USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1071 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 160:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -72:sc= 0.344 USER MOD Single : A 28 ASN : amide:sc= -0.312 X(o=-0.31,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 37:sc= -0.0192 USER MOD Single : A 34 THR OG1 : rot 130:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 150:sc= 0.869 (180deg=0.316) USER MOD Single : A 39 LYS NZ :NH3+ -166:sc= -0.0498 (180deg=-0.293) USER MOD Single : A 41 LYS NZ :NH3+ -153:sc= 0.948 (180deg=0.157) USER MOD Single : A 46 LYS NZ :NH3+ -166:sc= 0.524 (180deg=0.146) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.0412 K(o=-0.041,f=-3.5!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 72 TYR OH : rot 30:sc= -0.0324 USER MOD Single : A 74 GLN : amide:sc= -1.25! X(o=-1.3!,f=-1.7) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl -154:sc= -0.0582 (180deg=-0.473) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 89 GLN : amide:sc= -1.34 K(o=-1.3,f=-3.3) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 100 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0497) USER MOD Single : A 101 LYS NZ :NH3+ -140:sc= 0.927 (180deg=0.165) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0.148 X(o=0.15,f=-0.013) USER MOD Single : A 116 LYS NZ :NH3+ 152:sc= 0.813 (180deg=0.415) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 160:sc= -2.56 (180deg=-3.29!) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 2.389 13.633 -1.781 1.00 35.44 N ATOM 21 CA GLY A 2 3.179 12.867 -0.804 1.00 43.21 C ATOM 22 C GLY A 2 2.315 11.874 -0.037 1.00 4.11 C ATOM 23 O GLY A 2 2.273 11.899 1.193 1.00 71.13 O ATOM 0 HA2 GLY A 2 3.977 12.333 -1.320 1.00 43.21 H new ATOM 0 HA3 GLY A 2 3.655 13.553 -0.103 1.00 43.21 H new ATOM 27 N THR A 3 1.578 11.034 -0.777 1.00 41.03 N ATOM 28 CA THR A 3 0.607 10.091 -0.203 1.00 1.30 C ATOM 29 C THR A 3 1.071 8.655 -0.493 1.00 3.34 C ATOM 30 O THR A 3 1.066 8.230 -1.648 1.00 20.12 O ATOM 31 CB THR A 3 -0.808 10.364 -0.818 1.00 40.02 C ATOM 32 OG1 THR A 3 -1.111 11.768 -0.700 1.00 0.34 O ATOM 33 CG2 THR A 3 -1.915 9.546 -0.134 1.00 75.34 C ATOM 0 H THR A 3 1.639 10.989 -1.794 1.00 41.03 H new ATOM 0 HA THR A 3 0.541 10.223 0.877 1.00 1.30 H new ATOM 0 HB THR A 3 -0.777 10.059 -1.864 1.00 40.02 H new ATOM 0 HG1 THR A 3 -1.995 11.945 -1.085 1.00 0.34 H new ATOM 0 HG21 THR A 3 -2.875 9.773 -0.598 1.00 75.34 H new ATOM 0 HG22 THR A 3 -1.702 8.483 -0.243 1.00 75.34 H new ATOM 0 HG23 THR A 3 -1.955 9.802 0.925 1.00 75.34 H new ATOM 41 N VAL A 4 1.485 7.926 0.558 1.00 74.20 N ATOM 42 CA VAL A 4 2.084 6.586 0.416 1.00 5.25 C ATOM 43 C VAL A 4 1.017 5.519 0.682 1.00 11.44 C ATOM 44 O VAL A 4 0.292 5.600 1.662 1.00 11.30 O ATOM 45 CB VAL A 4 3.314 6.400 1.381 1.00 3.44 C ATOM 46 CG1 VAL A 4 3.960 5.000 1.234 1.00 11.20 C ATOM 47 CG2 VAL A 4 4.361 7.508 1.136 1.00 75.21 C ATOM 0 H VAL A 4 1.415 8.246 1.524 1.00 74.20 H new ATOM 0 HA VAL A 4 2.455 6.477 -0.603 1.00 5.25 H new ATOM 0 HB VAL A 4 2.944 6.480 2.403 1.00 3.44 H new ATOM 0 HG11 VAL A 4 4.804 4.915 1.918 1.00 11.20 H new ATOM 0 HG12 VAL A 4 3.223 4.233 1.471 1.00 11.20 H new ATOM 0 HG13 VAL A 4 4.308 4.866 0.210 1.00 11.20 H new ATOM 0 HG21 VAL A 4 5.205 7.366 1.810 1.00 75.21 H new ATOM 0 HG22 VAL A 4 4.708 7.458 0.104 1.00 75.21 H new ATOM 0 HG23 VAL A 4 3.909 8.483 1.320 1.00 75.21 H new ATOM 57 N VAL A 5 0.911 4.538 -0.225 1.00 70.13 N ATOM 58 CA VAL A 5 -0.072 3.445 -0.130 1.00 21.35 C ATOM 59 C VAL A 5 0.668 2.106 -0.252 1.00 51.45 C ATOM 60 O VAL A 5 1.288 1.839 -1.278 1.00 31.34 O ATOM 61 CB VAL A 5 -1.177 3.585 -1.249 1.00 3.20 C ATOM 62 CG1 VAL A 5 -2.197 2.421 -1.214 1.00 61.20 C ATOM 63 CG2 VAL A 5 -1.894 4.952 -1.143 1.00 62.43 C ATOM 0 H VAL A 5 1.507 4.478 -1.050 1.00 70.13 H new ATOM 0 HA VAL A 5 -0.580 3.492 0.833 1.00 21.35 H new ATOM 0 HB VAL A 5 -0.669 3.533 -2.212 1.00 3.20 H new ATOM 0 HG11 VAL A 5 -2.937 2.562 -2.002 1.00 61.20 H new ATOM 0 HG12 VAL A 5 -1.676 1.476 -1.370 1.00 61.20 H new ATOM 0 HG13 VAL A 5 -2.697 2.404 -0.246 1.00 61.20 H new ATOM 0 HG21 VAL A 5 -2.651 5.027 -1.923 1.00 62.43 H new ATOM 0 HG22 VAL A 5 -2.370 5.039 -0.166 1.00 62.43 H new ATOM 0 HG23 VAL A 5 -1.167 5.755 -1.265 1.00 62.43 H new ATOM 73 N ILE A 6 0.639 1.289 0.816 1.00 10.15 N ATOM 74 CA ILE A 6 1.361 0.004 0.870 1.00 13.42 C ATOM 75 C ILE A 6 0.354 -1.154 0.739 1.00 23.45 C ATOM 76 O ILE A 6 -0.344 -1.502 1.691 1.00 71.41 O ATOM 77 CB ILE A 6 2.205 -0.123 2.200 1.00 35.01 C ATOM 78 CG1 ILE A 6 3.184 1.091 2.358 1.00 71.25 C ATOM 79 CG2 ILE A 6 2.980 -1.462 2.273 1.00 43.03 C ATOM 80 CD1 ILE A 6 4.132 1.304 1.184 1.00 4.43 C ATOM 0 H ILE A 6 0.115 1.500 1.665 1.00 10.15 H new ATOM 0 HA ILE A 6 2.065 -0.041 0.039 1.00 13.42 H new ATOM 0 HB ILE A 6 1.498 -0.111 3.030 1.00 35.01 H new ATOM 0 HG12 ILE A 6 2.596 1.998 2.501 1.00 71.25 H new ATOM 0 HG13 ILE A 6 3.775 0.948 3.263 1.00 71.25 H new ATOM 0 HG21 ILE A 6 3.546 -1.505 3.204 1.00 43.03 H new ATOM 0 HG22 ILE A 6 2.275 -2.293 2.238 1.00 43.03 H new ATOM 0 HG23 ILE A 6 3.666 -1.532 1.428 1.00 43.03 H new ATOM 0 HD11 ILE A 6 4.770 2.165 1.383 1.00 4.43 H new ATOM 0 HD12 ILE A 6 4.751 0.417 1.051 1.00 4.43 H new ATOM 0 HD13 ILE A 6 3.554 1.483 0.277 1.00 4.43 H new ATOM 92 N VAL A 7 0.253 -1.708 -0.468 1.00 43.03 N ATOM 93 CA VAL A 7 -0.628 -2.843 -0.768 1.00 25.23 C ATOM 94 C VAL A 7 0.219 -4.125 -0.825 1.00 22.54 C ATOM 95 O VAL A 7 0.992 -4.320 -1.759 1.00 61.52 O ATOM 96 CB VAL A 7 -1.399 -2.625 -2.121 1.00 54.40 C ATOM 97 CG1 VAL A 7 -2.335 -3.816 -2.437 1.00 33.21 C ATOM 98 CG2 VAL A 7 -2.182 -1.290 -2.093 1.00 11.14 C ATOM 0 H VAL A 7 0.784 -1.381 -1.275 1.00 43.03 H new ATOM 0 HA VAL A 7 -1.378 -2.932 0.018 1.00 25.23 H new ATOM 0 HB VAL A 7 -0.662 -2.570 -2.922 1.00 54.40 H new ATOM 0 HG11 VAL A 7 -2.852 -3.632 -3.379 1.00 33.21 H new ATOM 0 HG12 VAL A 7 -1.746 -4.730 -2.519 1.00 33.21 H new ATOM 0 HG13 VAL A 7 -3.067 -3.926 -1.637 1.00 33.21 H new ATOM 0 HG21 VAL A 7 -2.709 -1.157 -3.038 1.00 11.14 H new ATOM 0 HG22 VAL A 7 -2.902 -1.308 -1.275 1.00 11.14 H new ATOM 0 HG23 VAL A 7 -1.487 -0.463 -1.946 1.00 11.14 H new ATOM 108 N VAL A 8 0.100 -4.973 0.210 1.00 44.24 N ATOM 109 CA VAL A 8 0.851 -6.236 0.305 1.00 64.42 C ATOM 110 C VAL A 8 -0.107 -7.420 0.047 1.00 55.54 C ATOM 111 O VAL A 8 -1.163 -7.513 0.672 1.00 34.55 O ATOM 112 CB VAL A 8 1.533 -6.403 1.720 1.00 73.31 C ATOM 113 CG1 VAL A 8 2.373 -7.698 1.790 1.00 64.14 C ATOM 114 CG2 VAL A 8 2.391 -5.164 2.084 1.00 44.21 C ATOM 0 H VAL A 8 -0.518 -4.803 1.003 1.00 44.24 H new ATOM 0 HA VAL A 8 1.641 -6.220 -0.446 1.00 64.42 H new ATOM 0 HB VAL A 8 0.735 -6.483 2.458 1.00 73.31 H new ATOM 0 HG11 VAL A 8 2.829 -7.783 2.776 1.00 64.14 H new ATOM 0 HG12 VAL A 8 1.729 -8.559 1.612 1.00 64.14 H new ATOM 0 HG13 VAL A 8 3.154 -7.666 1.031 1.00 64.14 H new ATOM 0 HG21 VAL A 8 2.846 -5.312 3.063 1.00 44.21 H new ATOM 0 HG22 VAL A 8 3.173 -5.031 1.337 1.00 44.21 H new ATOM 0 HG23 VAL A 8 1.758 -4.277 2.108 1.00 44.21 H new ATOM 124 N SER A 9 0.254 -8.297 -0.898 1.00 60.10 N ATOM 125 CA SER A 9 -0.463 -9.557 -1.149 1.00 23.24 C ATOM 126 C SER A 9 0.561 -10.644 -1.478 1.00 34.33 C ATOM 127 O SER A 9 1.538 -10.381 -2.177 1.00 61.21 O ATOM 128 CB SER A 9 -1.485 -9.404 -2.303 1.00 41.21 C ATOM 129 OG SER A 9 -2.408 -8.353 -2.054 1.00 52.24 O ATOM 0 H SER A 9 1.055 -8.154 -1.513 1.00 60.10 H new ATOM 0 HA SER A 9 -1.025 -9.833 -0.257 1.00 23.24 H new ATOM 0 HB2 SER A 9 -0.954 -9.209 -3.235 1.00 41.21 H new ATOM 0 HB3 SER A 9 -2.027 -10.340 -2.435 1.00 41.21 H new ATOM 0 HG SER A 9 -2.817 -8.070 -2.898 1.00 52.24 H new ATOM 135 N ARG A 10 0.310 -11.864 -0.983 1.00 62.33 N ATOM 136 CA ARG A 10 1.210 -13.032 -1.137 1.00 65.31 C ATOM 137 C ARG A 10 1.399 -13.432 -2.625 1.00 22.41 C ATOM 138 O ARG A 10 2.404 -14.055 -2.985 1.00 3.22 O ATOM 139 CB ARG A 10 0.612 -14.223 -0.343 1.00 1.31 C ATOM 140 CG ARG A 10 1.435 -15.540 -0.357 1.00 21.44 C ATOM 141 CD ARG A 10 0.622 -16.764 0.118 1.00 0.32 C ATOM 142 NE ARG A 10 1.438 -17.993 0.163 1.00 61.15 N ATOM 143 CZ ARG A 10 1.074 -19.151 0.739 1.00 25.11 C ATOM 144 NH1 ARG A 10 -0.111 -19.291 1.329 1.00 74.24 N ATOM 145 NH2 ARG A 10 1.908 -20.178 0.711 1.00 70.05 N ATOM 0 H ARG A 10 -0.536 -12.078 -0.455 1.00 62.33 H new ATOM 0 HA ARG A 10 2.193 -12.764 -0.750 1.00 65.31 H new ATOM 0 HB2 ARG A 10 0.481 -13.912 0.693 1.00 1.31 H new ATOM 0 HB3 ARG A 10 -0.381 -14.435 -0.740 1.00 1.31 H new ATOM 0 HG2 ARG A 10 1.800 -15.723 -1.368 1.00 21.44 H new ATOM 0 HG3 ARG A 10 2.310 -15.422 0.282 1.00 21.44 H new ATOM 0 HD2 ARG A 10 0.214 -16.565 1.109 1.00 0.32 H new ATOM 0 HD3 ARG A 10 -0.225 -16.917 -0.551 1.00 0.32 H new ATOM 0 HE ARG A 10 2.356 -17.961 -0.281 1.00 61.15 H new ATOM 0 HH11 ARG A 10 -0.766 -18.509 1.351 1.00 74.24 H new ATOM 0 HH12 ARG A 10 -0.365 -20.180 1.759 1.00 74.24 H new ATOM 0 HH21 ARG A 10 2.816 -20.085 0.256 1.00 70.05 H new ATOM 0 HH22 ARG A 10 1.643 -21.062 1.145 1.00 70.05 H new ATOM 159 N ASP A 11 0.431 -13.043 -3.474 1.00 61.14 N ATOM 160 CA ASP A 11 0.333 -13.514 -4.870 1.00 3.41 C ATOM 161 C ASP A 11 0.355 -12.344 -5.884 1.00 22.14 C ATOM 162 O ASP A 11 -0.090 -11.235 -5.574 1.00 12.22 O ATOM 163 CB ASP A 11 -0.969 -14.340 -5.007 1.00 71.53 C ATOM 164 CG ASP A 11 -1.210 -14.860 -6.435 1.00 1.44 C ATOM 165 OD1 ASP A 11 -2.145 -14.379 -7.096 1.00 40.40 O ATOM 166 OD2 ASP A 11 -0.454 -15.739 -6.900 1.00 31.13 O ATOM 0 H ASP A 11 -0.308 -12.391 -3.212 1.00 61.14 H new ATOM 0 HA ASP A 11 1.201 -14.132 -5.101 1.00 3.41 H new ATOM 0 HB2 ASP A 11 -0.929 -15.186 -4.321 1.00 71.53 H new ATOM 0 HB3 ASP A 11 -1.816 -13.724 -4.704 1.00 71.53 H new ATOM 171 N GLU A 12 0.862 -12.642 -7.107 1.00 35.42 N ATOM 172 CA GLU A 12 0.975 -11.689 -8.230 1.00 44.25 C ATOM 173 C GLU A 12 -0.389 -11.282 -8.766 1.00 73.00 C ATOM 174 O GLU A 12 -0.634 -10.087 -8.953 1.00 5.25 O ATOM 175 CB GLU A 12 1.822 -12.289 -9.399 1.00 12.12 C ATOM 176 CG GLU A 12 3.341 -12.245 -9.179 1.00 62.03 C ATOM 177 CD GLU A 12 3.898 -10.812 -9.079 1.00 71.45 C ATOM 178 OE1 GLU A 12 3.912 -10.232 -7.964 1.00 21.14 O ATOM 179 OE2 GLU A 12 4.347 -10.265 -10.103 1.00 62.32 O ATOM 0 H GLU A 12 1.210 -13.572 -7.340 1.00 35.42 H new ATOM 0 HA GLU A 12 1.476 -10.805 -7.835 1.00 44.25 H new ATOM 0 HB2 GLU A 12 1.521 -13.325 -9.553 1.00 12.12 H new ATOM 0 HB3 GLU A 12 1.586 -11.749 -10.316 1.00 12.12 H new ATOM 0 HG2 GLU A 12 3.585 -12.787 -8.266 1.00 62.03 H new ATOM 0 HG3 GLU A 12 3.836 -12.764 -10.000 1.00 62.03 H new ATOM 186 N ARG A 13 -1.271 -12.283 -9.004 1.00 63.54 N ATOM 187 CA ARG A 13 -2.561 -12.055 -9.682 1.00 13.13 C ATOM 188 C ARG A 13 -3.398 -11.059 -8.874 1.00 4.14 C ATOM 189 O ARG A 13 -4.027 -10.188 -9.452 1.00 74.23 O ATOM 190 CB ARG A 13 -3.383 -13.357 -9.914 1.00 24.12 C ATOM 191 CG ARG A 13 -2.784 -14.405 -10.889 1.00 55.12 C ATOM 192 CD ARG A 13 -1.512 -15.111 -10.357 1.00 31.33 C ATOM 193 NE ARG A 13 -1.275 -16.405 -11.025 1.00 33.11 N ATOM 194 CZ ARG A 13 -1.039 -17.562 -10.387 1.00 1.33 C ATOM 195 NH1 ARG A 13 -1.002 -17.624 -9.059 1.00 61.04 N ATOM 196 NH2 ARG A 13 -0.874 -18.668 -11.093 1.00 14.31 N ATOM 0 H ARG A 13 -1.109 -13.253 -8.735 1.00 63.54 H new ATOM 0 HA ARG A 13 -2.326 -11.655 -10.668 1.00 13.13 H new ATOM 0 HB2 ARG A 13 -3.532 -13.840 -8.948 1.00 24.12 H new ATOM 0 HB3 ARG A 13 -4.368 -13.074 -10.285 1.00 24.12 H new ATOM 0 HG2 ARG A 13 -3.541 -15.159 -11.105 1.00 55.12 H new ATOM 0 HG3 ARG A 13 -2.546 -13.913 -11.832 1.00 55.12 H new ATOM 0 HD2 ARG A 13 -0.649 -14.463 -10.507 1.00 31.33 H new ATOM 0 HD3 ARG A 13 -1.609 -15.270 -9.283 1.00 31.33 H new ATOM 0 HE ARG A 13 -1.292 -16.421 -12.045 1.00 33.11 H new ATOM 0 HH11 ARG A 13 -1.155 -16.782 -8.505 1.00 61.04 H new ATOM 0 HH12 ARG A 13 -0.821 -18.514 -8.595 1.00 61.04 H new ATOM 0 HH21 ARG A 13 -0.927 -18.636 -12.111 1.00 14.31 H new ATOM 0 HH22 ARG A 13 -0.694 -19.553 -10.619 1.00 14.31 H new ATOM 210 N ILE A 14 -3.349 -11.184 -7.530 1.00 52.13 N ATOM 211 CA ILE A 14 -4.046 -10.266 -6.618 1.00 40.42 C ATOM 212 C ILE A 14 -3.524 -8.816 -6.818 1.00 3.21 C ATOM 213 O ILE A 14 -4.296 -7.917 -7.157 1.00 44.21 O ATOM 214 CB ILE A 14 -3.879 -10.695 -5.103 1.00 10.34 C ATOM 215 CG1 ILE A 14 -4.263 -12.202 -4.899 1.00 54.05 C ATOM 216 CG2 ILE A 14 -4.728 -9.777 -4.178 1.00 24.45 C ATOM 217 CD1 ILE A 14 -4.144 -12.701 -3.463 1.00 14.23 C ATOM 0 H ILE A 14 -2.828 -11.920 -7.054 1.00 52.13 H new ATOM 0 HA ILE A 14 -5.108 -10.310 -6.859 1.00 40.42 H new ATOM 0 HB ILE A 14 -2.830 -10.578 -4.831 1.00 10.34 H new ATOM 0 HG12 ILE A 14 -5.289 -12.350 -5.237 1.00 54.05 H new ATOM 0 HG13 ILE A 14 -3.625 -12.815 -5.536 1.00 54.05 H new ATOM 0 HG21 ILE A 14 -4.600 -10.087 -3.141 1.00 24.45 H new ATOM 0 HG22 ILE A 14 -4.400 -8.744 -4.291 1.00 24.45 H new ATOM 0 HG23 ILE A 14 -5.780 -9.856 -4.453 1.00 24.45 H new ATOM 0 HD11 ILE A 14 -4.429 -13.752 -3.418 1.00 14.23 H new ATOM 0 HD12 ILE A 14 -3.114 -12.590 -3.123 1.00 14.23 H new ATOM 0 HD13 ILE A 14 -4.803 -12.118 -2.820 1.00 14.23 H new ATOM 229 N LEU A 15 -2.186 -8.646 -6.682 1.00 22.33 N ATOM 230 CA LEU A 15 -1.494 -7.335 -6.789 1.00 62.12 C ATOM 231 C LEU A 15 -1.768 -6.618 -8.133 1.00 14.21 C ATOM 232 O LEU A 15 -1.965 -5.399 -8.154 1.00 23.31 O ATOM 233 CB LEU A 15 0.039 -7.522 -6.624 1.00 40.51 C ATOM 234 CG LEU A 15 0.547 -7.951 -5.215 1.00 50.24 C ATOM 235 CD1 LEU A 15 2.055 -8.252 -5.255 1.00 4.21 C ATOM 236 CD2 LEU A 15 0.223 -6.879 -4.144 1.00 32.51 C ATOM 0 H LEU A 15 -1.550 -9.421 -6.493 1.00 22.33 H new ATOM 0 HA LEU A 15 -1.893 -6.710 -5.990 1.00 62.12 H new ATOM 0 HB2 LEU A 15 0.370 -8.268 -7.346 1.00 40.51 H new ATOM 0 HB3 LEU A 15 0.526 -6.584 -6.890 1.00 40.51 H new ATOM 0 HG LEU A 15 0.021 -8.863 -4.932 1.00 50.24 H new ATOM 0 HD11 LEU A 15 2.393 -8.550 -4.263 1.00 4.21 H new ATOM 0 HD12 LEU A 15 2.246 -9.060 -5.961 1.00 4.21 H new ATOM 0 HD13 LEU A 15 2.596 -7.360 -5.570 1.00 4.21 H new ATOM 0 HD21 LEU A 15 0.592 -7.211 -3.174 1.00 32.51 H new ATOM 0 HD22 LEU A 15 0.705 -5.939 -4.413 1.00 32.51 H new ATOM 0 HD23 LEU A 15 -0.856 -6.732 -4.091 1.00 32.51 H new ATOM 248 N GLU A 16 -1.770 -7.382 -9.241 1.00 14.52 N ATOM 249 CA GLU A 16 -1.885 -6.812 -10.601 1.00 62.32 C ATOM 250 C GLU A 16 -3.333 -6.454 -10.938 1.00 14.53 C ATOM 251 O GLU A 16 -3.547 -5.526 -11.711 1.00 71.25 O ATOM 252 CB GLU A 16 -1.270 -7.757 -11.661 1.00 64.22 C ATOM 253 CG GLU A 16 -1.974 -9.111 -11.822 1.00 31.01 C ATOM 254 CD GLU A 16 -1.154 -10.126 -12.636 1.00 33.52 C ATOM 255 OE1 GLU A 16 -1.522 -10.435 -13.793 1.00 64.33 O ATOM 256 OE2 GLU A 16 -0.130 -10.614 -12.112 1.00 11.25 O ATOM 0 H GLU A 16 -1.693 -8.399 -9.223 1.00 14.52 H new ATOM 0 HA GLU A 16 -1.311 -5.885 -10.618 1.00 62.32 H new ATOM 0 HB2 GLU A 16 -1.275 -7.247 -12.624 1.00 64.22 H new ATOM 0 HB3 GLU A 16 -0.227 -7.937 -11.401 1.00 64.22 H new ATOM 0 HG2 GLU A 16 -2.179 -9.527 -10.835 1.00 31.01 