 -5.680 -5.670 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.814 -5.445 -3.791 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.954 -6.812 -3.765 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.642 -5.884 -2.278 1.00 0.00 H new ATOM 984 N LEU A 62 12.852 -5.958 -4.685 1.00 0.00 N ATOM 985 CA LEU A 62 13.780 -5.629 -5.761 1.00 0.00 C ATOM 986 C LEU A 62 13.958 -6.812 -6.707 1.00 0.00 C ATOM 987 O LEU A 62 14.061 -6.640 -7.922 1.00 0.00 O ATOM 988 CB LEU A 62 15.134 -5.214 -5.184 1.00 0.00 C ATOM 989 CG LEU A 62 15.264 -3.751 -4.759 1.00 0.00 C ATOM 990 CD1 LEU A 62 16.351 -3.595 -3.707 1.00 0.00 C ATOM 991 CD2 LEU A 62 15.554 -2.870 -5.965 1.00 0.00 C ATOM 0 H LEU A 62 13.237 -5.846 -3.747 1.00 0.00 H new ATOM 0 HA LEU A 62 13.362 -4.796 -6.326 1.00 0.00 H new ATOM 0 HB2 LEU A 62 15.346 -5.843 -4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.903 -5.425 -5.927 1.00 0.00 H new ATOM 0 HG LEU A 62 14.317 -3.433 -4.322 1.00 0.00 H new ATOM 0 HD11 LEU A 62 16.429 -2.547 -3.417 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.100 -4.196 -2.833 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.304 -3.930 -4.116 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.643 -1.832 -5.644 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.487 -3.187 -6.432 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.740 -2.959 -6.684 1.00 0.00 H new ATOM 1003 N LYS A 63 13.991 -8.014 -6.143 1.00 0.00 N ATOM 1004 CA LYS A 63 14.153 -9.228 -6.935 1.00 0.00 C ATOM 1005 C LYS A 63 12.876 -9.549 -7.705 1.00 0.00 C ATOM 1006 O LYS A 63 12.925 -9.968 -8.862 1.00 0.00 O ATOM 1007 CB LYS A 63 14.527 -10.405 -6.032 1.00 0.00 C ATOM 1008 CG LYS A 63 15.981 -10.396 -5.592 1.00 0.00 C ATOM 1009 CD LYS A 63 16.744 -11.579 -6.163 1.00 0.00 C ATOM 1010 CE LYS A 63 17.975 -11.903 -5.331 1.00 0.00 C ATOM 1011 NZ LYS A 63 18.261 -13.364 -5.309 1.00 0.00 N ATOM 0 H LYS A 63 13.908 -8.174 -5.139 1.00 0.00 H new ATOM 0 HA LYS A 63 14.956 -9.060 -7.652 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.889 -10.391 -5.149 1.00 0.00 H new ATOM 0 HB3 LYS A 63 14.321 -11.336 -6.560 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.454 -9.468 -5.913 1.00 0.00 H new ATOM 0 HG3 LYS A 63 16.033 -10.420 -4.503 1.00 0.00 H new ATOM 0 HD2 LYS A 63 16.090 -12.450 -6.202 1.00 0.00 H new ATOM 0 HD3 LYS A 63 17.044 -11.360 -7.188 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.836 -11.370 -5.734 1.00 0.00 H new ATOM 0 HE3 LYS A 63 17.828 -11.546 -4.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.107 -13.543 -4.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 17.450 -13.870 -4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 18.426 -13.700 -6.279 1.00 0.00 H new ATOM 1025 N LEU A 64 11.734 -9.351 -7.056 1.00 0.00 N ATOM 1026 CA LEU A 64 10.443 -9.618 -7.680 1.00 0.00 C ATOM 1027 C LEU A 64 10.163 -8.622 -8.800 1.00 0.00 C ATOM 1028 O LEU A 64 9.550 -8.965 -9.811 1.00 0.00 O ATOM 1029 CB LEU A 64 9.327 -9.556 -6.636 1.00 0.00 C ATOM 1030 CG LEU A 64 8.695 -10.893 -6.248 1.00 0.00 C ATOM 1031 CD1 LEU A 64 8.139 -10.831 -4.834 1.00 0.00 C ATOM 1032 CD2 LEU A 64 7.602 -11.273 -7.237 1.00 0.00 C ATOM 0 H LEU A 64 11.676 -9.006 -6.098 1.00 0.00 H new ATOM 0 HA LEU A 64 10.475 -10.619 -8.109 1.00 0.00 H new ATOM 0 HB2 LEU A 64 9.726 -9.090 -5.735 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.541 -8.901 -7.012 1.00 0.00 H new ATOM 0 HG LEU A 64 9.468 -11.661 -6.278 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.693 -11.792 -4.576 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.945 -10.606 -4.136 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.380 -10.051 -4.776 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.163 -12.227 -6.945 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.830 -10.504 -7.239 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.029 -11.360 -8.236 1.00 0.00 H new ATOM 1044 N SER A 65 10.617 -7.386 -8.614 1.00 0.00 N ATOM 1045 CA SER A 65 10.414 -6.339 -9.608 1.00 0.00 C ATOM 1046 C SER A 65 10.989 -6.754 -10.959 1.00 0.00 C ATOM 1047 O SER A 65 10.362 -6.554 -11.999 1.00 0.00 O ATOM 1048 CB SER A 65 11.062 -5.033 -9.144 1.00 0.00 C ATOM 1049 OG SER A 65 10.080 -4.064 -8.820 1.00 0.00 O ATOM 0 H SER A 65 11.128 -7.086 -7.784 1.00 0.00 H new ATOM 0 HA SER A 65 9.341 -6.183 -9.722 1.00 0.00 H new ATOM 0 HB2 SER A 65 11.690 -5.224 -8.274 1.00 0.00 H new ATOM 0 HB3 SER A 65 11.713 -4.647 -9.929 1.00 0.00 H new ATOM 0 HG SER A 65 10.423 -3.472 -8.118 1.00 0.00 H new ATOM 1055 N GLN A 66 12.186 -7.331 -10.933 1.00 0.00 N ATOM 1056 CA GLN A 66 12.847 -7.773 -12.155 1.00 0.00 C ATOM 1057 C GLN A 66 12.085 -8.927 -12.799 1.00 0.00 C ATOM 1058 O GLN A 66 11.928 -8.976 -14.020 1.00 0.00 O ATOM 1059 CB GLN A 66 14.285 -8.199 -11.857 1.00 0.00 C ATOM 1060 CG GLN A 66 14.962 -8.911 -13.017 1.00 0.00 C ATOM 1061 CD GLN A 66 15.170 -10.390 -12.753 1.00 0.00 C ATOM 1062 OE1 GLN A 66 14.552 -11.240 -13.394 1.00 0.00 O ATOM 1063 NE2 GLN A 66 16.044 -10.704 -11.805 1.00 0.00 N ATOM 0 H GLN A 66 12.718 -7.503 -10.080 1.00 0.00 H new ATOM 0 HA GLN A 66 12.861 -6.936 -12.853 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.869 -7.317 -11.592 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.288 -8.856 -10.987 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.358 -8.788 -13.916 1.00 0.00 H new ATOM 0 HG3 GLN A 66 15.926 -8.442 -13.214 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.534 -9.967 -11.299 1.00 0.00 H new ATOM 0 HE22 GLN A 66 16.226 -11.683 -11.583 1.00 0.00 H new ATOM 1072 N PHE A 67 11.614 -9.854 -11.972 1.00 0.00 N ATOM 1073 CA PHE A 67 10.870 -11.008 -12.460 1.00 0.00 C ATOM 1074 C PHE A 67 9.687 -10.569 -13.319 1.00 0.00 C ATOM 1075 O PHE A 67 9.567 -10.964 -14.479 1.00 0.00 O ATOM 1076 CB PHE A 67 10.376 -11.857 -11.287 1.00 0.00 C ATOM 1077 CG PHE A 67 9.414 -12.937 -11.692 1.00 0.00 C ATOM 1078 CD1 PHE A 67 8.052 -12.686 -11.744 1.00 0.00 C ATOM 1079 CD2 PHE A 67 9.871 -14.203 -12.021 1.00 0.00 C ATOM 1080 CE1 PHE A 67 7.164 -13.678 -12.116 1.00 0.00 C ATOM 1081 CE2 PHE A 67 8.988 -15.198 -12.394 1.00 0.00 C ATOM 1082 CZ PHE A 67 7.632 -14.936 -12.441 1.00 0.00 C ATOM 0 H PHE A 67 11.735 -9.828 -10.960 1.00 0.00 H new ATOM 0 HA PHE A 67 11.541 -11.607 -13.076 1.00 0.00 H new ATOM 0 HB2 PHE A 67 11.234 -12.312 -10.792 1.00 0.00 H new ATOM 0 HB3 PHE A 67 9.894 -11.207 -10.556 1.00 0.00 H new ATOM 0 HD1 PHE A 67 7.680 -11.704 -11.491 1.00 0.00 H new ATOM 0 HD2 PHE A 67 10.930 -14.414 -11.985 1.00 0.00 H new ATOM 0 HE1 PHE A 67 6.105 -13.469 -12.152 1.00 0.00 H new ATOM 0 HE2 PHE A 67 9.357 -16.180 -12.649 1.00 0.00 H new ATOM 0 HZ PHE A 67 6.940 -15.713 -12.731 1.00 0.00 H new ATOM 1092 N TYR A 68 8.816 -9.751 -12.740 1.00 0.00 N ATOM 1093 CA TYR A 68 7.641 -9.260 -13.449 1.00 0.00 C ATOM 1094 C TYR A 68 8.044 -8.383 -14.631 1.00 0.00 C ATOM 1095 O TYR A 68 7.566 -8.571 -15.749 1.00 0.00 O ATOM 1096 CB TYR A 68 6.738 -8.470 -12.500 1.00 0.00 C ATOM 1097 CG TYR A 68 5.476 -9.207 -12.111 1.00 0.00 C ATOM 1098 CD1 TYR A 68 5.221 -9.537 -10.786 1.00 0.00 C ATOM 1099 CD2 TYR A 68 4.540 -9.575 -13.070 1.00 0.00 C ATOM 1100 CE1 TYR A 68 4.070 -10.211 -10.426 1.00 0.00 C ATOM 1101 CE2 TYR A 68 3.385 -10.247 -12.719 1.00 0.00 C ATOM 1102 CZ TYR A 68 3.155 -10.563 -11.396 1.00 0.00 C ATOM 1103 OH TYR A 68 2.006 -11.234 -11.043 1.00 0.00 O ATOM 0 H TYR A 68 8.901 -9.414 -11.781 1.00 0.00 H new ATOM 0 HA TYR A 68 7.092 -10.122 -13.829 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.299 -8.226 -11.598 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.466 -7.526 -12.972 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.935 -9.262 -10.024 1.00 0.00 H new ATOM 0 HD2 TYR A 68 4.718 -9.332 -14.107 1.00 0.00 H new ATOM 0 HE1 TYR A 68 3.888 -10.461 -9.391 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.666 -10.523 -13.476 1.00 0.00 H new ATOM 0 HH TYR A 68 1.468 -11.406 -11.844 1.00 0.00 H new ATOM 1113 N ALA A 69 8.928 -7.425 -14.374 1.00 0.00 N ATOM 1114 CA ALA A 69 9.399 -6.520 -15.415 1.00 0.00 C ATOM 1115 C ALA A 69 9.925 -7.295 -16.619 1.00 0.00 C ATOM 1116 O ALA A 69 9.738 -6.884 -17.765 1.00 0.00 O ATOM 1117 CB ALA A 69 10.479 -5.600 -14.866 1.00 0.00 C ATOM 0 H ALA A 69 9.333 -7.255 -13.453 1.00 0.00 H new ATOM 0 HA ALA A 69 8.554 -5.915 -15.745 1.00 0.00 H new ATOM 0 HB1 ALA A 69 10.821 -4.930 -15.654 1.00 0.00 H new ATOM 0 HB2 ALA A 69 10.073 -5.013 -14.042 1.00 0.00 H new ATOM 0 HB3 ALA A 69 11.318 -6.197 -14.508 1.00 0.00 H new ATOM 1123 N LEU A 70 10.582 -8.418 -16.353 1.00 0.00 N ATOM 1124 CA LEU A 70 11.135 -9.251 -17.415 1.00 0.00 C ATOM 1125 C LEU A 70 10.025 -9.836 -18.282 1.00 0.00 C ATOM 1126 O LEU A 70 10.091 -9.783 -19.511 1.00 0.00 O ATOM 1127 CB LEU A 70 11.979 -10.379 -16.818 1.00 0.00 C ATOM 1128 CG LEU A 70 12.313 -11.538 -17.759 1.00 0.00 C ATOM 1129 CD1 LEU A 70 12.916 -11.017 -19.054 1.00 0.00 C ATOM 1130 CD2 LEU A 70 13.260 -12.518 -17.082 1.00 0.00 C ATOM 0 H LEU A 70 10.745 -8.773 -15.411 1.00 0.00 H new ATOM 0 HA LEU A 70 11.769 -8.624 -18.042 1.00 0.00 H new ATOM 0 HB2 LEU A 70 12.913 -9.953 -16.453 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.453 -10.780 -15.952 1.00 0.00 H new ATOM 0 HG LEU A 70 11.389 -12.064 -17.999 1.00 0.00 H new ATOM 0 HD11 LEU A 70 13.147 -11.856 -19.711 1.00 0.00 H new ATOM 0 HD12 LEU A 70 12.203 -10.356 -19.547 1.00 0.00 H new ATOM 0 HD13 LEU A 70 13.830 -10.466 -18.834 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.487 -13.336 -17.766 1.00 0.00 H new ATOM 0 HD22 LEU A 70 14.183 -12.005 -16.812 1.00 0.00 H new ATOM 0 HD23 LEU A 70 12.790 -12.916 -16.183 1.00 0.00 H new ATOM 1142 N ILE A 71 9.006 -10.391 -17.635 1.00 0.00 N ATOM 1143 CA ILE A 71 7.881 -10.982 -18.348 1.00 0.00 C ATOM 1144 C ILE A 71 6.734 -9.987 -18.488 1.00 0.00 C ATOM 1145 O ILE A 71 5.574 -10.374 -18.615 1.00 0.00 O ATOM 1146 CB ILE A 71 7.364 -12.246 -17.635 1.00 0.00 C ATOM 1147 CG1 ILE A 71 6.862 -11.897 -16.233 1.00 0.00 C ATOM 1148 CG2 ILE A 71 8.459 -13.300 -17.565 1.00 0.00 C ATOM 1149 CD1 ILE A 71 6.355 -13.094 -15.457 1.00 0.00 C ATOM 0 H ILE A 71 8.936 -10.444 -16.619 1.00 0.00 H new ATOM 0 HA ILE A 71 8.245 -11.256 -19.339 1.00 0.00 H new ATOM 0 HB ILE A 71 6.531 -12.654 -18.208 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.670 -11.427 -15.673 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.062 -11.162 -16.315 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.078 -14.187 -17.059 1.00 0.00 H new ATOM 0 HG22 ILE A 71 8.774 -13.565 -18.574 1.00 0.00 H new ATOM 0 HG23 ILE A 71 9.311 -12.904 -17.012 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.015 -12.772 -14.473 1.00 0.00 H new ATOM 0 HD12 ILE A 71 5.525 -13.552 -15.995 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.159 -13.821 -15.343 1.00 0.00 H new ATOM 1161 N ASN A 72 7.069 -8.700 -18.466 1.00 0.00 N ATOM 1162 CA ASN A 72 6.067 -7.648 -18.592 1.00 0.00 C ATOM 1163 C ASN A 72 6.013 -7.116 -20.021 1.00 0.00 C ATOM 1164 O ASN A 72 4.987 -6.602 -20.464 1.00 0.00 O ATOM 1165 CB ASN A 72 6.374 -6.505 -17.622 1.00 0.00 C ATOM 1166 CG ASN A 72 5.270 -6.299 -16.603 1.00 0.00 C ATOM 1167 OD1 ASN A 72 4.499 -5.343 -16.692 1.00 0.00 O ATOM 1168 ND2 ASN A 72 5.189 -7.197 -15.628 1.00 0.00 N ATOM 0 H ASN A 72 8.026 -8.362 -18.362 1.00 0.00 H new ATOM 0 HA ASN A 72 5.095 -8.075 -18.345 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.309 -6.714 -17.103 1.00 0.00 H new ATOM 0 HB3 ASN A 72 6.521 -5.584 -18.185 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.466 -7.110 -14.913 1.00 0.00 H new ATOM 0 HD22 ASN A 72 5.849 -7.974 -15.594 1.00 0.00 H new ATOM 1175 N GLY A 73 7.126 -7.245 -20.737 1.00 0.00 N ATOM 1176 CA GLY A 73 7.184 -6.773 -22.108 1.00 0.00 C ATOM 1177 C GLY A 73 8.437 -7.234 -22.827 1.00 0.00 C ATOM 1178 O GLY A 73 9.179 -6.420 -23.378 1.00 0.00 O ATOM 0 H GLY A 73 7.988 -7.668 -20.392 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.307 -7.128 -22.649 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.144 -5.684 -22.116 1.00 0.00 H new ATOM 1182 N ASP A 74 8.673 -8.541 -22.821 1.00 0.00 N ATOM 1183 CA ASP A 74 9.845 -9.109 -23.477 1.00 0.00 C ATOM 1184 C ASP A 74 9.515 -9.540 -24.903 1.00 0.00 C ATOM 1185 O ASP A 74 8.363 -9.836 -25.220 1.00 0.00 O ATOM 1186 CB ASP A 74 10.375 -10.302 -22.680 1.00 0.00 C ATOM 1187 CG ASP A 74 11.523 -11.002 -23.380 1.00 0.00 C ATOM 1188 OD1 ASP A 74 11.502 -12.249 -23.451 1.00 0.00 O ATOM 1189 OD2 ASP A 74 12.441 -10.304 -23.858 1.00 0.00 O ATOM 0 H ASP A 74 8.068 -9.227 -22.369 1.00 0.00 H new ATOM 0 HA ASP A 74 10.615 -8.339 -23.519 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.705 -9.962 -21.699 1.00 0.00 H new ATOM 0 HB3 ASP A 74 9.566 -11.013 -22.515 1.00 0.00 H new ATOM 1194 N GLU A 75 10.533 -9.571 -25.758 1.00 0.00 N ATOM 1195 CA GLU A 75 10.348 -9.964 -27.150 1.00 0.00 C ATOM 1196 C GLU A 75 10.595 -11.459 -27.330 1.00 0.00 C ATOM 1197 O GLU A 75 11.257 -11.880 -28.279 1.00 0.00 O ATOM 1198 CB GLU A 75 11.290 -9.168 -28.056 1.00 0.00 C ATOM 1199 CG GLU A 75 10.816 -9.079 -29.497 1.00 0.00 C ATOM 1200 CD GLU A 75 10.162 -7.749 -29.815 1.00 0.00 C ATOM 1201 OE1 GLU A 75 9.378 -7.258 -28.976 1.00 0.00 O ATOM 1202 OE2 GLU A 75 10.433 -7.198 -30.903 1.00 0.00 O ATOM 0 H GLU A 75 11.493 -9.329 -25.511 1.00 0.00 H new ATOM 0 HA GLU A 75 9.317 -9.747 -27.429 1.00 0.00 H new ATOM 0 HB2 GLU A 75 11.400 -8.160 -27.656 1.00 0.00 H new ATOM 0 HB3 GLU A 75 12.277 -9.629 -28.035 1.00 0.00 H new ATOM 0 HG2 GLU A 75 11.664 -9.231 -30.165 1.00 0.00 H new ATOM 0 HG3 GLU A 75 10.108 -9.884 -29.693 1.00 0.00 H new ATOM 1209 N SER A 76 10.057 -12.256 -26.412 1.00 0.00 N ATOM 1210 CA SER A 76 10.221 -13.704 -26.467 1.00 0.00 C ATOM 1211 C SER A 76 9.264 -14.396 -25.502 1.00 0.00 C ATOM 1212 O SER A 76 9.552 -15.481 -24.995 1.00 0.00 O ATOM 1213 CB SER A 76 11.664 -14.088 -26.134 1.00 0.00 C ATOM 1214 OG SER A 76 11.968 -15.388 -26.607 1.00 0.00 O ATOM 0 H SER A 76 9.504 -11.924 -25.622 1.00 0.00 H new ATOM 0 HA SER A 76 9.989 -14.033 -27.480 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.348 -13.366 -26.580 1.00 0.00 H new ATOM 0 HB3 SER A 76 11.815 -14.046 -25.055 1.00 0.00 H new ATOM 0 HG SER A 76 11.313 -16.026 -26.255 1.00 0.00 H new ATOM 1220 N ILE A 77 8.124 -13.761 -25.252 1.00 0.00 N ATOM 1221 CA ILE A 77 7.123 -14.315 -24.349 1.00 0.00 C ATOM 1222 C ILE A 77 5.712 -13.985 -24.823 1.00 0.00 C ATOM 1223 O ILE A 77 5.485 -12.955 -25.459 1.00 0.00 O ATOM 1224 CB ILE A 77 7.306 -13.788 -22.913 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.768 -13.920 -22.481 1.00 0.00 C ATOM 1226 CG2 ILE A 77 6.394 -14.537 -21.953 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.046 -13.350 -21.108 1.00 0.00 C ATOM 0 H ILE A 77 7.871 -12.862 -25.662 1.00 0.00 H new ATOM 0 HA ILE A 77 7.261 -15.396 -24.351 1.00 0.00 H new ATOM 0 HB ILE A 77 7.034 -12.733 -22.891 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.048 -14.973 -22.492 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.401 -13.415 -23.210 1.00 0.00 H new ATOM 0 HG21 ILE A 77 6.535 -14.153 -20.943 1.00 0.00 H new ATOM 0 HG22 ILE A 77 5.356 -14.396 -22.253 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.637 -15.599 -21.975 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.101 -13.478 -20.868 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.798 -12.289 -21.098 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.439 -13.872 -20.368 1.00 0.00 H new ATOM 1443 N TYR A 91 2.901 -15.548 -19.570 1.00 0.00 N ATOM 1444 CA TYR A 91 4.342 -15.449 -19.369 1.00 0.00 C ATOM 1445 C TYR A 91 5.042 -16.733 -19.804 1.00 0.00 C ATOM 1446 O TYR A 91 6.120 -17.065 -19.310 1.00 0.00 O ATOM 1447 CB TYR A 91 4.654 -15.157 -17.900 1.00 0.00 C ATOM 1448 CG TYR A 91 3.928 -13.947 -17.356 1.00 0.00 C ATOM 1449 CD1 TYR A 91 3.347 -13.970 -16.094 1.00 0.00 C ATOM 1450 CD2 TYR A 91 3.824 -12.781 -18.104 1.00 0.00 C ATOM 1451 CE1 TYR A 91 2.683 -12.868 -15.593 1.00 0.00 C ATOM 1452 CE2 TYR A 91 3.163 -11.673 -17.610 1.00 0.00 C ATOM 1453 CZ TYR A 91 2.594 -11.721 -16.354 1.00 0.00 C ATOM 1454 OH TYR A 91 1.934 -10.620 -15.860 1.00 0.00 O ATOM 0 HA TYR A 91 4.714 -14.628 -19.983 1.00 0.00 H new ATOM 0 HB2 TYR A 91 4.390 -16.028 -17.301 1.00 0.00 H new ATOM 0 HB3 TYR A 91 5.728 -15.007 -17.788 1.00 0.00 H new ATOM 0 HD1 TYR A 91 3.416 -14.866 -15.494 1.00 0.00 H new ATOM 0 HD2 TYR A 91 4.267 -12.740 -19.088 1.00 0.00 H new ATOM 0 HE1 TYR A 91 2.236 -12.904 -14.611 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.092 -10.774 -18.204 1.00 0.00 H new ATOM 0 HH TYR A 91 1.964 -9.897 -16.521 1.00 0.00 H new ATOM 1464 N THR A 92 4.421 -17.452 -20.733 1.00 0.00 N ATOM 1465 CA THR A 92 4.983 -18.700 -21.236 1.00 0.00 C ATOM 1466 C THR A 92 6.191 -18.439 -22.128 1.00 0.00 C ATOM 1467 O THR A 92 6.049 -18.187 -23.325 1.00 0.00 O ATOM 1468 CB THR A 92 3.938 -19.506 -22.030 1.00 0.00 C ATOM 1469 OG1 THR A 92 2.662 -19.423 -21.385 1.00 0.00 O ATOM 1470 CG2 THR A 92 4.357 -20.964 -22.151 1.00 0.00 C ATOM 0 H THR A 92 3.529 -17.192 -21.153 1.00 0.00 H new ATOM 0 HA THR A 92 5.295 -19.279 -20.367 