USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 788 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 GLN : amide:sc= -0.207 X(o=-0.46,f=-0.17) USER MOD Set 1.2: A 50 ASN : amide:sc= -0.255 X(o=-0.46,f=-0.17) USER MOD Set 2.1: A 26 GLN : amide:sc= -3.62! C(o=-2.7!,f=-11!) USER MOD Set 2.2: A 29 LYS NZ :NH3+ 151:sc= 0.601 (180deg=0) USER MOD Set 2.3: A 30 TYR OH : rot 180:sc= 0.296 USER MOD Set 3.1: A 10 SER OG : rot -160:sc= 1.53 USER MOD Set 3.2: A 15 SER OG : rot 89:sc= 1.19 USER MOD Set 3.3: A 84 TYR OH : rot 82:sc= 1.63 USER MOD Set 4.1: A 5 HIS : no HE2:sc= -6.52! C(o=-6.5!,f=-6.5!) USER MOD Set 4.2: A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot -140:sc= -0.212 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot -84:sc= -2.32 USER MOD Single : A 17 SER OG : rot 160:sc= -0.404 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -150:sc= -0.313 (180deg=-1.31!) USER MOD Single : A 23 MET CE :methyl -141:sc= -0.927 (180deg=-4.14) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.1 F(o=-0.84,f=-0.1) USER MOD Single : A 62 TYR OH : rot 114:sc= 0.00245 USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -4.01! C(o=-4!,f=-11!) USER MOD Single : A 73 ASN :FLIP amide:sc= -1.44! C(o=-2.9!,f=-1.4!) USER MOD Single : A 74 LYS NZ :NH3+ -109:sc= 0.617 (180deg=0.00161) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.136) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 55 N LYS A 4 6.120 9.843 6.787 1.00 0.00 N ATOM 56 CA LYS A 4 4.693 9.514 6.609 1.00 0.00 C ATOM 57 C LYS A 4 4.381 8.132 6.123 1.00 0.00 C ATOM 58 O LYS A 4 5.247 7.351 5.681 1.00 0.00 O ATOM 59 CB LYS A 4 3.929 10.613 5.892 1.00 0.00 C ATOM 60 CG LYS A 4 2.893 11.281 6.828 1.00 0.00 C ATOM 61 CD LYS A 4 3.512 12.004 8.046 1.00 0.00 C ATOM 62 CE LYS A 4 2.537 11.886 9.248 1.00 0.00 C ATOM 63 NZ LYS A 4 1.427 12.843 9.071 1.00 0.00 N ATOM 0 HA LYS A 4 4.307 9.478 7.628 1.00 0.00 H new ATOM 0 HB2 LYS A 4 4.628 11.364 5.525 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.421 10.197 5.022 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.309 11.999 6.252 1.00 0.00 H new ATOM 0 HG3 LYS A 4 2.199 10.520 7.185 1.00 0.00 H new ATOM 0 HD2 LYS A 4 4.476 11.562 8.297 1.00 0.00 H new ATOM 0 HD3 LYS A 4 3.694 13.052 7.810 1.00 0.00 H new ATOM 0 HE2 LYS A 4 2.149 10.870 9.318 1.00 0.00 H new ATOM 0 HE3 LYS A 4 3.064 12.091 10.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.771 12.767 9.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 1.807 13.810 9.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.920 12.627 8.189 1.00 0.00 H new ATOM 77 N HIS A 5 3.112 7.668 6.413 1.00 0.00 N ATOM 78 CA HIS A 5 2.654 6.300 6.167 1.00 0.00 C ATOM 79 C HIS A 5 2.534 5.918 4.696 1.00 0.00 C ATOM 80 O HIS A 5 1.929 6.640 3.886 1.00 0.00 O ATOM 81 CB HIS A 5 1.398 5.970 6.979 1.00 0.00 C ATOM 82 CG HIS A 5 1.256 6.828 8.262 1.00 0.00 C ATOM 83 ND1 HIS A 5 0.520 7.935 8.405 1.00 0.00 N ATOM 84 CD2 HIS A 5 1.990 6.642 9.378 1.00 0.00 C ATOM 85 CE1 HIS A 5 0.600 8.310 9.694 1.00 0.00 C ATOM 86 NE2 HIS A 5 1.684 7.686 10.203 1.00 0.00 N ATOM 0 H HIS A 5 2.393 8.261 6.827 1.00 0.00 H new ATOM 0 HA HIS A 5 3.456 5.658 6.532 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.519 6.118 6.352 1.00 0.00 H new ATOM 0 HB3 HIS A 5 1.419 4.916 7.255 1.00 0.00 H new ATOM 0 HD1 HIS A 5 -0.006 8.409 7.671 1.00 0.00 H new ATOM 0 HD2 HIS A 5 2.678 5.834 9.578 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -0.069 8.977 10.217 1.00 0.00 H new ATOM 94 N ILE A 6 3.030 4.704 4.380 1.00 0.00 N ATOM 95 CA ILE A 6 2.659 3.855 3.253 1.00 0.00 C ATOM 96 C ILE A 6 2.018 2.549 3.762 1.00 0.00 C ATOM 97 O ILE A 6 2.663 1.560 3.979 1.00 0.00 O ATOM 98 CB ILE A 6 3.914 3.587 2.326 1.00 0.00 C ATOM 99 CG1 ILE A 6 4.458 4.887 1.734 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.650 2.488 1.299 1.00 0.00 C ATOM 101 CD1 ILE A 6 5.784 4.810 0.996 1.00 0.00 C ATOM 0 H ILE A 6 3.752 4.269 4.954 1.00 0.00 H new ATOM 0 HA ILE A 6 1.915 4.368 2.643 1.00 0.00 H new ATOM 0 HB ILE A 6 4.716 3.192 2.950 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.711 5.284 1.047 1.00 0.00 H new ATOM 0 HG13 ILE A 6 4.563 5.609 2.543 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.540 2.341 0.687 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.406 1.559 1.815 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.815 2.779 0.661 1.00 0.00 H new ATOM 0 HD11 ILE A 6 6.053 5.800 0.628 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.558 4.452 1.675 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.693 4.122 0.155 1.00 0.00 H new ATOM 113 N TYR A 7 0.663 2.629 3.950 1.00 0.00 N ATOM 114 CA TYR A 7 -0.257 1.574 4.212 1.00 0.00 C ATOM 115 C TYR A 7 -0.779 1.003 2.833 1.00 0.00 C ATOM 116 O TYR A 7 -0.797 1.644 1.825 1.00 0.00 O ATOM 117 CB TYR A 7 -1.519 2.029 5.012 1.00 0.00 C ATOM 118 CG TYR A 7 -1.234 2.652 6.372 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.112 2.215 7.112 1.00 0.00 C ATOM 120 CD2 TYR A 7 -2.075 3.649 6.865 1.00 0.00 C ATOM 121 CE1 TYR A 7 0.176 2.801 8.341 1.00 0.00 C ATOM 122 CE2 TYR A 7 -1.864 4.149 8.152 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.727 3.715 8.884 1.00 0.00 C ATOM 124 OH TYR A 7 -0.516 4.225 10.112 1.00 0.00 O ATOM 0 H TYR A 7 0.188 3.531 3.910 1.00 0.00 H new ATOM 0 HA TYR A 7 0.283 0.838 4.808 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.072 2.749 4.409 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.170 1.166 5.154 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.520 1.429 6.725 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -2.882 4.031 6.257 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.086 2.552 8.867 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -2.556 4.856 8.585 1.00 0.00 H new ATOM 0 HH TYR A 7 -1.240 4.847 10.337 1.00 0.00 H new ATOM 134 N LEU A 8 -1.174 -0.272 2.998 1.00 0.00 N ATOM 135 CA LEU A 8 -1.520 -1.206 1.858 1.00 0.00 C ATOM 136 C LEU A 8 -2.313 -2.358 2.515 1.00 0.00 C ATOM 137 O LEU A 8 -2.027 -2.803 3.612 1.00 0.00 O ATOM 138 CB LEU A 8 -0.015 -1.705 1.566 1.00 0.00 C ATOM 139 CG LEU A 8 0.059 -2.946 0.611 1.00 0.00 C ATOM 140 CD1 LEU A 8 1.541 -3.224 0.176 1.00 0.00 C ATOM 141 CD2 LEU A 8 -0.656 -4.134 1.226 1.00 0.00 C ATOM 0 H LEU A 8 -1.269 -0.705 3.917 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.078 -0.829 1.001 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.552 -0.884 1.127 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.466 -1.955 2.512 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.476 -2.734 -0.315 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.570 -4.089 -0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.936 -2.353 -0.347 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.148 -3.423 1.059 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.594 -4.986 0.549 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.186 -4.390 2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.702 -3.881 1.396 1.00 0.00 H new ATOM 153 N PHE A 9 -3.342 -2.837 1.745 1.00 0.00 N ATOM 154 CA PHE A 9 -4.608 -3.457 2.301 1.00 0.00 C ATOM 155 C PHE A 9 -4.994 -4.622 1.375 1.00 0.00 C ATOM 156 O PHE A 9 -5.320 -4.414 0.213 1.00 0.00 O ATOM 157 CB PHE A 9 -5.653 -2.299 2.235 1.00 0.00 C ATOM 158 CG PHE A 9 -5.266 -1.039 3.009 1.00 0.00 C ATOM 159 CD1 PHE A 9 -4.762 -1.185 4.323 1.00 0.00 C ATOM 160 CD2 PHE A 9 -5.389 0.253 2.450 1.00 0.00 C ATOM 161 CE1 PHE A 9 -4.732 -0.066 5.177 1.00 0.00 C ATOM 162 CE2 PHE A 9 -5.241 1.380 3.270 1.00 0.00 C ATOM 163 CZ PHE A 9 -4.768 1.199 4.591 1.00 0.00 C ATOM 0 H PHE A 9 -3.324 -2.808 0.726 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.523 -3.851 3.314 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.812 -2.032 1.190 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.605 -2.666 2.619 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.404 -2.144 4.667 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.596 0.371 1.397 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -4.683 -0.183 6.249 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -5.483 2.366 2.901 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.429 2.055 5.155 1.00 0.00 H new ATOM 173 N SER A 10 -4.758 -5.893 1.834 1.00 0.00 N ATOM 174 CA SER A 10 -4.541 -7.048 0.973 1.00 0.00 C ATOM 175 C SER A 10 -5.104 -8.348 1.526 1.00 0.00 C ATOM 176 O SER A 10 -5.486 -8.470 2.694 1.00 0.00 O ATOM 177 CB SER A 10 -3.028 -7.176 0.704 1.00 0.00 C ATOM 178 OG SER A 10 -2.746 -7.326 -0.678 1.00 0.00 O ATOM 0 H SER A 10 -4.718 -6.120 2.828 1.00 0.00 H new ATOM 0 HA SER A 10 -5.089 -6.876 0.047 1.00 0.00 H new ATOM 0 HB2 SER A 10 -2.516 -6.292 1.085 1.00 0.00 H new ATOM 0 HB3 SER A 10 -2.634 -8.033 1.250 1.00 0.00 H new ATOM 0 HG SER A 10 -1.852 -7.711 -0.789 1.00 0.00 H new ATOM 184 N SER A 11 -5.106 -9.402 0.639 1.00 0.00 N ATOM 185 CA SER A 11 -6.048 -10.515 0.693 1.00 0.00 C ATOM 186 C SER A 11 -5.527 -11.624 1.663 1.00 0.00 C ATOM 187 O SER A 11 -6.310 -12.338 2.284 1.00 0.00 O ATOM 188 CB SER A 11 -6.156 -11.119 -0.725 1.00 0.00 C ATOM 189 OG SER A 11 -7.467 -11.697 -0.910 1.00 0.00 O ATOM 0 H SER A 11 -4.438 -9.477 -0.128 1.00 0.00 H new ATOM 0 HA SER A 11 -7.014 -10.156 1.048 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.980 -10.347 -1.474 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.389 -11.881 -0.866 1.00 0.00 H new ATOM 0 HG SER A 11 -7.386 -12.539 -1.405 1.00 0.00 H new ATOM 195 N ALA A 12 -4.180 -11.692 1.753 1.00 0.00 N ATOM 196 CA ALA A 12 -3.468 -12.676 2.586 1.00 0.00 C ATOM 197 C ALA A 12 -2.164 -12.055 3.155 1.00 0.00 C ATOM 198 O ALA A 12 -1.071 -12.291 2.671 1.00 0.00 O ATOM 199 CB ALA A 12 -3.082 -13.908 1.733 1.00 0.00 C ATOM 0 H ALA A 12 -3.558 -11.062 1.247 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.127 -12.972 3.402 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.556 -14.631 2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -3.984 -14.367 1.327 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.434 -13.595 0.914 1.00 0.00 H new ATOM 205 N GLY A 13 -2.364 -11.196 4.187 1.00 0.00 N ATOM 206 CA GLY A 13 -1.297 -10.540 4.952 1.00 0.00 C ATOM 207 C GLY A 13 0.082 -10.597 4.262 1.00 0.00 C ATOM 208 O GLY A 13 0.524 -9.644 3.620 1.00 0.00 O ATOM 0 H GLY A 13 -3.297 -10.941 4.510 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.568 -9.497 5.118 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -1.223 -11.010 5.933 1.00 0.00 H new ATOM 212 N MET A 14 0.789 -11.735 4.448 1.00 0.00 N ATOM 213 CA MET A 14 2.196 -11.969 4.132 1.00 0.00 C ATOM 214 C MET A 14 2.364 -12.374 2.642 1.00 0.00 C ATOM 215 O MET A 14 3.315 -13.011 2.262 1.00 0.00 O ATOM 216 CB MET A 14 2.853 -12.933 5.070 1.00 0.00 C ATOM 217 CG MET A 14 2.028 -13.229 6.354 1.00 0.00 C ATOM 218 SD MET A 14 1.763 -11.758 7.420 1.00 0.00 S ATOM 219 CE MET A 14 0.405 -12.358 8.427 1.00 0.00 C ATOM 0 H MET A 14 0.352 -12.564 4.851 1.00 0.00 H new ATOM 0 HA MET A 14 2.723 -11.026 4.279 1.00 0.00 H new ATOM 0 HB2 MET A 14 3.034 -13.870 4.543 1.00 0.00 H new ATOM 0 HB3 MET A 14 3.826 -12.536 5.359 1.00 0.00 H new ATOM 0 HG2 MET A 14 1.059 -13.637 6.066 1.00 0.00 H new ATOM 0 HG3 MET A 14 2.538 -13.999 6.933 1.00 0.00 H new ATOM 0 HE1 MET A 14 0.111 -11.586 9.139 1.00 0.00 H new ATOM 0 HE2 MET A 14 -0.442 -12.603 7.787 1.00 0.00 H new ATOM 0 HE3 MET A 14 0.720 -13.250 8.969 1.00 0.00 H new ATOM 229 N SER A 15 1.344 -11.961 1.836 1.00 0.00 N ATOM 230 CA SER A 15 1.533 -11.637 0.405 1.00 0.00 C ATOM 231 C SER A 15 1.770 -10.125 0.199 1.00 0.00 C ATOM 232 O SER A 15 2.021 -9.637 -0.910 1.00 0.00 O ATOM 233 CB SER A 15 0.282 -12.058 -0.353 1.00 0.00 C ATOM 234 OG SER A 15 -0.904 -11.390 0.147 1.00 0.00 O ATOM 0 H SER A 15 0.384 -11.847 2.161 1.00 0.00 H new ATOM 0 HA SER A 15 2.409 -12.169 0.035 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.406 -11.833 -1.412 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.153 -13.137 -0.270 1.00 0.00 H new ATOM 0 HG SER A 15 -1.029 -10.543 -0.331 1.00 0.00 H new ATOM 240 N THR A 16 1.717 -9.344 1.358 1.00 0.00 N ATOM 241 CA THR A 16 2.191 -8.030 1.577 1.00 0.00 C ATOM 242 C THR A 16 3.124 -7.770 2.742 1.00 0.00 C ATOM 243 O THR A 16 4.036 -6.897 2.634 1.00 0.00 O ATOM 244 CB THR A 16 1.207 -6.839 1.489 1.00 0.00 C ATOM 245 OG1 THR A 16 1.972 -5.590 1.717 1.00 0.00 O ATOM 246 CG2 THR A 16 0.029 -6.955 2.474 1.00 0.00 C ATOM 0 H THR A 16 1.287 -9.718 2.204 1.00 0.00 H new ATOM 0 HA THR A 16 2.777 -8.050 0.658 1.00 0.00 H new ATOM 0 HB THR A 16 0.755 -6.836 0.497 1.00 0.00 H new ATOM 0 HG1 THR A 16 2.060 -5.431 2.680 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.625 -6.090 2.363 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.534 -7.864 2.263 1.00 0.00 H new ATOM 0 HG23 THR A 16 0.410 -6.993 3.494 1.00 0.00 H new ATOM 254 N SER A 17 2.841 -8.375 3.901 1.00 0.00 N ATOM 255 CA SER A 17 3.587 -8.094 5.161 1.00 0.00 C ATOM 256 C SER A 17 5.079 -7.841 4.798 1.00 0.00 C ATOM 257 O SER A 17 5.769 -6.992 5.300 1.00 0.00 O ATOM 258 CB SER A 17 3.414 -9.234 6.119 1.00 0.00 C ATOM 259 OG SER A 17 4.384 -10.281 5.928 1.00 0.00 O ATOM 0 H SER A 17 2.100 -9.068 4.006 1.00 0.00 H new ATOM 0 HA SER A 17 3.199 -7.205 5.658 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.489 -8.858 7.140 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.412 -9.649 6.005 1.00 0.00 H new ATOM 0 HG SER A 17 4.443 -10.825 6.741 1.00 0.00 H new ATOM 265 N LEU A 18 5.542 -8.685 3.792 1.00 0.00 N ATOM 266 CA LEU A 18 6.914 -8.773 3.310 1.00 0.00 C ATOM 267 C LEU A 18 7.207 -7.805 2.148 1.00 0.00 C ATOM 268 O LEU A 18 8.379 -7.493 1.889 1.00 0.00 O ATOM 269 CB LEU A 18 7.096 -10.240 2.859 1.00 0.00 C ATOM 270 CG LEU A 18 8.107 -11.157 3.501 1.00 0.00 C ATOM 271 CD1 LEU A 18 7.737 -12.681 3.437 1.00 0.00 C ATOM 272 CD2 LEU A 18 9.536 -10.941 2.883 1.00 0.00 C ATOM 0 H LEU A 18 4.919 -9.328 3.304 1.00 0.00 H new ATOM 0 HA LEU A 18 7.611 -8.486 4.097 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.124 -10.723 2.963 1.00 0.00 H new ATOM 0 HB3 LEU A 18 7.327 -10.214 1.794 1.00 0.00 H new ATOM 0 HG LEU A 18 8.103 -10.880 4.555 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.519 -13.266 3.922 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.789 -12.847 3.949 1.00 0.00 H new ATOM 0 HD13 LEU A 18 7.646 -12.990 2.396 1.00 0.00 H new ATOM 0 HD21 LEU A 18 10.246 -11.614 3.364 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.505 -11.149 1.814 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.849 -9.909 3.043 1.00 0.00 H new ATOM 284 N LEU A 19 6.178 -7.312 1.445 1.00 0.00 N ATOM 285 CA LEU A 19 6.146 -6.125 0.584 1.00 0.00 C ATOM 286 C LEU A 19 6.514 -4.909 1.533 1.00 0.00 C ATOM 287 O LEU A 19 7.418 -4.209 1.328 1.00 0.00 O ATOM 288 CB LEU A 19 4.654 -5.888 0.221 1.00 0.00 C ATOM 289 CG LEU A 19 4.080 -6.540 -1.039 1.00 0.00 C ATOM 290 CD1 LEU A 19 2.551 -6.306 -1.203 1.00 0.00 C ATOM 291 CD2 LEU A 19 4.873 -6.106 -2.312 1.00 0.00 C ATOM 0 H LEU A 19 5.269 -7.775 1.467 1.00 0.00 H new ATOM 0 HA LEU A 19 6.793 -6.226 -0.288 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.053 -6.223 1.067 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.505 -4.812 0.131 1.00 0.00 H new ATOM 0 HG LEU A 19 4.206 -7.616 -0.916 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.204 -6.793 -2.115 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.025 -6.725 -0.345 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.351 -5.236 -1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.441 -6.586 -3.191 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.816 -5.023 -2.425 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.916 -6.406 -2.211 1.00 0.00 H new ATOM 303 N VAL A 20 5.609 -4.765 2.574 1.00 0.00 N ATOM 304 CA VAL A 20 5.646 -3.726 3.556 1.00 0.00 C ATOM 305 C VAL A 20 6.940 -3.768 4.411 1.00 0.00 C ATOM 306 O VAL A 20 7.368 -2.768 4.987 1.00 0.00 O ATOM 307 CB VAL A 20 4.357 -3.698 4.375 1.00 0.00 C ATOM 308 CG1 VAL A 20 4.514 -3.352 5.869 1.00 0.00 C ATOM 309 CG2 VAL A 20 3.187 -2.998 3.733 1.00 0.00 C ATOM 0 H VAL A 20 4.832 -5.412 2.712 1.00 0.00 H new ATOM 0 HA VAL A 20 5.692 -2.770 3.035 1.00 0.00 H new ATOM 0 HB VAL A 20 4.090 -4.755 4.364 1.00 0.00 H new ATOM 0 HG11 VAL A 20 3.536 -3.362 6.349 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.160 -4.088 6.347 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.957 -2.361 5.968 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.327 -3.039 4.402 1.00 0.00 H new ATOM 0 HG22 VAL A 20 3.447 -1.957 3.540 1.00 0.00 H new ATOM 0 HG23 VAL A 20 2.939 -3.491 2.793 1.00 0.00 H new ATOM 319 N SER A 21 7.529 -4.982 4.551 1.00 0.00 N ATOM 320 CA SER A 21 8.744 -5.255 5.342 1.00 0.00 C ATOM 321 C SER A 21 10.009 -5.236 4.459 1.00 0.00 C ATOM 322 O SER A 21 11.132 -5.047 4.969 1.00 0.00 O ATOM 323 CB SER A 21 8.595 -6.566 6.087 1.00 0.00 C ATOM 324 OG SER A 21 8.101 -6.349 7.434 1.00 0.00 O ATOM 0 H SER A 21 7.157 -5.819 4.102 1.00 0.00 H new ATOM 0 HA SER A 21 8.866 -4.459 6.077 1.00 0.00 H new ATOM 0 HB2 SER A 21 7.910 -7.219 5.546 1.00 0.00 H new ATOM 0 HB3 SER A 21 9.557 -7.076 6.127 1.00 0.00 H new ATOM 0 HG SER A 21 8.012 -7.211 7.893 1.00 0.00 H new ATOM 330 N LYS A 22 9.821 -5.391 3.153 1.00 0.00 N ATOM 331 CA LYS A 22 10.908 -5.336 2.118 1.00 0.00 C ATOM 332 C LYS A 22 10.981 -3.877 1.538 1.00 0.00 C ATOM 333 O LYS A 22 12.022 -3.326 1.340 1.00 0.00 O ATOM 334 CB LYS A 22 10.666 -6.327 1.016 1.00 0.00 C ATOM 335 CG LYS A 22 11.909 -6.438 0.070 1.00 0.00 C ATOM 336 CD LYS A 22 11.744 -7.494 -1.045 1.00 0.00 C ATOM 337 CE LYS A 22 11.882 -8.891 -0.479 1.00 0.00 C ATOM 338 NZ LYS A 22 13.076 -9.001 0.403 1.00 0.00 N ATOM 0 H LYS A 22 8.899 -5.563 2.752 1.00 0.00 H new ATOM 0 HA LYS A 22 11.857 -5.598 2.586 1.00 0.00 H new ATOM 0 HB2 LYS A 22 10.444 -7.304 1.445 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.792 -6.026 0.438 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.096 -5.466 -0.386 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.788 -6.685 0.666 1.00 0.00 H new ATOM 0 HD2 LYS A 22 10.768 -7.382 -1.518 1.00 0.00 H new ATOM 0 HD3 LYS A 22 12.494 -7.334 -1.819 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.985 -9.147 0.085 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.962 -9.610 -1.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.446 -9.972 0.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.810 -8.339 0.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 12.808 -8.768 1.381 1.00 0.00 H new ATOM 352 N MET A 23 9.767 -3.374 1.256 1.00 0.00 N ATOM 353 CA MET A 23 9.497 -1.894 1.073 1.00 0.00 C ATOM 354 C MET A 23 10.122 -1.094 2.235 1.00 0.00 C ATOM 355 O MET A 23 11.002 -0.257 2.066 1.00 0.00 O ATOM 356 CB MET A 23 7.979 -1.691 1.046 1.00 0.00 C ATOM 357 CG MET A 23 7.401 -1.724 -0.375 1.00 0.00 C ATOM 358 SD MET A 23 6.011 -0.481 -0.578 1.00 0.00 S ATOM 359 CE MET A 23 4.620 -1.644 -0.513 1.00 0.00 C ATOM 0 H MET A 23 8.937 -3.956 1.145 1.00 0.00 H new ATOM 0 HA MET A 23 9.940 -1.540 0.142 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.502 -2.467 1.646 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.736 -0.735 1.510 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.190 -1.510 -1.095 1.00 0.00 H new ATOM 0 HG3 MET A 23 7.031 -2.725 -0.596 1.00 0.00 H new ATOM 0 HE1 MET A 23 3.860 -1.342 -1.233 1.00 0.00 H new ATOM 0 HE2 MET A 23 4.972 -2.647 -0.756 1.00 0.00 H new ATOM 0 HE3 MET A 23 4.191 -1.643 0.489 1.00 0.00 H new ATOM 369 N ARG A 24 9.668 -1.411 3.481 1.00 0.00 N ATOM 370 CA ARG A 24 10.203 -0.859 4.744 1.00 0.00 C ATOM 371 C ARG A 24 11.735 -0.702 4.647 1.00 0.00 C ATOM 372 O ARG A 24 12.294 0.346 4.927 1.00 0.00 O ATOM 373 CB ARG A 24 9.826 -1.714 5.948 1.00 0.00 C ATOM 374 CG ARG A 24 8.728 -1.094 6.849 1.00 0.00 C ATOM 375 CD ARG A 24 7.968 -2.150 7.609 1.00 0.00 C ATOM 376 NE ARG A 24 7.042 -1.515 8.571 1.00 0.00 N ATOM 377 CZ ARG A 24 7.137 -1.485 9.896 1.00 0.00 C ATOM 378 NH1 ARG A 24 8.240 -1.959 10.545 1.00 0.00 N ATOM 379 NH2 ARG A 24 6.167 -0.934 10.670 1.00 0.00 N ATOM 0 H ARG A 24 8.905 -2.071 3.630 1.00 0.00 H new ATOM 0 HA ARG A 24 9.751 0.122 4.894 1.00 0.00 H new ATOM 0 HB2 ARG A 24 9.484 -2.687 5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.718 -1.888 6.549 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.185 -0.398 7.552 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.035 -0.518 6.235 1.00 0.00 H new ATOM 0 HD2 ARG A 24 7.409 -2.778 6.915 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.664 -2.801 8.138 1.00 0.00 H new ATOM 0 HE ARG A 24 6.232 -1.043 8.169 1.00 0.00 H new ATOM 0 HH11 ARG A 24 9.017 -2.348 10.012 1.00 0.00 H new ATOM 0 HH12 ARG A 24 8.287 -1.924 11.563 1.00 0.00 H new ATOM 0 HH21 ARG A 24 5.338 -0.529 10.236 1.00 0.00 H new ATOM 0 HH22 ARG A 24 6.268 -0.926 11.685 1.00 0.00 H new ATOM 393 N ALA A 25 12.395 -1.829 4.257 1.00 0.00 N ATOM 394 CA ALA A 25 13.767 -1.848 3.761 1.00 0.00 C ATOM 395 C ALA A 25 14.096 -0.532 2.977 1.00 0.00 C ATOM 396 O ALA A 25 14.732 0.348 3.457 1.00 0.00 O ATOM 397 CB ALA A 25 14.163 -3.053 2.940 1.00 0.00 C ATOM 0 H ALA A 25 11.966 -2.754 4.286 1.00 0.00 H new ATOM 0 HA ALA A 25 14.369 -1.919 4.667 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.203 -2.955 2.628 1.00 0.00 H new ATOM 0 HB2 ALA A 25 14.048 -3.956 3.540 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.524 -3.119 2.059 1.00 0.00 H new ATOM 403 N GLN A 26 13.569 -0.484 1.713 1.00 0.00 N ATOM 404 CA GLN A 26 13.548 0.725 0.868 1.00 0.00 C ATOM 405 C GLN A 26 13.539 1.987 1.796 1.00 0.00 C ATOM 406 O GLN A 26 14.504 2.747 1.829 1.00 0.00 O ATOM 407 CB GLN A 26 12.281 0.715 0.025 1.00 0.00 C ATOM 408 CG GLN A 26 12.179 -0.336 -1.089 1.00 0.00 C ATOM 409 CD GLN A 26 13.393 -1.280 -1.156 1.00 0.00 C ATOM 410 OE1 GLN A 26 14.481 -0.904 -1.682 1.00 0.00 O ATOM 411 NE2 GLN A 26 13.321 -2.484 -0.622 1.00 0.00 N ATOM 0 H GLN A 26 13.148 -1.296 1.262 1.00 0.00 H new ATOM 0 HA GLN A 26 14.423 0.747 0.219 1.00 0.00 H new ATOM 0 HB2 GLN A 26 11.432 0.578 0.695 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.172 1.699 -0.430 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.276 -0.928 -0.937 1.00 0.00 H new ATOM 0 HG3 GLN A 26 12.070 0.171 -2.047 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.451 -2.801 -0.194 1.00 0.00 H new ATOM 0 HE22 GLN A 26 14.135 -3.098 -0.637 1.00 0.00 H new ATOM 420 N ALA A 27 12.386 2.262 2.409 1.00 0.00 N ATOM 421 CA ALA A 27 11.924 3.554 2.919 1.00 0.00 C ATOM 422 C ALA A 27 12.838 4.133 3.986 1.00 0.00 C ATOM 423 O ALA A 27 12.994 5.347 4.141 1.00 0.00 O ATOM 424 CB ALA A 27 10.485 3.422 3.440 1.00 0.00 C ATOM 0 H ALA A 27 11.697 1.529 2.575 1.00 0.00 H new ATOM 0 HA ALA A 27 11.948 4.259 2.088 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.145 4.386 3.819 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.832 3.100 2.628 1.00 0.00 H new ATOM 0 HB3 ALA A 27 10.455 2.686 4.243 1.00 0.00 H new ATOM 430 N GLU A 28 13.452 3.234 4.755 1.00 0.00 N ATOM 431 CA GLU A 28 14.446 3.541 5.845 1.00 0.00 C ATOM 432 C GLU A 28 15.871 3.309 5.305 1.00 0.00 C ATOM 433 O GLU A 28 16.858 3.906 5.784 1.00 0.00 O ATOM 434 CB GLU A 28 14.139 2.527 7.002 1.00 0.00 C ATOM 435 CG GLU A 28 15.418 2.275 7.843 1.00 0.00 C ATOM 436 CD GLU A 28 15.208 2.051 9.326 1.00 0.00 C ATOM 437 OE1 GLU A 28 14.387 2.745 9.945 1.00 0.00 O ATOM 438 OE2 GLU A 28 15.948 1.155 9.873 1.00 0.00 O ATOM 0 H GLU A 28 13.283 2.233 4.653 1.00 0.00 H new ATOM 0 HA GLU A 28 14.375 4.572 6.191 1.00 0.00 H new ATOM 0 HB2 GLU A 28 13.347 2.920 7.639 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.777 1.587 6.586 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.931 1.405 7.434 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.085 3.127 7.716 1.00 0.00 H new ATOM 445 N LYS A 29 15.995 2.387 4.341 1.00 0.00 N ATOM 446 CA LYS A 29 17.177 2.299 3.404 1.00 0.00 C ATOM 447 C LYS A 29 17.475 3.667 2.791 1.00 0.00 C ATOM 448 O LYS A 29 18.646 4.043 2.588 1.00 0.00 O ATOM 449 CB LYS A 29 16.885 1.251 2.326 1.00 0.00 C ATOM 450 CG LYS A 29 17.782 1.430 1.103 1.00 0.00 C ATOM 451 CD LYS A 29 18.028 0.122 0.290 1.00 0.00 C ATOM 452 CE LYS A 29 16.721 -0.111 -0.537 1.00 0.00 C ATOM 453 NZ LYS A 29 17.098 -0.401 -1.935 1.00 0.00 N ATOM 0 H LYS A 29 15.290 1.670 4.170 1.00 0.00 H new ATOM 0 HA LYS A 29 18.065 1.992 3.957 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.030 0.253 2.740 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.840 1.322 2.024 1.00 0.00 H new ATOM 0 HG2 LYS A 29 17.334 2.174 0.444 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.743 1.828 1.427 1.00 0.00 H new ATOM 0 HD2 LYS A 29 18.893 0.224 -0.365 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.228 -0.720 0.953 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.150 -0.940 -0.119 1.00 0.00 H new ATOM 0 HE3 LYS A 29 16.082 0.771 -0.