H new ATOM 0 HG3 GLU A 16 -2.937 -8.957 -12.309 1.00 31.01 H new ATOM 263 N GLU A 17 -4.317 -7.166 -10.340 1.00 24.41 N ATOM 264 CA GLU A 17 -5.736 -6.758 -10.432 1.00 35.41 C ATOM 265 C GLU A 17 -5.902 -5.381 -9.785 1.00 45.41 C ATOM 266 O GLU A 17 -6.476 -4.468 -10.377 1.00 22.40 O ATOM 267 CB GLU A 17 -6.681 -7.761 -9.730 1.00 24.44 C ATOM 268 CG GLU A 17 -6.738 -9.163 -10.347 1.00 71.54 C ATOM 269 CD GLU A 17 -7.132 -9.184 -11.828 1.00 3.12 C ATOM 270 OE1 GLU A 17 -6.240 -9.320 -12.695 1.00 22.34 O ATOM 271 OE2 GLU A 17 -8.339 -9.085 -12.135 1.00 2.10 O ATOM 0 H GLU A 17 -4.157 -8.014 -9.796 1.00 24.41 H new ATOM 0 HA GLU A 17 -6.006 -6.730 -11.488 1.00 35.41 H new ATOM 0 HB2 GLU A 17 -6.373 -7.854 -8.689 1.00 24.44 H new ATOM 0 HB3 GLU A 17 -7.688 -7.343 -9.728 1.00 24.44 H new ATOM 0 HG2 GLU A 17 -5.762 -9.636 -10.236 1.00 71.54 H new ATOM 0 HG3 GLU A 17 -7.451 -9.766 -9.785 1.00 71.54 H new ATOM 278 N LEU A 18 -5.336 -5.264 -8.568 1.00 4.55 N ATOM 279 CA LEU A 18 -5.363 -4.038 -7.757 1.00 74.21 C ATOM 280 C LEU A 18 -4.598 -2.891 -8.454 1.00 54.03 C ATOM 281 O LEU A 18 -4.976 -1.724 -8.336 1.00 51.32 O ATOM 282 CB LEU A 18 -4.765 -4.343 -6.356 1.00 41.40 C ATOM 283 CG LEU A 18 -5.482 -5.483 -5.556 1.00 43.10 C ATOM 284 CD1 LEU A 18 -4.800 -5.759 -4.202 1.00 12.33 C ATOM 285 CD2 LEU A 18 -6.978 -5.177 -5.375 1.00 73.11 C ATOM 0 H LEU A 18 -4.840 -6.033 -8.117 1.00 4.55 H new ATOM 0 HA LEU A 18 -6.395 -3.707 -7.641 1.00 74.21 H new ATOM 0 HB2 LEU A 18 -3.716 -4.612 -6.478 1.00 41.40 H new ATOM 0 HB3 LEU A 18 -4.793 -3.430 -5.760 1.00 41.40 H new ATOM 0 HG LEU A 18 -5.394 -6.394 -6.148 1.00 43.10 H new ATOM 0 HD11 LEU A 18 -5.331 -6.557 -3.683 1.00 12.33 H new ATOM 0 HD12 LEU A 18 -3.766 -6.061 -4.370 1.00 12.33 H new ATOM 0 HD13 LEU A 18 -4.819 -4.855 -3.594 1.00 12.33 H new ATOM 0 HD21 LEU A 18 -7.450 -5.985 -4.816 1.00 73.11 H new ATOM 0 HD22 LEU A 18 -7.094 -4.242 -4.828 1.00 73.11 H new ATOM 0 HD23 LEU A 18 -7.452 -5.087 -6.352 1.00 73.11 H new ATOM 297 N LEU A 19 -3.536 -3.262 -9.201 1.00 60.04 N ATOM 298 CA LEU A 19 -2.720 -2.335 -10.009 1.00 32.14 C ATOM 299 C LEU A 19 -3.561 -1.735 -11.142 1.00 50.41 C ATOM 300 O LEU A 19 -3.573 -0.517 -11.329 1.00 15.21 O ATOM 301 CB LEU A 19 -1.481 -3.081 -10.578 1.00 4.24 C ATOM 302 CG LEU A 19 -0.565 -2.297 -11.577 1.00 14.12 C ATOM 303 CD1 LEU A 19 0.032 -1.028 -10.934 1.00 73.22 C ATOM 304 CD2 LEU A 19 0.542 -3.216 -12.140 1.00 1.24 C ATOM 0 H LEU A 19 -3.218 -4.229 -9.259 1.00 60.04 H new ATOM 0 HA LEU A 19 -2.374 -1.519 -9.374 1.00 32.14 H new ATOM 0 HB2 LEU A 19 -0.866 -3.402 -9.738 1.00 4.24 H new ATOM 0 HB3 LEU A 19 -1.832 -3.983 -11.079 1.00 4.24 H new ATOM 0 HG LEU A 19 -1.189 -1.968 -12.408 1.00 14.12 H new ATOM 0 HD11 LEU A 19 0.661 -0.513 -11.660 1.00 73.22 H new ATOM 0 HD12 LEU A 19 -0.774 -0.366 -10.619 1.00 73.22 H new ATOM 0 HD13 LEU A 19 0.632 -1.307 -10.068 1.00 73.22 H new ATOM 0 HD21 LEU A 19 1.167 -2.651 -12.832 1.00 1.24 H new ATOM 0 HD22 LEU A 19 1.155 -3.591 -11.321 1.00 1.24 H new ATOM 0 HD23 LEU A 19 0.086 -4.055 -12.665 1.00 1.24 H new ATOM 316 N GLU A 20 -4.286 -2.614 -11.860 1.00 75.22 N ATOM 317 CA GLU A 20 -5.172 -2.224 -12.970 1.00 22.01 C ATOM 318 C GLU A 20 -6.303 -1.302 -12.473 1.00 71.24 C ATOM 319 O GLU A 20 -6.682 -0.373 -13.177 1.00 13.45 O ATOM 320 CB GLU A 20 -5.748 -3.486 -13.657 1.00 64.34 C ATOM 321 CG GLU A 20 -4.688 -4.354 -14.370 1.00 41.54 C ATOM 322 CD GLU A 20 -5.243 -5.726 -14.779 1.00 1.11 C ATOM 323 OE1 GLU A 20 -5.615 -5.921 -15.961 1.00 15.51 O ATOM 324 OE2 GLU A 20 -5.320 -6.617 -13.912 1.00 4.53 O ATOM 0 H GLU A 20 -4.272 -3.619 -11.684 1.00 75.22 H new ATOM 0 HA GLU A 20 -4.588 -1.666 -13.702 1.00 22.01 H new ATOM 0 HB2 GLU A 20 -6.257 -4.094 -12.909 1.00 64.34 H new ATOM 0 HB3 GLU A 20 -6.500 -3.180 -14.384 1.00 64.34 H new ATOM 0 HG2 GLU A 20 -4.328 -3.831 -15.256 1.00 41.54 H new ATOM 0 HG3 GLU A 20 -3.831 -4.492 -13.711 1.00 41.54 H new ATOM 331 N VAL A 21 -6.795 -1.552 -11.239 1.00 24.14 N ATOM 332 CA VAL A 21 -7.821 -0.707 -10.595 1.00 5.32 C ATOM 333 C VAL A 21 -7.302 0.747 -10.428 1.00 35.31 C ATOM 334 O VAL A 21 -8.042 1.703 -10.686 1.00 34.25 O ATOM 335 CB VAL A 21 -8.281 -1.309 -9.203 1.00 43.43 C ATOM 336 CG1 VAL A 21 -9.286 -0.383 -8.470 1.00 65.02 C ATOM 337 CG2 VAL A 21 -8.892 -2.721 -9.389 1.00 73.03 C ATOM 0 H VAL A 21 -6.493 -2.340 -10.666 1.00 24.14 H new ATOM 0 HA VAL A 21 -8.695 -0.688 -11.246 1.00 5.32 H new ATOM 0 HB VAL A 21 -7.390 -1.387 -8.580 1.00 43.43 H new ATOM 0 HG11 VAL A 21 -9.573 -0.836 -7.521 1.00 65.02 H new ATOM 0 HG12 VAL A 21 -8.820 0.585 -8.284 1.00 65.02 H new ATOM 0 HG13 VAL A 21 -10.172 -0.245 -9.089 1.00 65.02 H new ATOM 0 HG21 VAL A 21 -9.201 -3.114 -8.420 1.00 73.03 H new ATOM 0 HG22 VAL A 21 -9.758 -2.659 -10.048 1.00 73.03 H new ATOM 0 HG23 VAL A 21 -8.148 -3.384 -9.830 1.00 73.03 H new ATOM 347 N VAL A 22 -6.011 0.889 -10.048 1.00 53.21 N ATOM 348 CA VAL A 22 -5.357 2.209 -9.887 1.00 52.24 C ATOM 349 C VAL A 22 -5.204 2.921 -11.249 1.00 53.05 C ATOM 350 O VAL A 22 -5.554 4.093 -11.381 1.00 22.14 O ATOM 351 CB VAL A 22 -3.935 2.098 -9.206 1.00 41.21 C ATOM 352 CG1 VAL A 22 -3.314 3.502 -8.985 1.00 45.22 C ATOM 353 CG2 VAL A 22 -4.002 1.315 -7.875 1.00 2.52 C ATOM 0 H VAL A 22 -5.398 0.099 -9.846 1.00 53.21 H new ATOM 0 HA VAL A 22 -6.007 2.792 -9.234 1.00 52.24 H new ATOM 0 HB VAL A 22 -3.291 1.541 -9.886 1.00 41.21 H new ATOM 0 HG11 VAL A 22 -2.336 3.397 -8.515 1.00 45.22 H new ATOM 0 HG12 VAL A 22 -3.203 4.006 -9.945 1.00 45.22 H new ATOM 0 HG13 VAL A 22 -3.966 4.091 -8.339 1.00 45.22 H new ATOM 0 HG21 VAL A 22 -3.006 1.259 -7.435 1.00 2.52 H new ATOM 0 HG22 VAL A 22 -4.675 1.826 -7.186 1.00 2.52 H new ATOM 0 HG23 VAL A 22 -4.373 0.307 -8.064 1.00 2.52 H new ATOM 363 N LEU A 23 -4.699 2.177 -12.253 1.00 43.03 N ATOM 364 CA LEU A 23 -4.334 2.731 -13.579 1.00 44.31 C ATOM 365 C LEU A 23 -5.577 3.189 -14.377 1.00 72.11 C ATOM 366 O LEU A 23 -5.525 4.199 -15.094 1.00 51.04 O ATOM 367 CB LEU A 23 -3.528 1.677 -14.394 1.00 50.02 C ATOM 368 CG LEU A 23 -2.208 1.154 -13.732 1.00 72.31 C ATOM 369 CD1 LEU A 23 -1.514 0.095 -14.617 1.00 63.22 C ATOM 370 CD2 LEU A 23 -1.246 2.310 -13.379 1.00 53.33 C ATOM 0 H LEU A 23 -4.531 1.174 -12.171 1.00 43.03 H new ATOM 0 HA LEU A 23 -3.713 3.611 -13.410 1.00 44.31 H new ATOM 0 HB2 LEU A 23 -4.177 0.823 -14.586 1.00 50.02 H new ATOM 0 HB3 LEU A 23 -3.277 2.111 -15.362 1.00 50.02 H new ATOM 0 HG LEU A 23 -2.488 0.670 -12.796 1.00 72.31 H new ATOM 0 HD11 LEU A 23 -0.602 -0.246 -14.128 1.00 63.22 H new ATOM 0 HD12 LEU A 23 -2.185 -0.751 -14.765 1.00 63.22 H new ATOM 0 HD13 LEU A 23 -1.265 0.535 -15.583 1.00 63.22 H new ATOM 0 HD21 LEU A 23 -0.343 1.905 -12.922 1.00 53.33 H new ATOM 0 HD22 LEU A 23 -0.982 2.853 -14.286 1.00 53.33 H new ATOM 0 HD23 LEU A 23 -1.734 2.988 -12.679 1.00 53.33 H new ATOM 382 N LYS A 24 -6.682 2.427 -14.252 1.00 71.34 N ATOM 383 CA LYS A 24 -7.955 2.704 -14.961 1.00 5.24 C ATOM 384 C LYS A 24 -8.764 3.808 -14.251 1.00 45.11 C ATOM 385 O LYS A 24 -9.596 4.477 -14.884 1.00 75.12 O ATOM 386 CB LYS A 24 -8.810 1.409 -15.078 1.00 4.41 C ATOM 387 CG LYS A 24 -8.131 0.248 -15.852 1.00 11.44 C ATOM 388 CD LYS A 24 -7.782 0.592 -17.321 1.00 65.13 C ATOM 389 CE LYS A 24 -9.017 0.881 -18.194 1.00 70.14 C ATOM 390 NZ LYS A 24 -8.647 1.173 -19.602 1.00 51.12 N ATOM 0 H LYS A 24 -6.721 1.600 -13.656 1.00 71.34 H new ATOM 0 HA LYS A 24 -7.705 3.055 -15.962 1.00 5.24 H new ATOM 0 HB2 LYS A 24 -9.058 1.062 -14.075 1.00 4.41 H new ATOM 0 HB3 LYS A 24 -9.750 1.655 -15.571 1.00 4.41 H new ATOM 0 HG2 LYS A 24 -7.218 -0.039 -15.330 1.00 11.44 H new ATOM 0 HG3 LYS A 24 -8.791 -0.619 -15.839 1.00 11.44 H new ATOM 0 HD2 LYS A 24 -7.125 1.461 -17.336 1.00 65.13 H new ATOM 0 HD3 LYS A 24 -7.224 -0.237 -17.757 1.00 65.13 H new ATOM 0 HE2 LYS A 24 -9.689 0.023 -18.166 1.00 70.14 H new ATOM 0 HE3 LYS A 24 -9.564 1.728 -17.780 1.00 70.14 H new ATOM 0 HZ1 LYS A 24 -9.507 1.362 -20.155 1.00 51.12 H new ATOM 0 HZ2 LYS A 24 -8.026 2.007 -19.632 1.00 51.12 H new ATOM 0 HZ3 LYS A 24 -8.148 0.355 -20.007 1.00 51.12 H new ATOM 404 N SER A 25 -8.533 3.963 -12.934 1.00 54.01 N ATOM 405 CA SER A 25 -9.149 5.028 -12.133 1.00 72.44 C ATOM 406 C SER A 25 -8.424 6.359 -12.399 1.00 74.10 C ATOM 407 O SER A 25 -9.010 7.284 -12.973 1.00 32.23 O ATOM 408 CB SER A 25 -9.125 4.659 -10.625 1.00 51.35 C ATOM 409 OG SER A 25 -9.764 5.642 -9.821 1.00 11.33 O ATOM 0 H SER A 25 -7.915 3.353 -12.400 1.00 54.01 H new ATOM 0 HA SER A 25 -10.193 5.141 -12.424 1.00 72.44 H new ATOM 0 HB2 SER A 25 -9.618 3.697 -10.480 1.00 51.35 H new ATOM 0 HB3 SER A 25 -8.092 4.540 -10.298 1.00 51.35 H new ATOM 0 HG SER A 25 -9.205 6.446 -9.781 1.00 11.33 H new ATOM 415 N ASP A 26 -7.137 6.445 -12.009 1.00 22.11 N ATOM 416 CA ASP A 26 -6.341 7.689 -12.126 1.00 12.35 C ATOM 417 C ASP A 26 -4.895 7.387 -12.592 1.00 74.20 C ATOM 418 O ASP A 26 -4.176 6.641 -11.915 1.00 65.22 O ATOM 419 CB ASP A 26 -6.313 8.439 -10.767 1.00 62.20 C ATOM 420 CG ASP A 26 -7.709 8.906 -10.326 1.00 43.11 C ATOM 421 OD1 ASP A 26 -8.219 9.898 -10.903 1.00 33.33 O ATOM 422 OD2 ASP A 26 -8.310 8.287 -9.415 1.00 10.13 O ATOM 0 H ASP A 26 -6.621 5.663 -11.607 1.00 22.11 H new ATOM 0 HA ASP A 26 -6.816 8.322 -12.876 1.00 12.35 H new ATOM 0 HB2 ASP A 26 -5.894 7.785 -10.003 1.00 62.20 H new ATOM 0 HB3 ASP A 26 -5.652 9.302 -10.845 1.00 62.20 H new ATOM 427 N PRO A 27 -4.434 7.994 -13.744 1.00 41.24 N ATOM 428 CA PRO A 27 -3.043 7.839 -14.252 1.00 21.35 C ATOM 429 C PRO A 27 -2.037 8.818 -13.582 1.00 34.35 C ATOM 430 O PRO A 27 -0.873 8.912 -13.996 1.00 22.34 O ATOM 431 CB PRO A 27 -3.220 8.141 -15.760 1.00 64.32 C ATOM 432 CG PRO A 27 -4.301 9.186 -15.814 1.00 31.11 C ATOM 433 CD PRO A 27 -5.247 8.864 -14.660 1.00 43.21 C ATOM 0 HA PRO A 27 -2.619 6.858 -14.038 1.00 21.35 H new ATOM 0 HB2 PRO A 27 -2.293 8.506 -16.202 1.00 64.32 H new ATOM 0 HB3 PRO A 27 -3.506 7.246 -16.313 1.00 64.32 H new ATOM 0 HG2 PRO A 27 -3.883 10.187 -15.709 1.00 31.11 H new ATOM 0 HG3 PRO A 27 -4.825 9.158 -16.769 1.00 31.11 H new ATOM 0 HD2 PRO A 27 -5.581 9.770 -14.155 1.00 43.21 H new ATOM 0 HD3 PRO A 27 -6.140 8.347 -15.011 1.00 43.21 H new ATOM 441 N ASN A 28 -2.505 9.543 -12.547 1.00 31.32 N ATOM 442 CA ASN A 28 -1.695 10.532 -11.804 1.00 41.41 C ATOM 443 C ASN A 28 -0.862 9.871 -10.698 1.00 22.34 C ATOM 444 O ASN A 28 0.098 10.465 -10.206 1.00 32.05 O ATOM 445 CB ASN A 28 -2.615 11.621 -11.176 1.00 52.42 C ATOM 446 CG ASN A 28 -3.491 12.379 -12.185 1.00 14.43 C ATOM 447 OD1 ASN A 28 -4.590 12.828 -11.849 1.00 22.11 O ATOM 448 ND2 ASN A 28 -3.018 12.560 -13.416 1.00 72.42 N ATOM 0 H ASN A 28 -3.461 9.459 -12.200 1.00 31.32 H new ATOM 0 HA ASN A 28 -1.011 10.992 -12.518 1.00 41.41 H new ATOM 0 HB2 ASN A 28 -3.262 11.149 -10.436 1.00 52.42 H new ATOM 0 HB3 ASN A 28 -1.993 12.340 -10.643 1.00 52.42 H new ATOM 0 HD21 ASN A 28 -3.567 13.078 -14.102 1.00 72.42 H new ATOM 0 HD22 ASN A 28 -2.107 12.180 -13.673 1.00 72.42 H new ATOM 455 N VAL A 29 -1.241 8.650 -10.307 1.00 45.42 N ATOM 456 CA VAL A 29 -0.613 7.944 -9.181 1.00 65.05 C ATOM 457 C VAL A 29 0.632 7.159 -9.660 1.00 44.11 C ATOM 458 O VAL A 29 0.544 6.369 -10.609 1.00 24.03 O ATOM 459 CB VAL A 29 -1.644 6.969 -8.498 1.00 34.22 C ATOM 460 CG1 VAL A 29 -1.060 6.348 -7.206 1.00 74.22 C ATOM 461 CG2 VAL A 29 -2.991 7.688 -8.219 1.00 72.23 C ATOM 0 H VAL A 29 -1.989 8.123 -10.759 1.00 45.42 H new ATOM 0 HA VAL A 29 -0.295 8.684 -8.446 1.00 65.05 H new ATOM 0 HB VAL A 29 -1.841 6.153 -9.194 1.00 34.22 H new ATOM 0 HG11 VAL A 29 -1.796 5.680 -6.758 1.00 74.22 H new ATOM 0 HG12 VAL A 29 -0.159 5.785 -7.448 1.00 74.22 H new ATOM 0 HG13 VAL A 29 -0.814 7.141 -6.500 1.00 74.22 H new ATOM 0 HG21 VAL A 29 -3.684 6.992 -7.747 1.00 72.23 H new ATOM 0 HG22 VAL A 29 -2.820 8.536 -7.555 1.00 72.23 H new ATOM 0 HG23 VAL A 29 -3.416 8.042 -9.158 1.00 72.23 H new ATOM 471 N LYS A 30 1.787 7.415 -9.009 1.00 52.15 N ATOM 472 CA LYS A 30 3.027 6.639 -9.214 1.00 62.24 C ATOM 473 C LYS A 30 2.809 5.209 -8.688 1.00 32.11 C ATOM 474 O LYS A 30 2.476 5.029 -7.528 1.00 31.05 O ATOM 475 CB LYS A 30 4.207 7.342 -8.472 1.00 3.24 C ATOM 476 CG LYS A 30 5.559 6.579 -8.441 1.00 45.54 C ATOM 477 CD LYS A 30 6.129 6.293 -9.850 1.00 60.23 C ATOM 478 CE LYS A 30 7.506 5.616 -9.805 1.00 24.05 C ATOM 479 NZ LYS A 30 8.015 5.317 -11.165 1.00 63.40 N ATOM 0 H LYS A 30 1.885 8.166 -8.326 1.00 52.15 H new ATOM 0 HA LYS A 30 3.277 6.587 -10.274 1.00 62.24 H new ATOM 0 HB2 LYS A 30 4.374 8.313 -8.939 1.00 3.24 H new ATOM 0 HB3 LYS A 30 3.899 7.532 -7.444 1.00 3.24 H new ATOM 0 HG2 LYS A 30 6.285 7.162 -7.874 1.00 45.54 H new ATOM 0 HG3 LYS A 30 5.424 5.635 -7.912 1.00 45.54 H new ATOM 0 HD2 LYS A 30 5.433 5.656 -10.397 1.00 60.23 H new ATOM 0 HD3 LYS A 30 6.207 7.229 -10.403 1.00 60.23 H new ATOM 0 HE2 LYS A 30 8.213 6.263 -9.286 1.00 24.05 H new ATOM 0 HE3 LYS A 30 7.439 4.692 -9.230 1.00 24.05 H new ATOM 0 HZ1 LYS A 30 8.947 4.860 -11.094 1.00 63.40 H new ATOM 0 HZ2 LYS A 30 7.353 4.679 -11.651 1.00 63.40 H new ATOM 0 HZ3 LYS A 30 8.103 6.201 -11.705 1.00 63.40 H new ATOM 493 N THR A 31 2.956 4.194 -9.548 1.00 52.35 N ATOM 494 CA THR A 31 2.725 2.789 -9.162 1.00 12.41 C ATOM 495 C THR A 31 3.928 1.913 -9.527 1.00 53.24 C ATOM 496 O THR A 31 4.455 1.995 -10.643 1.00 35.25 O ATOM 497 CB THR A 31 1.423 2.241 -9.833 1.00 23.20 C ATOM 498 OG1 THR A 31 1.394 2.611 -11.227 1.00 50.31 O ATOM 499 CG2 THR A 31 0.151 2.755 -9.137 1.00 74.10 C ATOM 0 H THR A 31 3.235 4.316 -10.521 1.00 52.35 H new ATOM 0 HA THR A 31 2.598 2.754 -8.080 1.00 12.41 H new ATOM 0 HB THR A 31 1.440 1.156 -9.735 1.00 23.20 H new ATOM 0 HG1 THR A 31 2.302 2.572 -11.595 1.00 50.31 H new ATOM 0 HG21 THR A 31 -0.727 2.348 -9.638 1.00 74.10 H new ATOM 0 HG22 THR A 31 0.154 2.438 -8.094 1.00 74.10 H new ATOM 0 HG23 THR A 31 0.124 3.844 -9.185 1.00 74.10 H new ATOM 507 N VAL A 32 4.334 1.072 -8.556 1.00 3.13 N ATOM 508 CA VAL A 32 5.460 0.118 -8.674 1.00 5.24 C ATOM 509 C VAL A 32 5.052 -1.185 -7.963 1.00 24.30 C ATOM 510 O VAL A 32 4.447 -1.122 -6.896 1.00 53.31 O ATOM 511 CB VAL A 32 6.795 0.662 -8.009 1.00 74.11 C ATOM 512 CG1 VAL A 32 7.974 -0.332 -8.174 1.00 74.11 C ATOM 513 CG2 VAL A 32 7.178 2.056 -8.550 1.00 3.03 C ATOM 0 H VAL A 32 3.878 1.034 -7.644 1.00 3.13 H new ATOM 0 HA VAL A 32 5.664 -0.037 -9.733 1.00 5.24 H new ATOM 0 HB VAL A 32 6.591 0.760 -6.943 1.00 74.11 H new ATOM 0 HG11 VAL A 32 8.867 0.081 -7.704 1.00 74.11 H new ATOM 0 HG12 VAL A 32 7.720 -1.280 -7.700 1.00 74.11 H new ATOM 0 HG13 VAL A 32 8.165 -0.497 -9.234 1.00 74.11 H new ATOM 0 HG21 VAL A 32 8.097 2.393 -8.070 1.00 3.03 H new ATOM 0 HG22 VAL A 32 7.332 1.998 -9.628 1.00 3.03 H new ATOM 0 HG23 VAL A 32 6.376 2.763 -8.335 1.00 3.03 H new ATOM 523 N ARG A 33 5.375 -2.356 -8.547 1.00 61.12 N ATOM 524 CA ARG A 33 5.184 -3.656 -7.879 1.00 61.31 C ATOM 525 C ARG A 33 6.570 -4.246 -7.556 1.00 52.44 