USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 679 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 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl -155:sc= -0.0942 (180deg=-0.406) USER MOD Single : A 14 LYS NZ :NH3+ 159:sc= 2 (180deg=1.69) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 23 THR OG1 : rot 130:sc= -0.198 USER MOD Single : A 38 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-3.5!) USER MOD Single : A 41 MET CE :methyl 163:sc= -0.0144 (180deg=-0.272) USER MOD Single : A 44 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.35) USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 49 HIS : no HD1:sc= -0.635 K(o=-0.63,f=-1.6) USER MOD Single : A 55 LYS NZ :NH3+ 154:sc= -0.166 (180deg=-0.981) USER MOD Single : A 58 ASN : amide:sc= -1.58! C(o=-1.6!,f=-6.5!) USER MOD Single : A 60 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.18) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -1.27 X(o=-1.3,f=-0.92) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= -0.0974 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -127:sc= 0.45 (180deg=-0.23) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= -0.0952 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.030 -6.806 -22.343 1.00 0.00 N ATOM 2 CA GLY A 1 0.125 -5.728 -21.989 1.00 0.00 C ATOM 3 C GLY A 1 0.505 -5.058 -20.684 1.00 0.00 C ATOM 4 O GLY A 1 0.626 -3.834 -20.619 1.00 0.00 O ATOM 0 H1 GLY A 1 0.728 -7.232 -23.242 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.994 -6.430 -22.445 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.017 -7.529 -21.596 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.119 -4.986 -22.787 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.889 -6.120 -21.911 1.00 0.00 H new ATOM 8 N SER A 2 0.692 -5.860 -19.640 1.00 0.00 N ATOM 9 CA SER A 2 1.055 -5.336 -18.329 1.00 0.00 C ATOM 10 C SER A 2 2.286 -6.051 -17.780 1.00 0.00 C ATOM 11 O SER A 2 2.333 -7.280 -17.730 1.00 0.00 O ATOM 12 CB SER A 2 -0.114 -5.488 -17.354 1.00 0.00 C ATOM 13 OG SER A 2 -1.236 -4.735 -17.781 1.00 0.00 O ATOM 0 H SER A 2 0.598 -6.875 -19.677 1.00 0.00 H new ATOM 0 HA SER A 2 1.290 -4.278 -18.441 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.388 -6.540 -17.271 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.192 -5.159 -16.361 1.00 0.00 H new ATOM 0 HG SER A 2 -1.970 -4.850 -17.142 1.00 0.00 H new ATOM 19 N SER A 3 3.282 -5.272 -17.370 1.00 0.00 N ATOM 20 CA SER A 3 4.515 -5.829 -16.828 1.00 0.00 C ATOM 21 C SER A 3 4.227 -7.064 -15.980 1.00 0.00 C ATOM 22 O SER A 3 4.729 -8.152 -16.257 1.00 0.00 O ATOM 23 CB SER A 3 5.249 -4.780 -15.990 1.00 0.00 C ATOM 24 OG SER A 3 6.021 -3.920 -16.810 1.00 0.00 O ATOM 0 H SER A 3 3.259 -4.253 -17.403 1.00 0.00 H new ATOM 0 HA SER A 3 5.149 -6.124 -17.664 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.527 -4.194 -15.422 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.897 -5.276 -15.267 1.00 0.00 H new ATOM 0 HG SER A 3 6.478 -3.258 -16.250 1.00 0.00 H new ATOM 30 N GLY A 4 3.414 -6.885 -14.943 1.00 0.00 N ATOM 31 CA GLY A 4 3.072 -7.992 -14.069 1.00 0.00 C ATOM 32 C GLY A 4 1.851 -8.752 -14.547 1.00 0.00 C ATOM 33 O GLY A 4 1.239 -8.390 -15.552 1.00 0.00 O ATOM 0 H GLY A 4 2.986 -5.993 -14.693 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.919 -8.675 -14.004 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.890 -7.614 -13.063 1.00 0.00 H new ATOM 37 N SER A 5 1.495 -9.811 -13.826 1.00 0.00 N ATOM 38 CA SER A 5 0.341 -10.627 -14.185 1.00 0.00 C ATOM 39 C SER A 5 -0.662 -10.685 -13.036 1.00 0.00 C ATOM 40 O SER A 5 -1.847 -10.408 -13.218 1.00 0.00 O ATOM 41 CB SER A 5 0.788 -12.042 -14.559 1.00 0.00 C ATOM 42 OG SER A 5 -0.322 -12.917 -14.659 1.00 0.00 O ATOM 0 H SER A 5 1.989 -10.124 -12.990 1.00 0.00 H new ATOM 0 HA SER A 5 -0.145 -10.167 -15.046 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.324 -12.019 -15.508 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.484 -12.417 -13.809 1.00 0.00 H new ATOM 0 HG SER A 5 -0.011 -13.814 -14.900 1.00 0.00 H new ATOM 48 N SER A 6 -0.177 -11.048 -11.853 1.00 0.00 N ATOM 49 CA SER A 6 -1.030 -11.147 -10.675 1.00 0.00 C ATOM 50 C SER A 