USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 949 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 Single : A 3 THR OG1 : rot 12:sc= 0.665 USER MOD Single : A 4 LYS NZ :NH3+ 177:sc= 0.535 (180deg=0.529) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 90:sc= 0.0312 USER MOD Single : A 14 TYR OH : rot 81:sc= 0.115 USER MOD Single : A 15 ASN : amide:sc= -1.23 K(o=-1.2,f=-2.2) USER MOD Single : A 28 THR OG1 : rot -140:sc= -1.56 USER MOD Single : A 30 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.113) USER MOD Single : A 31 TYR OH : rot 125:sc= 0.824 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 48:sc= 0.594 USER MOD Single : A 41 GLN : amide:sc=-0.00497 X(o=-0.005,f=0) USER MOD Single : A 45 TYR OH : rot -65:sc= 1.72 USER MOD Single : A 46 GLN : amide:sc= -0.255 X(o=-0.26,f=-0.065) USER MOD Single : A 47 HIS : no HD1:sc= -0.134 X(o=-0.13,f=-0.3) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.0319 X(o=-0.032,f=-0.0034) USER MOD Single : A 52 CYS SG : rot 139:sc= 1.53 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 5:sc=0.000461 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 114:sc= 1.45 USER MOD Single : A 85 ASN : amide:sc= -0.64 X(o=-0.64,f=-0.37) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.495 X(o=-0.5,f=-0.78) USER MOD Single : A 93 LYS NZ :NH3+ -178:sc= 0.0418 (180deg=0.0412) USER MOD Single : A 94 THR OG1 : rot 86:sc= 0.812 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.021) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0.82 K(o=0.82,f=-0.025) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -116:sc= -0.146 (180deg=-1.33) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -166:sc= -0.0106 (180deg=-0.157) USER MOD Single : A 123 ASN : amide:sc= 1.04 K(o=1,f=-0.27) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 13 N THR A 3 -3.267 -17.448 -10.814 1.00 0.00 N ATOM 14 CA THR A 3 -3.452 -16.213 -10.056 1.00 0.00 C ATOM 15 C THR A 3 -4.764 -15.528 -10.434 1.00 0.00 C ATOM 16 O THR A 3 -5.047 -15.312 -11.615 1.00 0.00 O ATOM 17 CB THR A 3 -2.277 -15.257 -10.292 1.00 0.00 C ATOM 18 OG1 THR A 3 -1.125 -15.965 -10.720 1.00 0.00 O ATOM 19 CG2 THR A 3 -1.894 -14.462 -9.060 1.00 0.00 C ATOM 0 HA THR A 3 -3.491 -16.473 -8.998 1.00 0.00 H new ATOM 0 HB THR A 3 -2.622 -14.566 -11.061 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.373 -16.885 -10.950 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.056 -13.806 -9.296 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.744 -13.862 -8.735 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.605 -15.145 -8.261 1.00 0.00 H new ATOM 27 N LYS A 4 -5.560 -15.186 -9.421 1.00 0.00 N ATOM 28 CA LYS A 4 -6.843 -14.521 -9.637 1.00 0.00 C ATOM 29 C LYS A 4 -7.031 -13.380 -8.636 1.00 0.00 C ATOM 30 O LYS A 4 -6.600 -13.474 -7.486 1.00 0.00 O ATOM 31 CB LYS A 4 -7.995 -15.524 -9.513 1.00 0.00 C ATOM 32 CG LYS A 4 -7.897 -16.695 -10.481 1.00 0.00 C ATOM 33 CD LYS A 4 -8.679 -16.435 -11.761 1.00 0.00 C ATOM 34 CE LYS A 4 -8.031 -17.110 -12.960 1.00 0.00 C ATOM 35 NZ LYS A 4 -7.092 -16.199 -13.674 1.00 0.00 N ATOM 0 H LYS A 4 -5.337 -15.359 -8.441 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.847 -14.106 -10.645 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.021 -15.909 -8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.938 -15.003 -9.682 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -6.851 -16.879 -10.725 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.275 -17.597 -10.000 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.700 -16.800 -11.645 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.742 -15.361 -11.938 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.493 -17.998 -12.629 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.806 -17.445 -13.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -6.634 -16.714 -14.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -7.619 -15.388 -14.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -6.367 -15.859 -13.011 1.00 0.00 H new ATOM 49 N ILE A 5 -7.678 -12.305 -9.083 1.00 0.00 N ATOM 50 CA ILE A 5 -7.922 -11.147 -8.226 1.00 0.00 C ATOM 51 C ILE A 5 -9.411 -10.987 -7.935 1.00 0.00 C ATOM 52 O ILE A 5 -10.236 -10.972 -8.851 1.00 0.00 O ATOM 53 CB ILE A 5 -7.381 -9.843 -8.857 1.00 0.00 C ATOM 54 CG1 ILE A 5 -7.627 -8.654 -7.921 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.019 -9.591 -10.218 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.755 -7.455 -8.224 1.00 0.00 C ATOM 0 H ILE A 5 -8.042 -12.212 -10.031 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.389 -11.328 -7.293 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.307 -9.956 -9.002 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.674 -8.358 -7.990 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.452 -8.970 -6.892 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.622 -8.668 -10.641 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.793 -10.423 -10.885 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.099 -9.502 -10.103 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.983 -6.652 -7.523 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.706 -7.734 -8.127 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.947 -7.113 -9.241 1.00 0.00 H new ATOM 68 N ASP A 6 -9.748 -10.862 -6.654 1.00 0.00 N ATOM 69 CA ASP A 6 -11.138 -10.694 -6.246 1.00 0.00 C ATOM 70 C ASP A 6 -11.612 -9.273 -6.532 1.00 0.00 C ATOM 71 O ASP A 6 -11.289 -8.336 -5.798 1.00 0.00 O ATOM 72 CB ASP A 6 -11.308 -11.019 -4.762 1.00 0.00 C ATOM 73 CG ASP A 6 -12.730 -11.413 -4.413 1.00 0.00 C ATOM 74 OD1 ASP A 6 -13.663 -10.660 -4.766 1.00 0.00 O ATOM 75 OD2 ASP A 6 -12.912 -12.478 -3.785 1.00 0.00 O ATOM 0 H ASP A 6 -9.079 -10.874 -5.884 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.748 -11.388 -6.824 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.633 -11.831 -4.491 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.018 -10.152 -4.168 1.00 0.00 H new ATOM 80 N LYS A 7 -12.377 -9.124 -7.608 1.00 0.00 N ATOM 81 CA LYS A 7 -12.901 -7.819 -8.008 1.00 0.00 C ATOM 82 C LYS A 7 -13.955 -7.325 -7.018 1.00 0.00 C ATOM 83 O LYS A 7 -14.058 -6.125 -6.763 1.00 0.00 O ATOM 84 CB LYS A 7 -13.498 -7.886 -9.419 1.00 0.00 C ATOM 85 CG LYS A 7 -12.682 -7.138 -10.464 1.00 0.00 C ATOM 86 CD LYS A 7 -13.563 -6.265 -11.346 1.00 0.00 C ATOM 87 CE LYS A 7 -13.771 -6.888 -12.719 1.00 0.00 C ATOM 88 NZ LYS A 7 -15.151 -6.661 -13.234 1.00 0.00 N ATOM 0 H LYS A 7 -12.650 -9.892 -8.222 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.071 -7.113 -8.010 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.585 -8.931 -9.718 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.508 -7.476 -9.397 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -11.936 -6.518 -9.968 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.141 -7.853 -11.084 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.529 -6.116 -10.863 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -13.107 -5.281 -11.457 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.049 -6.469 -13.420 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.577 -7.959 -12.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.249 -7.102 -14.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -15.840 -7.083 -12.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.329 -5.639 -13.312 1.00 0.00 H new ATOM 102 N GLU A 8 -14.732 -8.255 -6.463 1.00 0.00 N ATOM 103 CA GLU A 8 -15.774 -7.918 -5.500 1.00 0.00 C ATOM 104 C GLU A 8 -15.164 -7.448 -4.178 1.00 0.00 C ATOM 105 O GLU A 8 -15.539 -6.398 -3.652 1.00 0.00 O ATOM 106 CB GLU A 8 -16.678 -9.127 -5.258 1.00 0.00 C ATOM 107 CG GLU A 8 -17.720 -9.334 -6.346 1.00 0.00 C ATOM 108 CD GLU A 8 -18.826 -10.283 -5.921 1.00 0.00 C ATOM 109 OE1 GLU A 8 -18.507 -11.389 -5.436 1.00 0.00 O ATOM 110 OE2 GLU A 8 -20.011 -9.919 -6.076 1.00 0.00 O ATOM 0 H GLU A 8 -14.657 -9.252 -6.667 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.369 -7.103 -5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.061 -10.022 -5.182 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.184 -9.006 -4.300 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.155 -8.372 -6.615 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -17.234 -9.725 -7.240 1.00 0.00 H new ATOM 117 N ALA A 9 -14.222 -8.233 -3.652 1.00 0.00 N ATOM 118 CA ALA A 9 -13.552 -7.904 -2.395 1.00 0.00 C ATOM 119 C ALA A 9 -12.776 -6.597 -2.516 1.00 0.00 C ATOM 120 O ALA A 9 -12.974 -5.674 -1.724 1.00 0.00 O ATOM 121 CB ALA A 9 -12.623 -9.035 -1.977 1.00 0.00 C ATOM 0 H ALA A 9 -13.906 -9.103 -4.080 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.315 -7.776 -1.627 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.132 -8.775 -1.039 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.201 -9.949 -1.842 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.870 -9.192 -2.750 1.00 0.00 H new ATOM 127 N CYS A 10 -11.897 -6.522 -3.517 1.00 0.00 N ATOM 128 CA CYS A 10 -11.095 -5.323 -3.751 1.00 0.00 C ATOM 129 C CYS A 10 -11.990 -4.096 -3.923 1.00 0.00 C ATOM 130 O CYS A 10 -11.654 -3.003 -3.464 1.00 0.00 O ATOM 131 CB CYS A 10 -10.213 -5.505 -4.988 1.00 0.00 C ATOM 132 SG CYS A 10 -9.105 -4.114 -5.320 1.00 0.00 S ATOM 0 H CYS A 10 -11.723 -7.279 -4.178 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.457 -5.167 -2.881 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -9.616 -6.409 -4.865 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.853 -5.661 -5.857 1.00 0.00 H new ATOM 0 HG CYS A 10 -7.977 -4.301 -4.702 1.00 0.00 H new ATOM 138 N ARG A 11 -13.136 -4.291 -4.578 1.00 0.00 N ATOM 139 CA ARG A 11 -14.090 -3.207 -4.807 1.00 0.00 C ATOM 140 C ARG A 11 -14.573 -2.627 -3.479 1.00 0.00 C ATOM 141 O ARG A 11 -14.506 -1.417 -3.264 1.00 0.00 O ATOM 142 CB ARG A 11 -15.287 -3.705 -5.622 1.00 0.00 C ATOM 143 CG ARG A 11 -15.222 -3.331 -7.095 1.00 0.00 C ATOM 144 CD ARG A 11 -16.540 -3.615 -7.799 1.00 0.00 C ATOM 145 NE ARG A 11 -16.522 -4.892 -8.511 1.00 0.00 N ATOM 146 CZ ARG A 11 -17.618 -5.524 -8.937 1.00 0.00 C ATOM 147 NH1 ARG A 11 -18.824 -5.004 -8.720 1.00 0.00 N ATOM 148 NH2 ARG A 11 -17.511 -6.681 -9.580 1.00 0.00 N ATOM 0 H ARG A 11 -13.425 -5.192 -4.959 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.582 -2.424 -5.370 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.349 -4.790 -5.534 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.202 -3.297 -5.193 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -14.976 -2.274 -7.193 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.421 -3.891 -7.579 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.347 -3.621 -7.067 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -16.754 -2.811 -8.503 1.00 0.00 H new ATOM 0 HE ARG A 11 -15.617 -5.326 -8.693 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -18.915 -4.117 -8.225 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -19.657 -5.493 -9.049 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -16.591 -7.087 -9.749 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -18.349 -7.163 -9.905 1.00 0.00 H new ATOM 162 N ALA A 12 -15.055 -3.503 -2.593 1.00 0.00 N ATOM 163 CA ALA A 12 -15.545 -3.084 -1.281 1.00 0.00 C ATOM 164 C ALA A 12 -14.503 -2.245 -0.547 1.00 0.00 C ATOM 165 O ALA A 12 -14.810 -1.171 -0.032 1.00 0.00 O ATOM 166 CB ALA A 12 -15.933 -4.297 -0.447 1.00 0.00 C ATOM 0 H ALA A 12 -15.116 -4.507 -2.763 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.430 -2.466 -1.433 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.296 -3.968 0.527 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.719 -4.854 -0.958 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.063 -4.939 -0.312 1.00 0.00 H new ATOM 172 N ALA A 13 -13.267 -2.742 -0.509 1.00 0.00 N ATOM 173 CA ALA A 13 -12.173 -2.038 0.158 1.00 0.00 C ATOM 174 C ALA A 13 -11.959 -0.642 -0.432 1.00 0.00 C ATOM 175 O ALA A 13 -11.640 0.299 0.295 1.00 0.00 O ATOM 176 CB ALA A 13 -10.891 -2.855 0.073 1.00 0.00 C ATOM 0 H ALA A 13 -12.998 -3.630 -0.933 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.446 -1.914 1.206 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.084 -2.319 0.574 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.042 -3.820 0.558 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.628 -3.012 -0.973 1.00 0.00 H new ATOM 182 N TYR A 14 -12.137 -0.517 -1.750 1.00 0.00 N ATOM 183 CA TYR A 14 -11.960 0.765 -2.433 1.00 0.00 C ATOM 184 C TYR A 14 -12.933 1.816 -1.900 1.00 0.00 C ATOM 185 O TYR A 14 -12.514 2.843 -1.361 1.00 0.00 O ATOM 186 CB TYR A 14 -12.153 0.600 -3.945 1.00 0.00 C ATOM 187 CG TYR A 14 -11.329 1.563 -4.775 1.00 0.00 C ATOM 188 CD1 TYR A 14 -11.339 2.927 -4.509 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.540 1.106 -5.824 1.00 0.00 C ATOM 190 CE1 TYR A 14 -10.589 3.807 -5.263 1.00 0.00 C ATOM 191 CE2 TYR A 14 -9.787 1.981 -6.583 1.00 0.00 C ATOM 192 CZ TYR A 14 -9.814 3.330 -6.298 1.00 0.00 C ATOM 193 OH TYR A 14 -9.064 4.204 -7.052 1.00 0.00 O ATOM 0 H TYR A 14 -12.403 -1.287 -2.363 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.943 1.106 -2.237 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.894 -0.421 -4.226 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.207 0.739 -4.185 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.944 3.305 -3.698 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -10.515 0.050 -6.049 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.609 4.864 -5.043 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.180 1.610 -7.396 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.233 4.416 -6.577 1.00 0.00 H new ATOM 203 N ASN A 15 -14.232 1.563 -2.061 1.00 0.00 N ATOM 204 CA ASN A 15 -15.257 2.496 -1.603 1.00 0.00 C ATOM 205 C ASN A 15 -15.213 2.682 -0.088 1.00 0.00 C ATOM 206 O ASN A 15 -15.495 3.771 0.414 1.00 0.00 O ATOM 207 CB ASN A 15 -16.649 2.030 -2.040 1.00 0.00 C ATOM 208 CG ASN A 15 -16.900 0.557 -1.768 1.00 0.00 C ATOM 209 OD1 ASN A 15 -17.022 0.139 -0.617 1.00 0.00 O ATOM 210 ND2 ASN A 15 -16.986 -0.234 -2.831 1.00 0.00 N ATOM 0 H ASN A 15 -14.597 0.720 -2.505 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.048 3.461 -2.065 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.403 2.622 -1.521 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -16.771 2.222 -3.106 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.160 -1.232 -2.711 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.878 0.156 -3.767 1.00 0.00 H new ATOM 217 N LEU A 16 -14.854 1.621 0.640 1.00 0.00 N ATOM 218 CA LEU A 16 -14.772 1.687 2.096 1.00 0.00 C ATOM 219 C LEU A 16 -13.741 2.724 2.535 1.00 0.00 C ATOM 220 O LEU A 16 -14.020 3.564 3.392 1.00 0.00 O ATOM 221 CB LEU A 16 -14.413 0.315 2.675 1.00 0.00 C ATOM 222 CG LEU A 16 -14.948 