C ATOM 526 O ARG A 33 7.178 -4.949 -8.374 1.00 22.32 O ATOM 527 CB ARG A 33 4.302 -4.610 -8.748 1.00 73.33 C ATOM 528 CG ARG A 33 4.148 -6.051 -8.185 1.00 2.31 C ATOM 529 CD ARG A 33 2.952 -6.828 -8.770 1.00 60.44 C ATOM 530 NE ARG A 33 2.922 -6.838 -10.244 1.00 34.31 N ATOM 531 CZ ARG A 33 2.293 -7.755 -11.003 1.00 63.53 C ATOM 532 NH1 ARG A 33 1.644 -8.782 -10.453 1.00 63.41 N ATOM 533 NH2 ARG A 33 2.265 -7.598 -12.321 1.00 5.12 N ATOM 0 H ARG A 33 5.771 -2.426 -9.484 1.00 61.12 H new ATOM 0 HA ARG A 33 4.640 -3.526 -6.944 1.00 61.31 H new ATOM 0 HB2 ARG A 33 3.311 -4.169 -8.854 1.00 73.33 H new ATOM 0 HB3 ARG A 33 4.733 -4.670 -9.747 1.00 73.33 H new ATOM 0 HG2 ARG A 33 5.063 -6.608 -8.385 1.00 2.31 H new ATOM 0 HG3 ARG A 33 4.038 -5.997 -7.102 1.00 2.31 H new ATOM 0 HD2 ARG A 33 2.984 -7.856 -8.408 1.00 60.44 H new ATOM 0 HD3 ARG A 33 2.026 -6.388 -8.399 1.00 60.44 H new ATOM 0 HE ARG A 33 3.418 -6.090 -10.728 1.00 34.31 H new ATOM 0 HH11 ARG A 33 1.617 -8.884 -9.438 1.00 63.41 H new ATOM 0 HH12 ARG A 33 1.174 -9.465 -11.047 1.00 63.41 H new ATOM 0 HH21 ARG A 33 2.717 -6.789 -12.748 1.00 5.12 H new ATOM 0 HH22 ARG A 33 1.792 -8.286 -12.907 1.00 5.12 H new ATOM 547 N THR A 34 7.086 -3.861 -6.377 1.00 34.02 N ATOM 548 CA THR A 34 8.366 -4.347 -5.829 1.00 31.00 C ATOM 549 C THR A 34 8.146 -4.952 -4.431 1.00 42.21 C ATOM 550 O THR A 34 7.336 -4.441 -3.647 1.00 73.41 O ATOM 551 CB THR A 34 9.442 -3.204 -5.775 1.00 11.41 C ATOM 552 OG1 THR A 34 10.675 -3.703 -5.223 1.00 41.13 O ATOM 553 CG2 THR A 34 8.968 -1.976 -4.969 1.00 51.24 C ATOM 0 H THR A 34 6.618 -3.191 -5.766 1.00 34.02 H new ATOM 0 HA THR A 34 8.746 -5.122 -6.495 1.00 31.00 H new ATOM 0 HB THR A 34 9.602 -2.876 -6.802 1.00 11.41 H new ATOM 0 HG1 THR A 34 11.420 -3.457 -5.810 1.00 41.13 H new ATOM 0 HG21 THR A 34 9.752 -1.218 -4.966 1.00 51.24 H new ATOM 0 HG22 THR A 34 8.068 -1.565 -5.427 1.00 51.24 H new ATOM 0 HG23 THR A 34 8.749 -2.276 -3.944 1.00 51.24 H new ATOM 561 N ASP A 35 8.858 -6.047 -4.135 1.00 34.44 N ATOM 562 CA ASP A 35 8.851 -6.682 -2.800 1.00 4.02 C ATOM 563 C ASP A 35 10.033 -6.166 -1.955 1.00 12.13 C ATOM 564 O ASP A 35 10.005 -6.247 -0.721 1.00 55.25 O ATOM 565 CB ASP A 35 8.913 -8.230 -2.927 1.00 1.51 C ATOM 566 CG ASP A 35 10.265 -8.751 -3.457 1.00 62.34 C ATOM 567 OD1 ASP A 35 10.969 -9.476 -2.729 1.00 21.34 O ATOM 568 OD2 ASP A 35 10.631 -8.437 -4.610 1.00 43.24 O ATOM 0 H ASP A 35 9.457 -6.522 -4.811 1.00 34.44 H new ATOM 0 HA ASP A 35 7.920 -6.416 -2.299 1.00 4.02 H new ATOM 0 HB2 ASP A 35 8.719 -8.675 -1.951 1.00 1.51 H new ATOM 0 HB3 ASP A 35 8.118 -8.564 -3.593 1.00 1.51 H new ATOM 573 N ASP A 36 11.061 -5.632 -2.646 1.00 54.21 N ATOM 574 CA ASP A 36 12.291 -5.127 -2.007 1.00 32.23 C ATOM 575 C ASP A 36 12.003 -3.836 -1.248 1.00 23.34 C ATOM 576 O ASP A 36 11.807 -2.798 -1.870 1.00 64.21 O ATOM 577 CB ASP A 36 13.384 -4.850 -3.064 1.00 72.44 C ATOM 578 CG ASP A 36 13.836 -6.114 -3.797 1.00 41.10 C ATOM 579 OD1 ASP A 36 14.765 -6.787 -3.315 1.00 23.42 O ATOM 580 OD2 ASP A 36 13.274 -6.439 -4.860 1.00 5.40 O ATOM 0 H ASP A 36 11.061 -5.539 -3.662 1.00 54.21 H new ATOM 0 HA ASP A 36 12.644 -5.891 -1.314 1.00 32.23 H new ATOM 0 HB2 ASP A 36 13.006 -4.130 -3.790 1.00 72.44 H new ATOM 0 HB3 ASP A 36 14.245 -4.390 -2.578 1.00 72.44 H new ATOM 585 N LYS A 37 11.984 -3.929 0.092 1.00 32.22 N ATOM 586 CA LYS A 37 11.813 -2.770 1.007 1.00 21.42 C ATOM 587 C LYS A 37 12.862 -1.672 0.767 1.00 33.01 C ATOM 588 O LYS A 37 12.600 -0.498 1.049 1.00 60.11 O ATOM 589 CB LYS A 37 11.806 -3.206 2.509 1.00 61.35 C ATOM 590 CG LYS A 37 13.027 -4.012 3.037 1.00 63.33 C ATOM 591 CD LYS A 37 13.006 -5.504 2.623 1.00 35.41 C ATOM 592 CE LYS A 37 13.978 -6.361 3.441 1.00 71.41 C ATOM 593 NZ LYS A 37 15.393 -5.959 3.245 1.00 73.00 N ATOM 0 H LYS A 37 12.087 -4.817 0.583 1.00 32.22 H new ATOM 0 HA LYS A 37 10.836 -2.346 0.775 1.00 21.42 H new ATOM 0 HB2 LYS A 37 11.710 -2.307 3.118 1.00 61.35 H new ATOM 0 HB3 LYS A 37 10.911 -3.804 2.680 1.00 61.35 H new ATOM 0 HG2 LYS A 37 13.943 -3.553 2.666 1.00 63.33 H new ATOM 0 HG3 LYS A 37 13.054 -3.945 4.125 1.00 63.33 H new ATOM 0 HD2 LYS A 37 11.996 -5.895 2.742 1.00 35.41 H new ATOM 0 HD3 LYS A 37 13.257 -5.587 1.566 1.00 35.41 H new ATOM 0 HE2 LYS A 37 13.725 -6.283 4.498 1.00 71.41 H new ATOM 0 HE3 LYS A 37 13.859 -7.408 3.161 1.00 71.41 H new ATOM 0 HZ1 LYS A 37 15.934 -6.160 4.110 1.00 73.00 H new ATOM 0 HZ2 LYS A 37 15.799 -6.494 2.451 1.00 73.00 H new ATOM 0 HZ3 LYS A 37 15.439 -4.941 3.036 1.00 73.00 H new ATOM 607 N GLU A 38 14.034 -2.076 0.237 1.00 62.23 N ATOM 608 CA GLU A 38 15.079 -1.152 -0.243 1.00 20.43 C ATOM 609 C GLU A 38 14.501 -0.242 -1.338 1.00 33.12 C ATOM 610 O GLU A 38 14.475 0.982 -1.190 1.00 63.51 O ATOM 611 CB GLU A 38 16.312 -1.938 -0.799 1.00 3.01 C ATOM 612 CG GLU A 38 17.186 -2.642 0.267 1.00 22.53 C ATOM 613 CD GLU A 38 16.444 -3.679 1.122 1.00 34.23 C ATOM 614 OE1 GLU A 38 15.873 -4.635 0.552 1.00 45.11 O ATOM 615 OE2 GLU A 38 16.427 -3.548 2.364 1.00 35.22 O ATOM 0 H GLU A 38 14.283 -3.059 0.130 1.00 62.23 H new ATOM 0 HA GLU A 38 15.414 -0.545 0.598 1.00 20.43 H new ATOM 0 HB2 GLU A 38 15.955 -2.688 -1.505 1.00 3.01 H new ATOM 0 HB3 GLU A 38 16.940 -1.246 -1.360 1.00 3.01 H new ATOM 0 HG2 GLU A 38 18.020 -3.134 -0.234 1.00 22.53 H new ATOM 0 HG3 GLU A 38 17.611 -1.885 0.926 1.00 22.53 H new ATOM 622 N LYS A 39 13.969 -0.893 -2.392 1.00 5.21 N ATOM 623 CA LYS A 39 13.395 -0.231 -3.569 1.00 63.21 C ATOM 624 C LYS A 39 12.130 0.575 -3.202 1.00 63.55 C ATOM 625 O LYS A 39 11.938 1.669 -3.723 1.00 2.11 O ATOM 626 CB LYS A 39 13.085 -1.292 -4.661 1.00 64.25 C ATOM 627 CG LYS A 39 12.486 -0.747 -5.980 1.00 3.13 C ATOM 628 CD LYS A 39 13.449 0.179 -6.755 1.00 10.14 C ATOM 629 CE LYS A 39 12.869 0.610 -8.114 1.00 65.14 C ATOM 630 NZ LYS A 39 12.551 -0.552 -8.990 1.00 31.43 N ATOM 0 H LYS A 39 13.928 -1.911 -2.445 1.00 5.21 H new ATOM 0 HA LYS A 39 14.123 0.479 -3.960 1.00 63.21 H new ATOM 0 HB2 LYS A 39 14.007 -1.824 -4.895 1.00 64.25 H new ATOM 0 HB3 LYS A 39 12.392 -2.023 -4.244 1.00 64.25 H new ATOM 0 HG2 LYS A 39 12.208 -1.586 -6.618 1.00 3.13 H new ATOM 0 HG3 LYS A 39 11.570 -0.200 -5.756 1.00 3.13 H new ATOM 0 HD2 LYS A 39 13.662 1.064 -6.155 1.00 10.14 H new ATOM 0 HD3 LYS A 39 14.397 -0.335 -6.913 1.00 10.14 H new ATOM 0 HE2 LYS A 39 11.965 1.196 -7.951 1.00 65.14 H new ATOM 0 HE3 LYS A 39 13.583 1.259 -8.621 1.00 65.14 H new ATOM 0 HZ1 LYS A 39 12.392 -0.220 -9.963 1.00 31.43 H new ATOM 0 HZ2 LYS A 39 13.345 -1.223 -8.979 1.00 31.43 H new ATOM 0 HZ3 LYS A 39 11.693 -1.025 -8.641 1.00 31.43 H new ATOM 644 N VAL A 40 11.300 0.025 -2.279 1.00 12.53 N ATOM 645 CA VAL A 40 10.050 0.669 -1.821 1.00 73.15 C ATOM 646 C VAL A 40 10.344 2.058 -1.234 1.00 2.22 C ATOM 647 O VAL A 40 9.710 3.041 -1.625 1.00 14.15 O ATOM 648 CB VAL A 40 9.288 -0.191 -0.737 1.00 61.30 C ATOM 649 CG1 VAL A 40 7.998 0.521 -0.265 1.00 24.52 C ATOM 650 CG2 VAL A 40 8.960 -1.612 -1.252 1.00 42.34 C ATOM 0 H VAL A 40 11.481 -0.875 -1.835 1.00 12.53 H new ATOM 0 HA VAL A 40 9.409 0.757 -2.698 1.00 73.15 H new ATOM 0 HB VAL A 40 9.960 -0.293 0.115 1.00 61.30 H new ATOM 0 HG11 VAL A 40 7.495 -0.094 0.481 1.00 24.52 H new ATOM 0 HG12 VAL A 40 8.254 1.485 0.174 1.00 24.52 H new ATOM 0 HG13 VAL A 40 7.335 0.674 -1.116 1.00 24.52 H new ATOM 0 HG21 VAL A 40 8.436 -2.169 -0.475 1.00 42.34 H new ATOM 0 HG22 VAL A 40 8.327 -1.541 -2.137 1.00 42.34 H new ATOM 0 HG23 VAL A 40 9.885 -2.129 -1.508 1.00 42.34 H new ATOM 660 N LYS A 41 11.330 2.111 -0.313 1.00 12.03 N ATOM 661 CA LYS A 41 11.744 3.363 0.346 1.00 75.22 C ATOM 662 C LYS A 41 12.260 4.382 -0.679 1.00 35.42 C ATOM 663 O LYS A 41 11.941 5.559 -0.573 1.00 22.33 O ATOM 664 CB LYS A 41 12.833 3.105 1.410 1.00 4.41 C ATOM 665 CG LYS A 41 12.344 2.311 2.632 1.00 22.23 C ATOM 666 CD LYS A 41 13.491 2.033 3.623 1.00 63.51 C ATOM 667 CE LYS A 41 13.053 1.209 4.835 1.00 72.31 C ATOM 668 NZ LYS A 41 14.204 0.880 5.718 1.00 74.02 N ATOM 0 H LYS A 41 11.857 1.292 -0.009 1.00 12.03 H new ATOM 0 HA LYS A 41 10.862 3.772 0.840 1.00 75.22 H new ATOM 0 HB2 LYS A 41 13.658 2.564 0.946 1.00 4.41 H new ATOM 0 HB3 LYS A 41 13.229 4.063 1.748 1.00 4.41 H new ATOM 0 HG2 LYS A 41 11.554 2.867 3.136 1.00 22.23 H new ATOM 0 HG3 LYS A 41 11.909 1.367 2.303 1.00 22.23 H new ATOM 0 HD2 LYS A 41 14.292 1.506 3.104 1.00 63.51 H new ATOM 0 HD3 LYS A 41 13.904 2.982 3.966 1.00 63.51 H new ATOM 0 HE2 LYS A 41 12.306 1.764 5.402 1.00 72.31 H new ATOM 0 HE3 LYS A 41 12.578 0.288 4.497 1.00 72.31 H new ATOM 0 HZ1 LYS A 41 14.005 -0.001 6.233 1.00 74.02 H new ATOM 0 HZ2 LYS A 41 15.061 0.758 5.141 1.00 74.02 H new ATOM 0 HZ3 LYS A 41 14.352 1.653 6.398 1.00 74.02 H new ATOM 682 N GLU A 42 13.041 3.893 -1.671 1.00 42.41 N ATOM 683 CA GLU A 42 13.591 4.723 -2.768 1.00 42.34 C ATOM 684 C GLU A 42 12.466 5.381 -3.573 1.00 61.01 C ATOM 685 O GLU A 42 12.553 6.564 -3.921 1.00 63.25 O ATOM 686 CB GLU A 42 14.484 3.874 -3.706 1.00 4.14 C ATOM 687 CG GLU A 42 15.725 3.274 -3.025 1.00 42.01 C ATOM 688 CD GLU A 42 16.561 2.406 -3.972 1.00 22.34 C ATOM 689 OE1 GLU A 42 16.623 1.164 -3.781 1.00 23.44 O ATOM 690 OE2 GLU A 42 17.154 2.958 -4.924 1.00 13.15 O ATOM 0 H GLU A 42 13.308 2.910 -1.733 1.00 42.41 H new ATOM 0 HA GLU A 42 14.201 5.506 -2.317 1.00 42.34 H new ATOM 0 HB2 GLU A 42 13.886 3.064 -4.123 1.00 4.14 H new ATOM 0 HB3 GLU A 42 14.807 4.495 -4.542 1.00 4.14 H new ATOM 0 HG2 GLU A 42 16.346 4.081 -2.636 1.00 42.01 H new ATOM 0 HG3 GLU A 42 15.411 2.673 -2.171 1.00 42.01 H new ATOM 697 N GLU A 43 11.402 4.605 -3.837 1.00 13.45 N ATOM 698 CA GLU A 43 10.228 5.091 -4.567 1.00 73.24 C ATOM 699 C GLU A 43 9.418 6.092 -3.704 1.00 34.42 C ATOM 700 O GLU A 43 8.842 7.045 -4.245 1.00 40.13 O ATOM 701 CB GLU A 43 9.350 3.901 -5.040 1.00 5.24 C ATOM 702 CG GLU A 43 10.057 2.897 -5.981 1.00 0.50 C ATOM 703 CD GLU A 43 10.713 3.554 -7.216 1.00 34.45 C ATOM 704 OE1 GLU A 43 11.954 3.721 -7.230 1.00 61.00 O ATOM 705 OE2 GLU A 43 9.993 3.921 -8.170 1.00 21.53 O ATOM 0 H GLU A 43 11.335 3.628 -3.550 1.00 13.45 H new ATOM 0 HA GLU A 43 10.567 5.626 -5.454 1.00 73.24 H new ATOM 0 HB2 GLU A 43 8.992 3.362 -4.163 1.00 5.24 H new ATOM 0 HB3 GLU A 43 8.472 4.298 -5.551 1.00 5.24 H new ATOM 0 HG2 GLU A 43 10.821 2.362 -5.417 1.00 0.50 H new ATOM 0 HG3 GLU A 43 9.332 2.156 -6.318 1.00 0.50 H new ATOM 712 N ILE A 44 9.403 5.874 -2.362 1.00 13.44 N ATOM 713 CA ILE A 44 8.782 6.811 -1.393 1.00 63.44 C ATOM 714 C ILE A 44 9.551 8.155 -1.400 1.00 53.51 C ATOM 715 O ILE A 44 8.938 9.216 -1.336 1.00 54.21 O ATOM 716 CB ILE A 44 8.746 6.212 0.078 1.00 14.22 C ATOM 717 CG1 ILE A 44 7.855 4.929 0.144 1.00 54.54 C ATOM 718 CG2 ILE A 44 8.261 7.258 1.124 1.00 51.04 C ATOM 719 CD1 ILE A 44 7.843 4.226 1.497 1.00 30.34 C ATOM 0 H ILE A 44 9.818 5.050 -1.926 1.00 13.44 H new ATOM 0 HA ILE A 44 7.750 6.973 -1.704 1.00 63.44 H new ATOM 0 HB ILE A 44 9.771 5.940 0.331 1.00 14.22 H new ATOM 0 HG12 ILE A 44 6.832 5.201 -0.117 1.00 54.54 H new ATOM 0 HG13 ILE A 44 8.201 4.224 -0.612 1.00 54.54 H new ATOM 0 HG21 ILE A 44 8.252 6.804 2.115 1.00 51.04 H new ATOM 0 HG22 ILE A 44 8.936 8.114 1.123 1.00 51.04 H new ATOM 0 HG23 ILE A 44 7.255 7.589 0.868 1.00 51.04 H new ATOM 0 HD11 ILE A 44 7.199 3.348 1.445 1.00 30.34 H new ATOM 0 HD12 ILE A 44 8.856 3.918 1.756 1.00 30.34 H new ATOM 0 HD13 ILE A 44 7.466 4.909 2.258 1.00 30.34 H new ATOM 731 N GLU A 45 10.901 8.072 -1.518 1.00 15.14 N ATOM 732 CA GLU A 45 11.799 9.251 -1.569 1.00 30.34 C ATOM 733 C GLU A 45 11.541 10.081 -2.841 1.00 2.21 C ATOM 734 O GLU A 45 11.558 11.312 -2.800 1.00 32.21 O ATOM 735 CB GLU A 45 13.291 8.816 -1.515 1.00 75.11 C ATOM 736 CG GLU A 45 13.710 8.130 -0.204 1.00 20.50 C ATOM 737 CD GLU A 45 15.189 7.716 -0.177 1.00 41.53 C ATOM 738 OE1 GLU A 45 16.044 8.542 0.215 1.00 33.41 O ATOM 739 OE2 GLU A 45 15.510 6.568 -0.552 1.00 14.13 O ATOM 0 H GLU A 45 11.397 7.183 -1.580 1.00 15.14 H new ATOM 0 HA GLU A 45 11.584 9.869 -0.697 1.00 30.34 H new ATOM 0 HB2 GLU A 45 13.488 8.137 -2.344 1.00 75.11 H new ATOM 0 HB3 GLU A 45 13.918 9.695 -1.667 1.00 75.11 H new ATOM 0 HG2 GLU A 45 13.514 8.805 0.629 1.00 20.50 H new ATOM 0 HG3 GLU A 45 13.090 7.246 -0.051 1.00 20.50 H new ATOM 746 N LYS A 46 11.289 9.378 -3.958 1.00 23.21 N ATOM 747 CA LYS A 46 10.978 9.995 -5.259 1.00 5.43 C ATOM 748 C LYS A 46 9.605 10.696 -5.209 1.00 4.33 C ATOM 749 O LYS A 46 9.486 11.844 -5.625 1.00 24.11 O ATOM 750 CB LYS A 46 11.035 8.916 -6.376 1.00 24.11 C ATOM 751 CG LYS A 46 12.468 8.371 -6.632 1.00 62.35 C ATOM 752 CD LYS A 46 12.489 7.039 -7.417 1.00 51.01 C ATOM 753 CE LYS A 46 11.856 7.135 -8.814 1.00 21.21 C ATOM 754 NZ LYS A 46 11.885 5.830 -9.529 1.00 71.43 N ATOM 0 H LYS A 46 11.295 8.358 -3.984 1.00 23.21 H new ATOM 0 HA LYS A 46 11.722 10.758 -5.487 1.00 5.43 H new ATOM 0 HB2 LYS A 46 10.382 8.087 -6.104 1.00 24.11 H new ATOM 0 HB3 LYS A 46 10.644 9.340 -7.301 1.00 24.11 H new ATOM 0 HG2 LYS A 46 13.039 9.118 -7.183 1.00 62.35 H new ATOM 0 HG3 LYS A 46 12.970 8.228 -5.675 1.00 62.35 H new ATOM 0 HD2 LYS A 46 13.521 6.703 -7.518 1.00 51.01 H new ATOM 0 HD3 LYS A 46 11.961 6.279 -6.840 1.00 51.01 H new ATOM 0 HE2 LYS A 46 10.825 7.475 -8.722 1.00 21.21 H new ATOM 0 HE3 LYS A 46 12.387 7.883 -9.402 1.00 21.21 H new ATOM 0 HZ1 LYS A 46 11.673 5.981 -10.536 1.00 71.43 H new ATOM 0 HZ2 LYS A 46 12.828 5.403 -9.434 1.00 71.43 H new ATOM 0 HZ3 LYS A 46 11.173 5.193 -9.118 1.00 71.43 H new ATOM 768 N ALA A 47 8.597 10.008 -4.637 1.00 14.00 N ATOM 769 CA ALA A 47 7.232 10.556 -4.478 1.00 31.33 C ATOM 770 C ALA A 47 7.184 11.692 -3.425 1.00 12.41 C ATOM 771 O ALA A 47 6.302 12.552 -3.471 1.00 21.15 O ATOM 772 CB ALA A 47 6.253 9.431 -4.115 1.00 33.24 C ATOM 0 H ALA A 47 8.703 9.061 -4.273 1.00 14.00 H new ATOM 0 HA ALA A 47 6.933 10.992 -5.431 1.00 31.33 H new ATOM 0 HB1 ALA A 47 5.251 9.844 -4.000 1.00 33.24 H new ATOM 0 HB2 ALA A 47 6.248 8.683 -4.908 1.00 33.24 H new ATOM 0 HB3 ALA A 47 6.564 8.966 -3.179 1.00 33.24 H new ATOM 778 N ARG A 48 8.155 11.670 -2.492 1.00 45.43 N ATOM 779 CA ARG A 48 8.337 12.700 -1.447 1.00 50.45 C ATOM 780 C ARG A 48 8.789 14.029 -2.083 1.00 40.42 C ATOM 781 O ARG A 48 8.188 15.080 -1.840 1.00 63.30 O ATOM 782 CB ARG A 48 9.396 12.187 -0.425 1.00 32.13 C ATOM 783 CG ARG A 48 9.775 13.145 0.733 1.00 51.44 C ATOM 784 CD ARG A 48 8.606 13.458 1.686 1.00 14.24 C ATOM 785 NE ARG A 48 9.062 14.146 2.913 1.00 70.44 N ATOM 786 CZ ARG A 48 8.375 15.075 3.590 1.00 54.33 C ATOM 787 NH1 ARG A 48 7.169 15.477 3.175 1.00 34.35 N ATOM 788 NH2 ARG A 48 8.891 15.578 4.705 1.00 23.13 N ATOM 0 H ARG A 48 8.848 10.923 -2.441 1.00 45.43 H new ATOM 0 HA ARG A 48 7.394 12.881 -0.932 1.00 50.45 H new ATOM 0 HB2 ARG A 48 9.026 11.259 0.010 1.00 32.13 H new ATOM 0 HB3 ARG A 48 10.305 11.941 -0.973 1.00 32.13 H new ATOM 0 HG2 ARG A 48 10.591 12.704 1.306 1.00 51.44 H new ATOM 0 HG3 ARG A 48 10.149 14.078 