6 -0.780 -9.981 -9.723 1.00 0.00 C ATOM 51 O SER A 6 0.224 -9.949 -9.013 1.00 0.00 O ATOM 52 CB SER A 6 -0.785 -12.472 -9.951 1.00 0.00 C ATOM 53 OG SER A 6 -1.684 -12.636 -8.868 1.00 0.00 O ATOM 0 H SER A 6 0.802 -11.278 -11.685 1.00 0.00 H new ATOM 0 HA SER A 6 -2.068 -11.108 -11.005 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.900 -13.299 -10.651 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.241 -12.505 -9.584 1.00 0.00 H new ATOM 0 HG SER A 6 -1.508 -13.491 -8.423 1.00 0.00 H new ATOM 59 N GLY A 7 -1.702 -9.023 -9.716 1.00 0.00 N ATOM 60 CA GLY A 7 -1.563 -7.867 -8.849 1.00 0.00 C ATOM 61 C GLY A 7 -1.425 -6.573 -9.625 1.00 0.00 C ATOM 62 O GLY A 7 -1.394 -6.580 -10.856 1.00 0.00 O ATOM 0 H GLY A 7 -2.542 -9.027 -10.295 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.431 -7.803 -8.193 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.690 -7.999 -8.210 1.00 0.00 H new ATOM 66 N ARG A 8 -1.343 -5.459 -8.905 1.00 0.00 N ATOM 67 CA ARG A 8 -1.210 -4.150 -9.535 1.00 0.00 C ATOM 68 C ARG A 8 0.156 -3.539 -9.235 1.00 0.00 C ATOM 69 O ARG A 8 0.252 -2.502 -8.579 1.00 0.00 O ATOM 70 CB ARG A 8 -2.318 -3.213 -9.051 1.00 0.00 C ATOM 71 CG ARG A 8 -2.568 -3.288 -7.554 1.00 0.00 C ATOM 72 CD ARG A 8 -3.673 -2.335 -7.125 1.00 0.00 C ATOM 73 NE ARG A 8 -4.995 -2.819 -7.511 1.00 0.00 N ATOM 74 CZ ARG A 8 -5.546 -2.586 -8.697 1.00 0.00 C ATOM 75 NH1 ARG A 8 -4.891 -1.880 -9.608 1.00 0.00 N ATOM 76 NH2 ARG A 8 -6.754 -3.061 -8.974 1.00 0.00 N ATOM 0 H ARG A 8 -1.366 -5.436 -7.886 1.00 0.00 H new ATOM 0 HA ARG A 8 -1.301 -4.282 -10.613 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -2.057 -2.188 -9.316 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -3.242 -3.454 -9.578 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -2.839 -4.308 -7.280 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -1.650 -3.047 -7.018 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -3.637 -2.202 -6.044 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -3.501 -1.356 -7.572 1.00 0.00 H new ATOM 0 HE ARG A 8 -5.525 -3.366 -6.833 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -3.962 -1.514 -9.399 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -5.316 -1.702 -10.518 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -7.260 -3.606 -8.276 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -7.176 -2.881 -9.885 1.00 0.00 H new ATOM 90 N MET A 9 1.209 -4.189 -9.719 1.00 0.00 N ATOM 91 CA MET A 9 2.569 -3.709 -9.504 1.00 0.00 C ATOM 92 C MET A 9 2.642 -2.194 -9.665 1.00 0.00 C ATOM 93 O MET A 9 2.400 -1.663 -10.749 1.00 0.00 O ATOM 94 CB MET A 9 3.532 -4.385 -10.481 1.00 0.00 C ATOM 95 CG MET A 9 3.792 -5.849 -10.164 1.00 0.00 C ATOM 96 SD MET A 9 5.431 -6.392 -10.683 1.00 0.00 S ATOM 97 CE MET A 9 5.923 -7.380 -9.272 1.00 0.00 C ATOM 0 H MET A 9 1.147 -5.050 -10.263 1.00 0.00 H new ATOM 0 HA MET A 9 2.861 -3.963 -8.485 1.00 0.00 H new ATOM 0 HB2 MET A 9 3.127 -4.307 -11.490 1.00 0.00 H new ATOM 0 HB3 MET A 9 4.480 -3.847 -10.475 1.00 0.00 H new ATOM 0 HG2 MET A 9 3.683 -6.009 -9.091 1.00 0.00 H new ATOM 0 HG3 MET A 9 3.038 -6.463 -10.656 1.00 0.00 H new ATOM 0 HE1 MET A 9 7.011 -7.416 -9.214 1.00 0.00 H new ATOM 0 HE2 MET A 9 5.526 -6.935 -8.360 1.00 0.00 H new ATOM 0 HE3 MET A 9 5.532 -8.392 -9.382 1.00 0.00 H new ATOM 107 N VAL A 10 2.978 -1.503 -8.580 1.00 0.00 N ATOM 108 CA VAL A 10 3.084 -0.049 -8.602 1.00 0.00 C ATOM 109 C VAL A 10 4.527 0.400 -8.406 1.00 0.00 C ATOM 110 O VAL A 10 5.182 0.016 -7.438 1.00 0.00 O ATOM 111 CB VAL A 10 2.205 0.594 -7.513 1.00 0.00 C ATOM 112 CG1 VAL A 10 2.298 2.111 -7.578 1.00 0.00 C ATOM 113 CG2 VAL A 10 0.762 0.134 -7.652 1.00 0.00 C ATOM 0 H VAL A 10 3.181 -1.927 -7.675 1.00 0.00 H new ATOM 0 HA VAL A 10 2.735 0.279 -9.581 1.00 0.00 H new ATOM 0 HB VAL A 10 2.572 0.273 -6.538 1.00 0.00 H new ATOM 0 HG11 VAL A 10 1.670 2.548 -6.801 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.332 2.419 -7.425 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.958 2.455 -8.555 1.00 0.00 H new ATOM 0 HG21 VAL A 10 0.156 0.598 -6.874 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.380 0.424 -8.631 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.714 -0.950 -7.550 1.00 0.00 H new ATOM 123 N GLY A 11 5.019 1.217 -9.333 1.00 0.00 N ATOM 124 CA GLY A 11 6.382 1.705 -9.244 1.00 0.00 C ATOM 125 C GLY A 11 6.465 3.080 -8.610 1.00 0.00 C ATOM 126 O GLY A 11 5.872 4.037 -9.109 1.00 0.00 O ATOM 0 H GLY A 11 4.497 1.549 -10.144 1.00 0.00 H new ATOM 0 HA2 GLY A 11 6.979 1.003 -8.662 1.00 0.00 H new ATOM 0 HA3 GLY A 11 6.818 1.742 -10.243 1.00 0.00 H new ATOM 130 N ILE A 12 7.201 3.178 -7.508 1.00 0.00 N ATOM 131 CA ILE A 12 7.359 4.445 -6.806 1.00 0.00 C ATOM 132 C ILE A 12 8.795 4.948 -6.896 1.00 0.00 C ATOM 133 O ILE A 12 9.744 4.184 -6.718 1.00 0.00 O ATOM 134 CB ILE A 12 6.962 4.320 -5.323 1.00 0.00 C ATOM 135 CG1 ILE A 12 5.558 3.726 -5.197 1.00 0.00 C ATOM 136 CG2 ILE A 12 7.033 5.677 -4.639 1.00 0.00 C ATOM 137 CD1 ILE A 12 5.544 2.215 -5.139 1.00 0.00 C ATOM 0 H ILE A 12 7.697 2.395 -7.082 1.00 0.00 H new ATOM 0 HA ILE A 12 6.695 5.160 -7.292 1.00 0.00 H new ATOM 0 HB ILE A 12 7.665 3.650 -4.829 1.00 0.00 H new ATOM 0 HG12 ILE A 12 5.085 4.120 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 12 4.956 4.055 -6.044 1.00 0.00 H new ATOM 0 HG21 ILE A 12 6.750 5.572 -3.592 1.00 0.00 H new ATOM 0 HG22 ILE A 12 8.050 6.064 -4.703 1.00 0.00 H new ATOM 0 HG23 ILE A 12 6.350 6.369 -5.132 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.516 1.864 -5.050 1.00 0.00 H new ATOM 0 HD12 ILE A 12 5.988 1.812 -6.049 1.00 0.00 H new ATOM 0 HD13 ILE A 12 6.118 1.879 -4.276 1.00 0.00 H new ATOM 149 N ARG A 13 8.948 6.240 -7.170 1.00 0.00 N ATOM 150 CA ARG A 13 10.269 6.846 -7.283 1.00 0.00 C ATOM 151 C ARG A 13 10.657 7.549 -5.985 1.00 0.00 C ATOM 152 O ARG A 13 11.111 8.694 -5.998 1.00 0.00 O ATOM 153 CB ARG A 13 10.300 7.842 -8.444 1.00 0.00 C ATOM 154 CG ARG A 13 10.487 7.187 -9.803 1.00 0.00 C ATOM 155 CD ARG A 13 9.184 6.598 -10.321 1.00 0.00 C ATOM 156 NE ARG A 13 9.279 6.212 -11.727 1.00 0.00 N ATOM 157 CZ ARG A 13 9.187 7.074 -12.733 1.00 0.00 C ATOM 158 NH1 ARG A 13 8.999 8.364 -12.490 1.00 0.00 N ATOM 159 NH2 ARG A 13 9.283 6.646 -13.985 1.00 0.00 N ATOM 0 H ARG A 13 8.173 6.887 -7.318 1.00 0.00 H new ATOM 0 HA ARG A 13 10.990 6.052 -7.476 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.370 8.411 -8.449 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.108 8.554 -8.279 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.863 7.923 -10.514 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.239 6.401 -9.729 1.00 0.00 H new ATOM 0 HD2 ARG A 13 8.917 5.727 -9.723 1.00 0.00 H new ATOM 0 HD3 ARG A 13 8.383 7.327 -10.198 1.00 0.00 H new ATOM 0 HE ARG A 13 9.424 5.227 -11.948 1.00 0.00 H new ATOM 0 HH11 ARG A 13 8.925 8.696 -11.529 1.00 0.00 H new ATOM 0 HH12 ARG A 13 8.929 9.024 -13.265 1.00 0.00 H new ATOM 0 HH21 ARG A 13 9.428 5.654 -14.175 1.00 0.00 H new ATOM 0 HH22 ARG A 13 9.212 7.309 -14.757 1.00 0.00 H new ATOM 173 N LYS A 14 10.475 6.857 -4.866 1.00 0.00 N ATOM 174 CA LYS A 14 10.805 7.413 -3.559 1.00 0.00 C ATOM 175 C LYS A 14 12.306 7.331 -3.297 1.00 0.00 C ATOM 176 O LYS A 14 12.998 6.477 -3.852 1.00 0.00 O ATOM 177 CB LYS A 14 10.043 6.671 -2.459 1.00 0.00 C ATOM 178 CG LYS A 14 10.709 5.377 -2.024 1.00 0.00 C ATOM 179 CD LYS A 14 10.128 4.862 -0.719 1.00 0.00 C ATOM 180 CE LYS A 14 10.581 5.703 0.464 1.00 0.00 C ATOM 181 NZ LYS A 14 11.822 5.162 1.086 1.00 0.00 N ATOM 0 H LYS A 14 10.100 5.909 -4.838 1.00 0.00 H new ATOM 0 HA LYS A 14 10.509 8.462 -3.552 1.00 0.00 H new ATOM 0 HB2 LYS A 14 9.941 7.326 -1.594 1.00 0.00 H new ATOM 0 HB3 LYS A 14 9.036 6.450 -2.812 1.00 0.00 H new ATOM 0 HG2 LYS A 14 10.584 4.623 -2.801 1.00 0.00 H new ATOM 0 HG3 LYS A 14 11.780 5.540 -1.907 1.00 0.00 H new ATOM 0 HD2 LYS A 14 9.040 4.869 -0.776 1.00 0.00 H new ATOM 0 HD3 LYS A 14 10.432 3.826 -0.568 1.00 0.00 H new ATOM 0 HE2 LYS A 14 10.756 6.727 0.136 1.00 0.00 H new ATOM 0 HE3 LYS A 14 9.787 5.739 1.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 12.294 5.913 1.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 11.578 4.376 1.