USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 512 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 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS :FLIP no HE2:sc= 0.0792 F(o=-0.58,f=0.079) USER MOD Single : A 146 TYR OH : rot -92:sc= 0.0757 USER MOD Single : A 151 GLN : amide:sc= -0.0174 K(o=-0.017,f=-0.62) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 ASN : amide:sc= 0.0383 X(o=0.038,f=0) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 THR OG1 : rot -86:sc= 0.702 USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 193 MET CE :methyl 143:sc= -1.23 (180deg=-2.16) USER MOD Single : A 196 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN :FLIP amide:sc= -4.99! C(o=-9.1!,f=-5!) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 144 8.765 -7.562 -6.685 1.00 0.00 N ATOM 2 CA LYS A 144 8.760 -6.731 -7.922 1.00 0.00 C ATOM 3 C LYS A 144 8.063 -5.398 -7.635 1.00 0.00 C ATOM 4 O LYS A 144 7.781 -5.069 -6.501 1.00 0.00 O ATOM 5 CB LYS A 144 8.009 -7.473 -9.031 1.00 0.00 C ATOM 6 CG LYS A 144 6.512 -7.482 -8.717 1.00 0.00 C ATOM 7 CD LYS A 144 5.834 -8.614 -9.490 1.00 0.00 C ATOM 8 CE LYS A 144 4.598 -9.087 -8.722 1.00 0.00 C ATOM 9 NZ LYS A 144 3.962 -10.221 -9.451 1.00 0.00 N ATOM 0 HA LYS A 144 9.785 -6.544 -8.241 1.00 0.00 H new ATOM 0 HB2 LYS A 144 8.187 -6.989 -9.991 1.00 0.00 H new ATOM 0 HB3 LYS A 144 8.380 -8.495 -9.115 1.00 0.00 H new ATOM 0 HG2 LYS A 144 6.355 -7.614 -7.646 1.00 0.00 H new ATOM 0 HG3 LYS A 144 6.067 -6.525 -8.989 1.00 0.00 H new ATOM 0 HD2 LYS A 144 5.548 -8.270 -10.484 1.00 0.00 H new ATOM 0 HD3 LYS A 144 6.529 -9.442 -9.627 1.00 0.00 H new ATOM 0 HE2 LYS A 144 4.879 -9.400 -7.716 1.00 0.00 H new ATOM 0 HE3 LYS A 144 3.888 -8.267 -8.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 3.122 -10.542 -8.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 3.680 -9.908 -10.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 4.640 -11.005 -9.532 1.00 0.00 H new ATOM 23 N HIS A 145 7.784 -4.630 -8.652 1.00 0.00 N ATOM 24 CA HIS A 145 7.107 -3.322 -8.430 1.00 0.00 C ATOM 25 C HIS A 145 5.700 -3.565 -7.880 1.00 0.00 C ATOM 26 O HIS A 145 4.824 -4.033 -8.578 1.00 0.00 O ATOM 27 CB HIS A 145 7.011 -2.563 -9.755 1.00 0.00 C ATOM 28 CG HIS A 145 6.801 -1.099 -9.481 1.00 0.00 C ATOM 29 ND1 HIS A 145 5.850 -0.430 -8.751 1.00 0.00 N flip ATOM 30 CD2 HIS A 145 7.642 -0.123 -9.994 1.00 0.00 C flip ATOM 31 CE1 HIS A 145 6.094 0.939 -8.808 1.00 0.00 C flip ATOM 32 NE2 HIS A 145 7.184 1.069 -9.569 1.00 0.00 N flip ATOM 0 H HIS A 145 7.995 -4.851 -9.625 1.00 0.00 H new ATOM 0 HA HIS A 145 7.682 -2.733 -7.716 1.00 0.00 H new ATOM 0 HB2 HIS A 145 7.922 -2.708 -10.336 1.00 0.00 H new ATOM 0 HB3 HIS A 145 6.187 -2.954 -10.351 1.00 0.00 H new ATOM 0 HD1 HIS A 145 5.082 -0.869 -8.244 1.00 0.00 H new ATOM 0 HD2 HIS A 145 8.506 -0.289 -10.620 1.00 0.00 H new ATOM 0 HE1 HIS A 145 5.524 1.727 -8.338 1.00 0.00 H new ATOM 40 N TYR A 146 5.478 -3.255 -6.632 1.00 0.00 N ATOM 41 CA TYR A 146 4.129 -3.473 -6.044 1.00 0.00 C ATOM 42 C TYR A 146 3.224 -2.289 -6.386 1.00 0.00 C ATOM 43 O TYR A 146 3.674 -1.169 -6.527 1.00 0.00 O ATOM 44 CB TYR A 146 4.255 -3.607 -4.527 1.00 0.00 C ATOM 45 CG TYR A 146 5.055 -4.840 -4.199 1.00 0.00 C ATOM 46 CD1 TYR A 146 4.851 -6.020 -4.926 1.00 0.00 C ATOM 47 CD2 TYR A 146 6.001 -4.807 -3.168 1.00 0.00 C ATOM 48 CE1 TYR A 146 5.592 -7.168 -4.619 1.00 0.00 C ATOM 49 CE2 TYR A 146 6.741 -5.954 -2.862 1.00 0.00 C ATOM 50 CZ TYR A 146 6.537 -7.135 -3.587 1.00 0.00 C ATOM 51 OH TYR A 146 7.270 -8.266 -3.284 1.00 0.00 O ATOM 0 H TYR A 146 6.172 -2.861 -5.996 1.00 0.00 H new ATOM 0 HA TYR A 146 3.694 -4.385 -6.453 1.00 0.00 H new ATOM 0 HB2 TYR A 146 4.741 -2.724 -4.112 1.00 0.00 H new ATOM 0 HB3 TYR A 146 3.266 -3.670 -4.073 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.123 -6.044 -5.723 1.00 0.00 H new ATOM 0 HD2 TYR A 146 6.160 -3.897 -2.609 1.00 0.00 H new ATOM 0 HE1 TYR A 146 5.434 -8.078 -5.178 1.00 0.00 H new ATOM 0 HE2 TYR A 146 7.470 -5.929 -2.066 1.00 0.00 H new ATOM 0 HH TYR A 146 6.807 -8.780 -2.590 1.00 0.00 H new ATOM 61 N ARG A 147 1.949 -2.528 -6.529 1.00 0.00 N ATOM 62 CA ARG A 147 1.014 -1.421 -6.873 1.00 0.00 C ATOM 63 C ARG A 147 0.684 -0.608 -5.619 1.00 0.00 C ATOM 64 O ARG A 147 -0.310 -0.847 -4.962 1.00 0.00 O ATOM 65 CB ARG A 147 -0.276 -2.007 -7.448 1.00 0.00 C ATOM 66 CG ARG A 147 -0.102 -2.256 -8.946 1.00 0.00 C ATOM 67 CD ARG A 147 -0.468 -0.989 -9.720 1.00 0.00 C ATOM 68 NE ARG A 147 -0.309 -1.235 -11.181 1.00 0.00 N ATOM 69 CZ ARG A 147 0.677 -0.680 -11.832 1.00 0.00 C ATOM 70 NH1 ARG A 147 1.908 -1.029 -11.575 1.00 0.00 N ATOM 71 NH2 ARG A 147 0.430 0.224 -12.739 1.00 0.00 N ATOM 0 H ARG A 147 1.514 -3.444 -6.422 1.00 0.00 H new ATOM 0 HA ARG A 147 1.485 -0.771 -7.610 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -0.522 -2.940 -6.940 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -1.107 -1.322 -7.277 1.00 0.00 H new ATOM 0 HG2 ARG A 147 0.928 -2.541 -9.161 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -0.735 -3.085 -9.264 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -1.495 -0.699 -9.499 1.00 0.00 H new ATOM 0 HD3 ARG A 147 0.170 -0.162 -9.408 1.00 0.00 H new ATOM 0 HE ARG A 147 -0.970 -1.837 -11.672 1.00 0.00 H new ATOM 0 HH11 ARG A 147 2.100 -1.736 -10.865 1.00 0.00 H new ATOM 0 HH12 ARG A 147 2.678 -0.595 -12.084 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -0.532 0.496 -12.939 1.00 0.00 H new ATOM 0 HH22 ARG A 147 1.199 0.659 -13.249 1.00 0.00 H new ATOM 85 N GLY A 148 1.498 0.357 -5.286 1.00 0.00 N ATOM 86 CA GLY A 148 1.207 1.184 -4.081 1.00 0.00 C ATOM 87 C GLY A 148 2.451 1.292 -3.194 1.00 0.00 C ATOM 88 O GLY A 148 2.424 1.928 -2.161 1.00 0.00 O ATOM 0 H GLY A 148 2.347 0.607 -5.793 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.882 2.179 -4.385 1.00 0.00 H new ATOM 0 HA3 GLY A 148 0.387 0.739 -3.516 1.00 0.00 H new ATOM 92 N VAL A 149 3.539 0.680 -3.575 1.00 0.00 N ATOM 93 CA VAL A 149 4.763 0.766 -2.725 1.00 0.00 C ATOM 94 C VAL A 149 5.820 1.637 -3.403 1.00 0.00 C ATOM 95 O VAL A 149 6.332 1.306 -4.454 1.00 0.00 O ATOM 96 CB VAL A 149 5.348 -0.631 -2.508 1.00 0.00 C ATOM 97 CG1 VAL A 149 6.652 -0.514 -1.718 1.00 0.00 C ATOM 98 CG2 VAL A 149 4.357 -1.489 -1.725 1.00 0.00 C ATOM 0 H VAL A 149 3.635 0.130 -4.428 1.00 0.00 H new ATOM 0 HA VAL A 149 4.484 1.206 -1.768 1.00 0.00 H new ATOM 0 HB VAL A 149 5.542 -1.097 -3.474 1.00 0.00 H new ATOM 0 HG11 VAL A 149 7.073 -1.507 -1.561 1.00 0.00 H new ATOM 0 HG12 VAL A 149 7.362 0.097 -2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 149 6.452 -0.048 -0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.777 -2.483 -1.573 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.160 -1.026 -0.758 1.00 0.00 H new ATOM 0 HG23 VAL A 149 3.425 -1.571 -2.285 1.00 0.00 H new ATOM 108 N ARG A 150 6.172 2.733 -2.792 1.00 0.00 N ATOM 109 CA ARG A 150 7.219 3.607 -3.381 1.00 0.00 C ATOM 110 C ARG A 150 8.580 3.053 -2.963 1.00 0.00 C ATOM 111 O ARG A 150 8.728 2.513 -1.883 1.00 0.00 O ATOM 112 CB ARG A 150 7.056 5.033 -2.852 1.00 0.00 C ATOM 113 CG ARG A 150 5.647 5.536 -3.171 1.00 0.00 C ATOM 114 CD ARG A 150 5.737 6.862 -3.927 1.00 0.00 C ATOM 115 NE ARG A 150 4.740 6.870 -5.035 1.00 0.00 N ATOM 116 CZ ARG A 150 4.836 6.004 -6.007 1.00 0.00 C ATOM 117 NH1 ARG A 150 5.898 5.988 -6.765 1.00 0.00 N ATOM 118 NH2 ARG A 150 3.869 5.154 -6.220 1.00 0.00 N