0.313 1.00 51.44 H new ATOM 0 HD2 ARG A 48 7.875 14.081 1.171 1.00 14.24 H new ATOM 0 HD3 ARG A 48 8.100 12.531 1.956 1.00 14.24 H new ATOM 0 HE ARG A 48 9.981 13.891 3.276 1.00 70.44 H new ATOM 0 HH11 ARG A 48 6.760 15.075 2.332 1.00 34.35 H new ATOM 0 HH12 ARG A 48 6.658 16.186 3.702 1.00 34.35 H new ATOM 0 HH21 ARG A 48 9.800 15.256 5.037 1.00 23.13 H new ATOM 0 HH22 ARG A 48 8.378 16.286 5.230 1.00 23.13 H new ATOM 802 N LYS A 49 9.842 13.943 -2.922 1.00 35.44 N ATOM 803 CA LYS A 49 10.458 15.113 -3.585 1.00 54.30 C ATOM 804 C LYS A 49 9.528 15.682 -4.670 1.00 74.35 C ATOM 805 O LYS A 49 9.349 16.897 -4.766 1.00 12.03 O ATOM 806 CB LYS A 49 11.820 14.715 -4.207 1.00 24.21 C ATOM 807 CG LYS A 49 12.857 14.227 -3.178 1.00 34.14 C ATOM 808 CD LYS A 49 14.168 13.739 -3.839 1.00 12.03 C ATOM 809 CE LYS A 49 15.187 13.227 -2.811 1.00 30.54 C ATOM 810 NZ LYS A 49 16.434 12.732 -3.445 1.00 2.51 N ATOM 0 H LYS A 49 10.291 13.058 -3.160 1.00 35.44 H new ATOM 0 HA LYS A 49 10.620 15.886 -2.834 1.00 54.30 H new ATOM 0 HB2 LYS A 49 11.656 13.929 -4.944 1.00 24.21 H new ATOM 0 HB3 LYS A 49 12.229 15.573 -4.742 1.00 24.21 H new ATOM 0 HG2 LYS A 49 13.084 15.037 -2.484 1.00 34.14 H new ATOM 0 HG3 LYS A 49 12.427 13.416 -2.591 1.00 34.14 H new ATOM 0 HD2 LYS A 49 13.940 12.943 -4.548 1.00 12.03 H new ATOM 0 HD3 LYS A 49 14.610 14.556 -4.409 1.00 12.03 H new ATOM 0 HE2 LYS A 49 15.431 14.030 -2.115 1.00 30.54 H new ATOM 0 HE3 LYS A 49 14.737 12.424 -2.227 1.00 30.54 H new ATOM 0 HZ1 LYS A 49 17.089 12.398 -2.709 1.00 2.51 H new ATOM 0 HZ2 LYS A 49 16.208 11.948 -4.090 1.00 2.51 H new ATOM 0 HZ3 LYS A 49 16.881 13.503 -3.981 1.00 2.51 H new ATOM 824 N GLN A 50 8.937 14.773 -5.467 1.00 34.42 N ATOM 825 CA GLN A 50 7.971 15.118 -6.528 1.00 71.31 C ATOM 826 C GLN A 50 6.647 15.642 -5.933 1.00 74.42 C ATOM 827 O GLN A 50 5.877 16.319 -6.626 1.00 53.42 O ATOM 828 CB GLN A 50 7.700 13.876 -7.426 1.00 42.03 C ATOM 829 CG GLN A 50 8.880 13.447 -8.334 1.00 51.00 C ATOM 830 CD GLN A 50 9.097 14.402 -9.508 1.00 12.01 C ATOM 831 OE1 GLN A 50 8.562 14.205 -10.597 1.00 62.25 O ATOM 832 NE2 GLN A 50 9.868 15.445 -9.296 1.00 75.14 N ATOM 0 H GLN A 50 9.117 13.772 -5.393 1.00 34.42 H new ATOM 0 HA GLN A 50 8.405 15.913 -7.134 1.00 71.31 H new ATOM 0 HB2 GLN A 50 7.432 13.036 -6.785 1.00 42.03 H new ATOM 0 HB3 GLN A 50 6.835 14.085 -8.056 1.00 42.03 H new ATOM 0 HG2 GLN A 50 9.792 13.396 -7.739 1.00 51.00 H new ATOM 0 HG3 GLN A 50 8.693 12.444 -8.717 1.00 51.00 H new ATOM 0 HE21 GLN A 50 10.299 15.583 -8.382 1.00 75.14 H new ATOM 0 HE22 GLN A 50 10.035 16.116 -10.046 1.00 75.14 H new ATOM 841 N GLY A 51 6.386 15.301 -4.650 1.00 62.25 N ATOM 842 CA GLY A 51 5.175 15.723 -3.949 1.00 42.01 C ATOM 843 C GLY A 51 3.927 15.114 -4.556 1.00 63.23 C ATOM 844 O GLY A 51 2.913 15.794 -4.715 1.00 31.24 O ATOM 0 H GLY A 51 7.012 14.728 -4.084 1.00 62.25 H new ATOM 0 HA2 GLY A 51 5.245 15.436 -2.900 1.00 42.01 H new ATOM 0 HA3 GLY A 51 5.099 16.810 -3.978 1.00 42.01 H new ATOM 848 N ARG A 52 4.017 13.820 -4.895 1.00 74.05 N ATOM 849 CA ARG A 52 2.962 13.084 -5.609 1.00 21.14 C ATOM 850 C ARG A 52 2.526 11.837 -4.810 1.00 14.35 C ATOM 851 O ARG A 52 3.221 11.432 -3.864 1.00 51.44 O ATOM 852 CB ARG A 52 3.458 12.683 -7.029 1.00 31.03 C ATOM 853 CG ARG A 52 4.739 11.818 -7.074 1.00 65.21 C ATOM 854 CD ARG A 52 4.964 11.176 -8.458 1.00 53.43 C ATOM 855 NE ARG A 52 4.940 12.185 -9.540 1.00 62.41 N ATOM 856 CZ ARG A 52 5.895 12.376 -10.456 1.00 51.14 C ATOM 857 NH1 ARG A 52 6.999 11.633 -10.466 1.00 10.12 N ATOM 858 NH2 ARG A 52 5.743 13.337 -11.353 1.00 32.15 N ATOM 0 H ARG A 52 4.833 13.248 -4.679 1.00 74.05 H new ATOM 0 HA ARG A 52 2.094 13.735 -5.713 1.00 21.14 H new ATOM 0 HB2 ARG A 52 2.658 12.141 -7.533 1.00 31.03 H new ATOM 0 HB3 ARG A 52 3.636 13.593 -7.602 1.00 31.03 H new ATOM 0 HG2 ARG A 52 5.600 12.435 -6.818 1.00 65.21 H new ATOM 0 HG3 ARG A 52 4.672 11.035 -6.319 1.00 65.21 H new ATOM 0 HD2 ARG A 52 5.922 10.656 -8.467 1.00 53.43 H new ATOM 0 HD3 ARG A 52 4.193 10.427 -8.641 1.00 53.43 H new ATOM 0 HE ARG A 52 4.120 12.790 -9.592 1.00 62.41 H new ATOM 0 HH11 ARG A 52 7.128 10.902 -9.766 1.00 10.12 H new ATOM 0 HH12 ARG A 52 7.716 11.794 -11.173 1.00 10.12 H new ATOM 0 HH21 ARG A 52 4.906 13.920 -11.339 1.00 32.15 H new ATOM 0 HH22 ARG A 52 6.463 13.495 -12.058 1.00 32.15 H new ATOM 872 N PRO A 53 1.334 11.236 -5.144 1.00 5.13 N ATOM 873 CA PRO A 53 0.918 9.942 -4.559 1.00 10.11 C ATOM 874 C PRO A 53 1.742 8.758 -5.089 1.00 51.21 C ATOM 875 O PRO A 53 2.437 8.872 -6.111 1.00 51.53 O ATOM 876 CB PRO A 53 -0.553 9.812 -5.007 1.00 45.34 C ATOM 877 CG PRO A 53 -0.632 10.597 -6.283 1.00 61.05 C ATOM 878 CD PRO A 53 0.280 11.783 -6.064 1.00 33.25 C ATOM 0 HA PRO A 53 1.060 9.921 -3.479 1.00 10.11 H new ATOM 0 HB2 PRO A 53 -0.828 8.769 -5.166 1.00 45.34 H new ATOM 0 HB3 PRO A 53 -1.233 10.210 -4.254 1.00 45.34 H new ATOM 0 HG2 PRO A 53 -0.307 10.000 -7.135 1.00 61.05 H new ATOM 0 HG3 PRO A 53 -1.654 10.916 -6.488 1.00 61.05 H new ATOM 0 HD2 PRO A 53 0.708 12.141 -7.000 1.00 33.25 H new ATOM 0 HD3 PRO A 53 -0.251 12.622 -5.615 1.00 33.25 H new ATOM 886 N ILE A 54 1.623 7.621 -4.390 1.00 63.04 N ATOM 887 CA ILE A 54 2.312 6.390 -4.755 1.00 74.13 C ATOM 888 C ILE A 54 1.608 5.167 -4.141 1.00 73.32 C ATOM 889 O ILE A 54 1.156 5.215 -2.999 1.00 23.11 O ATOM 890 CB ILE A 54 3.833 6.434 -4.340 1.00 32.55 C ATOM 891 CG1 ILE A 54 4.586 5.175 -4.858 1.00 71.03 C ATOM 892 CG2 ILE A 54 4.014 6.615 -2.810 1.00 61.33 C ATOM 893 CD1 ILE A 54 6.076 5.211 -4.640 1.00 5.43 C ATOM 0 H ILE A 54 1.043 7.536 -3.555 1.00 63.04 H new ATOM 0 HA ILE A 54 2.271 6.297 -5.840 1.00 74.13 H new ATOM 0 HB ILE A 54 4.275 7.310 -4.814 1.00 32.55 H new ATOM 0 HG12 ILE A 54 4.179 4.293 -4.363 1.00 71.03 H new ATOM 0 HG13 ILE A 54 4.389 5.061 -5.924 1.00 71.03 H new ATOM 0 HG21 ILE A 54 5.077 6.640 -2.570 1.00 61.33 H new ATOM 0 HG22 ILE A 54 3.549 7.550 -2.497 1.00 61.33 H new ATOM 0 HG23 ILE A 54 3.543 5.783 -2.287 1.00 61.33 H new ATOM 0 HD11 ILE A 54 6.523 4.296 -5.030 1.00 5.43 H new ATOM 0 HD12 ILE A 54 6.499 6.071 -5.159 1.00 5.43 H new ATOM 0 HD13 ILE A 54 6.286 5.291 -3.573 1.00 5.43 H new ATOM 905 N VAL A 55 1.484 4.089 -4.939 1.00 74.11 N ATOM 906 CA VAL A 55 1.001 2.784 -4.486 1.00 44.15 C ATOM 907 C VAL A 55 2.082 1.734 -4.819 1.00 41.51 C ATOM 908 O VAL A 55 2.450 1.556 -5.994 1.00 71.32 O ATOM 909 CB VAL A 55 -0.368 2.371 -5.154 1.00 61.12 C ATOM 910 CG1 VAL A 55 -0.888 1.047 -4.559 1.00 34.14 C ATOM 911 CG2 VAL A 55 -1.441 3.479 -5.014 1.00 75.33 C ATOM 0 H VAL A 55 1.722 4.108 -5.931 1.00 74.11 H new ATOM 0 HA VAL A 55 0.817 2.841 -3.413 1.00 44.15 H new ATOM 0 HB VAL A 55 -0.176 2.231 -6.218 1.00 61.12 H new ATOM 0 HG11 VAL A 55 -1.833 0.781 -5.034 1.00 34.14 H new ATOM 0 HG12 VAL A 55 -0.158 0.257 -4.736 1.00 34.14 H new ATOM 0 HG13 VAL A 55 -1.042 1.166 -3.486 1.00 34.14 H new ATOM 0 HG21 VAL A 55 -2.366 3.151 -5.488 1.00 75.33 H new ATOM 0 HG22 VAL A 55 -1.624 3.676 -3.958 1.00 75.33 H new ATOM 0 HG23 VAL A 55 -1.088 4.390 -5.498 1.00 75.33 H new ATOM 921 N ILE A 56 2.597 1.069 -3.777 1.00 30.33 N ATOM 922 CA ILE A 56 3.587 -0.004 -3.895 1.00 5.43 C ATOM 923 C ILE A 56 2.881 -1.346 -3.667 1.00 45.13 C ATOM 924 O ILE A 56 2.149 -1.505 -2.689 1.00 40.35 O ATOM 925 CB ILE A 56 4.756 0.159 -2.852 1.00 53.53 C ATOM 926 CG1 ILE A 56 5.545 1.491 -3.083 1.00 41.41 C ATOM 927 CG2 ILE A 56 5.718 -1.059 -2.896 1.00 15.31 C ATOM 928 CD1 ILE A 56 6.341 1.545 -4.379 1.00 11.22 C ATOM 0 H ILE A 56 2.331 1.267 -2.812 1.00 30.33 H new ATOM 0 HA ILE A 56 4.027 0.040 -4.891 1.00 5.43 H new ATOM 0 HB ILE A 56 4.305 0.203 -1.861 1.00 53.53 H new ATOM 0 HG12 ILE A 56 4.839 2.321 -3.072 1.00 41.41 H new ATOM 0 HG13 ILE A 56 6.228 1.642 -2.247 1.00 41.41 H new ATOM 0 HG21 ILE A 56 6.515 -0.920 -2.166 1.00 15.31 H new ATOM 0 HG22 ILE A 56 5.165 -1.968 -2.660 1.00 15.31 H new ATOM 0 HG23 ILE A 56 6.150 -1.146 -3.893 1.00 15.31 H new ATOM 0 HD11 ILE A 56 6.853 2.504 -4.452 1.00 11.22 H new ATOM 0 HD12 ILE A 56 7.075 0.740 -4.389 1.00 11.22 H new ATOM 0 HD13 ILE A 56 5.665 1.430 -5.226 1.00 11.22 H new ATOM 940 N PHE A 57 3.111 -2.298 -4.576 1.00 23.25 N ATOM 941 CA PHE A 57 2.554 -3.648 -4.496 1.00 60.33 C ATOM 942 C PHE A 57 3.676 -4.629 -4.110 1.00 13.35 C ATOM 943 O PHE A 57 4.535 -4.959 -4.928 1.00 62.02 O ATOM 944 CB PHE A 57 1.904 -4.024 -5.850 1.00 42.45 C ATOM 945 CG PHE A 57 0.753 -3.103 -6.246 1.00 30.01 C ATOM 946 CD1 PHE A 57 -0.546 -3.352 -5.801 1.00 42.35 C ATOM 947 CD2 PHE A 57 0.973 -1.968 -7.037 1.00 0.53 C ATOM 948 CE1 PHE A 57 -1.586 -2.508 -6.136 1.00 71.44 C ATOM 949 CE2 PHE A 57 -0.072 -1.129 -7.370 1.00 74.25 C ATOM 950 CZ PHE A 57 -1.348 -1.399 -6.919 1.00 41.22 C ATOM 0 H PHE A 57 3.697 -2.149 -5.398 1.00 23.25 H new ATOM 0 HA PHE A 57 1.778 -3.696 -3.732 1.00 60.33 H new ATOM 0 HB2 PHE A 57 2.665 -3.998 -6.630 1.00 42.45 H new ATOM 0 HB3 PHE A 57 1.537 -5.049 -5.796 1.00 42.45 H new ATOM 0 HD1 PHE A 57 -0.741 -4.218 -5.185 1.00 42.35 H new ATOM 0 HD2 PHE A 57 1.970 -1.747 -7.390 1.00 0.53 H new ATOM 0 HE1 PHE A 57 -2.586 -2.717 -5.785 1.00 71.44 H new ATOM 0 HE2 PHE A 57 0.110 -0.260 -7.985 1.00 74.25 H new ATOM 0 HZ PHE A 57 -2.162 -0.739 -7.180 1.00 41.22 H new ATOM 960 N ILE A 58 3.667 -5.057 -2.841 1.00 4.32 N ATOM 961 CA ILE A 58 4.697 -5.944 -2.267 1.00 11.31 C ATOM 962 C ILE A 58 4.180 -7.389 -2.271 1.00 20.34 C ATOM 963 O ILE A 58 3.116 -7.663 -1.702 1.00 43.14 O ATOM 964 CB ILE A 58 5.052 -5.519 -0.791 1.00 14.40 C ATOM 965 CG1 ILE A 58 5.495 -4.022 -0.739 1.00 74.32 C ATOM 966 CG2 ILE A 58 6.142 -6.440 -0.187 1.00 34.13 C ATOM 967 CD1 ILE A 58 5.781 -3.485 0.654 1.00 12.13 C ATOM 0 H ILE A 58 2.940 -4.797 -2.175 1.00 4.32 H new ATOM 0 HA ILE A 58 5.599 -5.865 -2.874 1.00 11.31 H new ATOM 0 HB ILE A 58 4.153 -5.630 -0.185 1.00 14.40 H new ATOM 0 HG12 ILE A 58 6.390 -3.902 -1.349 1.00 74.32 H new ATOM 0 HG13 ILE A 58 4.715 -3.412 -1.194 1.00 74.32 H new ATOM 0 HG21 ILE A 58 6.365 -6.121 0.831 1.00 34.13 H new ATOM 0 HG22 ILE A 58 5.783 -7.469 -0.174 1.00 34.13 H new ATOM 0 HG23 ILE A 58 7.046 -6.379 -0.792 1.00 34.13 H new ATOM 0 HD11 ILE A 58 6.081 -2.439 0.586 1.00 12.13 H new ATOM 0 HD12 ILE A 58 4.883 -3.566 1.267 1.00 12.13 H new ATOM 0 HD13 ILE A 58 6.584 -4.064 1.109 1.00 12.13 H new ATOM 979 N ARG A 59 4.916 -8.306 -2.927 1.00 64.41 N ATOM 980 CA ARG A 59 4.540 -9.728 -2.950 1.00 62.45 C ATOM 981 C ARG A 59 5.187 -10.471 -1.781 1.00 60.34 C ATOM 982 O ARG A 59 6.417 -10.560 -1.712 1.00 63.04 O ATOM 983 CB ARG A 59 4.910 -10.427 -4.284 1.00 31.11 C ATOM 984 CG ARG A 59 4.270 -11.833 -4.407 1.00 40.51 C ATOM 985 CD ARG A 59 4.677 -12.594 -5.669 1.00 12.13 C ATOM 986 NE ARG A 59 6.115 -12.920 -5.690 1.00 5.43 N ATOM 987 CZ ARG A 59 6.996 -12.496 -6.607 1.00 64.44 C ATOM 988 NH1 ARG A 59 6.623 -11.699 -7.604 1.00 63.30 N ATOM 989 NH2 ARG A 59 8.257 -12.867 -6.496 1.00 65.43 N ATOM 0 H ARG A 59 5.768 -8.088 -3.444 1.00 64.41 H new ATOM 0 HA ARG A 59 3.455 -9.763 -2.855 1.00 62.45 H new ATOM 0 HB2 ARG A 59 4.584 -9.807 -5.119 1.00 31.11 H new ATOM 0 HB3 ARG A 59 5.994 -10.516 -4.357 1.00 31.11 H new ATOM 0 HG2 ARG A 59 4.546 -12.424 -3.534 1.00 40.51 H new ATOM 0 HG3 ARG A 59 3.185 -11.730 -4.392 1.00 40.51 H new ATOM 0 HD2 ARG A 59 4.098 -13.515 -5.737 1.00 12.13 H new ATOM 0 HD3 ARG A 59 4.430 -11.996 -6.546 1.00 12.13 H new ATOM 0 HE ARG A 59 6.469 -13.519 -4.944 1.00 5.43 H new ATOM 0 HH11 ARG A 59 5.651 -11.399 -7.681 1.00 63.30 H new ATOM 0 HH12 ARG A 59 7.309 -11.387 -8.292 1.00 63.30 H new ATOM 0 HH21 ARG A 59 8.546 -13.466 -5.723 1.00 65.43 H new ATOM 0 HH22 ARG A 59 8.943 -12.555 -7.184 1.00 65.43 H new ATOM 1003 N GLY A 60 4.333 -10.969 -0.860 1.00 40.23 N ATOM 1004 CA GLY A 60 4.753 -11.870 0.215 1.00 50.12 C ATOM 1005 C GLY A 60 5.770 -11.256 1.173 1.00 21.12 C ATOM 1006 O GLY A 60 6.904 -11.725 1.255 1.00 2.30 O ATOM 0 H GLY A 60 3.336 -10.753 -0.848 1.00 40.23 H new ATOM 0 HA2 GLY A 60 3.874 -12.178 0.782 1.00 50.12 H new ATOM 0 HA3 GLY A 60 5.181 -12.771 -0.225 1.00 50.12 H new ATOM 1010 N ALA A 61 5.362 -10.193 1.888 1.00 11.44 N ATOM 1011 CA ALA A 61 6.221 -9.518 2.879 1.00 60.22 C ATOM 1012 C ALA A 61 6.127 -10.213 4.244 1.00 70.41 C ATOM 1013 O ALA A 61 5.367 -11.171 4.415 1.00 4.42 O ATOM 1014 CB ALA A 61 5.811 -8.045 3.007 1.00 64.40 C ATOM 0 H ALA A 61 4.434 -9.779 1.797 1.00 11.44 H new ATOM 0 HA ALA A 61 7.255 -9.574 2.537 1.00 60.22 H new ATOM 0 HB1 ALA A 61 6.449 -7.552 3.740 1.00 64.40 H new ATOM 0 HB2 ALA A 61 5.920 -7.552 2.041 1.00 64.40 H new ATOM 0 HB3 ALA A 61 4.772 -7.983 3.331 1.00 64.40 H new ATOM 1020 N THR A 62 6.902 -9.696 5.204 1.00 44.33 N ATOM 1021 CA THR A 62 6.873 -10.137 6.607 1.00 13.05 C ATOM 1022 C THR A 62 6.933 -8.889 7.522 1.00 75.20 C ATOM 1023 O THR A 62 6.990 -7.757 7.015 1.00 2.21 O ATOM 1024 CB THR A 62 8.034 -11.158 6.894 1.00 54.30 C ATOM 1025 OG1 THR A 62 7.940 -11.667 8.235 1.00 65.40 O ATOM 1026 CG2 THR A 62 9.427 -10.542 6.660 1.00 40.33 C ATOM 0 H THR A 62 7.576 -8.951 5.028 1.00 44.33 H new ATOM 0 HA THR A 62 5.945 -10.669 6.817 1.00 13.05 H new ATOM 0 HB THR A 62 7.916 -11.979 6.187 1.00 54.30 H new ATOM 0 HG1 THR A 62 8.669 -12.302 8.396 1.00 65.40 H new ATOM 0 HG21 THR A 62 10.194 -11.287 6.872 1.00 40.33 H new ATOM 0 HG22 THR A 62 9.512 -10.218 5.623 1.00 40.33 H new ATOM 0 HG23 THR A 62 9.561 -9.685 7.320 1.00 40.33 H new ATOM 1034 N GLU A 63 6.914 -9.109 8.855 1.00 23.00 N ATOM 1035 CA GLU A 63 6.772 -8.041 9.872 1.00 21.33 C ATOM 1036 C GLU A 63 7.852 -6.962 9.711 1.00 13.10 C ATOM 1037 O GLU A 63 7.527 -5.792 9.495 1.00 20.33 O ATOM 1038 CB GLU A 63 6.818 -8.600 11.338 1.00 40.21 C ATOM 1039 CG GLU A 63 5.772 -9.683 11.700 1.00 42.55 C ATOM 1040 CD GLU A 63 6.108 -11.082 11.162 1.00 34.35 C ATOM 1041 OE1 GLU A 63 5.586 -11.469 10.096 1.00 60.05 O ATOM 1042 OE2 GLU A 63 6.906 -11.799 11.793 1.00 1.21 O ATOM 0 H GLU A 63 6.998 -10.041 9.260 1.00 23.00 H new ATOM 0 HA GLU A 63 5.791 -7.598 9.703 1.00 21.33 H new ATOM 0 HB2 GLU A 63 7.811 -9.013 11.514 1.00 40.21 H new ATOM 0 HB3 GLU A 63 6.694 -7.763 12.026 1.00 40.21 H new ATOM 0 HG2 GLU A 63 5.679 -9.735 12.785 1.00 42.55 H new ATOM 0 HG3 GLU A 63 4.800 -9.379 11.311 1.00 42.55 H new ATOM 1049 N GLU A 64 9.128 -7.407 9.764 1.00 13.25 N ATOM 1050 CA GLU A 64 10.322 -6.532 9.725 1.00 20.02 C ATOM 1051 C GLU A 64 10.357 -5.629 8.473 1.00 33.53 C ATOM 1052 O GLU A 64 10.947 -4.551 8.501 1.00 70.42 O ATOM 1053 CB GLU A 64 11.604 -7.404 9.812 1.00 44.34 C ATOM 1054 CG GLU A 64 11.788 -8.382 8.632 1.00 61.15 C ATOM 1055 CD GLU A 64 12.900 -9.423 8.857 1.00 64.32 C ATOM 1056 OE1 GLU A 64 12.618 -10.481 9.457 1.00 41.24 O ATOM 1057 OE2 GLU A 64 14.045 -9.200 8.416 1.00 24.34 O ATOM 0 H GLU A 64 9.360 -8.398 9.836 1.00 13.25 H new ATOM 0 HA GLU A 64 10.273 -5.863 10.584 1.00 20.02 H new ATOM 0 HB2 GLU A 64 12.473 -6.748 9.864 1.00 44.34 H new ATOM 0 HB3 