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 16.377 -1.012 -2.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 17.165 0.489 -2.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 18.018 -0.885 -1.953 1.00 0.00 H new ATOM 467 N TYR A 30 16.384 4.410 2.469 1.00 0.00 N ATOM 468 CA TYR A 30 16.392 5.720 1.766 1.00 0.00 C ATOM 469 C TYR A 30 16.266 6.858 2.750 1.00 0.00 C ATOM 470 O TYR A 30 17.216 7.666 3.018 1.00 0.00 O ATOM 471 CB TYR A 30 15.233 5.701 0.704 1.00 0.00 C ATOM 472 CG TYR A 30 15.321 4.499 -0.262 1.00 0.00 C ATOM 473 CD1 TYR A 30 16.599 4.150 -0.727 1.00 0.00 C ATOM 474 CD2 TYR A 30 14.204 3.742 -0.579 1.00 0.00 C ATOM 475 CE1 TYR A 30 16.720 3.136 -1.689 1.00 0.00 C ATOM 476 CE2 TYR A 30 14.293 2.723 -1.544 1.00 0.00 C ATOM 477 CZ TYR A 30 15.556 2.513 -2.149 1.00 0.00 C ATOM 478 OH TYR A 30 15.635 1.682 -3.237 1.00 0.00 O ATOM 0 H TYR A 30 15.440 4.102 2.701 1.00 0.00 H new ATOM 0 HA TYR A 30 17.339 5.880 1.251 1.00 0.00 H new ATOM 0 HB2 TYR A 30 14.274 5.675 1.221 1.00 0.00 H new ATOM 0 HB3 TYR A 30 15.260 6.626 0.128 1.00 0.00 H new ATOM 0 HD1 TYR A 30 17.476 4.655 -0.350 1.00 0.00 H new ATOM 0 HD2 TYR A 30 13.264 3.935 -0.084 1.00 0.00 H new ATOM 0 HE1 TYR A 30 17.689 2.844 -2.065 1.00 0.00 H new ATOM 0 HE2 TYR A 30 13.434 2.126 -1.812 1.00 0.00 H new ATOM 0 HH TYR A 30 14.746 1.322 -3.439 1.00 0.00 H new ATOM 488 N GLU A 31 15.050 7.012 3.321 1.00 0.00 N ATOM 489 CA GLU A 31 14.521 8.229 3.932 1.00 0.00 C ATOM 490 C GLU A 31 13.106 8.560 3.337 1.00 0.00 C ATOM 491 O GLU A 31 12.681 9.718 3.347 1.00 0.00 O ATOM 492 CB GLU A 31 15.455 9.427 3.661 1.00 0.00 C ATOM 493 CG GLU A 31 15.192 10.616 4.559 1.00 0.00 C ATOM 494 CD GLU A 31 14.892 11.930 3.820 1.00 0.00 C ATOM 495 OE1 GLU A 31 15.213 12.054 2.653 1.00 0.00 O ATOM 496 OE2 GLU A 31 14.314 12.822 4.531 1.00 0.00 O ATOM 0 H GLU A 31 14.383 6.242 3.365 1.00 0.00 H new ATOM 0 HA GLU A 31 14.448 8.059 5.006 1.00 0.00 H new ATOM 0 HB2 GLU A 31 16.489 9.107 3.790 1.00 0.00 H new ATOM 0 HB3 GLU A 31 15.344 9.736 2.622 1.00 0.00 H new ATOM 0 HG2 GLU A 31 14.350 10.382 5.210 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.060 10.767 5.201 1.00 0.00 H new ATOM 503 N VAL A 32 12.480 7.555 2.748 1.00 0.00 N ATOM 504 CA VAL A 32 10.991 7.515 2.524 1.00 0.00 C ATOM 505 C VAL A 32 10.328 7.078 3.846 1.00 0.00 C ATOM 506 O VAL A 32 9.975 5.911 4.039 1.00 0.00 O ATOM 507 CB VAL A 32 10.732 6.510 1.357 1.00 0.00 C ATOM 508 CG1 VAL A 32 9.335 6.733 0.681 1.00 0.00 C ATOM 509 CG2 VAL A 32 11.854 6.566 0.317 1.00 0.00 C ATOM 0 H VAL A 32 12.965 6.728 2.400 1.00 0.00 H new ATOM 0 HA VAL A 32 10.570 8.481 2.246 1.00 0.00 H new ATOM 0 HB VAL A 32 10.723 5.513 1.797 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.201 6.011 -0.124 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.547 6.601 1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.285 7.743 0.274 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.645 5.855 -0.482 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.915 7.572 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.802 6.311 0.790 1.00 0.00 H new ATOM 519 N PRO A 33 10.205 8.003 4.820 1.00 0.00 N ATOM 520 CA PRO A 33 10.042 7.755 6.265 1.00 0.00 C ATOM 521 C PRO A 33 8.613 7.630 6.850 1.00 0.00 C ATOM 522 O PRO A 33 7.566 7.775 6.186 1.00 0.00 O ATOM 523 CB PRO A 33 10.873 8.834 6.940 1.00 0.00 C ATOM 524 CG PRO A 33 10.949 9.972 5.942 1.00 0.00 C ATOM 525 CD PRO A 33 10.429 9.451 4.609 1.00 0.00 C ATOM 0 HA PRO A 33 10.380 6.739 6.466 1.00 0.00 H new ATOM 0 HB2 PRO A 33 10.411 9.160 7.872 1.00 0.00 H new ATOM 0 HB3 PRO A 33 11.867 8.464 7.190 1.00 0.00 H new ATOM 0 HG2 PRO A 33 10.353 10.819 6.281 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.975 10.325 5.841 1.00 0.00 H new ATOM 0 HD2 PRO A 33 9.506 9.955 4.322 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.149 9.626 3.810 1.00 0.00 H new ATOM 533 N VAL A 34 8.575 7.472 8.190 1.00 0.00 N ATOM 534 CA VAL A 34 7.519 7.047 9.038 1.00 0.00 C ATOM 535 C VAL A 34 7.442 5.476 9.024 1.00 0.00 C ATOM 536 O VAL A 34 8.156 4.805 9.721 1.00 0.00 O ATOM 537 CB VAL A 34 6.103 7.680 8.677 1.00 0.00 C ATOM 538 CG1 VAL A 34 4.980 6.845 9.460 1.00 0.00 C ATOM 539 CG2 VAL A 34 6.052 9.124 9.372 1.00 0.00 C ATOM 0 H VAL A 34 9.409 7.675 8.741 1.00 0.00 H new ATOM 0 HA VAL A 34 7.752 7.410 10.039 1.00 0.00 H new ATOM 0 HB VAL A 34 5.955 7.697 7.597 1.00 0.00 H new ATOM 0 HG11 VAL A 34 3.996 7.256 9.232 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.019 5.801 9.148 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.161 6.909 10.533 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.096 9.600 9.153 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.163 9.013 10.451 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.862 9.742 8.986 1.00 0.00 H new ATOM 549 N ILE A 35 6.481 5.007 8.185 1.00 0.00 N ATOM 550 CA ILE A 35 6.035 3.578 8.172 1.00 0.00 C ATOM 551 C ILE A 35 5.671 3.156 6.754 1.00 0.00 C ATOM 552 O ILE A 35 5.260 3.914 5.879 1.00 0.00 O ATOM 553 CB ILE A 35 4.796 3.472 9.149 1.00 0.00 C ATOM 554 CG1 ILE A 35 5.165 3.802 10.594 1.00 0.00 C ATOM 555 CG2 ILE A 35 3.989 2.196 8.942 1.00 0.00 C ATOM 556 CD1 ILE A 35 5.158 2.677 11.625 1.00 0.00 C ATOM 0 H ILE A 35 5.997 5.594 7.506 1.00 0.00 H new ATOM 0 HA ILE A 35 6.829 2.909 8.505 1.00 0.00 H new ATOM 0 HB ILE A 35 4.093 4.259 8.876 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.163 4.240 10.589 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.480 4.575 10.942 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.152 2.178 9.640 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.611 2.167 7.920 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.627 1.330 9.118 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.442 3.075 12.599 1.00 0.00 H new ATOM 0 HD12 ILE A 35 4.159 2.246 11.686 1.00 0.00 H new ATOM 0 HD13 ILE A 35 5.869 1.906 11.327 1.00 0.00 H new ATOM 568 N ILE A 36 5.768 1.813 6.513 1.00 0.00 N ATOM 569 CA ILE A 36 4.868 1.017 5.622 1.00 0.00 C ATOM 570 C ILE A 36 4.158 -0.049 6.492 1.00 0.00 C ATOM 571 O ILE A 36 4.750 -0.738 7.306 1.00 0.00 O ATOM 572 CB ILE A 36 5.746 0.374 4.488 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.855 1.363 4.052 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.873 -0.118 3.325 1.00 0.00 C ATOM 575 CD1 ILE A 36 8.043 0.794 3.308 1.00 0.00 C ATOM 0 H ILE A 36 6.493 1.241 6.945 1.00 0.00 H new ATOM 0 HA ILE A 36 4.104 1.633 5.147 1.00 0.00 H new ATOM 0 HB ILE A 36 6.247 -0.513 4.875 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.397 2.126 3.422 1.00 0.00 H new ATOM 0 HG13 ILE A 36 7.226 1.867 4.944 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.507 -0.558 2.555 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.171 -0.868 3.689 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.321 0.722 2.904 1.00 0.00 H new ATOM 0 HD11 ILE A 36 8.739 1.597 3.065 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.545 0.056 3.934 1.00 0.00 H new ATOM 0 HD13 ILE A 36 7.703 0.319 2.388 1.00 0.00 H new ATOM 587 N GLU A 37 2.801 -0.137 6.272 1.00 0.00 N ATOM 588 CA GLU A 37 1.930 -1.069 7.020 1.00 0.00 C ATOM 589 C GLU A 37 0.782 -1.616 6.134 1.00 0.00 C ATOM 590 O GLU A 37 0.102 -0.850 5.448 1.00 0.00 O ATOM 591 CB GLU A 37 1.446 -0.494 8.326 1.00 0.00 C ATOM 592 CG GLU A 37 2.519 -0.592 9.446 1.00 0.00 C ATOM 593 CD GLU A 37 2.289 -1.801 10.378 1.00 0.00 C ATOM 594 OE1 GLU A 37 1.103 -2.307 10.298 1.00 0.00 O ATOM 595 OE2 GLU A 37 3.193 -2.195 11.120 1.00 0.00 O ATOM 0 H GLU A 37 2.306 0.430 5.584 1.00 0.00 H new ATOM 0 HA GLU A 37 2.545 -1.926 7.294 1.00 0.00 H new ATOM 0 HB2 GLU A 37 1.170 0.550 8.181 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.545 -1.021 8.641 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.507 -0.669 8.993 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.509 0.325 10.036 1.00 0.00 H new ATOM 602 N ALA A 38 0.675 -2.945 6.084 1.00 0.00 N ATOM 603 CA ALA A 38 -0.466 -3.694 5.479 1.00 0.00 C ATOM 604 C ALA A 38 -1.606 -3.842 6.481 1.00 0.00 C ATOM 605 O ALA A 38 -1.343 -3.992 7.713 1.00 0.00 O ATOM 606 CB ALA A 38 0.035 -5.098 5.049 1.00 0.00 C ATOM 0 H ALA A 38 1.391 -3.561 6.469 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.840 -3.144 4.615 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.788 -5.658 4.605 1.00 0.00 H new ATOM 0 HB2 ALA A 38 0.837 -4.990 4.318 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.409 -5.634 5.921 1.00 0.00 H new ATOM 612 N PHE A 39 -2.857 -3.787 6.026 1.00 0.00 N ATOM 613 CA PHE A 39 -4.121 -3.991 6.755 1.00 0.00 C ATOM 614 C PHE A 39 -5.135 -4.780 5.940 1.00 0.00 C ATOM 615 O PHE A 39 -4.906 -4.976 4.746 1.00 0.00 O ATOM 616 CB PHE A 39 -4.635 -2.639 7.258 1.00 0.00 C ATOM 617 CG PHE A 39 -3.570 -1.728 7.911 1.00 0.00 C ATOM 618 CD1 PHE A 39 -2.613 -1.056 7.144 1.00 0.00 C ATOM 619 CD2 PHE A 39 -3.610 -1.567 9.301 1.00 0.00 C ATOM 620 CE1 PHE A 39 -1.559 -0.379 7.786 1.00 0.00 C ATOM 621 CE2 PHE A 39 -2.701 -0.718 9.942 1.00 0.00 C ATOM 622 CZ PHE A 39 -1.672 -0.146 9.192 1.00 0.00 C ATOM 0 H PHE A 39 -3.035 -3.579 5.043 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.941 -4.617 7.629 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -5.082 -2.104 6.420 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.430 -2.818 7.982 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.682 -1.056 6.066 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -4.347 -2.101 9.882 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.692 -0.046 7.234 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -2.794 -0.509 10.998 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.947 0.485 9.684 1.00 0.00 H new ATOM 632 N PRO A 40 -6.162 -5.390 6.584 1.00 0.00 N ATOM 633 CA PRO A 40 -7.165 -6.277 5.956 1.00 0.00 C ATOM 634 C PRO A 40 -8.332 -5.631 5.178 1.00 0.00 C ATOM 635 O PRO A 40 -9.468 -6.056 5.176 1.00 0.00 O ATOM 636 CB PRO A 40 -7.578 -7.275 7.008 1.00 0.00 C ATOM 637 CG PRO A 40 -7.256 -6.660 8.319 1.00 0.00 C ATOM 638 CD