0.040 4.082 1.00 0.00 C ATOM 223 CD1 LEU A 16 -14.429 1.078 5.067 1.00 0.00 C ATOM 224 CD2 LEU A 16 -16.470 0.019 4.079 1.00 0.00 C ATOM 0 H LEU A 16 -14.617 0.711 0.244 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.749 1.986 2.476 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.792 -0.455 2.003 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.327 0.218 2.691 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.591 -0.940 4.399 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -14.821 0.864 6.061 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -13.340 1.044 5.091 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -14.754 2.070 4.755 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -16.833 -0.178 5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -16.847 0.984 3.740 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -16.822 -0.764 3.407 1.00 0.00 H new ATOM 236 N VAL A 17 -12.552 2.661 1.936 1.00 0.00 N ATOM 237 CA VAL A 17 -11.480 3.598 2.255 1.00 0.00 C ATOM 238 C VAL A 17 -11.781 4.985 1.683 1.00 0.00 C ATOM 239 O VAL A 17 -11.378 6.000 2.255 1.00 0.00 O ATOM 240 CB VAL A 17 -10.120 3.101 1.716 1.00 0.00 C ATOM 241 CG1 VAL A 17 -8.999 4.053 2.107 1.00 0.00 C ATOM 242 CG2 VAL A 17 -9.829 1.695 2.222 1.00 0.00 C ATOM 0 H VAL A 17 -12.309 1.969 1.227 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.421 3.664 3.341 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.175 3.074 0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.052 3.681 1.716 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.200 5.041 1.693 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.941 4.120 3.193 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -8.867 1.360 1.833 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.798 1.700 3.312 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.613 1.017 1.884 1.00 0.00 H new ATOM 252 N ARG A 18 -12.499 5.019 0.555 1.00 0.00 N ATOM 253 CA ARG A 18 -12.865 6.278 -0.091 1.00 0.00 C ATOM 254 C ARG A 18 -13.585 7.205 0.886 1.00 0.00 C ATOM 255 O ARG A 18 -13.393 8.421 0.852 1.00 0.00 O ATOM 256 CB ARG A 18 -13.753 6.017 -1.309 1.00 0.00 C ATOM 257 CG ARG A 18 -13.835 7.197 -2.265 1.00 0.00 C ATOM 258 CD ARG A 18 -13.814 6.745 -3.716 1.00 0.00 C ATOM 259 NE ARG A 18 -14.754 7.505 -4.539 1.00 0.00 N ATOM 260 CZ ARG A 18 -16.078 7.333 -4.516 1.00 0.00 C ATOM 261 NH1 ARG A 18 -16.625 6.419 -3.718 1.00 0.00 N ATOM 262 NH2 ARG A 18 -16.859 8.077 -5.292 1.00 0.00 N ATOM 0 H ARG A 18 -12.837 4.186 0.072 1.00 0.00 H new ATOM 0 HA ARG A 18 -11.946 6.765 -0.418 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.372 5.149 -1.847 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -14.757 5.765 -0.969 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -14.748 7.759 -2.072 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.000 7.873 -2.082 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -12.807 6.859 -4.117 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.060 5.685 -3.769 1.00 0.00 H new ATOM 0 HE ARG A 18 -14.375 8.211 -5.170 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -16.032 5.845 -3.119 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -17.637 6.293 -3.706 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.447 8.780 -5.906 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.870 7.945 -5.274 1.00 0.00 H new ATOM 276 N ASP A 19 -14.407 6.624 1.759 1.00 0.00 N ATOM 277 CA ASP A 19 -15.143 7.402 2.746 1.00 0.00 C ATOM 278 C ASP A 19 -14.215 7.870 3.859 1.00 0.00 C ATOM 279 O ASP A 19 -13.538 7.061 4.496 1.00 0.00 O ATOM 280 CB ASP A 19 -16.291 6.580 3.337 1.00 0.00 C ATOM 281 CG ASP A 19 -17.469 7.444 3.737 1.00 0.00 C ATOM 282 OD1 ASP A 19 -17.964 8.207 2.879 1.00 0.00 O ATOM 283 OD2 ASP A 19 -17.897 7.364 4.909 1.00 0.00 O ATOM 0 H ASP A 19 -14.578 5.619 1.800 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.560 8.275 2.244 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.618 5.839 2.607 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.932 6.033 4.209 1.00 0.00 H new ATOM 318 N ALA A 23 -12.967 5.081 10.787 1.00 0.00 N ATOM 319 CA ALA A 23 -11.618 4.864 11.300 1.00 0.00 C ATOM 320 C ALA A 23 -10.856 3.880 10.410 1.00 0.00 C ATOM 321 O ALA A 23 -10.405 2.826 10.867 1.00 0.00 O ATOM 322 CB ALA A 23 -11.673 4.364 12.738 1.00 0.00 C ATOM 0 HA ALA A 23 -11.084 5.814 11.288 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.660 4.207 13.107 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.176 5.103 13.361 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.223 3.424 12.775 1.00 0.00 H new ATOM 328 N VAL A 24 -10.729 4.231 9.130 1.00 0.00 N ATOM 329 CA VAL A 24 -10.043 3.387 8.160 1.00 0.00 C ATOM 330 C VAL A 24 -9.222 4.230 7.184 1.00 0.00 C ATOM 331 O VAL A 24 -9.773 4.859 6.278 1.00 0.00 O ATOM 332 CB VAL A 24 -11.051 2.529 7.365 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.330 1.608 6.394 1.00 0.00 C ATOM 334 CG2 VAL A 24 -11.938 1.726 8.309 1.00 0.00 C ATOM 0 H VAL A 24 -11.096 5.100 8.742 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.374 2.731 8.717 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.686 3.201 6.788 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.061 1.014 5.845 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.747 2.204 5.692 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.665 0.945 6.947 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.641 1.129 7.728 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.319 1.067 8.918 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.490 2.407 8.957 1.00 0.00 H new ATOM 344 N ILE A 25 -7.903 4.238 7.373 1.00 0.00 N ATOM 345 CA ILE A 25 -7.007 5.002 6.505 1.00 0.00 C ATOM 346 C ILE A 25 -6.182 4.083 5.599 1.00 0.00 C ATOM 347 O ILE A 25 -5.759 4.490 4.516 1.00 0.00 O ATOM 348 CB ILE A 25 -6.052 5.905 7.320 1.00 0.00 C ATOM 349 CG1 ILE A 25 -5.102 5.062 8.178 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.845 6.869 8.192 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.645 5.233 7.810 1.00 0.00 C ATOM 0 H ILE A 25 -7.432 3.725 8.118 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.644 5.633 5.885 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.452 6.485 6.619 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.238 5.329 9.226 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.372 4.011 8.080 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.157 7.497 8.759 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.474 7.497 7.561 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.472 6.304 8.881 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.030 4.607 8.457 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.495 4.938 6.771 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.358 6.277 7.936 1.00 0.00 H new ATOM 363 N TRP A 26 -5.957 2.845 6.047 1.00 0.00 N ATOM 364 CA TRP A 26 -5.186 1.877 5.272 1.00 0.00 C ATOM 365 C TRP A 26 -5.858 0.505 5.270 1.00 0.00 C ATOM 366 O TRP A 26 -6.647 0.186 6.162 1.00 0.00 O ATOM 367 CB TRP A 26 -3.758 1.761 5.827 1.00 0.00 C ATOM 368 CG TRP A 26 -3.683 1.157 7.203 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.445 1.819 8.372 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.840 -0.226 7.550 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.448 0.934 9.424 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.688 -0.325 8.945 1.00 0.00 C ATOM 373 CE3 TRP A 26 -4.095 -1.389 6.820 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.785 -1.539 9.621 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.191 -2.590 7.492 1.00 0.00 C ATOM 376 CH2 TRP A 26 -4.038 -2.657 8.878 1.00 0.00 C ATOM 0 H TRP A 26 -6.298 2.492 6.941 1.00 0.00 H new ATOM 0 HA TRP A 26 -5.142 2.236 4.244 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -3.162 1.157 5.143 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.307 2.753 5.852 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.279 2.883 8.458 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.296 1.177 10.403 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.215 -1.349 5.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.665 -1.594 10.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.388 -3.495 6.936 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.121 -3.613 9.373 1.00 0.00 H new ATOM 387 N VAL A 27 -5.524 -0.307 4.265 1.00 0.00 N ATOM 388 CA VAL A 27 -6.071 -1.655 4.140 1.00 0.00 C ATOM 389 C VAL A 27 -4.992 -2.621 3.653 1.00 0.00 C ATOM 390 O VAL A 27 -4.079 -2.217 2.931 1.00 0.00 O ATOM 391 CB VAL A 27 -7.270 -1.698 3.169 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.423 -0.861 3.702 1.00 0.00 C ATOM 393 CG2 VAL A 27 -6.864 -1.229 1.778 1.00 0.00 C ATOM 0 H VAL A 27 -4.873 -0.050 3.523 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.419 -1.956 5.128 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.603 -2.733 3.092 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.258 -0.905 3.003 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -8.739 -1.251 4.669 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.099 0.174 3.816 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.727 -1.269 1.114 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.496 -0.205 1.833 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -6.078 -1.877 1.391 1.00 0.00 H new ATOM 403 N THR A 28 -5.088 -3.890 4.046 1.00 0.00 N ATOM 404 CA THR A 28 -4.092 -4.880 3.625 1.00 0.00 C ATOM 405 C THR A 28 -4.587 -5.674 2.422 1.00 0.00 C ATOM 406 O THR A 28 -5.729 -5.523 1.994 1.00 0.00 O ATOM 407 CB THR A 28 -3.742 -5.841 4.770 1.00 0.00 C ATOM 408 OG1 THR A 28 -4.006 -5.257 6.030 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.289 -6.267 4.765 1.00 0.00 C ATOM 0 H THR A 28 -5.830 -4.255 4.644 1.00 0.00 H new ATOM 0 HA THR A 28 -3.192 -4.333 3.343 1.00 0.00 H new ATOM 0 HB THR A 28 -4.371 -6.716 4.606 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.291 -5.494 6.657 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.106 -6.945 5.598 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.062 -6.774 3.827 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.652 -5.388 4.866 1.00 0.00 H new ATOM 417 N PHE A 29 -3.718 -6.527 1.887 1.00 0.00 N ATOM 418 CA PHE A 29 -4.058 -7.364 0.742 1.00 0.00 C ATOM 419 C PHE A 29 -3.285 -8.677 0.802 1.00 0.00 C ATOM 420 O PHE A 29 -2.127 -8.749 0.385 1.00 0.00 O ATOM 421 CB PHE A 29 -3.766 -6.633 -0.570 1.00 0.00 C ATOM 422 CG PHE A 29 -4.993 -6.049 -1.208 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.552 -4.878 -0.721 1.00 0.00 C ATOM 424 CD2 PHE A 29 -5.591 -6.674 -2.290 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.684 -4.340 -1.301 1.00 0.00 C ATOM 426 CE2 PHE A 29 -6.723 -6.142 -2.876 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.271 -4.973 -2.381 1.00 0.00 C ATOM 0 H PHE A 29 -2.767 -6.657 2.232 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.125 -7.582 0.780 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.048 -5.835 -0.382 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.297 -7.326 -1.268 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -5.097 -4.380 0.122 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.167 -7.588 -2.680 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.110 -3.427 -0.912 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.179 -6.638 -3.720 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.156 -4.555 -2.837 1.00 0.00 H new ATOM 437 N LYS A 30 -3.929 -9.708 1.341 1.00 0.00 N ATOM 438 CA LYS A 30 -3.301 -11.020 1.477 1.00 0.00 C ATOM 439 C LYS A 30 -3.805 -11.993 0.412 1.00 0.00 C ATOM 440 O LYS A 30 -4.702 -11.671 -0.368 1.00 0.00 O ATOM 441 CB LYS A 30 -3.564 -11.591 2.874 1.00 0.00 C ATOM 442 CG LYS A 30 -5.039 -11.821 3.181 1.00 0.00 C ATOM 443 CD LYS A 30 -5.519 -10.923 4.310 1.00 0.00 C ATOM 444 CE LYS A 30 -7.004 -11.110 4.584 1.00 0.00 C ATOM 445 NZ LYS A 30 -7.376 -10.680 5.962 1.00 0.00 N ATOM 0 H LYS A 30 -4.886 -9.661 1.691 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.228 -10.892 1.337 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -3.030 -12.536 2.976 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.150 -10.910 3.618 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.632 -11.631 2.286 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.197 -12.865 3.452 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -4.952 -11.141 5.215 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -5.324 -9.881 4.055 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -7.582 -10.538 3.858 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.269 -12.159 4.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -8.412 -10.679 6.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -6.965 -11.338 6.