USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 799 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 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.0851 X(o=-0.085,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -149:sc= -2.65! (180deg=-3.96!) USER MOD Single : A 25 GLN : amide:sc= -0.192 K(o=-0.19,f=-1.9!) USER MOD Single : A 26 ASN : amide:sc= -0.483 K(o=-0.48,f=-3.7!) USER MOD Single : A 33 LYS NZ :NH3+ -159:sc= -0.202 (180deg=-0.896) USER MOD Single : A 46 GLN : amide:sc= -0.0464 K(o=-0.046,f=-0.83) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -170:sc= -1.28 (180deg=-1.51) USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.252 USER MOD Single : A 52 HIS : no HD1:sc= -9.38! C(o=-9.4!,f=-13!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ -142:sc= 1.21 (180deg=0.44) USER MOD Single : A 58 TYR OH : rot -158:sc= 0.205 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.881 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 136:sc= 0.72 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.777 K(o=-0.78,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= -0.0397 USER MOD Single : A 96 HIS : no HD1:sc= -0.344 X(o=-0.34,f=-0.65) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 34 N VAL A 3 -25.112 -12.162 6.354 1.00 0.00 N ATOM 35 CA VAL A 3 -24.576 -13.399 5.716 1.00 0.00 C ATOM 36 C VAL A 3 -23.090 -13.223 5.388 1.00 0.00 C ATOM 37 O VAL A 3 -22.631 -12.133 5.109 1.00 0.00 O ATOM 38 CB VAL A 3 -25.391 -13.569 4.435 1.00 0.00 C ATOM 39 CG1 VAL A 3 -26.869 -13.748 4.788 1.00 0.00 C ATOM 40 CG2 VAL A 3 -25.225 -12.326 3.557 1.00 0.00 C ATOM 0 HA VAL A 3 -24.657 -14.269 6.368 1.00 0.00 H new ATOM 0 HB VAL A 3 -25.038 -14.447 3.895 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -27.449 -13.869 3.873 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -26.989 -14.632 5.414 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -27.223 -12.870 5.329 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -25.806 -12.446 2.643 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -25.578 -11.448 4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -24.173 -12.197 3.304 1.00 0.00 H new ATOM 50 N LYS A 4 -22.337 -14.288 5.418 1.00 0.00 N ATOM 51 CA LYS A 4 -20.882 -14.182 5.108 1.00 0.00 C ATOM 52 C LYS A 4 -20.643 -14.435 3.617 1.00 0.00 C ATOM 53 O LYS A 4 -21.394 -15.137 2.969 1.00 0.00 O ATOM 54 CB LYS A 4 -20.217 -15.270 5.951 1.00 0.00 C ATOM 55 CG LYS A 4 -18.947 -14.712 6.597 1.00 0.00 C ATOM 56 CD LYS A 4 -17.898 -15.820 6.705 1.00 0.00 C ATOM 57 CE LYS A 4 -17.524 -16.028 8.174 1.00 0.00 C ATOM 58 NZ LYS A 4 -18.510 -17.021 8.685 1.00 0.00 N ATOM 0 H LYS A 4 -22.666 -15.227 5.644 1.00 0.00 H new ATOM 0 HA LYS A 4 -20.481 -13.193 5.332 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -20.905 -15.620 6.720 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -19.973 -16.130 5.327 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -18.558 -13.885 6.003 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -19.174 -14.315 7.586 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -18.288 -16.747 6.283 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -17.013 -15.555 6.127 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -16.504 -16.398 8.273 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -17.580 -15.093 8.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -18.318 -17.216 9.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -19.472 -16.639 8.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -18.429 -17.903 8.140 1.00 0.00 H new ATOM 72 N CYS A 5 -19.602 -13.870 3.068 1.00 0.00 N ATOM 73 CA CYS A 5 -19.319 -14.080 1.620 1.00 0.00 C ATOM 74 C CYS A 5 -18.000 -14.846 1.443 1.00 0.00 C ATOM 75 O CYS A 5 -17.073 -14.652 2.205 1.00 0.00 O ATOM 76 CB CYS A 5 -19.201 -12.673 1.031 1.00 0.00 C ATOM 77 SG CYS A 5 -20.854 -11.980 0.780 1.00 0.00 S ATOM 0 H CYS A 5 -18.936 -13.273 3.559 1.00 0.00 H new ATOM 0 HA CYS A 5 -20.096 -14.665 1.129 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -18.626 -12.034 1.701 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -18.663 -12.708 0.084 1.00 0.00 H new ATOM 82 N PRO A 6 -17.948 -15.691 0.439 1.00 0.00 N ATOM 83 CA PRO A 6 -19.106 -15.897 -0.469 1.00 0.00 C ATOM 84 C PRO A 6 -20.177 -16.749 0.222 1.00 0.00 C ATOM 85 O PRO A 6 -19.939 -17.343 1.253 1.00 0.00 O ATOM 86 CB PRO A 6 -18.504 -16.645 -1.653 1.00 0.00 C ATOM 87 CG PRO A 6 -17.295 -17.336 -1.107 1.00 0.00 C ATOM 88 CD PRO A 6 -16.800 -16.524 0.064 1.00 0.00 C ATOM 0 HA PRO A 6 -19.593 -14.967 -0.761 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -19.213 -17.361 -2.068 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.236 -15.959 -2.457 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -17.542 -18.350 -0.793 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.522 -17.418 -1.871 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.487 -17.165 0.888 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -15.939 -15.914 -0.210 1.00 0.00 H new ATOM 96 N GLY A 7 -21.353 -16.812 -0.340 1.00 0.00 N ATOM 97 CA GLY A 7 -22.433 -17.627 0.289 1.00 0.00 C ATOM 98 C GLY A 7 -23.697 -17.559 -0.569 1.00 0.00 C ATOM 99 O GLY A 7 -24.027 -16.531 -1.126 1.00 0.00 O ATOM 0 H GLY A 7 -21.613 -16.337 -1.204 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.107 -18.662 0.392 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.643 -17.257 1.293 1.00 0.00 H new ATOM 103 N GLU A 8 -24.410 -18.647 -0.677 1.00 0.00 N ATOM 104 CA GLU A 8 -25.657 -18.644 -1.497 1.00 0.00 C ATOM 105 C GLU A 8 -26.881 -18.489 -0.590 1.00 0.00 C ATOM 106 O GLU A 8 -26.825 -18.755 0.594 1.00 0.00 O ATOM 107 CB GLU A 8 -25.675 -20.004 -2.196 1.00 0.00 C ATOM 108 CG GLU A 8 -26.322 -19.861 -3.576 1.00 0.00 C ATOM 109 CD GLU A 8 -26.107 -21.145 -4.376 1.00 0.00 C ATOM 110 OE1 GLU A 8 -26.297 -22.210 -3.813 1.00 0.00 O ATOM 111 OE2 GLU A 8 -25.757 -21.042 -5.541 1.00 0.00 O ATOM 0 H GLU A 8 -24.184 -19.537 -0.234 1.00 0.00 H new ATOM 0 HA GLU A 8 -25.682 -17.820 -2.211 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -24.659 -20.386 -2.297 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -26.229 -20.726 -1.596 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -27.388 -19.660 -3.470 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -25.889 -19.013 -4.106 1.00 0.00 H new ATOM 118 N TYR A 9 -27.986 -18.063 -1.137 1.00 0.00 N ATOM 119 CA TYR A 9 -29.211 -17.891 -0.304 1.00 0.00 C ATOM 120 C TYR A 9 -30.455 -17.839 -1.197 1.00 0.00 C ATOM 121 O TYR A 9 -30.362 -17.692 -2.399 1.00 0.00 O ATOM 122 CB TYR A 9 -29.015 -16.560 0.421 1.00 0.00 C ATOM 123 CG TYR A 9 -28.484 -16.818 1.812 1.00 0.00 C ATOM 124 CD1 TYR A 9 -29.337 -17.314 2.806 1.00 0.00 C ATOM 125 CD2 TYR A 9 -27.139 -16.560 2.107 1.00 0.00 C ATOM 126 CE1 TYR A 9 -28.845 -17.553 4.096 1.00 0.00 C ATOM 127 CE2 TYR A 9 -26.647 -16.799 3.397 1.00 0.00 C ATOM 128 CZ TYR A 9 -27.499 -17.296 4.392 1.00 0.00 C ATOM 129 OH TYR A 9 -27.014 -17.530 5.662 1.00 0.00 O ATOM 0 H TYR A 9 -28.094 -17.827 -2.123 1.00 0.00 H new ATOM 0 HA TYR A 9 -29.355 -18.716 0.393 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -28.320 -15.930 -0.134 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -29.961 -16.020 0.475 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -30.374 -17.512 2.578 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -26.482 -16.177 1.340 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -29.503 -17.935 4.862 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -25.610 -16.600 3.624 1.00 0.00 H new ATOM 0 HH TYR A 9 -26.062 -17.300 5.696 1.00 0.00 H new ATOM 139 N GLN A 10 -31.618 -17.957 -0.617 1.00 0.00 N ATOM 140 CA GLN A 10 -32.865 -17.913 -1.432 1.00 0.00 C ATOM 141 C GLN A 10 -33.658 -16.642 -1.119 1.00 0.00 C ATOM 142 O GLN A 10 -33.988 -16.368 0.018 1.00 0.00 O ATOM 143 CB GLN A 10 -33.655 -19.154 -1.014 1.00 0.00 C ATOM 144 CG GLN A 10 -32.775 -20.396 -1.170 1.00 0.00 C ATOM 145 CD GLN A 10 -32.862 -21.246 0.098 1.00 0.00 C ATOM 146 OE1 GLN A 10 -33.299 -22.379 0.055 1.00 0.00 O ATOM 147 NE2 GLN A 10 -32.461 -20.745 1.234 1.00 0.00 N ATOM 0 H GLN A 10 -31.759 -18.082 0.386 1.00 0.00 H new ATOM 0 HA GLN A 10 -32.658 -17.902 -2.502 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -33.985 -19.057 0.020 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -34.551 -19.251 -1.627 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -33.098 -20.978 -2.033 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -31.742 -20.102 -1.353 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -32.094 -19.794 1.271 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -32.514 -21.304 2.085 1.00 0.00 H new ATOM 156 N VAL A 11 -33.967 -15.864 -2.119 1.00 0.00 N ATOM 157 CA VAL A 11 -34.739 -14.610 -1.878 1.00 0.00 C ATOM 158 C VAL A 11 -36.221 -14.833 -2.196 1.00 0.00 C ATOM 159 O VAL A 11 -36.636 -14.778 -3.336 1.00 0.00 O ATOM 160 CB VAL A 11 -34.135 -13.583 -2.834 1.00 0.00 C ATOM 161 CG1 VAL A 11 -35.067 -12.375 -2.944 1.00 0.00 C ATOM 162 CG2 VAL A 11 -32.775 -13.129 -2.299 1.00 0.00 C ATOM 0 H VAL A 11 -33.719 -16.041 -3.092 1.00 0.00 H new ATOM 0 HA VAL A 11 -34.682 -14.283 -0.840 1.00 0.00 H new ATOM 0 HB VAL A 11 -34.009 -14.034 -3.818 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -34.635 -11.643 -3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -36.037 -12.697 -3.324 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -35.194 -11.923 -1.960 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -32.342 -12.396 -2.980 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -32.903 -12.679 -1.315 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -32.109 -13.989 -2.221 1.00 0.00 H new ATOM 172 N ASP A 12 -37.021 -15.085 -1.196 1.00 0.00 N ATOM 173 CA ASP A 12 -38.474 -15.312 -1.443 1.00 0.00 C ATOM 174 C ASP A 12 -38.667 -16.214 -2.665 1.00 0.00 C ATOM 175 O ASP A 12 -39.072 -15.767 -3.720 1.00 0.00 O ATOM 176 CB ASP A 12 -39.052 -13.920 -1.706 1.00 0.00 C ATOM 177 CG ASP A 12 -40.574 -13.965 -1.562 1.00 0.00 C ATOM 178 OD1 ASP A 12 -41.039 -14.200 -0.459 1.00 0.00 O ATOM 179 OD2 ASP A 12 -41.250 -13.761 -2.558 1.00 0.00 O ATOM 0 H ASP A 12 -36.732 -15.144 -0.220 1.00 0.00 H new ATOM 0 HA ASP A 12 -38.965 -15.805 -0.604 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -38.631 -13.201 -1.004 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -38.780 -13.585 -2.707 1.00 0.00 H new ATOM 184 N GLY A 13 -38.380 -17.480 -2.531 1.00 0.00 N ATOM 185 CA GLY A 13 -38.547 -18.408 -3.685 1.00 0.00 C ATOM 186 C GLY A 13 -37.645 -17.960 -4.836 1.00 0.00 C ATOM 187 O GLY A 13 -38.100 -17.720 -5.937 1.00 0.00 O ATOM 0 H GLY A 13 -38.037 -17.912 -1.673 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -38.295 -19.425 -3.386 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -39.588 -18.419 -4.008 1.00 0.00 H new ATOM 191 N LYS A 14 -36.369 -17.844 -4.591 1.00 0.00 N ATOM 192 CA LYS A 14 -35.438 -17.410 -5.673 1.00 0.00 C ATOM 193 C LYS A 14 -34.028 -17.944 -5.406 1.00 0.00 C ATOM 194 O LYS A 14 -33.744 -18.475 -4.351 1.00 0.00 O ATOM 195 CB LYS A 14 -35.452 -15.883 -5.616 1.00 0.00 C ATOM 196 CG LYS A 14 -34.796 -15.319 -6.879 1.00 0.00 C ATOM 197 CD LYS A 14 -35.642 -14.165 -7.423 1.00 0.00 C ATOM 198 CE LYS A 14 -36.780 -14.725 -8.279 1.00 0.00 C ATOM 199 NZ LYS A 14 -36.370 -14.456 -9.685 1.00 0.00 N ATOM 0 H LYS A 14 -35.930 -18.031 -3.689 1.00 0.00 H new ATOM 0 HA LYS A 14 -35.738 -17.785 -6.651 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -36.477 -15.521 -5.533 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -34.919 -15.537 -4.731 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -33.788 -14.970 -6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -34.701 -16.101 -7.632 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -36.048 -13.578 -6.599 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -35.022 -13.494 -8.018 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -36.917 -15.792 -8.105 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -37.727 -14.239 -8.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -37.101 -14.812 -10.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -36.254 -13.432 -9.