ATOM 0 H ARG A 150 5.779 3.060 -1.910 1.00 0.00 H new ATOM 0 HA ARG A 150 7.134 3.627 -4.467 1.00 0.00 H new ATOM 0 HB2 ARG A 150 7.227 5.055 -1.776 1.00 0.00 H new ATOM 0 HB3 ARG A 150 7.799 5.688 -3.306 1.00 0.00 H new ATOM 0 HG2 ARG A 150 5.114 4.799 -3.771 1.00 0.00 H new ATOM 0 HG3 ARG A 150 5.079 5.668 -2.250 1.00 0.00 H new ATOM 0 HD2 ARG A 150 5.549 7.694 -3.248 1.00 0.00 H new ATOM 0 HD3 ARG A 150 6.742 6.998 -4.327 1.00 0.00 H new ATOM 0 HE ARG A 150 3.982 7.553 -5.034 1.00 0.00 H new ATOM 0 HH11 ARG A 150 6.654 6.652 -6.598 1.00 0.00 H new ATOM 0 HH12 ARG A 150 5.972 5.311 -7.524 1.00 0.00 H new ATOM 0 HH21 ARG A 150 3.039 5.167 -5.627 1.00 0.00 H new ATOM 0 HH22 ARG A 150 3.943 4.477 -6.979 1.00 0.00 H new ATOM 132 N GLN A 151 9.574 3.159 -3.797 1.00 0.00 N ATOM 133 CA GLN A 151 10.904 2.609 -3.414 1.00 0.00 C ATOM 134 C GLN A 151 12.022 3.524 -3.908 1.00 0.00 C ATOM 135 O GLN A 151 12.049 3.930 -5.053 1.00 0.00 O ATOM 136 CB GLN A 151 11.076 1.226 -4.043 1.00 0.00 C ATOM 137 CG GLN A 151 10.991 1.343 -5.567 1.00 0.00 C ATOM 138 CD GLN A 151 9.830 0.491 -6.081 1.00 0.00 C ATOM 139 OE1 GLN A 151 8.682 0.763 -5.789 1.00 0.00 O ATOM 140 NE2 GLN A 151 10.082 -0.539 -6.843 1.00 0.00 N ATOM 0 H GLN A 151 9.526 3.597 -4.717 1.00 0.00 H new ATOM 0 HA GLN A 151 10.957 2.539 -2.328 1.00 0.00 H new ATOM 0 HB2 GLN A 151 12.037 0.800 -3.754 1.00 0.00 H new ATOM 0 HB3 GLN A 151 10.304 0.550 -3.676 1.00 0.00 H new ATOM 0 HG2 GLN A 151 10.847 2.384 -5.855 1.00 0.00 H new ATOM 0 HG3 GLN A 151 11.926 1.014 -6.020 1.00 0.00 H new ATOM 0 HE21 GLN A 151 11.045 -0.768 -7.089 1.00 0.00 H new ATOM 0 HE22 GLN A 151 9.316 -1.114 -7.193 1.00 0.00 H new ATOM 149 N ARG A 152 12.961 3.832 -3.057 1.00 0.00 N ATOM 150 CA ARG A 152 14.095 4.700 -3.483 1.00 0.00 C ATOM 151 C ARG A 152 15.147 3.814 -4.157 1.00 0.00 C ATOM 152 O ARG A 152 14.976 2.613 -4.233 1.00 0.00 O ATOM 153 CB ARG A 152 14.721 5.400 -2.266 1.00 0.00 C ATOM 154 CG ARG A 152 13.739 5.418 -1.091 1.00 0.00 C ATOM 155 CD ARG A 152 12.397 5.986 -1.554 1.00 0.00 C ATOM 156 NE ARG A 152 12.003 7.115 -0.662 1.00 0.00 N ATOM 157 CZ ARG A 152 12.814 8.122 -0.489 1.00 0.00 C ATOM 158 NH1 ARG A 152 13.313 8.743 -1.522 1.00 0.00 N ATOM 159 NH2 ARG A 152 13.124 8.510 0.717 1.00 0.00 N ATOM 0 H ARG A 152 12.992 3.521 -2.086 1.00 0.00 H new ATOM 0 HA ARG A 152 13.735 5.463 -4.173 1.00 0.00 H new ATOM 0 HB2 ARG A 152 15.636 4.885 -1.974 1.00 0.00 H new ATOM 0 HB3 ARG A 152 15.000 6.420 -2.530 1.00 0.00 H new ATOM 0 HG2 ARG A 152 13.604 4.409 -0.701 1.00 0.00 H new ATOM 0 HG3 ARG A 152 14.140 6.023 -0.278 1.00 0.00 H new ATOM 0 HD2 ARG A 152 12.472 6.332 -2.585 1.00 0.00 H new ATOM 0 HD3 ARG A 152 11.634 5.208 -1.533 1.00 0.00 H new ATOM 0 HE ARG A 152 11.100 7.100 -0.188 1.00 0.00 H new ATOM 0 HH11 ARG A 152 13.069 8.441 -2.465 1.00 0.00 H new ATOM 0 HH12 ARG A 152 13.947 9.530 -1.386 1.00 0.00 H new ATOM 0 HH21 ARG A 152 12.732 8.026 1.525 1.00 0.00 H new ATOM 0 HH22 ARG A 152 13.758 9.297 0.852 1.00 0.00 H new ATOM 173 N PRO A 153 16.209 4.420 -4.620 1.00 0.00 N ATOM 174 CA PRO A 153 17.302 3.690 -5.281 1.00 0.00 C ATOM 175 C PRO A 153 18.160 2.991 -4.228 1.00 0.00 C ATOM 176 O PRO A 153 19.214 3.464 -3.854 1.00 0.00 O ATOM 177 CB PRO A 153 18.085 4.790 -6.004 1.00 0.00 C ATOM 178 CG PRO A 153 17.745 6.115 -5.281 1.00 0.00 C ATOM 179 CD PRO A 153 16.424 5.878 -4.524 1.00 0.00 C ATOM 0 HA PRO A 153 16.963 2.913 -5.966 1.00 0.00 H new ATOM 0 HB2 PRO A 153 19.156 4.592 -5.968 1.00 0.00 H new ATOM 0 HB3 PRO A 153 17.805 4.839 -7.056 1.00 0.00 H new ATOM 0 HG2 PRO A 153 18.541 6.395 -4.592 1.00 0.00 H new ATOM 0 HG3 PRO A 153 17.641 6.931 -5.996 1.00 0.00 H new ATOM 0 HD2 PRO A 153 16.496 6.203 -3.486 1.00 0.00 H new ATOM 0 HD3 PRO A 153 15.601 6.433 -4.975 1.00 0.00 H new ATOM 187 N TRP A 154 17.703 1.871 -3.736 1.00 0.00 N ATOM 188 CA TRP A 154 18.477 1.146 -2.692 1.00 0.00 C ATOM 189 C TRP A 154 18.369 1.920 -1.377 1.00 0.00 C ATOM 190 O TRP A 154 19.355 2.378 -0.834 1.00 0.00 O ATOM 191 CB TRP A 154 19.945 1.052 -3.117 1.00 0.00 C ATOM 192 CG TRP A 154 20.598 -0.095 -2.415 1.00 0.00 C ATOM 193 CD1 TRP A 154 21.340 0.002 -1.287 1.00 0.00 C ATOM 194 CD2 TRP A 154 20.583 -1.508 -2.773 1.00 0.00 C ATOM 195 NE1 TRP A 154 21.781 -1.259 -0.930 1.00 0.00 N ATOM 196 CE2 TRP A 154 21.341 -2.224 -1.814 1.00 0.00 C ATOM 197 CE3 TRP A 154 19.992 -2.232 -3.826 1.00 0.00 C ATOM 198 CZ2 TRP A 154 21.506 -3.608 -1.898 1.00 0.00 C ATOM 199 CZ3 TRP A 154 20.156 -3.626 -3.913 1.00 0.00 C ATOM 200 CH2 TRP A 154 20.912 -4.311 -2.950 1.00 0.00 C ATOM 0 H TRP A 154 16.827 1.428 -4.013 1.00 0.00 H new ATOM 0 HA TRP A 154 18.079 0.139 -2.563 1.00 0.00 H new ATOM 0 HB2 TRP A 154 20.014 0.917 -4.196 1.00 0.00 H new ATOM 0 HB3 TRP A 154 20.463 1.981 -2.878 1.00 0.00 H new ATOM 0 HD1 TRP A 154 21.553 0.916 -0.753 1.00 0.00 H new ATOM 0 HE1 TRP A 154 22.361 -1.453 -0.113 1.00 0.00 H new ATOM 0 HE3 TRP A 154 19.409 -1.713 -4.572 1.00 0.00 H new ATOM 0 HZ2 TRP A 154 22.089 -4.132 -1.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 154 19.698 -4.172 -4.725 1.00 0.00 H new ATOM 0 HH2 TRP A 154 21.035 -5.382 -3.021 1.00 0.00 H new ATOM 211 N GLY A 155 17.176 2.085 -0.863 1.00 0.00 N ATOM 212 CA GLY A 155 17.019 2.844 0.410 1.00 0.00 C ATOM 213 C GLY A 155 15.765 2.388 1.161 1.00 0.00 C ATOM 214 O GLY A 155 15.720 1.309 1.716 1.00 0.00 O ATOM 0 H GLY A 155 16.311 1.729 -1.268 1.00 0.00 H new ATOM 0 HA2 GLY A 155 17.898 2.697 1.037 1.00 0.00 H new ATOM 0 HA3 GLY A 155 16.954 3.911 0.197 1.00 0.00 H new ATOM 218 N LYS A 156 14.753 3.215 1.202 1.00 0.00 N ATOM 219 CA LYS A 156 13.511 2.843 1.942 1.00 0.00 C ATOM 220 C LYS A 156 12.339 2.659 0.974 1.00 0.00 C ATOM 221 O LYS A 156 12.499 2.667 -0.231 1.00 0.00 O ATOM 222 CB LYS A 156 13.161 3.958 2.926 1.00 0.00 C ATOM 223 CG LYS A 156 14.325 4.177 3.895 1.00 0.00 C ATOM 224 CD LYS A 156 14.012 3.500 5.232 1.00 0.00 C ATOM 225 CE LYS A 156 14.541 4.363 6.380 1.00 0.00 C ATOM 226 NZ LYS A 156 14.178 3.733 7.681 1.00 0.00 N ATOM 0 H LYS A 156 14.733 4.132 0.755 1.00 0.00 H new ATOM 0 HA LYS A 156 13.688 1.906 2.470 1.00 0.00 H new ATOM 0 HB2 LYS A 156 12.948 4.880 2.385 1.00 0.00 H new ATOM 0 HB3 LYS A 156 12.259 3.697 3.479 1.00 0.00 H new ATOM 0 HG2 LYS A 156 15.244 3.768 3.475 1.00 0.00 H new ATOM 0 HG3 LYS A 156 14.491 5.244 4.046 1.00 0.00 H new ATOM 0 HD2 LYS A 156 12.936 3.358 5.336 1.00 0.00 H new ATOM 0 HD3 LYS A 156 14.469 2.511 5.266 1.00 0.00 H new ATOM 0 HE2 LYS A 156 15.623 4.466 6.303 1.00 0.00 H new ATOM 0 HE3 LYS A 156 14.120 5.366 6.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 14.537 4.318 8.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 13.143 3.656 7.