GLU A 64 11.579 -7.974 10.741 1.00 44.34 H new ATOM 0 HG2 GLU A 64 10.847 -8.902 8.453 1.00 61.15 H new ATOM 0 HG3 GLU A 64 12.014 -7.812 7.731 1.00 61.15 H new ATOM 1064 N VAL A 65 9.726 -6.097 7.381 1.00 12.23 N ATOM 1065 CA VAL A 65 9.585 -5.350 6.126 1.00 64.32 C ATOM 1066 C VAL A 65 8.521 -4.244 6.264 1.00 3.55 C ATOM 1067 O VAL A 65 8.838 -3.052 6.177 1.00 4.34 O ATOM 1068 CB VAL A 65 9.207 -6.343 4.963 1.00 44.31 C ATOM 1069 CG1 VAL A 65 8.968 -5.624 3.613 1.00 74.22 C ATOM 1070 CG2 VAL A 65 10.288 -7.443 4.825 1.00 43.04 C ATOM 0 H VAL A 65 9.294 -7.020 7.349 1.00 12.23 H new ATOM 0 HA VAL A 65 10.535 -4.870 5.891 1.00 64.32 H new ATOM 0 HB VAL A 65 8.259 -6.808 5.233 1.00 44.31 H new ATOM 0 HG11 VAL A 65 8.711 -6.359 2.850 1.00 74.22 H new ATOM 0 HG12 VAL A 65 8.150 -4.911 3.720 1.00 74.22 H new ATOM 0 HG13 VAL A 65 9.874 -5.095 3.317 1.00 74.22 H new ATOM 0 HG21 VAL A 65 10.015 -8.123 4.018 1.00 43.04 H new ATOM 0 HG22 VAL A 65 11.250 -6.982 4.601 1.00 43.04 H new ATOM 0 HG23 VAL A 65 10.362 -8.000 5.759 1.00 43.04 H new ATOM 1080 N VAL A 66 7.266 -4.662 6.540 1.00 23.42 N ATOM 1081 CA VAL A 66 6.092 -3.773 6.452 1.00 62.33 C ATOM 1082 C VAL A 66 6.135 -2.679 7.537 1.00 21.20 C ATOM 1083 O VAL A 66 5.959 -1.506 7.220 1.00 72.30 O ATOM 1084 CB VAL A 66 4.732 -4.562 6.541 1.00 52.42 C ATOM 1085 CG1 VAL A 66 3.529 -3.635 6.217 1.00 53.34 C ATOM 1086 CG2 VAL A 66 4.737 -5.799 5.612 1.00 55.32 C ATOM 0 H VAL A 66 7.042 -5.615 6.827 1.00 23.42 H new ATOM 0 HA VAL A 66 6.140 -3.302 5.470 1.00 62.33 H new ATOM 0 HB VAL A 66 4.623 -4.915 7.566 1.00 52.42 H new ATOM 0 HG11 VAL A 66 2.602 -4.204 6.285 1.00 53.34 H new ATOM 0 HG12 VAL A 66 3.502 -2.811 6.930 1.00 53.34 H new ATOM 0 HG13 VAL A 66 3.637 -3.238 5.208 1.00 53.34 H new ATOM 0 HG21 VAL A 66 3.784 -6.322 5.697 1.00 55.32 H new ATOM 0 HG22 VAL A 66 4.885 -5.479 4.581 1.00 55.32 H new ATOM 0 HG23 VAL A 66 5.546 -6.469 5.903 1.00 55.32 H new ATOM 1096 N ARG A 67 6.416 -3.082 8.802 1.00 41.15 N ATOM 1097 CA ARG A 67 6.467 -2.151 9.959 1.00 72.05 C ATOM 1098 C ARG A 67 7.481 -1.005 9.712 1.00 64.22 C ATOM 1099 O ARG A 67 7.229 0.136 10.080 1.00 22.01 O ATOM 1100 CB ARG A 67 6.827 -2.908 11.283 1.00 41.25 C ATOM 1101 CG ARG A 67 8.297 -3.405 11.377 1.00 55.31 C ATOM 1102 CD ARG A 67 8.595 -4.241 12.634 1.00 44.01 C ATOM 1103 NE ARG A 67 9.977 -4.763 12.642 1.00 51.31 N ATOM 1104 CZ ARG A 67 10.418 -5.803 13.370 1.00 23.04 C ATOM 1105 NH1 ARG A 67 9.605 -6.482 14.179 1.00 14.34 N ATOM 1106 NH2 ARG A 67 11.683 -6.178 13.257 1.00 71.42 N ATOM 0 H ARG A 67 6.612 -4.052 9.048 1.00 41.15 H new ATOM 0 HA ARG A 67 5.473 -1.718 10.068 1.00 72.05 H new ATOM 0 HB2 ARG A 67 6.628 -2.248 12.127 1.00 41.25 H new ATOM 0 HB3 ARG A 67 6.162 -3.766 11.386 1.00 41.25 H new ATOM 0 HG2 ARG A 67 8.525 -4.001 10.494 1.00 55.31 H new ATOM 0 HG3 ARG A 67 8.963 -2.543 11.360 1.00 55.31 H new ATOM 0 HD2 ARG A 67 8.434 -3.629 13.522 1.00 44.01 H new ATOM 0 HD3 ARG A 67 7.894 -5.074 12.689 1.00 44.01 H new ATOM 0 HE ARG A 67 10.656 -4.293 12.043 1.00 51.31 H new ATOM 0 HH11 ARG A 67 8.623 -6.216 14.256 1.00 14.34 H new ATOM 0 HH12 ARG A 67 9.964 -7.268 14.721 1.00 14.34 H new ATOM 0 HH21 ARG A 67 12.308 -5.679 12.624 1.00 71.42 H new ATOM 0 HH22 ARG A 67 12.032 -6.966 13.803 1.00 71.42 H new ATOM 1120 N ASP A 68 8.590 -1.362 9.029 1.00 32.14 N ATOM 1121 CA ASP A 68 9.743 -0.488 8.763 1.00 45.31 C ATOM 1122 C ASP A 68 9.426 0.523 7.643 1.00 71.31 C ATOM 1123 O ASP A 68 9.790 1.700 7.737 1.00 72.35 O ATOM 1124 CB ASP A 68 10.955 -1.394 8.408 1.00 13.14 C ATOM 1125 CG ASP A 68 12.222 -0.679 7.912 1.00 54.33 C ATOM 1126 OD1 ASP A 68 12.947 -1.269 7.077 1.00 3.21 O ATOM 1127 OD2 ASP A 68 12.532 0.453 8.365 1.00 3.24 O ATOM 0 H ASP A 68 8.707 -2.296 8.637 1.00 32.14 H new ATOM 0 HA ASP A 68 9.982 0.106 9.645 1.00 45.31 H new ATOM 0 HB2 ASP A 68 11.216 -1.977 9.291 1.00 13.14 H new ATOM 0 HB3 ASP A 68 10.640 -2.101 7.641 1.00 13.14 H new ATOM 1132 N ILE A 69 8.741 0.046 6.595 1.00 62.33 N ATOM 1133 CA ILE A 69 8.310 0.879 5.454 1.00 3.01 C ATOM 1134 C ILE A 69 7.224 1.893 5.888 1.00 72.43 C ATOM 1135 O ILE A 69 7.290 3.090 5.556 1.00 14.54 O ATOM 1136 CB ILE A 69 7.743 -0.028 4.301 1.00 14.34 C ATOM 1137 CG1 ILE A 69 8.847 -0.978 3.737 1.00 32.22 C ATOM 1138 CG2 ILE A 69 7.111 0.816 3.170 1.00 34.24 C ATOM 1139 CD1 ILE A 69 8.326 -1.995 2.740 1.00 62.45 C ATOM 0 H ILE A 69 8.467 -0.933 6.510 1.00 62.33 H new ATOM 0 HA ILE A 69 9.180 1.427 5.093 1.00 3.01 H new ATOM 0 HB ILE A 69 6.954 -0.644 4.732 1.00 14.34 H new ATOM 0 HG12 ILE A 69 9.621 -0.377 3.259 1.00 32.22 H new ATOM 0 HG13 ILE A 69 9.319 -1.505 4.566 1.00 32.22 H new ATOM 0 HG21 ILE A 69 6.730 0.155 2.392 1.00 34.24 H new ATOM 0 HG22 ILE A 69 6.291 1.410 3.574 1.00 34.24 H new ATOM 0 HG23 ILE A 69 7.865 1.479 2.746 1.00 34.24 H new ATOM 0 HD11 ILE A 69 9.150 -2.619 2.392 1.00 62.45 H new ATOM 0 HD12 ILE A 69 7.573 -2.621 3.219 1.00 62.45 H new ATOM 0 HD13 ILE A 69 7.880 -1.477 1.891 1.00 62.45 H new ATOM 1151 N VAL A 70 6.237 1.383 6.634 1.00 52.20 N ATOM 1152 CA VAL A 70 5.060 2.151 7.053 1.00 33.21 C ATOM 1153 C VAL A 70 5.454 3.247 8.063 1.00 23.40 C ATOM 1154 O VAL A 70 5.030 4.403 7.907 1.00 54.31 O ATOM 1155 CB VAL A 70 3.949 1.192 7.629 1.00 74.20 C ATOM 1156 CG1 VAL A 70 2.766 1.971 8.243 1.00 35.54 C ATOM 1157 CG2 VAL A 70 3.444 0.230 6.521 1.00 53.12 C ATOM 0 H VAL A 70 6.233 0.419 6.966 1.00 52.20 H new ATOM 0 HA VAL A 70 4.640 2.651 6.180 1.00 33.21 H new ATOM 0 HB VAL A 70 4.405 0.612 8.431 1.00 74.20 H new ATOM 0 HG11 VAL A 70 2.027 1.268 8.626 1.00 35.54 H new ATOM 0 HG12 VAL A 70 3.127 2.598 9.058 1.00 35.54 H new ATOM 0 HG13 VAL A 70 2.308 2.598 7.479 1.00 35.54 H new ATOM 0 HG21 VAL A 70 2.677 -0.427 6.931 1.00 53.12 H new ATOM 0 HG22 VAL A 70 3.023 0.810 5.700 1.00 53.12 H new ATOM 0 HG23 VAL A 70 4.276 -0.370 6.153 1.00 53.12 H new ATOM 1167 N GLU A 71 6.303 2.889 9.062 1.00 14.20 N ATOM 1168 CA GLU A 71 6.801 3.861 10.062 1.00 31.00 C ATOM 1169 C GLU A 71 7.644 4.952 9.375 1.00 33.02 C ATOM 1170 O GLU A 71 7.564 6.116 9.747 1.00 22.14 O ATOM 1171 CB GLU A 71 7.622 3.183 11.203 1.00 70.14 C ATOM 1172 CG GLU A 71 9.003 2.622 10.789 1.00 25.54 C ATOM 1173 CD GLU A 71 9.825 2.061 11.962 1.00 52.32 C ATOM 1174 OE1 GLU A 71 9.680 0.859 12.289 1.00 42.15 O ATOM 1175 OE2 GLU A 71 10.623 2.818 12.561 1.00 52.44 O ATOM 0 H GLU A 71 6.653 1.940 9.193 1.00 14.20 H new ATOM 0 HA GLU A 71 5.925 4.316 10.526 1.00 31.00 H new ATOM 0 HB2 GLU A 71 7.770 3.910 12.002 1.00 70.14 H new ATOM 0 HB3 GLU A 71 7.029 2.369 11.619 1.00 70.14 H new ATOM 0 HG2 GLU A 71 8.857 1.834 10.050 1.00 25.54 H new ATOM 0 HG3 GLU A 71 9.575 3.413 10.303 1.00 25.54 H new ATOM 1182 N TYR A 72 8.420 4.541 8.350 1.00 31.21 N ATOM 1183 CA TYR A 72 9.297 5.423 7.561 1.00 20.14 C ATOM 1184 C TYR A 72 8.497 6.553 6.891 1.00 23.20 C ATOM 1185 O TYR A 72 8.868 7.732 6.981 1.00 24.20 O ATOM 1186 CB TYR A 72 10.044 4.569 6.503 1.00 20.11 C ATOM 1187 CG TYR A 72 10.866 5.367 5.495 1.00 54.25 C ATOM 1188 CD1 TYR A 72 11.980 6.103 5.902 1.00 50.41 C ATOM 1189 CD2 TYR A 72 10.529 5.389 4.129 1.00 72.25 C ATOM 1190 CE1 TYR A 72 12.717 6.835 4.997 1.00 61.41 C ATOM 1191 CE2 TYR A 72 11.271 6.118 3.228 1.00 74.15 C ATOM 1192 CZ TYR A 72 12.363 6.836 3.668 1.00 43.22 C ATOM 1193 OH TYR A 72 13.099 7.561 2.772 1.00 4.11 O ATOM 0 H TYR A 72 8.453 3.568 8.044 1.00 31.21 H new ATOM 0 HA TYR A 72 10.020 5.896 8.225 1.00 20.14 H new ATOM 0 HB2 TYR A 72 10.706 3.874 7.020 1.00 20.11 H new ATOM 0 HB3 TYR A 72 9.313 3.969 5.960 1.00 20.11 H new ATOM 0 HD1 TYR A 72 12.269 6.099 6.943 1.00 50.41 H new ATOM 0 HD2 TYR A 72 9.675 4.825 3.783 1.00 72.25 H new ATOM 0 HE1 TYR A 72 13.571 7.407 5.330 1.00 61.41 H new ATOM 0 HE2 TYR A 72 11.000 6.128 2.183 1.00 74.15 H new ATOM 0 HH TYR A 72 14.029 7.610 3.077 1.00 4.11 H new ATOM 1203 N ALA A 73 7.397 6.170 6.231 1.00 11.45 N ATOM 1204 CA ALA A 73 6.510 7.115 5.545 1.00 23.42 C ATOM 1205 C ALA A 73 5.800 8.058 6.549 1.00 12.30 C ATOM 1206 O ALA A 73 5.581 9.233 6.248 1.00 62.31 O ATOM 1207 CB ALA A 73 5.513 6.341 4.683 1.00 74.22 C ATOM 0 H ALA A 73 7.098 5.198 6.158 1.00 11.45 H new ATOM 0 HA ALA A 73 7.106 7.755 4.894 1.00 23.42 H new ATOM 0 HB1 ALA A 73 4.853 7.042 4.172 1.00 74.22 H new ATOM 0 HB2 ALA A 73 6.053 5.748 3.945 1.00 74.22 H new ATOM 0 HB3 ALA A 73 4.921 5.680 5.316 1.00 74.22 H new ATOM 1213 N GLN A 74 5.481 7.535 7.755 1.00 22.42 N ATOM 1214 CA GLN A 74 4.898 8.338 8.862 1.00 33.22 C ATOM 1215 C GLN A 74 5.921 9.365 9.409 1.00 23.51 C ATOM 1216 O GLN A 74 5.548 10.478 9.796 1.00 3.12 O ATOM 1217 CB GLN A 74 4.425 7.412 10.014 1.00 43.31 C ATOM 1218 CG GLN A 74 3.278 6.454 9.638 1.00 52.34 C ATOM 1219 CD GLN A 74 2.930 5.488 10.767 1.00 51.03 C ATOM 1220 OE1 GLN A 74 3.476 4.386 10.854 1.00 74.55 O ATOM 1221 NE2 GLN A 74 2.032 5.892 11.648 1.00 34.42 N ATOM 0 H GLN A 74 5.618 6.552 7.990 1.00 22.42 H new ATOM 0 HA GLN A 74 4.042 8.881 8.460 1.00 33.22 H new ATOM 0 HB2 GLN A 74 5.274 6.823 10.361 1.00 43.31 H new ATOM 0 HB3 GLN A 74 4.104 8.031 10.852 1.00 43.31 H new ATOM 0 HG2 GLN A 74 2.394 7.036 9.376 1.00 52.34 H new ATOM 0 HG3 GLN A 74 3.559 5.886 8.752 1.00 52.34 H new ATOM 0 HE21 GLN A 74 1.598 6.810 11.549 1.00 34.42 H new ATOM 0 HE22 GLN A 74 1.773 5.286 12.427 1.00 34.42 H new ATOM 1230 N LYS A 75 7.209 8.967 9.433 1.00 42.55 N ATOM 1231 CA LYS A 75 8.338 9.820 9.883 1.00 3.30 C ATOM 1232 C LYS A 75 8.621 10.952 8.869 1.00 32.00 C ATOM 1233 O LYS A 75 9.163 12.004 9.235 1.00 55.43 O ATOM 1234 CB LYS A 75 9.599 8.935 10.117 1.00 14.44 C ATOM 1235 CG LYS A 75 9.495 8.000 11.354 1.00 42.14 C ATOM 1236 CD LYS A 75 10.535 6.844 11.343 1.00 35.23 C ATOM 1237 CE LYS A 75 12.001 7.322 11.299 1.00 2.41 C ATOM 1238 NZ LYS A 75 12.953 6.176 11.334 1.00 20.21 N ATOM 0 H LYS A 75 7.502 8.036 9.138 1.00 42.55 H new ATOM 0 HA LYS A 75 8.068 10.298 10.825 1.00 3.30 H new ATOM 0 HB2 LYS A 75 9.774 8.327 9.229 1.00 14.44 H new ATOM 0 HB3 LYS A 75 10.468 9.583 10.236 1.00 14.44 H new ATOM 0 HG2 LYS A 75 9.630 8.591 12.260 1.00 42.14 H new ATOM 0 HG3 LYS A 75 8.492 7.576 11.396 1.00 42.14 H new ATOM 0 HD2 LYS A 75 10.390 6.230 12.232 1.00 35.23 H new ATOM 0 HD3 LYS A 75 10.345 6.206 10.480 1.00 35.23 H new ATOM 0 HE2 LYS A 75 12.167 7.906 10.394 1.00 2.41 H new ATOM 0 HE3 LYS A 75 12.194 7.982 12.144 1.00 2.41 H new ATOM 0 HZ1 LYS A 75 13.929 6.534 11.303 1.00 20.21 H new ATOM 0 HZ2 LYS A 75 12.811 5.633 12.210 1.00 20.21 H new ATOM 0 HZ3 LYS A 75 12.784 5.559 10.514 1.00 20.21 H new ATOM 1252 N GLU A 76 8.239 10.719 7.601 1.00 73.41 N ATOM 1253 CA GLU A 76 8.256 11.741 6.537 1.00 43.01 C ATOM 1254 C GLU A 76 6.984 12.625 6.590 1.00 35.30 C ATOM 1255 O GLU A 76 6.852 13.577 5.820 1.00 32.42 O ATOM 1256 CB GLU A 76 8.385 11.046 5.157 1.00 31.02 C ATOM 1257 CG GLU A 76 9.742 10.359 4.904 1.00 32.32 C ATOM 1258 CD GLU A 76 10.905 11.366 4.833 1.00 53.24 C ATOM 1259 OE1 GLU A 76 11.046 12.033 3.790 1.00 44.34 O ATOM 1260 OE2 GLU A 76 11.673 11.501 5.808 1.00 4.53 O ATOM 0 H GLU A 76 7.907 9.809 7.282 1.00 73.41 H new ATOM 0 HA GLU A 76 9.114 12.395 6.691 1.00 43.01 H new ATOM 0 HB2 GLU A 76 7.594 10.302 5.065 1.00 31.02 H new ATOM 0 HB3 GLU A 76 8.217 11.787 4.375 1.00 31.02 H new ATOM 0 HG2 GLU A 76 9.936 9.639 5.699 1.00 32.32 H new ATOM 0 HG3 GLU A 76 9.694 9.797 3.971 1.00 32.32 H new ATOM 1267 N GLY A 77 6.048 12.291 7.504 1.00 43.21 N ATOM 1268 CA GLY A 77 4.801 13.040 7.673 1.00 74.13 C ATOM 1269 C GLY A 77 3.780 12.759 6.576 1.00 21.11 C ATOM 1270 O GLY A 77 2.812 13.507 6.419 1.00 40.25 O ATOM 0 H GLY A 77 6.142 11.498 8.138 1.00 43.21 H new ATOM 0 HA2 GLY A 77 4.364 12.792 8.640 1.00 74.13 H new ATOM 0 HA3 GLY A 77 5.024 14.107 7.688 1.00 74.13 H new ATOM 1274 N LEU A 78 4.001 11.672 5.819 1.00 51.02 N ATOM 1275 CA LEU A 78 3.158 11.285 4.675 1.00 12.55 C ATOM 1276 C LEU A 78 2.011 10.382 5.155 1.00 22.15 C ATOM 1277 O LEU A 78 2.202 9.560 6.061 1.00 51.24 O ATOM 1278 CB LEU A 78 4.021 10.560 3.602 1.00 32.04 C ATOM 1279 CG LEU A 78 5.302 11.331 3.136 1.00 42.53 C ATOM 1280 CD1 LEU A 78 6.010 10.609 1.971 1.00 24.34 C ATOM 1281 CD2 LEU A 78 4.990 12.804 2.782 1.00 44.24 C ATOM 0 H LEU A 78 4.777 11.031 5.985 1.00 51.02 H new ATOM 0 HA LEU A 78 2.728 12.179 4.223 1.00 12.55 H new ATOM 0 HB2 LEU A 78 4.325 9.591 3.999 1.00 32.04 H new ATOM 0 HB3 LEU A 78 3.397 10.366 2.729 1.00 32.04 H new ATOM 0 HG LEU A 78 5.992 11.341 3.980 1.00 42.53 H new ATOM 0 HD11 LEU A 78 6.894 11.174 1.676 1.00 24.34 H new ATOM 0 HD12 LEU A 78 6.308 9.610 2.289 1.00 24.34 H new ATOM 0 HD13 LEU A 78 5.329 10.532 1.123 1.00 24.34 H new ATOM 0 HD21 LEU A 78 5.905 13.303 2.464 1.00 44.24 H new ATOM 0 HD22 LEU A 78 4.259 12.837 1.974 1.00 44.24 H new ATOM 0 HD23 LEU A 78 4.586 13.311 3.658 1.00 44.24 H new ATOM 1293 N ARG A 79 0.827 10.555 4.548 1.00 35.25 N ATOM 1294 CA ARG A 79 -0.375 9.787 4.898 1.00 1.34 C ATOM 1295 C ARG A 79 -0.269 8.371 4.292 1.00 10.21 C ATOM 1296 O ARG A 79 -0.191 8.222 3.064 1.00 74.24 O ATOM 1297 CB ARG A 79 -1.634 10.536 4.385 1.00 13.34 C ATOM 1298 CG ARG A 79 -2.974 9.930 4.847 1.00 60.44 C ATOM 1299 CD ARG A 79 -4.183 10.816 4.509 1.00 31.30 C ATOM 1300 NE ARG A 79 -5.430 10.247 5.047 1.00 63.21 N ATOM 1301 CZ ARG A 79 -6.527 10.941 5.382 1.00 63.34 C ATOM 1302 NH1 ARG A 79 -6.585 12.265 5.249 1.00 21.11 N ATOM 1303 NH2 ARG A 79 -7.565 10.295 5.877 1.00 21.43 N ATOM 0 H ARG A 79 0.677 11.232 3.800 1.00 35.25 H new ATOM 0 HA ARG A 79 -0.460 9.688 5.980 1.00 1.34 H new ATOM 0 HB2 ARG A 79 -1.585 11.573 4.718 1.00 13.34 H new ATOM 0 HB3 ARG A 79 -1.613 10.550 3.295 1.00 13.34 H new ATOM 0 HG2 ARG A 79 -3.105 8.954 4.381 1.00 60.44 H new ATOM 0 HG3 ARG A 79 -2.940 9.767 5.924 1.00 60.44 H new ATOM 0 HD2 ARG A 79 -4.030 11.815 4.918 1.00 31.30 H new ATOM 0 HD3 ARG A 79 -4.267 10.924 3.428 1.00 31.30 H new ATOM 0 HE ARG A 79 -5.462 9.236 5.176 1.00 63.21 H new ATOM 0 HH11 ARG A 79 -5.782 12.777 4.884 1.00 21.11 H new ATOM 0 HH12 ARG A 79 -7.433 12.767 5.512 1.00 21.11 H new ATOM 0 HH21 ARG A 79 -7.525 9.283 6.000 1.00 21.43 H new ATOM 0 HH22 ARG A 79 -8.408 10.807 6.137 1.00 21.43 H new ATOM 1317 N VAL A 80 -0.223 7.349 5.176 1.00 64.53 N ATOM 1318 CA VAL A 80 -0.006 5.937 4.787 1.00 41.33 C ATOM 1319 C VAL A 80 -1.344 5.166 4.783 1.00 13.31 C ATOM 1320 O VAL A 80 -2.027 5.077 5.814 1.00 13.50 O ATOM 1321 CB VAL A 80 1.021 5.208 5.739 1.00 41.11 C ATOM 1322 CG1 VAL A 80 1.495 3.866 5.117 1.00 54.20 C ATOM 1323 CG2 VAL A 80 2.220 6.122 6.070 1.00 63.13 C ATOM 0 H VAL A 80 -0.336 7.480 6.181 1.00 64.53 H new ATOM 0 HA VAL A 80 0.416 5.946 3.782 1.00 41.33 H new ATOM 0 HB VAL A 80 0.509 4.983 6.675 1.00 41.11 H new ATOM 0 HG11 VAL A 80 2.202 3.382 5.791 1.00 54.20 H new ATOM 0 HG12 VAL A 80 0.636 3.213 4.962 1.00 54.20 H new ATOM 0 HG13 VAL A 80 1.980 4.060 4.160 1.00 54.20 H new ATOM 0 HG21 VAL A 80 2.910 5.593 6.727 1.00 63.13 H new ATOM 