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 12.462 4.819 0.342 1.00 0.00 H new ATOM 195 N THR A 15 12.803 8.224 -2.447 1.00 0.00 N ATOM 196 CA THR A 15 14.221 8.253 -2.111 1.00 0.00 C ATOM 197 C THR A 15 14.449 7.863 -0.655 1.00 0.00 C ATOM 198 O THR A 15 13.625 8.154 0.211 1.00 0.00 O ATOM 199 CB THR A 15 14.829 9.646 -2.360 1.00 0.00 C ATOM 200 OG1 THR A 15 14.581 10.056 -3.709 1.00 0.00 O ATOM 201 CG2 THR A 15 16.327 9.638 -2.094 1.00 0.00 C ATOM 0 H THR A 15 12.244 8.937 -1.979 1.00 0.00 H new ATOM 0 HA THR A 15 14.715 7.529 -2.759 1.00 0.00 H new ATOM 0 HB THR A 15 14.358 10.351 -1.675 1.00 0.00 H new ATOM 0 HG1 THR A 15 14.969 10.943 -3.858 1.00 0.00 H new ATOM 0 HG21 THR A 15 16.734 10.632 -2.277 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.511 9.355 -1.058 1.00 0.00 H new ATOM 0 HG23 THR A 15 16.810 8.921 -2.757 1.00 0.00 H new ATOM 209 N ALA A 16 15.573 7.204 -0.393 1.00 0.00 N ATOM 210 CA ALA A 16 15.911 6.778 0.959 1.00 0.00 C ATOM 211 C ALA A 16 15.562 7.857 1.978 1.00 0.00 C ATOM 212 O ALA A 16 15.961 9.012 1.835 1.00 0.00 O ATOM 213 CB ALA A 16 17.388 6.423 1.047 1.00 0.00 C ATOM 0 H ALA A 16 16.265 6.954 -1.100 1.00 0.00 H new ATOM 0 HA ALA A 16 15.321 5.891 1.192 1.00 0.00 H new ATOM 0 HB1 ALA A 16 17.626 6.107 2.062 1.00 0.00 H new ATOM 0 HB2 ALA A 16 17.609 5.612 0.353 1.00 0.00 H new ATOM 0 HB3 ALA A 16 17.988 7.296 0.789 1.00 0.00 H new ATOM 219 N GLY A 17 14.815 7.472 3.009 1.00 0.00 N ATOM 220 CA GLY A 17 14.425 8.420 4.037 1.00 0.00 C ATOM 221 C GLY A 17 12.952 8.773 3.971 1.00 0.00 C ATOM 222 O GLY A 17 12.229 8.628 4.956 1.00 0.00 O ATOM 0 H GLY A 17 14.473 6.521 3.151 1.00 0.00 H new ATOM 0 HA2 GLY A 17 14.652 8.002 5.018 1.00 0.00 H new ATOM 0 HA3 GLY A 17 15.018 9.328 3.933 1.00 0.00 H new ATOM 226 N GLU A 18 12.508 9.238 2.808 1.00 0.00 N ATOM 227 CA GLU A 18 11.112 9.615 2.620 1.00 0.00 C ATOM 228 C GLU A 18 10.183 8.631 3.324 1.00 0.00 C ATOM 229 O GLU A 18 10.414 7.421 3.307 1.00 0.00 O ATOM 230 CB GLU A 18 10.774 9.676 1.129 1.00 0.00 C ATOM 231 CG GLU A 18 11.435 10.835 0.402 1.00 0.00 C ATOM 232 CD GLU A 18 10.770 12.165 0.698 1.00 0.00 C ATOM 233 OE1 GLU A 18 10.911 12.657 1.837 1.00 0.00 O ATOM 234 OE2 GLU A 18 10.109 12.714 -0.208 1.00 0.00 O ATOM 0 H GLU A 18 13.094 9.363 1.982 1.00 0.00 H new ATOM 0 HA GLU A 18 10.966 10.602 3.059 1.00 0.00 H new ATOM 0 HB2 GLU A 18 11.078 8.741 0.658 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.693 9.754 1.013 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.485 10.887 0.688 1.00 0.00 H new ATOM 0 HG3 GLU A 18 11.406 10.650 -0.672 1.00 0.00 H new ATOM 241 N HIS A 19 9.131 9.157 3.943 1.00 0.00 N ATOM 242 CA HIS A 19 8.167 8.325 4.654 1.00 0.00 C ATOM 243 C HIS A 19 6.795 8.396 3.989 1.00 0.00 C ATOM 244 O HIS A 19 6.124 9.428 4.033 1.00 0.00 O ATOM 245 CB HIS A 19 8.061 8.764 6.115 1.00 0.00 C ATOM 246 CG HIS A 19 7.674 7.657 7.046 1.00 0.00 C ATOM 247 ND1 HIS A 19 8.500 6.590 7.332 1.00 0.00 N ATOM 248 CD2 HIS A 19 6.542 7.455 7.759 1.00 0.00 C ATOM 249 CE1 HIS A 19 7.892 5.780 8.179 1.00 0.00 C ATOM 250 NE2 HIS A 19 6.702 6.282 8.455 1.00 0.00 N ATOM 0 H HIS A 19 8.924 10.156 3.967 1.00 0.00 H new ATOM 0 HA HIS A 19 8.518 7.294 4.617 1.00 0.00 H new ATOM 0 HB2 HIS A 19 9.019 9.176 6.432 1.00 0.00 H new ATOM 0 HB3 HIS A 19 7.327 9.566 6.192 1.00 0.00 H new ATOM 0 HD2 HIS A 19 5.674 8.097 7.777 1.00 0.00 H new ATOM 0 HE1 HIS A 19 8.299 4.863 8.578 1.00 0.00 H new ATOM 0 HE2 HIS A 19 6.014 5.866 9.083 1.00 0.00 H new ATOM 259 N LEU A 20 6.385 7.293 3.373 1.00 0.00 N ATOM 260 CA LEU A 20 5.093 7.229 2.697 1.00 0.00 C ATOM 261 C LEU A 20 3.958 7.554 3.663 1.00 0.00 C ATOM 262 O LEU A 20 3.098 8.383 3.370 1.00 0.00 O ATOM 263 CB LEU A 20 4.881 5.841 2.090 1.00 0.00 C ATOM 264 CG LEU A 20 5.751 5.498 0.880 1.00 0.00 C ATOM 265 CD1 LEU A 20 7.162 5.144 1.321 1.00 0.00 C ATOM 266 CD2 LEU A 20 5.134 4.354 0.088 1.00 0.00 C ATOM 0 H LEU A 20 6.928 6.431 3.327 1.00 0.00 H new ATOM 0 HA LEU A 20 5.090 7.971 1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.061 5.096 2.865 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.835 5.750 1.798 1.00 0.00 H new ATOM 0 HG LEU A 20 5.804 6.374 0.234 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.767 4.903 0.447 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.603 5.992 1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.129 