PRO A 40 -6.359 -5.439 8.033 1.00 0.00 C ATOM 0 HA PRO A 40 -6.683 -6.765 5.109 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.642 -7.498 6.935 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -7.045 -8.217 6.880 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.166 -6.358 8.838 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.743 -7.373 8.964 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.828 -4.522 8.391 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -5.404 -5.531 8.550 1.00 0.00 H new ATOM 646 N GLU A 41 -7.871 -4.638 4.372 1.00 0.00 N ATOM 647 CA GLU A 41 -8.691 -3.621 3.737 1.00 0.00 C ATOM 648 C GLU A 41 -10.024 -3.348 4.431 1.00 0.00 C ATOM 649 O GLU A 41 -11.078 -3.240 3.761 1.00 0.00 O ATOM 650 CB GLU A 41 -8.992 -4.056 2.241 1.00 0.00 C ATOM 651 CG GLU A 41 -10.118 -5.105 2.231 1.00 0.00 C ATOM 652 CD GLU A 41 -10.451 -5.618 0.835 1.00 0.00 C ATOM 653 OE1 GLU A 41 -10.491 -4.783 -0.114 1.00 0.00 O ATOM 654 OE2 GLU A 41 -10.695 -6.846 0.717 1.00 0.00 O ATOM 0 H GLU A 41 -6.880 -4.537 4.151 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.114 -2.698 3.796 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -9.283 -3.188 1.650 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -8.093 -4.467 1.782 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.827 -5.946 2.860 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.014 -4.671 2.674 1.00 0.00 H new ATOM 661 N THR A 42 -10.050 -3.380 5.766 1.00 0.00 N ATOM 662 CA THR A 42 -11.060 -2.829 6.705 1.00 0.00 C ATOM 663 C THR A 42 -10.567 -1.537 7.345 1.00 0.00 C ATOM 664 O THR A 42 -11.361 -0.644 7.743 1.00 0.00 O ATOM 665 CB THR A 42 -11.455 -3.812 7.826 1.00 0.00 C ATOM 666 OG1 THR A 42 -11.226 -3.271 9.140 1.00 0.00 O ATOM 667 CG2 THR A 42 -10.808 -5.196 7.614 1.00 0.00 C ATOM 0 H THR A 42 -9.294 -3.835 6.278 1.00 0.00 H new ATOM 0 HA THR A 42 -11.944 -2.639 6.096 1.00 0.00 H new ATOM 0 HB THR A 42 -12.533 -3.962 7.763 1.00 0.00 H new ATOM 0 HG1 THR A 42 -11.493 -3.929 9.816 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.107 -5.865 8.421 1.00 0.00 H new ATOM 0 HG22 THR A 42 -11.137 -5.609 6.660 1.00 0.00 H new ATOM 0 HG23 THR A 42 -9.723 -5.094 7.610 1.00 0.00 H new ATOM 675 N LEU A 43 -9.225 -1.454 7.518 1.00 0.00 N ATOM 676 CA LEU A 43 -8.489 -0.320 8.118 1.00 0.00 C ATOM 677 C LEU A 43 -7.903 0.546 6.965 1.00 0.00 C ATOM 678 O LEU A 43 -7.070 1.425 7.186 1.00 0.00 O ATOM 679 CB LEU A 43 -7.338 -0.966 8.937 1.00 0.00 C ATOM 680 CG LEU A 43 -7.747 -1.684 10.258 1.00 0.00 C ATOM 681 CD1 LEU A 43 -6.921 -2.914 10.572 1.00 0.00 C ATOM 682 CD2 LEU A 43 -7.854 -0.666 11.425 1.00 0.00 C ATOM 0 H LEU A 43 -8.602 -2.209 7.230 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.116 0.314 8.745 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.828 -1.688 8.299 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.614 -0.189 9.181 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.745 -2.095 10.108 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.267 -3.356 11.506 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.028 -3.640 9.766 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.873 -2.633 10.671 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.141 -1.188 12.338 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.890 -0.179 11.573 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.607 0.085 11.185 1.00 0.00 H new ATOM 694 N ALA A 44 -8.315 0.246 5.717 1.00 0.00 N ATOM 695 CA ALA A 44 -8.279 1.209 4.574 1.00 0.00 C ATOM 696 C ALA A 44 -9.018 2.527 4.953 1.00 0.00 C ATOM 697 O ALA A 44 -8.539 3.622 4.733 1.00 0.00 O ATOM 698 CB ALA A 44 -8.859 0.598 3.323 1.00 0.00 C ATOM 0 H ALA A 44 -8.685 -0.670 5.462 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.237 1.449 4.363 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.818 1.324 2.511 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.283 -0.286 3.049 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.896 0.314 3.504 1.00 0.00 H new ATOM 704 N GLY A 45 -10.231 2.335 5.534 1.00 0.00 N ATOM 705 CA GLY A 45 -11.032 3.443 6.137 1.00 0.00 C ATOM 706 C GLY A 45 -10.183 4.304 7.076 1.00 0.00 C ATOM 707 O GLY A 45 -10.077 5.559 6.869 1.00 0.00 O ATOM 0 H GLY A 45 -10.680 1.422 5.600 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.446 4.067 5.345 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.875 3.026 6.687 1.00 0.00 H new ATOM 711 N GLU A 46 -9.617 3.719 8.139 1.00 0.00 N ATOM 712 CA GLU A 46 -8.980 4.423 9.269 1.00 0.00 C ATOM 713 C GLU A 46 -7.470 4.620 9.015 1.00 0.00 C ATOM 714 O GLU A 46 -6.944 5.723 9.213 1.00 0.00 O ATOM 715 CB GLU A 46 -9.206 3.689 10.598 1.00 0.00 C ATOM 716 CG GLU A 46 -10.687 3.327 10.786 1.00 0.00 C ATOM 717 CD GLU A 46 -11.035 2.856 12.216 1.00 0.00 C ATOM 718 OE1 GLU A 46 -10.328 3.324 13.154 1.00 0.00 O ATOM 719 OE2 GLU A 46 -12.009 2.069 12.376 1.00 0.00 O ATOM 0 H GLU A 46 -9.587 2.705 8.244 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.452 5.402 9.345 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.601 2.783 10.624 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.874 4.317 11.425 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -11.298 4.196 10.540 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.952 2.541 10.079 1.00 0.00 H new ATOM 726 N LYS A 47 -6.789 3.514 8.688 1.00 0.00 N ATOM 727 CA LYS A 47 -5.316 3.517 8.354 1.00 0.00 C ATOM 728 C LYS A 47 -5.054 4.281 7.027 1.00 0.00 C ATOM 729 O LYS A 47 -4.227 5.198 6.989 1.00 0.00 O ATOM 730 CB LYS A 47 -4.806 2.076 8.236 1.00 0.00 C ATOM 731 CG LYS A 47 -4.332 1.533 9.594 1.00 0.00 C ATOM 732 CD LYS A 47 -4.804 2.337 10.827 1.00 0.00 C ATOM 733 CE LYS A 47 -4.735 1.479 12.088 1.00 0.00 C ATOM 734 NZ LYS A 47 -3.976 2.192 13.153 1.00 0.00 N ATOM 0 H LYS A 47 -7.217 2.589 8.641 1.00 0.00 H new ATOM 0 HA LYS A 47 -4.781 4.025 9.156 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.599 1.439 7.845 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.985 2.037 7.521 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.679 0.505 9.697 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.242 1.504 9.595 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.182 3.223 10.950 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.826 2.684 10.672 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -5.742 1.252 12.438 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.254 0.527 11.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.935 1.599 14.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.010 2.386 12.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -4.452 3.089 13.377 1.00 0.00 H new ATOM 748 N GLY A 48 -5.751 3.836 5.961 1.00 0.00 N ATOM 749 CA GLY A 48 -5.818 4.516 4.655 1.00 0.00 C ATOM 750 C GLY A 48 -6.158 5.971 4.722 1.00 0.00 C ATOM 751 O GLY A 48 -5.537 6.823 3.993 1.00 0.00 O ATOM 0 H GLY A 48 -6.295 2.973 5.987 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.857 4.405 4.154 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.560 4.012 4.036 1.00 0.00 H new ATOM 755 N GLN A 49 -7.167 6.362 5.536 1.00 0.00 N ATOM 756 CA GLN A 49 -7.471 7.753 5.919 1.00 0.00 C ATOM 757 C GLN A 49 -6.245 8.392 6.653 1.00 0.00 C ATOM 758 O GLN A 49 -5.990 9.580 6.523 1.00 0.00 O ATOM 759 CB GLN A 49 -8.674 7.765 6.836 1.00 0.00 C ATOM 760 CG GLN A 49 -8.976 9.155 7.446 1.00 0.00 C ATOM 761 CD GLN A 49 -9.302 9.063 8.942 1.00 0.00 C ATOM 762 OE1 GLN A 49 -10.323 9.464 9.489 1.00 0.00 O ATOM 763 NE2 GLN A 49 -8.333 8.438 9.695 1.00 0.00 N ATOM 0 H GLN A 49 -7.811 5.692 5.956 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.685 8.333 5.021 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.547 7.424 6.280 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.512 7.051 7.643 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -8.117 9.810 7.301 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.815 9.609 6.919 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -7.480 8.101 9.250 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -8.469 8.312 10.698 1.00 0.00 H new ATOM 772 N ASN A 50 -5.545 7.521 7.456 1.00 0.00 N ATOM 773 CA ASN A 50 -4.509 7.978 8.432 1.00 0.00 C ATOM 774 C ASN A 50 -3.115 7.777 7.811 1.00 0.00 C ATOM 775 O ASN A 50 -2.077 7.826 8.510 1.00 0.00 O ATOM 776 CB ASN A 50 -4.680 7.196 9.733 1.00 0.00 C ATOM 777 CG ASN A 50 -5.336 7.998 10.876 1.00 0.00 C ATOM 778 OD1 ASN A 50 -6.310 7.568 11.525 1.00 0.00 O ATOM 779 ND2 ASN A 50 -4.829 9.193 11.172 1.00 0.00 N ATOM 0 H ASN A 50 -5.683 6.510 7.442 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.622 9.038 8.661 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.283 6.310 9.534 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.702 6.847 10.065 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -5.237 9.748 11.924 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -4.032 9.553 10.647 1.00 0.00 H new ATOM 786 N ALA A 51 -3.091 7.457 6.491 1.00 0.00 N ATOM 787 CA ALA A 51 -1.858 7.265 5.705 1.00 0.00 C ATOM 788 C ALA A 51 -1.536 8.622 4.983 1.00 0.00 C ATOM 789 O ALA A 51 -2.371 9.517 4.928 1.00 0.00 O ATOM 790 CB ALA A 51 -2.061 6.181 4.635 1.00 0.00 C ATOM 0 H ALA A 51 -3.941 7.325 5.942 1.00 0.00 H new ATOM 0 HA ALA A 51 -1.048 6.958 6.367 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.140 6.054 4.066 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.322 5.239 5.117 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -2.865 6.480 3.962 1.00 0.00 H new ATOM 796 N ASP A 52 -0.297 8.728 4.509 1.00 0.00 N ATOM 797 CA ASP A 52 0.157 9.640 3.394 1.00 0.00 C ATOM 798 C ASP A 52 -0.436 9.123 2.048 1.00 0.00 C ATOM 799 O ASP A 52 -0.896 9.850 1.211 1.00 0.00 O ATOM 800 CB ASP A 52 1.690 9.555 3.312 1.00 0.00 C ATOM 801 CG ASP A 52 2.399 10.879 2.955 1.00 0.00 C ATOM 802 OD1 ASP A 52 1.688 11.811 2.440 1.00 0.00 O ATOM 803 OD2 ASP A 52 3.635 10.986 3.226 1.00 0.00 O ATOM 0 H ASP A 52 0.469 8.171 4.887 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.170 10.663 3.578 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.071 9.203 4.271 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.958 8.805 2.568 1.00 0.00 H new ATOM 808 N VAL A 53 -0.150 7.800 1.810 1.00 0.00 N ATOM 809 CA VAL A 53 -0.473 7.081 0.550 1.00 0.00 C ATOM 810 C VAL A 53 -0.700 5.565 0.913 1.00 0.00 C ATOM 811 O VAL A 53 -0.230 5.061 1.926 1.00 0.00 O ATOM 812 CB VAL A 53 0.641 7.297 -0.447 1.00 0.00 C ATOM 813 CG1 VAL A 53 0.775 6.370 -1.626 1.00 0.00 C ATOM 814 CG2 VAL A 53 0.910 8.781 -0.785 1.00 0.00 C ATOM 0 H VAL A 53 0.314 7.208 2.499 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.382 7.457 0.081 1.00 0.00 H new ATOM 0 HB VAL A 53 1.477 6.942 0.155 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.627 6.675 -2.234 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.928 5.351 -1.272 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.133 6.413 -2.227 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.724 8.848 -1.507 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.010 9.226 -1.210 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.186 9.317 0.123 1.00 0.00 H new ATOM 824 N VAL A 54 -1.541 4.934 0.075 1.00 0.00 N ATOM 825 CA VAL A 54 -2.205 3.642 0.367 1.00 0.00 C ATOM 826 C VAL A 54 -1.989 2.674 -0.814 1.00 0.00 C ATOM 827 O VAL A 54 -1.589 3.019 -1.910 1.00 0.00 O ATOM 828 CB VAL A 54 -3.698 3.918 0.707 1.00 0.00 C ATOM 829 CG1 VAL A 54 -4.150 5.374 0.498 1.00 0.00 C ATOM 830 CG2 VAL A 54 -4.630 2.855 0.189 1.00 0.00 C ATOM 0 H VAL A 54 -1.786 5.310 -0.841 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.771 3.149 1.237 