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -7.012 -9.722 6.137 1.00 0.00 H new ATOM 459 N TYR A 31 -3.215 -13.187 0.395 1.00 0.00 N ATOM 460 CA TYR A 31 -3.592 -14.219 -0.562 1.00 0.00 C ATOM 461 C TYR A 31 -4.438 -15.298 0.106 1.00 0.00 C ATOM 462 O TYR A 31 -3.992 -15.954 1.050 1.00 0.00 O ATOM 463 CB TYR A 31 -2.344 -14.853 -1.180 1.00 0.00 C ATOM 464 CG TYR A 31 -2.080 -14.415 -2.601 1.00 0.00 C ATOM 465 CD1 TYR A 31 -2.968 -14.733 -3.620 1.00 0.00 C ATOM 466 CD2 TYR A 31 -0.941 -13.691 -2.923 1.00 0.00 C ATOM 467 CE1 TYR A 31 -2.728 -14.338 -4.922 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.694 -13.294 -4.223 1.00 0.00 C ATOM 469 CZ TYR A 31 -1.590 -13.620 -5.217 1.00 0.00 C ATOM 470 OH TYR A 31 -1.345 -13.231 -6.512 1.00 0.00 O ATOM 0 H TYR A 31 -2.471 -13.462 1.037 1.00 0.00 H new ATOM 0 HA TYR A 31 -4.183 -13.749 -1.348 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -1.479 -14.604 -0.566 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -2.449 -15.938 -1.157 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.860 -15.298 -3.391 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -0.237 -13.434 -2.146 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -3.429 -14.591 -5.704 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.197 -12.731 -4.459 1.00 0.00 H new ATOM 0 HH TYR A 31 -1.216 -12.260 -6.543 1.00 0.00 H new ATOM 480 N ASP A 32 -5.653 -15.485 -0.398 1.00 0.00 N ATOM 481 CA ASP A 32 -6.557 -16.492 0.140 1.00 0.00 C ATOM 482 C ASP A 32 -6.583 -17.717 -0.770 1.00 0.00 C ATOM 483 O ASP A 32 -7.385 -17.795 -1.704 1.00 0.00 O ATOM 484 CB ASP A 32 -7.964 -15.912 0.302 1.00 0.00 C ATOM 485 CG ASP A 32 -8.122 -15.140 1.599 1.00 0.00 C ATOM 486 OD1 ASP A 32 -8.222 -15.786 2.664 1.00 0.00 O ATOM 487 OD2 ASP A 32 -8.141 -13.892 1.549 1.00 0.00 O ATOM 0 H ASP A 32 -6.034 -14.951 -1.179 1.00 0.00 H new ATOM 0 HA ASP A 32 -6.197 -16.798 1.122 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.183 -15.254 -0.539 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.694 -16.721 0.272 1.00 0.00 H new ATOM 492 N GLY A 33 -5.686 -18.666 -0.501 1.00 0.00 N ATOM 493 CA GLY A 33 -5.609 -19.873 -1.308 1.00 0.00 C ATOM 494 C GLY A 33 -4.905 -19.633 -2.630 1.00 0.00 C ATOM 495 O GLY A 33 -3.725 -19.951 -2.777 1.00 0.00 O ATOM 0 H GLY A 33 -5.011 -18.619 0.262 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.080 -20.647 -0.752 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.615 -20.247 -1.497 1.00 0.00 H new ATOM 499 N SER A 34 -5.631 -19.065 -3.591 1.00 0.00 N ATOM 500 CA SER A 34 -5.070 -18.773 -4.907 1.00 0.00 C ATOM 501 C SER A 34 -5.658 -17.484 -5.486 1.00 0.00 C ATOM 502 O SER A 34 -5.805 -17.348 -6.704 1.00 0.00 O ATOM 503 CB SER A 34 -5.319 -19.946 -5.861 1.00 0.00 C ATOM 504 OG SER A 34 -4.137 -20.294 -6.561 1.00 0.00 O ATOM 0 H SER A 34 -6.609 -18.798 -3.482 1.00 0.00 H new ATOM 0 HA SER A 34 -3.995 -18.631 -4.792 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.679 -20.807 -5.298 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.102 -19.681 -6.572 1.00 0.00 H new ATOM 0 HG SER A 34 -4.322 -21.046 -7.162 1.00 0.00 H new ATOM 510 N THR A 35 -5.988 -16.539 -4.607 1.00 0.00 N ATOM 511 CA THR A 35 -6.555 -15.260 -5.026 1.00 0.00 C ATOM 512 C THR A 35 -6.260 -14.175 -3.992 1.00 0.00 C ATOM 513 O THR A 35 -6.164 -14.456 -2.797 1.00 0.00 O ATOM 514 CB THR A 35 -8.066 -15.389 -5.248 1.00 0.00 C ATOM 515 OG1 THR A 35 -8.643 -14.127 -5.546 1.00 0.00 O ATOM 516 CG2 THR A 35 -8.806 -15.975 -4.060 1.00 0.00 C ATOM 0 H THR A 35 -5.872 -16.636 -3.598 1.00 0.00 H new ATOM 0 HA THR A 35 -6.089 -14.973 -5.969 1.00 0.00 H new ATOM 0 HB THR A 35 -8.173 -16.076 -6.088 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.110 -13.678 -6.235 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.870 -16.037 -4.288 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.422 -16.973 -3.848 1.00 0.00 H new ATOM 0 HG23 THR A 35 -8.658 -15.337 -3.189 1.00 0.00 H new ATOM 524 N ILE A 36 -6.119 -12.937 -4.459 1.00 0.00 N ATOM 525 CA ILE A 36 -5.835 -11.814 -3.569 1.00 0.00 C ATOM 526 C ILE A 36 -7.121 -11.168 -3.068 1.00 0.00 C ATOM 527 O ILE A 36 -8.059 -10.942 -3.837 1.00 0.00 O ATOM 528 CB ILE A 36 -4.955 -10.739 -4.246 1.00 0.00 C ATOM 529 CG1 ILE A 36 -5.387 -10.511 -5.697 1.00 0.00 C ATOM 530 CG2 ILE A 36 -3.491 -11.146 -4.186 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.686 -9.347 -6.364 1.00 0.00 C ATOM 0 H ILE A 36 -6.196 -12.686 -5.445 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.284 -12.226 -2.724 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.083 -9.802 -3.705 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.194 -11.417 -6.271 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.463 -10.340 -5.724 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -2.881 -10.381 -4.666 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.186 -11.254 -3.145 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.356 -12.096 -4.704 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -5.043 -9.247 -7.389 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.899 -8.430 -5.814 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.611 -9.525 -6.370 1.00 0.00 H new ATOM 543 N VAL A 37 -7.155 -10.883 -1.769 1.00 0.00 N ATOM 544 CA VAL A 37 -8.318 -10.270 -1.137 1.00 0.00 C ATOM 545 C VAL A 37 -7.883 -9.257 -0.077 1.00 0.00 C ATOM 546 O VAL A 37 -6.938 -9.507 0.675 1.00 0.00 O ATOM 547 CB VAL A 37 -9.218 -11.343 -0.486 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.479 -10.722 0.093 1.00 0.00 C ATOM 549 CG2 VAL A 37 -9.569 -12.429 -1.494 1.00 0.00 C ATOM 0 H VAL A 37 -6.383 -11.069 -1.129 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.886 -9.755 -1.912 1.00 0.00 H new ATOM 0 HB VAL A 37 -8.661 -11.798 0.333 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -11.094 -11.501 0.545 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.208 -9.988 0.852 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -11.041 -10.232 -0.702 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -10.204 -13.176 -1.018 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -10.100 -11.986 -2.336 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -8.655 -12.903 -1.851 1.00 0.00 H new ATOM 559 N PRO A 38 -8.568 -8.096 0.006 1.00 0.00 N ATOM 560 CA PRO A 38 -8.243 -7.054 0.988 1.00 0.00 C ATOM 561 C PRO A 38 -8.148 -7.608 2.410 1.00 0.00 C ATOM 562 O PRO A 38 -8.772 -8.622 2.732 1.00 0.00 O ATOM 563 CB PRO A 38 -9.405 -6.053 0.871 1.00 0.00 C ATOM 564 CG PRO A 38 -10.446 -6.742 0.051 1.00 0.00 C ATOM 565 CD PRO A 38 -9.709 -7.705 -0.834 1.00 0.00 C ATOM 0 HA PRO A 38 -7.269 -6.606 0.791 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.793 -5.786 1.854 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.079 -5.128 0.395 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.160 -7.265 0.687 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.013 -6.024 -0.541 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.326 -8.562 -1.105 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.387 -7.237 -1.764 1.00 0.00 H new ATOM 573 N GLY A 39 -7.359 -6.944 3.251 1.00 0.00 N ATOM 574 CA GLY A 39 -7.183 -7.379 4.614 1.00 0.00 C ATOM 575 C GLY A 39 -7.475 -6.285 5.617 1.00 0.00 C ATOM 576 O GLY A 39 -8.257 -5.375 5.344 1.00 0.00 O ATOM 0 H GLY A 39 -6.836 -6.104 3.003 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.838 -8.228 4.808 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.159 -7.728 4.751 1.00 0.00 H new ATOM 580 N GLU A 40 -6.834 -6.391 6.776 1.00 0.00 N ATOM 581 CA GLU A 40 -6.994 -5.441 7.880 1.00 0.00 C ATOM 582 C GLU A 40 -7.226 -4.013 7.398 1.00 0.00 C ATOM 583 O GLU A 40 -6.603 -3.557 6.441 1.00 0.00 O ATOM 584 CB GLU A 40 -5.768 -5.487 8.797 1.00 0.00 C ATOM 585 CG GLU A 40 -5.810 -6.609 9.825 1.00 0.00 C ATOM 586 CD GLU A 40 -5.841 -7.988 9.189 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.767 -8.483 8.788 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.943 -8.570 9.087 1.00 0.00 O ATOM 0 H GLU A 40 -6.180 -7.147 6.981 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.883 -5.744 8.433 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.873 -5.601 8.186 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.679 -4.533 9.317 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.938 -6.533 10.475 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.690 -6.485 10.456 1.00 0.00 H new ATOM 595 N GLN A 41 -8.132 -3.322 8.082 1.00 0.00 N ATOM 596 CA GLN A 41 -8.471 -1.938 7.754 1.00 0.00 C ATOM 597 C GLN A 41 -8.524 -1.092 9.025 1.00 0.00 C ATOM 598 O GLN A 41 -9.547 -1.048 9.710 1.00 0.00 O ATOM 599 CB GLN A 41 -9.818 -1.875 7.023 1.00 0.00 C ATOM 600 CG GLN A 41 -10.042 -3.018 6.042 1.00 0.00 C ATOM 601 CD GLN A 41 -11.445 -3.028 5.466 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.287 -3.829 5.871 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.706 -2.137 4.514 1.00 0.00 N ATOM 0 H GLN A 41 -8.650 -3.701 8.875 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.699 -1.539 7.096 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.621 -1.879 7.760 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.884 -0.929 6.485 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.320 -2.940 5.229 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.854 -3.966 6.546 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.979 -1.491 4.207 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.633 -2.100 4.091 1.00 0.00 H new ATOM 612 N GLY A 42 -7.410 -0.432 9.343 1.00 0.00 N ATOM 613 CA GLY A 42 -7.348 0.389 10.541 1.00 0.00 C ATOM 614 C GLY A 42 -6.835 1.791 10.281 1.00 0.00 C ATOM 615 O GLY A 42 -6.265 2.072 9.224 1.00 0.00 O ATOM 0 H GLY A 42 -6.551 -0.452 8.793 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.342 0.450 10.983 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.703 -0.097 11.273 1.00 0.00 H new ATOM 619 N ALA A 43 -7.034 2.670 11.260 1.00 0.00 N ATOM 620 CA ALA A 43 -6.586 4.053 11.161 1.00 0.00 C ATOM 621 C ALA A 43 -5.170 4.211 11.719 1.00 0.00 C ATOM 622 O ALA A 43 -4.478 5.181 11.407 1.00 0.00 O ATOM 623 CB ALA A 43 -7.551 4.976 11.893 1.00 0.00 C ATOM 0 H ALA A 43 -7.506 2.445 12.136 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.568 4.330 10.107 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.203 6.006 11.810 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.543 4.891 11.449 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.599 4.693 12.944 1.00 0.00 H new ATOM 629 N GLU A 44 -4.744 3.251 12.545 1.00 0.00 N ATOM 630 CA GLU A 44 -3.412 3.285 13.140 1.00 0.00 C ATOM 631 C GLU A 44 -2.420 2.490 12.293 1.00 0.00 C ATOM 632 O GLU A 44 -2.654 1.320 11.983 1.00 0.00 O ATOM 633 CB GLU A 44 -3.447 2.731 14.570 1.00 0.00 C ATOM 634 CG GLU A 44 -3.816 1.256 14.652 1.00 0.00 C ATOM 635 CD GLU A 44 -4.864 0.974 15.709 1.00 0.00 C ATOM 636 OE1 GLU A 44 -6.068 1.044 15.386 1.00 0.00 O ATOM 637 OE2 GLU A 44 -4.480 0.683 16.861 1.00 0.00 O ATOM 0 H GLU A 44 -5.305 2.443 12.815 1.00 0.00 H new ATOM 0 HA GLU A 44 -3.083 4.324 13.174 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.469 2.877 15.030 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.163 3.308 15.155 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.185 0.924 13.682 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.921 0.673 14.869 1.00 0.00 H new ATOM 644 N TYR A 45 -1.316 3.131 11.916 1.00 0.00 N ATOM 645 CA TYR A 45 -0.294 2.479 11.099 1.00 0.00 C ATOM 646 C TYR A 45 0.527 1.470 11.909 1.00 0.00 C ATOM 647 O TYR A 45 1.209 0.621 11.332 1.00 0.00 O ATOM 648 CB TYR A 45 0.636 3.518 10.474 1.00 0.00 C ATOM 649 CG TYR A 45 1.508 2.957 9.372 1.00 0.00 C ATOM 650 CD1 TYR A 45 1.002 2.757 8.094 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.835 2.628 9.611 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.795 2.246 7.086 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.635 2.116 8.609 1.00 0.00 C ATOM 654 CZ TYR A 45 3.112 1.929 7.348 1.00 0.00 C ATOM 655 OH TYR A 45 3.907 1.419 6.347 1.00 0.00 O ATOM 0 H TYR A 45 -1.106 4.098 12.162 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.812 1.935 10.309 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.038 4.336 10.073 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.272 3.940 11.252 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.028 3.005 7.886 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.249 2.775 10.598 1.00 0.00 H new ATOM 0 HE1 TYR A 45 1.387 2.095 6.098 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.665 1.863 8.812 1.00 0.00 H new ATOM 0 HH TYR A 45 3.564 0.543 6.071 1.00 0.00 H new ATOM 665 N GLN A 46 0.463 1.559 13.241 1.00 0.00 N ATOM 666 CA GLN A 46 1.206 0.642 14.107 1.00 0.00 C ATOM 667 C GLN A 46 0.945 -0.813 13.718 1.00 0.00 C ATOM 668 O GLN A 46 1.866 -1.633 13.696 1.00 0.00 O ATOM 669 CB GLN A 46 0.831 0.870 15.574 1.00 0.00 C ATOM 670 CG GLN A 46 2.001 1.303 16.444 1.00 0.00 C ATOM 671 CD GLN A 46 2.607 2.620 15.996 1.00 0.00 C ATOM 672 OE1 GLN A 46 2.090 3.692 16.311 1.00 0.00 O ATOM 673 NE2 GLN A 46 3.710 2.549 15.256 1.00 0.00 N ATOM 0 H GLN A 46 -0.093 2.253 13.740 1.00 0.00 H new ATOM 0 HA GLN A 46 2.269 0.845 13.978 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.050 1.629 15.627 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.409 -0.050 15.979 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.666 1.395 17.477 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.769 0.529 16.425 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.106 1.640 15.017 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.160 3.404 14.927 1.00 0.00 H new ATOM 682 N HIS A 47 -0.314 -1.121 13.404 1.00 0.00 N ATOM 683 CA HIS A 47 -0.699 -2.472 13.005 1.00 0.00 C ATOM 684 C HIS A 47 -0.119 -2.832 11.636 1.00 0.00 C ATOM 685 O HIS A 47 0.152 -4.002 11.361 1.00 0.00 O ATOM 686 CB HIS A 47 -2.224 -2.603 12.973 1.00 0.00 C ATOM 687 CG HIS A 47 -2.829 -2.976 14.294 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.106 -3.034 15.469 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.100 -3.311 14.621 1.00 0.00 C ATOM 690 CE1 HIS A 47 -2.906 -3.387 16.459 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.119 -3.561 15.971 1.00 0.00 N ATOM 0 H HIS A 47 -1.084 -0.452 13.419 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.294 -3.165 13.742 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.653 -1.658 12.642 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.499 -3.355 12.233 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.941 -3.370 13.946 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.616 -3.512 17.492 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.940 -3.837 16.510 1.00 0.00 H new ATOM 700 N PHE A 48 0.074 -1.823 10.783 1.00 0.00 N ATOM 701 CA PHE A 48 0.626 -2.041 9.451 1.00 0.00 C ATOM 702 C PHE A 48 2.051 -2.585 9.536 1.00 0.00 C ATOM 703 O PHE A 48 2.405 -3.533 8.835 1.00 0.00 O ATOM 704 CB PHE A 48 0.609 -0.737 8.652 1.00 0.00 C ATOM 705 CG PHE A 48 0.866 -0.932 7.187 1.00 0.00 C ATOM 706 CD1 PHE A 48 2.162 -1.014 6.704 1.00 0.00 C ATOM 707 CD2 PHE A 48 -0.187 -1.038 6.295 1.00 0.00 C ATOM 708 CE1 PHE A 48 2.402 -1.196 5.356 1.00 0.00 C ATOM 709 CE2 PHE A 48 0.047 -1.222 4.947 1.00 0.00 C ATOM 710 CZ PHE A 48 1.344 -1.300 4.477 1.00 0.00 C ATOM 0 H PHE A 48 -0.145 -0.849 10.994 1.00 0.00 H new ATOM 0 HA PHE A 48 0.006 -2.778 8.941 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.359 -0.253 8.782 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.361 -0.061 9.058 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.993 -0.935 7.389 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.202 -0.976 6.657 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.417 -1.257 4.991 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.783 -1.305 4.261 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.529 -1.442 3.423 1.00 0.00 H new ATOM 720 N ILE A 49 2.860 -1.978 10.404 1.00 0.00 N ATOM 721 CA ILE A 49 4.248 -2.396 10.593 1.00 0.00 C ATOM 722 C ILE A 49 4.323 -3.765 11.267 1.00 0.00 C ATOM 723 O ILE A 49 5.125 -4.615 10.874 1.00 0.00 O ATOM 724 CB ILE A 49 5.036 -1.376 11.445 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.809 0.050 10.932 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.522 -1.710 11.441 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.573 1.057 12.036 1.00 0.00 C ATOM 0 H ILE A 49 2.576 -1.192 10.989 1.00 0.00 H new ATOM 0 HA ILE A 49 4.696 -2.453 9.601 1.00 0.00 H new ATOM 0 HB ILE A 49 4.670 -1.435 12.470 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.675 0.360 10.347 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.952 0.053 10.258 1.00 0.00 H new ATOM 0 HG21 ILE A 49 