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 14.600 2.784 7.737 1.00 0.00 H new ATOM 240 N PHE A 157 11.155 2.496 1.508 1.00 0.00 N ATOM 241 CA PHE A 157 9.948 2.314 0.650 1.00 0.00 C ATOM 242 C PHE A 157 8.773 3.059 1.289 1.00 0.00 C ATOM 243 O PHE A 157 8.947 3.800 2.237 1.00 0.00 O ATOM 244 CB PHE A 157 9.611 0.823 0.547 1.00 0.00 C ATOM 245 CG PHE A 157 10.668 0.128 -0.272 1.00 0.00 C ATOM 246 CD1 PHE A 157 11.964 -0.019 0.238 1.00 0.00 C ATOM 247 CD2 PHE A 157 10.357 -0.363 -1.546 1.00 0.00 C ATOM 248 CE1 PHE A 157 12.951 -0.656 -0.525 1.00 0.00 C ATOM 249 CE2 PHE A 157 11.343 -1.003 -2.310 1.00 0.00 C ATOM 250 CZ PHE A 157 12.640 -1.149 -1.799 1.00 0.00 C ATOM 0 H PHE A 157 10.973 2.481 2.511 1.00 0.00 H new ATOM 0 HA PHE A 157 10.141 2.707 -0.348 1.00 0.00 H new ATOM 0 HB2 PHE A 157 9.557 0.381 1.542 1.00 0.00 H new ATOM 0 HB3 PHE A 157 8.632 0.691 0.086 1.00 0.00 H new ATOM 0 HD1 PHE A 157 12.203 0.359 1.221 1.00 0.00 H new ATOM 0 HD2 PHE A 157 9.358 -0.249 -1.940 1.00 0.00 H new ATOM 0 HE1 PHE A 157 13.951 -0.767 -0.132 1.00 0.00 H new ATOM 0 HE2 PHE A 157 11.103 -1.383 -3.292 1.00 0.00 H new ATOM 0 HZ PHE A 157 13.400 -1.642 -2.388 1.00 0.00 H new ATOM 260 N ALA A 158 7.581 2.876 0.790 1.00 0.00 N ATOM 261 CA ALA A 158 6.417 3.585 1.394 1.00 0.00 C ATOM 262 C ALA A 158 5.110 2.903 0.993 1.00 0.00 C ATOM 263 O ALA A 158 4.691 2.962 -0.145 1.00 0.00 O ATOM 264 CB ALA A 158 6.388 5.034 0.909 1.00 0.00 C ATOM 0 H ALA A 158 7.363 2.272 -0.003 1.00 0.00 H new ATOM 0 HA ALA A 158 6.520 3.556 2.479 1.00 0.00 H new ATOM 0 HB1 ALA A 158 5.536 5.549 1.352 1.00 0.00 H new ATOM 0 HB2 ALA A 158 7.309 5.535 1.205 1.00 0.00 H new ATOM 0 HB3 ALA A 158 6.298 5.052 -0.177 1.00 0.00 H new ATOM 270 N ALA A 159 4.450 2.276 1.925 1.00 0.00 N ATOM 271 CA ALA A 159 3.158 1.614 1.599 1.00 0.00 C ATOM 272 C ALA A 159 2.046 2.663 1.661 1.00 0.00 C ATOM 273 O ALA A 159 1.667 3.116 2.721 1.00 0.00 O ATOM 274 CB ALA A 159 2.879 0.504 2.615 1.00 0.00 C ATOM 0 H ALA A 159 4.749 2.193 2.897 1.00 0.00 H new ATOM 0 HA ALA A 159 3.202 1.176 0.602 1.00 0.00 H new ATOM 0 HB1 ALA A 159 1.932 0.020 2.375 1.00 0.00 H new ATOM 0 HB2 ALA A 159 3.682 -0.232 2.579 1.00 0.00 H new ATOM 0 HB3 ALA A 159 2.824 0.932 3.616 1.00 0.00 H new ATOM 280 N GLU A 160 1.531 3.066 0.533 1.00 0.00 N ATOM 281 CA GLU A 160 0.456 4.096 0.536 1.00 0.00 C ATOM 282 C GLU A 160 -0.692 3.647 -0.369 1.00 0.00 C ATOM 283 O GLU A 160 -0.500 2.911 -1.317 1.00 0.00 O ATOM 284 CB GLU A 160 1.023 5.423 0.024 1.00 0.00 C ATOM 285 CG GLU A 160 2.342 5.719 0.739 1.00 0.00 C ATOM 286 CD GLU A 160 2.951 7.007 0.181 1.00 0.00 C ATOM 287 OE1 GLU A 160 2.240 7.997 0.124 1.00 0.00 O ATOM 288 OE2 GLU A 160 4.115 6.980 -0.181 1.00 0.00 O ATOM 0 H GLU A 160 1.807 2.727 -0.389 1.00 0.00 H new ATOM 0 HA GLU A 160 0.082 4.226 1.552 1.00 0.00 H new ATOM 0 HB2 GLU A 160 1.184 5.372 -1.053 1.00 0.00 H new ATOM 0 HB3 GLU A 160 0.311 6.229 0.202 1.00 0.00 H new ATOM 0 HG2 GLU A 160 2.171 5.820 1.811 1.00 0.00 H new ATOM 0 HG3 GLU A 160 3.035 4.889 0.603 1.00 0.00 H new ATOM 295 N ILE A 161 -1.886 4.086 -0.081 1.00 0.00 N ATOM 296 CA ILE A 161 -3.050 3.690 -0.919 1.00 0.00 C ATOM 297 C ILE A 161 -3.978 4.895 -1.094 1.00 0.00 C ATOM 298 O ILE A 161 -4.304 5.582 -0.146 1.00 0.00 O ATOM 299 CB ILE A 161 -3.814 2.556 -0.230 1.00 0.00 C ATOM 300 CG1 ILE A 161 -5.094 2.255 -1.014 1.00 0.00 C ATOM 301 CG2 ILE A 161 -4.177 2.978 1.195 1.00 0.00 C ATOM 302 CD1 ILE A 161 -6.004 1.345 -0.186 1.00 0.00 C ATOM 0 H ILE A 161 -2.105 4.703 0.701 1.00 0.00 H new ATOM 0 HA ILE A 161 -2.700 3.351 -1.894 1.00 0.00 H new ATOM 0 HB ILE A 161 -3.189 1.664 -0.197 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.612 3.184 -1.253 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -4.848 1.775 -1.961 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -4.721 2.171 1.686 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -3.266 3.194 1.754 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -4.803 3.870 1.162 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -6.914 1.133 -0.747 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -5.485 0.411 0.030 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -6.262 1.842 0.749 1.00 0.00 H new ATOM 314 N ARG A 162 -4.407 5.156 -2.298 1.00 0.00 N ATOM 315 CA ARG A 162 -5.317 6.313 -2.527 1.00 0.00 C ATOM 316 C ARG A 162 -6.760 5.814 -2.571 1.00 0.00 C ATOM 317 O ARG A 162 -7.052 4.776 -3.129 1.00 0.00 O ATOM 318 CB ARG A 162 -4.973 6.989 -3.857 1.00 0.00 C ATOM 319 CG ARG A 162 -5.797 8.270 -4.004 1.00 0.00 C ATOM 320 CD ARG A 162 -4.876 9.431 -4.390 1.00 0.00 C ATOM 321 NE ARG A 162 -5.127 9.813 -5.808 1.00 0.00 N ATOM 322 CZ ARG A 162 -5.711 10.947 -6.084 1.00 0.00 C ATOM 323 NH1 ARG A 162 -6.996 11.083 -5.899 1.00 0.00 N ATOM 324 NH2 ARG A 162 -5.010 11.946 -6.547 1.00 0.00 N ATOM 0 H ARG A 162 -4.167 4.619 -3.132 1.00 0.00 H new ATOM 0 HA ARG A 162 -5.198 7.033 -1.718 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -3.909 7.222 -3.895 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -5.181 6.313 -4.686 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -6.566 8.134 -4.764 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -6.309 8.494 -3.068 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -5.054 10.284 -3.735 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.833 9.141 -4.259 1.00 0.00 H new ATOM 0 HE ARG A 162 -4.843 9.189 -6.563 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -7.545 10.302 -5.538 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -7.451 11.970 -6.115 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -4.006 11.840 -6.693 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -5.466 12.832 -6.763 1.00 0.00 H new ATOM 338 N ASP A 163 -7.667 6.542 -1.983 1.00 0.00 N ATOM 339 CA ASP A 163 -9.089 6.105 -1.990 1.00 0.00 C ATOM 340 C ASP A 163 -9.957 7.215 -2.594 1.00 0.00 C ATOM 341 O ASP A 163 -10.178 8.231 -1.967 1.00 0.00 O ATOM 342 CB ASP A 163 -9.539 5.835 -0.553 1.00 0.00 C ATOM 343 CG ASP A 163 -10.806 4.978 -0.567 1.00 0.00 C ATOM 344 OD1 ASP A 163 -11.389 4.836 -1.630 1.00 0.00 O ATOM 345 OD2 ASP A 163 -11.173 4.479 0.484 1.00 0.00 O ATOM 0 H ASP A 163 -7.485 7.421 -1.498 1.00 0.00 H new ATOM 0 HA ASP A 163 -9.192 5.197 -2.584 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -8.748 5.325 -0.003 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -9.730 6.776 -0.038 1.00 0.00 H new ATOM 350 N PRO A 164 -10.426 6.991 -3.797 1.00 0.00 N ATOM 351 CA PRO A 164 -11.274 7.965 -4.504 1.00 0.00 C ATOM 352 C PRO A 164 -12.699 7.933 -3.946 1.00 0.00 C ATOM 353 O PRO A 164 -13.410 8.917 -3.973 1.00 0.00 O ATOM 354 CB PRO A 164 -11.238 7.488 -5.959 1.00 0.00 C ATOM 355 CG PRO A 164 -10.854 5.989 -5.916 1.00 0.00 C ATOM 356 CD PRO A 164 -10.162 5.753 -4.560 1.00 0.00 C ATOM 0 HA PRO A 164 -10.931 8.994 -4.395 1.00 0.00 H new ATOM 0 HB2 PRO A 164 -12.207 7.627 -6.438 1.00 0.00 H new ATOM 0 HB3 PRO A 164 -10.512 8.059 -6.537 1.00 0.00 H new ATOM 0 HG2 PRO A 164 -11.738 5.359 -6.015 1.00 0.00 H new ATOM 0 HG3 PRO A 164 -10.188 5.735 -6.741 1.00 0.00 H new ATOM 0 HD2 PRO A 164 -10.569 4.878 -4.052 1.00 0.00 H new ATOM 0 HD3 PRO A 164 -9.093 5.582 -4.683 1.00 0.00 H new ATOM 364 N ALA A 165 -13.117 6.808 -3.435 1.00 0.00 N ATOM 365 CA ALA A 165 -14.490 6.711 -2.870 1.00 0.00 C ATOM 366 C ALA A 165 -14.596 7.615 -1.640 1.00 0.00 C ATOM 367 O ALA A 165 -15.663 8.072 -1.284 1.00 0.00 O ATOM 368 CB ALA A 165 -14.774 5.264 -2.465 1.00 0.00 C ATOM 0 H ALA A 165 -12.566 5.951 -3.385 1.00 0.00 H new ATOM 0 HA ALA A 165 -15.216 7.027 -3.619 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -15.780 5.193 -2.051 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -14.695 4.619 -3.340 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -14.050 4.947 -1.715 1.00 0.00 H new ATOM 374 N LYS A 166 -13.496 7.874 -0.988 1.00 0.00 N ATOM 375 CA LYS A 166 -13.533 8.746 0.219 1.00 0.00 C ATOM 376 C LYS A 166 -13.305 10.200 -0.196 1.00 0.00 C ATOM 377 O LYS A 166 -12.567 10.928 0.437 1.00 0.00 O ATOM 378 CB LYS A 166 -12.434 8.316 1.192 1.00 0.00 C ATOM 379 CG LYS A 166 -12.695 6.885 1.655 1.00 0.00 C ATOM 380 CD LYS A 166 -13.034 6.884 3.148 1.00 0.00 C ATOM 381 CE LYS A 166 -13.710 5.562 3.514 1.00 0.00 C ATOM 382 NZ LYS A 166 -14.458 5.720 4.795 1.00 0.00 N ATOM 0 H LYS A 166 -12.573 7.519 -1.239 1.00 0.00 H new ATOM 0 HA LYS A 166 -14.505 8.654 0.704 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -11.459 8.381 0.708 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -12.409 8.988 2.050 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -13.516 6.451 1.085 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -11.817 6.266 1.470 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -12.127 7.017 3.738 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -13.693 7.720 3.383 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -14.391 5.258 2.719 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -12.963 4.775 3.