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -35.469 -14.936 -9.882 1.00 0.00 H new ATOM 213 N LYS A 15 -33.142 -17.805 -6.355 1.00 0.00 N ATOM 214 CA LYS A 15 -31.750 -18.303 -6.155 1.00 0.00 C ATOM 215 C LYS A 15 -30.748 -17.163 -6.358 1.00 0.00 C ATOM 216 O LYS A 15 -30.712 -16.534 -7.397 1.00 0.00 O ATOM 217 CB LYS A 15 -31.560 -19.383 -7.221 1.00 0.00 C ATOM 218 CG LYS A 15 -32.222 -20.681 -6.758 1.00 0.00 C ATOM 219 CD LYS A 15 -31.170 -21.789 -6.671 1.00 0.00 C ATOM 220 CE LYS A 15 -31.851 -23.111 -6.306 1.00 0.00 C ATOM 221 NZ LYS A 15 -31.847 -23.149 -4.818 1.00 0.00 N ATOM 0 H LYS A 15 -33.321 -17.369 -7.259 1.00 0.00 H new ATOM 0 HA LYS A 15 -31.589 -18.691 -5.149 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -31.996 -19.057 -8.165 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -30.498 -19.548 -7.401 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -32.693 -20.535 -5.786 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -33.011 -20.968 -7.454 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -30.649 -21.887 -7.624 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -30.420 -21.535 -5.922 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -32.867 -23.153 -6.699 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -31.312 -23.961 -6.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -32.298 -24.027 -4.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -30.867 -23.114 -4.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -32.373 -22.332 -4.448 1.00 0.00 H new ATOM 235 N VAL A 16 -29.935 -16.893 -5.374 1.00 0.00 N ATOM 236 CA VAL A 16 -28.937 -15.793 -5.513 1.00 0.00 C ATOM 237 C VAL A 16 -27.615 -16.195 -4.855 1.00 0.00 C ATOM 238 O VAL A 16 -27.568 -16.544 -3.693 1.00 0.00 O ATOM 239 CB VAL A 16 -29.559 -14.602 -4.786 1.00 0.00 C ATOM 240 CG1 VAL A 16 -28.652 -13.379 -4.936 1.00 0.00 C ATOM 241 CG2 VAL A 16 -30.930 -14.295 -5.393 1.00 0.00 C ATOM 0 H VAL A 16 -29.918 -17.385 -4.481 1.00 0.00 H new ATOM 0 HA VAL A 16 -28.715 -15.563 -6.555 1.00 0.00 H new ATOM 0 HB VAL A 16 -29.672 -14.842 -3.729 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -29.097 -12.530 -4.417 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -27.675 -13.596 -4.505 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -28.537 -13.138 -5.993 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -31.375 -13.445 -4.875 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -30.815 -14.056 -6.450 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -31.578 -15.165 -5.286 1.00 0.00 H new ATOM 251 N ILE A 17 -26.538 -16.150 -5.591 1.00 0.00 N ATOM 252 CA ILE A 17 -25.219 -16.529 -5.008 1.00 0.00 C ATOM 253 C ILE A 17 -24.372 -15.279 -4.760 1.00 0.00 C ATOM 254 O ILE A 17 -24.425 -14.323 -5.509 1.00 0.00 O ATOM 255 CB ILE A 17 -24.564 -17.422 -6.062 1.00 0.00 C ATOM 256 CG1 ILE A 17 -23.169 -17.832 -5.585 1.00 0.00 C ATOM 257 CG2 ILE A 17 -24.446 -16.655 -7.379 1.00 0.00 C ATOM 258 CD1 ILE A 17 -22.986 -19.339 -5.775 1.00 0.00 C ATOM 0 H ILE A 17 -26.514 -15.867 -6.571 1.00 0.00 H new ATOM 0 HA ILE A 17 -25.321 -17.037 -4.049 1.00 0.00 H new ATOM 0 HB ILE A 17 -25.174 -18.312 -6.214 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -22.408 -17.289 -6.145 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -23.040 -17.569 -4.535 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -23.979 -17.292 -8.130 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -25.439 -16.361 -7.719 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -23.836 -15.765 -7.228 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -21.992 -19.631 -5.435 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -23.739 -19.873 -5.195 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -23.096 -19.589 -6.830 1.00 0.00 H new ATOM 270 N LEU A 18 -23.591 -15.278 -3.715 1.00 0.00 N ATOM 271 CA LEU A 18 -22.742 -14.088 -3.420 1.00 0.00 C ATOM 272 C LEU A 18 -21.262 -14.432 -3.611 1.00 0.00 C ATOM 273 O LEU A 18 -20.698 -15.214 -2.872 1.00 0.00 O ATOM 274 CB LEU A 18 -23.029 -13.749 -1.957 1.00 0.00 C ATOM 275 CG LEU A 18 -24.354 -12.992 -1.859 1.00 0.00 C ATOM 276 CD1 LEU A 18 -24.647 -12.665 -0.394 1.00 0.00 C ATOM 277 CD2 LEU A 18 -24.258 -11.693 -2.661 1.00 0.00 C ATOM 0 H LEU A 18 -23.504 -16.049 -3.053 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.961 -13.251 -4.083 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -23.075 -14.662 -1.363 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -22.221 -13.143 -1.548 1.00 0.00 H new ATOM 0 HG LEU A 18 -25.157 -13.610 -2.261 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -25.591 -12.125 -0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -24.714 -13.590 0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -23.845 -12.046 0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -25.202 -11.152 -2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.456 -11.075 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -24.048 -11.925 -3.705 1.00 0.00 H new ATOM 289 N ASP A 19 -20.632 -13.852 -4.594 1.00 0.00 N ATOM 290 CA ASP A 19 -19.189 -14.146 -4.831 1.00 0.00 C ATOM 291 C ASP A 19 -18.366 -13.792 -3.590 1.00 0.00 C ATOM 292 O ASP A 19 -18.895 -13.638 -2.505 1.00 0.00 O ATOM 293 CB ASP A 19 -18.793 -13.255 -6.008 1.00 0.00 C ATOM 294 CG ASP A 19 -19.735 -13.517 -7.185 1.00 0.00 C ATOM 295 OD1 ASP A 19 -20.520 -14.447 -7.094 1.00 0.00 O ATOM 296 OD2 ASP A 19 -19.656 -12.782 -8.156 1.00 0.00 O ATOM 0 H ASP A 19 -21.052 -13.187 -5.244 1.00 0.00 H new ATOM 0 HA ASP A 19 -19.011 -15.201 -5.039 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -18.841 -12.206 -5.716 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -17.763 -13.457 -6.301 1.00 0.00 H new ATOM 301 N GLU A 20 -17.077 -13.661 -3.738 1.00 0.00 N ATOM 302 CA GLU A 20 -16.222 -13.317 -2.566 1.00 0.00 C ATOM 303 C GLU A 20 -16.565 -11.916 -2.055 1.00 0.00 C ATOM 304 O GLU A 20 -16.410 -11.615 -0.887 1.00 0.00 O ATOM 305 CB GLU A 20 -14.789 -13.360 -3.096 1.00 0.00 C ATOM 306 CG GLU A 20 -13.857 -13.898 -2.008 1.00 0.00 C ATOM 307 CD GLU A 20 -12.427 -13.428 -2.282 1.00 0.00 C ATOM 308 OE1 GLU A 20 -11.893 -13.790 -3.317 1.00 0.00 O ATOM 309 OE2 GLU A 20 -11.890 -12.717 -1.449 1.00 0.00 O ATOM 0 H GLU A 20 -16.578 -13.777 -4.620 1.00 0.00 H new ATOM 0 HA GLU A 20 -16.368 -14.003 -1.732 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.736 -13.994 -3.981 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -14.472 -12.362 -3.400 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.184 -13.549 -1.029 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -13.895 -14.987 -1.987 1.00 0.00 H new ATOM 316 N ASP A 21 -17.031 -11.055 -2.919 1.00 0.00 N ATOM 317 CA ASP A 21 -17.383 -9.674 -2.481 1.00 0.00 C ATOM 318 C ASP A 21 -18.904 -9.503 -2.440 1.00 0.00 C ATOM 319 O ASP A 21 -19.438 -8.508 -2.889 1.00 0.00 O ATOM 320 CB ASP A 21 -16.768 -8.755 -3.537 1.00 0.00 C ATOM 321 CG ASP A 21 -15.243 -8.825 -3.450 1.00 0.00 C ATOM 322 OD1 ASP A 21 -14.745 -9.791 -2.897 1.00 0.00 O ATOM 323 OD2 ASP A 21 -14.599 -7.912 -3.940 1.00 0.00 O ATOM 0 H ASP A 21 -17.183 -11.248 -3.909 1.00 0.00 H new ATOM 0 HA ASP A 21 -17.012 -9.451 -1.481 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -17.100 -9.053 -4.531 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -17.105 -7.730 -3.383 1.00 0.00 H new ATOM 328 N CYS A 22 -19.605 -10.465 -1.906 1.00 0.00 N ATOM 329 CA CYS A 22 -21.090 -10.358 -1.836 1.00 0.00 C ATOM 330 C CYS A 22 -21.644 -9.802 -3.151 1.00 0.00 C ATOM 331 O CYS A 22 -22.648 -9.118 -3.172 1.00 0.00 O ATOM 332 CB CYS A 22 -21.366 -9.386 -0.689 1.00 0.00 C ATOM 333 SG CYS A 22 -20.561 -9.983 0.818 1.00 0.00 S ATOM 0 H CYS A 22 -19.213 -11.322 -1.515 1.00 0.00 H new ATOM 0 HA CYS A 22 -21.564 -11.326 -1.674 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -20.995 -8.393 -0.943 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -22.440 -9.293 -0.528 1.00 0.00 H new ATOM 338 N PHE A 23 -20.999 -10.089 -4.249 1.00 0.00 N ATOM 339 CA PHE A 23 -21.492 -9.572 -5.559 1.00 0.00 C ATOM 340 C PHE A 23 -22.530 -10.530 -6.149 1.00 0.00 C ATOM 341 O PHE A 23 -22.415 -11.734 -6.034 1.00 0.00 O ATOM 342 CB PHE A 23 -20.253 -9.508 -6.452 1.00 0.00 C ATOM 343 CG PHE A 23 -20.608 -8.835 -7.756 1.00 0.00 C ATOM 344 CD1 PHE A 23 -21.169 -7.550 -7.751 1.00 0.00 C ATOM 345 CD2 PHE A 23 -20.379 -9.495 -8.970 1.00 0.00 C ATOM 346 CE1 PHE A 23 -21.500 -6.926 -8.962 1.00 0.00 C ATOM 347 CE2 PHE A 23 -20.709 -8.871 -10.180 1.00 0.00 C ATOM 348 CZ PHE A 23 -21.270 -7.587 -10.176 1.00 0.00 C ATOM 0 H PHE A 23 -20.154 -10.658 -4.296 1.00 0.00 H new ATOM 0 HA PHE A 23 -21.976 -8.600 -5.463 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -19.458 -8.957 -5.950 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -19.875 -10.513 -6.640 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -21.346 -7.041 -6.815 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -19.948 -10.485 -8.973 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -21.932 -5.936 -8.959 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -20.531 -9.380 -11.116 1.00 0.00 H new ATOM 0 HZ PHE A 23 -21.525 -7.107 -11.109 1.00 0.00 H new ATOM 358 N MET A 24 -23.544 -10.003 -6.781 1.00 0.00 N ATOM 359 CA MET A 24 -24.588 -10.883 -7.380 1.00 0.00 C ATOM 360 C MET A 24 -24.087 -11.477 -8.699 1.00 0.00 C ATOM 361 O MET A 24 -23.682 -10.765 -9.597 1.00 0.00 O ATOM 362 CB MET A 24 -25.786 -9.965 -7.627 1.00 0.00 C ATOM 363 CG MET A 24 -26.773 -10.654 -8.570 1.00 0.00 C ATOM 364 SD MET A 24 -28.379 -9.828 -8.472 1.00 0.00 S ATOM 365 CE MET A 24 -29.133 -10.939 -7.258 1.00 0.00 C ATOM 0 H MET A 24 -23.694 -9.002 -6.908 1.00 0.00 H new ATOM 0 HA MET A 24 -24.843 -11.721 -6.731 1.00 0.00 H new ATOM 0 HB2 MET A 24 -26.275 -9.727 -6.683 1.00 0.00 H new ATOM 0 HB3 MET A 24 -25.452 -9.022 -8.060 1.00 0.00 H new ATOM 0 HG2 MET A 24 -26.398 -10.622 -9.593 1.00 0.00 H new ATOM 0 HG3 MET A 24 -26.876 -11.705 -8.301 1.00 0.00 H new ATOM 0 HE1 MET A 24 -30.207 -10.994 -7.433 1.00 0.00 H new ATOM 0 HE2 MET A 24 -28.698 -11.934 -7.356 1.00 0.00 H new ATOM 0 HE3 MET A 24 -28.948 -10.559 -6.253 1.00 0.00 H new ATOM 375 N GLN A 25 -24.109 -12.776 -8.822 1.00 0.00 N ATOM 376 CA GLN A 25 -23.632 -13.413 -10.083 1.00 0.00 C ATOM 377 C GLN A 25 -24.815 -13.686 -11.017 1.00 0.00 C ATOM 378 O GLN A 25 -24.654 -14.209 -12.103 1.00 0.00 O ATOM 379 CB GLN A 25 -22.983 -14.725 -9.641 1.00 0.00 C ATOM 380 CG GLN A 25 -21.491 -14.694 -9.978 1.00 0.00 C ATOM 381 CD GLN A 25 -20.968 -16.125 -10.113 1.00 0.00 C ATOM 382 OE1 GLN A 25 -21.687 -17.010 -10.533 1.00 0.00 O ATOM 383 NE2 GLN A 25 -19.737 -16.392 -9.772 1.00 0.00 N ATOM 0 H GLN A 25 -24.436 -13.423 -8.105 1.00 0.00 H new ATOM 0 HA GLN A 25 -22.936 -12.778 -10.630 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -23.122 -14.869 -8.570 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -23.462 -15.567 -10.141 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -21.329 -14.147 -10.907 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -20.942 -14.167 -9.198 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -19.133 -15.650 -9.419 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -19.379 -17.343 -9.858 1.00 0.00 H new ATOM 392 N ASN A 26 -26.003 -13.337 -10.605 1.00 0.00 N ATOM 393 CA ASN A 26 -27.194 -13.577 -11.470 1.00 0.00 C ATOM 394 C ASN A 26 -27.896 -12.252 -11.785 1.00 0.00 C ATOM 395 O ASN A 26 -28.994 -12.007 -11.329 1.00 0.00 O ATOM 396 CB ASN A 26 -28.107 -14.483 -10.643 1.00 0.00 C ATOM 397 CG ASN A 26 -28.436 -15.744 -11.443 1.00 0.00 C ATOM 398 OD1 ASN A 26 -27.843 -15.997 -12.473 1.00 0.00 O ATOM 399 ND2 ASN A 26 -29.365 -16.553 -11.010 1.00 0.00 N ATOM 0 H ASN A 26 -26.201 -12.896 -9.707 1.00 0.00 H new ATOM 0 HA ASN A 26 -26.926 -14.029 -12.425 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -27.619 -14.751 -9.706 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -29.024 -13.954 -10.384 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -29.592 -17.397 -11.536 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -29.863 -16.341 -10.145 1.00 0.00 H new ATOM 406 N PRO A 27 -27.229 -11.441 -12.560 1.00 0.00 N ATOM 407 CA PRO A 27 -27.790 -10.122 -12.946 1.00 0.00 C ATOM 408 C PRO A 27 -28.923 -10.299 -13.962 1.00 0.00 C ATOM 409 O PRO A 27 -29.736 -9.418 -14.158 1.00 0.00 O ATOM 410 CB PRO A 27 -26.603 -9.399 -13.574 1.00 0.00 C ATOM 411 CG PRO A 27 -25.693 -10.487 -14.053 1.00 0.00 C ATOM 412 CD PRO A 27 -25.903 -11.670 -13.143 1.00 0.00 C ATOM 0 HA PRO A 27 -28.219 -9.576 -12.106 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -26.921 -8.760 -14.398 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -26.103 -8.758 -12.848 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -25.918 -10.751 -15.086 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.654 -10.160 -14.027 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -25.867 -12.609 -13.695 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -25.133 -11.723 -12.374 1.00 0.00 H new ATOM 420 N GLU A 28 -28.980 -11.431 -14.608 1.00 0.00 N ATOM 421 CA GLU A 28 -30.061 -11.663 -15.610 1.00 0.00 C ATOM 422 C GLU A 28 -31.424 -11.714 -14.915 1.00 0.00 C ATOM 423 O GLU A 28 -32.458 -11.641 -15.549 1.00 