1.00 0.00 H new ATOM 0 HB THR A 92 3.867 -19.080 -23.031 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.003 -19.937 -21.897 1.00 0.00 H new ATOM 0 HG21 THR A 92 3.604 -21.513 -22.716 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.315 -21.026 -22.668 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.453 -21.399 -21.156 1.00 0.00 H new ATOM 1478 N LEU A 93 7.380 -18.501 -21.538 1.00 0.00 N ATOM 1479 CA LEU A 93 8.615 -18.272 -22.280 1.00 0.00 C ATOM 1480 C LEU A 93 8.672 -19.150 -23.526 1.00 0.00 C ATOM 1481 O LEU A 93 8.022 -20.192 -23.595 1.00 0.00 O ATOM 1482 CB LEU A 93 9.827 -18.552 -21.389 1.00 0.00 C ATOM 1483 CG LEU A 93 9.786 -17.942 -19.988 1.00 0.00 C ATOM 1484 CD1 LEU A 93 11.103 -18.175 -19.265 1.00 0.00 C ATOM 1485 CD2 LEU A 93 9.472 -16.454 -20.063 1.00 0.00 C ATOM 0 H LEU A 93 7.515 -18.708 -20.548 1.00 0.00 H new ATOM 0 HA LEU A 93 8.634 -17.228 -22.593 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.938 -19.632 -21.290 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.719 -18.185 -21.897 1.00 0.00 H new ATOM 0 HG LEU A 93 8.994 -18.432 -19.422 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.055 -17.734 -18.270 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.286 -19.246 -19.179 1.00 0.00 H new ATOM 0 HD13 LEU A 93 11.914 -17.713 -19.828 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.447 -16.036 -19.057 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.242 -15.949 -20.646 1.00 0.00 H new ATOM 0 HD23 LEU A 93 8.502 -16.310 -20.540 1.00 0.00 H new ATOM 1497 N GLY A 94 9.457 -18.721 -24.510 1.00 0.00 N ATOM 1498 CA GLY A 94 9.586 -19.480 -25.740 1.00 0.00 C ATOM 1499 C GLY A 94 10.181 -20.856 -25.513 1.00 0.00 C ATOM 1500 O GLY A 94 10.098 -21.727 -26.379 1.00 0.00 O ATOM 0 H GLY A 94 10.006 -17.862 -24.477 1.00 0.00 H new ATOM 0 HA2 GLY A 94 8.605 -19.584 -26.204 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.213 -18.928 -26.440 1.00 0.00 H new ATOM 1504 N ASP A 95 10.785 -21.052 -24.345 1.00 0.00 N ATOM 1505 CA ASP A 95 11.397 -22.331 -24.007 1.00 0.00 C ATOM 1506 C ASP A 95 10.426 -23.208 -23.223 1.00 0.00 C ATOM 1507 O ASP A 95 10.834 -24.140 -22.531 1.00 0.00 O ATOM 1508 CB ASP A 95 12.674 -22.110 -23.194 1.00 0.00 C ATOM 1509 CG ASP A 95 13.763 -21.429 -24.000 1.00 0.00 C ATOM 1510 OD1 ASP A 95 13.533 -21.157 -25.197 1.00 0.00 O ATOM 1511 OD2 ASP A 95 14.844 -21.168 -23.434 1.00 0.00 O ATOM 0 H ASP A 95 10.863 -20.341 -23.617 1.00 0.00 H new ATOM 0 HA ASP A 95 11.650 -22.842 -24.936 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.443 -21.505 -22.317 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.041 -23.070 -22.831 1.00 0.00 H new ATOM 1516 N GLY A 96 9.137 -22.901 -23.335 1.00 0.00 N ATOM 1517 CA GLY A 96 8.128 -23.670 -22.630 1.00 0.00 C ATOM 1518 C GLY A 96 8.427 -23.801 -21.150 1.00 0.00 C ATOM 1519 O GLY A 96 8.028 -24.776 -20.513 1.00 0.00 O ATOM 0 H GLY A 96 8.774 -22.134 -23.901 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.156 -23.194 -22.760 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.058 -24.664 -23.073 1.00 0.00 H new ATOM 1523 N SER A 97 9.135 -22.819 -20.602 1.00 0.00 N ATOM 1524 CA SER A 97 9.493 -22.831 -19.188 1.00 0.00 C ATOM 1525 C SER A 97 8.607 -21.876 -18.395 1.00 0.00 C ATOM 1526 O SER A 97 8.612 -20.667 -18.629 1.00 0.00 O ATOM 1527 CB SER A 97 10.963 -22.449 -19.010 1.00 0.00 C ATOM 1528 OG SER A 97 11.652 -22.478 -20.248 1.00 0.00 O ATOM 0 H SER A 97 9.472 -22.005 -21.115 1.00 0.00 H new ATOM 0 HA SER A 97 9.339 -23.841 -18.808 1.00 0.00 H new ATOM 0 HB2 SER A 97 11.033 -21.452 -18.575 1.00 0.00 H new ATOM 0 HB3 SER A 97 11.438 -23.136 -18.310 1.00 0.00 H new ATOM 0 HG SER A 97 12.589 -22.228 -20.107 1.00 0.00 H new ATOM 1534 N SER A 98 7.846 -22.427 -17.454 1.00 0.00 N ATOM 1535 CA SER A 98 6.952 -21.625 -16.628 1.00 0.00 C ATOM 1536 C SER A 98 7.742 -20.779 -15.635 1.00 0.00 C ATOM 1537 O SER A 98 7.948 -21.177 -14.487 1.00 0.00 O ATOM 1538 CB SER A 98 5.970 -22.528 -15.878 1.00 0.00 C ATOM 1539 OG SER A 98 4.800 -21.817 -15.514 1.00 0.00 O ATOM 0 H SER A 98 7.831 -23.425 -17.245 1.00 0.00 H new ATOM 0 HA SER A 98 6.393 -20.957 -17.283 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.702 -23.379 -16.504 1.00 0.00 H new ATOM 0 HB3 SER A 98 6.449 -22.928 -14.984 1.00 0.00 H new ATOM 0 HG SER A 98 4.188 -22.416 -15.038 1.00 0.00 H new ATOM 1545 N LEU A 99 8.183 -19.609 -16.084 1.00 0.00 N ATOM 1546 CA LEU A 99 8.951 -18.704 -15.236 1.00 0.00 C ATOM 1547 C LEU A 99 8.232 -18.453 -13.915 1.00 0.00 C ATOM 1548 O LEU A 99 7.268 -17.690 -13.858 1.00 0.00 O ATOM 1549 CB LEU A 99 9.192 -17.378 -15.958 1.00 0.00 C ATOM 1550 CG LEU A 99 10.386 -16.555 -15.472 1.00 0.00 C ATOM 1551 CD1 LEU A 99 11.591 -16.778 -16.373 1.00 0.00 C ATOM 1552 CD2 LEU A 99 10.027 -15.078 -15.413 1.00 0.00 C ATOM 0 H LEU A 99 8.022 -19.265 -17.031 1.00 0.00 H new ATOM 0 HA LEU A 99 9.911 -19.174 -15.022 1.00 0.00 H new ATOM 0 HB2 LEU A 99 9.327 -17.585 -17.020 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.294 -16.768 -15.864 1.00 0.00 H new ATOM 0 HG LEU A 99 10.645 -16.885 -14.466 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.431 -16.184 -16.011 1.00 0.00 H new ATOM 0 HD12 LEU A 99 11.862 -17.834 -16.363 1.00 0.00 H new ATOM 0 HD13 LEU A 99 11.345 -16.476 -17.391 1.00 0.00 H new ATOM 0 HD21 LEU A 99 10.888 -14.508 -15.065 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.741 -14.733 -16.407 1.00 0.00 H new ATOM 0 HD23 LEU A 99 9.194 -14.933 -14.725 1.00 0.00 H new ATOM 1564 N GLN A 100 8.708 -19.100 -12.855 1.00 0.00 N ATOM 1565 CA GLN A 100 8.110 -18.945 -11.534 1.00 0.00 C ATOM 1566 C GLN A 100 8.790 -17.823 -10.757 1.00 0.00 C ATOM 1567 O