7.060 -0.981 12.046 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.672 -2.707 11.855 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.899 -1.682 10.418 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.420 2.045 11.601 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.689 0.771 12.607 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.439 1.082 12.697 1.00 0.00 H new ATOM 739 N GLN A 50 3.486 -3.966 12.286 1.00 0.00 N ATOM 740 CA GLN A 50 3.452 -5.227 13.026 1.00 0.00 C ATOM 741 C GLN A 50 3.221 -6.416 12.095 1.00 0.00 C ATOM 742 O GLN A 50 3.917 -7.429 12.187 1.00 0.00 O ATOM 743 CB GLN A 50 2.356 -5.183 14.094 1.00 0.00 C ATOM 744 CG GLN A 50 2.861 -4.772 15.468 1.00 0.00 C ATOM 745 CD GLN A 50 2.091 -5.436 16.592 1.00 0.00 C ATOM 746 OE1 GLN A 50 2.237 -6.634 16.834 1.00 0.00 O ATOM 747 NE2 GLN A 50 1.264 -4.663 17.287 1.00 0.00 N ATOM 0 H GLN A 50 2.820 -3.268 12.618 1.00 0.00 H new ATOM 0 HA GLN A 50 4.422 -5.357 13.506 1.00 0.00 H new ATOM 0 HB2 GLN A 50 1.580 -4.486 13.778 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.891 -6.166 14.166 1.00 0.00 H new ATOM 0 HG2 GLN A 50 3.917 -5.028 15.555 1.00 0.00 H new ATOM 0 HG3 GLN A 50 2.786 -3.689 15.570 1.00 0.00 H new ATOM 0 HE21 GLN A 50 1.173 -3.674 17.053 1.00 0.00 H new ATOM 0 HE22 GLN A 50 0.720 -5.058 18.054 1.00 0.00 H new ATOM 756 N GLN A 51 2.240 -6.287 11.203 1.00 0.00 N ATOM 757 CA GLN A 51 1.916 -7.353 10.257 1.00 0.00 C ATOM 758 C GLN A 51 2.938 -7.424 9.122 1.00 0.00 C ATOM 759 O GLN A 51 3.233 -8.507 8.614 1.00 0.00 O ATOM 760 CB GLN A 51 0.511 -7.147 9.685 1.00 0.00 C ATOM 761 CG GLN A 51 -0.568 -7.932 10.415 1.00 0.00 C ATOM 762 CD GLN A 51 -0.631 -7.604 11.896 1.00 0.00 C ATOM 763 OE1 GLN A 51 -0.200 -8.395 12.735 1.00 0.00 O ATOM 764 NE2 GLN A 51 -1.168 -6.434 12.226 1.00 0.00 N ATOM 0 H GLN A 51 1.656 -5.455 11.116 1.00 0.00 H new ATOM 0 HA GLN A 51 1.948 -8.298 10.799 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.265 -6.086 9.724 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.510 -7.436 8.634 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.536 -7.722 9.959 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -0.382 -8.999 10.291 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -1.513 -5.808 11.498 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.235 -6.162 13.207 1.00 0.00 H new ATOM 773 N CYS A 52 3.471 -6.265 8.723 1.00 0.00 N ATOM 774 CA CYS A 52 4.454 -6.201 7.641 1.00 0.00 C ATOM 775 C CYS A 52 5.813 -6.746 8.090 1.00 0.00 C ATOM 776 O CYS A 52 6.718 -5.983 8.432 1.00 0.00 O ATOM 777 CB CYS A 52 4.607 -4.760 7.141 1.00 0.00 C ATOM 778 SG CYS A 52 3.487 -4.324 5.791 1.00 0.00 S ATOM 0 H CYS A 52 3.238 -5.361 9.133 1.00 0.00 H new ATOM 0 HA CYS A 52 4.090 -6.825 6.825 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.437 -4.078 7.974 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.634 -4.609 6.810 1.00 0.00 H new ATOM 0 HG CYS A 52 3.033 -3.120 5.976 1.00 0.00 H new ATOM 784 N THR A 53 5.945 -8.071 8.078 1.00 0.00 N ATOM 785 CA THR A 53 7.189 -8.728 8.475 1.00 0.00 C ATOM 786 C THR A 53 7.909 -9.296 7.254 1.00 0.00 C ATOM 787 O THR A 53 7.270 -9.754 6.304 1.00 0.00 O ATOM 788 CB THR A 53 6.910 -9.845 9.485 1.00 0.00 C ATOM 789 OG1 THR A 53 5.847 -10.674 9.043 1.00 0.00 O ATOM 790 CG2 THR A 53 6.553 -9.326 10.863 1.00 0.00 C ATOM 0 H THR A 53 5.203 -8.712 7.797 1.00 0.00 H new ATOM 0 HA THR A 53 7.831 -7.983 8.945 1.00 0.00 H new ATOM 0 HB THR A 53 7.840 -10.410 9.556 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.688 -11.381 9.703 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.367 -10.167 11.532 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.378 -8.729 11.252 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.657 -8.709 10.798 1.00 0.00 H new ATOM 798 N ASP A 54 9.240 -9.256 7.281 1.00 0.00 N ATOM 799 CA ASP A 54 10.051 -9.758 6.174 1.00 0.00 C ATOM 800 C ASP A 54 10.060 -11.290 6.139 1.00 0.00 C ATOM 801 O ASP A 54 11.098 -11.920 6.349 1.00 0.00 O ATOM 802 CB ASP A 54 11.485 -9.223 6.285 1.00 0.00 C ATOM 803 CG ASP A 54 12.047 -9.328 7.693 1.00 0.00 C ATOM 804 OD1 ASP A 54 11.652 -8.510 8.553 1.00 0.00 O ATOM 805 OD2 ASP A 54 12.878 -10.227 7.936 1.00 0.00 O ATOM 0 H ASP A 54 9.781 -8.880 8.060 1.00 0.00 H new ATOM 0 HA ASP A 54 9.607 -9.404 5.244 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.128 -9.776 5.600 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.504 -8.180 5.968 1.00 0.00 H new ATOM 810 N ASP A 55 8.898 -11.884 5.872 1.00 0.00 N ATOM 811 CA ASP A 55 8.783 -13.338 5.813 1.00 0.00 C ATOM 812 C ASP A 55 7.567 -13.770 4.987 1.00 0.00 C ATOM 813 O ASP A 55 6.889 -14.734 5.340 1.00 0.00 O ATOM 814 CB ASP A 55 8.682 -13.913 7.230 1.00 0.00 C ATOM 815 CG ASP A 55 9.493 -15.182 7.402 1.00 0.00 C ATOM 816 OD1 ASP A 55 9.037 -16.246 6.934 1.00 0.00 O ATOM 817 OD2 ASP A 55 10.584 -15.110 8.003 1.00 0.00 O ATOM 0 H ASP A 55 8.028 -11.383 5.694 1.00 0.00 H new ATOM 0 HA ASP A 55 9.677 -13.726 5.325 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.025 -13.167 7.947 1.00 0.00 H new ATOM 0 HB3 ASP A 55 7.637 -14.120 7.461 1.00 0.00 H new ATOM 822 N VAL A 56 7.308 -13.049 3.887 1.00 0.00 N ATOM 823 CA VAL A 56 6.175 -13.327 2.987 1.00 0.00 C ATOM 824 C VAL A 56 5.882 -12.112 2.111 1.00 0.00 C ATOM 825 O VAL A 56 6.317 -11.001 2.413 1.00 0.00 O ATOM 826 CB VAL A 56 4.861 -13.683 3.733 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.728 -15.187 3.927 1.00 0.00 C ATOM 828 CG2 VAL A 56 4.759 -12.942 5.062 1.00 0.00 C ATOM 0 H VAL A 56 7.878 -12.255 3.594 1.00 0.00 H new ATOM 0 HA VAL A 56 6.483 -14.190 2.396 1.00 0.00 H new ATOM 0 HB VAL A 56 4.029 -13.355 3.110 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.798 -15.405 4.452 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.720 -15.680 2.955 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.571 -15.554 4.513 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.828 -13.213 5.559 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.602 -13.215 5.697 1.00 0.00 H new ATOM 0 HG23 VAL A 56 4.774 -11.867 4.881 1.00 0.00 H new ATOM 838 N ARG A 57 5.123 -12.328 1.041 1.00 0.00 N ATOM 839 CA ARG A 57 4.754 -11.245 0.135 1.00 0.00 C ATOM 840 C ARG A 57 3.276 -10.893 0.297 1.00 0.00 C ATOM 841 O ARG A 57 2.407 -11.760 0.176 1.00 0.00 O ATOM 842 CB ARG A 57 5.045 -11.634 -1.319 1.00 0.00 C ATOM 843 CG ARG A 57 4.317 -12.891 -1.779 1.00 0.00 C ATOM 844 CD ARG A 57 3.386 -12.600 -2.946 1.00 0.00 C ATOM 845 NE ARG A 57 2.191 -11.864 -2.528 1.00 0.00 N ATOM 846 CZ ARG A 57 1.486 -11.064 -3.332 1.00 0.00 C ATOM 847 NH1 ARG A 57 1.848 -10.894 -4.600 1.00 0.00 N ATOM 848 NH2 ARG A 57 0.412 -10.437 -2.868 1.00 0.00 N ATOM 0 H ARG A 57 4.752 -13.242 0.780 1.00 0.00 H new ATOM 0 HA ARG A 57 5.353 -10.371 0.388 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.765 -10.805 -1.970 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.118 -11.784 -1.437 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.045 -13.647 -2.073 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.744 -13.305 -0.949 1.00 0.00 H new ATOM 0 HD2 ARG A 57 3.921 -12.023 -3.701 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.088 -13.538 -3.414 1.00 0.00 H new ATOM 0 HE ARG A 57 1.878 -11.969 -1.563 1.00 0.00 H new ATOM 0 HH11 ARG A 57 2.669 -11.376 -4.965 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.304 -10.281 -5.208 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.125 -10.566 -1.898 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.127 -9.826 -3.482 1.00 0.00 H new ATOM 862 N LEU A 58 2.997 -9.623 0.574 1.00 0.00 N ATOM 863 CA LEU A 58 1.621 -9.166 0.754 1.00 0.00 C ATOM 864 C LEU A 58 1.456 -7.722 0.286 1.00 0.00 C ATOM 865 O LEU A 58 2.366 -6.903 0.432 1.00 0.00 O ATOM 866 CB LEU A 58 1.199 -9.296 2.221 1.00 0.00 C ATOM 867 CG LEU A 58 2.037 -8.489 3.217 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.288 -7.241 3.657 1.00 0.00 C ATOM 869 CD2 LEU A 58 2.402 -9.345 4.421 1.00 0.00 C ATOM 0 H LEU A 58 3.702 -8.893 0.679 1.00 0.00 H new ATOM 0 HA LEU A 58 0.976 -9.799 0.144 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.158 -8.985 2.311 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.243 -10.348 2.503 1.00 0.00 H new ATOM 0 HG LEU A 58 2.958 -8.180 2.722 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.899 -6.680 4.364 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.076 -6.618 2.788 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.351 -7.528 4.135 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.997 -8.756 5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.492 -9.683 4.916 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.979 -10.209 4.092 1.00 0.00 H new ATOM 881 N PHE A 59 0.288 -7.419 -0.272 1.00 0.00 N ATOM 882 CA PHE A 59 -0.002 -6.074 -0.760 1.00 0.00 C ATOM 883 C PHE A 59 -0.644 -5.223 0.333 1.00 0.00 C ATOM 884 O PHE A 59 -1.077 -5.741 1.364 1.00 0.00 O ATOM 885 CB PHE A 59 -0.924 -6.137 -1.981 1.00 0.00 C ATOM 886 CG PHE A 59 -0.192 -6.080 -3.291 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.736 -7.053 -3.624 1.00 0.00 C ATOM 888 CD2 PHE A 59 -0.431 -5.052 -4.191 1.00 0.00 C ATOM 889 CE1 PHE A 59 1.413 -7.004 -4.827 1.00 0.00 C ATOM 890 CE2 PHE A 59 0.242 -4.999 -5.396 1.00 0.00 C ATOM 891 CZ PHE A 59 1.166 -5.976 -5.714 1.00 0.00 C ATOM 0 H PHE A 59 -0.473 -8.086 -0.398 1.00 0.00 H new ATOM 0 HA PHE A 59 0.941 -5.610 -1.049 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.506 -7.058 -1.939 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.632 -5.310 -1.934 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.933 -7.860 -2.934 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.151 -4.285 -3.947 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.135 -7.769 -5.073 1.00 0.00 H new ATOM 0 HE2 PHE A 59 0.046 -4.194 -6.089 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.694 -5.935 -6.655 1.00 0.00 H new ATOM 901 N ALA A 60 -0.698 -3.914 0.097 1.00 0.00 N ATOM 902 CA ALA A 60 -1.284 -2.984 1.055 1.00 0.00 C ATOM 903 C ALA A 60 -1.810 -1.732 0.356 1.00 0.00 C ATOM 904 O ALA A 60 -1.596 -1.542 -0.843 1.00 0.00 O ATOM 905 CB ALA A 60 -0.265 -2.612 2.122 1.00 0.00 C ATOM 0 H ALA A 60 -0.342 -3.474 -0.752 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.128 -3.479 1.535 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.717 -1.917 2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.054 -3.511 2.649 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.598 -2.141 1.652 1.00 0.00 H new ATOM 911 N PHE A 61 -2.507 -0.887 1.114 1.00 0.00 N ATOM 912 CA PHE A 61 -3.078 0.341 0.572 1.00 0.00 C ATOM 913 C PHE A 61 -3.205 1.409 1.656 1.00 0.00 C ATOM 914 O PHE A 61 -3.596 1.113 2.786 1.00 0.00 O ATOM 915 CB PHE A 61 -4.453 0.048 -0.033 1.00 0.00 C ATOM 916 CG PHE A 61 -4.747 0.824 -1.286 1.00 0.00 C ATOM 917 CD1 PHE A 61 -5.256 2.112 -1.215 1.00 0.00 C ATOM 918 CD2 PHE A 61 -4.520 0.264 -2.533 1.00 0.00 C ATOM 919 CE1 PHE A 61 -5.534 2.827 -2.364 1.00 0.00 C ATOM 920 CE2 PHE A 61 -4.796 0.976 -3.687 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.303 2.258 -3.602 1.00 0.00 C ATOM 0 H PHE A 61 -2.689 -1.032 2.107 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.411 0.718 -0.203 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.522 -1.017 -0.253 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.220 0.271 0.709 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.437 2.562 -0.250 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -4.124 -0.738 -2.605 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -5.931 3.829 -2.295 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.615 0.530 -4.654 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.519 2.815 -4.502 1.00 0.00 H new ATOM 931 N VAL A 62 -2.874 2.651 1.306 1.00 0.00 N ATOM 932 CA VAL A 62 -2.958 3.761 2.251 1.00 0.00 C ATOM 933 C VAL A 62 -3.414 5.041 1.553 1.00 0.00 C ATOM 934 O VAL A 62 -2.963 5.353 0.451 1.00 0.00 O ATOM 935 CB VAL A 62 -1.606 4.022 2.953 1.00 0.00 C ATOM 936 CG1 VAL A 62 -1.772 5.038 4.075 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.014 2.724 3.489 1.00 0.00 C ATOM 0 H VAL A 62 -2.546 2.913 0.376 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.692 3.475 3.004 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.915 4.432 2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.809 5.208 4.557 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.143 5.977 3.664 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.483 4.657 4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.063 2.933 3.979 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.702 2.280 4.208 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -0.853 2.030 2.664 1.00 0.00 H new ATOM 947 N ARG A 63 -4.311 5.779 2.208 1.00 0.00 N ATOM 948 CA ARG A 63 -4.829 7.028 1.658 1.00 0.00 C ATOM 949 C ARG A 63 -4.171 8.229 2.335 1.00 0.00 C ATOM 950 O ARG A 63 -4.154 8.324 3.565 1.00 0.00 O ATOM 951 CB ARG A 63 -6.349 7.095 1.834 1.00 0.00 C ATOM 952 CG ARG A 63 -7.006 8.242 1.082 1.00 0.00 C ATOM 953 CD ARG A 63 -8.299 8.677 1.755 1.00 0.00 C ATOM 954 NE ARG A 63 -9.030 9.661 0.957 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.812 9.352 -0.078 1.00 0.00 C ATOM 956 NH1 ARG A 63 -9.964 8.087 -0.458 1.00 0.00 N ATOM 957 NH2 ARG A 63 -10.443 10.316 -0.740 1.00 0.00 N ATOM 0 H ARG A 63 -4.693 5.531 3.121 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.594 7.057 0.594 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.786 6.155 1.497 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.578 7.191 2.895 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.319 9.086 1.030 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.213 7.936 0.056 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.931 7.805 1.923 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.073 9.100 2.734 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.936 10.645 1.208 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.480 7.342 0.044 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.565 7.861 -1.251 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.328 11.289 -0.456 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.042 10.083 -1.532 1.00 0.00 H new ATOM 971 N PHE A 64 -3.629 9.139 1.529 1.00 0.00 N ATOM 972 CA PHE A 64 -2.967 10.332 2.052 1.00 0.00 C ATOM 973 C PHE A 64 -3.687 11.603 1.614 1.00 0.00 C ATOM 974 O PHE A 64 -4.429 11.603 0.630 1.00 0.00 O ATOM 975 CB PHE A 64 -1.511 10.380 1.587 1.00 0.00 C ATOM 976 CG PHE A 64 -0.619 9.412 2.309 1.00 0.00 C ATOM 977 CD1 PHE A 64 0.012 9.779 3.487 1.00 0.00 C ATOM 978 CD2 PHE A 64 -0.415 8.137 1.811 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.834 8.890 4.154 1.00 0.00 C ATOM 980 CE2 PHE