0.00 O ATOM 424 CB GLU A 28 -29.730 -13.015 -16.242 1.00 0.00 C ATOM 425 CG GLU A 28 -28.668 -12.823 -17.327 1.00 0.00 C ATOM 426 CD GLU A 28 -27.664 -13.974 -17.268 1.00 0.00 C ATOM 427 OE1 GLU A 28 -27.859 -14.865 -16.458 1.00 0.00 O ATOM 428 OE2 GLU A 28 -26.715 -13.947 -18.035 1.00 0.00 O ATOM 0 H GLU A 28 -28.327 -12.205 -14.486 1.00 0.00 H new ATOM 0 HA GLU A 28 -30.114 -10.867 -16.353 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -29.367 -13.706 -15.481 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -30.629 -13.458 -16.672 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -29.139 -12.787 -18.309 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -28.155 -11.872 -17.185 1.00 0.00 H new ATOM 435 N ASP A 29 -31.432 -11.839 -13.617 1.00 0.00 N ATOM 436 CA ASP A 29 -32.728 -11.895 -12.881 1.00 0.00 C ATOM 437 C ASP A 29 -32.892 -10.654 -12.000 1.00 0.00 C ATOM 438 O ASP A 29 -33.822 -10.550 -11.225 1.00 0.00 O ATOM 439 CB ASP A 29 -32.639 -13.155 -12.019 1.00 0.00 C ATOM 440 CG ASP A 29 -32.188 -14.335 -12.883 1.00 0.00 C ATOM 441 OD1 ASP A 29 -31.073 -14.292 -13.375 1.00 0.00 O ATOM 442 OD2 ASP A 29 -32.967 -15.261 -13.038 1.00 0.00 O ATOM 0 H ASP A 29 -30.598 -11.905 -13.033 1.00 0.00 H new ATOM 0 HA ASP A 29 -33.584 -11.920 -13.555 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -31.935 -13.000 -11.201 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -33.608 -13.370 -11.569 1.00 0.00 H new ATOM 447 N TRP A 30 -31.998 -9.711 -12.114 1.00 0.00 N ATOM 448 CA TRP A 30 -32.106 -8.476 -11.283 1.00 0.00 C ATOM 449 C TRP A 30 -33.541 -7.944 -11.314 1.00 0.00 C ATOM 450 O TRP A 30 -34.305 -8.245 -12.208 1.00 0.00 O ATOM 451 CB TRP A 30 -31.148 -7.477 -11.933 1.00 0.00 C ATOM 452 CG TRP A 30 -31.055 -6.252 -11.081 1.00 0.00 C ATOM 453 CD1 TRP A 30 -30.048 -5.980 -10.220 1.00 0.00 C ATOM 454 CD2 TRP A 30 -31.981 -5.131 -10.997 1.00 0.00 C ATOM 455 NE1 TRP A 30 -30.297 -4.764 -9.610 1.00 0.00 N ATOM 456 CE2 TRP A 30 -31.477 -4.201 -10.056 1.00 0.00 C ATOM 457 CE3 TRP A 30 -33.199 -4.833 -11.637 1.00 0.00 C ATOM 458 CZ2 TRP A 30 -32.156 -3.018 -9.762 1.00 0.00 C ATOM 459 CZ3 TRP A 30 -33.886 -3.644 -11.344 1.00 0.00 C ATOM 460 CH2 TRP A 30 -33.365 -2.737 -10.408 1.00 0.00 C ATOM 0 H TRP A 30 -31.198 -9.741 -12.746 1.00 0.00 H new ATOM 0 HA TRP A 30 -31.857 -8.657 -10.237 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -30.162 -7.926 -12.052 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -31.501 -7.214 -12.930 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -29.190 -6.610 -10.038 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -29.685 -4.335 -8.916 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -33.608 -5.524 -12.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -31.751 -2.324 -9.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -34.820 -3.426 -11.841 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -33.897 -1.823 -10.187 1.00 0.00 H new ATOM 471 N ASP A 31 -33.912 -7.155 -10.342 1.00 0.00 N ATOM 472 CA ASP A 31 -35.299 -6.606 -10.318 1.00 0.00 C ATOM 473 C ASP A 31 -35.507 -5.746 -9.069 1.00 0.00 C ATOM 474 O ASP A 31 -34.603 -5.547 -8.282 1.00 0.00 O ATOM 475 CB ASP A 31 -36.209 -7.834 -10.283 1.00 0.00 C ATOM 476 CG ASP A 31 -36.883 -8.010 -11.644 1.00 0.00 C ATOM 477 OD1 ASP A 31 -36.465 -7.347 -12.580 1.00 0.00 O ATOM 478 OD2 ASP A 31 -37.804 -8.804 -11.729 1.00 0.00 O ATOM 0 H ASP A 31 -33.317 -6.867 -9.565 1.00 0.00 H new ATOM 0 HA ASP A 31 -35.507 -5.969 -11.178 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -35.628 -8.723 -10.035 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -36.963 -7.719 -9.504 1.00 0.00 H new ATOM 483 N GLU A 32 -36.694 -5.237 -8.881 1.00 0.00 N ATOM 484 CA GLU A 32 -36.961 -4.390 -7.682 1.00 0.00 C ATOM 485 C GLU A 32 -36.771 -5.210 -6.404 1.00 0.00 C ATOM 486 O GLU A 32 -36.155 -4.765 -5.455 1.00 0.00 O ATOM 487 CB GLU A 32 -38.419 -3.951 -7.827 1.00 0.00 C ATOM 488 CG GLU A 32 -38.868 -3.239 -6.548 1.00 0.00 C ATOM 489 CD GLU A 32 -39.348 -1.828 -6.891 1.00 0.00 C ATOM 490 OE1 GLU A 32 -39.621 -1.582 -8.054 1.00 0.00 O ATOM 491 OE2 GLU A 32 -39.436 -1.016 -5.983 1.00 0.00 O ATOM 0 H GLU A 32 -37.490 -5.370 -9.505 1.00 0.00 H new ATOM 0 HA GLU A 32 -36.283 -3.539 -7.616 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -38.526 -3.285 -8.683 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -39.054 -4.817 -8.016 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -39.670 -3.801 -6.069 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -38.043 -3.191 -5.837 1.00 0.00 H new ATOM 498 N LYS A 33 -37.292 -6.406 -6.371 1.00 0.00 N ATOM 499 CA LYS A 33 -37.140 -7.255 -5.154 1.00 0.00 C ATOM 500 C LYS A 33 -35.661 -7.562 -4.906 1.00 0.00 C ATOM 501 O LYS A 33 -35.246 -7.800 -3.789 1.00 0.00 O ATOM 502 CB LYS A 33 -37.909 -8.538 -5.469 1.00 0.00 C ATOM 503 CG LYS A 33 -38.262 -9.256 -4.165 1.00 0.00 C ATOM 504 CD LYS A 33 -39.774 -9.486 -4.101 1.00 0.00 C ATOM 505 CE LYS A 33 -40.110 -10.852 -4.704 1.00 0.00 C ATOM 506 NZ LYS A 33 -40.125 -10.628 -6.177 1.00 0.00 N ATOM 0 H LYS A 33 -37.817 -6.833 -7.134 1.00 0.00 H new ATOM 0 HA LYS A 33 -37.517 -6.764 -4.257 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -38.817 -8.303 -6.024 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -37.307 -9.189 -6.103 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -37.736 -10.209 -4.108 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -37.938 -8.662 -3.311 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -40.116 -9.439 -3.067 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -40.295 -8.699 -4.645 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -39.368 -11.600 -4.426 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -41.075 -11.214 -4.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -40.676 -11.380 -6.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -40.558 -9.705 -6.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -39.151 -10.642 -6.540 1.00 0.00 H new ATOM 520 N VAL A 34 -34.865 -7.561 -5.939 1.00 0.00 N ATOM 521 CA VAL A 34 -33.413 -7.855 -5.764 1.00 0.00 C ATOM 522 C VAL A 34 -32.695 -6.652 -5.147 1.00 0.00 C ATOM 523 O VAL A 34 -32.122 -6.739 -4.079 1.00 0.00 O ATOM 524 CB VAL A 34 -32.894 -8.123 -7.175 1.00 0.00 C ATOM 525 CG1 VAL A 34 -31.406 -8.475 -7.114 1.00 0.00 C ATOM 526 CG2 VAL A 34 -33.668 -9.291 -7.790 1.00 0.00 C ATOM 0 H VAL A 34 -35.156 -7.369 -6.898 1.00 0.00 H new ATOM 0 HA VAL A 34 -33.241 -8.699 -5.097 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.032 -7.232 -7.787 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -31.036 -8.666 -8.121 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -30.853 -7.644 -6.676 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -31.268 -9.366 -6.501 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.298 -9.483 -8.797 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -33.530 -10.182 -7.177 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -34.728 -9.042 -7.834 1.00 0.00 H new ATOM 536 N ALA A 35 -32.718 -5.531 -5.814 1.00 0.00 N ATOM 537 CA ALA A 35 -32.033 -4.322 -5.269 1.00 0.00 C ATOM 538 C ALA A 35 -32.534 -4.017 -3.854 1.00 0.00 C ATOM 539 O ALA A 35 -31.817 -3.472 -3.038 1.00 0.00 O ATOM 540 CB ALA A 35 -32.409 -3.191 -6.225 1.00 0.00 C ATOM 0 H ALA A 35 -33.181 -5.399 -6.713 1.00 0.00 H new ATOM 0 HA ALA A 35 -30.954 -4.457 -5.199 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -31.943 -2.263 -5.893 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -32.061 -3.433 -7.229 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -33.492 -3.069 -6.236 1.00 0.00 H new ATOM 546 N GLU A 36 -33.757 -4.361 -3.557 1.00 0.00 N ATOM 547 CA GLU A 36 -34.297 -4.086 -2.194 1.00 0.00 C ATOM 548 C GLU A 36 -33.728 -5.087 -1.184 1.00 0.00 C ATOM 549 O GLU A 36 -33.082 -4.716 -0.225 1.00 0.00 O ATOM 550 CB GLU A 36 -35.810 -4.256 -2.326 1.00 0.00 C ATOM 551 CG GLU A 36 -36.395 -3.064 -3.085 1.00 0.00 C ATOM 552 CD GLU A 36 -37.447 -2.371 -2.219 1.00 0.00 C ATOM 553 OE1 GLU A 36 -37.428 -2.581 -1.018 1.00 0.00 O ATOM 554 OE2 GLU A 36 -38.254 -1.641 -2.772 1.00 0.00 O ATOM 0 H GLU A 36 -34.405 -4.820 -4.197 1.00 0.00 H new ATOM 0 HA GLU A 36 -34.028 -3.092 -1.837 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -36.038 -5.183 -2.853 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -36.265 -4.330 -1.339 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -35.603 -2.361 -3.345 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -36.843 -3.400 -4.020 1.00 0.00 H new ATOM 561 N TRP A 37 -33.965 -6.353 -1.391 1.00 0.00 N ATOM 562 CA TRP A 37 -33.439 -7.375 -0.440 1.00 0.00 C ATOM 563 C TRP A 37 -31.949 -7.140 -0.175 1.00 0.00 C ATOM 564 O TRP A 37 -31.463 -7.351 0.920 1.00 0.00 O ATOM 565 CB TRP A 37 -33.653 -8.716 -1.142 1.00 0.00 C ATOM 566 CG TRP A 37 -33.125 -9.819 -0.282 1.00 0.00 C ATOM 567 CD1 TRP A 37 -33.771 -10.350 0.781 1.00 0.00 C ATOM 568 CD2 TRP A 37 -31.860 -10.532 -0.391 1.00 0.00 C ATOM 569 NE1 TRP A 37 -32.982 -11.344 1.332 1.00 0.00 N ATOM 570 CE2 TRP A 37 -31.794 -11.494 0.645 1.00 0.00 C ATOM 571 CE3 TRP A 37 -30.772 -10.437 -1.280 1.00 0.00 C ATOM 572 CZ2 TRP A 37 -30.688 -12.333 0.794 1.00 0.00 C ATOM 573 CZ3 TRP A 37 -29.657 -11.281 -1.134 1.00 0.00 C ATOM 574 CH2 TRP A 37 -29.616 -12.227 -0.098 1.00 0.00 C ATOM 0 H TRP A 37 -34.499 -6.725 -2.176 1.00 0.00 H new ATOM 0 HA TRP A 37 -33.942 -7.334 0.526 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -34.714 -8.870 -1.339 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -33.146 -8.718 -2.107 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -34.743 -10.048 1.141 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -33.246 -11.898 2.146 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -30.794 -9.711 -2.079 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -30.660 -13.059 1.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -28.828 -11.201 -1.822 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -28.757 -12.873 0.010 1.00 0.00 H new ATOM 585 N LEU A 38 -31.221 -6.708 -1.166 1.00 0.00 N ATOM 586 CA LEU A 38 -29.762 -6.463 -0.969 1.00 0.00 C ATOM 587 C LEU A 38 -29.544 -5.208 -0.120 1.00 0.00 C ATOM 588 O LEU A 38 -28.823 -5.226 0.858 1.00 0.00 O ATOM 589 CB LEU A 38 -29.201 -6.263 -2.377 1.00 0.00 C ATOM 590 CG LEU A 38 -28.071 -7.264 -2.624 1.00 0.00 C ATOM 591 CD1 LEU A 38 -28.365 -8.061 -3.896 1.00 0.00 C ATOM 592 CD2 LEU A 38 -26.751 -6.509 -2.791 1.00 0.00 C ATOM 0 H LEU A 38 -31.571 -6.514 -2.104 1.00 0.00 H new ATOM 0 HA LEU A 38 -29.272 -7.286 -0.448 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -29.990 -6.399 -3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -28.830 -5.244 -2.491 1.00 0.00 H new ATOM 0 HG LEU A 38 -27.997 -7.946 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -27.560 -8.774 -4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -29.307 -8.598 -3.780 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -28.438 -7.380 -4.744 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -25.944 -7.221 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -26.826 -5.828 -3.639 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -26.541 -5.939 -1.886 1.00 0.00 H new ATOM 604 N ALA A 39 -30.159 -4.118 -0.488 1.00 0.00 N ATOM 605 CA ALA A 39 -29.983 -2.861 0.298 1.00 0.00 C ATOM 606 C ALA A 39 -30.352 -3.093 1.765 1.00 0.00 C ATOM 607 O ALA A 39 -29.838 -2.443 2.653 1.00 0.00 O ATOM 608 CB ALA A 39 -30.942 -1.858 -0.343 1.00 0.00 C ATOM 0 H ALA A 39 -30.775 -4.042 -1.297 1.00 0.00 H new ATOM 0 HA ALA A 39 -28.952 -2.508 0.285 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -30.873 -0.904 0.179 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -30.676 -1.718 -1.391 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -31.962 -2.236 -0.275 1.00 0.00 H new ATOM 614 N ARG A 40 -31.241 -4.012 2.027 1.00 0.00 N ATOM 615 CA ARG A 40 -31.643 -4.281 3.438 1.00 0.00 C ATOM 616 C ARG A 40 -30.568 -5.103 4.153 1.00 0.00 C ATOM 617 O ARG A 40 -30.003 -4.679 5.142 1.00 0.00 O ATOM 618 CB ARG A 40 -32.944 -5.077 3.332 1.00 0.00 C ATOM 619 CG ARG A 40 -33.529 -5.288 4.730 1.00 0.00 C ATOM 620 CD ARG A 40 -34.021 -6.730 4.866 1.00 0.00 C ATOM 621 NE ARG A 40 -33.160 -7.332 5.921 1.00 0.00 N ATOM 622 CZ ARG A 40 -33.648 -8.239 6.722 1.00 0.00 C ATOM 623 NH1 ARG A 40 -34.858 -8.110 7.195 1.00 0.00 N ATOM 624 NH2 ARG A 40 -32.926 -9.275 7.052 1.00 0.00 N ATOM 0 H ARG A 40 -31.706 -4.588 1.326 1.00 0.00 H new ATOM 0 HA ARG A 40 -31.770 -3.363 4.012 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -33.658 -4.545 2.704 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -32.756 -6.039 2.856 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -32.774 -5.077 