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -14.917 4.820 5.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -13.798 5.991 5.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -15.182 6.459 4.686 1.00 0.00 H new ATOM 396 N ASN A 167 -13.932 10.632 -1.255 1.00 0.00 N ATOM 397 CA ASN A 167 -13.748 12.039 -1.704 1.00 0.00 C ATOM 398 C ASN A 167 -12.266 12.289 -1.994 1.00 0.00 C ATOM 399 O ASN A 167 -11.783 13.400 -1.899 1.00 0.00 O ATOM 400 CB ASN A 167 -14.219 12.987 -0.599 1.00 0.00 C ATOM 401 CG ASN A 167 -14.930 14.189 -1.225 1.00 0.00 C ATOM 402 OD1 ASN A 167 -16.140 14.213 -1.318 1.00 0.00 O ATOM 403 ND2 ASN A 167 -14.221 15.193 -1.660 1.00 0.00 N ATOM 0 H ASN A 167 -14.563 10.072 -1.828 1.00 0.00 H new ATOM 0 HA ASN A 167 -14.330 12.215 -2.609 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -14.894 12.465 0.079 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -13.368 13.323 -0.006 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -14.683 16.000 -2.079 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -13.204 15.171 -1.581 1.00 0.00 H new ATOM 410 N GLY A 168 -11.540 11.264 -2.349 1.00 0.00 N ATOM 411 CA GLY A 168 -10.091 11.444 -2.645 1.00 0.00 C ATOM 412 C GLY A 168 -9.319 11.609 -1.334 1.00 0.00 C ATOM 413 O GLY A 168 -8.655 12.604 -1.115 1.00 0.00 O ATOM 0 H GLY A 168 -11.888 10.310 -2.447 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -9.712 10.584 -3.197 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -9.944 12.319 -3.278 1.00 0.00 H new ATOM 417 N ALA A 169 -9.401 10.643 -0.460 1.00 0.00 N ATOM 418 CA ALA A 169 -8.672 10.747 0.835 1.00 0.00 C ATOM 419 C ALA A 169 -7.407 9.887 0.781 1.00 0.00 C ATOM 420 O ALA A 169 -7.441 8.700 1.035 1.00 0.00 O ATOM 421 CB ALA A 169 -9.573 10.254 1.970 1.00 0.00 C ATOM 0 H ALA A 169 -9.941 9.787 -0.587 1.00 0.00 H new ATOM 0 HA ALA A 169 -8.398 11.787 1.013 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -9.039 10.330 2.917 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -10.474 10.866 2.011 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -9.848 9.215 1.791 1.00 0.00 H new ATOM 427 N ARG A 170 -6.291 10.478 0.454 1.00 0.00 N ATOM 428 CA ARG A 170 -5.026 9.696 0.388 1.00 0.00 C ATOM 429 C ARG A 170 -4.800 8.987 1.722 1.00 0.00 C ATOM 430 O ARG A 170 -5.388 9.338 2.726 1.00 0.00 O ATOM 431 CB ARG A 170 -3.861 10.646 0.112 1.00 0.00 C ATOM 432 CG ARG A 170 -4.087 11.352 -1.225 1.00 0.00 C ATOM 433 CD ARG A 170 -3.827 12.848 -1.059 1.00 0.00 C ATOM 434 NE ARG A 170 -3.140 13.368 -2.274 1.00 0.00 N ATOM 435 CZ ARG A 170 -3.833 13.939 -3.220 1.00 0.00 C ATOM 436 NH1 ARG A 170 -4.514 13.210 -4.060 1.00 0.00 N ATOM 437 NH2 ARG A 170 -3.847 15.240 -3.324 1.00 0.00 N ATOM 0 H ARG A 170 -6.201 11.469 0.230 1.00 0.00 H new ATOM 0 HA ARG A 170 -5.091 8.957 -0.410 1.00 0.00 H new ATOM 0 HB2 ARG A 170 -3.778 11.380 0.914 1.00 0.00 H new ATOM 0 HB3 ARG A 170 -2.923 10.092 0.089 1.00 0.00 H new ATOM 0 HG2 ARG A 170 -3.423 10.938 -1.984 1.00 0.00 H new ATOM 0 HG3 ARG A 170 -5.108 11.185 -1.569 1.00 0.00 H new ATOM 0 HD2 ARG A 170 -4.768 13.377 -0.905 1.00 0.00 H new ATOM 0 HD3 ARG A 170 -3.213 13.026 -0.176 1.00 0.00 H new ATOM 0 HE ARG A 170 -2.128 13.278 -2.366 1.00 0.00 H new ATOM 0 HH11 ARG A 170 -4.505 12.193 -3.977 1.00 0.00 H new ATOM 0 HH12 ARG A 170 -5.056 13.656 -4.800 1.00 0.00 H new ATOM 0 HH21 ARG A 170 -3.316 15.810 -2.666 1.00 0.00 H new ATOM 0 HH22 ARG A 170 -4.389 15.687 -4.064 1.00 0.00 H new ATOM 451 N VAL A 171 -3.958 7.990 1.749 1.00 0.00 N ATOM 452 CA VAL A 171 -3.712 7.269 3.027 1.00 0.00 C ATOM 453 C VAL A 171 -2.284 6.722 3.057 1.00 0.00 C ATOM 454 O VAL A 171 -2.010 5.647 2.561 1.00 0.00 O ATOM 455 CB VAL A 171 -4.701 6.110 3.148 1.00 0.00 C ATOM 456 CG1 VAL A 171 -4.315 5.232 4.340 1.00 0.00 C ATOM 457 CG2 VAL A 171 -6.112 6.665 3.357 1.00 0.00 C ATOM 0 H VAL A 171 -3.433 7.646 0.945 1.00 0.00 H new ATOM 0 HA VAL A 171 -3.845 7.960 3.859 1.00 0.00 H new ATOM 0 HB VAL A 171 -4.676 5.514 2.236 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -5.020 4.405 4.426 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -3.310 4.837 4.191 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -4.339 5.827 5.253 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -6.819 5.840 3.443 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -6.137 7.261 4.269 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -6.387 7.290 2.507 1.00 0.00 H new ATOM 467 N TRP A 172 -1.374 7.446 3.648 1.00 0.00 N ATOM 468 CA TRP A 172 0.032 6.958 3.725 1.00 0.00 C ATOM 469 C TRP A 172 0.134 5.943 4.867 1.00 0.00 C ATOM 470 O TRP A 172 0.098 6.298 6.029 1.00 0.00 O ATOM 471 CB TRP A 172 0.969 8.139 3.992 1.00 0.00 C ATOM 472 CG TRP A 172 2.387 7.664 4.019 1.00 0.00 C ATOM 473 CD1 TRP A 172 2.882 6.737 4.872 1.00 0.00 C ATOM 474 CD2 TRP A 172 3.503 8.075 3.174 1.00 0.00 C ATOM 475 NE1 TRP A 172 4.225 6.559 4.609 1.00 0.00 N ATOM 476 CE2 TRP A 172 4.655 7.356 3.572 1.00 0.00 C ATOM 477 CE3 TRP A 172 3.625 8.991 2.113 1.00 0.00 C ATOM 478 CZ2 TRP A 172 5.885 7.539 2.943 1.00 0.00 C ATOM 479 CZ3 TRP A 172 4.863 9.178 1.474 1.00 0.00 C ATOM 480 CH2 TRP A 172 5.991 8.453 1.889 1.00 0.00 C ATOM 0 H TRP A 172 -1.543 8.354 4.081 1.00 0.00 H new ATOM 0 HA TRP A 172 0.319 6.486 2.785 1.00 0.00 H new ATOM 0 HB2 TRP A 172 0.844 8.896 3.218 1.00 0.00 H new ATOM 0 HB3 TRP A 172 0.715 8.609 4.942 1.00 0.00 H new ATOM 0 HD1 TRP A 172 2.318 6.221 5.634 1.00 0.00 H new ATOM 0 HE1 TRP A 172 4.827 5.914 5.121 1.00 0.00 H new ATOM 0 HE3 TRP A 172 2.762 9.554 1.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 6.750 6.979 3.