4.283 1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 20 5.766 4.123 -0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.051 3.474 0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.143 4.645 -0.260 1.00 0.00 H new ATOM 278 N GLY A 21 3.962 6.894 4.817 1.00 0.00 N ATOM 279 CA GLY A 21 2.929 7.128 5.809 1.00 0.00 C ATOM 280 C GLY A 21 1.746 6.195 5.644 1.00 0.00 C ATOM 281 O GLY A 21 0.685 6.604 5.173 1.00 0.00 O ATOM 0 H GLY A 21 4.662 6.201 5.083 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.351 7.002 6.806 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.587 8.160 5.736 1.00 0.00 H new ATOM 285 N VAL A 22 1.927 4.937 6.032 1.00 0.00 N ATOM 286 CA VAL A 22 0.866 3.943 5.924 1.00 0.00 C ATOM 287 C VAL A 22 0.980 2.895 7.025 1.00 0.00 C ATOM 288 O VAL A 22 2.080 2.472 7.384 1.00 0.00 O ATOM 289 CB VAL A 22 0.894 3.238 4.555 1.00 0.00 C ATOM 290 CG1 VAL A 22 0.549 4.217 3.443 1.00 0.00 C ATOM 291 CG2 VAL A 22 2.253 2.600 4.312 1.00 0.00 C ATOM 0 H VAL A 22 2.799 4.582 6.424 1.00 0.00 H new ATOM 0 HA VAL A 22 -0.079 4.476 6.030 1.00 0.00 H new ATOM 0 HB VAL A 22 0.143 2.448 4.557 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.574 3.701 2.483 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.449 4.622 3.611 1.00 0.00 H new ATOM 0 HG13 VAL A 22 1.274 5.030 3.436 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.255 2.106 3.340 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.025 3.370 4.329 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.455 1.866 5.092 1.00 0.00 H new ATOM 301 N THR A 23 -0.164 2.478 7.560 1.00 0.00 N ATOM 302 CA THR A 23 -0.193 1.480 8.621 1.00 0.00 C ATOM 303 C THR A 23 -0.870 0.197 8.151 1.00 0.00 C ATOM 304 O THR A 23 -1.989 0.226 7.639 1.00 0.00 O ATOM 305 CB THR A 23 -0.927 2.007 9.868 1.00 0.00 C ATOM 306 OG1 THR A 23 -2.237 2.460 9.510 1.00 0.00 O ATOM 307 CG2 THR A 23 -0.150 3.145 10.513 1.00 0.00 C ATOM 0 H THR A 23 -1.083 2.817 7.275 1.00 0.00 H new ATOM 0 HA THR A 23 0.843 1.266 8.882 1.00 0.00 H new ATOM 0 HB THR A 23 -1.009 1.191 10.586 1.00 0.00 H new ATOM 0 HG1 THR A 23 -2.897 2.062 10.115 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.688 3.501 11.392 1.00 0.00 H new ATOM 0 HG22 THR A 23 0.836 2.789 10.811 1.00 0.00 H new ATOM 0 HG23 THR A 23 -0.041 3.961 9.799 1.00 0.00 H new ATOM 315 N PHE A 24 -0.184 -0.927 8.327 1.00 0.00 N ATOM 316 CA PHE A 24 -0.719 -2.221 7.921 1.00 0.00 C ATOM 317 C PHE A 24 -1.151 -3.037 9.136 1.00 0.00 C ATOM 318 O PHE A 24 -0.708 -2.784 10.256 1.00 0.00 O ATOM 319 CB PHE A 24 0.323 -2.998 7.115 1.00 0.00 C ATOM 320 CG PHE A 24 0.889 -2.221 5.960 1.00 0.00 C ATOM 321 CD1 PHE A 24 1.929 -1.326 6.154 1.00 0.00 C ATOM 322 CD2 PHE A 24 0.381 -2.386 4.682 1.00 0.00 C ATOM 323 CE1 PHE A 24 2.453 -0.610 5.094 1.00 0.00 C ATOM 324 CE2 PHE A 24 0.901 -1.673 3.618 1.00 0.00 C ATOM 325 CZ PHE A 24 1.937 -0.783 3.824 1.00 0.00 C ATOM 0 H PHE A 24 0.744 -0.968 8.748 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.594 -2.044 7.295 1.00 0.00 H new ATOM 0 HB2 PHE A 24 1.137 -3.293 7.777 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -0.130 -3.915 6.738 1.00 0.00 H new ATOM 0 HD1 PHE A 24 2.335 -1.186 7.145 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -0.430 -3.079 4.515 1.00 0.00 H new ATOM 0 HE1 PHE A 24 3.264 0.084 5.258 1.00 0.00 H new ATOM 0 HE2 PHE A 24 0.497 -1.812 2.626 1.00 0.00 H new ATOM 0 HZ PHE A 24 2.343 -0.224 2.994 1.00 0.00 H new ATOM 335 N ARG A 25 -2.019 -4.017 8.905 1.00 0.00 N ATOM 336 CA ARG A 25 -2.512 -4.870 9.980 1.00 0.00 C ATOM 337 C ARG A 25 -2.313 -6.344 9.639 1.00 0.00 C ATOM 338 O ARG A 25 -2.255 -6.719 8.469 1.00 0.00 O ATOM 339 CB ARG A 25 -3.994 -4.592 10.241 1.00 0.00 C ATOM 340 CG ARG A 25 -4.910 -5.083 9.132 1.00 0.00 C ATOM 341 CD ARG A 25 -6.228 -4.325 9.122 1.00 0.00 C ATOM 342 NE ARG A 25 -7.294 -5.089 8.478 1.00 0.00 N ATOM 343 CZ ARG A 25 -8.577 -4.749 8.531 1.00 0.00 C ATOM 344 NH1 ARG A 25 -8.952 -3.664 9.194 1.00 0.00 N ATOM 345 NH2 ARG A 25 -9.488 -5.495 7.919 1.00 0.00 N ATOM 0 H ARG A 25 -2.395 -4.240 7.983 1.00 0.00 H new ATOM 0 HA ARG A 25 -1.942 -4.643 10.881 