5.487 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -34.352 -4.594 4.900 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -35.073 -6.763 5.149 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -33.927 -7.270 3.924 1.00 0.00 H new ATOM 0 HE ARG A 40 -32.189 -7.035 6.018 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -35.422 -7.300 6.938 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -35.239 -8.819 7.821 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -31.980 -9.376 6.684 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -33.308 -9.984 7.678 1.00 0.00 H new ATOM 638 N GLU A 41 -30.283 -6.278 3.663 1.00 0.00 N ATOM 639 CA GLU A 41 -29.249 -7.130 4.316 1.00 0.00 C ATOM 640 C GLU A 41 -27.937 -6.354 4.471 1.00 0.00 C ATOM 641 O GLU A 41 -27.146 -6.625 5.352 1.00 0.00 O ATOM 642 CB GLU A 41 -29.060 -8.318 3.371 1.00 0.00 C ATOM 643 CG GLU A 41 -29.874 -9.510 3.881 1.00 0.00 C ATOM 644 CD GLU A 41 -28.994 -10.383 4.775 1.00 0.00 C ATOM 645 OE1 GLU A 41 -28.235 -9.827 5.552 1.00 0.00 O ATOM 646 OE2 GLU A 41 -29.092 -11.595 4.668 1.00 0.00 O ATOM 0 H GLU A 41 -30.722 -6.686 2.837 1.00 0.00 H new ATOM 0 HA GLU A 41 -29.548 -7.446 5.315 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -29.380 -8.050 2.364 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -28.005 -8.584 3.310 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -30.742 -9.159 4.439 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -30.249 -10.094 3.041 1.00 0.00 H new ATOM 653 N LEU A 42 -27.698 -5.394 3.620 1.00 0.00 N ATOM 654 CA LEU A 42 -26.436 -4.606 3.720 1.00 0.00 C ATOM 655 C LEU A 42 -26.621 -3.419 4.670 1.00 0.00 C ATOM 656 O LEU A 42 -26.119 -3.413 5.776 1.00 0.00 O ATOM 657 CB LEU A 42 -26.158 -4.119 2.297 1.00 0.00 C ATOM 658 CG LEU A 42 -25.285 -5.142 1.569 1.00 0.00 C ATOM 659 CD1 LEU A 42 -26.077 -5.761 0.416 1.00 0.00 C ATOM 660 CD2 LEU A 42 -24.040 -4.445 1.016 1.00 0.00 C ATOM 0 H LEU A 42 -28.321 -5.121 2.860 1.00 0.00 H new ATOM 0 HA LEU A 42 -25.612 -5.199 4.116 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -27.096 -3.978 1.760 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -25.657 -3.151 2.324 1.00 0.00 H new ATOM 0 HG LEU A 42 -24.986 -5.926 2.265 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -25.455 -6.490 -0.103 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -26.965 -6.256 0.809 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -26.377 -4.978 -0.281 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -23.416 -5.172 0.497 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -24.340 -3.662 0.320 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -23.475 -4.003 1.837 1.00 0.00 H new ATOM 672 N GLU A 43 -27.335 -2.412 4.245 1.00 0.00 N ATOM 673 CA GLU A 43 -27.549 -1.225 5.123 1.00 0.00 C ATOM 674 C GLU A 43 -28.660 -1.507 6.139 1.00 0.00 C ATOM 675 O GLU A 43 -28.485 -1.341 7.328 1.00 0.00 O ATOM 676 CB GLU A 43 -27.961 -0.099 4.174 1.00 0.00 C ATOM 677 CG GLU A 43 -26.712 0.615 3.656 1.00 0.00 C ATOM 678 CD GLU A 43 -26.903 2.128 3.770 1.00 0.00 C ATOM 679 OE1 GLU A 43 -27.975 2.598 3.425 1.00 0.00 O ATOM 680 OE2 GLU A 43 -25.976 2.791 4.202 1.00 0.00 O ATOM 0 H GLU A 43 -27.779 -2.360 3.328 1.00 0.00 H new ATOM 0 HA GLU A 43 -26.657 -0.970 5.695 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -28.534 -0.504 3.340 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -28.609 0.608 4.692 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -25.839 0.304 4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -26.527 0.339 2.618 1.00 0.00 H new ATOM 687 N GLY A 44 -29.804 -1.936 5.677 1.00 0.00 N ATOM 688 CA GLY A 44 -30.924 -2.229 6.616 1.00 0.00 C ATOM 689 C GLY A 44 -32.170 -1.442 6.199 1.00 0.00 C ATOM 690 O GLY A 44 -33.034 -1.163 7.006 1.00 0.00 O ATOM 0 H GLY A 44 -30.011 -2.096 4.691 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -31.141 -3.297 6.616 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -30.637 -1.962 7.633 1.00 0.00 H new ATOM 694 N ILE A 45 -32.273 -1.084 4.948 1.00 0.00 N ATOM 695 CA ILE A 45 -33.467 -0.318 4.488 1.00 0.00 C ATOM 696 C ILE A 45 -34.690 -1.239 4.430 1.00 0.00 C ATOM 697 O ILE A 45 -35.019 -1.787 3.396 1.00 0.00 O ATOM 698 CB ILE A 45 -33.100 0.185 3.091 1.00 0.00 C ATOM 699 CG1 ILE A 45 -32.164 1.390 3.215 1.00 0.00 C ATOM 700 CG2 ILE A 45 -34.369 0.603 2.345 1.00 0.00 C ATOM 701 CD1 ILE A 45 -31.010 1.247 2.220 1.00 0.00 C ATOM 0 H ILE A 45 -31.583 -1.288 4.225 1.00 0.00 H new ATOM 0 HA ILE A 45 -33.720 0.503 5.159 1.00 0.00 H new ATOM 0 HB ILE A 45 -32.601 -0.612 2.539 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -32.713 2.311 3.021 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -31.775 1.459 4.231 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -34.105 0.961 1.350 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -35.038 -0.253 2.257 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -34.869 1.399 2.896 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -30.344 2.105 2.309 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -30.455 0.334 2.435 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -31.407 1.200 1.206 1.00 0.00 H new ATOM 713 N GLN A 46 -35.362 -1.416 5.535 1.00 0.00 N ATOM 714 CA GLN A 46 -36.562 -2.303 5.545 1.00 0.00 C ATOM 715 C GLN A 46 -37.437 -2.033 4.318 1.00 0.00 C ATOM 716 O GLN A 46 -38.115 -2.912 3.824 1.00 0.00 O ATOM 717 CB GLN A 46 -37.311 -1.939 6.828 1.00 0.00 C ATOM 718 CG GLN A 46 -36.557 -2.497 8.036 1.00 0.00 C ATOM 719 CD GLN A 46 -37.071 -1.825 9.313 1.00 0.00 C ATOM 720 OE1 GLN A 46 -37.256 -0.626 9.349 1.00 0.00 O ATOM 721 NE2 GLN A 46 -37.310 -2.555 10.368 1.00 0.00 N ATOM 0 H GLN A 46 -35.133 -0.986 6.431 1.00 0.00 H new ATOM 0 HA GLN A 46 -36.293 -3.359 5.513 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -37.404 -0.856 6.913 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -38.322 -2.344 6.798 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -36.697 -3.576 8.099 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -35.487 -2.320 7.924 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -37.154 -3.563 10.337 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -37.653 -2.118 11.224 1.00 0.00 H new ATOM 730 N LYS A 47 -37.427 -0.826 3.821 1.00 0.00 N ATOM 731 CA LYS A 47 -38.260 -0.506 2.627 1.00 0.00 C ATOM 732 C LYS A 47 -37.605 0.606 1.804 1.00 0.00 C ATOM 733 O LYS A 47 -37.529 1.743 2.228 1.00 0.00 O ATOM 734 CB LYS A 47 -39.600 -0.035 3.194 1.00 0.00 C ATOM 735 CG LYS A 47 -40.742 -0.639 2.374 1.00 0.00 C ATOM 736 CD LYS A 47 -42.022 -0.651 3.212 1.00 0.00 C ATOM 737 CE LYS A 47 -42.733 0.699 3.081 1.00 0.00 C ATOM 738 NZ LYS A 47 -44.032 0.518 3.786 1.00 0.00 N ATOM 0 H LYS A 47 -36.879 -0.049 4.190 1.00 0.00 H new ATOM 0 HA LYS A 47 -38.376 -1.363 1.964 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -39.690 -0.334 4.238 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -39.656 1.053 3.168 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -40.896 -0.060 1.464 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -40.486 -1.653 2.067 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -42.680 -1.454 2.879 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -41.783 -0.848 4.257 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -42.147 1.500 3.532 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -42.885 0.966 2.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -44.578 1.402 3.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -44.571 -0.246 3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -43.856 0.271 4.781 1.00 0.00 H new ATOM 752 N MET A 48 -37.131 0.290 0.630 1.00 0.00 N ATOM 753 CA MET A 48 -36.483 1.330 -0.219 1.00 0.00 C ATOM 754 C MET A 48 -37.373 2.575 -0.297 1.00 0.00 C ATOM 755 O MET A 48 -38.573 2.503 -0.124 1.00 0.00 O ATOM 756 CB MET A 48 -36.341 0.684 -1.596 1.00 0.00 C ATOM 757 CG MET A 48 -35.013 -0.073 -1.670 1.00 0.00 C ATOM 758 SD MET A 48 -33.659 1.103 -1.907 1.00 0.00 S ATOM 759 CE MET A 48 -33.592 1.012 -3.713 1.00 0.00 C ATOM 0 H MET A 48 -37.164 -0.644 0.222 1.00 0.00 H new ATOM 0 HA MET A 48 -35.521 1.651 0.180 1.00 0.00 H new ATOM 0 HB2 MET A 48 -37.171 0.001 -1.777 1.00 0.00 H new ATOM 0 HB3 MET A 48 -36.381 1.447 -2.373 1.00 0.00 H new ATOM 0 HG2 MET A 48 -34.857 -0.644 -0.755 1.00 0.00 H new ATOM 0 HG3 MET A 48 -35.035 -0.788 -2.492 1.00 0.00 H new ATOM 0 HE1 MET A 48 -32.702 1.530 -4.071 1.00 0.00 H new ATOM 0 HE2 MET A 48 -33.554 -0.032 -4.024 1.00 0.00 H new ATOM 0 HE3 MET A 48 -34.480 1.484 -4.134 1.00 0.00 H new ATOM 769 N THR A 49 -36.793 3.715 -0.556 1.00 0.00 N ATOM 770 CA THR A 49 -37.608 4.961 -0.645 1.00 0.00 C ATOM 771 C THR A 49 -37.732 5.411 -2.103 1.00 0.00 C ATOM 772 O THR A 49 -37.252 4.758 -3.008 1.00 0.00 O ATOM 773 CB THR A 49 -36.837 5.998 0.172 1.00 0.00 C ATOM 774 OG1 THR A 49 -37.493 7.255 0.078 1.00 0.00 O ATOM 775 CG2 THR A 49 -35.412 6.121 -0.368 1.00 0.00 C ATOM 0 H THR A 49 -35.792 3.838 -0.710 1.00 0.00 H new ATOM 0 HA THR A 49 -38.622 4.818 -0.270 1.00 0.00 H new ATOM 0 HB THR A 49 -36.800 5.684 1.215 1.00 0.00 H new ATOM 0 HG1 THR A 49 -37.001 7.921 0.603 1.00 0.00 H new ATOM 0 HG21 THR A 49 -34.864 6.861 0.216 1.00 0.00 H new ATOM 0 HG22 THR A 49 -34.910 5.156 -0.294 1.00 0.00 H new ATOM 0 HG23 THR A 49 -35.444 6.434 -1.412 1.00 0.00 H new ATOM 783 N GLU A 50 -38.375 6.523 -2.338 1.00 0.00 N ATOM 784 CA GLU A 50 -38.531 7.014 -3.738 1.00 0.00 C ATOM 785 C GLU A 50 -37.216 7.616 -4.237 1.00 0.00 C ATOM 786 O GLU A 50 -36.871 7.500 -5.397 1.00 0.00 O ATOM 787 CB GLU A 50 -39.617 8.087 -3.662 1.00 0.00 C ATOM 788 CG GLU A 50 -40.988 7.421 -3.531 1.00 0.00 C ATOM 789 CD GLU A 50 -41.227 6.503 -4.731 1.00 0.00 C ATOM 790 OE1 GLU A 50 -40.706 6.800 -5.793 1.00 0.00 O ATOM 791 OE2 GLU A 50 -41.928 5.518 -4.568 1.00 0.00 O ATOM 0 H GLU A 50 -38.799 7.113 -1.622 1.00 0.00 H new ATOM 0 HA GLU A 50 -38.796 6.214 -4.429 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -39.437 8.742 -2.809 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -39.589 8.711 -4.555 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -41.038 6.848 -2.605 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -41.769 8.180 -3.479 1.00 0.00 H new ATOM 798 N GLU A 51 -36.479 8.259 -3.374 1.00 0.00 N ATOM 799 CA GLU A 51 -35.187 8.868 -3.804 1.00 0.00 C ATOM 800 C GLU A 51 -34.223 7.781 -4.289 1.00 0.00 C ATOM 801 O GLU A 51 -33.522 7.952 -5.266 1.00 0.00 O ATOM 802 CB GLU A 51 -34.635 9.553 -2.553 1.00 0.00 C ATOM 803 CG GLU A 51 -35.161 10.987 -2.482 1.00 0.00 C ATOM 804 CD GLU A 51 -35.494 11.338 -1.029 1.00 0.00 C ATOM 805 OE1 GLU A 51 -34.965 10.683 -0.147 1.00 0.00 O ATOM 806 OE2 GLU A 51 -36.271 12.257 -0.826 1.00 0.00 O ATOM 0 H GLU A 51 -36.714 8.390 -2.390 1.00 0.00 H new ATOM 0 HA GLU A 51 -35.317 9.568 -4.629 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -34.933 9.001 -1.662 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -33.545 9.555 -2.577 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -34.415 11.679 -2.873 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -36.049 11.091 -3.105 1.00 0.00 H new ATOM 813 N HIS A 52 -34.183 6.666 -3.612 1.00 0.00 N ATOM 814 CA HIS A 52 -33.264 5.570 -4.034 1.00 0.00 C ATOM 815 C HIS A 52 -33.639 5.070 -5.432 1.00 0.00 C ATOM 816 O HIS A 52 -32.827 5.054 -6.334 1.00 0.00 O ATOM 817 CB HIS A 52 -33.465 4.464 -2.997 1.00 0.00 C ATOM 818 CG HIS A 52 -32.534 4.688 -1.838 1.00 0.00 C ATOM 819 ND1 HIS A 52 -32.975 4.654 -0.510 1.00 0.00 N ATOM 820 CD2 HIS A 52 -31.183 4.951 -1.780 1.00 0.00 C ATOM 821 CE1 HIS A 52 -31.907 4.891 0.281 1.00 0.00 C ATOM 822 NE2 HIS A 52 -30.821 5.073 -0.454 1.00 0.00 N ATOM 0 H HIS A 52 -34.746 6.466 -2.785 1.00 0.00 H new ATOM 0 HA HIS A 52 -32.226 5.899 -4.084 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -34.499 4.459 -2.651 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -33.275 3.490 -3.447 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -30.520 5.046 -2.628 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -31.935 4.927 1.360 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -29.884 5.269 -0.103 1.00 0.00 H new ATOM 830 N TRP A 53 -34.863 4.660 -5.616 1.00 0.00 N ATOM 831 CA TRP A 53 -35.289 4.160 -6.955 1.00 0.00 C ATOM 832 C TRP A 53 -35.149 5.265 -8.007 1.00 0.00 C ATOM 833 O TRP A 53 -34.968 5.001 -9.178 1.00 0.00 O ATOM 834 CB TRP A 53 -36.757 3.768 -6.782 1.00 0.00 C ATOM 835 CG TRP A 53 -36.838 2.374 -6.249 1.00 0.00 C ATOM 836 CD1 TRP A 53 -37.627 1.979 -5.223 1.00 0.00 C ATOM 837 CD2 TRP A 53 -36.120 1.187 -6.693 1.00 0.00 C ATOM 838 NE1 TRP A 53 -37.439 0.625 -5.011 1.00 0.00 N ATOM 839 CE2 TRP A 53 -36.519 0.092 -5.892 1.00 0.00 C ATOM 840 CE3 TRP A 53 -35.169 0.959 -7.706 1.00 0.00 C ATOM 841 CZ2 TRP A 53 -35.994 -1.186 -6.088 1.00 0.00 C ATOM 842 CZ3 TRP A 53 -34.637 -0.327 -7.907 1.00 0.00 C ATOM 843 CH2 TRP A 53 -35.049 -1.397 -7.098 1.00 0.00 C ATOM 0 H TRP A 53 -35.587 4.649 -4.898 1.00 0.00 H new ATOM 0 HA TRP A 53 -34.679 3.323 -7.294 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -37.252 4.459 -6.100 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -37.278 3.835 -7.737 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -38.294 2.616 -4.662 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -37.921 0.086 -4.292 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -34.846 1.777 -8.333 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -36.315 -2.007 -5.