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.771 3.821 1.790 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.204 5.469 0.761 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.557 6.034 1.132 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.010 5.652 -0.547 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.655 3.107 0.459 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.545 2.794 -0.896 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.365 1.893 0.628 1.00 0.00 H new ATOM 840 N LEU A 55 -2.195 1.355 -0.490 1.00 0.00 N ATOM 841 CA LEU A 55 -2.141 0.238 -1.481 1.00 0.00 C ATOM 842 C LEU A 55 -3.206 -0.759 -1.087 1.00 0.00 C ATOM 843 O LEU A 55 -3.460 -0.953 0.085 1.00 0.00 O ATOM 844 CB LEU A 55 -0.694 -0.296 -1.319 1.00 0.00 C ATOM 845 CG LEU A 55 0.464 0.598 -1.828 1.00 0.00 C ATOM 846 CD1 LEU A 55 1.589 0.875 -0.817 1.00 0.00 C ATOM 847 CD2 LEU A 55 1.000 0.141 -3.191 1.00 0.00 C ATOM 0 H LEU A 55 -2.401 1.044 0.459 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.335 0.498 -2.522 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.526 -0.493 -0.260 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.630 -1.254 -1.835 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.004 1.573 -1.965 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.345 1.510 -1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.177 1.379 0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.044 -0.067 -0.511 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.810 0.800 -3.503 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.373 -0.880 -3.111 1.00 0.00 H new ATOM 0 HD23 LEU A 55 0.198 0.178 -3.928 1.00 0.00 H new ATOM 859 N LEU A 56 -3.945 -1.315 -2.095 1.00 0.00 N ATOM 860 CA LEU A 56 -4.989 -2.320 -1.921 1.00 0.00 C ATOM 861 C LEU A 56 -4.633 -3.535 -2.833 1.00 0.00 C ATOM 862 O LEU A 56 -4.364 -3.349 -4.032 1.00 0.00 O ATOM 863 CB LEU A 56 -6.308 -1.702 -2.405 1.00 0.00 C ATOM 864 CG LEU A 56 -7.460 -1.529 -1.369 1.00 0.00 C ATOM 865 CD1 LEU A 56 -7.630 -2.735 -0.441 1.00 0.00 C ATOM 866 CD2 LEU A 56 -7.202 -0.221 -0.556 1.00 0.00 C ATOM 0 H LEU A 56 -3.810 -1.054 -3.072 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.075 -2.639 -0.882 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.083 -0.720 -2.821 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.684 -2.317 -3.223 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.400 -1.457 -1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.448 -2.547 0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.854 -3.622 -1.034 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.709 -2.896 0.119 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.999 -0.084 0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.245 -0.297 -0.039 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.181 0.631 -1.235 1.00 0.00 H new ATOM 878 N GLY A 57 -4.545 -4.727 -2.263 1.00 0.00 N ATOM 879 CA GLY A 57 -4.117 -5.991 -2.918 1.00 0.00 C ATOM 880 C GLY A 57 -4.838 -6.204 -4.252 1.00 0.00 C ATOM 881 O GLY A 57 -5.864 -5.545 -4.552 1.00 0.00 O ATOM 0 H GLY A 57 -4.779 -4.865 -1.280 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.040 -5.969 -3.085 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.320 -6.832 -2.255 1.00 0.00 H new ATOM 885 N PRO A 58 -4.297 -7.114 -5.078 1.00 0.00 N ATOM 886 CA PRO A 58 -4.808 -7.574 -6.364 1.00 0.00 C ATOM 887 C PRO A 58 -5.745 -8.795 -6.467 1.00 0.00 C ATOM 888 O PRO A 58 -6.241 -9.167 -7.541 1.00 0.00 O ATOM 889 CB PRO A 58 -3.559 -7.713 -7.266 1.00 0.00 C ATOM 890 CG PRO A 58 -2.549 -8.280 -6.279 1.00 0.00 C ATOM 891 CD PRO A 58 -2.919 -7.658 -4.908 1.00 0.00 C ATOM 0 HA PRO A 58 -5.537 -6.824 -6.671 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.732 -8.382 -8.109 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -3.240 -6.756 -7.679 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -2.602 -9.368 -6.244 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.530 -8.020 -6.566 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.887 -8.406 -4.116 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.217 -6.871 -4.632 1.00 0.00 H new ATOM 899 N GLN A 59 -6.074 -9.294 -5.255 1.00 0.00 N ATOM 900 CA GLN A 59 -7.132 -10.303 -5.029 1.00 0.00 C ATOM 901 C GLN A 59 -8.346 -9.643 -4.298 1.00 0.00 C ATOM 902 O GLN A 59 -9.452 -10.185 -4.292 1.00 0.00 O ATOM 903 CB GLN A 59 -6.516 -11.394 -4.153 1.00 0.00 C ATOM 904 CG GLN A 59 -4.957 -11.550 -4.342 1.00 0.00 C ATOM 905 CD GLN A 59 -4.436 -12.889 -3.825 1.00 0.00 C ATOM 906 OE1 GLN A 59 -3.890 -12.873 -2.552 1.00 0.00 O flip ATOM 907 NE2 GLN A 59 -4.432 -13.956 -4.432 1.00 0.00 N flip ATOM 0 H GLN A 59 -5.607 -9.004 -4.396 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.494 -10.717 -5.970 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.726 -11.171 -3.107 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -6.998 -12.345 -4.379 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -4.711 -11.452 -5.399 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -4.448 -10.740 -3.820 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -4.825 -14.010 -5.372 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -4.036 -14.789 -3.996 1.00 0.00 H new ATOM 916 N ILE A 60 -8.062 -8.489 -3.659 1.00 0.00 N ATOM 917 CA ILE A 60 -9.007 -7.704 -2.809 1.00 0.00 C ATOM 918 C ILE A 60 -9.642 -6.596 -3.645 1.00 0.00 C ATOM 919 O ILE A 60 -10.420 -5.752 -3.160 1.00 0.00 O ATOM 920 CB ILE A 60 -8.320 -7.183 -1.534 1.00 0.00 C ATOM 921 CG1 ILE A 60 -7.227 -6.117 -1.863 1.00 0.00 C ATOM 922 CG2 ILE A 60 -7.854 -8.236 -0.545 1.00 0.00 C ATOM 923 CD1 ILE A 60 -7.728 -4.863 -2.581 1.00 0.00 C ATOM 0 H ILE A 60 -7.140 -8.056 -3.717 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.808 -8.356 -2.460 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.118 -6.685 -0.983 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.747 -5.815 -0.932 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.460 -6.586 -2.480 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.386 -7.750 0.311 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -8.709 -8.822 -0.207 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.131 -8.894 -1.028 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.891 -4.189 -2.762 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.180 -5.144 -3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -8.471 -4.361 -1.961 1.00 0.00 H new ATOM 935 N ALA A 61 -9.306 -6.566 -4.965 1.00 0.00 N ATOM 936 CA ALA A 61 -9.651 -5.528 -5.938 1.00 0.00 C ATOM 937 C ALA A 61 -11.060 -4.962 -5.682 1.00 0.00 C ATOM 938 O ALA A 61 -11.301 -3.768 -5.699 1.00 0.00 O ATOM 939 CB ALA A 61 -9.533 -6.064 -7.377 1.00 0.00 C ATOM 0 H ALA A 61 -8.756 -7.314 -5.387 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.938 -4.713 -5.816 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.794 -5.275 -8.082 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.509 -6.390 -7.561 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.212 -6.907 -7.508 1.00 0.00 H new ATOM 945 N TYR A 62 -12.030 -5.902 -5.514 1.00 0.00 N ATOM 946 CA TYR A 62 -13.490 -5.686 -5.628 1.00 0.00 C ATOM 947 C TYR A 62 -13.895 -4.421 -4.851 1.00 0.00 C ATOM 948 O TYR A 62 -14.810 -3.691 -5.184 1.00 0.00 O ATOM 949 CB TYR A 62 -14.244 -6.947 -5.093 1.00 0.00 C ATOM 950 CG TYR A 62 -14.075 -7.172 -3.577 1.00 0.00 C ATOM 951 CD1 TYR A 62 -12.851 -7.597 -3.027 1.00 0.00 C ATOM 952 CD2 TYR A 62 -15.213 -6.951 -2.791 1.00 0.00 C ATOM 953 CE1 TYR A 62 -12.750 -7.668 -1.631 1.00 0.00 C ATOM 954 CE2 TYR A 62 -15.177 -7.332 -1.444 1.00 0.00 C ATOM 955 CZ TYR A 62 -13.940 -7.675 -0.872 1.00 0.00 C ATOM 956 OH TYR A 62 -13.885 -8.015 0.437 1.00 0.00 O ATOM 0 H TYR A 62 -11.801 -6.869 -5.286 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.762 -5.539 -6.673 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.305 -6.849 -5.321 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.884 -7.828 -5.625 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -12.017 -7.860 -3.660 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.097 -6.497 -3.214 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -11.785 -7.716 -1.148 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.082 -7.362 -0.856 1.00 0.00 H new ATOM 0 HH TYR A 62 -14.117 -7.238 0.987 1.00 0.00 H new ATOM 966 N MET A 63 -13.157 -4.206 -3.716 1.00 0.00 N ATOM 967 CA MET A 63 -13.404 -3.197 -2.709 1.00 0.00 C ATOM 968 C MET A 63 -12.990 -1.799 -3.140 1.00 0.00 C ATOM 969 O MET A 63 -13.396 -0.788 -2.585 1.00 0.00 O ATOM 970 CB MET A 63 -12.709 -3.614 -1.393 1.00 0.00 C ATOM 971 CG MET A 63 -13.345 -4.930 -0.864 1.00 0.00 C ATOM 972 SD MET A 63 -14.815 -4.657 0.232 1.00 0.00 S ATOM 973 CE MET A 63 -13.902 -4.348 1.778 1.00 0.00 C ATOM 0 H MET A 63 -12.340 -4.776 -3.496 1.00 0.00 H new ATOM 0 HA MET A 63 -14.481 -3.139 -2.554 1.00 0.00 H new ATOM 0 HB2 MET A 63 -11.642 -3.756 -1.562 1.00 0.00 H new ATOM 0 HB3 MET A 63 -12.811 -2.824 -0.649 1.00 0.00 H new ATOM 0 HG2 MET A 63 -13.644 -5.545 -1.712 1.00 0.00 H new ATOM 0 HG3 MET A 63 -12.591 -5.492 -0.313 1.00 0.00 H new ATOM 0 HE1 MET A 63 -14.608 -4.156 2.586 1.00 0.00 H new ATOM 0 HE2 MET A 63 -13.297 -5.221 2.024 1.00 0.00 H new ATOM 0 HE3 MET A 63 -13.253 -3.482 1.650 1.00 0.00 H new ATOM 983 N LEU A 64 -12.059 -1.731 -4.153 1.00 0.00 N ATOM 984 CA LEU A 64 -11.442 -0.516 -4.705 1.00 0.00 C ATOM 985 C LEU A 64 -12.440 0.620 -4.823 1.00 0.00 C ATOM 986 O LEU A 64 -12.094 1.783 -4.502 1.00 0.00 O ATOM 987 CB LEU A 64 -10.924 -0.936 -6.104 1.00 0.00 C ATOM 988 CG LEU A 64 -9.463 -0.642 -6.477 1.00 0.00 C ATOM 989 CD1 LEU A 64 -9.178 -0.703 -8.014 1.00 0.00 C ATOM 990 CD2 LEU A 64 -8.924 0.645 -5.831 1.00 0.00 C ATOM 0 H LEU A 64 -11.717 -2.574 -4.614 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.647 -0.144 -4.058 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.079 -2.010 -6.203 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.557 -0.453 -6.848 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.895 -1.465 -6.043 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.126 -0.484 -8.198 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.412 -1.700 -8.388 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.797 0.032 -8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.888 0.797 -6.133 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.525 1.494 -6.156 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.977 0.557 -4.746 1.00 0.00 H new ATOM 1002 N PRO A 65 -13.658 0.356 -5.322 1.00 0.00 N ATOM 1003 CA PRO A 65 -14.754 1.353 -5.529 1.00 0.00 C ATOM 1004 C PRO A 65 -15.492 1.871 -4.238 1.00 0.00 C ATOM 1005 O PRO A 65 -15.676 3.042 -4.063 1.00 0.00 O ATOM 1006 CB PRO A 65 -15.664 0.798 -6.559 1.00 0.00 C ATOM 1007 CG PRO A 65 -15.246 -0.590 -6.865 1.00 0.00 C ATOM 1008 CD PRO A 65 -14.041 -0.912 -5.961 1.00 0.00 C ATOM 0 HA PRO A 65 -14.298 2.281 -5.872 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -16.693 0.812 -6.201 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -15.632 1.410 -7.461 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -16.063 -1.288 -6.680 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -14.975 -0.687 -7.916 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -14.304 -1.661 -5.214 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -13.215 -1.320 -6.544 1.00 0.00 H new ATOM 1016 N GLU A 66 -15.622 0.888 -3.325 1.00 0.00 N ATOM 1017 CA GLU A 66 -16.030 1.107 -1.913 1.00 0.00 C ATOM 1018 C GLU A 66 -14.902 1.888 -1.146 1.00 0.00 C ATOM 1019 O GLU A 66 -15.155 2.832 -0.455 1.00 0.00 O ATOM 1020 CB GLU A 66 -16.207 -0.292 -1.228 1.00 0.00 C ATOM 1021 CG GLU A 66 -16.916 -0.152 0.126 1.00 0.00 C ATOM 1022 CD GLU A 66 -16.344 -1.002 1.261 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -16.174 -2.222 1.089 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -16.101 -0.382 2.369 1.00 0.00 O ATOM 0 H GLU A 66 -15.446 -0.092 -3.544 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.957 1.679 -1.886 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.783 -0.950 -1.879 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.232 -0.758 -1.086 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.882 0.895 0.427 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -17.966 -0.412 -0.005 1.00 0.00 H new ATOM 1031 N ILE A 67 -13.667 1.363 -1.294 1.00 0.00 N ATOM 1032 CA ILE A 67 -12.408 1.901 -0.774 1.00 0.00 C ATOM 1033 C ILE A 67 -12.256 3.390 -1.111 1.00 0.00 C ATOM 1034 O ILE A 67 -12.003 4.233 -0.237 1.00 0.00 O ATOM 1035 CB ILE A 67 -11.183 1.047 -1.264 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -11.316 -0.397 -0.739 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.836 1.694 -1.017 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -10.785 -0.701 0.647 1.00 0.00 C ATOM 0 H ILE A 67 -13.522 0.497 -1.814 1.00 0.00 H new ATOM 0 HA ILE A 67 -12.431 1.828 0.313 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.215 1.001 -2.353 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -12.373 -0.663 -0.758 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -10.809 -1.057 -1.443 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -9.045 1.040 -1.384 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -9.789 2.649 -1.541 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.702 1.860 0.052 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.949 -1.754 0.877 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.717 -0.484 0.683 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.306 -0.084 1.380 1.00 0.00 H new ATOM 1050 N GLN A 68 -12.393 3.686 -2.429 1.00 0.00 N ATOM 1051 CA GLN A 68 -12.138 5.024 -3.016 1.00 0.00 C ATOM 1052 C GLN A 68 -13.305 5.966 -2.639 1.00 0.00 C ATOM 1053 O GLN A 68 -13.182 7.187 -2.625 1.00 0.00 O ATOM 1054 CB GLN A 68 -11.982 4.877 -4.496 1.00 0.00 C ATOM 1055 CG GLN A 68 -10.671 4.190 -4.973 1.00 0.00 C ATOM 1056 CD GLN A 68 -9.444 4.600 -4.146 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -8.644 3.797 -3.643 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -9.201 5.909 -3.967 1.00 0.00 N ATOM 0 H GLN A 68 -12.686 2.995 -3.119 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.219 5.461 -2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -12.829 4.306 -4.877 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.036 5.867 -4.948 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -10.794 3.108 -4.919 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.497 4.439 -6.020 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.833 6.604 -4.364 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.384 6.208 -3.434 1.00 0.00 H new ATOM 1067 N ARG A 69 -14.477 5.334 -2.356 1.00 0.00 N ATOM 1068 CA ARG A 69 -15.723 6.013 -1.966 1.00 0.00 C ATOM 1069 C ARG A 69 -15.773 6.260 -0.450 1.00 0.00 C ATOM 1070 O ARG A 69 -16.735 6.791 0.091 1.00 0.00 O ATOM 1071 CB ARG A 69 -16.947 5.289 -2.483 1.00 0.00 C ATOM 1072 CG ARG A 69 -17.532 4.235 -1.546 1.00 0.00 C ATOM 1073 CD ARG A 69 -18.880 4.675 -0.914 1.00 0.00 C ATOM 1074 NE ARG A 69 -19.918 3.681 -1.247 1.00 0.00 N ATOM 1075 CZ ARG A 69 -21.195 3.930 -1.640 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -21.696 5.181 -1.687 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -21.973 2.916 -2.114 1.00 0.00 N ATOM 0 H ARG A 69 -14.573 4.319 -2.396 1.00 0.00 H new ATOM 0 HA ARG A 69 -15.730 6.993 -2.444 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -17.720 6.027 -2.699 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -16.692 4.809 -3.428 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -17.680 3.307 -2.098 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -16.816 4.023 -0.752 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -18.777 4.763 0.168 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -19.167 5.658 -1.288 1.00 0.00 H new ATOM 0 HE ARG A 69 -19.648 2.700 -1.174 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -21.112 5.974 -1.423 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -22.659 5.334 -1.987 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -21.597 1.970 -2.174 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -22.931 3.103 -2.409 1.00 0.00 H new ATOM 1091 N LEU A 70 -14.699 5.783 0.237 1.00 0.00 N ATOM 1092 CA LEU A 70 -14.275 6.196 1.589 1.00 0.00 C ATOM 1093 C LEU A 70 -13.142 7.235 1.468 1.00 0.00 C ATOM 1094 O LEU A 70 -13.331 8.400 1.826 1.00 0.00 O ATOM 1095 CB LEU A 70 -13.761 4.915 2.277 1.00 0.00 C ATOM 1096 CG LEU A 70 -14.696 4.143 3.236 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -16.204 4.376 3.022 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -14.298 2.662 3.339 1.00 0.00 C ATOM 0 H LEU A 70 -14.085 5.071 -0.159 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.086 6.650 2.159 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -13.453 4.223 1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -12.865 5.181 2.837 1.00 0.00 H new ATOM 0 HG LEU A 70 -14.533 4.587 4.218 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -16.769 3.789 3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -16.431 5.434 3.156 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -16.480 4.071 2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -14.976 2.150 4.021 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -14.357 2.200 2.354 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -13.278 2.585 3.715 1.00 0.00 H new ATOM 1110 N LEU A 71 -11.929 6.807 1.094 1.00 0.00 N ATOM 1111 CA LEU A 71 -10.775 7.632 0.637 1.00 0.00 C ATOM 1112 C LEU A 71 -10.891 7.881 -0.877 1.00 0.00 C ATOM 1113 O LEU A 71 -10.430 7.082 -1.678 1.00 0.00 O ATOM 1114 CB LEU A 71 -9.539 6.715 0.921 1.00 0.00 C ATOM 1115 CG LEU A 71 -9.265 6.220 2.325 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -10.507 5.999 3.239 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -8.345 4.959 2.328 1.00 0.00 C ATOM 0 H LEU A 71 -11.701 5.813 1.099 1.00 0.00 H new ATOM 0 HA LEU A 71 -10.716 8.603 1.129 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.634 5.837 0.282 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.652 7.256 0.590 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.741 7.059 2.782 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.181 5.645 4.217 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.045 6.940 3.355 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.165 5.258 2.786 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -8.173 4.636 3.355 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.827 4.156 1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.391 5.203 1.860 1.00 0.00 H new ATOM 1129 N PRO A 72 -11.608 8.979 -1.258 1.00 0.00 N ATOM 1130 CA PRO A 72 -11.594 9.578 -2.599 1.00 0.00 C ATOM 1131 C PRO A 72 -10.513 10.651 -2.919 1.00 0.00 C ATOM 1132 O PRO A 72 -10.158 10.896 -4.043 1.00 0.00 O ATOM 1133 CB PRO A 72 -13.019 10.128 -2.786 1.00 0.00 C ATOM 1134 CG PRO A 72 -13.284 10.697 -1.360 1.00 0.00 C ATOM 1135 CD PRO A 72 -12.675 9.588 -0.436 1.00 0.00 C ATOM 0 HA PRO A 72 -11.302 8.804 -3.309 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.070 10.897 -3.557 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -13.732 9.351 -3.063 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -12.799 11.661 -1.211 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.348 10.843 -1.172 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -12.275 10.012 0.485 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.426 8.852 -0.149 1.00 0.00 H new ATOM 1143 N ASN A 73 -9.933 11.150 -1.790 1.00 0.00 N ATOM 1144 CA ASN A 73 -8.884 12.195 -1.777 1.00 0.00 C ATOM 1145 C ASN A 73 -7.659 11.722 -0.986 1.00 0.00 C ATOM 1146 O ASN A 73 -6.945 12.523 -0.381 1.00 0.00 O ATOM 1147 CB ASN A 73 -9.474 13.498 -1.165 1.00 0.00 C ATOM 1148 CG ASN A 73 -10.335 13.217 0.083 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -11.679 13.158 -0.131 1.00 0.00 O flip ATOM 1150 ND2 ASN A 73 -9.873 13.077 1.215 1.00 0.00 N flip ATOM 0 H ASN A 73 -10.189 10.830 -0.856 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.557 12.395 -2.797 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -8.661 14.173 -0.899 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -10.079 14.008 -1.915 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -8.865 13.123 1.364 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -10.498 12.915 2.005 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.472 10.381 -0.940 1.00 0.00 N ATOM 1158 CA LYS A 74 -6.236 9.756 -0.389 1.00 0.00 C ATOM 1159 C LYS A 74 -5.577 8.823 -1.390 1.00 0.00 C ATOM 1160 O LYS A 74 -6.274 8.091 -2.131 1.00 0.00 O ATOM 1161 CB LYS A 74 -6.604 8.975 0.911 1.00 0.00 C ATOM 1162 CG LYS A 74 -5.770 9.493 2.080 1.00 0.00 C ATOM 1163 CD LYS A 74 -6.245 10.802 2.704 1.00 0.00 C ATOM 1164 CE LYS A 74 -5.785 10.872 4.180 1.00 0.00 C ATOM 1165 NZ LYS A 74 -4.486 11.551 4.286 1.00 0.00 N ATOM 0 H LYS A 74 -8.160 9.707 -1.277 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.519 10.546 -0.167 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.665 9.094 1.129 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -6.425 7.909 0.769 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.751 8.728 2.856 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.743 9.626 1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -5.843 11.649 2.147 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -7.331 10.870 2.648 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -6.529 11.404 4.773 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -5.710 9.865 4.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.751 10.858 4.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.252 11.997 3.