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -4.285 -5.067 11.178 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -4.137 -3.519 10.370 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -4.413 -4.964 8.169 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.102 -6.148 9.262 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -6.518 -4.089 10.146 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.097 -3.376 8.602 1.00 0.00 H new ATOM 0 HE ARG A 25 -7.039 -5.929 7.959 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -8.255 -3.088 9.665 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -9.938 -3.405 9.233 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -9.203 -6.330 7.407 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -10.473 -5.233 7.960 1.00 0.00 H new ATOM 359 N VAL A 26 -2.207 -7.175 10.672 1.00 0.00 N ATOM 360 CA VAL A 26 -2.014 -8.608 10.483 1.00 0.00 C ATOM 361 C VAL A 26 -3.327 -9.365 10.648 1.00 0.00 C ATOM 362 O VAL A 26 -3.843 -9.497 11.757 1.00 0.00 O ATOM 363 CB VAL A 26 -0.981 -9.171 11.476 1.00 0.00 C ATOM 364 CG1 VAL A 26 -0.841 -10.676 11.306 1.00 0.00 C ATOM 365 CG2 VAL A 26 0.362 -8.479 11.297 1.00 0.00 C ATOM 0 H VAL A 26 -2.252 -6.880 11.647 1.00 0.00 H new ATOM 0 HA VAL A 26 -1.643 -8.747 9.468 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.333 -8.975 12.489 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.107 -11.056 12.016 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -1.803 -11.154 11.489 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.513 -10.898 10.291 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.080 -8.889 12.007 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.722 -8.641 10.281 1.00 0.00 H new ATOM 0 HG23 VAL A 26 0.247 -7.410 11.474 1.00 0.00 H new ATOM 375 N GLU A 27 -3.862 -9.861 9.536 1.00 0.00 N ATOM 376 CA GLU A 27 -5.115 -10.606 9.559 1.00 0.00 C ATOM 377 C GLU A 27 -5.147 -11.652 8.448 1.00 0.00 C ATOM 378 O GLU A 27 -5.312 -11.322 7.274 1.00 0.00 O ATOM 379 CB GLU A 27 -6.303 -9.653 9.411 1.00 0.00 C ATOM 380 CG GLU A 27 -6.147 -8.659 8.272 1.00 0.00 C ATOM 381 CD GLU A 27 -6.684 -9.190 6.957 1.00 0.00 C ATOM 382 OE1 GLU A 27 -7.571 -10.069 6.990 1.00 0.00 O ATOM 383 OE2 GLU A 27 -6.217 -8.728 5.895 1.00 0.00 O ATOM 0 H GLU A 27 -3.448 -9.760 8.609 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.186 -11.118 10.519 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.209 -10.237 9.251 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -6.438 -9.106 10.344 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -6.668 -7.736 8.527 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -5.093 -8.409 8.155 1.00 0.00 H new ATOM 390 N GLY A 28 -4.986 -12.916 8.829 1.00 0.00 N ATOM 391 CA GLY A 28 -4.999 -13.991 7.854 1.00 0.00 C ATOM 392 C GLY A 28 -3.630 -14.245 7.254 1.00 0.00 C ATOM 393 O GLY A 28 -3.515 -14.585 6.077 1.00 0.00 O ATOM 0 H GLY A 28 -4.847 -13.214 9.794 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -5.359 -14.904 8.329 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -5.702 -13.747 7.058 1.00 0.00 H new ATOM 397 N GLY A 29 -2.590 -14.078 8.064 1.00 0.00 N ATOM 398 CA GLY A 29 -1.236 -14.294 7.587 1.00 0.00 C ATOM 399 C GLY A 29 -0.881 -13.393 6.422 1.00 0.00 C ATOM 400 O GLY A 29 -0.079 -13.762 5.565 1.00 0.00 O ATOM 0 H GLY A 29 -2.660 -13.797 9.042 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -0.535 -14.121 8.403 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.122 -15.335 7.285 1.00 0.00 H new ATOM 404 N GLU A 30 -1.482 -12.207 6.389 1.00 0.00 N ATOM 405 CA GLU A 30 -1.225 -11.252 5.317 1.00 0.00 C ATOM 406 C GLU A 30 -1.231 -9.822 5.850 1.00 0.00 C ATOM 407 O GLU A 30 -1.779 -9.547 6.919 1.00 0.00 O ATOM 408 CB GLU A 30 -2.272 -11.399 4.211 1.00 0.00 C ATOM 409 CG GLU A 30 -3.515 -10.553 4.433 1.00 0.00 C ATOM 410 CD GLU A 30 -4.721 -11.078 3.678 1.00 0.00 C ATOM 411 OE1 GLU A 30 -4.558 -11.479 2.506 1.00 0.00 O ATOM 412 OE2 GLU A 30 -5.826 -11.088 4.258 1.00 0.00 O ATOM 0 H GLU A 30 -2.149 -11.885 7.091 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.239 -11.464 4.905 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -1.822 -11.125 3.257 