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -33.908 -0.492 -8.687 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -34.637 -2.383 -7.255 1.00 0.00 H new ATOM 854 N LYS A 54 -35.235 6.501 -7.598 1.00 0.00 N ATOM 855 CA LYS A 54 -35.109 7.619 -8.577 1.00 0.00 C ATOM 856 C LYS A 54 -33.682 7.687 -9.128 1.00 0.00 C ATOM 857 O LYS A 54 -33.445 7.442 -10.295 1.00 0.00 O ATOM 858 CB LYS A 54 -35.436 8.883 -7.779 1.00 0.00 C ATOM 859 CG LYS A 54 -35.710 10.038 -8.744 1.00 0.00 C ATOM 860 CD LYS A 54 -37.156 10.509 -8.580 1.00 0.00 C ATOM 861 CE LYS A 54 -37.171 11.914 -7.974 1.00 0.00 C ATOM 862 NZ LYS A 54 -37.123 12.835 -9.143 1.00 0.00 N ATOM 0 H LYS A 54 -35.387 6.785 -6.630 1.00 0.00 H new ATOM 0 HA LYS A 54 -35.772 7.493 -9.433 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -36.306 8.711 -7.145 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -34.605 9.135 -7.120 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -35.024 10.861 -8.546 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -35.535 9.717 -9.771 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -37.660 10.513 -9.547 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -37.704 9.819 -7.938 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -38.069 12.078 -7.378 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -36.318 12.069 -7.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -37.130 13.820 -8.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -36.254 12.660 -9.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -37.951 12.669 -9.750 1.00 0.00 H new ATOM 876 N LEU A 55 -32.731 8.022 -8.300 1.00 0.00 N ATOM 877 CA LEU A 55 -31.321 8.109 -8.779 1.00 0.00 C ATOM 878 C LEU A 55 -30.907 6.795 -9.448 1.00 0.00 C ATOM 879 O LEU A 55 -30.272 6.789 -10.485 1.00 0.00 O ATOM 880 CB LEU A 55 -30.488 8.355 -7.522 1.00 0.00 C ATOM 881 CG LEU A 55 -29.143 8.970 -7.913 1.00 0.00 C ATOM 882 CD1 LEU A 55 -28.948 10.290 -7.167 1.00 0.00 C ATOM 883 CD2 LEU A 55 -28.015 8.005 -7.541 1.00 0.00 C ATOM 0 H LEU A 55 -32.868 8.239 -7.313 1.00 0.00 H new ATOM 0 HA LEU A 55 -31.185 8.899 -9.518 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -31.021 9.022 -6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -30.330 7.418 -6.988 1.00 0.00 H new ATOM 0 HG LEU A 55 -29.127 9.154 -8.987 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -27.989 10.728 -7.446 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -29.751 10.978 -7.430 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -28.964 10.107 -6.093 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -27.056 8.442 -7.819 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -28.032 7.822 -6.467 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -28.152 7.063 -8.072 1.00 0.00 H new ATOM 895 N VAL A 56 -31.258 5.684 -8.863 1.00 0.00 N ATOM 896 CA VAL A 56 -30.882 4.373 -9.466 1.00 0.00 C ATOM 897 C VAL A 56 -31.333 4.316 -10.927 1.00 0.00 C ATOM 898 O VAL A 56 -30.539 4.113 -11.825 1.00 0.00 O ATOM 899 CB VAL A 56 -31.626 3.329 -8.632 1.00 0.00 C ATOM 900 CG1 VAL A 56 -31.644 1.994 -9.378 1.00 0.00 C ATOM 901 CG2 VAL A 56 -30.914 3.151 -7.289 1.00 0.00 C ATOM 0 H VAL A 56 -31.789 5.626 -7.994 1.00 0.00 H new ATOM 0 HA VAL A 56 -29.805 4.207 -9.461 1.00 0.00 H new ATOM 0 HB VAL A 56 -32.650 3.663 -8.463 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -32.175 1.251 -8.782 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -32.149 2.119 -10.336 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -30.621 1.659 -9.549 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -31.443 2.407 -6.693 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.891 2.818 -7.461 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -30.901 4.101 -6.755 1.00 0.00 H new ATOM 911 N LYS A 57 -32.602 4.492 -11.173 1.00 0.00 N ATOM 912 CA LYS A 57 -33.101 4.446 -12.578 1.00 0.00 C ATOM 913 C LYS A 57 -32.274 5.382 -13.463 1.00 0.00 C ATOM 914 O LYS A 57 -31.857 5.021 -14.546 1.00 0.00 O ATOM 915 CB LYS A 57 -34.551 4.925 -12.500 1.00 0.00 C ATOM 916 CG LYS A 57 -35.385 4.200 -13.558 1.00 0.00 C ATOM 917 CD LYS A 57 -36.266 5.209 -14.298 1.00 0.00 C ATOM 918 CE LYS A 57 -35.859 5.258 -15.772 1.00 0.00 C ATOM 919 NZ LYS A 57 -34.724 6.222 -15.826 1.00 0.00 N ATOM 0 H LYS A 57 -33.314 4.665 -10.464 1.00 0.00 H new ATOM 0 HA LYS A 57 -33.024 3.449 -13.011 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -34.956 4.732 -11.507 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -34.598 6.002 -12.659 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -34.730 3.688 -14.263 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -36.005 3.437 -13.087 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -37.315 4.926 -14.209 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -36.163 6.197 -13.848 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -35.559 4.274 -16.132 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -36.687 5.588 -16.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -34.793 6.791 -16.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -34.761 6.849 -14.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -33.825 5.700 -15.825 1.00 0.00 H new ATOM 933 N TYR A 58 -32.031 6.582 -13.011 1.00 0.00 N ATOM 934 CA TYR A 58 -31.229 7.539 -13.827 1.00 0.00 C ATOM 935 C TYR A 58 -29.889 6.909 -14.215 1.00 0.00 C ATOM 936 O TYR A 58 -29.442 7.017 -15.341 1.00 0.00 O ATOM 937 CB TYR A 58 -31.011 8.749 -12.918 1.00 0.00 C ATOM 938 CG TYR A 58 -31.634 9.972 -13.548 1.00 0.00 C ATOM 939 CD1 TYR A 58 -33.012 10.003 -13.804 1.00 0.00 C ATOM 940 CD2 TYR A 58 -30.836 11.076 -13.875 1.00 0.00 C ATOM 941 CE1 TYR A 58 -33.590 11.139 -14.387 1.00 0.00 C ATOM 942 CE2 TYR A 58 -31.414 12.211 -14.458 1.00 0.00 C ATOM 943 CZ TYR A 58 -32.790 12.242 -14.714 1.00 0.00 C ATOM 944 OH TYR A 58 -33.360 13.360 -15.289 1.00 0.00 O ATOM 0 H TYR A 58 -32.353 6.942 -12.112 1.00 0.00 H new ATOM 0 HA TYR A 58 -31.731 7.813 -14.755 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -31.454 8.566 -11.939 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -29.945 8.911 -12.760 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -33.628 9.152 -13.552 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -29.774 11.052 -13.677 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -34.652 11.164 -14.584 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -30.798 13.062 -14.710 1.00 0.00 H new ATOM 0 HH TYR A 58 -32.672 13.870 -15.765 1.00 0.00 H new ATOM 954 N LEU A 59 -29.243 6.251 -13.291 1.00 0.00 N ATOM 955 CA LEU A 59 -27.932 5.615 -13.606 1.00 0.00 C ATOM 956 C LEU A 59 -28.103 4.554 -14.698 1.00 0.00 C ATOM 957 O LEU A 59 -27.287 4.429 -15.588 1.00 0.00 O ATOM 958 CB LEU A 59 -27.483 4.967 -12.295 1.00 0.00 C ATOM 959 CG LEU A 59 -26.026 4.515 -12.420 1.00 0.00 C ATOM 960 CD1 LEU A 59 -25.310 4.728 -11.086 1.00 0.00 C ATOM 961 CD2 LEU A 59 -25.987 3.030 -12.789 1.00 0.00 C ATOM 0 H LEU A 59 -29.566 6.126 -12.332 1.00 0.00 H new ATOM 0 HA LEU A 59 -27.203 6.335 -13.977 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -27.586 5.676 -11.473 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -28.120 4.114 -12.062 1.00 0.00 H new ATOM 0 HG LEU A 59 -25.528 5.097 -13.195 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -24.272 4.406 -11.175 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -25.341 5.785 -10.821 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -25.806 4.145 -10.310 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -24.951 2.705 -12.879 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -26.484 2.449 -12.012 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -26.499 2.878 -13.739 1.00 0.00 H new ATOM 973 N ARG A 60 -29.159 3.790 -14.635 1.00 0.00 N ATOM 974 CA ARG A 60 -29.381 2.738 -15.670 1.00 0.00 C ATOM 975 C ARG A 60 -29.496 3.376 -17.058 1.00 0.00 C ATOM 976 O ARG A 60 -29.170 2.769 -18.058 1.00 0.00 O ATOM 977 CB ARG A 60 -30.697 2.066 -15.277 1.00 0.00 C ATOM 978 CG ARG A 60 -30.750 0.659 -15.875 1.00 0.00 C ATOM 979 CD ARG A 60 -31.827 -0.160 -15.160 1.00 0.00 C ATOM 980 NE ARG A 60 -31.978 -1.393 -15.980 1.00 0.00 N ATOM 981 CZ ARG A 60 -30.969 -2.208 -16.127 1.00 0.00 C ATOM 982 NH1 ARG A 60 -30.423 -2.765 -15.080 1.00 0.00 N ATOM 983 NH2 ARG A 60 -30.504 -2.462 -17.319 1.00 0.00 N ATOM 0 H ARG A 60 -29.877 3.848 -13.913 1.00 0.00 H new ATOM 0 HA ARG A 60 -28.558 2.025 -15.717 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -30.781 2.015 -14.191 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -31.540 2.657 -15.635 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -30.968 0.714 -16.942 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -29.780 0.172 -15.773 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -31.529 -0.399 -14.139 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -32.766 0.391 -15.098 1.00 0.00 H new ATOM 0 HE ARG A 60 -32.871 -1.601 -16.427 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -30.785 -2.563 -14.148 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -29.635 -3.402 -15.194 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -30.929 -2.024 -18.136 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -29.716 -3.099 -17.434 1.00 0.00 H new ATOM 997 N GLU A 61 -29.957 4.594 -17.124 1.00 0.00 N ATOM 998 CA GLU A 61 -30.093 5.268 -18.446 1.00 0.00 C ATOM 999 C GLU A 61 -28.716 5.453 -19.091 1.00 0.00 C ATOM 1000 O GLU A 61 -28.499 5.085 -20.228 1.00 0.00 O ATOM 1001 CB GLU A 61 -30.727 6.625 -18.135 1.00 0.00 C ATOM 1002 CG GLU A 61 -32.020 6.782 -18.939 1.00 0.00 C ATOM 1003 CD GLU A 61 -32.839 7.940 -18.367 1.00 0.00 C ATOM 1004 OE1 GLU A 61 -32.343 9.054 -18.381 1.00 0.00 O ATOM 1005 OE2 GLU A 61 -33.949 7.692 -17.927 1.00 0.00 O ATOM 0 H GLU A 61 -30.245 5.152 -16.320 1.00 0.00 H new ATOM 0 HA GLU A 61 -30.695 4.688 -19.145 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -30.938 6.704 -17.068 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -30.033 7.428 -18.383 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -31.788 6.970 -19.987 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -32.599 5.859 -18.901 1.00 0.00 H new ATOM 1012 N TYR A 62 -27.785 6.021 -18.374 1.00 0.00 N ATOM 1013 CA TYR A 62 -26.425 6.228 -18.948 1.00 0.00 C ATOM 1014 C TYR A 62 -25.696 4.888 -19.081 1.00 0.00 C ATOM 1015 O TYR A 62 -24.833 4.721 -19.919 1.00 0.00 O ATOM 1016 CB TYR A 62 -25.705 7.132 -17.948 1.00 0.00 C ATOM 1017 CG TYR A 62 -24.352 7.515 -18.499 1.00 0.00 C ATOM 1018 CD1 TYR A 62 -23.239 6.699 -18.255 1.00 0.00 C ATOM 1019 CD2 TYR A 62 -24.210 8.686 -19.256 1.00 0.00 C ATOM 1020 CE1 TYR A 62 -21.984 7.054 -18.767 1.00 0.00 C ATOM 1021 CE2 TYR A 62 -22.955 9.041 -19.768 1.00 0.00 C ATOM 1022 CZ TYR A 62 -21.842 8.225 -19.524 1.00 0.00 C ATOM 1023 OH TYR A 62 -20.606 8.575 -20.030 1.00 0.00 O ATOM 0 H TYR A 62 -27.907 6.350 -17.416 1.00 0.00 H new ATOM 0 HA TYR A 62 -26.461 6.670 -19.944 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -26.298 8.026 -17.757 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -25.589 6.617 -16.994 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -23.349 5.796 -17.672 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -25.068 9.315 -19.445 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -21.126 6.425 -18.578 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -22.845 9.944 -20.351 1.00 0.00 H new ATOM 0 HH TYR A 62 -20.683 9.413 -20.531 1.00 0.00 H new ATOM 1033 N TRP A 63 -26.036 3.934 -18.259 1.00 0.00 N ATOM 1034 CA TRP A 63 -25.360 2.606 -18.338 1.00 0.00 C ATOM 1035 C TRP A 63 -25.973 1.764 -19.460 1.00 0.00 C ATOM 1036 O TRP A 63 -25.498 0.692 -19.776 1.00 0.00 O ATOM 1037 CB TRP A 63 -25.613 1.952 -16.979 1.00 0.00 C ATOM 1038 CG TRP A 63 -24.915 0.630 -16.927 1.00 0.00 C ATOM 1039 CD1 TRP A 63 -23.712 0.409 -16.348 1.00 0.00 C ATOM 1040 CD2 TRP A 63 -25.355 -0.651 -17.463 1.00 0.00 C ATOM 1041 NE1 TRP A 63 -23.386 -0.928 -16.494 1.00 0.00 N ATOM 1042 CE2 TRP A 63 -24.367 -1.622 -17.174 1.00 0.00 C ATOM 1043 CE3 TRP A 63 -26.505 -1.061 -18.164 1.00 0.00 C ATOM 1044 CZ2 TRP A 63 -24.513 -2.954 -17.567 1.00 0.00 C ATOM 1045 CZ3 TRP A 63 -26.657 -2.401 -18.561 1.00 0.00 C ATOM 1046 CH2 TRP A 63 -25.662 -3.345 -18.264 1.00 0.00 C ATOM 0 H TRP A 63 -26.751 4.015 -17.537 1.00 0.00 H new ATOM 0 HA TRP A 63 -24.296 2.698 -18.556 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -25.252 2.598 -16.179 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -26.683 1.817 -16.821 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -23.106 1.154 -15.853 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -22.526 -1.349 -16.142 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -27.275 -0.341 -18.398 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -23.745 -3.677 -17.