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 4.947 9.883 0.660 1.00 0.00 H new ATOM 0 HH2 TRP A 172 6.940 8.601 1.395 1.00 0.00 H new ATOM 491 N LEU A 173 0.249 4.683 4.548 1.00 0.00 N ATOM 492 CA LEU A 173 0.338 3.649 5.620 1.00 0.00 C ATOM 493 C LEU A 173 1.618 3.857 6.433 1.00 0.00 C ATOM 494 O LEU A 173 1.600 3.848 7.647 1.00 0.00 O ATOM 495 CB LEU A 173 0.346 2.251 4.995 1.00 0.00 C ATOM 496 CG LEU A 173 -0.810 2.123 3.998 1.00 0.00 C ATOM 497 CD1 LEU A 173 -0.671 0.815 3.217 1.00 0.00 C ATOM 498 CD2 LEU A 173 -2.140 2.124 4.758 1.00 0.00 C ATOM 0 H LEU A 173 0.285 4.324 3.594 1.00 0.00 H new ATOM 0 HA LEU A 173 -0.526 3.742 6.278 1.00 0.00 H new ATOM 0 HB2 LEU A 173 1.296 2.074 4.490 1.00 0.00 H new ATOM 0 HB3 LEU A 173 0.253 1.494 5.774 1.00 0.00 H new ATOM 0 HG LEU A 173 -0.785 2.963 3.304 1.00 0.00 H new ATOM 0 HD11 LEU A 173 -1.494 0.725 2.508 1.00 0.00 H new ATOM 0 HD12 LEU A 173 0.275 0.813 2.676 1.00 0.00 H new ATOM 0 HD13 LEU A 173 -0.695 -0.027 3.909 1.00 0.00 H new ATOM 0 HD21 LEU A 173 -2.964 2.033 4.050 1.00 0.00 H new ATOM 0 HD22 LEU A 173 -2.163 1.284 5.452 1.00 0.00 H new ATOM 0 HD23 LEU A 173 -2.241 3.056 5.314 1.00 0.00 H new ATOM 510 N GLY A 174 2.731 4.047 5.776 1.00 0.00 N ATOM 511 CA GLY A 174 4.004 4.259 6.522 1.00 0.00 C ATOM 512 C GLY A 174 5.181 3.745 5.694 1.00 0.00 C ATOM 513 O GLY A 174 5.027 2.911 4.825 1.00 0.00 O ATOM 0 H GLY A 174 2.813 4.064 4.759 1.00 0.00 H new ATOM 0 HA2 GLY A 174 4.136 5.319 6.740 1.00 0.00 H new ATOM 0 HA3 GLY A 174 3.966 3.739 7.479 1.00 0.00 H new ATOM 517 N THR A 175 6.361 4.243 5.957 1.00 0.00 N ATOM 518 CA THR A 175 7.551 3.789 5.184 1.00 0.00 C ATOM 519 C THR A 175 7.978 2.409 5.682 1.00 0.00 C ATOM 520 O THR A 175 7.686 2.022 6.796 1.00 0.00 O ATOM 521 CB THR A 175 8.706 4.780 5.366 1.00 0.00 C ATOM 522 OG1 THR A 175 9.538 4.344 6.433 1.00 0.00 O ATOM 523 CG2 THR A 175 8.157 6.174 5.678 1.00 0.00 C ATOM 0 H THR A 175 6.550 4.944 6.673 1.00 0.00 H new ATOM 0 HA THR A 175 7.294 3.736 4.126 1.00 0.00 H new ATOM 0 HB THR A 175 9.287 4.827 4.445 1.00 0.00 H new ATOM 0 HG1 THR A 175 10.278 4.976 6.550 1.00 0.00 H new ATOM 0 HG21 THR A 175 8.985 6.871 5.806 1.00 0.00 H new ATOM 0 HG22 THR A 175 7.525 6.508 4.856 1.00 0.00 H new ATOM 0 HG23 THR A 175 7.570 6.137 6.595 1.00 0.00 H new ATOM 531 N PHE A 176 8.665 1.661 4.865 1.00 0.00 N ATOM 532 CA PHE A 176 9.105 0.304 5.291 1.00 0.00 C ATOM 533 C PHE A 176 10.583 0.113 4.941 1.00 0.00 C ATOM 534 O PHE A 176 11.209 0.975 4.358 1.00 0.00 O ATOM 535 CB PHE A 176 8.265 -0.747 4.568 1.00 0.00 C ATOM 536 CG PHE A 176 6.876 -0.758 5.157 1.00 0.00 C ATOM 537 CD1 PHE A 176 5.930 0.187 4.738 1.00 0.00 C ATOM 538 CD2 PHE A 176 6.535 -1.709 6.127 1.00 0.00 C ATOM 539 CE1 PHE A 176 4.642 0.180 5.289 1.00 0.00 C ATOM 540 CE2 PHE A 176 5.249 -1.715 6.678 1.00 0.00 C ATOM 541 CZ PHE A 176 4.301 -0.772 6.260 1.00 0.00 C ATOM 0 H PHE A 176 8.941 1.931 3.921 1.00 0.00 H new ATOM 0 HA PHE A 176 8.974 0.197 6.368 1.00 0.00 H new ATOM 0 HB2 PHE A 176 8.220 -0.524 3.502 1.00 0.00 H new ATOM 0 HB3 PHE A 176 8.724 -1.730 4.669 1.00 0.00 H new ATOM 0 HD1 PHE A 176 6.194 0.921 3.990 1.00 0.00 H new ATOM 0 HD2 PHE A 176 7.264 -2.437 6.449 1.00 0.00 H new ATOM 0 HE1 PHE A 176 3.912 0.908 4.966 1.00 0.00 H new ATOM 0 HE2 PHE A 176 4.987 -2.448 7.427 1.00 0.00 H new ATOM 0 HZ PHE A 176 3.308 -0.778 6.685 1.00 0.00 H new ATOM 551 N GLU A 177 11.148 -1.010 5.295 1.00 0.00 N ATOM 552 CA GLU A 177 12.587 -1.250 4.984 1.00 0.00 C ATOM 553 C GLU A 177 12.730 -1.745 3.543 1.00 0.00 C ATOM 554 O GLU A 177 13.718 -1.483 2.884 1.00 0.00 O ATOM 555 CB GLU A 177 13.151 -2.302 5.943 1.00 0.00 C ATOM 556 CG GLU A 177 12.145 -3.444 6.099 1.00 0.00 C ATOM 557 CD GLU A 177 12.878 -4.712 6.539 1.00 0.00 C ATOM 558 OE1 GLU A 177 13.929 -4.586 7.146 1.00 0.00 O ATOM 559 OE2 GLU A 177 12.375 -5.789 6.263 1.00 0.00 O ATOM 0 H GLU A 177 10.677 -1.770 5.785 1.00 0.00 H new ATOM 0 HA GLU A 177 13.139 -0.317 5.101 1.00 0.00 H new ATOM 0 HB2 GLU A 177 14.097 -2.686 5.562 1.00 0.00 H new ATOM 0 HB3 GLU A 177 13.358 -1.851 6.913 1.00 0.00 H new ATOM 0 HG2 GLU A 177 11.386 -3.176 6.834 1.00 0.00 H new ATOM 0 HG3 GLU A 177 11.628 -3.619 5.156 1.00 0.00 H new ATOM 566 N THR A 178 11.758 -2.460 3.046 1.00 0.00 N ATOM 567 CA THR A 178 11.852 -2.967 1.648 1.00 0.00 C ATOM 568 C THR A 178 10.480 -2.883 0.973 1.00 0.00 C ATOM 569 O THR A 178 9.494 -2.529 1.588 1.00 0.00 O ATOM 570 CB THR A 178 12.324 -4.424 1.663 1.00 0.00 C ATOM 571 OG1 THR A 178 11.227 -5.273 1.971 1.00 0.00 O ATOM 572 CG2 THR A 178 13.418 -4.597 2.717 1.00 0.00 C ATOM 0 H THR A 178 10.906 -2.714 3.546 1.00 0.00 H new ATOM 0 HA THR A 178 12.565 -2.358 1.092 1.00 0.00 H new ATOM 0 HB THR A 178 12.723 -4.687 0.683 1.00 0.00 H new ATOM 0 HG1 THR A 178 11.132 -5.345 2.944 1.00 0.00 H new ATOM 0 HG21 THR A 178 13.753 -5.634 2.727 1.00 0.00 H new ATOM 0 HG22 THR A 178 14.259 -3.946 2.479 1.00 0.00 H new ATOM 0 HG23 THR A 178 13.023 -4.334 3.698 1.00 0.00 H new ATOM 580 N ALA A 179 10.411 -3.204 -0.291 1.00 0.00 N ATOM 581 CA ALA A 179 9.108 -3.143 -1.010 1.00 0.00 C ATOM 582 C ALA A 179 8.227 -4.317 -0.579 1.00 0.00 C ATOM 583 O ALA A 179 7.022 -4.276 -0.706 1.00 0.00 O ATOM 584 CB ALA A 179 9.356 -3.227 -2.516 1.00 0.00 C ATOM 0 H ALA A 179 11.204 -3.507 -0.857 1.00 0.00 H new ATOM 0 HA ALA A 179 8.607 -2.205 -0.770 1.00 0.00 H new ATOM 0 HB1 ALA A 179 8.404 -3.183 -3.045 1.00 0.00 H new ATOM 0 HB2 ALA A 179 9.984 -2.393 -2.828 1.00 0.00 H new ATOM 0 HB3 ALA A 179 9.858 -4.166 -2.750 1.00 0.00 H new ATOM 590 N GLU A 180 8.820 -5.366 -0.081 1.00 0.00 N ATOM 591 CA GLU A 180 8.012 -6.544 0.350 1.00 0.00 C ATOM 592 C GLU A 180 7.223 -6.196 1.612 1.00 0.00 C ATOM 593 O GLU A 180 6.035 -6.433 1.698 1.00 0.00 O ATOM 594 CB GLU A 180 8.946 -7.721 0.640 1.00 0.00 C ATOM 595 CG GLU A 180 8.119 -8.989 0.856 1.00 0.00 C ATOM 596 CD GLU A 180 9.048 -10.204 0.880 1.00 0.00 C ATOM 597 OE1 GLU A 180 9.981 -10.226 0.095 1.00 0.00 O ATOM 598 OE2 GLU A 180 8.811 -11.091 1.684 1.00 0.00 O ATOM 0 H GLU A 180 9.828 -5.460 0.047 1.00 0.00 H new ATOM 0 HA GLU A 180 7.317 -6.815 -0.444 1.00 0.00 H new ATOM 0 HB2 GLU A 180 9.638 -7.863 -0.190 1.00 0.00 H new ATOM 0 HB3 GLU A 180 9.548 -7.512 1.524 1.00 0.00 H new ATOM 0 HG2 GLU A 180 7.567 -8.921 1.793 1.00 0.00 H new ATOM 0 HG3 GLU A 180 7.383 -9.096 0.060 1.00 0.00 H new ATOM 605 N ASP A 181 7.874 -5.641 2.590 1.00 0.00 N ATOM 606 CA ASP A 181 7.163 -5.280 3.848 1.00 0.00 C ATOM 607 C ASP A 181 6.115 -4.205 3.555 1.00 0.00 C ATOM 608 O ASP A 181 4.966 -4.328 3.931 1.00 0.00 O ATOM 609 CB ASP A 181 8.172 -4.747 4.866 1.00 0.00 C ATOM 610 CG ASP A 181 9.489 -5.512 4.736 1.00 0.00 C ATOM 611 OD1 ASP A 181 9.559 -6.622 5.236 1.00 0.00 O ATOM 612 OD2 ASP A 181 10.407 -4.975 4.137 1.00 0.00 O ATOM 0 H ASP A 181 8.870 -5.420 2.575 1.00 0.00 H new ATOM 0 HA ASP A 181 6.669 -6.164 4.253 1.00 0.00 H new ATOM 0 HB2 ASP A 181 8.341 -3.683 4.702 1.00 0.00 H new ATOM 0 HB3 ASP A 181 7.776 -4.855 5.876 1.00 0.00 H new ATOM 617 N ALA A 182 6.499 -3.151 2.888 1.00 0.00 N ATOM 618 CA ALA A 182 5.520 -2.073 2.575 1.00 0.00 C ATOM 619 C ALA A 182 4.334 -2.666 1.817 1.00 0.00 C ATOM 620 O ALA A 182 3.191 -2.483 2.187 1.00 0.00 O ATOM 621 CB ALA A 182 6.195 -1.001 1.716 1.00 0.00 C ATOM 0 H ALA A 182 7.447 -2.990 2.547 1.00 0.00 H new ATOM 0 HA ALA A 182 5.168 -1.622 3.503 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.478 -0.213 1.488 1.00 0.00 H new ATOM 0 HB2 ALA A 182 7.039 -0.577 2.260 1.00 0.00 H new ATOM 0 HB3 ALA A 182 6.550 -1.449 0.788 1.00 0.00 H new ATOM 627 N ALA A 183 4.599 -3.377 0.761 1.00 0.00 N ATOM 628 CA ALA A 183 3.491 -3.988 -0.025 1.00 0.00 C ATOM 629 C ALA A 183 2.587 -4.788 0.912 1.00 0.00 C ATOM 630 O ALA A 183 1.376 -4.739 0.811 1.00 0.00 O ATOM 631 CB ALA A 183 4.071 -4.919 -1.095 1.00 0.00 C ATOM 0 H ALA A 183 5.537 -3.563 0.406 1.00 0.00 H new ATOM 0 HA ALA A 183 2.912 -3.201 -0.508 1.00 0.00 H new ATOM 0 HB1 ALA A 183 3.258 -5.365 -1.669 1.00 0.00 H new ATOM 0 HB2 ALA A 183 4.716 -4.348 -1.763 1.00 0.00 H new ATOM 0 HB3 ALA A 183 4.652 -5.707 -0.616 1.00 0.00 H new ATOM 637 N LEU A 184 3.161 -5.522 1.828 1.00 0.00 N ATOM 638 CA LEU A 184 2.327 -6.319 2.769 1.00 0.00 C ATOM 639 C LEU A 184 1.412 -5.377 3.549 1.00 0.00 C ATOM 640 O LEU A 184 0.249 -5.655 3.761 1.00 