A 64 0.405 7.244 2.473 1.00 0.00 C ATOM 981 CZ PHE A 64 1.030 7.620 3.645 1.00 0.00 C ATOM 0 H PHE A 64 -3.635 9.073 0.511 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.998 10.277 3.140 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.472 10.170 0.518 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.126 11.390 1.727 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.140 10.770 3.888 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.902 7.837 0.895 1.00 0.00 H new ATOM 0 HE1 PHE A 64 1.322 9.187 5.071 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.557 6.252 2.074 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.671 6.923 4.164 1.00 0.00 H new ATOM 991 N THR A 65 -3.455 12.687 2.350 1.00 0.00 N ATOM 992 CA THR A 65 -4.069 13.974 2.040 1.00 0.00 C ATOM 993 C THR A 65 -3.089 15.115 2.296 1.00 0.00 C ATOM 994 O THR A 65 -2.413 15.147 3.326 1.00 0.00 O ATOM 995 CB THR A 65 -5.346 14.172 2.867 1.00 0.00 C ATOM 996 OG1 THR A 65 -5.890 15.463 2.652 1.00 0.00 O ATOM 997 CG2 THR A 65 -5.136 14.006 4.358 1.00 0.00 C ATOM 0 H THR A 65 -2.845 12.699 3.167 1.00 0.00 H new ATOM 0 HA THR A 65 -4.334 13.980 0.983 1.00 0.00 H new ATOM 0 HB THR A 65 -6.027 13.392 2.526 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.704 15.568 3.187 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.081 14.160 4.878 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.768 13.001 4.564 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.407 14.737 4.706 1.00 0.00 H new ATOM 1122 N SER A 74 -6.316 14.695 -2.117 1.00 0.00 N ATOM 1123 CA SER A 74 -6.168 13.303 -1.701 1.00 0.00 C ATOM 1124 C SER A 74 -5.319 12.522 -2.699 1.00 0.00 C ATOM 1125 O SER A 74 -5.425 12.727 -3.910 1.00 0.00 O ATOM 1126 CB SER A 74 -7.540 12.643 -1.555 1.00 0.00 C ATOM 1127 OG SER A 74 -7.480 11.524 -0.687 1.00 0.00 O ATOM 0 HA SER A 74 -5.662 13.292 -0.735 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.256 13.368 -1.169 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.901 12.328 -2.534 1.00 0.00 H new ATOM 0 HG SER A 74 -6.582 11.458 -0.299 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.480 11.625 -2.184 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.613 10.809 -3.029 1.00 0.00 C ATOM 1135 C LYS A 75 -3.511 9.384 -2.492 1.00 0.00 C ATOM 1136 O LYS A 75 -3.233 9.175 -1.310 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.218 11.436 -3.124 1.00 0.00 C ATOM 1138 CG LYS A 75 -2.210 12.803 -3.790 1.00 0.00 C ATOM 1139 CD LYS A 75 -1.097 12.921 -4.821 1.00 0.00 C ATOM 1140 CE LYS A 75 -1.205 14.219 -5.607 1.00 0.00 C ATOM 1141 NZ LYS A 75 -2.032 14.062 -6.836 1.00 0.00 N ATOM 0 H LYS A 75 -4.383 11.445 -1.185 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.053 10.770 -4.026 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.800 11.527 -2.121 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.564 10.765 -3.682 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.172 12.979 -4.271 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.087 13.576 -3.032 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.129 12.876 -4.321 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.142 12.074 -5.506 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.641 14.991 -4.973 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.207 14.559 -5.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.079 14.970 -7.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.603 13.344 -7.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.992 13.762 -6.572 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.743 8.408 -3.368 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.682 7.000 -2.982 1.00 0.00 C ATOM 1157 C PHE A 76 -2.252 6.472 -3.059 1.00 0.00 C ATOM 1158 O PHE A 76 -1.500 6.814 -3.973 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.591 6.157 -3.880 1.00 0.00 C ATOM 1160 CG PHE A 76 -6.013 6.641 -3.925 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.895 6.335 -2.901 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.467 7.400 -4.992 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -8.203 6.777 -2.940 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.773 7.844 -5.036 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.643 7.533 -4.010 1.00 0.00 C ATOM 0 H PHE A 76 -3.975 8.566 -4.349 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.027 6.923 -1.951 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.185 6.154 -4.892 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.579 5.125 -3.528 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.556 5.744 -2.063 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -5.792 7.647 -5.798 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.881 6.532 -2.136 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.115 8.435 -5.873 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.665 7.880 -4.044 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.888 5.633 -2.090 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.553 5.050 -2.040 1.00 0.00 C ATOM 1177 C ALA A 77 -0.624 3.529 -1.940 1.00 0.00 C ATOM 1178 O ALA A 77 -1.093 2.984 -0.938 1.00 0.00 O ATOM 1179 CB ALA A 77 0.229 5.624 -0.869 1.00 0.00 C ATOM 0 H ALA A 77 -2.502 5.343 -1.329 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.036 5.303 -2.965 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.224 5.180 -0.843 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.317 6.704 -0.985 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.292 5.400 0.062 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.154 2.849 -2.984 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.161 1.390 -3.017 1.00 0.00 C ATOM 1187 C LEU A 78 1.182 0.837 -2.546 1.00 0.00 C ATOM 1188 O LEU A 78 2.184 0.919 -3.262 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.471 0.891 -4.430 1.00 0.00 C ATOM 1190 CG LEU A 78 -1.140 -0.483 -4.500 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -2.320 -0.455 -5.459 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -0.134 -1.544 -4.920 1.00 0.00 C ATOM 0 H LEU A 78 0.237 3.287 -3.818 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.939 1.035 -2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.117 1.618 -4.922 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.459 0.855 -4.998 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.512 -0.736 -3.507 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.783 -1.441 -5.495 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.051 0.277 -5.115 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.973 -0.180 -6.455 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.627 -2.515 -4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.268 -1.296 -5.902 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.679 -1.582 -4.194 1.00 0.00 H new ATOM 1204 N ILE A 79 1.197 0.287 -1.335 1.00 0.00 N ATOM 1205 CA ILE A 79 2.419 -0.269 -0.762 1.00 0.00 C ATOM 1206 C ILE A 79 2.424 -1.793 -0.831 1.00 0.00 C ATOM 1207 O ILE A 79 1.606 -2.455 -0.192 1.00 0.00 O ATOM 1208 CB ILE A 79 2.606 0.170 0.707 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.403 1.684 0.848 1.00 0.00 C ATOM 1210 CG2 ILE A 79 3.985 -0.235 1.212 1.00 0.00 C ATOM 1211 CD1 ILE A 79 3.412 2.510 0.078 1.00 0.00 C ATOM 0 H ILE A 79 0.378 0.214 -0.732 1.00 0.00 H new ATOM 0 HA ILE A 79 3.246 0.118 -1.357 1.00 0.00 H new ATOM 0 HB ILE A 79 1.855 -0.334 1.315 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.400 1.940 0.505 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.458 1.952 1.903 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.100 0.082 2.249 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.092 -1.318 1.150 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.751 0.241 0.600 1.00 0.00 H new ATOM 0 HD11 ILE A 79 3.204 3.570 0.227 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.416 2.284 0.436 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.343 2.272 -0.983 1.00 0.00 H new ATOM 1223 N THR A 80 3.358 -2.342 -1.603 1.00 0.00 N ATOM 1224 CA THR A 80 3.484 -3.789 -1.749 1.00 0.00 C ATOM 1225 C THR A 80 4.744 -4.286 -1.042 1.00 0.00 C ATOM 1226 O THR A 80 5.863 -4.005 -1.477 1.00 0.00 O ATOM 1227 CB THR A 80 3.514 -4.182 -3.231 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.721 -5.578 -3.381 1.00 0.00 O ATOM 1229 CG2 THR A 80 4.595 -3.474 -4.021 1.00 0.00 C ATOM 0 H THR A 80 4.040 -1.805 -2.138 1.00 0.00 H new ATOM 0 HA THR A 80 2.616 -4.258 -1.287 1.00 0.00 H new ATOM 0 HB THR A 80 2.542 -3.881 -3.623 1.00 0.00 H new ATOM 0 HG1 THR A 80 2.921 -5.987 -3.773 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.558 -3.800 -5.061 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.435 -2.397 -3.972 1.00 0.00 H new ATOM 0 HG23 THR A 80 5.571 -3.715 -3.600 1.00 0.00 H new ATOM 1237 N TRP A 81 4.553 -5.018 0.054 1.00 0.00 N ATOM 1238 CA TRP A 81 5.673 -5.549 0.824 1.00 0.00 C ATOM 1239 C TRP A 81 6.135 -6.893 0.267 1.00 0.00 C ATOM 1240 O TRP A 81 5.317 -7.728 -0.127 1.00 0.00 O ATOM 1241 CB TRP A 81 5.287 -5.697 2.299 1.00 0.00 C ATOM 1242 CG TRP A 81 6.392 -6.249 3.147 1.00 0.00 C ATOM 1243 CD1 TRP A 81 6.398 -7.444 3.804 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.657 -5.632 3.421 1.00 0.00 C ATOM 1245 NE1 TRP A 81 7.586 -7.608 4.473 1.00 0.00 N ATOM 1246 CE2 TRP A 81 8.375 -6.508 4.256 1.00 0.00 C ATOM 1247 CE3 TRP A 81 8.250 -4.423 3.044 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 9.656 -6.215 4.718 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 9.521 -4.134 3.505 1.00 0.00 C ATOM 1250 CH2 TRP A 81 10.212 -5.025 4.334 1.00 0.00 C ATOM 0 H TRP A 81 3.634 -5.256 0.427 1.00 0.00 H new ATOM 0 HA TRP A 81 6.499 -4.842 0.743 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.990 -4.724 2.689 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.418 -6.350 2.376 1.00 0.00 H new ATOM 0 HD1 TRP A 81 5.587 -8.157 3.799 1.00 0.00 H new ATOM 0 HE1 TRP A 81 7.840 -8.417 5.040 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.725 -3.728 2.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 10.191 -6.902 5.356 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.989 -3.203 3.220 1.00 0.00 H new ATOM 0 HH2 TRP A 81 11.203 -4.768 4.677 1.00 0.00 H new ATOM 1261 N ILE A 82 7.451 -7.093 0.236 1.00 0.00 N ATOM 1262 CA ILE A 82 8.028 -8.331 -0.273 1.00 0.00 C ATOM 1263 C ILE A 82 9.015 -8.940 0.729 1.00 0.00 C ATOM 1264 O ILE A 82 10.226 -8.726 0.635 1.00 0.00 O ATOM 1265 CB ILE A 82 8.732 -8.099 -1.634 1.00 0.00 C ATOM 1266 CG1 ILE A 82 9.413 -9.385 -2.112 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.743 -6.960 -1.538 1.00 0.00 C ATOM 1268 CD1 ILE A 82 9.388 -9.566 -3.617 1.00 0.00 C ATOM 0 H ILE A 82 8.137 -6.411 0.559 1.00 0.00 H new ATOM 0 HA ILE A 82 7.208 -9.034 -0.419 1.00 0.00 H new ATOM 0 HB ILE A 82 7.974 -7.817 -2.365 1.00 0.00 H new ATOM 0 HG12 ILE A 82 10.449 -9.385 -1.772 1.00 0.00 H new ATOM 0 HG13 ILE A 82 8.924 -10.240 -1.644 1.00 0.00 H new ATOM 0 HG21 ILE A 82 10.223 -6.817 -2.506 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.231 -6.042 -1.248 1.00 0.00 H new ATOM 0 HG23 ILE A 82 10.498 -7.206 -0.791 1.00 0.00 H new ATOM 0 HD11 ILE A 82 9.889 -10.498 -3.880 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.355 -9.599 -3.962 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.903 -8.731 -4.092 1.00 0.00 H new ATOM 1280 N GLY A 83 8.488 -9.707 1.684 1.00 0.00 N ATOM 1281 CA GLY A 83 9.334 -10.344 2.683 1.00 0.00 C ATOM 1282 C GLY A 83 10.220 -11.416 2.074 1.00 0.00 C ATOM 1283 O GLY A 83 9.717 -12.402 1.529 1.00 0.00 O ATOM 0 H GLY A 83 7.491 -9.898 1.783 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.956 -9.590 3.166 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.709 -10.787 3.459 1.00 0.00 H new ATOM 1287 N GLU A 84 11.535 -11.191 2.156 1.00 0.00 N ATOM 1288 CA GLU A 84 12.560 -12.091 1.597 1.00 0.00 C ATOM 1289 C GLU A 84 12.207 -13.576 1.633 1.00 0.00 C ATOM 1290 O GLU A 84 12.632 -14.322 0.749 1.00 0.00 O ATOM 1291 CB GLU A 84 13.882 -11.901 2.322 1.00 0.00 C ATOM 1292 CG GLU A 84 14.659 -10.670 1.878 1.00 0.00 C ATOM 1293 CD GLU A 84 15.654 -10.972 0.772 1.00 0.00 C ATOM 1294 OE1 GLU A 84 15.235 -11.515 -0.274 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.850 -10.667 0.951 1.00 0.00 O ATOM 0 H GLU A 84 11.927 -10.370 2.617 1.00 0.00 H new ATOM 0 HA GLU A 84 12.628 -11.808 0.547 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.691 -11.831 3.393 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.501 -12.785 2.166 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.959 -9.909 1.533 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.189 -10.252 2.734 1.00 0.00 H new ATOM 1302 N ASN A 85 11.447 -14.024 2.632 1.00 0.00 N ATOM 1303 CA ASN A 85 11.079 -15.440 2.729 1.00 0.00 C ATOM 1304 C ASN A 85 10.026 -15.824 1.688 1.00 0.00 C ATOM 1305 O ASN A 85 9.149 -16.650 1.946 1.00 0.00 O ATOM 1306 CB ASN A 85 10.574 -15.761 4.131 1.00 0.00 C ATOM 1307 CG ASN A 85 11.702 -15.829 5.136 1.00 0.00 C ATOM 1308 OD1 ASN A 85 12.037 -16.901 5.639 1.00 0.00 O ATOM 1309 ND2 ASN A 85 12.295 -14.681 5.435 1.00 0.00 N ATOM 0 H ASN A 85 11.077 -13.436 3.379 1.00 0.00 H new ATOM 0 HA ASN A 85 11.975 -16.027 2.527 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.857 -15.001 4.441 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.043 -16.713 4.116 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.062 -14.663 6.107 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.984 -13.816 4.993 1.00 0.00 H new ATOM 1316 N VAL A 86 10.133 -15.229 0.506 1.00 0.00 N ATOM 1317 CA VAL A 86 9.206 -15.511 -0.584 1.00 0.00 C ATOM 1318 C VAL A 86 9.839 -16.451 -1.605 1.00 0.00 C ATOM 1319 O VAL A 86 10.797 -16.087 -2.292 1.00 0.00 O ATOM 1320 CB VAL A 86 8.743 -14.220 -1.295 1.00 0.00 C ATOM 1321 CG1 VAL A 86 7.701 -13.493 -0.457 1.00 0.00 C ATOM 1322 CG2 VAL A 86 9.923 -13.306 -1.593 1.00 0.00 C ATOM 0 H VAL A 86 10.855 -14.546 0.277 1.00 0.00 H new ATOM 0 HA VAL A 86 8.334 -15.991 -0.140 1.00 0.00 H new ATOM 0 HB VAL A 86 8.288 -14.502 -2.244 1.00 0.00 H new ATOM 0 HG11 VAL A 86 7.387 -12.586 -0.974 1.00 0.00 H new ATOM 0 HG12 VAL A 86 6.838 -14.142 -0.306 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.131 -13.229 0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.568 -12.405 -2.094 1.00 0.00 H new ATOM 0 HG22 VAL A 86 10.416 -13.033 -0.660 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.631 -13.825 -2.239 1.00 0.00 H new ATOM 1332 N SER A 87 9.299 -17.663 -1.703 1.00 0.00 N ATOM 1333 CA SER A 87 9.812 -18.656 -2.642 1.00 0.00 C ATOM 1334 C SER A 87 9.597 -18.206 -4.083 1.00 0.00 C ATOM 1335 O SER A 87 8.964 -17.178 -4.333 1.00 0.00 O ATOM 1336 CB SER A 87 9.143 -20.011 -2.404 1.00 0.00 C ATOM 1337 OG SER A 87 9.514 -20.548 -1.147 1.00 0.00 O ATOM 0 H SER A 87 8.507 -17.981 -1.144 1.00 0.00 H new ATOM 0 HA SER A 87 10.884 -18.759 -2.473 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.060 -19.898 -2.450 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.425 -20.704 -3.197 1.00 0.00 H new ATOM 0 HG SER A 87 9.072 -21.413 -1.018 1.00 0.00 H new ATOM 1343 N GLY A 88 10.132 -18.979 -5.029 1.00 0.00 N ATOM 1344 CA GLY A 88 9.996 -18.648 -6.438 1.00 0.00 C ATOM 1345 C GLY A 88 8.565 -18.331 -6.836 1.00 0.00 C ATOM 1346 O GLY A 88 8.314 -17.344 -7.528 1.00 0.00 O ATOM 0 H GLY A 88 10.659 -19.832 -4.842 1.00 0.00 H new ATOM 0 HA2 GLY A 88 10.630 -17.791 -6.667 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.358 -19.482 -7.039 1.00 0.00 H new ATOM 1350 N LEU A 89 7.626 -19.168 -6.392 1.00 0.00 N ATOM 1351 CA LEU A 89 6.211 -18.972 -6.701 1.00 0.00 C ATOM 1352 C LEU A 89 5.695 -17.666 -6.098 1.00 0.00 C ATOM 1353 O LEU A 89 5.039 -16.876 -6.778 1.00 0.00 O ATOM 1354 CB LEU A 89 5.384 -20.149 -6.177 1.00 0.00 C ATOM 1355 CG LEU A 89 4.103 -20.444 -6.962 1.00 0.00 C ATOM 1356 CD1 LEU A 89 3.986 -21.933 -7.250 1.00 0.00 C ATOM 1357 CD2 LEU A 89 2.884 -19.951 -6.197 1.00 0.00 C ATOM 0 H LEU A 89 7.821 -19.988 -5.817 1.00 0.00 H new ATOM 0 HA LEU A 89 6.108 -18.917 -7.785 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.008 -21.042 -6.182 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.118 -19.952 -5.138 1.00 0.00 H new ATOM 0 HG LEU A 89 4.151 -19.912 -7.912 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.070 -22.125 -7.809 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.844 -22.258 -7.838 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.960 -22.484 -6.310 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.982 -20.169 -6.770 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.832 -20.455 -5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.963 -18.875 -6.041 1.00 0.00 H new ATOM 1369 N GLN A 90 6.004 -17.447 -4.821 1.00 0.00 N ATOM 1370 CA GLN A 90 5.581 -16.239 -4.117 1.00 0.00 C ATOM 1371 C GLN A 90 6.200 -14.992 -4.744 1.00 0.00 C ATOM 1372 O GLN A 90 5.551 -13.948 -4.838 1.00 0.00 O ATOM 1373 CB GLN A 90 5.971 -16.333 -2.640 1.00 0.00 C ATOM 1374 CG GLN A 90 5.015 -17.173 -1.811 1.00 0.00 C ATOM 1375 CD GLN A 90 3.575 -16.701 -1.919 1.00 0.00 C ATOM 1376 OE1 GLN A 90 3.165 -15.765 -1.234 1.00 0.00 O ATOM 1377 NE2 GLN A 90 2.800 -17.347 -2.785 1.00 0.00 N ATOM 0 H GLN A 90 6.549 -18.094 -4.251 1.00 0.00 H new ATOM 0 HA GLN A 90 4.497 -16.157 -4.200 1.00 0.00 H new ATOM 0 HB2 GLN A 90 6.973 -16.756 -2.564 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.016 -15.328 -2.220 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.078 -18.212 -2.134 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.325 -17.144 -0.766 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.181 -18.118 -3.333 1.00 0.00 H new ATOM 0 HE22 GLN A 90 1.825 -17.071 -2.901 1.00 0.00 H new ATOM 1386 N ARG A 91 7.454 -15.110 -5.176 1.00 0.00 N ATOM 1387 CA ARG A 91 8.163 -13.997 -5.803 1.00 0.00 C ATOM 1388 C ARG A 91 7.459 -13.560 -7.085 1.00 0.00 C ATOM 1389 O ARG A 91 7.178 -12.376 -7.276 1.00 0.00 O ATOM 1390 CB ARG A 91 9.608 -14.396 -6.113 1.00 0.00 C ATOM 1391 CG ARG A 91 10.621 -13.821 -5.137 1.00 0.00 C ATOM 1392 CD ARG A 91 11.337 -12.615 -5.723 1.00 0.00 C ATOM 1393 NE ARG A 91 12.714 -12.504 -5.244 1.00 0.00 N ATOM 1394 CZ ARG A 91 13.508 -11.463 -5.499 1.00 0.00 C ATOM 1395 NH1 ARG A 91 13.064 -10.442 -6.228 1.00 0.00 N ATOM 1396 NH2 ARG A 91 14.748 -11.441 -5.027 1.00 0.00 N ATOM 0 H ARG A 91 8.001 -15.968 -5.103 1.00 0.00 H new ATOM 0 HA ARG A 91 8.166 -13.159 -5.105 1.00 0.00 H new ATOM 0 HB2 ARG A 91 9.685 -15.483 -6.105 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.859 -14.066 -7.121 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.116 -13.533 -4.215 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.351 -14.587 -4.875 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.337 -12.688 -6.811 1.00 0.00 H new ATOM 0 HD3 ARG A 91 10.790 -11.709 -5.464 1.00 0.00 H new ATOM 0 HE ARG A 91 13.090 -13.268 -4.682 1.00 0.00 H new ATOM 0 HH11 ARG A 91 12.112 -10.453 -6.595 1.00 0.00 H new ATOM 0 HH12 ARG A 91 13.675 -9.648 -6.420 1.00 0.00 H new ATOM 0 HH21 ARG A 91 15.095 -12.221 -4.468 1.00 0.00 H new ATOM 0 HH22 ARG A 91 15.354 -10.644 -5.223 1.00 0.00 H new ATOM 1410 N ALA A 92 7.174 -14.531 -7.957 1.00 0.00 N ATOM 1411 CA ALA A 92 6.498 -14.260 -9.226 1.00 0.00 C ATOM 1412 C ALA A 92 5.089 -13.708 -9.005 1.00 0.00 C ATOM 1413 O ALA A 92 4.590 -12.924 -9.815 1.00 0.00 O ATOM 1414 CB ALA A 92 6.444 -15.523 -10.073 1.00 0.00 C ATOM 0 H ALA A 92 7.402 -15.514 -7.806 1.00 0.00 H new ATOM 0 HA ALA A 92 7.073 -13.500 -9.755 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.939 -15.308 -11.015 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.458 -15.869 -10.276 1.00 0.00 H new ATOM 0 HB3 ALA A 92 5.897 -16.298 -9.536 1.00 0.00 H new ATOM 1420 N LYS A 93 4.452 -14.123 -7.908 1.00 0.00 N ATOM 1421 CA LYS A 93 3.102 -13.672 -7.582 1.00 0.00 C ATOM 1422 C LYS A 93 3.032 -12.147 -7.500 1.00 0.00 C ATOM 1423 O LYS A 93 2.037 -11.546 -7.905 1.00 0.00 O ATOM 1424 CB LYS A 93 2.651 -14.286 -6.256 1.00 0.00 C ATOM 1425 CG LYS A 93 2.262 -15.751 -6.366 1.00 0.00 C ATOM 1426 CD LYS A 93 0.869 -16.006 -5.811 1.00 0.00 C ATOM 1427 CE LYS A 93 0.000 -16.761 -6.806 1.00 0.00 C ATOM 1428 NZ LYS A 93 -1.175 -17.405 -6.148 1.00 0.00 N ATOM 0 H LYS A 93 4.852 -14.772 -7.231 1.00 0.00 H new ATOM 0 HA LYS A 93 2.435 -14.000 -8.379 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.455 -14.186 -5.527 1.00 0.00 H new ATOM 0 HB3 LYS A 93 1.801 -13.721 -5.874 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.300 -16.060 -7.411 1.00 0.00 H new ATOM 0 HG3 LYS A 93 2.986 -16.361 -5.826 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.944 -16.577 -4.886 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.396 -15.056 -5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.348 -16.074 -7.577 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.599 -17.523 -7.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -1.721 -17.936 -6.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.845 -18.055 -5.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.779 -16.673 -5.723 1.00 0.00 H new ATOM 1442 N THR A 94 4.096 -11.530 -6.978 1.00 0.00 N ATOM 1443 CA THR A 94 4.157 -10.074 -6.848 1.00 0.00 C ATOM 1444 C THR A 94 4.018 -9.401 -8.211 1.00 0.00 C ATOM 1445 O THR A 94 3.232 -8.465 -8.368 1.00 0.00 O ATOM 1446 CB THR A 94 5.471 -9.645 -6.184 1.00 0.00 C ATOM 1447 OG1 THR A 94 5.963 -10.665 -5.332 1.00 0.00 O ATOM 1448 CG2 THR A 94 5.340 -8.381 -5.357 1.00 0.00 C ATOM 0 H THR A 94 4.926 -12.017 -6.639 1.00 0.00 H new ATOM 0 HA THR A 94 3.325 -9.759 -6.218 1.00 0.00 H new ATOM 0 HB THR A 94 6.159 -9.454 -7.008 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.499 -11.297 -5.854 1.00 0.00 H new ATOM 0 HG21 THR A 94 6.305 -8.133 -4.915 1.00 0.00 H new ATOM 0 HG22 THR A 94 5.012 -7.561 -5.996 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.608 -8.539 -4.565 1.00 0.00 H new ATOM 1456 N GLY A 95 4.774 -9.890 -9.196 1.00 0.00 N ATOM 1457 CA GLY A 95 4.706 -9.328 -10.536 1.00 0.00 C ATOM 1458 C GLY A 95 3.313 -9.432 -11.126 1.00 0.00 C ATOM 1459 O GLY A 95 2.789 -8.459 -11.671 1.00 0.00 O ATOM 0 H GLY A 95 5.430 -10.663 -9.089 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.010 -8.282 -10.506 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.413 -9.847 -11.183 1.00 0.00 H new ATOM 1463 N THR A 96 2.707 -10.614 -11.003 1.00 0.00 N ATOM 1464 CA THR A 96 1.357 -10.846 -11.512 1.00 0.00 C ATOM 1465 C THR A 96 0.344 -9.968 -10.778 1.00 0.00 C ATOM 1466 O THR A 96 -0.649 -9.530 -11.360 1.00 0.00 O ATOM 1467 CB THR A 96 0.976 -12.323 -11.362 1.00 0.00 C ATOM 1468 OG1 THR A 96 2.062 -13.163 -11.712 1.00 0.00 O ATOM 1469 CG2 THR A 96 -0.208 -12.728 -12.216 1.00 0.00 C ATOM 0 H THR A 96 3.132 -11.426 -10.554 1.00 0.00 H new ATOM 0 HA THR A 96 1.343 -10.583 -12.570 1.00 0.00 H new ATOM 0 HB THR A 96 0.706 -12.442 -10.313 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.797 -14.101 -11.607 1.00 0.00 H new ATOM 0 HG21 THR A 96 -0.424 -13.785 -12.061 1.00 0.00 H new ATOM 0 HG22 THR A 96 -1.079 -12.135 -11.935 1.00 0.00 H new ATOM 0 HG23 THR A 96 0.025 -12.555 -13.267 1.00 0.00 H new ATOM 1477 N ASP A 97 0.606 -9.714 -9.497 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.275 -8.886 -8.679 1.00 0.00 C ATOM 1479 C ASP A 97 -0.220 -7.420 -9.109 1.00 0.00 C ATOM 1480 O ASP A 97 -1.212 -6.700 -8.994 1.00 0.00 O ATOM 1481 CB ASP A 97 0.106 -9.011 -7.199 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.955 -9.715 -6.374 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -1.632 -10.617 -6.912 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -1.101 -9.370 -5.183 1.00 0.00 O ATOM 0 H ASP A 97 1.424 -10.071 -9.003 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.295 -9.242 -8.821 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.046 -9.557 -7.116 1.00 0.00 H new ATOM 0 HB3 ASP A 97 0.278 -8.016 -6.788 1.00 0.00 H new ATOM 1489 N LYS A 98 0.938 -6.985 -9.606 1.00 0.00 N ATOM 1490 CA LYS A 98 1.111 -5.606 -10.055 1.00 0.00 C ATOM 1491 C LYS A 98 0.147 -5.279 -11.198 1.00 0.00 C ATOM 1492 O LYS A 98 -0.342 -4.154 -11.305 1.00 0.00 O ATOM 1493 CB LYS A 98 2.559 -5.366 -10.503 1.00 0.00 C ATOM 1494 CG LYS A 98 2.875 -3.912 -10.829 1.00 0.00 C ATOM 1495 CD LYS A 98 3.642 -3.237 -9.701 1.00 0.00 C ATOM 1496 CE LYS A 98 2.710 -2.761 -8.597 1.00 0.00 C ATOM 1497 NZ LYS A 98 3.455 -2.385 -7.364 1.00 0.00 N ATOM 0 H LYS A 98 1.769 -7.568 -9.707 1.00 0.00 H new ATOM 0 HA LYS A 98 0.887 -4.947 -9.216 1.00 0.00 H new ATOM 0 HB2 LYS A 98 3.233 -5.706 -9.716 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.762 -5.977 -11.382 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.460 -3.864 -11.747 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.947 -3.370 -11.014 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.371 -3.934 -9.287 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.201 -2.389 -10.097 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.137 -1.904 -8.950 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.994 -3.548 -8.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.780 -2.164 -6.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.061 -3.177 -7.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.046 -1.551 -7.556 1.00 0.00 H new ATOM 1511 N THR A 99 -0.128 -6.273 -12.044 1.00 0.00 N ATOM 1512 CA THR A 99 -1.035 -6.086 -13.174 1.00 0.00 C ATOM 1513 C THR A 99 -2.495 -6.255 -12.748 1.00 0.00 C ATOM 1514 O THR A 99 -3.385 -5.593 -13.285 1.00 0.00 O ATOM 1515 CB THR A 99 -0.687 -7.058 -14.308 1.00 0.00 C ATOM 1516 OG1 THR A 99 -1.337 -6.682 -15.509 1.00 0.00 O ATOM 1517 CG2 THR A 99 -1.057 -8.500 -14.022 1.00 0.00 C ATOM 0 H THR A 99 0.263 -7.212 -11.968 1.00 0.00 H new ATOM 0 HA THR A 99 -0.911 -5.067 -13.539 1.00 0.00 H new ATOM 0 HB THR A 99 0.397 -6.997 -14.402 1.00 0.00 H new ATOM 0 HG1 THR A 99 -1.101 -7.313 -16.220 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.778 -9.123 -14.872 1.00 0.00 H new ATOM 0 HG22 THR A 99 -0.527 -8.842 -13.133 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.132 -8.574 -13.855 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.731 -7.141 -11.779 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.074 -7.396 -11.278 1.00 0.00 C ATOM 1527 C LEU A 100 -4.612 -6.181 -10.525 1.00 0.00 C ATOM 1528 O LEU A 100 -5.744 -5.748 -10.751 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.063 -8.614 -10.353 1.00 0.00 C ATOM 1530 CG LEU A 100 -3.834 -9.958 -11.049 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -3.272 -10.977 -10.069 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -5.129 -10.466 -11.662 1.00 0.00 C ATOM 0 H LEU A 100 -2.003 -7.694 -11.327 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.726 -7.593 -12.129 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.284 -8.474 -9.603 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.014 -8.655 -9.822 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.107 -9.813 -11.849 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.116 -11.926 -10.581 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.322 -10.617 -9.674 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.975 -11.119 -9.248 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.949 -11.422 -12.153 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.876 -10.595 -10.879 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.492 -9.745 -12.394 1.00 0.00 H new ATOM 1544 N VAL A 101 -3.789 -5.640 -9.629 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.167 -4.478 -8.832 1.00 0.00 C ATOM 1546 C VAL A 101 -4.280 -3.222 -9.697 1.00 0.00 C ATOM 1547 O VAL A 101 -5.170 -2.400 -9.485 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.158 -4.229 -7.691 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -3.632 -3.102 -6.787 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -2.933 -5.506 -6.889 1.00 0.00 C ATOM 0 H VAL A 101 -2.851 -5.991 -9.437 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.143 -4.695 -8.398 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.208 -3.930 -8.134 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.905 -2.944 -5.990 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.735 -2.187 -7.370 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.596 -3.366 -6.352 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.219 -5.312 -6.089 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -3.878 -5.837 -6.459 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.541 -6.283 -7.545 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.383 -3.082 -10.673 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.402 -1.926 -11.568 1.00 0.00 C ATOM 1562 C LYS A 102 -4.696 -1.898 -12.387 1.00 0.00 C ATOM 1563 O LYS A 102 -5.276 -0.834 -12.611 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.190 -1.960 -12.501 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.865 -0.618 -13.137 1.00 0.00 C ATOM 1566 CD LYS A 102 -2.790 -0.313 -14.305 1.00 0.00 C ATOM 1567 CE LYS A 102 -2.057 0.416 -15.420 1.00 0.00 C ATOM 1568 NZ LYS A 102 -2.983 1.223 -16.267 1.00 0.00 N ATOM 0 H LYS A 102 -2.637 -3.752 -10.863 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.357 -1.021 -10.962 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.321 -2.305 -11.940 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.371 -2.690 -13.289 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.951 0.170 -12.389 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.831 -0.619 -13.482 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.210 -1.242 -14.691 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.626 0.295 -13.959 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.299 1.070 -14.988 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -1.535 -0.309 -16.