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -27.544 -2.705 -19.097 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -25.783 -4.373 -18.573 1.00 0.00 H new ATOM 1057 N GLU A 64 -27.025 2.242 -20.067 1.00 0.00 N ATOM 1058 CA GLU A 64 -27.666 1.468 -21.169 1.00 0.00 C ATOM 1059 C GLU A 64 -26.850 1.608 -22.457 1.00 0.00 C ATOM 1060 O GLU A 64 -26.513 0.633 -23.098 1.00 0.00 O ATOM 1061 CB GLU A 64 -29.051 2.090 -21.340 1.00 0.00 C ATOM 1062 CG GLU A 64 -29.957 1.120 -22.101 1.00 0.00 C ATOM 1063 CD GLU A 64 -31.400 1.287 -21.622 1.00 0.00 C ATOM 1064 OE1 GLU A 64 -31.586 1.772 -20.519 1.00 0.00 O ATOM 1065 OE2 GLU A 64 -32.295 0.924 -22.367 1.00 0.00 O ATOM 0 H GLU A 64 -27.468 3.134 -19.848 1.00 0.00 H new ATOM 0 HA GLU A 64 -27.725 0.403 -20.945 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.482 2.317 -20.365 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -28.973 3.033 -21.882 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -29.894 1.311 -23.172 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.626 0.094 -21.940 1.00 0.00 H new ATOM 1072 N THR A 65 -26.530 2.814 -22.839 1.00 0.00 N ATOM 1073 CA THR A 65 -25.736 3.014 -24.086 1.00 0.00 C ATOM 1074 C THR A 65 -24.575 2.017 -24.139 1.00 0.00 C ATOM 1075 O THR A 65 -24.259 1.473 -25.179 1.00 0.00 O ATOM 1076 CB THR A 65 -25.210 4.447 -23.995 1.00 0.00 C ATOM 1077 OG1 THR A 65 -26.287 5.357 -24.168 1.00 0.00 O ATOM 1078 CG2 THR A 65 -24.165 4.679 -25.087 1.00 0.00 C ATOM 0 H THR A 65 -26.783 3.669 -22.343 1.00 0.00 H new ATOM 0 HA THR A 65 -26.331 2.855 -24.985 1.00 0.00 H new ATOM 0 HB THR A 65 -24.753 4.605 -23.018 1.00 0.00 H new ATOM 0 HG1 THR A 65 -25.952 6.276 -24.108 1.00 0.00 H new ATOM 0 HG21 THR A 65 -23.791 5.701 -25.021 1.00 0.00 H new ATOM 0 HG22 THR A 65 -23.339 3.981 -24.954 1.00 0.00 H new ATOM 0 HG23 THR A 65 -24.620 4.521 -26.065 1.00 0.00 H new ATOM 1086 N PHE A 66 -23.938 1.772 -23.026 1.00 0.00 N ATOM 1087 CA PHE A 66 -22.799 0.810 -23.015 1.00 0.00 C ATOM 1088 C PHE A 66 -22.709 0.110 -21.657 1.00 0.00 C ATOM 1089 O PHE A 66 -22.780 -1.100 -21.565 1.00 0.00 O ATOM 1090 CB PHE A 66 -21.556 1.665 -23.259 1.00 0.00 C ATOM 1091 CG PHE A 66 -20.974 1.332 -24.612 1.00 0.00 C ATOM 1092 CD1 PHE A 66 -20.035 0.300 -24.737 1.00 0.00 C ATOM 1093 CD2 PHE A 66 -21.374 2.056 -25.744 1.00 0.00 C ATOM 1094 CE1 PHE A 66 -19.496 -0.009 -25.994 1.00 0.00 C ATOM 1095 CE2 PHE A 66 -20.836 1.748 -27.000 1.00 0.00 C ATOM 1096 CZ PHE A 66 -19.897 0.715 -27.125 1.00 0.00 C ATOM 0 H PHE A 66 -24.157 2.196 -22.125 1.00 0.00 H new ATOM 0 HA PHE A 66 -22.912 0.029 -23.767 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -21.814 2.723 -23.213 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -20.817 1.483 -22.479 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -19.726 -0.258 -23.865 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -22.098 2.852 -25.647 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -18.772 -0.805 -26.091 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -21.145 2.306 -27.872 1.00 0.00 H new ATOM 0 HZ PHE A 66 -19.482 0.477 -28.093 1.00 0.00 H new ATOM 1106 N GLY A 67 -22.552 0.861 -20.601 1.00 0.00 N ATOM 1107 CA GLY A 67 -22.457 0.238 -19.251 1.00 0.00 C ATOM 1108 C GLY A 67 -21.249 0.810 -18.508 1.00 0.00 C ATOM 1109 O GLY A 67 -20.503 0.094 -17.871 1.00 0.00 O ATOM 0 H GLY A 67 -22.485 1.879 -20.615 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -23.369 0.430 -18.686 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -22.361 -0.844 -19.344 1.00 0.00 H new ATOM 1113 N THR A 68 -21.050 2.098 -18.584 1.00 0.00 N ATOM 1114 CA THR A 68 -19.890 2.717 -17.882 1.00 0.00 C ATOM 1115 C THR A 68 -20.365 3.461 -16.631 1.00 0.00 C ATOM 1116 O THR A 68 -21.070 4.447 -16.713 1.00 0.00 O ATOM 1117 CB THR A 68 -19.289 3.697 -18.892 1.00 0.00 C ATOM 1118 OG1 THR A 68 -19.770 3.390 -20.194 1.00 0.00 O ATOM 1119 CG2 THR A 68 -17.764 3.584 -18.871 1.00 0.00 C ATOM 0 H THR A 68 -21.641 2.748 -19.102 1.00 0.00 H new ATOM 0 HA THR A 68 -19.163 1.974 -17.554 1.00 0.00 H new ATOM 0 HB THR A 68 -19.580 4.714 -18.627 1.00 0.00 H new ATOM 0 HG1 THR A 68 -19.387 4.018 -20.841 1.00 0.00 H new ATOM 0 HG21 THR A 68 -17.337 4.283 -19.591 1.00 0.00 H new ATOM 0 HG22 THR A 68 -17.395 3.821 -17.873 1.00 0.00 H new ATOM 0 HG23 THR A 68 -17.471 2.568 -19.134 1.00 0.00 H new ATOM 1127 N CYS A 69 -19.985 2.996 -15.472 1.00 0.00 N ATOM 1128 CA CYS A 69 -20.415 3.678 -14.217 1.00 0.00 C ATOM 1129 C CYS A 69 -20.050 5.163 -14.271 1.00 0.00 C ATOM 1130 O CYS A 69 -18.894 5.523 -14.176 1.00 0.00 O ATOM 1131 CB CYS A 69 -19.642 2.975 -13.101 1.00 0.00 C ATOM 1132 SG CYS A 69 -20.510 3.205 -11.530 1.00 0.00 S ATOM 0 H CYS A 69 -19.396 2.174 -15.339 1.00 0.00 H new ATOM 0 HA CYS A 69 -21.493 3.622 -14.064 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -19.546 1.912 -13.324 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -18.632 3.379 -13.033 1.00 0.00 H new ATOM 1137 N PRO A 70 -21.057 5.980 -14.422 1.00 0.00 N ATOM 1138 CA PRO A 70 -20.847 7.446 -14.491 1.00 0.00 C ATOM 1139 C PRO A 70 -20.496 8.000 -13.107 1.00 0.00 C ATOM 1140 O PRO A 70 -20.603 7.308 -12.115 1.00 0.00 O ATOM 1141 CB PRO A 70 -22.194 7.979 -14.967 1.00 0.00 C ATOM 1142 CG PRO A 70 -23.191 6.943 -14.553 1.00 0.00 C ATOM 1143 CD PRO A 70 -22.474 5.618 -14.543 1.00 0.00 C ATOM 0 HA PRO A 70 -20.026 7.732 -15.149 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -22.418 8.945 -14.514 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -22.201 8.124 -16.047 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -23.595 7.170 -13.566 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -24.033 6.920 -15.245 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -22.799 4.995 -13.710 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -22.665 5.054 -15.456 1.00 0.00 H new ATOM 1151 N PRO A 71 -20.085 9.239 -13.092 1.00 0.00 N ATOM 1152 CA PRO A 71 -19.709 9.902 -11.819 1.00 0.00 C ATOM 1153 C PRO A 71 -20.960 10.236 -11.000 1.00 0.00 C ATOM 1154 O PRO A 71 -22.027 9.703 -11.231 1.00 0.00 O ATOM 1155 CB PRO A 71 -19.002 11.175 -12.275 1.00 0.00 C ATOM 1156 CG PRO A 71 -19.545 11.455 -13.641 1.00 0.00 C ATOM 1157 CD PRO A 71 -19.934 10.130 -14.247 1.00 0.00 C ATOM 0 HA PRO A 71 -19.085 9.279 -11.179 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -19.202 12.002 -11.594 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -17.921 11.038 -12.301 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -20.407 12.120 -13.583 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -18.798 11.955 -14.257 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -20.862 10.208 -14.814 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -19.170 9.766 -14.934 1.00 0.00 H new ATOM 1165 N ILE A 72 -20.834 11.115 -10.044 1.00 0.00 N ATOM 1166 CA ILE A 72 -22.013 11.486 -9.209 1.00 0.00 C ATOM 1167 C ILE A 72 -22.211 13.005 -9.224 1.00 0.00 C ATOM 1168 O ILE A 72 -23.125 13.528 -8.617 1.00 0.00 O ATOM 1169 CB ILE A 72 -21.667 11.003 -7.800 1.00 0.00 C ATOM 1170 CG1 ILE A 72 -22.868 11.220 -6.875 1.00 0.00 C ATOM 1171 CG2 ILE A 72 -20.469 11.793 -7.271 1.00 0.00 C ATOM 1172 CD1 ILE A 72 -23.999 10.271 -7.275 1.00 0.00 C ATOM 0 H ILE A 72 -19.965 11.593 -9.804 1.00 0.00 H new ATOM 0 HA ILE A 72 -22.938 11.041 -9.576 1.00 0.00 H new ATOM 0 HB ILE A 72 -21.419 9.942 -7.831 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -22.579 11.042 -5.839 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -23.207 12.254 -6.938 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.222 11.449 -6.267 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -19.613 11.639 -7.928 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.717 12.854 -7.241 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -24.854 10.426 -6.616 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -24.294 10.470 -8.305 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -23.656 9.240 -7.189 1.00 0.00 H new ATOM 1184 N LYS A 73 -21.360 13.716 -9.912 1.00 0.00 N ATOM 1185 CA LYS A 73 -21.496 15.200 -9.964 1.00 0.00 C ATOM 1186 C LYS A 73 -22.363 15.614 -11.156 1.00 0.00 C ATOM 1187 O LYS A 73 -22.771 16.753 -11.273 1.00 0.00 O ATOM 1188 CB LYS A 73 -20.069 15.720 -10.137 1.00 0.00 C ATOM 1189 CG LYS A 73 -19.570 15.382 -11.543 1.00 0.00 C ATOM 1190 CD LYS A 73 -18.043 15.476 -11.582 1.00 0.00 C ATOM 1191 CE LYS A 73 -17.611 16.242 -12.834 1.00 0.00 C ATOM 1192 NZ LYS A 73 -16.146 16.456 -12.666 1.00 0.00 N ATOM 0 H LYS A 73 -20.576 13.334 -10.441 1.00 0.00 H new ATOM 0 HA LYS A 73 -21.974 15.601 -9.070 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -20.042 16.798 -9.979 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -19.414 15.272 -9.390 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -19.890 14.378 -11.822 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -20.005 16.068 -12.269 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -17.676 15.982 -10.689 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -17.606 14.477 -11.585 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.826 15.674 -13.739 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -18.142 17.190 -12.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -15.775 16.976 -13.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -15.972 17.005 -11.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -15.667 15.536 -12.594 1.00 0.00 H new ATOM 1206 N MET A 74 -22.646 14.702 -12.045 1.00 0.00 N ATOM 1207 CA MET A 74 -23.484 15.049 -13.229 1.00 0.00 C ATOM 1208 C MET A 74 -24.916 14.541 -13.037 1.00 0.00 C ATOM 1209 O MET A 74 -25.861 15.117 -13.539 1.00 0.00 O ATOM 1210 CB MET A 74 -22.816 14.340 -14.407 1.00 0.00 C ATOM 1211 CG MET A 74 -22.283 15.380 -15.394 1.00 0.00 C ATOM 1212 SD MET A 74 -22.903 15.010 -17.054 1.00 0.00 S ATOM 1213 CE MET A 74 -21.391 14.253 -17.698 1.00 0.00 C ATOM 0 H MET A 74 -22.334 13.732 -12.003 1.00 0.00 H new ATOM 0 HA MET A 74 -23.551 16.126 -13.385 1.00 0.00 H new ATOM 0 HB2 MET A 74 -22.001 13.710 -14.051 1.00 0.00 H new ATOM 0 HB3 MET A 74 -23.532 13.685 -14.904 1.00 0.00 H new ATOM 0 HG2 MET A 74 -22.597 16.379 -15.091 1.00 0.00 H new ATOM 0 HG3 MET A 74 -21.193 15.374 -15.392 1.00 0.00 H new ATOM 0 HE1 MET A 74 -21.550 13.944 -18.731 1.00 0.00 H new ATOM 0 HE2 MET A 74 -20.576 14.976 -17.657 1.00 0.00 H new ATOM 0 HE3 MET A 74 -21.134 13.383 -17.094 1.00 0.00 H new ATOM 1223 N VAL A 75 -25.084 13.466 -12.315 1.00 0.00 N ATOM 1224 CA VAL A 75 -26.457 12.925 -12.096 1.00 0.00 C ATOM 1225 C VAL A 75 -27.206 13.779 -11.069 1.00 0.00 C ATOM 1226 O VAL A 75 -28.415 13.897 -11.108 1.00 0.00 O ATOM 1227 CB VAL A 75 -26.245 11.509 -11.561 1.00 0.00 C ATOM 1228 CG1 VAL A 75 -27.601 10.881 -11.233 1.00 0.00 C ATOM 1229 CG2 VAL A 75 -25.538 10.664 -12.623 1.00 0.00 C ATOM 0 H VAL A 75 -24.333 12.940 -11.868 1.00 0.00 H new ATOM 0 HA VAL A 75 -27.052 12.931 -13.009 1.00 0.00 H new ATOM 0 HB VAL A 75 -25.633 11.548 -10.660 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -27.451 9.871 -10.851 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -28.108 11.483 -10.478 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -28.211 10.841 -12.135 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -25.386 9.654 -12.243 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -26.151 10.624 -13.524 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -24.573 11.111 -12.860 1.00 0.00 H new ATOM 1239 N THR A 76 -26.497 14.374 -10.149 1.00 0.00 N ATOM 1240 CA THR A 76 -27.169 15.218 -9.120 1.00 0.00 C ATOM 1241 C THR A 76 -27.559 16.573 -9.715 1.00 0.00 C ATOM 1242 O THR A 76 -28.586 17.133 -9.390 1.00 0.00 O ATOM 1243 CB THR A 76 -26.126 15.400 -8.016 1.00 0.00 C ATOM 1244 OG1 THR A 76 -26.738 15.998 -6.883 1.00 0.00 O ATOM 1245 CG2 THR A 76 -24.996 16.296 -8.522 1.00 0.00 C ATOM 0 H THR A 76 -25.482 14.312 -10.065 1.00 0.00 H new ATOM 0 HA THR A 76 -28.085 14.760 -8.747 1.00 0.00 H new ATOM 0 HB THR A 76 -25.718 14.429 -7.737 1.00 0.00 H new ATOM 0 HG1 THR A 76 -26.071 16.114 -6.174 1.00 0.00 H new ATOM 0 HG21 THR A 76 -24.254 16.425 -7.734 1.00 0.00 H new ATOM 0 HG22 THR A 76 -24.527 15.834 -9.391 1.00 0.00 H new ATOM 0 HG23 THR A 76 -25.401 17.269 -8.802 1.00 0.00 H new ATOM 1253 N LYS A 77 -26.745 17.105 -10.586 1.00 0.00 N ATOM 1254 CA LYS A 77 -27.069 18.425 -11.200 1.00 0.00 C ATOM 1255 C LYS A 77 -28.320 18.312 -12.075 1.00 0.00 C ATOM 1256 O LYS A 77 -29.061 19.261 -12.241 1.00 0.00 O ATOM 1257 CB LYS A 77 -25.850 18.776 -12.052 1.00 0.00 C ATOM 1258 CG LYS A 77 -25.695 20.296 -12.123 1.00 0.00 C ATOM 1259 CD LYS A 77 -25.867 20.761 -13.569 1.00 0.00 C ATOM 1260 CE LYS A 77 -26.930 21.861 -13.629 1.00 0.00 C ATOM 1261 NZ LYS A 77 -26.310 22.950 -14.434 1.00 0.00 N ATOM 0 H LYS A 77 -25.870 16.683 -10.899 1.00 0.00 H new ATOM 0 HA LYS A 77 -27.276 19.188 -10.449 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -24.953 18.328 -11.624 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -25.964 18.365 -13.055 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -26.436 20.778 -11.485 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -24.714 20.590 -11.750 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -24.919 21.135 -13.957 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -26.161 19.922 -14.199 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -27.847 21.499 -14.094 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -27.195 22.209 -12.