0.00 O ATOM 641 CB LEU A 184 3.229 -7.076 3.745 1.00 0.00 C ATOM 642 CG LEU A 184 2.370 -7.992 4.620 1.00 0.00 C ATOM 643 CD1 LEU A 184 1.896 -9.189 3.795 1.00 0.00 C ATOM 644 CD2 LEU A 184 3.197 -8.488 5.809 1.00 0.00 C ATOM 0 H LEU A 184 4.169 -5.603 1.964 1.00 0.00 H new ATOM 0 HA LEU A 184 1.727 -7.034 2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 184 3.965 -7.663 3.197 1.00 0.00 H new ATOM 0 HB3 LEU A 184 3.782 -6.373 4.368 1.00 0.00 H new ATOM 0 HG LEU A 184 1.506 -7.437 4.985 1.00 0.00 H new ATOM 0 HD11 LEU A 184 1.284 -9.841 4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 184 1.305 -8.837 2.949 1.00 0.00 H new ATOM 0 HD13 LEU A 184 2.760 -9.743 3.428 1.00 0.00 H new ATOM 0 HD21 LEU A 184 2.584 -9.140 6.431 1.00 0.00 H new ATOM 0 HD22 LEU A 184 4.062 -9.042 5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 184 3.534 -7.635 6.399 1.00 0.00 H new ATOM 656 N ALA A 185 1.931 -4.260 3.972 1.00 0.00 N ATOM 657 CA ALA A 185 1.095 -3.290 4.733 1.00 0.00 C ATOM 658 C ALA A 185 0.050 -2.684 3.796 1.00 0.00 C ATOM 659 O ALA A 185 -0.975 -2.195 4.226 1.00 0.00 O ATOM 660 CB ALA A 185 1.986 -2.178 5.295 1.00 0.00 C ATOM 0 H ALA A 185 2.899 -3.976 3.824 1.00 0.00 H new ATOM 0 HA ALA A 185 0.596 -3.802 5.556 1.00 0.00 H new ATOM 0 HB1 ALA A 185 1.374 -1.468 5.852 1.00 0.00 H new ATOM 0 HB2 ALA A 185 2.734 -2.612 5.959 1.00 0.00 H new ATOM 0 HB3 ALA A 185 2.485 -1.662 4.475 1.00 0.00 H new ATOM 666 N TYR A 186 0.302 -2.715 2.515 1.00 0.00 N ATOM 667 CA TYR A 186 -0.676 -2.142 1.550 1.00 0.00 C ATOM 668 C TYR A 186 -1.904 -3.049 1.477 1.00 0.00 C ATOM 669 O TYR A 186 -3.019 -2.589 1.343 1.00 0.00 O ATOM 670 CB TYR A 186 -0.035 -2.050 0.165 1.00 0.00 C ATOM 671 CG TYR A 186 -1.082 -1.647 -0.845 1.00 0.00 C ATOM 672 CD1 TYR A 186 -1.951 -2.610 -1.374 1.00 0.00 C ATOM 673 CD2 TYR A 186 -1.187 -0.310 -1.250 1.00 0.00 C ATOM 674 CE1 TYR A 186 -2.926 -2.236 -2.307 1.00 0.00 C ATOM 675 CE2 TYR A 186 -2.161 0.063 -2.184 1.00 0.00 C ATOM 676 CZ TYR A 186 -3.031 -0.899 -2.713 1.00 0.00 C ATOM 677 OH TYR A 186 -3.992 -0.531 -3.632 1.00 0.00 O ATOM 0 H TYR A 186 1.143 -3.113 2.097 1.00 0.00 H new ATOM 0 HA TYR A 186 -0.972 -1.147 1.881 1.00 0.00 H new ATOM 0 HB2 TYR A 186 0.776 -1.322 0.175 1.00 0.00 H new ATOM 0 HB3 TYR A 186 0.402 -3.010 -0.110 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -1.869 -3.641 -1.062 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -0.517 0.432 -0.842 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -3.597 -2.978 -2.714 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -2.242 1.094 -2.497 1.00 0.00 H new ATOM 0 HH TYR A 186 -3.929 0.432 -3.803 1.00 0.00 H new ATOM 687 N ASP A 187 -1.705 -4.332 1.560 1.00 0.00 N ATOM 688 CA ASP A 187 -2.852 -5.272 1.496 1.00 0.00 C ATOM 689 C ASP A 187 -3.746 -5.069 2.718 1.00 0.00 C ATOM 690 O ASP A 187 -4.946 -4.913 2.608 1.00 0.00 O ATOM 691 CB ASP A 187 -2.318 -6.700 1.491 1.00 0.00 C ATOM 692 CG ASP A 187 -1.267 -6.848 0.389 1.00 0.00 C ATOM 693 OD1 ASP A 187 -1.050 -5.886 -0.329 1.00 0.00 O ATOM 694 OD2 ASP A 187 -0.696 -7.920 0.284 1.00 0.00 O ATOM 0 H ASP A 187 -0.791 -4.772 1.670 1.00 0.00 H new ATOM 0 HA ASP A 187 -3.431 -5.088 0.591 1.00 0.00 H new ATOM 0 HB2 ASP A 187 -1.880 -6.939 2.460 1.00 0.00 H new ATOM 0 HB3 ASP A 187 -3.134 -7.404 1.327 1.00 0.00 H new ATOM 699 N ARG A 188 -3.166 -5.078 3.882 1.00 0.00 N ATOM 700 CA ARG A 188 -3.970 -4.894 5.123 1.00 0.00 C ATOM 701 C ARG A 188 -4.816 -3.623 5.018 1.00 0.00 C ATOM 702 O ARG A 188 -5.921 -3.563 5.522 1.00 0.00 O ATOM 703 CB ARG A 188 -3.033 -4.782 6.325 1.00 0.00 C ATOM 704 CG ARG A 188 -3.840 -4.928 7.616 1.00 0.00 C ATOM 705 CD ARG A 188 -3.408 -6.199 8.351 1.00 0.00 C ATOM 706 NE ARG A 188 -1.991 -6.062 8.793 1.00 0.00 N ATOM 707 CZ ARG A 188 -1.082 -6.874 8.327 1.00 0.00 C ATOM 708 NH1 ARG A 188 -1.134 -8.145 8.614 1.00 0.00 N ATOM 709 NH2 ARG A 188 -0.120 -6.413 7.574 1.00 0.00 N ATOM 0 H ARG A 188 -2.165 -5.205 4.030 1.00 0.00 H new ATOM 0 HA ARG A 188 -4.630 -5.752 5.249 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -2.265 -5.554 6.274 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -2.520 -3.821 6.311 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -3.686 -4.057 8.253 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -4.905 -4.972 7.388 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -4.054 -6.371 9.212 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -3.514 -7.064 7.696 1.00 0.00 H new ATOM 0 HE ARG A 188 -1.732 -5.334 9.459 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -1.885 -8.505 9.203 1.00 0.00 H new ATOM 0 HH12 ARG A 188 -0.423 -8.780 8.250 1.00 0.00 H new ATOM 0 HH21 ARG A 188 -0.079 -5.419 7.350 1.00 0.00 H new ATOM 0 HH22 ARG A 188 0.591 -7.047 7.209 1.00 0.00 H new ATOM 723 N ALA A 189 -4.312 -2.604 4.378 1.00 0.00 N ATOM 724 CA ALA A 189 -5.098 -1.342 4.259 1.00 0.00 C ATOM 725 C ALA A 189 -5.996 -1.409 3.022 1.00 0.00 C ATOM 726 O ALA A 189 -6.967 -0.689 2.909 1.00 0.00 O ATOM 727 CB ALA A 189 -4.143 -0.155 4.129 1.00 0.00 C ATOM 0 H ALA A 189 -3.394 -2.589 3.934 1.00 0.00 H new ATOM 0 HA ALA A 189 -5.715 -1.218 5.149 1.00 0.00 H new ATOM 0 HB1 ALA A 189 -4.718 0.767 4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 189 -3.505 -0.103 5.011 1.00 0.00 H new ATOM 0 HB3 ALA A 189 -3.524 -0.282 3.241 1.00 0.00 H new ATOM 733 N ALA A 190 -5.683 -2.271 2.096 1.00 0.00 N ATOM 734 CA ALA A 190 -6.522 -2.383 0.872 1.00 0.00 C ATOM 735 C ALA A 190 -7.590 -3.456 1.091 1.00 0.00 C ATOM 736 O ALA A 190 -8.461 -3.655 0.269 1.00 0.00 O ATOM 737 CB ALA A 190 -5.643 -2.767 -0.319 1.00 0.00 C ATOM 0 H ALA A 190 -4.883 -2.902 2.134 1.00 0.00 H new ATOM 0 HA ALA A 190 -7.002 -1.426 0.668 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -6.259 -2.849 -1.215 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -4.882 -2.002 -0.471 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -5.161 -3.725 -0.122 1.00 0.00 H new ATOM 743 N PHE A 191 -7.535 -4.144 2.198 1.00 0.00 N ATOM 744 CA PHE A 191 -8.555 -5.191 2.474 1.00 0.00 C ATOM 745 C PHE A 191 -9.559 -4.639 3.479 1.00 0.00 C ATOM 746 O PHE A 191 -10.735 -4.940 3.435 1.00 0.00 O ATOM 747 CB PHE A 191 -7.875 -6.428 3.064 1.00 0.00 C ATOM 748 CG PHE A 191 -8.667 -7.657 2.701 1.00 0.00 C ATOM 749 CD1 PHE A 191 -9.895 -7.901 3.325 1.00 0.00 C ATOM 750 CD2 PHE A 191 -8.176 -8.552 1.743 1.00 0.00 C ATOM 751 CE1 PHE A 191 -10.636 -9.042 2.993 1.00 0.00 C ATOM 752 CE2 PHE A 191 -8.916 -9.694 1.410 1.00 0.00 C ATOM 753 CZ PHE A 191 -10.146 -9.940 2.035 1.00 0.00 C ATOM 0 H PHE A 191 -6.827 -4.025 2.923 1.00 0.00 H new ATOM 0 HA PHE A 191 -9.062 -5.468 1.550 1.00 0.00 H new ATOM 0 HB2 PHE A 191 -6.857 -6.513 2.684 1.00 0.00 H new ATOM 0 HB3 PHE A 191 -7.804 -6.335 4.148 1.00 0.00 H new ATOM 0 HD1 PHE A 191 -10.272 -7.209 4.063 1.00 0.00 H new ATOM 0 HD2 PHE A 191 -7.228 -8.362 1.261 1.00 0.00 H new ATOM 0 HE1 PHE A 191 -11.584 -9.230 3.475 1.00 0.00 H new ATOM 0 HE2 PHE A 191 -8.538 -10.385 0.671 1.00 0.00 H new ATOM 0 HZ PHE A 191 -10.716 -10.821 1.779 1.00 0.00 H new ATOM 763 N ARG A 192 -9.097 -3.821 4.382 1.00 0.00 N ATOM 764 CA ARG A 192 -10.010 -3.228 5.390 1.00 0.00 C ATOM 765 C ARG A 192 -10.763 -2.067 4.746 1.00 0.00 C ATOM 766 O ARG A 192 -11.945 -1.879 4.956 1.00 0.00 O ATOM 767 CB ARG A 192 -9.187 -2.708 6.569 1.00 0.00 C ATOM 768 CG ARG A 192 -10.034 -2.763 7.843 1.00 0.00 C ATOM 769 CD