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.441 1.703 -17.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -3.691 0.597 -16.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -3.463 1.933 -15.678 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.141 -3.077 -12.827 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.367 -3.198 -13.616 1.00 0.00 C ATOM 1584 C GLU A 103 -7.592 -2.801 -12.789 1.00 0.00 C ATOM 1585 O GLU A 103 -8.406 -1.986 -13.225 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.526 -4.633 -14.129 1.00 0.00 C ATOM 1587 CG GLU A 103 -7.121 -4.726 -15.525 1.00 0.00 C ATOM 1588 CD GLU A 103 -8.595 -4.367 -15.558 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -9.376 -4.991 -14.809 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -8.969 -3.462 -16.334 1.00 0.00 O ATOM 0 H GLU A 103 -4.668 -3.963 -12.649 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.291 -2.520 -14.466 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.550 -5.119 -14.127 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.160 -5.188 -13.437 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -6.574 -4.061 -16.194 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -6.989 -5.739 -15.905 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.712 -3.380 -11.593 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.836 -3.088 -10.702 1.00 0.00 C ATOM 1599 C VAL A 104 -8.730 -1.677 -10.115 1.00 0.00 C ATOM 1600 O VAL A 104 -9.741 -0.998 -9.931 1.00 0.00 O ATOM 1601 CB VAL A 104 -8.934 -4.124 -9.555 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -7.705 -4.067 -8.659 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -10.202 -3.912 -8.742 1.00 0.00 C ATOM 0 H VAL A 104 -7.044 -4.054 -11.219 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.742 -3.150 -11.305 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.978 -5.116 -10.004 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.801 -4.805 -7.862 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.814 -4.283 -9.249 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.618 -3.072 -8.223 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.249 -4.651 -7.942 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.195 -2.911 -8.311 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.072 -4.022 -9.389 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.502 -1.243 -9.825 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.266 0.084 -9.263 1.00 0.00 C ATOM 1615 C VAL A 105 -6.410 0.927 -10.203 1.00 0.00 C ATOM 1616 O VAL A 105 -5.184 0.797 -10.232 1.00 0.00 O ATOM 1617 CB VAL A 105 -6.576 0.003 -7.883 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -6.484 1.382 -7.242 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -7.311 -0.966 -6.969 1.00 0.00 C ATOM 0 H VAL A 105 -6.656 -1.794 -9.971 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.241 0.555 -9.139 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.563 -0.371 -8.033 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.995 1.300 -6.271 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.905 2.044 -7.886 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -7.486 1.789 -7.110 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -6.808 -1.007 -6.003 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.338 -0.627 -6.829 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.315 -1.959 -7.419 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.068 1.790 -10.974 1.00 0.00 N ATOM 1630 CA GLN A 106 -6.376 2.660 -11.922 1.00 0.00 C ATOM 1631 C GLN A 106 -6.229 4.075 -11.361 1.00 0.00 C ATOM 1632 O GLN A 106 -5.208 4.732 -11.576 1.00 0.00 O ATOM 1633 CB GLN A 106 -7.130 2.692 -13.254 1.00 0.00 C ATOM 1634 CG GLN A 106 -7.333 1.314 -13.870 1.00 0.00 C ATOM 1635 CD GLN A 106 -8.592 1.226 -14.712 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -8.781 2.003 -15.648 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -9.461 0.274 -14.386 1.00 0.00 N ATOM 0 H GLN A 106 -8.081 1.905 -10.961 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.377 2.257 -12.089 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -8.103 3.160 -13.101 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.582 3.319 -13.958 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -6.470 1.067 -14.488 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -7.380 0.569 -13.076 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -9.265 -0.349 -13.602 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -10.324 0.167 -14.919 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.250 4.536 -10.636 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.231 5.868 -10.038 1.00 0.00 C ATOM 1648 C ASN A 107 -6.373 5.881 -8.771 1.00 0.00 C ATOM 1649 O ASN A 107 -6.890 5.798 -7.656 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.656 6.330 -9.712 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.275 7.142 -10.834 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.155 8.365 -10.868 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.945 6.463 -11.760 1.00 0.00 N ATOM 0 H ASN A 107 -8.100 4.004 -10.450 1.00 0.00 H new ATOM 0 HA ASN A 107 -6.794 6.557 -10.760 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.280 5.459 -9.511 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.641 6.928 -8.801 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.384 6.957 -12.537 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.020 5.448 -11.694 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.060 5.985 -8.956 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.123 6.009 -7.836 1.00 0.00 C ATOM 1662 C PHE A 108 -3.152 7.182 -7.969 1.00 0.00 C ATOM 1663 O PHE A 108 -3.188 7.920 -8.956 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.346 4.689 -7.762 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.706 4.289 -9.064 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.556 4.920 -9.511 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.255 3.280 -9.840 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -0.967 4.555 -10.705 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.671 2.910 -11.036 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.524 3.548 -11.469 1.00 0.00 C ATOM 0 H PHE A 108 -4.619 6.054 -9.873 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.694 6.134 -6.916 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.573 4.775 -6.999 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.023 3.897 -7.442 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.115 5.707 -8.918 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.150 2.777 -9.505 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.072 5.056 -11.041 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.110 2.123 -11.632 1.00 0.00 H new ATOM 0 HZ PHE A 108 -1.064 3.260 -12.403 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.283 7.348 -6.974 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.302 8.429 -6.989 1.00 0.00 C ATOM 1682 C ALA A 109 0.110 7.887 -7.190 1.00 0.00 C ATOM 1683 O ALA A 109 0.836 8.337 -8.078 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.381 9.244 -5.705 1.00 0.00 C ATOM 0 H ALA A 109 -2.239 6.749 -6.150 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.537 9.082 -7.830 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.642 10.045 -5.736 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.378 9.674 -5.608 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.180 8.598 -4.851 1.00 0.00 H new ATOM 1690 N LYS A 110 0.498 6.920 -6.357 1.00 0.00 N ATOM 1691 CA LYS A 110 1.827 6.324 -6.447 1.00 0.00 C ATOM 1692 C LYS A 110 1.840 4.910 -5.871 1.00 0.00 C ATOM 1693 O LYS A 110 1.159 4.622 -4.883 1.00 0.00 O ATOM 1694 CB LYS A 110 2.844 7.200 -5.713 1.00 0.00 C ATOM 1695 CG LYS A 110 4.285 6.749 -5.891 1.00 0.00 C ATOM 1696 CD LYS A 110 5.235 7.572 -5.035 1.00 0.00 C ATOM 1697 CE LYS A 110 5.704 8.822 -5.765 1.00 0.00 C ATOM 1698 NZ LYS A 110 6.288 9.826 -4.833 1.00 0.00 N ATOM 0 H LYS A 110 -0.088 6.536 -5.616 1.00 0.00 H new ATOM 0 HA LYS A 110 2.099 6.261 -7.501 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.748 8.226 -6.067 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.604 7.206 -4.650 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.373 5.696 -5.625 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.569 6.838 -6.940 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.737 7.856 -4.108 1.00 0.00 H new ATOM 0 HD3 LYS A 110 6.098 6.965 -4.760 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.447 8.547 -6.514 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.864 9.267 -6.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 5.703 10.686 -4.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 6.316 9.432 -3.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.254 10.063 -5.138 1.00 0.00 H new ATOM 1712 N GLU A 111 2.625 4.035 -6.495 1.00 0.00 N ATOM 1713 CA GLU A 111 2.745 2.649 -6.057 1.00 0.00 C ATOM 1714 C GLU A 111 4.146 2.116 -6.345 1.00 0.00 C ATOM 1715 O GLU A 111 4.629 2.196 -7.477 1.00 0.00 O ATOM 1716 CB GLU A 111 1.698 1.775 -6.753 1.00 0.00 C ATOM 1717 CG GLU A 111 1.718 1.878 -8.270 1.00 0.00 C ATOM 1718 CD GLU A 111 0.682 0.991 -8.937 1.00 0.00 C ATOM 1719 OE1 GLU A 111 0.527 -0.173 -8.505 1.00 0.00 O ATOM 1720 OE2 GLU A 111 0.029 1.457 -9.892 1.00 0.00 O ATOM 0 H GLU A 111 3.191 4.265 -7.312 1.00 0.00 H new ATOM 0 HA GLU A 111 2.572 2.614 -4.981 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.859 0.736 -6.467 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.708 2.055 -6.393 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.543 2.914 -8.561 1.00 0.00 H new ATOM 0 HG3 GLU A 111 2.709 1.607 -8.634 1.00 0.00 H new ATOM 1727 N PHE A 112 4.799 1.580 -5.318 1.00 0.00 N ATOM 1728 CA PHE A 112 6.149 1.045 -5.468 1.00 0.00 C ATOM 1729 C PHE A 112 6.356 -0.196 -4.605 1.00 0.00 C ATOM 1730 O PHE A 112 5.542 -0.503 -3.731 1.00 0.00 O ATOM 1731 CB PHE A 112 7.192 2.109 -5.106 1.00 0.00 C ATOM 1732 CG PHE A 112 6.853 2.898 -3.870 1.00 0.00 C ATOM 1733 CD1 PHE A 112 7.073 2.365 -2.610 1.00 0.00 C ATOM 1734 CD2 PHE A 112 6.318 4.171 -3.972 1.00 0.00 C ATOM 1735 CE1 PHE A 112 6.763 3.088 -1.474 1.00 0.00 C ATOM 1736 CE2 PHE A 112 6.007 4.900 -2.840 1.00 0.00 C ATOM 1737 CZ PHE A 112 6.229 4.357 -1.590 1.00 0.00 C ATOM 0 H PHE A 112 4.417 1.505 -4.375 1.00 0.00 H new ATOM 0 HA PHE A 112 6.275 0.760 -6.512 1.00 0.00 H new ATOM 0 HB2 PHE A 112 8.157 1.624 -4.962 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.303 2.796 -5.945 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.491 1.374 -2.515 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.142 4.599 -4.948 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.938 2.662 -0.497 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.591 5.892 -2.933 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.985 4.924 -0.704 1.00 0.00 H new ATOM 1747 N VAL A 113 7.459 -0.899 -4.854 1.00 0.00 N ATOM 1748 CA VAL A 113 7.795 -2.104 -4.104 1.00 0.00 C ATOM 1749 C VAL A 113 8.954 -1.833 -3.151 1.00 0.00 C ATOM 1750 O VAL A 113 9.981 -1.283 -3.552 1.00 0.00 O ATOM 1751 CB VAL A 113 8.169 -3.275 -5.038 1.00 0.00 C ATOM 1752 CG1 VAL A 113 8.154 -4.595 -4.279 1.00 0.00 C ATOM 1753 CG2 VAL A 113 7.231 -3.334 -6.237 1.00 0.00 C ATOM 0 H VAL A 113 8.138 -0.652 -5.574 1.00 0.00 H new ATOM 0 HA VAL A 113 6.908 -2.386 -3.536 1.00 0.00 H new ATOM 0 HB VAL A 113 9.180 -3.104 -5.407 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.420 -5.407 -4.956 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.874 -4.553 -3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.157 -4.771 -3.875 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.515 -4.167 -6.880 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.207 -3.475 -5.891 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.299 -2.402 -6.799 1.00 0.00 H new ATOM 1763 N ILE A 114 8.781 -2.216 -1.888 1.00 0.00 N ATOM 1764 CA ILE A 114 9.811 -2.009 -0.875 1.00 0.00 C ATOM 1765 C ILE A 114 10.132 -3.308 -0.144 1.00 0.00 C ATOM 1766 O ILE A 114 9.264 -4.165 0.036 1.00 0.00 O ATOM 1767 CB ILE A 114 9.385 -0.937 0.153 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.973 0.353 -0.556 1.00 0.00 C ATOM 1769 CG2 ILE A 114 10.503 -0.655 1.148 1.00 0.00 C ATOM 1770 CD1 ILE A 114 10.081 0.989 -1.370 1.00 0.00 C ATOM 0 H ILE A 114 7.936 -2.672 -1.542 1.00 0.00 H new ATOM 0 HA ILE A 114 10.703 -1.662 -1.396 1.00 0.00 H new ATOM 0 HB ILE A 114 8.528 -1.325 0.704 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.129 0.141 -1.213 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.626 1.070 0.188 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.175 0.103 1.859 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.753 -1.571 1.684 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.383 -0.295 0.614 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.710 1.899 -1.842 1.00 0.00 H new ATOM 0 HD12 ILE A 114 10.918 1.235 -0.716 1.00 0.00 H new ATOM 0 HD13 ILE A 114 10.414 0.292 -2.139 1.00 0.00 H new ATOM 1782 N SER A 115 11.386 -3.440 0.276 1.00 0.00 N ATOM 1783 CA SER A 115 11.839 -4.629 0.995 1.00 0.00 C ATOM 1784 C SER A 115 12.752 -4.249 2.162 1.00 0.00 C ATOM 1785 O SER A 115 13.651 -5.006 2.532 1.00 0.00 O ATOM 1786 CB SER A 115 12.565 -5.583 0.042 1.00 0.00 C ATOM 1787 OG SER A 115 13.619 -4.925 -0.640 1.00 0.00 O ATOM 0 H SER A 115 12.110 -2.736 0.131 1.00 0.00 H new ATOM 0 HA SER A 115 10.962 -5.135 1.400 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.964 -6.428 0.603 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.857 -5.987 -0.682 1.00 0.00 H new ATOM 0 HG SER A 115 14.066 -5.558 -1.240 1.00 0.00 H new ATOM 1793 N ASP A 116 12.507 -3.075 2.739 1.00 0.00 N ATOM 1794 CA ASP A 116 13.295 -2.586 3.866 1.00 0.00 C ATOM 1795 C ASP A 116 12.389 -1.986 4.937 1.00 0.00 C ATOM 1796 O ASP A 116 11.467 -1.228 4.627 1.00 0.00 O ATOM 1797 CB ASP A 116 14.309 -1.544 3.392 1.00 0.00 C ATOM 1798 CG ASP A 116 15.297 -1.168 4.476 1.00 0.00 C ATOM 1799 OD1 ASP A 116 16.182 -1.994 4.789 1.00 0.00 O ATOM 1800 OD2 ASP A 116 15.180 -0.052 5.019 1.00 0.00 O ATOM 0 H ASP A 116 11.764 -2.442 2.442 1.00 0.00 H new ATOM 0 HA ASP A 116 13.832 -3.430 4.300 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.850 -1.933 2.530 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.780 -0.651 3.060 1.00 0.00 H new ATOM 1805 N ARG A 117 12.654 -2.333 6.195 1.00 0.00 N ATOM 1806 CA ARG