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -26.979 23.742 -14.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -25.443 23.279 -13.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -26.075 22.591 -15.381 1.00 0.00 H new ATOM 1275 N GLU A 78 -28.561 17.159 -12.638 1.00 0.00 N ATOM 1276 CA GLU A 78 -29.764 16.991 -13.504 1.00 0.00 C ATOM 1277 C GLU A 78 -30.986 16.640 -12.652 1.00 0.00 C ATOM 1278 O GLU A 78 -32.076 16.458 -13.159 1.00 0.00 O ATOM 1279 CB GLU A 78 -29.416 15.836 -14.443 1.00 0.00 C ATOM 1280 CG GLU A 78 -29.459 16.326 -15.892 1.00 0.00 C ATOM 1281 CD GLU A 78 -29.868 15.172 -16.811 1.00 0.00 C ATOM 1282 OE1 GLU A 78 -31.032 14.808 -16.790 1.00 0.00 O ATOM 1283 OE2 GLU A 78 -29.008 14.672 -17.518 1.00 0.00 O ATOM 0 H GLU A 78 -27.979 16.328 -12.536 1.00 0.00 H new ATOM 0 HA GLU A 78 -30.010 17.902 -14.050 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -28.425 15.448 -14.208 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -30.120 15.016 -14.304 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -30.167 17.149 -15.988 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -28.482 16.710 -16.186 1.00 0.00 H new ATOM 1290 N THR A 79 -30.815 16.543 -11.361 1.00 0.00 N ATOM 1291 CA THR A 79 -31.970 16.204 -10.481 1.00 0.00 C ATOM 1292 C THR A 79 -31.982 17.110 -9.248 1.00 0.00 C ATOM 1293 O THR A 79 -32.546 16.776 -8.225 1.00 0.00 O ATOM 1294 CB THR A 79 -31.742 14.747 -10.075 1.00 0.00 C ATOM 1295 OG1 THR A 79 -30.560 14.654 -9.293 1.00 0.00 O ATOM 1296 CG2 THR A 79 -31.596 13.883 -11.329 1.00 0.00 C ATOM 0 H THR A 79 -29.927 16.684 -10.879 1.00 0.00 H new ATOM 0 HA THR A 79 -32.927 16.343 -10.984 1.00 0.00 H new ATOM 0 HB THR A 79 -32.592 14.395 -9.491 1.00 0.00 H new ATOM 0 HG1 THR A 79 -30.724 14.075 -8.519 1.00 0.00 H new ATOM 0 HG21 THR A 79 -31.434 12.845 -11.039 1.00 0.00 H new ATOM 0 HG22 THR A 79 -32.504 13.955 -11.928 1.00 0.00 H new ATOM 0 HG23 THR A 79 -30.746 14.233 -11.915 1.00 0.00 H new ATOM 1304 N GLY A 80 -31.362 18.256 -9.336 1.00 0.00 N ATOM 1305 CA GLY A 80 -31.337 19.183 -8.169 1.00 0.00 C ATOM 1306 C GLY A 80 -31.054 18.388 -6.893 1.00 0.00 C ATOM 1307 O GLY A 80 -31.441 18.776 -5.809 1.00 0.00 O ATOM 0 H GLY A 80 -30.872 18.590 -10.166 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -30.571 19.945 -8.313 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -32.292 19.702 -8.083 1.00 0.00 H new ATOM 1311 N PHE A 81 -30.381 17.276 -7.014 1.00 0.00 N ATOM 1312 CA PHE A 81 -30.074 16.456 -5.807 1.00 0.00 C ATOM 1313 C PHE A 81 -29.078 17.193 -4.908 1.00 0.00 C ATOM 1314 O PHE A 81 -28.867 18.382 -5.042 1.00 0.00 O ATOM 1315 CB PHE A 81 -29.454 15.169 -6.352 1.00 0.00 C ATOM 1316 CG PHE A 81 -30.427 14.027 -6.180 1.00 0.00 C ATOM 1317 CD1 PHE A 81 -31.659 14.048 -6.848 1.00 0.00 C ATOM 1318 CD2 PHE A 81 -30.098 12.946 -5.351 1.00 0.00 C ATOM 1319 CE1 PHE A 81 -32.561 12.987 -6.689 1.00 0.00 C ATOM 1320 CE2 PHE A 81 -31.001 11.886 -5.191 1.00 0.00 C ATOM 1321 CZ PHE A 81 -32.232 11.906 -5.860 1.00 0.00 C ATOM 0 H PHE A 81 -30.031 16.900 -7.895 1.00 0.00 H new ATOM 0 HA PHE A 81 -30.960 16.258 -5.204 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -29.204 15.292 -7.406 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -28.524 14.950 -5.827 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -31.913 14.882 -7.485 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -29.149 12.930 -4.836 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -33.509 13.003 -7.205 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -30.748 11.053 -4.552 1.00 0.00 H new ATOM 0 HZ PHE A 81 -32.927 11.089 -5.737 1.00 0.00 H new ATOM 1331 N SER A 82 -28.465 16.496 -3.991 1.00 0.00 N ATOM 1332 CA SER A 82 -27.484 17.156 -3.085 1.00 0.00 C ATOM 1333 C SER A 82 -26.470 16.132 -2.569 1.00 0.00 C ATOM 1334 O SER A 82 -26.819 15.024 -2.210 1.00 0.00 O ATOM 1335 CB SER A 82 -28.321 17.708 -1.932 1.00 0.00 C ATOM 1336 OG SER A 82 -27.482 18.451 -1.057 1.00 0.00 O ATOM 0 H SER A 82 -28.601 15.498 -3.830 1.00 0.00 H new ATOM 0 HA SER A 82 -26.917 17.939 -3.589 1.00 0.00 H new ATOM 0 HB2 SER A 82 -29.118 18.344 -2.318 1.00 0.00 H new ATOM 0 HB3 SER A 82 -28.799 16.891 -1.390 1.00 0.00 H new ATOM 0 HG SER A 82 -28.016 18.808 -0.317 1.00 0.00 H new ATOM 1342 N LEU A 83 -25.215 16.490 -2.531 1.00 0.00 N ATOM 1343 CA LEU A 83 -24.182 15.534 -2.039 1.00 0.00 C ATOM 1344 C LEU A 83 -24.605 14.946 -0.690 1.00 0.00 C ATOM 1345 O LEU A 83 -24.336 13.799 -0.391 1.00 0.00 O ATOM 1346 CB LEU A 83 -22.910 16.368 -1.885 1.00 0.00 C ATOM 1347 CG LEU A 83 -21.745 15.454 -1.502 1.00 0.00 C ATOM 1348 CD1 LEU A 83 -21.231 14.734 -2.750 1.00 0.00 C ATOM 1349 CD2 LEU A 83 -20.616 16.293 -0.898 1.00 0.00 C ATOM 0 H LEU A 83 -24.861 17.402 -2.819 1.00 0.00 H new ATOM 0 HA LEU A 83 -24.039 14.695 -2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -22.688 16.887 -2.817 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.053 17.132 -1.121 1.00 0.00 H new ATOM 0 HG LEU A 83 -22.084 14.720 -0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -20.401 14.082 -2.478 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.034 14.137 -3.182 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -20.892 15.469 -3.480 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -19.785 15.642 -0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -20.277 17.027 -1.629 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -20.981 16.808 -0.009 1.00 0.00 H new ATOM 1361 N GLU A 84 -25.268 15.720 0.125 1.00 0.00 N ATOM 1362 CA GLU A 84 -25.708 15.203 1.453 1.00 0.00 C ATOM 1363 C GLU A 84 -26.847 14.195 1.276 1.00 0.00 C ATOM 1364 O GLU A 84 -26.953 13.230 2.006 1.00 0.00 O ATOM 1365 CB GLU A 84 -26.196 16.434 2.217 1.00 0.00 C ATOM 1366 CG GLU A 84 -24.997 17.294 2.621 1.00 0.00 C ATOM 1367 CD GLU A 84 -25.369 18.774 2.511 1.00 0.00 C ATOM 1368 OE1 GLU A 84 -26.077 19.254 3.381 1.00 0.00 O ATOM 1369 OE2 GLU A 84 -24.938 19.402 1.558 1.00 0.00 O ATOM 0 H GLU A 84 -25.524 16.688 -0.071 1.00 0.00 H new ATOM 0 HA GLU A 84 -24.906 14.688 1.982 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -26.879 17.013 1.596 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -26.752 16.128 3.103 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -24.695 17.059 3.642 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -24.145 17.074 1.978 1.00 0.00 H new ATOM 1376 N LYS A 85 -27.700 14.413 0.313 1.00 0.00 N ATOM 1377 CA LYS A 85 -28.832 13.468 0.091 1.00 0.00 C ATOM 1378 C LYS A 85 -28.303 12.067 -0.231 1.00 0.00 C ATOM 1379 O LYS A 85 -28.759 11.080 0.311 1.00 0.00 O ATOM 1380 CB LYS A 85 -29.595 14.040 -1.104 1.00 0.00 C ATOM 1381 CG LYS A 85 -30.857 14.754 -0.613 1.00 0.00 C ATOM 1382 CD LYS A 85 -31.607 15.346 -1.808 1.00 0.00 C ATOM 1383 CE LYS A 85 -32.631 14.333 -2.322 1.00 0.00 C ATOM 1384 NZ LYS A 85 -33.956 14.909 -1.960 1.00 0.00 N ATOM 0 H LYS A 85 -27.663 15.204 -0.330 1.00 0.00 H new ATOM 0 HA LYS A 85 -29.465 13.370 0.973 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -28.961 14.736 -1.653 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -29.863 13.240 -1.794 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -31.499 14.054 -0.078 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -30.591 15.543 0.090 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -32.108 16.269 -1.515 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -30.904 15.603 -2.601 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -32.542 14.193 -3.399 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -32.486 13.356 -1.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -34.711 14.270 -2.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -34.014 15.024 -0.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -34.069 15.836 -2.419 1.00 0.00 H new ATOM 1398 N ILE A 86 -27.346 11.973 -1.113 1.00 0.00 N ATOM 1399 CA ILE A 86 -26.791 10.635 -1.472 1.00 0.00 C ATOM 1400 C ILE A 86 -25.849 10.137 -0.373 1.00 0.00 C ATOM 1401 O ILE A 86 -25.726 8.951 -0.138 1.00 0.00 O ATOM 1402 CB ILE A 86 -26.023 10.862 -2.774 1.00 0.00 C ATOM 1403 CG1 ILE A 86 -27.016 11.092 -3.917 1.00 0.00 C ATOM 1404 CG2 ILE A 86 -25.167 9.633 -3.083 1.00 0.00 C ATOM 1405 CD1 ILE A 86 -26.336 11.890 -5.031 1.00 0.00 C ATOM 0 H ILE A 86 -26.924 12.763 -1.601 1.00 0.00 H new ATOM 0 HA ILE A 86 -27.571 9.882 -1.584 1.00 0.00 H new ATOM 0 HB ILE A 86 -25.379 11.735 -2.669 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -27.370 10.136 -4.304 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -27.890 11.631 -3.551 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -24.619 9.795 -4.011 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -24.461 9.468 -2.269 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -25.810 8.759 -3.189 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -27.043 12.054 -5.845 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -26.004 12.852 -4.639 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -25.476 11.334 -5.404 1.00 0.00 H new ATOM 1417 N TYR A 87 -25.180 11.031 0.302 1.00 0.00 N ATOM 1418 CA TYR A 87 -24.245 10.603 1.382 1.00 0.00 C ATOM 1419 C TYR A 87 -25.025 9.987 2.546 1.00 0.00 C ATOM 1420 O TYR A 87 -24.549 9.095 3.221 1.00 0.00 O ATOM 1421 CB TYR A 87 -23.540 11.885 1.828 1.00 0.00 C ATOM 1422 CG TYR A 87 -22.105 11.858 1.359 1.00 0.00 C ATOM 1423 CD1 TYR A 87 -21.816 11.662 0.001 1.00 0.00 C ATOM 1424 CD2 TYR A 87 -21.063 12.027 2.280 1.00 0.00 C ATOM 1425 CE1 TYR A 87 -20.485 11.636 -0.434 1.00 0.00 C ATOM 1426 CE2 TYR A 87 -19.732 12.001 1.845 1.00 0.00 C ATOM 1427 CZ TYR A 87 -19.443 11.805 0.487 1.00 0.00 C ATOM 1428 OH TYR A 87 -18.130 11.779 0.058 1.00 0.00 O ATOM 0 H TYR A 87 -25.240 12.038 0.153 1.00 0.00 H new ATOM 0 HA TYR A 87 -23.538 9.847 1.039 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -24.052 12.756 1.418 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -23.578 11.975 2.914 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -22.619 11.531 -0.709 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -21.286 12.177 3.326 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -20.262 11.486 -1.480 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -18.929 12.132 2.555 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.533 11.913 0.824 1.00 0.00 H new ATOM 1438 N GLN A 88 -26.220 10.452 2.788 1.00 0.00 N ATOM 1439 CA GLN A 88 -27.027 9.889 3.908 1.00 0.00 C ATOM 1440 C GLN A 88 -27.811 8.664 3.433 1.00 0.00 C ATOM 1441 O GLN A 88 -27.937 7.683 4.140 1.00 0.00 O ATOM 1442 CB GLN A 88 -27.981 11.013 4.314 1.00 0.00 C ATOM 1443 CG GLN A 88 -28.449 10.790 5.753 1.00 0.00 C ATOM 1444 CD GLN A 88 -29.438 11.890 6.144 1.00 0.00 C ATOM 1445 OE1 GLN A 88 -30.371 11.649 6.884 1.00 0.00 O ATOM 1446 NE2 GLN A 88 -29.272 13.097 5.676 1.00 0.00 N ATOM 0 H GLN A 88 -26.673 11.197 2.259 1.00 0.00 H new ATOM 0 HA GLN A 88 -26.404 9.563 4.741 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -27.481 11.978 4.228 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -28.838 11.038 3.641 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -28.921 9.812 5.846 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -27.595 10.797 6.430 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -28.489 