ARG A 192 -9.222 -2.222 9.021 1.00 0.00 C ATOM 770 NE ARG A 192 -10.104 -2.099 10.215 1.00 0.00 N ATOM 771 CZ ARG A 192 -9.788 -1.273 11.175 1.00 0.00 C ATOM 772 NH1 ARG A 192 -8.559 -1.222 11.610 1.00 0.00 N ATOM 773 NH2 ARG A 192 -10.700 -0.501 11.699 1.00 0.00 N ATOM 0 H ARG A 192 -8.120 -3.538 4.463 1.00 0.00 H new ATOM 0 HA ARG A 192 -10.717 -3.979 5.744 1.00 0.00 H new ATOM 0 HB2 ARG A 192 -8.286 -3.309 6.692 1.00 0.00 H new ATOM 0 HB3 ARG A 192 -8.863 -1.685 6.378 1.00 0.00 H new ATOM 0 HG2 ARG A 192 -10.943 -2.175 7.714 1.00 0.00 H new ATOM 0 HG3 ARG A 192 -10.344 -3.789 8.042 1.00 0.00 H new ATOM 0 HD2 ARG A 192 -8.388 -2.889 9.239 1.00 0.00 H new ATOM 0 HD3 ARG A 192 -8.796 -1.251 8.768 1.00 0.00 H new ATOM 0 HE ARG A 192 -10.954 -2.659 10.282 1.00 0.00 H new ATOM 0 HH11 ARG A 192 -7.847 -1.827 11.200 1.00 0.00 H new ATOM 0 HH12 ARG A 192 -8.310 -0.577 12.360 1.00 0.00 H new ATOM 0 HH21 ARG A 192 -11.661 -0.543 11.358 1.00 0.00 H new ATOM 0 HH22 ARG A 192 -10.452 0.144 12.449 1.00 0.00 H new ATOM 787 N MET A 193 -10.078 -1.290 3.957 1.00 0.00 N ATOM 788 CA MET A 193 -10.732 -0.136 3.282 1.00 0.00 C ATOM 789 C MET A 193 -11.438 -0.615 2.013 1.00 0.00 C ATOM 790 O MET A 193 -12.431 -0.055 1.594 1.00 0.00 O ATOM 791 CB MET A 193 -9.669 0.895 2.905 1.00 0.00 C ATOM 792 CG MET A 193 -10.335 2.254 2.676 1.00 0.00 C ATOM 793 SD MET A 193 -9.231 3.571 3.242 1.00 0.00 S ATOM 794 CE MET A 193 -7.862 3.225 2.109 1.00 0.00 C ATOM 0 H MET A 193 -9.086 -1.405 3.749 1.00 0.00 H new ATOM 0 HA MET A 193 -11.461 0.312 3.957 1.00 0.00 H new ATOM 0 HB2 MET A 193 -8.924 0.972 3.697 1.00 0.00 H new ATOM 0 HB3 MET A 193 -9.144 0.579 2.004 1.00 0.00 H new ATOM 0 HG2 MET A 193 -10.563 2.386 1.618 1.00 0.00 H new ATOM 0 HG3 MET A 193 -11.282 2.302 3.214 1.00 0.00 H new ATOM 0 HE1 MET A 193 -7.408 4.163 1.790 1.00 0.00 H new ATOM 0 HE2 MET A 193 -7.115 2.615 2.617 1.00 0.00 H new ATOM 0 HE3 MET A 193 -8.238 2.689 1.238 1.00 0.00 H new ATOM 804 N ARG A 194 -10.931 -1.644 1.394 1.00 0.00 N ATOM 805 CA ARG A 194 -11.570 -2.154 0.149 1.00 0.00 C ATOM 806 C ARG A 194 -12.434 -3.371 0.482 1.00 0.00 C ATOM 807 O ARG A 194 -13.183 -3.855 -0.344 1.00 0.00 O ATOM 808 CB ARG A 194 -10.484 -2.555 -0.849 1.00 0.00 C ATOM 809 CG ARG A 194 -10.890 -2.112 -2.254 1.00 0.00 C ATOM 810 CD ARG A 194 -9.777 -2.465 -3.242 1.00 0.00 C ATOM 811 NE ARG A 194 -9.410 -1.252 -4.026 1.00 0.00 N ATOM 812 CZ ARG A 194 -8.230 -1.161 -4.574 1.00 0.00 C ATOM 813 NH1 ARG A 194 -7.665 -2.219 -5.088 1.00 0.00 N ATOM 814 NH2 ARG A 194 -7.613 -0.011 -4.606 1.00 0.00 N ATOM 0 H ARG A 194 -10.101 -2.154 1.696 1.00 0.00 H new ATOM 0 HA ARG A 194 -12.195 -1.375 -0.287 1.00 0.00 H new ATOM 0 HB2 ARG A 194 -9.535 -2.097 -0.572 1.00 0.00 H new ATOM 0 HB3 ARG A 194 -10.335 -3.635 -0.826 1.00 0.00 H new ATOM 0 HG2 ARG A 194 -11.819 -2.601 -2.547 1.00 0.00 H new ATOM 0 HG3 ARG A 194 -11.077 -1.038 -2.269 1.00 0.00 H new ATOM 0 HD2 ARG A 194 -8.906 -2.843 -2.706 1.00 0.00 H new ATOM 0 HD3 ARG A 194 -10.108 -3.258 -3.912 1.00 0.00 H new ATOM 0 HE ARG A 194 -10.082 -0.492 -4.134 1.00 0.00 H new ATOM 0 HH11 ARG A 194 -8.146 -3.118 -5.061 1.00 0.00 H new ATOM 0 HH12 ARG A 194 -6.742 -2.147 -5.516 1.00 0.00 H new ATOM 0 HH21 ARG A 194 -8.054 0.816 -4.203 1.00 0.00 H new ATOM 0 HH22 ARG A 194 -6.690 0.061 -5.034 1.00 0.00 H new ATOM 828 N GLY A 195 -12.335 -3.866 1.685 1.00 0.00 N ATOM 829 CA GLY A 195 -13.150 -5.053 2.074 1.00 0.00 C ATOM 830 C GLY A 195 -13.153 -6.072 0.933 1.00 0.00 C ATOM 831 O GLY A 195 -12.339 -6.011 0.032 1.00 0.00 O ATOM 0 H GLY A 195 -11.725 -3.500 2.416 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -12.742 -5.506 2.978 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -14.170 -4.746 2.303 1.00 0.00 H new ATOM 835 N SER A 196 -14.063 -7.006 0.961 1.00 0.00 N ATOM 836 CA SER A 196 -14.118 -8.026 -0.125 1.00 0.00 C ATOM 837 C SER A 196 -12.720 -8.596 -0.363 1.00 0.00 C ATOM 838 O SER A 196 -11.774 -8.258 0.322 1.00 0.00 O ATOM 839 CB SER A 196 -14.627 -7.373 -1.411 1.00 0.00 C ATOM 840 OG SER A 196 -15.956 -7.806 -1.662 1.00 0.00 O ATOM 0 H SER A 196 -14.771 -7.107 1.688 1.00 0.00 H new ATOM 0 HA SER A 196 -14.793 -8.831 0.167 1.00 0.00 H new ATOM 0 HB2 SER A 196 -14.597 -6.287 -1.318 1.00 0.00 H new ATOM 0 HB3 SER A 196 -13.981 -7.639 -2.248 1.00 0.00 H new ATOM 0 HG SER A 196 -16.286 -7.388 -2.485 1.00 0.00 H new ATOM 846 N ARG A 197 -12.581 -9.461 -1.330 1.00 0.00 N ATOM 847 CA ARG A 197 -11.245 -10.054 -1.614 1.00 0.00 C ATOM 848 C ARG A 197 -10.243 -8.936 -1.904 1.00 0.00 C ATOM 849 O ARG A 197 -9.149 -8.917 -1.376 1.00 0.00 O ATOM 850 CB ARG A 197 -11.349 -10.980 -2.828 1.00 0.00 C ATOM 851 CG ARG A 197 -12.626 -11.814 -2.721 1.00 0.00 C ATOM 852 CD ARG A 197 -12.342 -13.246 -3.183 1.00 0.00 C ATOM 853 NE ARG A 197 -13.404 -13.683 -4.133 1.00 0.00 N ATOM 854 CZ ARG A 197 -13.219 -13.568 -5.420 1.00 0.00 C ATOM 855 NH1 ARG A 197 -12.925 -12.406 -5.937 1.00 0.00 N ATOM 856 NH2 ARG A 197 -13.328 -14.616 -6.191 1.00 0.00 N ATOM 0 H ARG A 197 -13.336 -9.783 -1.936 1.00 0.00 H new ATOM 0 HA ARG A 197 -10.907 -10.626 -0.750 1.00 0.00 H new ATOM 0 HB2 ARG A 197 -11.360 -10.394 -3.747 1.00 0.00 H new ATOM 0 HB3 ARG A 197 -10.478 -11.633 -2.877 1.00 0.00 H new ATOM 0 HG2 ARG A 197 -12.986 -11.817 -1.692 1.00 0.00 H new ATOM 0 HG3 ARG A 197 -13.413 -11.373 -3.332 1.00 0.00 H new ATOM 0 HD2 ARG A 197 -11.365 -13.297 -3.665 1.00 0.00 H new ATOM 0 HD3 ARG A 197 -12.309 -13.917 -2.324 1.00 0.00 H new ATOM 0 HE ARG A 197 -14.277 -14.073 -3.777 1.00 0.00 H new ATOM 0 HH11 ARG A 197 -12.840 -11.587 -5.335 1.00 0.00 H new ATOM 0 HH12 ARG A 197 -12.781 -12.317 -6.943 1.00 0.00 H new ATOM 0 HH21 ARG A 197 -13.558 -15.524 -5.788 1.00 0.00 H new ATOM 0 HH22 ARG A 197 -13.184 -14.526 -7.197 1.00 0.00 H new ATOM 870 N ALA A 198 -10.613 -8.003 -2.734 1.00 0.00 N ATOM 871 CA ALA A 198 -9.689 -6.880 -3.058 1.00 0.00 C ATOM 872 C ALA A 198 -8.397 -7.433 -3.667 1.00 0.00 C ATOM 873 O ALA A 198 -7.968 -8.525 -3.353 1.00 0.00 O ATOM 874 CB ALA A 198 -9.359 -6.109 -1.778 1.00 0.00 C ATOM 0 H ALA A 198 -11.518 -7.969 -3.204 1.00 0.00 H new ATOM 0 HA ALA A 198 -10.168 -6.213 -3.775 1.00 0.00 H new ATOM 0 HB1 ALA A 198 -8.683 -5.287 -2.013 1.00 0.00 H new ATOM 0 HB2 ALA A 198 -10.277 -5.712 -1.346 1.00 0.00 H new ATOM 0 HB3 ALA A 198 -8.881 -6.779 -1.063 1.00 0.00 H new ATOM 880 N LEU A 199 -7.771 -6.683 -4.534 1.00 0.00 N ATOM 881 CA LEU A 199 -6.507 -7.163 -5.158 1.00 0.00 C ATOM 882 C LEU A 199 -5.315 -6.562 -4.412 1.00 0.00 C ATOM 883 O LEU A 199 -5.197 -5.360 -4.278 1.00 0.00 O ATOM 884 CB LEU A 199 -6.459 -6.726 -6.624 1.00 0.00 C ATOM 885 CG LEU A 199 -7.767 -7.110 -7.319 1.00 0.00 C ATOM 886 CD1 LEU A 199 -7.883 -6.354 -8.643 1.00 0.00 C ATOM 887 CD2 LEU A 199 -7.775 -8.616 -7.591 1.00 0.00 C ATOM 0 H LEU A 199 -8.081 -5.759 -4.836 1.00 0.00 H new ATOM 0 HA LEU A 199 -6.466 -8.251 -5.103 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -6.305 -5.649 -6.688 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -5.616 -7.199 -7.127 1.00 0.00 H new ATOM 0 HG LEU A 199 -8.609 -6.850 -6.677 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -8.815 -6.628 -9.138 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -7.876 -5.281 -8.451 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -7.041 -6.614 -9.285 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -8.706 -8.891 -8.086 