GLN A 100 9.989 -17.586 -10.908 1.00 0.00 O ATOM 1568 CB GLN A 100 8.207 -20.255 -10.751 1.00 0.00 C ATOM 1569 CG GLN A 100 7.356 -21.375 -11.330 1.00 0.00 C ATOM 1570 CD GLN A 100 6.089 -21.617 -10.534 1.00 0.00 C ATOM 1571 OE1 GLN A 100 5.907 -22.683 -9.945 1.00 0.00 O ATOM 1572 NE2 GLN A 100 5.206 -20.626 -10.511 1.00 0.00 N ATOM 0 H GLN A 100 9.505 -19.736 -12.886 1.00 0.00 H new ATOM 0 HA GLN A 100 7.060 -18.686 -11.666 1.00 0.00 H new ATOM 0 HB2 GLN A 100 9.248 -20.577 -10.725 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.904 -20.075 -9.720 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.093 -21.131 -12.359 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.943 -22.293 -11.360 1.00 0.00 H new ATOM 0 HE21 GLN A 100 5.398 -19.760 -11.014 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.335 -20.731 -9.990 1.00 0.00 H new ATOM 1581 N LYS A 101 8.017 -17.134 -9.925 1.00 0.00 N ATOM 1582 CA LYS A 101 8.544 -16.036 -9.122 1.00 0.00 C ATOM 1583 C LYS A 101 9.731 -16.497 -8.283 1.00 0.00 C ATOM 1584 O LYS A 101 9.925 -17.688 -8.040 1.00 0.00 O ATOM 1585 CB LYS A 101 7.450 -15.472 -8.212 1.00 0.00 C ATOM 1586 CG LYS A 101 6.677 -14.321 -8.832 1.00 0.00 C ATOM 1587 CD LYS A 101 5.481 -14.816 -9.627 1.00 0.00 C ATOM 1588 CE LYS A 101 4.554 -13.673 -10.010 1.00 0.00 C ATOM 1589 NZ LYS A 101 3.570 -14.082 -11.050 1.00 0.00 N ATOM 0 H LYS A 101 7.023 -17.316 -9.789 1.00 0.00 H new ATOM 0 HA LYS A 101 8.883 -15.253 -9.800 1.00 0.00 H new ATOM 0 HB2 LYS A 101 6.754 -16.271 -7.957 1.00 0.00 H new ATOM 0 HB3 LYS A 101 7.903 -15.134 -7.280 1.00 0.00 H new ATOM 0 HG2 LYS A 101 6.338 -13.645 -8.047 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.336 -13.748 -9.484 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.826 -15.323 -10.528 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.931 -15.551 -9.039 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.023 -13.324 -9.125 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.145 -12.834 -10.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.935 -13.286 -11.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.075 -14.359 -11.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.012 -14.888 -10.702 1.00 0.00 H new ATOM 1603 N PRO A 102 10.544 -15.533 -7.827 1.00 0.00 N ATOM 1604 CA PRO A 102 11.725 -15.816 -7.006 1.00 0.00 C ATOM 1605 C PRO A 102 11.356 -16.302 -5.608 1.00 0.00 C ATOM 1606 O PRO A 102 10.211 -16.167 -5.176 1.00 0.00 O ATOM 1607 CB PRO A 102 12.437 -14.463 -6.931 1.00 0.00 C ATOM 1608 CG PRO A 102 11.360 -13.455 -7.138 1.00 0.00 C ATOM 1609 CD PRO A 102 10.373 -14.092 -8.077 1.00 0.00 C ATOM 0 HA PRO A 102 12.336 -16.612 -7.432 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.927 -14.326 -5.967 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.209 -14.379 -7.695 1.00 0.00 H new ATOM 0 HG2 PRO A 102 10.885 -13.191 -6.193 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.763 -12.534 -7.560 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.354 -13.767 -7.870 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.584 -13.837 -9.115 1.00 0.00 H new ATOM 1617 N ASP A 103 12.333 -16.867 -4.906 1.00 0.00 N ATOM 1618 CA ASP A 103 12.111 -17.371 -3.556 1.00 0.00 C ATOM 1619 C ASP A 103 12.462 -16.312 -2.516 1.00 0.00 C ATOM 1620 O ASP A 103 13.594 -16.251 -2.035 1.00 0.00 O ATOM 1621 CB ASP A 103 12.941 -18.634 -3.318 1.00 0.00 C ATOM 1622 CG ASP A 103 12.268 -19.597 -2.360 1.00 0.00 C ATOM 1623 OD1 ASP A 103 12.983 -20.225 -1.551 1.00 0.00 O ATOM 1624 OD2 ASP A 103 11.027 -19.721 -2.418 1.00 0.00 O ATOM 0 H ASP A 103 13.286 -16.987 -5.250 1.00 0.00 H new ATOM 0 HA ASP A 103 11.054 -17.616 -3.455 1.00 0.00 H new ATOM 0 HB2 ASP A 103 13.115 -19.135 -4.270 1.00 0.00 H new ATOM 0 HB3 ASP A 103 13.917 -18.354 -2.922 1.00 0.00 H new ATOM 1629 N VAL A 104 11.484 -15.480 -2.173 1.00 0.00 N ATOM 1630 CA VAL A 104 11.690 -14.423 -1.190 1.00 0.00 C ATOM 1631 C VAL A 104 10.878 -14.682 0.074 1.00 0.00 C ATOM 1632 O VAL A 104 10.561 -13.757 0.822 1.00 0.00 O ATOM 1633 CB VAL A 104 11.306 -13.044 -1.759 1.00 0.00 C ATOM 1634 CG1 VAL A 104 12.071 -12.766 -3.044 1.00 0.00 C ATOM 1635 CG2 VAL A 104 9.806 -12.964 -1.994 1.00 0.00 C ATOM 0 H VAL A 104 10.541 -15.517 -2.561 1.00 0.00 H new ATOM 0 HA VAL A 104 12.752 -14.423 -0.943 1.00 0.00 H new ATOM 0 HB VAL A 104 11.577 -12.280 -1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.787 -11.788 -3.432 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.142 -12.779 -2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 104 11.833 -13.532 -3.782 1.00 0.00 H new ATOM 0 HG21 VAL A 104 9.553 -11.983 -2.396 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.507 -13.735 -2.704 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.281 -13.116 -1.051 1.00 0.00 H new ATOM 1645 N TYR A 105 10.544 -15.947 0.307 1.00 0.00 N ATOM 1646 CA TYR A 105 9.766 -16.329 1.480 1.00 0.00 C ATOM 1647 C TYR A 105 10.600 -16.201 2.751 1.00 0.00 C ATOM 1648 O TYR A 105 10.149 -15.639 3.748 1.00 0.00 O ATOM 1649 CB TYR A 105 9.255 -17.763 1.334 1.00 0.00 C ATOM 1650 CG TYR A 105 8.530 -18.275 2.558 1.00 0.00 C ATOM 1651 CD1 TYR A 105 9.154 -19.141 3.447 1.00 0.00 C ATOM 1652 CD2 TYR A 105 7.221 -17.893 2.825 1.00 0.00 C ATOM 1653 CE1 TYR A 105 8.496 -19.612 4.567 1.00 0.00 C ATOM 1654 CE2 TYR A 105 6.556 -18.358 3.943 1.00 0.00 C ATOM 1655 CZ TYR A 105 7.197 -19.217 4.810 1.00 0.00 C ATOM 1656 OH TYR A 105 6.537 -19.683 5.924 1.00 0.00 O ATOM 0 H TYR A 105 10.800 -16.725 -0.301 1.00 0.00 H new ATOM 0 HA TYR A 105 8.914 -15.653 1.556 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.584 -17.815 0.476 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.098 -18.420 1.120 1.00 0.00 H new ATOM 0 HD1 TYR A 105 10.171 -19.452 3.259 1.00 0.00 H new ATOM 0 HD2 TYR A 105 6.715 -17.221 2.147 1.00 0.00 H new ATOM 0 HE1 TYR A 105 8.996 -20.285 5.248 1.00 0.00 H new ATOM 0 HE2 TYR A 105 5.539 -18.050 4.137 1.00 0.00 H new ATOM 0 HH TYR A 105 5.632 -19.309 5.948 1.00 0.00 H new ATOM 1666 N ALA A 106 11.820 -16.727 2.706 1.00 0.00 N ATOM 1667 CA ALA A 106 12.718 -16.670 3.852 1.00 0.00 C ATOM 1668 C ALA A 106 13.080 -15.229 4.196 1.00 0.00 C ATOM 1669 O ALA A 106 13.423 -14.919 5.337 1.00 0.00 O ATOM 1670 CB ALA A 106 13.976 -17.481 3.577 1.00 0.00 C ATOM 0 H ALA A 106 12.208 -17.197 1.888 1.00 0.00 H new ATOM 0 HA ALA A 106 12.201 -17.101 4.709 1.00 0.00 H new ATOM 0 HB1 ALA A 106 14.638 -17.430 4.441 1.00 0.00 H new ATOM 0 HB2 ALA A 106 13.705 -18.520 3.388 1.00 0.00 H new ATOM 0 HB3 ALA A 106 14.487 -17.075 2.704 1.00 0.00 H new ATOM 1676 N LEU A 107 13.003 -14.352 3.201 1.00 0.00 N ATOM 1677 CA LEU A 107 13.323 -12.942 3.398 1.00 0.00 C ATOM 1678 C LEU A 107 12.312 -12.278 4.326 1.00 0.00 C ATOM 1679 O LEU A 107 12.684 -11.651 5.319 1.00 0.00 O ATOM 1680 CB LEU A 107 13.353 -12.213 2.053 1.00 0.00 C ATOM 1681 CG LEU A 107 14.543 -12.528 1.145 1.00 0.00 C ATOM 1682 CD1 LEU A 107 14.455 -11.729 -0.146 1.00 0.00 C ATOM 1683 CD2 LEU A 107 15.853 -12.242 1.864 1.00 0.00 C ATOM 0 H LEU A 107 12.722 -14.592 2.250 1.00 0.00 H new ATOM 0 HA LEU A 107 14.308 -12.880 3.861 1.00 0.00 H new ATOM 0 HB2 LEU A 107 12.437 -12.451 1.513 1.00 0.00 H new ATOM 0 HB3 LEU A 107 13.341 -11.140 2.244 1.00 0.00 H new ATOM 0 HG LEU A 107 14.514 -13.588 0.894 1.00 0.00 H new ATOM 0 HD11 LEU A 107 15.310 -11.966 -0.780 1.00 0.00 H new ATOM 0 HD12 LEU A 107 13.534 -11.984 -0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 107 14.458 -10.664 0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 107 16.689 -12.472 1.203 1.00 0.00 H new ATOM 0 HD22 LEU A 107 15.892 -11.190 2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 107 15.919 -12.859 2.760 1.00 0.00 H new ATOM 1695 N ILE A 108 11.032 -12.422 3.999 1.00 0.00 N ATOM 1696 CA ILE A 108 9.967 -11.839 4.806 1.00 0.00 C ATOM 1697 C ILE A 108 9.526 -12.797 5.907 1.00 0.00 C ATOM 1698 O ILE A 108 8.530 -12.557 6.591 1.00 0.00 O ATOM 1699 CB ILE A 108 8.746 -11.468 3.943 1.00 0.00 C ATOM 1700 CG1 ILE A 108 8.260 -12.688 3.158 1.00 0.00 C ATOM 1701 CG2 ILE A 108 9.092 -10.327 2.999 1.00 0.00 C ATOM 1702 CD1 ILE A 108 6.945 -12.462 2.445 1.00 0.00 C ATOM 0 H ILE A 108 10.707 -12.937 3.181 1.00 0.00 H new ATOM 0 HA ILE A 108 10.371 -10.933 5.257 1.00 0.00 H new ATOM 0 HB ILE A 108 7.941 -11.138 4.600 1.00 0.00 H new ATOM 0 HG12 ILE A 108 9.018 -12.965 2.426 1.00 0.00 H new ATOM 0 HG13 ILE A 108 8.154 -13.531 3.841 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.219 -10.076 2.396 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.396 -9.455 3.578 1.00 0.00 H new ATOM 0 HG23 ILE A 108 9.910 -10.631 2.345 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.661 -13.368 1.909 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.173 -12.215 3.174 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.052 -11.640 1.737 1.00 0.00 H new ATOM 1714 N LYS A 109 10.274 -13.882 6.076 1.00 0.00 N ATOM 1715 CA LYS A 109 9.963 -14.875 7.096 1.00 0.00 C ATOM 1716 C LYS A 109 9.895 -14.233 8.478 1.00 0.00 C ATOM 1717 O LYS A 109 9.243 -14.754 9.384 1.00 0.00 O ATOM 1718 CB LYS A 109 11.013 -15.988 7.091 1.00 0.00 C ATOM 1719 CG LYS A 109 10.826 -17.007 8.202 1.00 0.00 C ATOM 1720 CD LYS A 109 11.884 -16.854 9.282 1.00 0.00 C ATOM 1721 CE LYS A 109 11.757 -17.935 10.344 1.00 0.00 C ATOM 1722 NZ LYS A 109 11.948 -17.390 11.717 1.00 0.00 N ATOM 0 H LYS A 109 11.101 -14.096 5.519 1.00 0.00 H new ATOM 0 HA LYS A 109 8.988 -15.303 6.865 1.00 0.00 H new ATOM 0 HB2 LYS A 109 10.981 -16.501 6.130 1.00 0.00 H new ATOM 0 HB3 LYS A 109 12.003 -15.542 7.182 1.00 0.00 H new ATOM 0 HG2 LYS A 109 9.836 -16.889 8.642 1.00 0.00 H new ATOM 0 HG3 LYS A 109 10.872 -18.013 7.786 1.00 0.00 H new ATOM 0 HD2 LYS A 109 12.875 -16.900 8.831 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.791 -15.873 9.747 1.00 0.00 H new ATOM 0 HE2 LYS A 109 10.774 -18.401 10.272 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.494 -18.716 10.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 11.854 -18.158 12.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 12.895 -16.968 11.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 11.228 -16.663 11.905 1.00 0.00 H new ATOM 1736 N ASP A 110 10.570 -13.100 8.632 1.00 0.00 N ATOM 1737 CA ASP A 110 10.584 -12.385 9.903 1.00 0.00 C ATOM 1738 C ASP A 110 9.346 -11.505 10.045 1.00 0.00 C ATOM 1739 O ASP A 110 8.903 -11.214 11.157 1.00 0.00 O ATOM 1740 CB ASP A 110 11.848 -11.531 10.019 1.00 0.00 C ATOM 1741 CG ASP A 110 13.109 -12.322 9.731 1.00 0.00 C ATOM 1742 OD1 ASP A 110 13.149 -13.522 10.076 1.00 0.00 O ATOM 1743 OD2 ASP A 110 14.055 -11.741 9.160 1.00 0.00 O ATOM 0 H ASP A 110 11.115 -12.656 7.893 1.00 0.00 H new ATOM 0 HA ASP A 110 10.578 -13.122 10.706 1.00 0.00 H new ATOM 0 HB2 ASP A 110 11.782 -10.693 9.325 1.00 0.00 H new ATOM 0 HB3 ASP A 110 11.908 -11.110 11.023 1.00 0.00 H new ATOM 1748 N TYR A 111 8.794 -11.083 8.914 1.00 0.00 N ATOM 1749 CA TYR A 111 7.609 -10.233 8.912 1.00 0.00 C ATOM 1750 C TYR A 111 6.400 -10.984 8.363 1.00 0.00 C ATOM 1751 O TYR A 111 5.642 -10.455 7.550 1.00 0.00 O ATOM 1752 CB TYR A 111 7.861 -8.973 8.081 1.00 0.00 C ATOM 1753 CG TYR A 111 9.070 -8.184 8.530 1.00 0.00 C ATOM 1754 CD1 TYR A 111 8.944 -7.140 9.439 1.00 0.00 C ATOM 1755 CD2 TYR A 111 10.337 -8.480 8.045 1.00 0.00 C ATOM 1756 CE1 TYR A 111 10.046 -6.416 9.852 1.00 0.00 C ATOM 1757 CE2 TYR A 111 