A 117 11.859 -1.831 7.314 1.00 0.00 C ATOM 1807 C ARG A 117 11.965 -0.311 7.435 1.00 0.00 C ATOM 1808 O ARG A 117 10.984 0.359 7.761 1.00 0.00 O ATOM 1809 CB ARG A 117 12.300 -2.487 8.624 1.00 0.00 C ATOM 1810 CG ARG A 117 11.143 -2.826 9.551 1.00 0.00 C ATOM 1811 CD ARG A 117 11.088 -4.315 9.860 1.00 0.00 C ATOM 1812 NE ARG A 117 12.008 -4.685 10.935 1.00 0.00 N ATOM 1813 CZ ARG A 117 11.787 -4.440 12.230 1.00 0.00 C ATOM 1814 NH1 ARG A 117 10.671 -3.832 12.621 1.00 0.00 N ATOM 1815 NH2 ARG A 117 12.687 -4.805 13.135 1.00 0.00 N ATOM 0 H ARG A 117 13.412 -2.959 6.465 1.00 0.00 H new ATOM 0 HA ARG A 117 10.818 -2.088 7.118 1.00 0.00 H new ATOM 0 HB2 ARG A 117 12.853 -3.399 8.397 1.00 0.00 H new ATOM 0 HB3 ARG A 117 12.987 -1.819 9.143 1.00 0.00 H new ATOM 0 HG2 ARG A 117 11.244 -2.265 10.480 1.00 0.00 H new ATOM 0 HG3 ARG A 117 10.205 -2.515 9.091 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.072 -4.590 10.142 1.00 0.00 H new ATOM 0 HD3 ARG A 117 11.334 -4.881 8.962 1.00 0.00 H new ATOM 0 HE ARG A 117 12.874 -5.160 10.680 1.00 0.00 H new ATOM 0 HH11 ARG A 117 9.976 -3.549 11.930 1.00 0.00 H new ATOM 0 HH12 ARG A 117 10.510 -3.649 13.611 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.545 -5.271 12.841 1.00 0.00 H new ATOM 0 HH22 ARG A 117 12.520 -4.619 14.124 1.00 0.00 H new ATOM 1829 N LYS A 118 13.156 0.229 7.166 1.00 0.00 N ATOM 1830 CA LYS A 118 13.372 1.673 7.242 1.00 0.00 C ATOM 1831 C LYS A 118 12.504 2.397 6.218 1.00 0.00 C ATOM 1832 O LYS A 118 11.826 3.371 6.548 1.00 0.00 O ATOM 1833 CB LYS A 118 14.848 2.016 7.017 1.00 0.00 C ATOM 1834 CG LYS A 118 15.247 3.380 7.558 1.00 0.00 C ATOM 1835 CD LYS A 118 16.521 3.892 6.902 1.00 0.00 C ATOM 1836 CE LYS A 118 16.772 5.353 7.239 1.00 0.00 C ATOM 1837 NZ LYS A 118 15.790 6.263 6.579 1.00 0.00 N ATOM 0 H LYS A 118 13.979 -0.309 6.896 1.00 0.00 H new ATOM 0 HA LYS A 118 13.089 2.005 8.241 1.00 0.00 H new ATOM 0 HB2 LYS A 118 15.466 1.252 7.490 1.00 0.00 H new ATOM 0 HB3 LYS A 118 15.061 1.982 5.949 1.00 0.00 H new ATOM 0 HG2 LYS A 118 14.438 4.091 7.387 1.00 0.00 H new ATOM 0 HG3 LYS A 118 15.393 3.316 8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 118 17.368 3.291 7.231 1.00 0.00 H new ATOM 0 HD3 LYS A 118 16.448 3.774 5.821 1.00 0.00 H new ATOM 0 HE2 LYS A 118 16.720 5.488 8.319 1.00 0.00 H new ATOM 0 HE3 LYS A 118 17.781 5.626 6.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 16.131 7.244 6.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 15.683 5.993 5.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 14.870 6.187 7.058 1.00 0.00 H new ATOM 1851 N GLU A 119 12.518 1.907 4.979 1.00 0.00 N ATOM 1852 CA GLU A 119 11.719 2.500 3.909 1.00 0.00 C ATOM 1853 C GLU A 119 10.228 2.246 4.138 1.00 0.00 C ATOM 1854 O GLU A 119 9.386 3.055 3.744 1.00 0.00 O ATOM 1855 CB GLU A 119 12.142 1.939 2.550 1.00 0.00 C ATOM 1856 CG GLU A 119 13.435 2.534 2.021 1.00 0.00 C ATOM 1857 CD GLU A 119 13.851 1.925 0.698 1.00 0.00 C ATOM 1858 OE1 GLU A 119 14.578 0.909 0.715 1.00 0.00 O ATOM 1859 OE2 GLU A 119 13.448 2.462 -0.355 1.00 0.00 O ATOM 0 H GLU A 119 13.074 1.101 4.692 1.00 0.00 H new ATOM 0 HA GLU A 119 11.893 3.576 3.916 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.257 0.858 2.632 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.346 2.121 1.828 1.00 0.00 H new ATOM 0 HG2 GLU A 119 13.314 3.611 1.900 1.00 0.00 H new ATOM 0 HG3 GLU A 119 14.228 2.382 2.753 1.00 0.00 H new ATOM 1866 N LEU A 120 9.910 1.121 4.784 1.00 0.00 N ATOM 1867 CA LEU A 120 8.522 0.760 5.076 1.00 0.00 C ATOM 1868 C LEU A 120 7.879 1.788 6.006 1.00 0.00 C ATOM 1869 O LEU A 120 6.680 2.054 5.915 1.00 0.00 O ATOM 1870 CB LEU A 120 8.454 -0.634 5.716 1.00 0.00 C ATOM 1871 CG LEU A 120 7.445 -1.598 5.085 1.00 0.00 C ATOM 1872 CD1 LEU A 120 7.461 -2.936 5.810 1.00 0.00 C ATOM 1873 CD2 LEU A 120 6.044 -0.997 5.105 1.00 0.00 C ATOM 0 H LEU A 120 10.597 0.444 5.115 1.00 0.00 H new ATOM 0 HA LEU A 120 7.972 0.747 4.135 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.444 -1.087 5.666 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.209 -0.519 6.772 1.00 0.00 H new ATOM 0 HG LEU A 120 7.732 -1.764 4.047 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.738 -3.609 5.348 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.457 -3.374 5.744 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.199 -2.785 6.857 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.341 -1.697 4.652 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.747 -0.800 6.135 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.040 -0.064 4.542 1.00 0.00 H new ATOM 1885 N GLU A 121 8.689 2.359 6.901 1.00 0.00 N ATOM 1886 CA GLU A 121 8.219 3.359 7.853 1.00 0.00 C ATOM 1887 C GLU A 121 7.377 4.429 7.160 1.00 0.00 C ATOM 1888 O GLU A 121 7.766 4.969 6.121 1.00 0.00 O ATOM 1889 CB GLU A 121 9.412 4.006 8.560 1.00 0.00 C ATOM 1890 CG GLU A 121 9.029 4.830 9.782 1.00 0.00 C ATOM 1891 CD GLU A 121 10.101 5.829 10.194 1.00 0.00 C ATOM 1892 OE1 GLU A 121 11.093 5.993 9.451 1.00 0.00 O ATOM 1893 OE2 GLU A 121 9.942 6.454 11.264 1.00 0.00 O ATOM 0 H GLU A 121 9.682 2.141 6.983 1.00 0.00 H new ATOM 0 HA GLU A 121 7.590 2.859 8.589 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.109 3.225 8.864 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.939 4.646 7.852 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.103 5.366 9.575 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.828 4.158 10.616 1.00 0.00 H new ATOM 1900 N GLU A 122 6.217 4.718 7.744 1.00 0.00 N ATOM 1901 CA GLU A 122 5.292 5.713 7.200 1.00 0.00 C ATOM 1902 C GLU A 122 5.987 7.047 6.925 1.00 0.00 C ATOM 1903 O GLU A 122 5.625 7.756 5.986 1.00 0.00 O ATOM 1904 CB GLU A 122 4.124 5.929 8.163 1.00 0.00 C ATOM 1905 CG GLU A 122 2.964 6.697 7.548 1.00 0.00 C ATOM 1906 CD GLU A 122 1.795 6.846 8.501 1.00 0.00 C ATOM 1907 OE1 GLU A 122 1.843 7.751 9.362 1.00 0.00 O ATOM 1908 OE2 GLU A 122 0.832 6.062 8.388 1.00 0.00 O ATOM 0 H GLU A 122 5.892 4.273 8.602 1.00 0.00 H new ATOM 0 HA GLU A 122 4.919 5.328 6.251 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.765 4.960 8.509 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.482 6.468 9.040 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.308 7.685 7.243 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.630 6.184 6.646 1.00 0.00 H new ATOM 1915 N ASN A 123 6.986 7.381 7.743 1.00 0.00 N ATOM 1916 CA ASN A 123 7.726 8.630 7.576 1.00 0.00 C ATOM 1917 C ASN A 123 8.355 8.693 6.188 1.00 0.00 C ATOM 1918 O ASN A 123 8.277 9.715 5.505 1.00 0.00 O ATOM 1919 CB ASN A 123 8.815 8.757 8.647 1.00 0.00 C ATOM 1920 CG ASN A 123 8.343 9.519 9.871 1.00 0.00 C ATOM 1921 OD1 ASN A 123 7.780 10.609 9.759 1.00 0.00 O ATOM 1922 ND2 ASN A 123 8.574 8.952 11.051 1.00 0.00 N ATOM 0 H ASN A 123 7.300 6.806 8.525 1.00 0.00 H new ATOM 0 HA ASN A 123 7.027 9.459 7.686 1.00 0.00 H new ATOM 0 HB2 ASN A 123 9.142 7.762 8.947 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.682 9.262 8.221 1.00 0.00 H new ATOM 0 HD21 ASN A 123 8.282 9.421 11.908 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.043 8.048 11.099 1.00 0.00 H new ATOM 1929 N PHE A 124 8.967 7.585 5.781 1.00 0.00 N ATOM 1930 CA PHE A 124 9.607 7.490 4.476 1.00 0.00 C ATOM 1931 C PHE A 124 8.571 7.542 3.352 1.00 0.00 C ATOM 1932 O PHE A 124 8.737 8.280 2.379 1.00 0.00 O ATOM 1933 CB PHE A 124 10.411 6.194 4.384 1.00 0.00 C ATOM 1934 CG PHE A 124 11.301 6.128 3.177 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.772 5.848 1.928 1.00 0.00 C ATOM 1936 CD2 PHE A 124 12.664 6.349 3.291 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.586 5.792 0.813 1.00 0.00 C ATOM 1938 CE2 PHE A 124 13.483 6.294 2.180 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.942 6.014 0.940 1.00 0.00 C ATOM 0 H PHE A 124 9.032 6.736 6.342 1.00 0.00 H new ATOM 0 HA PHE A 124 10.278 8.341 4.361 1.00 0.00 H new ATOM 0 HB2 PHE A 124 11.020 6.089 5.282 1.00 0.00 H new ATOM 0 HB3 PHE A 124 9.723 5.349 4.365 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.712 5.671 1.824 1.00 0.00 H new ATOM 0 HD2 PHE A 124 13.091 6.567 4.259 1.00 0.00 H new ATOM 0 HE1 PHE A 124 11.162 5.575 -0.156 1.00 0.00 H new ATOM 0 HE2 PHE A 124 14.544 6.469 2.280 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.580 5.969 0.070 1.00 0.00 H new ATOM 1949 N ILE A 125 7.506 6.752 3.498 1.00 0.00 N ATOM 1950 CA ILE A 125 6.439 6.700 2.501 1.00 0.00 C ATOM 1951 C ILE A 125 5.791 8.071 2.315 1.00 0.00 C ATOM 1952 O ILE A 125 5.603 8.529 1.186 1.00 0.00 O ATOM 1953 CB ILE A 125 5.348 5.677 2.890 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.971 4.303 3.162 1.00 0.00 C ATOM 1955 CG2 ILE A 125 4.295 5.579 1.793 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.963 3.253 3.581 1.00 0.00 C ATOM 0 H ILE A 125 7.361 6.138 4.300 1.00 0.00 H new ATOM 0 HA ILE A 125 6.900 6.387 1.564 1.00 0.00 H new ATOM 0 HB ILE A 125 4.863 6.021 3.804 1.00 0.00 H new ATOM 0 HG12 ILE A 125 6.486 3.962 2.264 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.725 4.403 3.943 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.534 4.854 2.083 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.830 6.554 1.646 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.766 5.258 0.864 1.00 0.00 H new ATOM 0 HD11 ILE A 125 5.475 2.307 3.756 1.00 0.00 H new ATOM 0 HD12 ILE A 125 4.465 3.572 4.497 1.00 0.00 H new ATOM 0 HD13 ILE A 125 4.223 3.124 2.792 1.00 0.00 H new ATOM 1968 N LYS A 126 5.450 8.717 3.429 1.00 0.00 N ATOM 1969 CA LYS A 126 4.821 10.034 3.395 1.00 0.00 C ATOM 1970 C LYS A 126 5.741 11.067 2.751 1.00 0.00 C ATOM 1971 O LYS A 126 5.292 11.898 1.961 1.00 0.00 O ATOM 1972 CB LYS A 126 4.439 10.478 4.807 1.00 0.00 C ATOM 1973 CG LYS A 126 3.323 11.509 4.839 1.00 0.00 C ATOM 1974 CD LYS A 126 3.347 12.315 6.127 1.00 0.00 C ATOM 1975 CE LYS A 126 1.943 12.694 6.574 1.00 0.00 C ATOM 1976 NZ LYS A 126 1.888 14.077 7.127 1.00 0.00 N ATOM 0 H LYS A 126 5.600 8.348 4.368 1.00 0.00 H new ATOM 0 HA LYS A 126 3.917 9.959 2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.132 9.605 5.383 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.319 10.892 5.299 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.422 12.181 3.986 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.360 11.008 4.740 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.836 11.736 6.911 1.00 0.00 H new ATOM 0 HD3 LYS A 126 3.940 13.218 5.981 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.259 12.614 5.729 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.600 11.987 7.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 0.914 14.295 7.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 2.521 14.147 7.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 2.191 14.755 6.398 1.00 0.00 H new ATOM 1990 N SER A 127 7.031 11.009 3.089 1.00 0.00 N ATOM 1991 CA SER A 127 8.009 11.942 2.534 1.00 0.00 C ATOM 1992 C SER A 127 8.106 11.785 1.018 1.00 0.00 C ATOM 1993 O SER A 127 8.111 12.774 0.283 1.00 0.00 O ATOM 1994 CB SER A 127 9.383 11.720 3.173 1.00 0.00 C ATOM 1995 OG SER A 127 10.083 12.944 3.313 1.00 0.00 O ATOM 0 H SER A 127 7.420 10.328 3.742 1.00 0.00 H new ATOM 0 HA SER A 127 7.676 12.955 2.758 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.262 11.253 4.150 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.966 11.032 2.561 1.00 0.00 H new ATOM 0 HG SER A 127 10.956 12.776 3.725 1.00 0.00 H new ATOM 2001 N GLU A 128 8.176 10.534 0.560 1.00 0.00 N ATOM 2002 CA GLU A 128 8.267 10.237 -0.868 1.00 0.00 C ATOM 2003 C GLU A 128 7.012 10.706 -1.601 1.00 0.00 C ATOM 2004 O GLU A 128 7.100 11.395 -2.618 1.00 0.00 O ATOM 2005 CB GLU A 128 8.471 8.733 -1.080 1.00 0.00 C ATOM 2006 CG GLU A 128 8.793 8.354 -2.517 1.00 0.00 C ATOM 2007 CD GLU A 128 9.893 7.316 -2.611 1.00 0.00 C ATOM 2008 OE1 GLU A 128 9.609 6.125 -2.365 1.00 0.00 O ATOM 2009 OE2 GLU A 128 11.040 7.693 -2.932 1.00 0.00 O ATOM 0 H GLU A 128 8.171 9.709 1.160 1.00 0.00 H new ATOM 0 HA GLU A 128 9.123 10.774 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 128 9.279 8.391 -0.434 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.569 8.206 -0.768 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.894 7.970 -2.998 1.00 0.00 H new ATOM 0 HG3 GLU A 128 9.092 9.247 -3.066 1.00 0.00 H new ATOM 2016 N LEU A 129 5.845 10.332 -1.074 1.00 0.00 N ATOM 2017 CA LEU A 129 4.569 10.718 -1.675 1.00 0.00 C ATOM 2018 C LEU A 129 4.405 12.235 -1.689 1.00 0.00 C ATOM 2019 O LEU A 129 3.863 12.800 -2.641 1.00 0.00 O ATOM 2020 CB LEU A 129 3.405 10.075 -0.917 1.00 0.00 C ATOM 2021 CG LEU A 129 2.314 9.468 -1.804 1.00 0.00 C ATOM 2022 CD1 LEU A 129 2.553 7.979 -2.000 1.00 0.00 C ATOM 2023 CD2 LEU A 129 0.939 9.714 -1.202 1.00 0.00 C ATOM 0 H LEU A 129 5.758 9.762 -0.232 1.00 0.00 H new ATOM 0 HA LEU A 129 4.564 10.362 -2.705 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.801 9.294 -0.267 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.951 10.827 -0.272 1.00 0.00 H new ATOM 0 HG LEU A 129 2.354 9.953 -2.779 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.768 7.565 -2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.522 7.826 -2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 129 2.541 7.478 -1.032 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.176 9.276 -1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.887 9.256 -0.214 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.767 10.787 -1.114 1.00 0.00 H new ATOM 2035 N LYS A 130 4.881 12.890 -0.627 1.00 0.00 N ATOM 2036 CA LYS A 130 4.797 14.344 -0.515 1.00 0.00 C ATOM 2037 C LYS A 130 5.492 15.023 -1.692 1.00 0.00 C ATOM 2038 O LYS A 130 5.005 16.026 -2.217 1.00 0.00 O ATOM 2039 CB LYS A 130 5.425 14.810 0.802 1.00 0.00 C ATOM 2040 CG LYS A 130 5.214 16.287 1.089 1.00 0.00 C ATOM 2041 CD LYS A 130 5.949 16.719 2.347 1.00 0.00 C ATOM 2042 CE LYS A 130 5.751 18.201 2.626 1.00 0.00 C ATOM 2043 NZ LYS A 130 6.893 19.020 2.135 1.00 0.00 N ATOM 0 H LYS A 130 5.329 12.433 0.168 1.00 0.00 H new ATOM 0 HA LYS A 130 3.744 14.625 -0.529 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.006 14.226 1.621 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.495 14.603 0.778 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.563 16.877 0.242 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.149 16.489 1.201 1.00 0.00 H new ATOM 0 HD2 LYS A 130 5.592 16.137 3.196 1.00 0.00 H new ATOM 0 HD3 LYS A 130 7.013 16.507 2.239 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.831 18.540 2.149 1.00 0.00 H new ATOM 0 HE3 LYS A 130 5.630 18.355 3.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.717 20.023 2.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 7.768 18.715 2.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.994 18.895 1.108 1.00 0.00 H new