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -6.933 -8.874 -8.233 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -7.692 -9.156 -6.648 1.00 0.00 H new ATOM 899 N LEU A 200 -4.430 -7.388 -3.921 1.00 0.00 N ATOM 900 CA LEU A 200 -3.246 -6.861 -3.181 1.00 0.00 C ATOM 901 C LEU A 200 -1.973 -7.473 -3.760 1.00 0.00 C ATOM 902 O LEU A 200 -2.018 -8.410 -4.533 1.00 0.00 O ATOM 903 CB LEU A 200 -3.338 -7.225 -1.690 1.00 0.00 C ATOM 904 CG LEU A 200 -4.634 -7.988 -1.399 1.00 0.00 C ATOM 905 CD1 LEU A 200 -4.492 -8.755 -0.083 1.00 0.00 C ATOM 906 CD2 LEU A 200 -5.787 -6.993 -1.286 1.00 0.00 C ATOM 0 H LEU A 200 -4.475 -8.404 -4.000 1.00 0.00 H new ATOM 0 HA LEU A 200 -3.225 -5.776 -3.285 1.00 0.00 H new ATOM 0 HB2 LEU A 200 -2.480 -7.834 -1.405 1.00 0.00 H new ATOM 0 HB3 LEU A 200 -3.300 -6.318 -1.086 1.00 0.00 H new ATOM 0 HG LEU A 200 -4.834 -8.692 -2.207 1.00 0.00 H new ATOM 0 HD11 LEU A 200 -5.415 -9.298 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 200 -3.665 -9.461 -0.161 1.00 0.00 H new ATOM 0 HD13 LEU A 200 -4.295 -8.053 0.728 1.00 0.00 H new ATOM 0 HD21 LEU A 200 -6.712 -7.530 -1.079 1.00 0.00 H new ATOM 0 HD22 LEU A 200 -5.585 -6.293 -0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 200 -5.888 -6.445 -2.223 1.00 0.00 H new ATOM 918 N ASN A 201 -0.834 -6.964 -3.379 1.00 0.00 N ATOM 919 CA ASN A 201 0.440 -7.539 -3.898 1.00 0.00 C ATOM 920 C ASN A 201 0.543 -8.980 -3.414 1.00 0.00 C ATOM 921 O ASN A 201 1.024 -9.853 -4.110 1.00 0.00 O ATOM 922 CB ASN A 201 1.645 -6.752 -3.368 1.00 0.00 C ATOM 923 CG ASN A 201 1.241 -5.314 -3.041 1.00 0.00 C ATOM 924 OD1 ASN A 201 1.354 -4.889 -1.815 1.00 0.00 O flip ATOM 925 ND2 ASN A 201 0.821 -4.572 -3.907 1.00 0.00 N flip ATOM 0 H ASN A 201 -0.730 -6.180 -2.735 1.00 0.00 H new ATOM 0 HA ASN A 201 0.441 -7.488 -4.987 1.00 0.00 H new ATOM 0 HB2 ASN A 201 2.040 -7.237 -2.476 1.00 0.00 H new ATOM 0 HB3 ASN A 201 2.443 -6.752 -4.111 1.00 0.00 H new ATOM 0 HD21 ASN A 201 0.733 -4.906 -4.867 1.00 0.00 H new ATOM 0 HD22 ASN A 201 0.556 -3.615 -3.674 1.00 0.00 H new ATOM 932 N PHE A 202 0.082 -9.230 -2.219 1.00 0.00 N ATOM 933 CA PHE A 202 0.138 -10.606 -1.661 1.00 0.00 C ATOM 934 C PHE A 202 -1.264 -11.002 -1.187 1.00 0.00 C ATOM 935 O PHE A 202 -1.574 -10.900 -0.016 1.00 0.00 O ATOM 936 CB PHE A 202 1.109 -10.635 -0.475 1.00 0.00 C ATOM 937 CG PHE A 202 2.319 -9.786 -0.784 1.00 0.00 C ATOM 938 CD1 PHE A 202 2.915 -9.851 -2.048 1.00 0.00 C ATOM 939 CD2 PHE A 202 2.853 -8.940 0.198 1.00 0.00 C ATOM 940 CE1 PHE A 202 4.043 -9.074 -2.333 1.00 0.00 C ATOM 941 CE2 PHE A 202 3.982 -8.160 -0.088 1.00 0.00 C ATOM 942 CZ PHE A 202 4.577 -8.227 -1.354 1.00 0.00 C ATOM 0 H PHE A 202 -0.334 -8.532 -1.602 1.00 0.00 H new ATOM 0 HA PHE A 202 0.482 -11.305 -2.423 1.00 0.00 H new ATOM 0 HB2 PHE A 202 0.613 -10.265 0.422 1.00 0.00 H new ATOM 0 HB3 PHE A 202 1.416 -11.661 -0.269 1.00 0.00 H new ATOM 0 HD1 PHE A 202 2.504 -10.502 -2.805 1.00 0.00 H new ATOM 0 HD2 PHE A 202 2.395 -8.889 1.175 1.00 0.00 H new ATOM 0 HE1 PHE A 202 4.502 -9.127 -3.309 1.00 0.00 H new ATOM 0 HE2 PHE A 202 4.393 -7.507 0.668 1.00 0.00 H new ATOM 0 HZ PHE A 202 5.447 -7.626 -1.575 1.00 0.00 H new ATOM 952 N PRO A 203 -2.075 -11.434 -2.119 1.00 0.00 N ATOM 953 CA PRO A 203 -3.461 -11.844 -1.838 1.00 0.00 C ATOM 954 C PRO A 203 -3.496 -13.228 -1.185 1.00 0.00 C ATOM 955 O PRO A 203 -2.542 -13.978 -1.242 1.00 0.00 O ATOM 956 CB PRO A 203 -4.116 -11.873 -3.222 1.00 0.00 C ATOM 957 CG PRO A 203 -2.966 -12.032 -4.245 1.00 0.00 C ATOM 958 CD PRO A 203 -1.682 -11.557 -3.539 1.00 0.00 C ATOM 0 HA PRO A 203 -3.970 -11.175 -1.145 1.00 0.00 H new ATOM 0 HB2 PRO A 203 -4.823 -12.699 -3.300 1.00 0.00 H new ATOM 0 HB3 PRO A 203 -4.676 -10.956 -3.406 1.00 0.00 H new ATOM 0 HG2 PRO A 203 -2.872 -13.070 -4.564 1.00 0.00 H new ATOM 0 HG3 PRO A 203 -3.158 -11.440 -5.140 1.00 0.00 H new ATOM 0 HD2 PRO A 203 -0.869 -12.272 -3.667 1.00 0.00 H new ATOM 0 HD3 PRO A 203 -1.335 -10.605 -3.941 1.00 0.00 H new ATOM 966 N LEU A 204 -4.591 -13.567 -0.562 1.00 0.00 N ATOM 967 CA LEU A 204 -4.693 -14.898 0.098 1.00 0.00 C ATOM 968 C LEU A 204 -3.804 -14.916 1.343 1.00 0.00 C ATOM 969 O LEU A 204 -2.984 -14.042 1.546 1.00 0.00 O ATOM 970 CB LEU A 204 -4.237 -15.991 -0.872 1.00 0.00 C ATOM 971 CG LEU A 204 -5.201 -17.177 -0.795 1.00 0.00 C ATOM 972 CD1 LEU A 204 -6.332 -16.984 -1.806 1.00 0.00 C ATOM 973 CD2 LEU A 204 -4.446 -18.470 -1.118 1.00 0.00 C ATOM 0 H LEU A 204 -5.420 -12.979 -0.482 1.00 0.00 H new ATOM 0 HA LEU A 204 -5.728 -15.082 0.385 1.00 0.00 H new ATOM 0 HB2 LEU A 204 -4.206 -15.600 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 204 -3.226 -16.314 -0.624 1.00 0.00 H new ATOM 0 HG LEU A 204 -5.619 -17.239 0.210 1.00 0.00 H new ATOM 0 HD11 LEU A 204 -7.018 -17.829 -1.750 1.00 0.00 H new ATOM 0 HD12 LEU A 204 -6.870 -16.064 -1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 204 -5.915 -16.921 -2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 204 -5.132 -19.315 -1.063 1.00 0.00 H new ATOM 0 HD22 LEU A 204 -4.028 -18.406 -2.123 1.00 0.00 H new ATOM 0 HD23 LEU A 204 -3.640 -18.610 -0.398 1.00 0.00 H new ATOM 985 N ARG A 205 -3.960 -15.906 2.177 1.00 0.00 N ATOM 986 CA ARG A 205 -3.124 -15.983 3.407 1.00 0.00 C ATOM 987 C ARG A 205 -1.644 -15.911 3.023 1.00 0.00 C ATOM 988 O ARG A 205 -1.299 -15.621 1.895 1.00 0.00 O ATOM 989 CB ARG A 205 -3.401 -17.307 4.125 1.00 0.00 C ATOM 990 CG ARG A 205 -4.848 -17.325 4.624 1.00 0.00 C ATOM 991 CD ARG A 205 -4.864 -17.305 6.154 1.00 0.00 C ATOM 992 NE ARG A 205 -6.274 -17.289 6.636 1.00 0.00 N ATOM 993 CZ ARG A 205 -7.035 -16.256 6.395 1.00 0.00 C ATOM 994 NH1 ARG A 205 -6.590 -15.052 6.627 1.00 0.00 N ATOM 995 NH2 ARG A 205 -8.238 -16.426 5.921 1.00 0.00 N ATOM 0 H ARG A 205 -4.631 -16.665 2.060 1.00 0.00 H new ATOM 0 HA ARG A 205 -3.368 -15.151 4.068 1.00 0.00 H new ATOM 0 HB2 ARG A 205 -3.228 -18.143 3.447 1.00 0.00 H new ATOM 0 HB3 ARG A 205 -2.715 -17.429 4.963 1.00 0.00 H new ATOM 0 HG2 ARG A 205 -5.389 -16.463 4.233 1.00 0.00 H new ATOM 0 HG3 ARG A 205 -5.359 -18.215 4.257 1.00 0.00 H new ATOM 0 HD2 ARG A 205 -4.345 -18.180 6.545 1.00 0.00 H new ATOM 0 HD3 ARG A 205 -4.333 -16.428 6.522 1.00 0.00 H new ATOM 0 HE ARG A 205 -6.645 -18.085 7.154 1.00 0.00 H new ATOM 0 HH11 ARG A 205 -5.649 -14.919 6.996 1.00 0.00 H new ATOM 0 HH12 ARG A 205 -7.183 -14.244 6.439 1.00 0.00 H new ATOM 0 HH21 ARG A 205 -8.586 -17.367 5.738 1.00 0.00 H new ATOM 0 HH22 ARG A 205 -8.831 -15.618 5.733 1.00 0.00 H new ATOM 1009 N VAL A 206 -0.767 -16.175 3.952 1.00 0.00 N ATOM 1010 CA VAL A 206 0.688 -16.123 3.639 1.00 0.00 C ATOM 1011 C VAL A 206 1.153 -17.500 3.162 1.00 0.00 C ATOM 1012 O VAL A 206 2.313 -17.621 2.803 1.00 0.00 O ATOM 1013 CB VAL A 206 1.467 -15.728 4.894 1.00 0.00 C ATOM 1014 CG1 VAL A 206 0.916 -14.410 5.441 1.00 0.00 C ATOM 1015 CG2 VAL A 206 1.313 -16.821 5.954 1.00 0.00 C ATOM 0 H VAL A 206 -0.996 -16.424 4.914 1.00 0.00 H new ATOM 0 HA VAL A 206 0.866 -15.386 2.856 1.00 0.00 H new ATOM 0 HB VAL A 206 2.521 -15.607 4.645 1.00 0.00 H new ATOM 0 HG11 VAL A 206 1.471 -14.127 6.336 1.00 0.00 H new ATOM 0 HG12 VAL A 206 1.022 -13.630 4.687 1.00 0.00 H new ATOM 0 HG13 VAL A 206 -0.138 -14.532 5.691 1.00 0.00 H new ATOM 0 HG21 VAL A 206 1.868 -16.540 6.849 1.00 0.00 H new ATOM 0 HG22 VAL A 206 0.259 -16.940 6.203 1.00 0.00 H new ATOM 0 HG23 VAL A 206 1.703 -17.762 5.566 1.00 0.00 H new TER 1025 VAL A 206