11.445 -7.762 8.453 1.00 0.00 C ATOM 1758 CZ TYR A 111 11.294 -6.731 9.356 1.00 0.00 C ATOM 1759 OH TYR A 111 12.394 -6.012 9.764 1.00 0.00 O ATOM 0 H TYR A 111 9.148 -11.315 7.986 1.00 0.00 H new ATOM 0 HA TYR A 111 7.398 -9.945 9.942 1.00 0.00 H new ATOM 0 HB2 TYR A 111 7.990 -9.256 7.036 1.00 0.00 H new ATOM 0 HB3 TYR A 111 6.980 -8.333 8.131 1.00 0.00 H new ATOM 0 HD1 TYR A 111 7.968 -6.891 9.829 1.00 0.00 H new ATOM 0 HD2 TYR A 111 10.459 -9.286 7.336 1.00 0.00 H new ATOM 0 HE1 TYR A 111 9.931 -5.608 10.559 1.00 0.00 H new ATOM 0 HE2 TYR A 111 12.423 -8.007 8.067 1.00 0.00 H new ATOM 0 HH TYR A 111 13.196 -6.362 9.322 1.00 0.00 H new ATOM 1769 N VAL A 112 6.226 -12.222 8.814 1.00 0.00 N ATOM 1770 CA VAL A 112 5.109 -13.047 8.371 1.00 0.00 C ATOM 1771 C VAL A 112 4.117 -13.284 9.504 1.00 0.00 C ATOM 1772 O VAL A 112 4.329 -14.142 10.361 1.00 0.00 O ATOM 1773 CB VAL A 112 5.594 -14.408 7.836 1.00 0.00 C ATOM 1774 CG1 VAL A 112 4.454 -15.415 7.826 1.00 0.00 C ATOM 1775 CG2 VAL A 112 6.189 -14.251 6.445 1.00 0.00 C ATOM 0 H VAL A 112 6.845 -12.676 9.486 1.00 0.00 H new ATOM 0 HA VAL A 112 4.614 -12.503 7.566 1.00 0.00 H new ATOM 0 HB VAL A 112 6.373 -14.783 8.500 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.816 -16.370 7.445 1.00 0.00 H new ATOM 0 HG12 VAL A 112 4.077 -15.548 8.840 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.651 -15.049 7.186 1.00 0.00 H new ATOM 0 HG21 VAL A 112 6.527 -15.222 6.082 1.00 0.00 H new ATOM 0 HG22 VAL A 112 5.432 -13.854 5.768 1.00 0.00 H new ATOM 0 HG23 VAL A 112 7.035 -13.565 6.486 1.00 0.00 H new ATOM 1910 N ILE A 122 -10.977 -4.366 14.933 1.00 0.00 N ATOM 1911 CA ILE A 122 -11.857 -5.281 14.217 1.00 0.00 C ATOM 1912 C ILE A 122 -13.322 -4.984 14.519 1.00 0.00 C ATOM 1913 O ILE A 122 -13.672 -4.615 15.639 1.00 0.00 O ATOM 1914 CB ILE A 122 -11.557 -6.748 14.578 1.00 0.00 C ATOM 1915 CG1 ILE A 122 -10.104 -7.092 14.243 1.00 0.00 C ATOM 1916 CG2 ILE A 122 -12.511 -7.680 13.845 1.00 0.00 C ATOM 1917 CD1 ILE A 122 -9.149 -6.866 15.394 1.00 0.00 C ATOM 0 HA ILE A 122 -11.670 -5.131 13.154 1.00 0.00 H new ATOM 0 HB ILE A 122 -11.704 -6.880 15.650 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -10.048 -8.136 13.935 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -9.784 -6.491 13.392 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -12.286 -8.713 14.111 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -13.537 -7.447 14.129 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -12.394 -7.548 12.769 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -8.138 -7.130 15.085 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -9.176 -5.817 15.688 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -9.444 -7.488 16.239 1.00 0.00 H new ATOM 1929 N GLU A 123 -14.173 -5.149 13.511 1.00 0.00 N ATOM 1930 CA GLU A 123 -15.601 -4.900 13.670 1.00 0.00 C ATOM 1931 C GLU A 123 -15.864 -3.433 13.996 1.00 0.00 C ATOM 1932 O GLU A 123 -16.945 -3.073 14.462 1.00 0.00 O ATOM 1933 CB GLU A 123 -16.178 -5.790 14.773 1.00 0.00 C ATOM 1934 CG GLU A 123 -17.398 -6.584 14.338 1.00 0.00 C ATOM 1935 CD GLU A 123 -18.295 -6.959 15.502 1.00 0.00 C ATOM 1936 OE1 GLU A 123 -17.759 -7.257 16.591 1.00 0.00 O ATOM 1937 OE2 GLU A 123 -19.531 -6.954 15.326 1.00 0.00 O ATOM 0 H GLU A 123 -13.899 -5.454 12.577 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.092 -5.139 12.727 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.406 -6.482 15.111 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -16.445 -5.168 15.627 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -17.970 -5.999 13.617 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -17.074 -7.491 13.827 1.00 0.00 H new ATOM 1944 N ALA A 124 -14.867 -2.589 13.747 1.00 0.00 N ATOM 1945 CA ALA A 124 -14.991 -1.161 14.012 1.00 0.00 C ATOM 1946 C ALA A 124 -15.368 -0.399 12.747 1.00 0.00 C ATOM 1947 O ALA A 124 -16.292 0.416 12.753 1.00 0.00 O ATOM 1948 CB ALA A 124 -13.692 -0.618 14.590 1.00 0.00 C ATOM 0 H ALA A 124 -13.965 -2.870 13.362 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.789 -1.019 14.741 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.798 0.449 14.783 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.465 -1.135 15.522 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -12.882 -0.779 13.879 1.00 0.00 H new ATOM 1954 N LYS A 125 -14.649 -0.667 11.663 1.00 0.00 N ATOM 1955 CA LYS A 125 -14.908 -0.007 10.389 1.00 0.00 C ATOM 1956 C LYS A 125 -16.179 -0.549 9.744 1.00 0.00 C ATOM 1957 O LYS A 125 -16.897 0.177 9.056 1.00 0.00 O ATOM 1958 CB LYS A 125 -13.722 -0.197 9.441 1.00 0.00 C ATOM 1959 CG LYS A 125 -13.723 0.763 8.264 1.00 0.00 C ATOM 1960 CD LYS A 125 -12.543 1.719 8.324 1.00 0.00 C ATOM 1961 CE LYS A 125 -12.165 2.225 6.940 1.00 0.00 C ATOM 1962 NZ LYS A 125 -10.696 2.159 6.707 1.00 0.00 N ATOM 0 H LYS A 125 -13.881 -1.338 11.641 1.00 0.00 H new ATOM 0 HA LYS A 125 -15.044 1.057 10.582 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -12.796 -0.070 10.002 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -13.729 -1.220 9.065 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -13.688 0.198 7.332 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -14.653 1.331 8.257 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -12.790 2.564 8.967 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -11.688 1.215 8.775 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -12.680 1.632 6.184 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -12.505 3.254 6.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -10.480 2.512 5.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -10.206 2.745 7.