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -4.535 12.280 5.026 1.00 0.00 H new ATOM 1179 N PRO A 75 -4.239 8.915 -1.500 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.394 8.150 -2.421 1.00 0.00 C ATOM 1181 C PRO A 75 -3.459 6.598 -2.445 1.00 0.00 C ATOM 1182 O PRO A 75 -2.472 5.878 -2.587 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.010 8.712 -2.345 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.010 9.801 -1.330 1.00 0.00 C ATOM 1185 CD PRO A 75 -3.435 10.001 -0.877 1.00 0.00 C ATOM 0 HA PRO A 75 -3.847 8.299 -3.401 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.298 7.934 -2.069 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.701 9.097 -3.317 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.373 9.538 -0.486 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.611 10.721 -1.756 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.505 9.959 0.210 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.804 10.980 -1.183 1.00 0.00 H new ATOM 1193 N VAL A 76 -4.743 6.139 -2.472 1.00 0.00 N ATOM 1194 CA VAL A 76 -5.153 4.725 -2.389 1.00 0.00 C ATOM 1195 C VAL A 76 -5.071 4.062 -3.759 1.00 0.00 C ATOM 1196 O VAL A 76 -5.617 4.555 -4.758 1.00 0.00 O ATOM 1197 CB VAL A 76 -6.572 4.659 -1.763 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -7.023 3.258 -1.387 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -6.741 5.660 -0.594 1.00 0.00 C ATOM 0 H VAL A 76 -5.539 6.771 -2.555 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.475 4.164 -1.746 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.248 4.969 -2.560 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.024 3.301 -0.957 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.037 2.629 -2.277 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.332 2.837 -0.657 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.749 5.578 -0.188 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.015 5.433 0.187 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -6.578 6.675 -0.957 1.00 0.00 H new ATOM 1209 N GLU A 77 -4.306 2.957 -3.857 1.00 0.00 N ATOM 1210 CA GLU A 77 -3.991 2.266 -5.113 1.00 0.00 C ATOM 1211 C GLU A 77 -3.732 0.743 -4.856 1.00 0.00 C ATOM 1212 O GLU A 77 -3.237 0.347 -3.838 1.00 0.00 O ATOM 1213 CB GLU A 77 -2.708 2.889 -5.721 1.00 0.00 C ATOM 1214 CG GLU A 77 -3.053 3.973 -6.762 1.00 0.00 C ATOM 1215 CD GLU A 77 -3.627 3.451 -8.072 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -2.899 2.708 -8.793 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -4.793 3.870 -8.367 1.00 0.00 O ATOM 0 H GLU A 77 -3.882 2.513 -3.042 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.835 2.374 -5.794 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -2.101 3.324 -4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -2.109 2.109 -6.190 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.770 4.665 -6.319 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.151 4.545 -6.981 1.00 0.00 H new ATOM 1224 N VAL A 78 -4.172 -0.040 -5.867 1.00 0.00 N ATOM 1225 CA VAL A 78 -4.049 -1.535 -5.912 1.00 0.00 C ATOM 1226 C VAL A 78 -2.637 -1.941 -6.378 1.00 0.00 C ATOM 1227 O VAL A 78 -1.904 -1.178 -7.023 1.00 0.00 O ATOM 1228 CB VAL A 78 -5.160 -2.043 -6.862 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -4.814 -1.811 -8.367 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -5.568 -3.503 -6.621 1.00 0.00 C ATOM 0 H VAL A 78 -4.631 0.344 -6.693 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.178 -1.984 -4.927 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.028 -1.432 -6.614 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -5.627 -2.186 -8.989 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -4.679 -0.745 -8.549 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.894 -2.340 -8.615 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.351 -3.783 -7.326 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.703 -4.151 -6.763 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.941 -3.613 -5.603 1.00 0.00 H new ATOM 1240 N ILE A 79 -2.197 -3.151 -5.976 1.00 0.00 N ATOM 1241 CA ILE A 79 -0.863 -3.738 -6.225 1.00 0.00 C ATOM 1242 C ILE A 79 -0.818 -4.461 -7.559 1.00 0.00 C ATOM 1243 O ILE A 79 -1.793 -4.640 -8.282 1.00 0.00 O ATOM 1244 CB ILE A 79 -0.320 -4.512 -5.007 1.00 0.00 C ATOM 1245 CG1 ILE A 79 0.369 -3.504 -4.003 1.00 0.00 C ATOM 1246 CG2 ILE A 79 0.619 -5.679 -5.326 1.00 0.00 C ATOM 1247 CD1 ILE A 79 -0.009 -3.709 -2.527 1.00 0.00 C ATOM 0 H ILE A 79 -2.795 -3.780 -5.440 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.140 -2.930 -6.336 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.191 -4.984 -4.553 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.451 -3.595 -4.103 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.107 -2.487 -4.293 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.940 -6.152 -4.398 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.095 -6.409 -5.943 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.491 -5.308 -5.865 1.00 0.00 H new ATOM 0 HD11 ILE A 79 0.511 -2.973 -1.913 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.085 -3.587 -2.407 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.280 -4.712 -2.213 1.00 0.00 H new ATOM 1259 N ASP A 80 0.416 -4.860 -7.941 1.00 0.00 N ATOM 1260 CA ASP A 80 0.801 -5.842 -8.976 1.00 0.00 C ATOM 1261 C ASP A 80 1.028 -7.230 -8.264 1.00 0.00 C ATOM 1262 O ASP A 80 1.540 -7.281 -7.145 1.00 0.00 O ATOM 1263 CB ASP A 80 2.059 -5.461 -9.702 1.00 0.00 C ATOM 1264 CG ASP A 80 1.944 -4.936 -11.141 1.00 0.00 C ATOM 1265 OD1 ASP A 80 0.915 -5.291 -11.788 1.00 0.00 O ATOM 1266 OD2 ASP A 80 2.852 -4.154 -11.560 1.00 0.00 O ATOM 0 H ASP A 80 1.242 -4.466 -7.491 1.00 0.00 H new ATOM 0 HA ASP A 80 0.002 -5.884 -9.716 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.565 -4.698 -9.110 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.710 -6.335 -9.719 1.00 0.00 H new ATOM 1271 N SER A 81 0.384 -8.226 -8.864 1.00 0.00 N ATOM 1272 CA SER A 81 0.089 -9.584 -8.243 1.00 0.00 C ATOM 1273 C SER A 81 1.354 -10.421 -8.177 1.00 0.00 C ATOM 1274 O SER A 81 1.620 -11.136 -7.175 1.00 0.00 O ATOM 1275 CB SER A 81 -0.999 -10.169 -9.097 1.00 0.00 C ATOM 1276 OG SER A 81 -1.219 -11.536 -8.989 1.00 0.00 O ATOM 0 H SER A 81 0.030 -8.145 -9.817 1.00 0.00 H new ATOM 0 HA SER A 81 -0.247 -9.530 -7.207 1.00 0.00 H new ATOM 0 HB2 SER A 81 -1.930 -9.656 -8.857 1.00 0.00 H new ATOM 0 HB3 SER A 81 -0.770 -9.944 -10.139 1.00 0.00 H new ATOM 0 HG SER A 81 -1.948 -11.798 -9.589 1.00 0.00 H new ATOM 1282 N LEU A 82 2.237 -10.221 -9.178 1.00 0.00 N ATOM 1283 CA LEU A 82 3.567 -10.890 -9.351 1.00 0.00 C ATOM 1284 C LEU A 82 4.563 -10.162 -8.429 1.00 0.00 C ATOM 1285 O LEU A 82 5.237 -10.847 -7.641 1.00 0.00 O ATOM 1286 CB LEU A 82 3.878 -10.752 -10.829 1.00 0.00 C ATOM 1287 CG LEU A 82 5.257 -10.631 -11.415 1.00 0.00 C ATOM 1288 CD1 LEU A 82 6.420 -10.304 -10.486 1.00 0.00 C ATOM 1289 CD2 LEU A 82 5.595 -11.844 -12.348 1.00 0.00 C ATOM 0 H LEU A 82 2.043 -9.559 -9.930 1.00 0.00 H new ATOM 0 HA LEU A 82 3.604 -11.945 -9.079 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.423 -11.617 -11.312 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.331 -9.873 -11.169 1.00 0.00 H new ATOM 0 HG LEU A 82 5.169 -9.712 -11.995 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.343 -10.252 -11.063 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.240 -9.344 -10.002 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.509 -11.082 -9.727 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.599 -11.722 -12.754 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.545 -12.769 -11.774 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.876 -11.885 -13.166 1.00 0.00 H new ATOM 1301 N LEU A 83 4.667 -8.839 -8.554 1.00 0.00 N ATOM 1302 CA LEU A 83 5.547 -7.948 -7.696 1.00 0.00 C ATOM 1303 C LEU A 83 5.026 -8.137 -6.244 1.00 0.00 C ATOM 1304 O LEU A 83 5.770 -8.030 -5.301 1.00 0.00 O ATOM 1305 CB LEU A 83 5.291 -6.538 -8.186 1.00 0.00 C ATOM 1306 CG LEU A 83 5.680 -6.045 -9.567 1.00 0.00 C ATOM 1307 CD1 LEU A 83 6.179 -4.568 -9.599 1.00 0.00 C ATOM 1308 CD2 LEU A 83 6.647 -6.990 -10.333 1.00 0.00 C ATOM 0 H LEU A 83 4.145 -8.318 -9.258 1.00 0.00 H new ATOM 0 HA LEU A 83 6.614 -8.167 -7.741 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.218 -6.371 -8.092 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.780 -5.873 -7.474 1.00 0.00 H new ATOM 0 HG LEU A 83 4.737 -6.064 -10.113 1.00 0.00 H new ATOM 0 HD11 LEU A 83 6.437 -4.293 -10.622 1.00 0.00 H new ATOM 0 HD12 LEU A 83 5.391 -3.910 -9.234 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.059 -4.467 -8.963 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.874 -6.564 -11.310 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.569 -7.106 -9.764 1.00 0.00 H new ATOM 0 HD23 LEU A 83 6.176 -7.965 -10.463 1.00 0.00 H new ATOM 1320 N TYR A 84 3.709 -8.438 -6.126 1.00 0.00 N ATOM 1321 CA TYR A 84 2.937 -8.580 -4.889 1.00 0.00 C ATOM 1322 C TYR A 84 3.663 -9.600 -3.972 1.00 0.00 C ATOM 1323 O TYR A 84 4.335 -9.244 -2.989 1.00 0.00 O ATOM 1324 CB TYR A 84 1.503 -9.132 -5.289 1.00 0.00 C ATOM 1325 CG TYR A 84 0.568 -9.279 -4.111 1.00 0.00 C ATOM 1326 CD1 TYR A 84 0.670 -8.407 -2.998 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.398 -10.316 -4.131 1.00 0.00 C ATOM 1328 CE1 TYR A 84 -0.170 -8.601 -1.901 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.359 -10.362 -3.118 1.00 0.00 C ATOM 1330 CZ TYR A 84 -1.215 -9.532 -2.004 1.00 0.00 C ATOM 1331 OH TYR A 84 -2.100 -9.622 -0.984 1.00 0.00 O ATOM 0 H TYR A 84 3.131 -8.596 -6.951 1.00 0.00 H new ATOM 0 HA TYR A 84 2.841 -7.631 -4.361 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.053 -8.459 -6.019 1.00 0.00 H new ATOM 0 HB3 TYR A 84 1.617 -10.100 -5.776 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.390 -7.602 -2.999 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.391 -11.058 -4.916 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.019 -8.044 -0.988 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -2.203 -11.031 -3.195 1.00 0.00 H new ATOM 0 HH TYR A 84 -2.775 -8.917 -1.074 1.00 0.00 H new ATOM 1341 N GLY A 85 3.526 -10.902 -4.344 1.00 0.00 N ATOM 1342 CA GLY A 85 3.808 -12.037 -3.438 1.00 0.00 C ATOM 1343 C GLY A 85 5.261 -12.496 -3.477 1.00 0.00 C ATOM 1344 O GLY A 85 5.689 -13.393 -2.720 1.00 0.00 O ATOM 0 H GLY A 85 3.219 -11.187 -5.274 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.553 -11.750 -2.418 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.163 -12.874 -3.705 1.00 0.00 H new ATOM 1348 N LYS A 86 6.041 -11.911 -4.418 1.00 0.00 N ATOM 1349 CA LYS A 86 7.535 -11.791 -4.250 1.00 0.00 C ATOM 1350 C LYS A 86 7.912 -10.472 -3.583 1.00 0.00 C ATOM 1351 O LYS A 86 9.052 -10.054 -3.482 1.00 0.00 O ATOM 1352 CB LYS A 86 8.167 -11.960 -5.649 1.00 0.00 C ATOM 1353 CG LYS A 86 7.631 -13.324 -6.249 1.00 0.00 C ATOM 1354 CD LYS A 86 6.242 -13.253 -6.856 1.00 0.00 C ATOM 1355 CE LYS A 86 6.213 -14.049 -8.184 1.00 0.00 C ATOM 1356 NZ LYS A 86 6.525 -15.454 -7.944 1.00 0.00 N ATOM 0 H LYS A 86 5.683 -11.518 -5.289 1.00 0.00 H new ATOM 0 HA LYS A 86 7.918 -12.565 -3.585 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.898 -11.124 -6.295 1.00 0.00 H new ATOM 0 HB3 LYS A 86 9.255 -11.972 -5.580 1.00 0.00 H new ATOM 0 HG2 LYS A 86 8.329 -13.667 -7.013 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.629 -14.075 -5.459 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.509 -13.661 -6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.966 -12.214 -7.037 1.00 0.00 H new ATOM 0 HE2 LYS A 86 5.229 -13.962 -8.645 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.932 -13.625 -8.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.321 -16.006 -8.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.532 -15.550 -7.