0 HG22 VAL A 80 2.734 6.396 5.149 1.00 63.13 H new ATOM 0 HG23 VAL A 80 1.864 7.024 6.568 1.00 63.13 H new ATOM 1333 N LEU A 81 -1.720 4.643 3.606 1.00 60.45 N ATOM 1334 CA LEU A 81 -2.927 3.825 3.417 1.00 30.22 C ATOM 1335 C LEU A 81 -2.469 2.398 3.049 1.00 24.04 C ATOM 1336 O LEU A 81 -1.969 2.170 1.959 1.00 4.43 O ATOM 1337 CB LEU A 81 -3.826 4.417 2.276 1.00 35.24 C ATOM 1338 CG LEU A 81 -4.368 5.894 2.429 1.00 55.14 C ATOM 1339 CD1 LEU A 81 -5.091 6.113 3.769 1.00 3.43 C ATOM 1340 CD2 LEU A 81 -3.268 6.958 2.213 1.00 22.13 C ATOM 0 H LEU A 81 -1.187 4.778 2.747 1.00 60.45 H new ATOM 0 HA LEU A 81 -3.521 3.815 4.331 1.00 30.22 H new ATOM 0 HB2 LEU A 81 -3.257 4.368 1.347 1.00 35.24 H new ATOM 0 HB3 LEU A 81 -4.687 3.759 2.158 1.00 35.24 H new ATOM 0 HG LEU A 81 -5.101 6.024 1.633 1.00 55.14 H new ATOM 0 HD11 LEU A 81 -5.445 7.142 3.827 1.00 3.43 H new ATOM 0 HD12 LEU A 81 -5.940 5.433 3.840 1.00 3.43 H new ATOM 0 HD13 LEU A 81 -4.401 5.920 4.590 1.00 3.43 H new ATOM 0 HD21 LEU A 81 -3.697 7.953 2.330 1.00 22.13 H new ATOM 0 HD22 LEU A 81 -2.475 6.816 2.947 1.00 22.13 H new ATOM 0 HD23 LEU A 81 -2.855 6.856 1.209 1.00 22.13 H new ATOM 1352 N VAL A 82 -2.617 1.444 3.967 1.00 74.23 N ATOM 1353 CA VAL A 82 -2.161 0.050 3.786 1.00 12.42 C ATOM 1354 C VAL A 82 -3.363 -0.894 3.586 1.00 33.03 C ATOM 1355 O VAL A 82 -4.335 -0.838 4.341 1.00 52.14 O ATOM 1356 CB VAL A 82 -1.302 -0.435 5.021 1.00 15.12 C ATOM 1357 CG1 VAL A 82 -0.809 -1.902 4.865 1.00 24.00 C ATOM 1358 CG2 VAL A 82 -0.117 0.524 5.269 1.00 33.24 C ATOM 0 H VAL A 82 -3.061 1.610 4.870 1.00 74.23 H new ATOM 0 HA VAL A 82 -1.534 0.022 2.895 1.00 12.42 H new ATOM 0 HB VAL A 82 -1.956 -0.416 5.893 1.00 15.12 H new ATOM 0 HG11 VAL A 82 -0.224 -2.184 5.740 1.00 24.00 H new ATOM 0 HG12 VAL A 82 -1.668 -2.567 4.773 1.00 24.00 H new ATOM 0 HG13 VAL A 82 -0.189 -1.984 3.972 1.00 24.00 H new ATOM 0 HG21 VAL A 82 0.462 0.173 6.123 1.00 33.24 H new ATOM 0 HG22 VAL A 82 0.520 0.551 4.385 1.00 33.24 H new ATOM 0 HG23 VAL A 82 -0.496 1.525 5.474 1.00 33.24 H new ATOM 1368 N ILE A 83 -3.285 -1.757 2.555 1.00 73.41 N ATOM 1369 CA ILE A 83 -4.234 -2.873 2.352 1.00 61.25 C ATOM 1370 C ILE A 83 -3.432 -4.172 2.206 1.00 64.13 C ATOM 1371 O ILE A 83 -2.504 -4.242 1.403 1.00 42.51 O ATOM 1372 CB ILE A 83 -5.187 -2.661 1.106 1.00 74.24 C ATOM 1373 CG1 ILE A 83 -6.181 -1.497 1.387 1.00 21.51 C ATOM 1374 CG2 ILE A 83 -5.956 -3.959 0.735 1.00 4.31 C ATOM 1375 CD1 ILE A 83 -7.271 -1.314 0.351 1.00 2.22 C ATOM 0 H ILE A 83 -2.562 -1.702 1.838 1.00 73.41 H new ATOM 0 HA ILE A 83 -4.890 -2.921 3.221 1.00 61.25 H new ATOM 0 HB ILE A 83 -4.563 -2.401 0.251 1.00 74.24 H new ATOM 0 HG12 ILE A 83 -6.649 -1.666 2.357 1.00 21.51 H new ATOM 0 HG13 ILE A 83 -5.615 -0.568 1.464 1.00 21.51 H new ATOM 0 HG21 ILE A 83 -6.598 -3.768 -0.125 1.00 4.31 H new ATOM 0 HG22 ILE A 83 -5.243 -4.746 0.489 1.00 4.31 H new ATOM 0 HG23 ILE A 83 -6.567 -4.274 1.581 1.00 4.31 H new ATOM 0 HD11 ILE A 83 -7.910 -0.479 0.639 1.00 2.22 H new ATOM 0 HD12 ILE A 83 -6.820 -1.108 -0.620 1.00 2.22 H new ATOM 0 HD13 ILE A 83 -7.869 -2.223 0.288 1.00 2.22 H new ATOM 1387 N MET A 84 -3.785 -5.185 3.002 1.00 61.33 N ATOM 1388 CA MET A 84 -3.123 -6.504 2.976 1.00 23.45 C ATOM 1389 C MET A 84 -4.177 -7.582 2.674 1.00 1.40 C ATOM 1390 O MET A 84 -5.138 -7.745 3.429 1.00 1.42 O ATOM 1391 CB MET A 84 -2.380 -6.748 4.322 1.00 43.11 C ATOM 1392 CG MET A 84 -1.149 -5.839 4.523 1.00 43.10 C ATOM 1393 SD MET A 84 -0.454 -5.926 6.189 1.00 73.24 S ATOM 1394 CE MET A 84 -1.679 -5.051 7.167 1.00 13.31 C ATOM 0 H MET A 84 -4.539 -5.119 3.686 1.00 61.33 H new ATOM 0 HA MET A 84 -2.370 -6.545 2.189 1.00 23.45 H new ATOM 0 HB2 MET A 84 -3.076 -6.589 5.145 1.00 43.11 H new ATOM 0 HB3 MET A 84 -2.063 -7.790 4.369 1.00 43.11 H new ATOM 0 HG2 MET A 84 -0.380 -6.117 3.802 1.00 43.10 H new ATOM 0 HG3 MET A 84 -1.430 -4.808 4.308 1.00 43.10 H new ATOM 0 HE1 MET A 84 -1.204 -4.632 8.054 1.00 13.31 H new ATOM 0 HE2 MET A 84 -2.112 -4.246 6.573 1.00 13.31 H new ATOM 0 HE3 MET A 84 -2.466 -5.743 7.469 1.00 13.31 H new ATOM 1404 N VAL A 85 -3.992 -8.296 1.541 1.00 30.31 N ATOM 1405 CA VAL A 85 -4.973 -9.267 0.999 1.00 24.10 C ATOM 1406 C VAL A 85 -4.285 -10.613 0.715 1.00 63.22 C ATOM 1407 O VAL A 85 -3.229 -10.648 0.085 1.00 63.25 O ATOM 1408 CB VAL A 85 -5.632 -8.747 -0.334 1.00 70.54 C ATOM 1409 CG1 VAL A 85 -6.688 -9.744 -0.888 1.00 54.14 C ATOM 1410 CG2 VAL A 85 -6.244 -7.347 -0.130 1.00 35.12 C ATOM 0 H VAL A 85 -3.150 -8.215 0.971 1.00 30.31 H new ATOM 0 HA VAL A 85 -5.753 -9.391 1.750 1.00 24.10 H new ATOM 0 HB VAL A 85 -4.842 -8.671 -1.081 1.00 70.54 H new ATOM 0 HG11 VAL A 85 -7.117 -9.346 -1.807 1.00 54.14 H new ATOM 0 HG12 VAL A 85 -6.211 -10.702 -1.095 1.00 54.14 H new ATOM 0 HG13 VAL A 85 -7.478 -9.885 -0.150 1.00 54.14 H new ATOM 0 HG21 VAL A 85 -6.694 -7.007 -1.063 1.00 35.12 H new ATOM 0 HG22 VAL A 85 -7.009 -7.394 0.645 1.00 35.12 H new ATOM 0 HG23 VAL A 85 -5.463 -6.649 0.172 1.00 35.12 H new ATOM 1420 N ASP A 86 -4.910 -11.702 1.183 1.00 14.33 N ATOM 1421 CA ASP A 86 -4.455 -13.090 0.964 1.00 23.21 C ATOM 1422 C ASP A 86 -5.481 -14.058 1.573 1.00 42.51 C ATOM 1423 O ASP A 86 -6.254 -13.668 2.442 1.00 25.23 O ATOM 1424 CB ASP A 86 -3.044 -13.347 1.581 1.00 73.43 C ATOM 1425 CG ASP A 86 -2.549 -14.788 1.374 1.00 2.31 C ATOM 1426 OD1 ASP A 86 -2.270 -15.489 2.367 1.00 13.31 O ATOM 1427 OD2 ASP A 86 -2.503 -15.243 0.207 1.00 74.40 O ATOM 0 H ASP A 86 -5.765 -11.646 1.737 1.00 14.33 H new ATOM 0 HA ASP A 86 -4.373 -13.256 -0.110 1.00 23.21 H new ATOM 0 HB2 ASP A 86 -2.328 -12.656 1.136 1.00 73.43 H new ATOM 0 HB3 ASP A 86 -3.076 -13.130 2.649 1.00 73.43 H new ATOM 1432 N GLN A 87 -5.455 -15.325 1.112 1.00 43.54 N ATOM 1433 CA GLN A 87 -6.362 -16.397 1.572 1.00 21.34 C ATOM 1434 C GLN A 87 -6.233 -16.635 3.096 1.00 1.41 C ATOM 1435 O GLN A 87 -7.222 -16.944 3.775 1.00 65.23 O ATOM 1436 CB GLN A 87 -6.057 -17.708 0.796 1.00 65.13 C ATOM 1437 CG GLN A 87 -6.023 -17.548 -0.746 1.00 23.12 C ATOM 1438 CD GLN A 87 -7.355 -17.092 -1.355 1.00 14.22 C ATOM 1439 OE1 GLN A 87 -8.432 -17.425 -0.860 1.00 23.43 O ATOM 1440 NE2 GLN A 87 -7.291 -16.332 -2.441 1.00 11.12 N ATOM 0 H GLN A 87 -4.795 -15.637 0.400 1.00 43.54 H new ATOM 0 HA GLN A 87 -7.387 -16.085 1.373 1.00 21.34 H new ATOM 0 HB2 GLN A 87 -5.095 -18.098 1.130 1.00 65.13 H new ATOM 0 HB3 GLN A 87 -6.810 -18.452 1.055 1.00 65.13 H new ATOM 0 HG2 GLN A 87 -5.249 -16.827 -1.009 1.00 23.12 H new ATOM 0 HG3 GLN A 87 -5.737 -18.500 -1.194 1.00 23.12 H new ATOM 0 HE21 GLN A 87 -6.384 -16.072 -2.829 1.00 11.12 H new ATOM 0 HE22 GLN A 87 -8.149 -16.008 -2.888 1.00 11.12 H new ATOM 1449 N ASP A 88 -4.996 -16.486 3.610 1.00 3.13 N ATOM 1450 CA ASP A 88 -4.695 -16.603 5.045 1.00 72.24 C ATOM 1451 C ASP A 88 -4.905 -15.247 5.730 1.00 11.11 C ATOM 1452 O ASP A 88 -4.012 -14.388 5.717 1.00 53.44 O ATOM 1453 CB ASP A 88 -3.242 -17.096 5.269 1.00 24.55 C ATOM 1454 CG ASP A 88 -3.005 -18.516 4.750 1.00 33.30 C ATOM 1455 OD1 ASP A 88 -3.341 -19.479 5.469 1.00 30.12 O ATOM 1456 OD2 ASP A 88 -2.489 -18.680 3.622 1.00 15.15 O ATOM 0 H ASP A 88 -4.177 -16.281 3.037 1.00 3.13 H new ATOM 0 HA ASP A 88 -5.372 -17.337 5.482 1.00 72.24 H new ATOM 0 HB2 ASP A 88 -2.552 -16.414 4.772 1.00 24.55 H new ATOM 0 HB3 ASP A 88 -3.013 -17.061 6.334 1.00 24.55 H new ATOM 1461 N GLN A 89 -6.112 -15.068 6.313 1.00 35.23 N ATOM 1462 CA GLN A 89 -6.472 -13.864 7.093 1.00 44.04 C ATOM 1463 C GLN A 89 -5.576 -13.712 8.341 1.00 50.34 C ATOM 1464 O GLN A 89 -5.407 -12.609 8.864 1.00 54.43 O ATOM 1465 CB GLN A 89 -7.975 -13.911 7.510 1.00 11.20 C ATOM 1466 CG GLN A 89 -8.493 -12.612 8.178 1.00 14.15 C ATOM 1467 CD GLN A 89 -8.383 -11.383 7.268 1.00 64.14 C ATOM 1468 OE1 GLN A 89 -8.551 -11.461 6.061 1.00 73.11 O ATOM 1469 NE2 GLN A 89 -8.044 -10.252 7.835 1.00 73.11 N ATOM 0 H GLN A 89 -6.864 -15.755 6.255 1.00 35.23 H new ATOM 0 HA GLN A 89 -6.310 -12.996 6.455 1.00 44.04 H new ATOM 0 HB2 GLN A 89 -8.579 -14.117 6.626 1.00 11.20 H new ATOM 0 HB3 GLN A 89 -8.123 -14.743 8.198 1.00 11.20 H new ATOM 0 HG2 GLN A 89 -9.535 -12.750 8.468 1.00 14.15 H new ATOM 0 HG3 GLN A 89 -7.929 -12.431 9.093 1.00 14.15 H new ATOM 0 HE21 GLN A 89 -7.909 -10.208 8.845 1.00 73.11 H new ATOM 0 HE22 GLN A 89 -7.915 -9.415 7.267 1.00 73.11 H new ATOM 1478 N GLU A 90 -4.997 -14.842 8.783 1.00 24.31 N ATOM 1479 CA GLU A 90 -4.139 -14.927 9.977 1.00 42.40 C ATOM 1480 C GLU A 90 -2.912 -13.989 9.862 1.00 11.41 C ATOM 1481 O GLU A 90 -2.619 -13.214 10.779 1.00 62.52 O ATOM 1482 CB GLU A 90 -3.674 -16.398 10.185 1.00 53.11 C ATOM 1483 CG GLU A 90 -4.783 -17.465 10.036 1.00 65.04 C ATOM 1484 CD GLU A 90 -5.997 -17.229 10.950 1.00 2.53 C ATOM 1485 OE1 GLU A 90 -5.906 -17.519 12.159 1.00 43.31 O ATOM 1486 OE2 GLU A 90 -7.051 -16.757 10.467 1.00 21.31 O ATOM 0 H GLU A 90 -5.115 -15.739 8.311 1.00 24.31 H new ATOM 0 HA GLU A 90 -4.722 -14.604 10.839 1.00 42.40 H new ATOM 0 HB2 GLU A 90 -2.882 -16.617 9.468 1.00 53.11 H new ATOM 0 HB3 GLU A 90 -3.237 -16.487 11.180 1.00 53.11 H new ATOM 0 HG2 GLU A 90 -5.119 -17.484 8.999 1.00 65.04 H new ATOM 0 HG3 GLU A 90 -4.362 -18.447 10.253 1.00 65.04 H new ATOM 1493 N GLU A 91 -2.228 -14.066 8.700 1.00 22.51 N ATOM 1494 CA GLU A 91 -1.007 -13.290 8.413 1.00 55.21 C ATOM 1495 C GLU A 91 -1.347 -11.798 8.205 1.00 4.54 C ATOM 1496 O GLU A 91 -0.592 -10.907 8.625 1.00 72.24 O ATOM 1497 CB GLU A 91 -0.296 -13.859 7.158 1.00 11.23 C ATOM 1498 CG GLU A 91 1.046 -13.174 6.847 1.00 25.23 C ATOM 1499 CD GLU A 91 1.705 -13.670 5.561 1.00 10.21 C ATOM 1500 OE1 GLU A 91 1.556 -13.011 4.507 1.00 21.32 O ATOM 1501 OE2 GLU A 91 2.388 -14.717 5.593 1.00 35.41 O ATOM 0 H GLU A 91 -2.511 -14.673 7.931 1.00 22.51 H new ATOM 0 HA GLU A 91 -0.335 -13.373 9.267 1.00 55.21 H new ATOM 0 HB2 GLU A 91 -0.125 -14.926 7.300 1.00 11.23 H new ATOM 0 HB3 GLU A 91 -0.956 -13.753 6.297 1.00 11.23 H new ATOM 0 HG2 GLU A 91 0.886 -12.098 6.771 1.00 25.23 H new ATOM 0 HG3 GLU A 91 1.729 -13.337 7.681 1.00 25.23 H new ATOM 1508 N LEU A 92 -2.510 -11.554 7.571 1.00 65.33 N ATOM 1509 CA LEU A 92 -3.001 -10.196 7.268 1.00 12.23 C ATOM 1510 C LEU A 92 -3.255 -9.418 8.567 1.00 61.32 C ATOM 1511 O LEU A 92 -2.761 -8.297 8.748 1.00 14.21 O ATOM 1512 CB LEU A 92 -4.311 -10.268 6.442 1.00 23.12 C ATOM 1513 CG LEU A 92 -4.252 -11.111 5.139 1.00 1.42 C ATOM 1514 CD1 LEU A 92 -5.595 -11.038 4.389 1.00 25.54 C ATOM 1515 CD2 LEU A 92 -3.063 -10.684 4.246 1.00 41.00 C ATOM 0 H LEU A 92 -3.136 -12.294 7.254 1.00 65.33 H new ATOM 0 HA LEU A 92 -2.239 -9.679 6.685 1.00 12.23 H new ATOM 0 HB2 LEU A 92 -5.096 -10.675 7.079 1.00 23.12 H new ATOM 0 HB3 LEU A 92 -4.608 -9.252 6.180 1.00 23.12 H new ATOM 0 HG LEU A 92 -4.082 -12.153 5.410 1.00 1.42 H new ATOM 0 HD11 LEU A 92 -5.536 -11.634 3.478 1.00 25.54 H new ATOM 0 HD12 LEU A 92 -6.389 -11.427 5.026 1.00 25.54 H new ATOM 0 HD13 LEU A 92 -5.812 -10.001 4.131 1.00 25.54 H new ATOM 0 HD21 LEU A 92 -3.050 -11.293 3.342 1.00 41.00 H new ATOM 0 HD22 LEU A 92 -3.171 -9.634 3.974 1.00 41.00 H new ATOM 0 HD23 LEU A 92 -2.130 -10.824 4.791 1.00 41.00 H new ATOM 1527 N GLU A 93 -4.009 -10.070 9.469 1.00 31.03 N ATOM 1528 CA GLU A 93 -4.402 -9.511 10.766 1.00 23.13 C ATOM 1529 C GLU A 93 -3.178 -9.394 11.712 1.00 3.50 C ATOM 1530 O GLU A 93 -3.159 -8.520 12.594 1.00 54.33 O ATOM 1531 CB GLU A 93 -5.538 -10.370 11.393 1.00 64.04 C ATOM 1532 CG GLU A 93 -6.222 -9.723 12.617 1.00 54.54 C ATOM 1533 CD GLU A 93 -7.268 -10.630 13.282 1.00 72.40 C ATOM 1534 OE1 GLU A 93 -6.875 -11.519 14.064 1.00 4.43 O ATOM 1535 OE2 GLU A 93 -8.482 -10.451 13.043 1.00 63.25 O ATOM 0 H GLU A 93 -4.365 -11.013 9.312 1.00 31.03 H new ATOM 0 HA GLU A 93 -4.787 -8.502 10.616 1.00 23.13 H new ATOM 0 HB2 GLU A 93 -6.292 -10.565 10.631 1.00 64.04 H new ATOM 0 HB3 GLU A 93 -5.127 -11.335 11.689 1.00 64.04 H new ATOM 0 HG2 GLU A 93 -5.461 -9.459 13.352 1.00 54.54 H new ATOM 0 HG3 GLU A 93 -6.702 -8.794 12.307 1.00 54.54 H new ATOM 1542 N ARG A 94 -2.154 -10.256 11.492 1.00 25.11 N ATOM 1543 CA ARG A 94 -0.881 -10.235 12.254 1.00 61.31 C ATOM 1544 C ARG A 94 -0.184 -8.869 12.110 1.00 30.42 C ATOM 1545 O ARG A 94 0.147 -8.218 13.108 1.00 72.24 O ATOM 1546 CB ARG A 94 0.066 -11.371 11.756 1.00 24.32 C ATOM 1547 CG ARG A 94 1.370 -11.559 12.582 1.00 43.12 C ATOM 1548 CD ARG A 94 1.074 -11.972 14.032 1.00 22.31 C ATOM 1549 NE ARG A 94 2.278 -12.247 14.836 1.00 43.21 N ATOM 1550 CZ ARG A 94 2.253 -12.576 16.144 1.00 52.01 C ATOM 1551 NH1 ARG A 94 1.097 -12.657 16.804 1.00 51.41 N ATOM 1552 NH2 ARG A 94 3.387 -12.836 16.784 1.00 22.01 N ATOM 0 H ARG A 94 -2.188 -10.986 10.780 1.00 25.11 H new ATOM 0 HA ARG A 94 -1.110 -10.400 13.307 1.00 61.31 H new ATOM 0 HB2 ARG A 94 -0.487 -12.311 11.761 1.00 24.32 H new ATOM 0 HB3 ARG A 94 0.338 -11.167 10.720 1.00 24.32 H new ATOM 0 HG2 ARG A 94 1.994 -12.317 12.109 1.00 43.12 H new ATOM 0 HG3 ARG A 94 1.940 -10.630 12.578 1.00 43.12 H new ATOM 0 HD2 ARG A 94 0.501 -11.180 14.514 1.00 22.31 H new ATOM 0 HD3 ARG A 94 0.444 -12.862 14.024 1.00 22.31 H new ATOM 0 HE ARG A 94 3.186 -12.185 14.375 1.00 43.21 H new ATOM 0 HH11 ARG A 94 0.219 -12.469 16.320 1.00 51.41 H new ATOM 0 HH12 ARG A 94 1.091 -12.907 17.793 1.00 51.41 H new ATOM 0 HH21 ARG A 94 4.276 -12.787 16.287 1.00 22.01 H new ATOM 0 HH22 ARG A 94 3.369 -13.085 17.773 1.00 22.01 H new ATOM 1566 N ILE A 95 0.009 -8.442 10.853 1.00 11.14 N ATOM 1567 CA ILE A 95 0.668 -7.164 10.525 1.00 2.31 C ATOM 1568 C ILE A 95 -0.270 -5.973 10.839 1.00 64.04 C ATOM 1569 O ILE A 95 0.189 -4.900 11.274 1.00 64.14 O ATOM 1570 CB ILE A 95 1.104 -7.119 9.013 1.00 61.12 C ATOM 1571 CG1 ILE A 95 1.862 -8.422 8.595 1.00 12.23 C ATOM 1572 CG2 ILE A 95 1.972 -5.874 8.724 1.00 44.23 C ATOM 1573 CD1 ILE A 95 3.151 -8.687 9.344 1.00 71.51 C ATOM 0 H ILE A 95 -0.287 -8.972 10.033 1.00 11.14 H new ATOM 0 HA ILE A 95 1.563 -7.085 11.142 1.00 2.31 H new ATOM 0 HB ILE A 95 0.195 -7.053 8.415 1.00 61.12 H new ATOM 0 HG12 ILE A 95 1.196 -9.273 8.739 1.00 12.23 H new ATOM 0 HG13 ILE A 95 2.084 -8.368 7.529 1.00 12.23 H new ATOM 0 HG21 ILE A 95 2.260 -5.867 7.673 1.00 44.23 H new ATOM 0 HG22 ILE A 95 1.402 -4.973 8.950 1.00 44.23 H new ATOM 0 HG23 ILE A 95 2.867 -5.903 9.345 1.00 44.23 H new ATOM 0 HD11 ILE A 95 3.599 -9.612 8.981 1.00 71.51 H new ATOM 0 HD12 ILE A 95 3.843 -7.861 9.181 1.00 71.51 H new ATOM 0 HD13 ILE A 95 2.940 -8.780 10.409 1.00 71.51 H new ATOM 1585 N TYR A 96 -1.587 -6.200 10.618 1.00 42.34 N ATOM 1586 CA TYR A 96 -2.661 -5.218 10.877 1.00 23.22 C ATOM 1587 C TYR A 96 -2.547 -4.636 12.292 1.00 42.03 C ATOM 1588 O TYR A 96 -2.579 -3.421 12.444 1.00 21.51 O ATOM 1589 CB TYR A 96 -4.042 -5.907 10.696 1.00 23.20 C ATOM 1590 CG TYR A 96 -5.292 -5.050 10.987 1.00 24.45 C ATOM 1591 CD1 TYR A 96 -5.966 -4.388 9.964 1.00 55.51 C ATOM 1592 CD2 TYR A 96 -5.815 -4.920 12.287 1.00 2.01 C ATOM 1593 CE1 TYR A 96 -7.101 -3.641 10.211 