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -10.375 1.173 6.792 1.00 0.00 H new ATOM 1976 N VAL A 126 -16.453 -1.830 9.971 1.00 0.00 N ATOM 1977 CA VAL A 126 -17.639 -2.469 9.414 1.00 0.00 C ATOM 1978 C VAL A 126 -18.898 -1.675 9.745 1.00 0.00 C ATOM 1979 O VAL A 126 -19.763 -1.481 8.891 1.00 0.00 O ATOM 1980 CB VAL A 126 -17.800 -3.908 9.939 1.00 0.00 C ATOM 1981 CG1 VAL A 126 -19.050 -4.552 9.358 1.00 0.00 C ATOM 1982 CG2 VAL A 126 -16.565 -4.735 9.616 1.00 0.00 C ATOM 0 H VAL A 126 -15.869 -2.446 10.537 1.00 0.00 H new ATOM 0 HA VAL A 126 -17.505 -2.497 8.333 1.00 0.00 H new ATOM 0 HB VAL A 126 -17.910 -3.870 11.023 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -19.147 -5.568 9.740 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -19.926 -3.971 9.646 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -18.974 -4.579 8.271 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -16.697 -5.749 9.994 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -16.421 -4.767 8.536 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -15.691 -4.283 10.086 1.00 0.00 H new ATOM 1992 N ARG A 127 -18.992 -1.218 10.989 1.00 0.00 N ATOM 1993 CA ARG A 127 -20.146 -0.445 11.433 1.00 0.00 C ATOM 1994 C ARG A 127 -20.223 0.889 10.697 1.00 0.00 C ATOM 1995 O ARG A 127 -21.306 1.435 10.493 1.00 0.00 O ATOM 1996 CB ARG A 127 -20.074 -0.203 12.942 1.00 0.00 C ATOM 1997 CG ARG A 127 -20.937 -1.157 13.753 1.00 0.00 C ATOM 1998 CD ARG A 127 -21.944 -0.405 14.609 1.00 0.00 C ATOM 1999 NE ARG A 127 -23.263 -0.352 13.983 1.00 0.00 N ATOM 2000 CZ ARG A 127 -24.328 0.195 14.558 1.00 0.00 C ATOM 2001 NH1 ARG A 127 -24.230 0.733 15.766 1.00 0.00 N ATOM 2002 NH2 ARG A 127 -25.494 0.205 13.924 1.00 0.00 N ATOM 0 H ARG A 127 -18.284 -1.369 11.707 1.00 0.00 H new ATOM 0 HA ARG A 127 -21.045 -1.018 11.206 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -19.038 -0.297 13.268 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -20.382 0.821 13.153 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -21.463 -1.835 13.081 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -20.302 -1.771 14.391 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -22.024 -0.888 15.583 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -21.585 0.609 14.785 1.00 0.00 H new ATOM 0 HE ARG A 127 -23.372 -0.757 13.053 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -23.335 0.727 16.256 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -25.049 1.152 16.205 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -25.573 -0.208 12.995 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -26.311 0.625 14.366 1.00 0.00 H new ATOM 2016 N MET A 128 -19.065 1.408 10.300 1.00 0.00 N ATOM 2017 CA MET A 128 -19.001 2.678 9.586 1.00 0.00 C ATOM 2018 C MET A 128 -19.359 2.492 8.115 1.00 0.00 C ATOM 2019 O MET A 128 -20.272 3.141 7.602 1.00 0.00 O ATOM 2020 CB MET A 128 -17.604 3.288 9.710 1.00 0.00 C ATOM 2021 CG MET A 128 -17.573 4.789 9.471 1.00 0.00 C ATOM 2022 SD MET A 128 -17.614 5.213 7.719 1.00 0.00 S ATOM 2023 CE MET A 128 -16.201 4.294 7.114 1.00 0.00 C ATOM 0 H MET A 128 -18.159 0.969 10.461 1.00 0.00 H new ATOM 0 HA MET A 128 -19.726 3.356 10.036 1.00 0.00 H new ATOM 0 HB2 MET A 128 -17.212 3.079 10.705 1.00 0.00 H new ATOM 0 HB3 MET A 128 -16.939 2.801 8.997 1.00 0.00 H new ATOM 0 HG2 MET A 128 -18.423 5.251 9.973 1.00 0.00 H new ATOM 0 HG3 MET A 128 -16.672 5.206 9.921 1.00 0.00 H new ATOM 0 HE1 MET A 128 -15.789 4.795 6.238 1.00 0.00 H new ATOM 0 HE2 MET A 128 -15.440 4.241 7.893 1.00 0.00 H new ATOM 0 HE3 MET A 128 -16.512 3.285 6.842 1.00 0.00 H new ATOM 2033 N ARG A 129 -18.635 1.604 7.442 1.00 0.00 N ATOM 2034 CA ARG A 129 -18.876 1.336 6.029 1.00 0.00 C ATOM 2035 C ARG A 129 -20.291 0.807 5.810 1.00 0.00 C ATOM 2036 O ARG A 129 -20.861 0.960 4.729 1.00 0.00 O ATOM 2037 CB ARG A 129 -17.855 0.327 5.499 1.00 0.00 C ATOM 2038 CG ARG A 129 -17.863 -0.997 6.244 1.00 0.00 C ATOM 2039 CD ARG A 129 -18.757 -2.018 5.557 1.00 0.00 C ATOM 2040 NE ARG A 129 -18.041 -2.769 4.530 1.00 0.00 N ATOM 2041 CZ ARG A 129 -18.484 -3.907 4.008 1.00 0.00 C ATOM 2042 NH1 ARG A 129 -19.636 -4.423 4.415 1.00 0.00 N ATOM 2043 NH2 ARG A 129 -17.775 -4.532 3.077 1.00 0.00 N ATOM 0 H ARG A 129 -17.877 1.058 7.852 1.00 0.00 H new ATOM 0 HA ARG A 129 -18.768 2.273 5.483 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -18.055 0.141 4.444 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -16.858 0.764 5.563 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -16.847 -1.386 6.308 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -18.208 -0.839 7.266 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -19.155 -2.709 6.300 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -19.609 -1.509 5.106 1.00 0.00 H new ATOM 0 HE ARG A 129 -17.151 -2.399 4.195 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -20.184 -3.946 5.131 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -19.974 -5.297 4.012 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -16.888 -4.139 2.761 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -18.116 -5.406 2.677 1.00 0.00 H new ATOM 2057 N SER A 130 -20.851 0.184 6.842 1.00 0.00 N ATOM 2058 CA SER A 130 -22.197 -0.371 6.760 1.00 0.00 C ATOM 2059 C SER A 130 -23.174 0.447 7.599 1.00 0.00 C ATOM 2060 O SER A 130 -23.889 -0.094 8.442 1.00 0.00 O ATOM 2061 CB SER A 130 -22.199 -1.827 7.229 1.00 0.00 C ATOM 2062 OG SER A 130 -23.378 -2.495 6.814 1.00 0.00 O ATOM 0 H SER A 130 -20.394 0.051 7.744 1.00 0.00 H new ATOM 0 HA SER A 130 -22.518 -0.331 5.719 1.00 0.00 H new ATOM 0 HB2 SER A 130 -21.326 -2.342 6.829 1.00 0.00 H new ATOM 0 HB3 SER A 130 -22.121 -1.862 8.316 1.00 0.00 H new ATOM 0 HG SER A 130 -24.163 -2.001 7.131 1.00 0.00 H new