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 5.944 -15.809 -7.158 1.00 0.00 H new ATOM 1370 N VAL A 87 6.842 -9.737 -3.098 1.00 0.00 N ATOM 1371 CA VAL A 87 6.901 -8.825 -1.950 1.00 0.00 C ATOM 1372 C VAL A 87 8.017 -7.775 -2.246 1.00 0.00 C ATOM 1373 O VAL A 87 8.788 -7.421 -1.392 1.00 0.00 O ATOM 1374 CB VAL A 87 7.051 -9.597 -0.641 1.00 0.00 C ATOM 1375 CG1 VAL A 87 5.733 -9.793 0.153 1.00 0.00 C ATOM 1376 CG2 VAL A 87 7.739 -10.985 -0.803 1.00 0.00 C ATOM 0 H VAL A 87 5.914 -9.783 -3.520 1.00 0.00 H new ATOM 0 HA VAL A 87 5.969 -8.277 -1.812 1.00 0.00 H new ATOM 0 HB VAL A 87 7.701 -8.939 -0.064 1.00 0.00 H new ATOM 0 HG11 VAL A 87 5.938 -10.351 1.066 1.00 0.00 H new ATOM 0 HG12 VAL A 87 5.314 -8.820 0.409 1.00 0.00 H new ATOM 0 HG13 VAL A 87 5.019 -10.346 -0.458 1.00 0.00 H new ATOM 0 HG21 VAL A 87 7.809 -11.472 0.170 1.00 0.00 H new ATOM 0 HG22 VAL A 87 7.151 -11.606 -1.478 1.00 0.00 H new ATOM 0 HG23 VAL A 87 8.739 -10.849 -1.214 1.00 0.00 H new ATOM 1386 N ASP A 88 8.132 -7.380 -3.551 1.00 0.00 N ATOM 1387 CA ASP A 88 9.264 -6.720 -4.212 1.00 0.00 C ATOM 1388 C ASP A 88 9.445 -5.265 -3.797 1.00 0.00 C ATOM 1389 O ASP A 88 9.224 -4.315 -4.583 1.00 0.00 O ATOM 1390 CB ASP A 88 9.094 -6.792 -5.749 1.00 0.00 C ATOM 1391 CG ASP A 88 10.169 -7.673 -6.458 1.00 0.00 C ATOM 1392 OD1 ASP A 88 10.680 -8.599 -5.767 1.00 0.00 O ATOM 1393 OD2 ASP A 88 10.450 -7.361 -7.648 1.00 0.00 O ATOM 0 H ASP A 88 7.365 -7.535 -4.205 1.00 0.00 H new ATOM 0 HA ASP A 88 10.158 -7.258 -3.895 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.104 -7.187 -5.978 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.137 -5.783 -6.158 1.00 0.00 H new ATOM 1398 N GLY A 89 9.652 -5.072 -2.469 1.00 0.00 N ATOM 1399 CA GLY A 89 9.929 -3.789 -1.840 1.00 0.00 C ATOM 1400 C GLY A 89 10.213 -2.630 -2.769 1.00 0.00 C ATOM 1401 O GLY A 89 9.616 -1.518 -2.606 1.00 0.00 O ATOM 0 H GLY A 89 9.626 -5.841 -1.799 1.00 0.00 H new ATOM 0 HA2 GLY A 89 9.076 -3.524 -1.215 1.00 0.00 H new ATOM 0 HA3 GLY A 89 10.785 -3.912 -1.176 1.00 0.00 H new ATOM 1405 N LEU A 90 11.140 -2.782 -3.743 1.00 0.00 N ATOM 1406 CA LEU A 90 11.691 -1.770 -4.634 1.00 0.00 C ATOM 1407 C LEU A 90 10.626 -1.393 -5.699 1.00 0.00 C ATOM 1408 O LEU A 90 10.373 -0.205 -5.879 1.00 0.00 O ATOM 1409 CB LEU A 90 12.918 -2.393 -5.346 1.00 0.00 C ATOM 1410 CG LEU A 90 14.229 -2.608 -4.584 1.00 0.00 C ATOM 1411 CD1 LEU A 90 14.440 -4.055 -4.099 1.00 0.00 C ATOM 1412 CD2 LEU A 90 15.455 -2.009 -5.290 1.00 0.00 C ATOM 0 H LEU A 90 11.547 -3.698 -3.930 1.00 0.00 H new ATOM 0 HA LEU A 90 11.975 -0.878 -4.076 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.607 -3.363 -5.733 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.145 -1.764 -6.207 1.00 0.00 H new ATOM 0 HG LEU A 90 14.117 -2.026 -3.669 1.00 0.00 H new ATOM 0 HD11 LEU A 90 15.390 -4.126 -3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 90 13.628 -4.336 -3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.452 -4.728 -4.956 1.00 0.00 H new ATOM 0 HD21 LEU A 90 16.347 -2.199 -4.694 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.570 -2.468 -6.272 1.00 0.00 H new ATOM 0 HD23 LEU A 90 15.319 -0.934 -5.406 1.00 0.00 H new ATOM 1424 N GLY A 91 10.112 -2.416 -6.412 1.00 0.00 N ATOM 1425 CA GLY A 91 8.988 -2.237 -7.393 1.00 0.00 C ATOM 1426 C GLY A 91 7.851 -1.444 -6.707 1.00 0.00 C ATOM 1427 O GLY A 91 7.284 -0.545 -7.318 1.00 0.00 O ATOM 0 H GLY A 91 10.446 -3.377 -6.337 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.339 -1.705 -8.277 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.622 -3.207 -7.729 1.00 0.00 H new ATOM 1431 N VAL A 92 7.541 -1.844 -5.444 1.00 0.00 N ATOM 1432 CA VAL A 92 6.329 -1.415 -4.727 1.00 0.00 C ATOM 1433 C VAL A 92 6.551 0.085 -4.273 1.00 0.00 C ATOM 1434 O VAL A 92 5.733 0.950 -4.533 1.00 0.00 O ATOM 1435 CB VAL A 92 5.953 -2.341 -3.600 1.00 0.00 C ATOM 1436 CG1 VAL A 92 4.616 -3.108 -3.770 1.00 0.00 C ATOM 1437 CG2 VAL A 92 7.067 -3.244 -3.054 1.00 0.00 C ATOM 0 H VAL A 92 8.132 -2.474 -4.902 1.00 0.00 H new ATOM 0 HA VAL A 92 5.465 -1.465 -5.390 1.00 0.00 H new ATOM 0 HB VAL A 92 5.775 -1.607 -2.814 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.448 -3.743 -2.900 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.797 -2.395 -3.862 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.662 -3.726 -4.667 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.672 -3.862 -2.248 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.440 -3.885 -3.853 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.881 -2.627 -2.673 1.00 0.00 H new ATOM 1447 N LEU A 93 7.648 0.291 -3.505 1.00 0.00 N ATOM 1448 CA LEU A 93 8.284 1.615 -3.272 1.00 0.00 C ATOM 1449 C LEU A 93 8.070 2.484 -4.536 1.00 0.00 C ATOM 1450 O LEU A 93 7.507 3.560 -4.421 1.00 0.00 O ATOM 1451 CB LEU A 93 9.769 1.316 -3.047 1.00 0.00 C ATOM 1452 CG LEU A 93 10.771 2.460 -2.776 1.00 0.00 C ATOM 1453 CD1 LEU A 93 11.093 3.332 -4.033 1.00 0.00 C ATOM 1454 CD2 LEU A 93 10.301 3.335 -1.584 1.00 0.00 C ATOM 0 H LEU A 93 8.125 -0.469 -3.021 1.00 0.00 H new ATOM 0 HA LEU A 93 7.868 2.155 -2.421 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.834 0.627 -2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.125 0.779 -3.926 1.00 0.00 H new ATOM 0 HG LEU A 93 11.712 1.979 -2.509 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.803 4.113 -3.762 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.525 2.703 -4.811 1.00 0.00 H new ATOM 0 HD13 LEU A 93 10.175 3.789 -4.404 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.023 4.134 -1.412 1.00 0.00 H new ATOM 0 HD22 LEU A 93 9.327 3.768 -1.813 1.00 0.00 H new ATOM 0 HD23 LEU A 93 10.222 2.718 -0.689 1.00 0.00 H new ATOM 1466 N LYS A 94 8.582 2.017 -5.714 1.00 0.00 N ATOM 1467 CA LYS A 94 8.566 2.796 -6.963 1.00 0.00 C ATOM 1468 C LYS A 94 7.147 2.943 -7.538 1.00 0.00 C ATOM 1469 O LYS A 94 6.872 3.858 -8.335 1.00 0.00 O ATOM 1470 CB LYS A 94 9.520 2.255 -8.007 1.00 0.00 C ATOM 1471 CG LYS A 94 9.511 3.100 -9.301 1.00 0.00 C ATOM 1472 CD LYS A 94 9.663 2.332 -10.615 1.00 0.00 C ATOM 1473 CE LYS A 94 8.482 1.384 -10.817 1.00 0.00 C ATOM 1474 NZ LYS A 94 8.342 0.966 -12.241 1.00 0.00 N ATOM 0 H LYS A 94 9.011 1.097 -5.810 1.00 0.00 H new ATOM 0 HA LYS A 94 8.920 3.791 -6.693 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.530 2.233 -7.597 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.250 1.226 -8.245 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.576 3.659 -9.338 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.317 3.831 -9.237 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.722 3.032 -11.448 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.595 1.766 -10.607 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.614 0.502 -10.191 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.564 1.873 -10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 7.530 0.324 -12.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.191 1.806 -12.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.208 0.477 -12.546 1.00 0.00 H new ATOM 1488 N ALA A 95 6.300 1.932 -7.202 1.00 0.00 N ATOM 1489 CA ALA A 95 4.901 1.839 -7.667 1.00 0.00 C ATOM 1490 C ALA A 95 3.944 2.667 -6.784 1.00 0.00 C ATOM 1491 O ALA A 95 2.855 3.060 -7.205 1.00 0.00 O ATOM 1492 CB ALA A 95 4.424 0.402 -7.783 1.00 0.00 C ATOM 0 H ALA A 95 6.577 1.158 -6.598 1.00 0.00 H new ATOM 0 HA ALA A 95 4.885 2.268 -8.669 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.390 0.389 -8.128 1.00 0.00 H new ATOM 0 HB2 ALA A 95 5.052 -0.133 -8.496 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.487 -0.082 -6.809 1.00 0.00 H new ATOM 1498 N ALA A 96 4.384 2.914 -5.528 1.00 0.00 N ATOM 1499 CA ALA A 96 3.763 3.880 -4.590 1.00 0.00 C ATOM 1500 C ALA A 96 3.922 5.315 -5.059 1.00 0.00 C ATOM 1501 O ALA A 96 2.902 6.049 -5.100 1.00 0.00 O ATOM 1502 CB ALA A 96 4.370 3.691 -3.185 1.00 0.00 C ATOM 0 H ALA A 96 5.195 2.439 -5.131 1.00 0.00 H new ATOM 0 HA ALA A 96 2.692 3.680 -4.554 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.915 4.400 -2.494 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.179 2.675 -2.840 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.445 3.864 -3.227 1.00 0.00 H new ATOM 1508 N VAL A 97 5.157 5.738 -5.361 1.00 0.00 N ATOM 1509 CA VAL A 97 5.481 7.012 -6.016 1.00 0.00 C ATOM 1510 C VAL A 97 4.600 7.149 -7.295 1.00 0.00 C ATOM 1511 O VAL A 97 4.099 8.219 -7.628 1.00 0.00 O ATOM 1512 CB VAL A 97 6.977 7.113 -6.312 1.00 0.00 C ATOM 1513 CG1 VAL A 97 7.357 7.308 -7.802 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.692 8.148 -5.422 1.00 0.00 C ATOM 0 H VAL A 97 5.986 5.183 -5.149 1.00 0.00 H new ATOM 0 HA VAL A 97 5.255 7.846 -5.352 1.00 0.00 H new ATOM 0 HB VAL A 97 7.343 6.119 -6.054 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.441 7.367 -7.896 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.987 6.465 -8.385 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.910 8.230 -8.174 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.751 8.177 -5.676 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.253 9.132 -5.584 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.578 7.868 -4.375 1.00 0.00 H new ATOM 1524 N ALA A 98 4.520 6.028 -8.041 1.00 0.00 N ATOM 1525 CA ALA A 98 3.850 5.974 -9.377 1.00 0.00 C ATOM 1526 C ALA A 98 2.317 6.120 -9.197 1.00 0.00 C ATOM 1527 O ALA A 98 1.628 6.532 -10.120 1.00 0.00 O ATOM 1528 CB ALA A 98 4.170 4.622 -10.039 1.00 0.00 C ATOM 0 H ALA A 98 4.913 5.134 -7.745 1.00 0.00 H new ATOM 0 HA ALA A 98 4.212 6.787 -10.006 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.686 4.571 -11.015 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.248 4.524 -10.163 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.802 3.812 -9.409 1.00 0.00 H new ATOM 1534 N ALA A 99 1.839 5.742 -7.999 1.00 0.00 N ATOM 1535 CA ALA A 99 0.418 5.642 -7.629 1.00 0.00 C ATOM 1536 C ALA A 99 -0.065 6.947 -6.932 1.00 0.00 C ATOM 1537 O ALA A 99 -1.196 7.362 -7.093 1.00 0.00 O ATOM 1538 CB ALA A 99 0.165 4.465 -6.684 1.00 0.00 C ATOM 0 H ALA A 99 2.459 5.487 -7.230 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.138 5.486 -8.553 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.895 4.422 -6.432 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.460 3.536 -7.173 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.749 4.597 -5.773 1.00 0.00 H new ATOM 1544 N ILE A 100 0.860 7.537 -6.132 1.00 0.00 N ATOM 1545 CA ILE A 100 0.755 8.943 -5.613 1.00 0.00 C ATOM 1546 C ILE A 100 0.252 9.845 -6.801 1.00 0.00 C ATOM 1547 O ILE A 100 -0.791 10.427 -6.745 1.00 0.00 O ATOM 1548 CB ILE A 100 2.097 9.410 -5.036 1.00 0.00 C ATOM 1549 CG1 ILE A 100 2.225 9.253 -3.535 1.00 0.00 C ATOM 1550 CG2 ILE A 100 2.562 10.797 -5.567 1.00 0.00 C ATOM 1551 CD1 ILE A 100 2.530 10.524 -2.720 1.00 0.00 C ATOM 0 H ILE A 100 1.705 7.057 -5.823 1.00 0.00 H new ATOM 0 HA ILE A 100 0.044 9.009 -4.790 1.00 0.00 H new ATOM 0 HB ILE A 100 2.820 8.700 -5.438 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.296 8.825 -3.159 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.013 8.527 -3.337 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.518 11.058 -5.113 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.674 10.753 -6.650 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.820 11.553 -5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.595 10.271 -1.662 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.477 10.950 -3.051 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.733 11.252 -2.870 1.00 0.00 H new ATOM 1563 N LYS A 101 1.154 9.902 -7.809 1.00 0.00 N ATOM 1564 CA LYS A 101 0.949 10.760 -9.009 1.00 0.00 C ATOM 1565 C LYS A 101 -0.216 10.307 -9.876 1.00 0.00 C ATOM 1566 O LYS A 101 -1.024 11.103 -10.356 1.00 0.00 O ATOM 1567 CB LYS A 101 2.245 10.935 -9.786 1.00 0.00 C ATOM 1568 CG LYS A 101 2.320 12.351 -10.417 1.00 0.00 C ATOM 1569 CD LYS A 101 2.750 12.372 -11.895 1.00 0.00 C ATOM 1570 CE LYS A 101 1.469 12.300 -12.764 1.00 0.00 C ATOM 1571 NZ LYS A 101 1.661 11.326 -13.859 1.00 0.00 N ATOM 0 H LYS A 101 2.025 9.371 -7.820 1.00 0.00 H new ATOM 0 HA LYS A 101 0.658 11.748 -8.651 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.096 10.782 -9.122 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.311 10.179 -10.568 1.00 0.00 H new ATOM 0 HG2 LYS A 101 1.343 12.826 -10.330 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.020 12.955 -9.840 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.311 13.280 -12.116 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.407 11.530 -12.113 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.618 12.007 -12.150 1.00 0.00 H new ATOM 0 HE3 LYS A 101 1.242 13.283 -13.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.799 11.281 -14.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 2.462 11.623 -14.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.857 10.387 -13.458 1.00 0.00 H new