13.300 5.055 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -29.925 13.837 5.932 1.00 0.00 H new ATOM 1455 N LEU A 89 -28.341 8.711 2.242 1.00 0.00 N ATOM 1456 CA LEU A 89 -29.117 7.548 1.726 1.00 0.00 C ATOM 1457 C LEU A 89 -28.199 6.335 1.555 1.00 0.00 C ATOM 1458 O LEU A 89 -28.602 5.206 1.751 1.00 0.00 O ATOM 1459 CB LEU A 89 -29.663 8.004 0.371 1.00 0.00 C ATOM 1460 CG LEU A 89 -30.935 8.827 0.586 1.00 0.00 C ATOM 1461 CD1 LEU A 89 -31.274 9.588 -0.696 1.00 0.00 C ATOM 1462 CD2 LEU A 89 -32.091 7.890 0.944 1.00 0.00 C ATOM 0 H LEU A 89 -28.270 9.504 1.604 1.00 0.00 H new ATOM 0 HA LEU A 89 -29.915 7.249 2.406 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -28.915 8.600 -0.153 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -29.878 7.139 -0.256 1.00 0.00 H new ATOM 0 HG LEU A 89 -30.776 9.537 1.397 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -32.180 10.174 -0.542 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -30.450 10.254 -0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -31.434 8.879 -1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -32.998 8.474 1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -32.249 7.181 0.132 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -31.850 7.347 1.858 1.00 0.00 H new ATOM 1474 N PHE A 90 -26.964 6.559 1.195 1.00 0.00 N ATOM 1475 CA PHE A 90 -26.021 5.419 1.015 1.00 0.00 C ATOM 1476 C PHE A 90 -24.983 5.414 2.141 1.00 0.00 C ATOM 1477 O PHE A 90 -24.908 6.342 2.921 1.00 0.00 O ATOM 1478 CB PHE A 90 -25.351 5.665 -0.337 1.00 0.00 C ATOM 1479 CG PHE A 90 -26.112 4.933 -1.415 1.00 0.00 C ATOM 1480 CD1 PHE A 90 -26.298 3.547 -1.324 1.00 0.00 C ATOM 1481 CD2 PHE A 90 -26.633 5.638 -2.508 1.00 0.00 C ATOM 1482 CE1 PHE A 90 -27.005 2.867 -2.325 1.00 0.00 C ATOM 1483 CE2 PHE A 90 -27.340 4.959 -3.508 1.00 0.00 C ATOM 1484 CZ PHE A 90 -27.527 3.573 -3.416 1.00 0.00 C ATOM 0 H PHE A 90 -26.568 7.482 1.018 1.00 0.00 H new ATOM 0 HA PHE A 90 -26.527 4.454 1.045 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -25.327 6.733 -0.555 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -24.317 5.322 -0.310 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -25.896 3.003 -0.482 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -26.489 6.706 -2.579 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -27.147 1.799 -2.255 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -27.741 5.503 -4.350 1.00 0.00 H new ATOM 0 HZ PHE A 90 -28.074 3.050 -4.186 1.00 0.00 H new ATOM 1494 N PRO A 91 -24.217 4.359 2.184 1.00 0.00 N ATOM 1495 CA PRO A 91 -23.170 4.219 3.225 1.00 0.00 C ATOM 1496 C PRO A 91 -21.982 5.138 2.923 1.00 0.00 C ATOM 1497 O PRO A 91 -21.656 6.021 3.691 1.00 0.00 O ATOM 1498 CB PRO A 91 -22.766 2.751 3.129 1.00 0.00 C ATOM 1499 CG PRO A 91 -23.112 2.338 1.733 1.00 0.00 C ATOM 1500 CD PRO A 91 -24.256 3.210 1.277 1.00 0.00 C ATOM 0 HA PRO A 91 -23.516 4.496 4.221 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -21.702 2.622 3.325 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -23.301 2.147 3.862 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -22.252 2.456 1.073 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -23.395 1.286 1.703 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -24.132 3.518 0.239 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -25.208 2.684 1.342 1.00 0.00 H new ATOM 1508 N SER A 92 -21.331 4.937 1.810 1.00 0.00 N ATOM 1509 CA SER A 92 -20.165 5.800 1.461 1.00 0.00 C ATOM 1510 C SER A 92 -19.629 5.428 0.077 1.00 0.00 C ATOM 1511 O SER A 92 -19.021 4.392 -0.107 1.00 0.00 O ATOM 1512 CB SER A 92 -19.120 5.507 2.538 1.00 0.00 C ATOM 1513 OG SER A 92 -17.829 5.478 1.943 1.00 0.00 O ATOM 0 H SER A 92 -21.555 4.213 1.127 1.00 0.00 H new ATOM 0 HA SER A 92 -20.428 6.857 1.426 1.00 0.00 H new ATOM 0 HB2 SER A 92 -19.158 6.270 3.315 1.00 0.00 H new ATOM 0 HB3 SER A 92 -19.333 4.552 3.018 1.00 0.00 H new ATOM 0 HG SER A 92 -17.156 5.292 2.631 1.00 0.00 H new ATOM 1519 N GLY A 93 -19.850 6.265 -0.898 1.00 0.00 N ATOM 1520 CA GLY A 93 -19.356 5.958 -2.269 1.00 0.00 C ATOM 1521 C GLY A 93 -20.537 5.578 -3.163 1.00 0.00 C ATOM 1522 O GLY A 93 -20.737 4.420 -3.469 1.00 0.00 O ATOM 0 H GLY A 93 -20.351 7.148 -0.805 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.837 6.823 -2.682 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -18.636 5.141 -2.233 1.00 0.00 H new ATOM 1526 N PRO A 94 -21.283 6.576 -3.552 1.00 0.00 N ATOM 1527 CA PRO A 94 -22.463 6.352 -4.422 1.00 0.00 C ATOM 1528 C PRO A 94 -22.019 6.000 -5.845 1.00 0.00 C ATOM 1529 O PRO A 94 -22.786 5.489 -6.635 1.00 0.00 O ATOM 1530 CB PRO A 94 -23.189 7.695 -4.393 1.00 0.00 C ATOM 1531 CG PRO A 94 -22.130 8.699 -4.063 1.00 0.00 C ATOM 1532 CD PRO A 94 -21.098 7.993 -3.223 1.00 0.00 C ATOM 0 HA PRO A 94 -23.092 5.527 -4.089 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -23.654 7.913 -5.354 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -23.983 7.699 -3.646 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -21.680 9.097 -4.972 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -22.555 9.544 -3.521 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -20.090 8.330 -3.463 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -21.252 8.180 -2.160 1.00 0.00 H new ATOM 1540 N ALA A 95 -20.785 6.270 -6.174 1.00 0.00 N ATOM 1541 CA ALA A 95 -20.294 5.948 -7.544 1.00 0.00 C ATOM 1542 C ALA A 95 -20.354 4.438 -7.784 1.00 0.00 C ATOM 1543 O ALA A 95 -21.150 3.954 -8.564 1.00 0.00 O ATOM 1544 CB ALA A 95 -18.846 6.439 -7.570 1.00 0.00 C ATOM 0 H ALA A 95 -20.097 6.699 -5.555 1.00 0.00 H new ATOM 0 HA ALA A 95 -20.897 6.417 -8.321 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -18.411 6.238 -8.549 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -18.822 7.511 -7.376 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -18.271 5.918 -6.804 1.00 0.00 H new ATOM 1550 N HIS A 96 -19.518 3.689 -7.119 1.00 0.00 N ATOM 1551 CA HIS A 96 -19.527 2.210 -7.308 1.00 0.00 C ATOM 1552 C HIS A 96 -20.705 1.588 -6.554 1.00 0.00 C ATOM 1553 O HIS A 96 -20.988 0.413 -6.684 1.00 0.00 O ATOM 1554 CB HIS A 96 -18.200 1.727 -6.720 1.00 0.00 C ATOM 1555 CG HIS A 96 -18.243 1.845 -5.222 1.00 0.00 C ATOM 1556 ND1 HIS A 96 -18.630 0.792 -4.409 1.00 0.00 N ATOM 1557 CD2 HIS A 96 -17.950 2.885 -4.375 1.00 0.00 C ATOM 1558 CE1 HIS A 96 -18.560 1.217 -3.133 1.00 0.00 C ATOM 1559 NE2 HIS A 96 -18.151 2.486 -3.056 1.00 0.00 N ATOM 0 H HIS A 96 -18.829 4.037 -6.453 1.00 0.00 H new ATOM 0 HA HIS A 96 -19.635 1.928 -8.355 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -18.017 0.692 -7.009 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -17.376 2.319 -7.119 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -17.615 3.864 -4.685 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -18.805 0.606 -2.277 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -18.015 3.043 -2.212 1.00 0.00 H new ATOM 1567 N GLY A 97 -21.393 2.367 -5.764 1.00 0.00 N ATOM 1568 CA GLY A 97 -22.551 1.819 -5.001 1.00 0.00 C ATOM 1569 C GLY A 97 -23.731 1.597 -5.948 1.00 0.00 C ATOM 1570 O GLY A 97 -23.973 0.497 -6.404 1.00 0.00 O ATOM 0 H GLY A 97 -21.204 3.358 -5.614 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -22.273 0.879 -4.524 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -22.835 2.509 -4.206 1.00 0.00 H new ATOM 1574 N ALA A 98 -24.468 2.633 -6.245 1.00 0.00 N ATOM 1575 CA ALA A 98 -25.638 2.484 -7.162 1.00 0.00 C ATOM 1576 C ALA A 98 -25.286 1.558 -8.332 1.00 0.00 C ATOM 1577 O ALA A 98 -26.125 0.848 -8.848 1.00 0.00 O ATOM 1578 CB ALA A 98 -25.926 3.898 -7.667 1.00 0.00 C ATOM 0 H ALA A 98 -24.312 3.577 -5.893 1.00 0.00 H new ATOM 0 HA ALA A 98 -26.500 2.044 -6.660 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -26.776 3.875 -8.349 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -26.157 4.546 -6.822 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -25.051 4.283 -8.191 1.00 0.00 H new ATOM 1584 N CYS A 99 -24.050 1.562 -8.753 1.00 0.00 N ATOM 1585 CA CYS A 99 -23.648 0.681 -9.888 1.00 0.00 C ATOM 1586 C CYS A 99 -23.720 -0.790 -9.468 1.00 0.00 C ATOM 1587 O CYS A 99 -24.486 -1.563 -10.009 1.00 0.00 O ATOM 1588 CB CYS A 99 -22.207 1.079 -10.205 1.00 0.00 C ATOM 1589 SG CYS A 99 -22.176 2.077 -11.715 1.00 0.00 S ATOM 0 H CYS A 99 -23.303 2.135 -8.362 1.00 0.00 H new ATOM 0 HA CYS A 99 -24.302 0.795 -10.752 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -21.783 1.643 -9.374 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -21.592 0.188 -10.332 1.00 0.00 H new ATOM 1594 N LYS A 100 -22.928 -1.182 -8.508 1.00 0.00 N ATOM 1595 CA LYS A 100 -22.950 -2.603 -8.055 1.00 0.00 C ATOM 1596 C LYS A 100 -24.387 -3.038 -7.754 1.00 0.00 C ATOM 1597 O LYS A 100 -24.852 -4.054 -8.234 1.00 0.00 O ATOM 1598 CB LYS A 100 -22.106 -2.624 -6.781 1.00 0.00 C ATOM 1599 CG LYS A 100 -22.324 -3.947 -6.044 1.00 0.00 C ATOM 1600 CD LYS A 100 -21.262 -4.106 -4.954 1.00 0.00 C ATOM 1601 CE LYS A 100 -21.865 -4.846 -3.757 1.00 0.00 C ATOM 1602 NZ LYS A 100 -20.827 -4.760 -2.691 1.00 0.00 N ATOM 0 H LYS A 100 -22.266 -0.580 -8.017 1.00 0.00 H new ATOM 0 HA LYS A 100 -22.563 -3.285 -8.812 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -21.051 -2.504 -7.029 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -22.380 -1.788 -6.137 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -23.320 -3.969 -5.602 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -22.268 -4.780 -6.745 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -20.406 -4.658 -5.343 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -20.895 -3.128 -4.643 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -22.799 -4.385 -3.437 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -22.091 -5.883 -4.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -21.166 -5.245 -1.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -19.951 -5.213 -3.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -20.638 -3.761 -2.470 1.00 0.00 H new ATOM 1616 N VAL A 101 -25.093 -2.279 -6.962 1.00 0.00 N ATOM 1617 CA VAL A 101 -26.498 -2.650 -6.630 1.00 0.00 C ATOM 1618 C VAL A 101 -27.272 -2.991 -7.906 1.00 0.00 C ATOM 1619 O VAL A 101 -27.813 -4.070 -8.044 1.00 0.00 O ATOM 1620 CB VAL A 101 -27.087 -1.407 -5.962 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -28.605 -1.559 -5.852 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -26.488 -1.248 -4.563 1.00 0.00 C ATOM 0 H VAL A 101 -24.758 -1.418 -6.530 1.00 0.00 H new ATOM 0 HA VAL A 101 -26.552 -3.526 -5.983 1.00 0.00 H new ATOM 0 HB VAL A 101 -26.852 -0.527 -6.560 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -29.026 -0.673 -5.376 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -29.032 -1.673 -6.848 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -28.840 -2.439 -5.253 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -26.907 -0.362 -4.086 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -26.723 -2.128 -3.964 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -25.406 -1.140 -4.641 1.00 0.00 H new ATOM 1632 N ALA A 102 -27.330 -2.080 -8.838 1.00 0.00 N ATOM 1633 CA ALA A 102 -28.071 -2.354 -10.103 1.00 0.00 C ATOM 1634 C ALA A 102 -27.566 -3.650 -10.742 1.00 0.00 C ATOM 1635 O ALA A 102 -28.317 -4.390 -11.347 1.00 0.00 O ATOM 1636 CB ALA A 102 -27.768 -1.158 -11.006 1.00 0.00 C ATOM 0 H ALA A 102 -26.897 -1.158 -8.779 1.00 0.00 H new ATOM 0 HA ALA A 102 -29.141 -2.479 -9.936 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -28.279 -1.284 -11.961 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -28.115 -0.243 -10.527 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.693 -1.093 -11.176 1.00 0.00 H new ATOM 1642 N GLY A 103 -26.298 -3.931 -10.614 1.00 0.00 N ATOM 1643 CA GLY A 103 -25.746 -5.179 -11.215 1.00 0.00 C ATOM 1644 C GLY A 103 -24.297 -4.943 -11.643 1.00 0.00 C ATOM 1645 O GLY A 103 -23.380 -5.555 -11.130 1.00 0.00 O ATOM 0 H GLY A 103 -25.620 -3.351 -10.119 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -25.795 -5.995 -10.494 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -26.346 -5.477 -12.075 1.00 0.00 H new ATOM 1649 N ALA A 104 -24.081 -4.059 -12.578 1.00 0.00 N ATOM 1650 CA ALA A 104 -22.689 -3.785 -13.038 1.00 0.00 C ATOM 1651 C ALA A 104 -21.951 -5.099 -13.307 1.00 0.00 C ATOM 1652 O ALA A 104 -20.926 -5.369 -12.712 1.00 0.00 O ATOM 1653 CB ALA A 104 -22.033 -3.026 -11.884 1.00 0.00 C ATOM 0 H ALA A 104 -24.807 -3.515 -13.043 1.00 0.00 H new ATOM 0 HA ALA A 104 -22.666 -3.214 -13.966 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -21.002 -2.787 -12.145 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -22.583 -2.104 -11.696 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -22.045 -3.646 -10.987 1.00 0.00 H new