1.00 11.11 C ATOM 1594 CE2 TYR A 96 -6.949 -4.164 12.535 1.00 13.11 C ATOM 1595 CZ TYR A 96 -7.583 -3.523 11.491 1.00 23.03 C ATOM 1596 OH TYR A 96 -8.706 -2.757 11.730 1.00 40.23 O ATOM 0 H TYR A 96 -1.936 -7.085 10.249 1.00 42.34 H new ATOM 0 HA TYR A 96 -2.562 -4.397 10.167 1.00 23.22 H new ATOM 0 HB2 TYR A 96 -4.109 -6.268 9.670 1.00 23.20 H new ATOM 0 HB3 TYR A 96 -4.072 -6.783 11.345 1.00 23.20 H new ATOM 0 HD1 TYR A 96 -5.592 -4.460 8.953 1.00 55.51 H new ATOM 0 HD2 TYR A 96 -5.322 -5.420 13.108 1.00 2.01 H new ATOM 0 HE1 TYR A 96 -7.610 -3.149 9.396 1.00 11.11 H new ATOM 0 HE2 TYR A 96 -7.335 -4.077 13.540 1.00 13.11 H new ATOM 0 HH TYR A 96 -8.918 -2.777 12.687 1.00 40.23 H new ATOM 1606 N GLU A 97 -2.399 -5.536 13.295 1.00 52.22 N ATOM 1607 CA GLU A 97 -2.338 -5.175 14.727 1.00 63.44 C ATOM 1608 C GLU A 97 -1.227 -4.141 15.009 1.00 75.52 C ATOM 1609 O GLU A 97 -1.468 -3.142 15.699 1.00 2.44 O ATOM 1610 CB GLU A 97 -2.092 -6.438 15.588 1.00 2.11 C ATOM 1611 CG GLU A 97 -2.034 -6.171 17.124 1.00 4.02 C ATOM 1612 CD GLU A 97 -1.282 -7.236 17.947 1.00 41.24 C ATOM 1613 OE1 GLU A 97 -0.855 -8.263 17.381 1.00 32.12 O ATOM 1614 OE2 GLU A 97 -1.096 -7.028 19.168 1.00 74.43 O ATOM 0 H GLU A 97 -2.318 -6.539 13.128 1.00 52.22 H new ATOM 0 HA GLU A 97 -3.297 -4.728 14.990 1.00 63.44 H new ATOM 0 HB2 GLU A 97 -2.884 -7.160 15.387 1.00 2.11 H new ATOM 0 HB3 GLU A 97 -1.154 -6.898 15.276 1.00 2.11 H new ATOM 0 HG2 GLU A 97 -1.560 -5.204 17.291 1.00 4.02 H new ATOM 0 HG3 GLU A 97 -3.053 -6.095 17.502 1.00 4.02 H new ATOM 1621 N GLN A 98 -0.022 -4.413 14.457 1.00 54.33 N ATOM 1622 CA GLN A 98 1.164 -3.543 14.587 1.00 11.20 C ATOM 1623 C GLN A 98 0.833 -2.128 14.079 1.00 41.22 C ATOM 1624 O GLN A 98 0.906 -1.152 14.832 1.00 42.20 O ATOM 1625 CB GLN A 98 2.351 -4.165 13.781 1.00 63.21 C ATOM 1626 CG GLN A 98 3.657 -3.322 13.727 1.00 1.53 C ATOM 1627 CD GLN A 98 4.368 -3.144 15.079 1.00 31.32 C ATOM 1628 OE1 GLN A 98 4.324 -4.017 15.949 1.00 41.32 O ATOM 1629 NE2 GLN A 98 5.048 -2.017 15.258 1.00 24.02 N ATOM 0 H GLN A 98 0.153 -5.252 13.904 1.00 54.33 H new ATOM 0 HA GLN A 98 1.455 -3.467 15.635 1.00 11.20 H new ATOM 0 HB2 GLN A 98 2.588 -5.137 14.214 1.00 63.21 H new ATOM 0 HB3 GLN A 98 2.016 -4.344 12.759 1.00 63.21 H new ATOM 0 HG2 GLN A 98 4.348 -3.794 13.029 1.00 1.53 H new ATOM 0 HG3 GLN A 98 3.420 -2.337 13.325 1.00 1.53 H new ATOM 0 HE21 GLN A 98 5.068 -1.311 14.522 1.00 24.02 H new ATOM 0 HE22 GLN A 98 5.550 -1.858 16.131 1.00 24.02 H new ATOM 1638 N LEU A 99 0.374 -2.065 12.818 1.00 13.10 N ATOM 1639 CA LEU A 99 0.128 -0.796 12.101 1.00 41.43 C ATOM 1640 C LEU A 99 -1.130 -0.058 12.639 1.00 21.04 C ATOM 1641 O LEU A 99 -1.262 1.161 12.477 1.00 5.21 O ATOM 1642 CB LEU A 99 -0.023 -1.084 10.588 1.00 61.01 C ATOM 1643 CG LEU A 99 1.076 -1.987 9.924 1.00 73.32 C ATOM 1644 CD1 LEU A 99 0.819 -2.154 8.416 1.00 12.10 C ATOM 1645 CD2 LEU A 99 2.498 -1.460 10.198 1.00 73.22 C ATOM 0 H LEU A 99 0.161 -2.894 12.263 1.00 13.10 H new ATOM 0 HA LEU A 99 0.981 -0.139 12.270 1.00 41.43 H new ATOM 0 HB2 LEU A 99 -0.992 -1.556 10.428 1.00 61.01 H new ATOM 0 HB3 LEU A 99 -0.042 -0.130 10.061 1.00 61.01 H new ATOM 0 HG LEU A 99 1.008 -2.972 10.386 1.00 73.32 H new ATOM 0 HD11 LEU A 99 1.596 -2.784 7.982 1.00 12.10 H new ATOM 0 HD12 LEU A 99 -0.154 -2.620 8.262 1.00 12.10 H new ATOM 0 HD13 LEU A 99 0.833 -1.176 7.934 1.00 12.10 H new ATOM 0 HD21 LEU A 99 3.227 -2.115 9.720 1.00 73.22 H new ATOM 0 HD22 LEU A 99 2.596 -0.452 9.795 1.00 73.22 H new ATOM 0 HD23 LEU A 99 2.678 -1.440 11.273 1.00 73.22 H new ATOM 1657 N LYS A 100 -2.033 -0.819 13.289 1.00 42.12 N ATOM 1658 CA LYS A 100 -3.282 -0.299 13.894 1.00 61.12 C ATOM 1659 C LYS A 100 -2.914 0.627 15.065 1.00 44.12 C ATOM 1660 O LYS A 100 -3.474 1.718 15.211 1.00 1.43 O ATOM 1661 CB LYS A 100 -4.165 -1.514 14.360 1.00 1.30 C ATOM 1662 CG LYS A 100 -5.645 -1.221 14.749 1.00 10.21 C ATOM 1663 CD LYS A 100 -5.827 -0.592 16.154 1.00 71.05 C ATOM 1664 CE LYS A 100 -7.305 -0.403 16.536 1.00 65.43 C ATOM 1665 NZ LYS A 100 -8.040 0.443 15.556 1.00 5.23 N ATOM 0 H LYS A 100 -1.917 -1.825 13.412 1.00 42.12 H new ATOM 0 HA LYS A 100 -3.860 0.279 13.173 1.00 61.12 H new ATOM 0 HB2 LYS A 100 -4.168 -2.254 13.560 1.00 1.30 H new ATOM 0 HB3 LYS A 100 -3.677 -1.975 15.219 1.00 1.30 H new ATOM 0 HG2 LYS A 100 -6.077 -0.551 14.006 1.00 10.21 H new ATOM 0 HG3 LYS A 100 -6.210 -2.152 14.705 1.00 10.21 H new ATOM 0 HD2 LYS A 100 -5.343 -1.226 16.896 1.00 71.05 H new ATOM 0 HD3 LYS A 100 -5.323 0.374 16.183 1.00 71.05 H new ATOM 0 HE2 LYS A 100 -7.787 -1.378 16.604 1.00 65.43 H new ATOM 0 HE3 LYS A 100 -7.367 0.053 17.524 1.00 65.43 H new ATOM 0 HZ1 LYS A 100 -9.002 0.625 15.907 1.00 5.23 H new ATOM 0 HZ2 LYS A 100 -7.539 1.346 15.433 1.00 5.23 H new ATOM 0 HZ3 LYS A 100 -8.093 -0.051 14.642 1.00 5.23 H new ATOM 1679 N LYS A 101 -1.945 0.165 15.874 1.00 52.10 N ATOM 1680 CA LYS A 101 -1.414 0.905 17.035 1.00 61.44 C ATOM 1681 C LYS A 101 -0.643 2.175 16.607 1.00 13.34 C ATOM 1682 O LYS A 101 -0.528 3.123 17.391 1.00 63.14 O ATOM 1683 CB LYS A 101 -0.490 -0.029 17.853 1.00 62.31 C ATOM 1684 CG LYS A 101 -1.197 -1.284 18.412 1.00 71.14 C ATOM 1685 CD LYS A 101 -0.200 -2.281 19.039 1.00 14.52 C ATOM 1686 CE LYS A 101 -0.875 -3.546 19.583 1.00 14.11 C ATOM 1687 NZ LYS A 101 0.120 -4.550 20.038 1.00 31.24 N ATOM 0 H LYS A 101 -1.502 -0.744 15.739 1.00 52.10 H new ATOM 0 HA LYS A 101 -2.256 1.229 17.647 1.00 61.44 H new ATOM 0 HB2 LYS A 101 0.341 -0.344 17.222 1.00 62.31 H new ATOM 0 HB3 LYS A 101 -0.064 0.535 18.683 1.00 62.31 H new ATOM 0 HG2 LYS A 101 -1.929 -0.984 19.162 1.00 71.14 H new ATOM 0 HG3 LYS A 101 -1.747 -1.777 17.610 1.00 71.14 H new ATOM 0 HD2 LYS A 101 0.540 -2.565 18.291 1.00 14.52 H new ATOM 0 HD3 LYS A 101 0.338 -1.787 19.848 1.00 14.52 H new ATOM 0 HE2 LYS A 101 -1.529 -3.280 20.413 1.00 14.11 H new ATOM 0 HE3 LYS A 101 -1.505 -3.984 18.808 1.00 14.11 H new ATOM 0 HZ1 LYS A 101 -0.196 -5.502 19.762 1.00 31.24 H new ATOM 0 HZ2 LYS A 101 1.041 -4.350 19.598 1.00 31.24 H new ATOM 0 HZ3 LYS A 101 0.213 -4.503 21.073 1.00 31.24 H new ATOM 1701 N ASP A 102 -0.120 2.181 15.366 1.00 53.11 N ATOM 1702 CA ASP A 102 0.585 3.348 14.789 1.00 62.01 C ATOM 1703 C ASP A 102 -0.406 4.360 14.170 1.00 54.31 C ATOM 1704 O ASP A 102 0.018 5.408 13.678 1.00 51.20 O ATOM 1705 CB ASP A 102 1.628 2.895 13.728 1.00 75.33 C ATOM 1706 CG ASP A 102 2.757 2.041 14.324 1.00 53.23 C ATOM 1707 OD1 ASP A 102 2.822 0.826 14.042 1.00 71.31 O ATOM 1708 OD2 ASP A 102 3.588 2.592 15.084 1.00 40.33 O ATOM 0 H ASP A 102 -0.172 1.381 14.735 1.00 53.11 H new ATOM 0 HA ASP A 102 1.110 3.847 15.603 1.00 62.01 H new ATOM 0 HB2 ASP A 102 1.122 2.326 12.949 1.00 75.33 H new ATOM 0 HB3 ASP A 102 2.059 3.775 13.251 1.00 75.33 H new ATOM 1713 N GLY A 103 -1.719 4.039 14.204 1.00 64.25 N ATOM 1714 CA GLY A 103 -2.763 4.931 13.682 1.00 11.13 C ATOM 1715 C GLY A 103 -2.770 5.006 12.166 1.00 4.33 C ATOM 1716 O GLY A 103 -3.082 6.052 11.591 1.00 3.03 O ATOM 0 H GLY A 103 -2.075 3.165 14.590 1.00 64.25 H new ATOM 0 HA2 GLY A 103 -3.737 4.585 14.028 1.00 11.13 H new ATOM 0 HA3 GLY A 103 -2.617 5.931 14.090 1.00 11.13 H new ATOM 1720 N VAL A 104 -2.386 3.894 11.524 1.00 30.45 N ATOM 1721 CA VAL A 104 -2.338 3.768 10.060 1.00 44.21 C ATOM 1722 C VAL A 104 -3.676 3.219 9.560 1.00 13.41 C ATOM 1723 O VAL A 104 -4.279 2.368 10.228 1.00 43.44 O ATOM 1724 CB VAL A 104 -1.177 2.802 9.624 1.00 22.44 C ATOM 1725 CG1 VAL A 104 -1.034 2.723 8.085 1.00 0.25 C ATOM 1726 CG2 VAL A 104 0.149 3.221 10.293 1.00 51.21 C ATOM 0 H VAL A 104 -2.096 3.046 12.012 1.00 30.45 H new ATOM 0 HA VAL A 104 -2.152 4.751 9.626 1.00 44.21 H new ATOM 0 HB VAL A 104 -1.433 1.799 9.965 1.00 22.44 H new ATOM 0 HG11 VAL A 104 -0.220 2.044 7.830 1.00 0.25 H new ATOM 0 HG12 VAL A 104 -1.964 2.354 7.652 1.00 0.25 H new ATOM 0 HG13 VAL A 104 -0.817 3.715 7.688 1.00 0.25 H new ATOM 0 HG21 VAL A 104 0.944 2.543 9.982 1.00 51.21 H new ATOM 0 HG22 VAL A 104 0.402 4.238 9.994 1.00 51.21 H new ATOM 0 HG23 VAL A 104 0.039 3.178 11.377 1.00 51.21 H new ATOM 1736 N ASP A 105 -4.135 3.701 8.395 1.00 33.32 N ATOM 1737 CA ASP A 105 -5.335 3.159 7.757 1.00 74.21 C ATOM 1738 C ASP A 105 -4.989 1.773 7.210 1.00 51.11 C ATOM 1739 O ASP A 105 -4.261 1.659 6.242 1.00 11.30 O ATOM 1740 CB ASP A 105 -5.809 4.087 6.614 1.00 43.32 C ATOM 1741 CG ASP A 105 -7.038 3.538 5.864 1.00 3.54 C ATOM 1742 OD1 ASP A 105 -8.129 3.449 6.466 1.00 62.32 O ATOM 1743 OD2 ASP A 105 -6.941 3.231 4.657 1.00 51.54 O ATOM 0 H ASP A 105 -3.692 4.462 7.880 1.00 33.32 H new ATOM 0 HA ASP A 105 -6.146 3.088 8.481 1.00 74.21 H new ATOM 0 HB2 ASP A 105 -6.049 5.067 7.025 1.00 43.32 H new ATOM 0 HB3 ASP A 105 -4.992 4.229 5.907 1.00 43.32 H new ATOM 1748 N VAL A 106 -5.472 0.732 7.880 1.00 41.14 N ATOM 1749 CA VAL A 106 -5.173 -0.663 7.519 1.00 13.10 C ATOM 1750 C VAL A 106 -6.466 -1.431 7.259 1.00 35.03 C ATOM 1751 O VAL A 106 -7.393 -1.391 8.070 1.00 42.03 O ATOM 1752 CB VAL A 106 -4.286 -1.379 8.617 1.00 50.41 C ATOM 1753 CG1 VAL A 106 -2.799 -1.043 8.410 1.00 65.33 C ATOM 1754 CG2 VAL A 106 -4.727 -0.998 10.060 1.00 73.24 C ATOM 0 H VAL A 106 -6.084 0.824 8.691 1.00 41.14 H new ATOM 0 HA VAL A 106 -4.587 -0.654 6.600 1.00 13.10 H new ATOM 0 HB VAL A 106 -4.430 -2.453 8.501 1.00 50.41 H new ATOM 0 HG11 VAL A 106 -2.203 -1.543 9.173 1.00 65.33 H new ATOM 0 HG12 VAL A 106 -2.483 -1.382 7.423 1.00 65.33 H new ATOM 0 HG13 VAL A 106 -2.655 0.035 8.486 1.00 65.33 H new ATOM 0 HG21 VAL A 106 -4.092 -1.511 10.782 1.00 73.24 H new ATOM 0 HG22 VAL A 106 -4.634 0.079 10.196 1.00 73.24 H new ATOM 0 HG23 VAL A 106 -5.764 -1.295 10.214 1.00 73.24 H new ATOM 1764 N ARG A 107 -6.529 -2.081 6.083 1.00 24.03 N ATOM 1765 CA ARG A 107 -7.711 -2.815 5.614 1.00 54.23 C ATOM 1766 C ARG A 107 -7.267 -4.201 5.142 1.00 64.33 C ATOM 1767 O ARG A 107 -6.559 -4.335 4.140 1.00 43.54 O ATOM 1768 CB ARG A 107 -8.422 -2.020 4.475 1.00 3.31 C ATOM 1769 CG ARG A 107 -8.698 -0.555 4.862 1.00 4.22 C ATOM 1770 CD ARG A 107 -9.389 0.303 3.794 1.00 3.52 C ATOM 1771 NE ARG A 107 -9.572 1.667 4.326 1.00 30.51 N ATOM 1772 CZ ARG A 107 -10.669 2.417 4.230 1.00 74.33 C ATOM 1773 NH1 ARG A 107 -11.747 1.998 3.581 1.00 62.13 N ATOM 1774 NH2 ARG A 107 -10.710 3.564 4.885 1.00 61.43 N ATOM 0 H ARG A 107 -5.749 -2.110 5.426 1.00 24.03 H new ATOM 0 HA ARG A 107 -8.431 -2.932 6.424 1.00 54.23 H new ATOM 0 HB2 ARG A 107 -7.803 -2.045 3.578 1.00 3.31 H new ATOM 0 HB3 ARG A 107 -9.363 -2.510 4.227 1.00 3.31 H new ATOM 0 HG2 ARG A 107 -9.314 -0.547 5.761 1.00 4.22 H new ATOM 0 HG3 ARG A 107 -7.750 -0.084 5.121 1.00 4.22 H new ATOM 0 HD2 ARG A 107 -8.789 0.330 2.885 1.00 3.52 H new ATOM 0 HD3 ARG A 107 -10.353 -0.131 3.527 1.00 3.52 H new ATOM 0 HE ARG A 107 -8.778 2.078 4.817 1.00 30.51 H new ATOM 0 HH11 ARG A 107 -11.751 1.079 3.138 1.00 62.13 H new ATOM 0 HH12 ARG A 107 -12.572 2.595 3.524 1.00 62.13 H new ATOM 0 HH21 ARG A 107 -9.912 3.858 5.449 1.00 61.43 H new ATOM 0 HH22 ARG A 107 -11.539 4.155 4.827 1.00 61.43 H new ATOM 1788 N VAL A 108 -7.671 -5.222 5.895 1.00 14.22 N ATOM 1789 CA VAL A 108 -7.298 -6.618 5.653 1.00 4.11 C ATOM 1790 C VAL A 108 -8.558 -7.435 5.345 1.00 61.51 C ATOM 1791 O VAL A 108 -9.585 -7.278 6.019 1.00 72.50 O ATOM 1792 CB VAL A 108 -6.510 -7.212 6.883 1.00 55.24 C ATOM 1793 CG1 VAL A 108 -5.139 -6.514 7.032 1.00 2.44 C ATOM 1794 CG2 VAL A 108 -7.322 -7.113 8.207 1.00 11.14 C ATOM 0 H VAL A 108 -8.278 -5.102 6.706 1.00 14.22 H new ATOM 0 HA VAL A 108 -6.631 -6.668 4.792 1.00 4.11 H new ATOM 0 HB VAL A 108 -6.350 -8.272 6.684 1.00 55.24 H new ATOM 0 HG11 VAL A 108 -4.607 -6.935 7.885 1.00 2.44 H new ATOM 0 HG12 VAL A 108 -4.552 -6.668 6.127 1.00 2.44 H new ATOM 0 HG13 VAL A 108 -5.290 -5.446 7.189 1.00 2.44 H new ATOM 0 HG21 VAL A 108 -6.738 -7.535 9.025 1.00 11.14 H new ATOM 0 HG22 VAL A 108 -7.543 -6.067 8.421 1.00 11.14 H new ATOM 0 HG23 VAL A 108 -8.255 -7.667 8.104 1.00 11.14 H new ATOM 1804 N THR A 109 -8.484 -8.271 4.298 1.00 23.11 N ATOM 1805 CA THR A 109 -9.614 -9.085 3.843 1.00 42.31 C ATOM 1806 C THR A 109 -9.109 -10.299 3.045 1.00 33.54 C ATOM 1807 O THR A 109 -8.321 -10.153 2.099 1.00 42.13 O ATOM 1808 CB THR A 109 -10.647 -8.241 2.990 1.00 12.45 C ATOM 1809 OG1 THR A 109 -11.734 -9.077 2.551 1.00 10.43 O ATOM 1810 CG2 THR A 109 -10.010 -7.545 1.762 1.00 53.04 C ATOM 0 H THR A 109 -7.637 -8.399 3.745 1.00 23.11 H new ATOM 0 HA THR A 109 -10.143 -9.439 4.727 1.00 42.31 H new ATOM 0 HB THR A 109 -11.012 -7.455 3.651 1.00 12.45 H new ATOM 0 HG1 THR A 109 -12.366 -8.543 2.026 1.00 10.43 H new ATOM 0 HG21 THR A 109 -10.775 -6.985 1.224 1.00 53.04 H new ATOM 0 HG22 THR A 109 -9.228 -6.863 2.095 1.00 53.04 H new ATOM 0 HG23 THR A 109 -9.578 -8.297 1.101 1.00 53.04 H new ATOM 1818 N ASP A 110 -9.520 -11.509 3.470 1.00 65.43 N ATOM 1819 CA ASP A 110 -9.280 -12.731 2.702 1.00 62.03 C ATOM 1820 C ASP A 110 -10.387 -12.836 1.642 1.00 12.43 C ATOM 1821 O ASP A 110 -11.416 -13.499 1.821 1.00 21.11 O ATOM 1822 CB ASP A 110 -9.197 -13.981 3.639 1.00 3.13 C ATOM 1823 CG ASP A 110 -10.455 -14.255 4.489 1.00 13.40 C ATOM 1824 OD1 ASP A 110 -10.780 -13.438 5.377 1.00 5.44 O ATOM 1825 OD2 ASP A 110 -11.137 -15.284 4.272 1.00 4.31 O ATOM 0 H ASP A 110 -10.021 -11.659 4.346 1.00 65.43 H new ATOM 0 HA ASP A 110 -8.314 -12.694 2.198 1.00 62.03 H new ATOM 0 HB2 ASP A 110 -8.994 -14.860 3.027 1.00 3.13 H new ATOM 0 HB3 ASP A 110 -8.346 -13.856 4.309 1.00 3.13 H new ATOM 1830 N ASN A 111 -10.137 -12.139 0.525 1.00 61.33 N ATOM 1831 CA ASN A 111 -11.111 -11.929 -0.553 1.00 63.52 C ATOM 1832 C ASN A 111 -10.447 -11.025 -1.601 1.00 42.03 C ATOM 1833 O ASN A 111 -10.366 -9.805 -1.414 1.00 43.25 O ATOM 1834 CB ASN A 111 -12.453 -11.280 -0.022 1.00 55.41 C ATOM 1835 CG ASN A 111 -13.711 -12.075 -0.394 1.00 12.45 C ATOM 1836 OD1 ASN A 111 -14.344 -11.822 -1.422 1.00 32.43 O ATOM 1837 ND2 ASN A 111 -14.069 -13.053 0.435 1.00 25.41 N ATOM 0 H ASN A 111 -9.236 -11.698 0.343 1.00 61.33 H new ATOM 0 HA ASN A 111 -11.389 -12.889 -0.987 1.00 63.52 H new ATOM 0 HB2 ASN A 111 -12.398 -11.190 1.063 1.00 55.41 H new ATOM 0 HB3 ASN A 111 -12.541 -10.270 -0.422 1.00 55.41 H new ATOM 0 HD21 ASN A 111 -14.891 -13.621 0.229 1.00 25.41 H new ATOM 0 HD22 ASN A 111 -13.522 -13.234 1.276 1.00 25.41 H new ATOM 1844 N GLU A 112 -9.931 -11.646 -2.672 1.00 63.54 N ATOM 1845 CA GLU A 112 -9.252 -10.959 -3.786 1.00 14.41 C ATOM 1846 C GLU A 112 -10.238 -10.044 -4.553 1.00 55.33 C ATOM 1847 O GLU A 112 -9.871 -8.939 -4.972 1.00 63.43 O ATOM 1848 CB GLU A 112 -8.595 -12.045 -4.696 1.00 40.13 C ATOM 1849 CG GLU A 112 -7.815 -11.550 -5.946 1.00 40.12 C ATOM 1850 CD GLU A 112 -8.708 -11.230 -7.166 1.00 4.41 C ATOM 1851 OE1 GLU A 112 -9.471 -12.120 -7.596 1.00 3.02 O ATOM 1852 OE2 GLU A 112 -8.633 -10.112 -7.706 1.00 10.23 O ATOM 0 H GLU A 112 -9.974 -12.658 -2.792 1.00 63.54 H new ATOM 0 HA GLU A 112 -8.469 -10.299 -3.413 1.00 14.41 H new ATOM 0 HB2 GLU A 112 -7.911 -12.631 -4.082 1.00 40.13 H new ATOM 0 HB3 GLU A 112 -9.380 -12.722 -5.034 1.00 40.13 H new ATOM 0 HG2 GLU A 112 -7.252 -10.656 -5.678 1.00 40.12 H new ATOM 0 HG3 GLU A 112 -7.089 -12.311 -6.232 1.00 40.12 H new ATOM 1859 N ASP A 113 -11.491 -10.515 -4.695 1.00 11.14 N ATOM 1860 CA ASP A 113 -12.569 -9.778 -5.376 1.00 20.51 C ATOM 1861 C ASP A 113 -12.911 -8.491 -4.612 1.00 52.22 C ATOM 1862 O ASP A 113 -12.924 -7.403 -5.201 1.00 30.13 O ATOM 1863 CB ASP A 113 -13.836 -10.670 -5.505 1.00 71.33 C ATOM 1864 CG ASP A 113 -15.018 -9.929 -6.165 1.00 65.54 C ATOM 1865 OD1 ASP A 113 -15.968 -9.520 -5.455 1.00 12.12 O ATOM 1866 OD2 ASP A 113 -14.990 -9.739 -7.399 1.00 45.33 O ATOM 0 H ASP A 113 -11.785 -11.424 -4.337 1.00 11.14 H new ATOM 0 HA ASP A 113 -12.221 -9.510 -6.374 1.00 20.51 H new ATOM 0 HB2 ASP A 113 -13.594 -11.556 -6.092 1.00 71.33 H new ATOM 0 HB3 ASP A 113 -14.135 -11.015 -4.515 1.00 71.33 H new ATOM 1871 N GLU A 114 -13.159 -8.644 -3.293 1.00 33.55 N ATOM 1872 CA GLU A 114 -13.553 -7.536 -2.399 1.00 22.41 C ATOM 1873 C GLU A 114 -12.435 -6.479 -2.307 1.00 43.01 C ATOM 1874 O GLU A 114 -12.712 -5.275 -2.216 1.00 2.30 O ATOM 1875 CB GLU A 114 -13.902 -8.086 -0.990 1.00 43.42 C ATOM 1876 CG GLU A 114 -14.540 -7.064 -0.023 1.00 64.14 C ATOM 1877 CD GLU A 114 -15.863 -6.478 -0.565 1.00 4.14 C ATOM 1878 OE1 GLU A 114 -16.910 -7.160 -0.462 1.00 31.52 O ATOM 1879 OE2 GLU A 114 -15.864 -5.329 -1.071 1.00 22.20 O ATOM 0 H GLU A 114 -13.091 -9.544 -2.818 1.00 33.55 H new ATOM 0 HA GLU A 114 -14.437 -7.054 -2.816 1.00 22.41 H new ATOM 0 HB2 GLU A 114 -14.585 -8.928 -1.105 1.00 43.42 H new ATOM 0 HB3 GLU A 114 -12.991 -8.474 -0.534 1.00 43.42 H new ATOM 0 HG2 GLU A 114 -14.727 -7.545 0.937 1.00 64.14 H new ATOM 0 HG3 GLU A 114 -13.835 -6.253 0.159 1.00 64.14 H new ATOM 1886 N ALA A 115 -11.181 -6.961 -2.382 1.00 10.05 N ATOM 1887 CA ALA A 115 -9.970 -6.129 -2.343 1.00 52.03 C ATOM 1888 C ALA A 115 -9.993 -5.014 -3.398 1.00 40.25 C ATOM 1889 O ALA A 115 -9.532 -3.905 -3.140 1.00 22.42 O ATOM 1890 CB ALA A 115 -8.749 -7.017 -2.565 1.00 2.34 C ATOM 0 H ALA A 115 -10.980 -7.957 -2.473 1.00 10.05 H new ATOM 0 HA ALA A 115 -9.926 -5.649 -1.365 1.00 52.03 H new ATOM 0 HB1 ALA A 115 -7.846 -6.407 -2.538 1.00 2.34 H new ATOM 0 HB2 ALA A 115 -8.701 -7.772 -1.781 1.00 2.34 H new ATOM 0 HB3 ALA A 115 -8.827 -7.507 -3.536 1.00 2.34 H new ATOM 1896 N LYS A 116 -10.548 -5.343 -4.582 1.00 21.41 N ATOM 1897 CA LYS A 116 -10.596 -4.438 -5.746 1.00 21.11 C ATOM 1898 C LYS A 116 -11.560 -3.253 -5.505 1.00 1.42 C ATOM 1899 O LYS A 116 -11.325 -2.144 -6.008 1.00 13.30 O ATOM 1900 CB LYS A 116 -10.991 -5.250 -7.006 1.00 74.23 C ATOM 1901 CG LYS A 116 -10.086 -6.485 -7.254 1.00 34.12 C ATOM 1902 CD LYS A 116 -10.487 -7.312 -8.496 1.00 2.54 C ATOM 1903 CE LYS A 116 -10.248 -6.572 -9.825 1.00 2.20 C ATOM 1904 NZ LYS A 116 -10.456 -7.458 -11.003 1.00 42.21 N ATOM 0 H LYS A 116 -10.978 -6.251 -4.758 1.00 21.41 H new ATOM 0 HA LYS A 116 -9.608 -4.004 -5.900 1.00 21.11 H new ATOM 0 HB2 LYS A 116 -12.025 -5.581 -6.906 1.00 74.23 H new ATOM 0 HB3 LYS A 116 -10.948 -4.597 -7.878 1.00 74.23 H new ATOM 0 HG2 LYS A 116 -9.055 -6.151 -7.369 1.00 34.12 H new ATOM 0 HG3 LYS A 116 -10.117 -7.129 -6.375 1.00 34.12 H new ATOM 0 HD2 LYS A 116 -9.922 -8.244 -8.501 1.00 2.54 H new ATOM 0 HD3 LYS A 116 -11.541 -7.579 -8.421 1.00 2.54 H new ATOM 0 HE2 LYS A 116 -10.922 -5.718 -9.890 1.00 2.20 H new ATOM 0 HE3 LYS A 116 -9.232 -6.178 -9.843 1.00 2.20 H new ATOM 0 HZ1 LYS A 116 -10.754 -6.886 -11.819 1.00 42.21 H new ATOM 0 HZ2 LYS A 116 -9.567 -7.948 -11.230 1.00 42.21 H new ATOM 0 HZ3 LYS A 116 -11.192 -8.160 -10.784 1.00 42.21 H new ATOM 1918 N LYS A 117 -12.627 -3.499 -4.706 1.00 74.45 N ATOM 1919 CA LYS A 117 -13.566 -2.439 -4.279 1.00 23.35 C ATOM 1920 C LYS A 117 -12.870 -1.532 -3.247 1.00 24.21 C ATOM 1921 O LYS A 117 -12.962 -0.300 -3.317 1.00 52.34 O ATOM 1922 CB LYS A 117 -14.883 -3.010 -3.648 1.00 23.11 C ATOM 1923 CG LYS A 117 -15.808 -3.839 -4.588 1.00 52.23 C ATOM 1924 CD LYS A 117 -15.321 -5.290 -4.810 1.00 42.02 C ATOM 1925 CE LYS A 117 -16.325 -6.164 -5.587 1.00 10.13 C ATOM 1926 NZ LYS A 117 -16.550 -5.699 -6.980 1.00 4.04 N ATOM 0 H LYS A 117 -12.857 -4.425 -4.345 1.00 74.45 H new ATOM 0 HA LYS A 117 -13.847 -1.879 -5.171 1.00 23.35 H new ATOM 0 HB2 LYS A 117 -14.609 -3.638 -2.800 1.00 23.11 H new ATOM 0 HB3 LYS A 117 -15.461 -2.175 -3.253 1.00 23.11 H new ATOM 0 HG2 LYS A 117 -16.813 -3.862 -4.167 1.00 52.23 H new ATOM 0 HG3 LYS A 117 -15.877 -3.336 -5.552 1.00 52.23 H new ATOM 0 HD2 LYS A 117 -14.375 -5.268 -5.351 1.00 42.02 H new ATOM 0 HD3 LYS A 117 -15.124 -5.751 -3.842 1.00 42.02 H new ATOM 0 HE2 LYS A 117 -15.962 -7.192 -5.608 1.00 10.13 H new ATOM 0 HE3 LYS A 117 -17.277 -6.173 -5.056 1.00 10.13 H new ATOM 0 HZ1 LYS A 117 -17.234 -6.327 -7.449 1.00 4.04 H new ATOM 0 HZ2 LYS A 117 -16.924 -4.729 -6.966 1.00 4.04 H new ATOM 0 HZ3 LYS A 117 -15.650 -5.716 -7.501 1.00 4.04 H new ATOM 1940 N ARG A 118 -12.154 -2.178 -2.299 1.00 12.22 N ATOM 1941 CA ARG A 118 -11.479 -1.491 -1.174 1.00 43.23 C ATOM 1942 C ARG A 118 -10.222 -0.719 -1.643 1.00 62.34 C ATOM 1943 O ARG A 118 -9.772 0.215 -0.968 1.00 63.10 O ATOM 1944 CB ARG A 118 -11.120 -2.517 -0.058 1.00 60.11 C ATOM 1945 CG ARG A 118 -12.308 -3.422 0.372 1.00 10.42 C ATOM 1946 CD ARG A 118 -13.535 -2.635 0.888 1.00 3.23 C ATOM 1947 NE ARG A 118 -14.736 -3.485 0.974 1.00 63.34 N ATOM 1948 CZ ARG A 118 -15.882 -3.161 1.599 1.00 2.51 C ATOM 1949 NH1 ARG A 118 -16.021 -1.994 2.224 1.00 23.33 N ATOM 1950 NH2 ARG A 118 -16.906 -4.004 1.560 1.00 1.34 N ATOM 0 H ARG A 118 -12.028 -3.190 -2.292 1.00 12.22 H new ATOM 0 HA ARG A 118 -12.171 -0.755 -0.765 1.00 43.23 H new ATOM 0 HB2 ARG A 118 -10.303 -3.148 -0.408 1.00 60.11 H new ATOM 0 HB3 ARG A 118 -10.754 -1.976 0.815 1.00 60.11 H new ATOM 0 HG2 ARG A 118 -12.612 -4.035 -0.477 1.00 10.42 H new ATOM 0 HG3 ARG A 118 -11.970 -4.103 1.153 1.00 10.42 H new ATOM 0 HD2 ARG A 118 -13.313 -2.220 1.871 1.00 3.23 H new ATOM 0 HD3 ARG A 118 -13.732 -1.794 0.224 1.00 3.23 H new ATOM 0 HE ARG A 118 -14.694 -4.398 0.520 1.00 63.34 H new ATOM 0 HH11 ARG A 118 -15.250 -1.326 2.235 1.00 23.33 H new ATOM 0 HH12 ARG A 118 -16.899 -1.767 2.692 1.00 23.33 H new ATOM 0 HH21 ARG A 118 -16.820 -4.888 1.059 1.00 1.34 H new ATOM 0 HH22 ARG A 118 -17.779 -3.768 2.031 1.00 1.34 H new ATOM 1964 N LEU A 119 -9.667 -1.119 -2.801 1.00 21.15 N ATOM 1965 CA LEU A 119 -8.499 -0.457 -3.410 1.00 4.44 C ATOM 1966 C LEU A 119 -8.952 0.862 -4.055 1.00 41.44 C ATOM 1967 O LEU A 119 -8.320 1.903 -3.875 1.00 2.24 O ATOM 1968 CB LEU A 119 -7.811 -1.393 -4.464 1.00 60.41 C ATOM 1969 CG LEU A 119 -6.238 -1.385 -4.479 1.00 23.30 C ATOM 1970 CD1 LEU A 119 -5.644 0.012 -4.785 1.00 14.54 C ATOM 1971 CD2 LEU A 119 -5.677 -1.955 -3.153 1.00 64.43 C ATOM 0 H LEU A 119 -10.016 -1.911 -3.341 1.00 21.15 H new ATOM 0 HA LEU A 119 -7.761 -0.244 -2.637 1.00 4.44 H new ATOM 0 HB2 LEU A 119 -8.147 -2.415 -4.285 1.00 60.41 H new ATOM 0 HB3 LEU A 119 -8.164 -1.110 -5.456 1.00 60.41 H new ATOM 0 HG LEU A 119 -5.927 -2.033 -5.298 1.00 23.30 H new ATOM 0 HD11 LEU A 119 -4.556 -0.047 -4.782 1.00 14.54 H new ATOM 0 HD12 LEU A 119 -5.986 0.346 -5.764 1.00 14.54 H new ATOM 0 HD13 LEU A 119 -5.972 0.721 -4.025 1.00 14.54 H new ATOM 0 HD21 LEU A 119 -4.588 -1.941 -3.183 1.00 64.43 H new ATOM 0 HD22 LEU A 119 -6.025 -1.346 -2.319 1.00 64.43 H new ATOM 0 HD23 LEU A 119 -6.023 -2.980 -3.022 1.00 64.43 H new ATOM 1983 N LYS A 120 -10.072 0.788 -4.797 1.00 34.34 N ATOM 1984 CA LYS A 120 -10.696 1.952 -5.450 1.00 61.31 C ATOM 1985 C LYS A 120 -11.210 2.960 -4.397 1.00 51.24 C ATOM 1986 O LYS A 120 -11.251 4.169 -4.647 1.00 14.32 O ATOM 1987 CB LYS A 120 -11.844 1.471 -6.361 1.00 62.12 C ATOM 1988 CG LYS A 120 -12.461 2.570 -7.259 1.00 31.41 C ATOM 1989 CD LYS A 120 -13.596 2.036 -8.168 1.00 20.21 C ATOM 1990 CE LYS A 120 -13.137 0.909 -9.114 1.00 20.52 C ATOM 1991 NZ LYS A 120 -14.208 0.511 -10.065 1.00 62.41 N ATOM 0 H LYS A 120 -10.572 -0.086 -4.961 1.00 34.34 H new ATOM 0 HA LYS A 120 -9.951 2.465 -6.059 1.00 61.31 H new ATOM 0 HB2 LYS A 120 -11.473 0.667 -6.997 1.00 62.12 H new ATOM 0 HB3 LYS A 120 -12.631 1.046 -5.738 1.00 62.12 H new ATOM 0 HG2 LYS A 120 -12.852 3.370 -6.630 1.00 31.41 H new ATOM 0 HG3 LYS A 120 -11.679 3.006 -7.880 1.00 31.41 H new ATOM 0 HD2 LYS A 120 -14.410 1.668 -7.544 1.00 20.21 H new ATOM 0 HD3 LYS A 120 -13.996 2.859 -8.761 1.00 20.21 H new ATOM 0 HE2 LYS A 120 -12.260 1.238 -9.672 1.00 20.52 H new ATOM 0 HE3 LYS A 120 -12.834 0.043 -8.526 1.00 20.52 H new ATOM 0 HZ1 LYS A 120 -13.859 -0.249 -10.683 1.00 62.41 H new ATOM 0 HZ2 LYS A 120 -15.036 0.172 -9.534 1.00 62.41 H new ATOM 0 HZ3 LYS A 120 -14.480 1.331 -10.644 1.00 62.41 H new ATOM 2005 N GLU A 121 -11.592 2.423 -3.219 1.00 52.53 N ATOM 2006 CA GLU A 121 -11.914 3.216 -2.019 1.00 62.15 C ATOM 2007 C GLU A 121 -10.719 4.121 -1.644 1.00 74.10 C ATOM 2008 O GLU A 121 -10.892 5.315 -1.361 1.00 10.02 O ATOM 2009 CB GLU A 121 -12.250 2.252 -0.852 1.00 61.21 C ATOM 2010 CG GLU A 121 -12.475 2.907 0.528 1.00 74.43 C ATOM 2011 CD GLU A 121 -13.782 3.706 0.640 1.00 20.41 C ATOM 2012 OE1 GLU A 121 -13.756 4.945 0.496 1.00 0.30 O ATOM 2013 OE2 GLU A 121 -14.842 3.093 0.902 1.00 62.51 O ATOM 0 H GLU A 121 -11.686 1.418 -3.075 1.00 52.53 H new ATOM 0 HA GLU A 121 -12.775 3.854 -2.220 1.00 62.15 H new ATOM 0 HB2 GLU A 121 -13.148 1.693 -1.117 1.00 61.21 H new ATOM 0 HB3 GLU A 121 -11.440 1.529 -0.760 1.00 61.21 H new ATOM 0 HG2 GLU A 121 -12.471 2.129 1.292 1.00 74.43 H new ATOM 0 HG3 GLU A 121 -11.637 3.570 0.744 1.00 74.43 H new ATOM 2020 N LEU A 122 -9.497 3.527 -1.669 1.00 15.42 N ATOM 2021 CA LEU A 122 -8.262 4.266 -1.393 1.00 72.44 C ATOM 2022 C LEU A 122 -7.977 5.287 -2.493 1.00 53.03 C ATOM 2023 O LEU A 122 -7.516 6.347 -2.169 1.00 43.23 O ATOM 2024 CB LEU A 122 -7.017 3.353 -1.211 1.00 22.11 C ATOM 2025 CG LEU A 122 -6.984 2.450 0.059 1.00 74.54 C ATOM 2026 CD1 LEU A 122 -5.578 1.845 0.246 1.00 34.14 C ATOM 2027 CD2 LEU A 122 -7.446 3.205 1.334 1.00 55.24 C ATOM 0 H LEU A 122 -9.353 2.539 -1.878 1.00 15.42 H new ATOM 0 HA LEU A 122 -8.435 4.774 -0.444 1.00 72.44 H new ATOM 0 HB2 LEU A 122 -6.937 2.709 -2.087 1.00 22.11 H new ATOM 0 HB3 LEU A 122 -6.130 3.987 -1.200 1.00 22.11 H new ATOM 0 HG LEU A 122 -7.697 1.640 -0.095 1.00 74.54 H new ATOM 0 HD11 LEU A 122 -5.568 1.216 1.136 1.00 34.14 H new ATOM 0 HD12 LEU A 122 -5.322 1.243 -0.626 1.00 34.14 H new ATOM 0 HD13 LEU A 122 -4.849 2.647 0.360 1.00 34.14 H new ATOM 0 HD21 LEU A 122 -7.405 2.532 2.190 1.00 55.24 H new ATOM 0 HD22 LEU A 122 -6.790 4.057 1.510 1.00 55.24 H new ATOM 0 HD23 LEU A 122 -8.469 3.557 1.198 1.00 55.24 H new ATOM 2039 N LEU A 123 -8.267 4.956 -3.784 1.00 54.35 N ATOM 2040 CA LEU A 123 -7.982 5.855 -4.954 1.00 74.22 C ATOM 2041 C LEU A 123 -8.527 7.288 -4.748 1.00 2.13 C ATOM 2042 O LEU A 123 -7.895 8.271 -5.174 1.00 22.34 O ATOM 2043 CB LEU A 123 -8.532 5.248 -6.294 1.00 25.45 C ATOM 2044 CG LEU A 123 -7.501 4.470 -7.176 1.00 33.50 C ATOM 2045 CD1 LEU A 123 -6.355 5.402 -7.658 1.00 21.13 C ATOM 2046 CD2 LEU A 123 -6.944 3.227 -6.446 1.00 52.22 C ATOM 0 H LEU A 123 -8.700 4.071 -4.047 1.00 54.35 H new ATOM 0 HA LEU A 123 -6.897 5.926 -5.025 1.00 74.22 H new ATOM 0 HB2 LEU A 123 -9.354 4.574 -6.052 1.00 25.45 H new ATOM 0 HB3 LEU A 123 -8.950 6.059 -6.891 1.00 25.45 H new ATOM 0 HG LEU A 123 -8.034 4.114 -8.058 1.00 33.50 H new ATOM 0 HD11 LEU A 123 -5.655 4.832 -8.269 1.00 21.13 H new ATOM 0 HD12 LEU A 123 -6.773 6.216 -8.250 1.00 21.13 H new ATOM 0 HD13 LEU A 123 -5.832 5.813 -6.794 1.00 21.13 H new ATOM 0 HD21 LEU A 123 -6.232 2.714 -7.092 1.00 52.22 H new ATOM 0 HD22 LEU A 123 -6.444 3.538 -5.529 1.00 52.22 H new ATOM 0 HD23 LEU A 123 -7.763 2.551 -6.201 1.00 52.22 H new ATOM 2058 N GLU A 124 -9.704 7.374 -4.104 1.00 30.20 N ATOM 2059 CA GLU A 124 -10.309 8.650 -3.680 1.00 75.53 C ATOM 2060 C GLU A 124 -9.430 9.308 -2.602 1.00 14.14 C ATOM 2061 O GLU A 124 -8.981 10.438 -2.767 1.00 23.30 O ATOM 2062 CB GLU A 124 -11.739 8.402 -3.139 1.00 61.23 C ATOM 2063 CG GLU A 124 -12.686 7.751 -4.161 1.00 44.34 C ATOM 2064 CD GLU A 124 -14.070 7.441 -3.572 1.00 60.22 C ATOM 2065 OE1 GLU A 124 -14.875 8.382 -3.401 1.00 34.02 O ATOM 2066 OE2 GLU A 124 -14.366 6.256 -3.290 1.00 11.21 O ATOM 0 H GLU A 124 -10.265 6.557 -3.862 1.00 30.20 H new ATOM 0 HA GLU A 124 -10.375 9.321 -4.536 1.00 75.53 H new ATOM 0 HB2 GLU A 124 -11.678 7.765 -2.257 1.00 61.23 H new ATOM 0 HB3 GLU A 124 -12.165 9.352 -2.817 1.00 61.23 H new ATOM 0 HG2 GLU A 124 -12.801 8.415 -5.018 1.00 44.34 H new ATOM 0 HG3 GLU A 124 -12.238 6.829 -4.530 1.00 44.34 H new ATOM 2073 N LYS A 125 -9.126 8.525 -1.552 1.00 34.00 N ATOM 2074 CA LYS A 125 -8.315 8.956 -0.388 1.00 10.30 C ATOM 2075 C LYS A 125 -6.844 9.256 -0.761 1.00 64.12 C ATOM 2076 O LYS A 125 -6.128 9.886 0.017 1.00 62.12 O ATOM 2077 CB LYS A 125 -8.334 7.846 0.683 1.00 53.43 C ATOM 2078 CG LYS A 125 -9.740 7.427 1.156 1.00 52.42 C ATOM 2079 CD LYS A 125 -9.690 6.280 2.196 1.00 3.13 C ATOM 2080 CE LYS A 125 -8.820 6.632 3.421 1.00 21.11 C ATOM 2081 NZ LYS A 125 -8.805 5.555 4.428 1.00 60.44 N ATOM 0 H LYS A 125 -9.440 7.557 -1.482 1.00 34.00 H new ATOM 0 HA LYS A 125 -8.758 9.879 -0.013 1.00 10.30 H new ATOM 0 HB2 LYS A 125 -7.823 6.969 0.286 1.00 53.43 H new ATOM 0 HB3 LYS A 125 -7.761 8.184 1.547 1.00 53.43 H new ATOM 0 HG2 LYS A 125 -10.247 8.288 1.592 1.00 52.42 H new ATOM 0 HG3 LYS A 125 -10.331 7.110 0.297 1.00 52.42 H new ATOM 0 HD2 LYS A 125 -10.703 6.050 2.527 1.00 3.13 H new ATOM 0 HD3 LYS A 125 -9.297 5.380 1.722 1.00 3.13 H new ATOM 0 HE2 LYS A 125 -7.800 6.833 3.093 1.00 21.11 H new ATOM 0 HE3 LYS A 125 -9.195 7.548 3.878 1.00 21.11 H new ATOM 0 HZ1 LYS A 125 -7.977 5.670 5.046 1.00 60.44 H new ATOM 0 HZ2 LYS A 125 -9.673 5.602 4.999 1.00 60.44 H new ATOM 0 HZ3 LYS A 125 -8.755 4.633 3.949 1.00 60.44 H new ATOM 2095 N VAL A 126 -6.409 8.758 -1.928 1.00 13.01 N ATOM 2096 CA VAL A 126 -5.047 8.930 -2.425 1.00 30.12 C ATOM 2097 C VAL A 126 -4.870 10.388 -2.856 1.00 12.34 C ATOM 2098 O VAL A 126 -4.111 11.131 -2.226 1.00 23.21 O ATOM 2099 CB VAL A 126 -4.759 7.916 -3.619 1.00 4.31 C ATOM 2100 CG1 VAL A 126 -3.535 8.314 -4.458 1.00 50.23 C ATOM 2101 CG2 VAL A 126 -4.574 6.473 -3.094 1.00 3.10 C ATOM 0 H VAL A 126 -7.005 8.219 -2.556 1.00 13.01 H new ATOM 0 HA VAL A 126 -4.324 8.705 -1.641 1.00 30.12 H new ATOM 0 HB VAL A 126 -5.635 7.960 -4.266 1.00 4.31 H new ATOM 0 HG11 VAL A 126 -3.389 7.586 -5.256 1.00 50.23 H new ATOM 0 HG12 VAL A 126 -3.697 9.301 -4.892 1.00 50.23 H new ATOM 0 HG13 VAL A 126 -2.650 8.338 -3.822 1.00 50.23 H new ATOM 0 HG21 VAL A 126 -4.379 5.803 -3.932 1.00 3.10 H new ATOM 0 HG22 VAL A 126 -3.733 6.443 -2.402 1.00 3.10 H new ATOM 0 HG23 VAL A 126 -5.480 6.155 -2.578 1.00 3.10 H new