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -2.564 -12.446 4.136 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.743 -10.522 5.498 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.313 -9.528 4.120 1.00 0.00 H new ATOM 419 N LEU A 31 -0.616 -8.915 5.100 1.00 0.00 N ATOM 420 CA LEU A 31 -0.548 -7.512 5.496 1.00 0.00 C ATOM 421 C LEU A 31 -1.441 -6.652 4.607 1.00 0.00 C ATOM 422 O LEU A 31 -1.333 -6.687 3.381 1.00 0.00 O ATOM 423 CB LEU A 31 0.895 -7.011 5.426 1.00 0.00 C ATOM 424 CG LEU A 31 1.730 -7.190 6.694 1.00 0.00 C ATOM 425 CD1 LEU A 31 3.171 -6.771 6.448 1.00 0.00 C ATOM 426 CD2 LEU A 31 1.130 -6.393 7.844 1.00 0.00 C ATOM 0 H LEU A 31 -0.157 -9.125 4.214 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.904 -7.432 6.523 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.398 -7.527 4.608 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.879 -5.951 5.173 1.00 0.00 H new ATOM 0 HG LEU A 31 1.722 -8.246 6.966 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.750 -6.905 7.362 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.598 -7.384 5.654 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.199 -5.723 6.151 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.737 -6.532 8.739 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.108 -5.335 7.581 1.00 0.00 H new ATOM 0 HD23 LEU A 31 0.115 -6.740 8.037 1.00 0.00 H new ATOM 438 N VAL A 32 -2.322 -5.878 5.234 1.00 0.00 N ATOM 439 CA VAL A 32 -3.231 -5.006 4.501 1.00 0.00 C ATOM 440 C VAL A 32 -3.194 -3.585 5.052 1.00 0.00 C ATOM 441 O VAL A 32 -3.209 -3.379 6.266 1.00 0.00 O ATOM 442 CB VAL A 32 -4.679 -5.529 4.557 1.00 0.00 C ATOM 443 CG1 VAL A 32 -5.202 -5.499 5.985 1.00 0.00 C ATOM 444 CG2 VAL A 32 -5.575 -4.716 3.635 1.00 0.00 C ATOM 0 H VAL A 32 -2.425 -5.838 6.248 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.895 -4.999 3.464 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.687 -6.564 4.214 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.226 -5.872 6.005 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.574 -6.128 6.616 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.181 -4.475 6.359 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.594 -5.099 3.687 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.564 -3.671 3.945 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -5.210 -4.794 2.611 1.00 0.00 H new ATOM 454 N ILE A 33 -3.146 -2.608 4.153 1.00 0.00 N ATOM 455 CA ILE A 33 -3.108 -1.206 4.550 1.00 0.00 C ATOM 456 C ILE A 33 -4.322 -0.842 5.397 1.00 0.00 C ATOM 457 O ILE A 33 -5.398 -0.560 4.870 1.00 0.00 O ATOM 458 CB ILE A 33 -3.054 -0.275 3.324 1.00 0.00 C ATOM 459 CG1 ILE A 33 -1.695 -0.388 2.630 1.00 0.00 C ATOM 460 CG2 ILE A 33 -3.325 1.163 3.739 1.00 0.00 C ATOM 461 CD1 ILE A 33 -1.606 0.402 1.343 1.00 0.00 C ATOM 0 H ILE A 33 -3.132 -2.761 3.145 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.202 -1.069 5.140 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.827 -0.581 2.619 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.918 -0.044 3.312 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -1.491 -1.437 2.418 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -3.283 1.809 2.862 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.314 1.231 4.193 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.572 1.482 4.460 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.615 0.275 0.906 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -2.360 0.043 0.643 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.778 1.458 1.552 1.00 0.00 H new ATOM 473 N ALA A 34 -4.141 -0.848 6.714 1.00 0.00 N ATOM 474 CA ALA A 34 -5.221 -0.515 7.635 1.00 0.00 C ATOM 475 C ALA A 34 -5.628 0.948 7.497 1.00 0.00 C ATOM 476 O ALA A 34 -6.815 1.272 7.463 1.00 0.00 O ATOM 477 CB ALA A 34 -4.805 -0.816 9.067 1.00 0.00 C ATOM 0 H ALA A 34 -3.257 -1.080 7.167 1.00 0.00 H new ATOM 0 HA ALA A 34 -6.084 -1.131 7.382 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -5.621 -0.563 9.744 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.570 -1.876 9.163 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.925 -0.225 9.322 1.00 0.00 H new ATOM 483 N ARG A 35 -4.635 1.829 7.420 1.00 0.00 N ATOM 484 CA ARG A 35 -4.891 3.258 7.288 1.00 0.00 C ATOM 485 C ARG A 35 -3.745 3.950 6.553 1.00 0.00 C ATOM 486 O ARG A 35 -2.609 3.475 6.568 1.00 0.00 O ATOM 487 CB ARG A 35 -5.083 3.893 8.667 1.00 0.00 C ATOM 488 CG ARG A 35 -4.682 5.358 8.724 1.00 0.00 C ATOM 489 CD ARG A 35 -5.055 5.986 10.058 1.00 0.00 C ATOM 490 NE ARG A 35 -6.500 6.000 10.271 1.00 0.00 N ATOM 491 CZ ARG A 35 -7.067 6.208 11.454 1.00 0.00 C ATOM 492 NH1 ARG A 35 -6.315 6.419 12.525 1.00 0.00 N ATOM 493 NH2 ARG A 35 -8.389 6.207 11.567 1.00 0.00 N ATOM 0 H ARG A 35 -3.647 1.578 7.447 1.00 0.00 H new ATOM 0 HA ARG A 35 -5.804 3.386 6.706 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -6.129 3.800 8.958 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -4.498 3.336 9.399 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -3.607 5.449 8.566 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.170 5.902 7.915 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -4.575 5.434 10.866 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -4.673 7.006 10.098 1.00 0.00 H new ATOM 0 HE ARG A 35 -7.107 5.841 9.467 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -5.298 6.422 12.442 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -6.753 6.578 13.432 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -8.971 6.046 10.745 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -8.823 6.367 12.476 1.00 0.00 H new ATOM 507 N ILE A 36 -4.053 5.072 5.912 1.00 0.00 N ATOM 508 CA ILE A 36 -3.050 5.828 5.173 1.00 0.00 C ATOM 509 C ILE A 36 -2.992 7.276 5.648 1.00 0.00 C ATOM 510 O ILE A 36 -3.913 8.058 5.406 1.00 0.00 O ATOM 511 CB ILE A 36 -3.332 5.807 3.659 1.00 0.00 C ATOM 512 CG1 ILE A 36 -3.353 4.368 3.142 1.00 0.00 C ATOM 513 CG2 ILE A 36 -2.289 6.628 2.915 1.00 0.00 C ATOM 514 CD1 ILE A 36 -4.228 4.176 1.922 1.00 0.00 C ATOM 0 H ILE A 36 -4.989 5.477 5.889 1.00 0.00 H new ATOM 0 HA ILE A 36 -2.090 5.348 5.362 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.311 6.251 3.480 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.335 4.063 2.901 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.703 3.710 3.937 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -2.501 6.604 1.846 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -2.318 7.659 3.267 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -1.299 6.210 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -4.195 3.132 1.611 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.255 4.450 2.164 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.865 4.808 1.111 1.00 0.00 H new ATOM 526 N LEU A 37 -1.904 7.627 6.325 1.00 0.00 N ATOM 527 CA LEU A 37 -1.725 8.983 6.833 1.00 0.00 C ATOM 528 C LEU A 37 -2.019 10.015 5.749 1.00 0.00 C ATOM 529 O LEU A 37 -1.221 10.212 4.831 1.00 0.00 O ATOM 530 CB LEU A 37 -0.299 9.168 7.355 1.00 0.00 C ATOM 531 CG LEU A 37 -0.073 8.823 8.828 1.00 0.00 C ATOM 532 CD1 LEU A 37 -0.427 7.368 9.095 1.00 0.00 C ATOM 533 CD2 LEU A 37 1.368 9.105 9.227 1.00 0.00 C ATOM 0 H LEU A 37 -1.133 6.992 6.535 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.429 9.133 7.652 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.370 8.554 6.752 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.007 10.206 7.197 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.726 9.452 9.433 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.260 7.140 10.148 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.475 7.197 8.849 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.200 6.722 8.480 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.510 8.854 10.278 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.039 8.502 8.616 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.588 10.162 9.074 1.00 0.00 H new ATOM 545 N HIS A 38 -3.169 10.673 5.862 1.00 0.00 N ATOM 546 CA HIS A 38 -3.567 11.687 4.892 1.00 0.00 C ATOM 547 C HIS A 38 -2.366 12.518 4.450 1.00 0.00 C ATOM 548 O HIS A 38 -1.389 12.655 5.185 1.00 0.00 O ATOM 549 CB HIS A 38 -4.641 12.598 5.488 1.00 0.00 C ATOM 550 CG HIS A 38 -4.866 13.852 4.701 1.00 0.00 C ATOM 551 ND1 HIS A 38 -3.996 14.921 4.723 1.00 0.00 N ATOM 552 CD2 HIS A 38 -5.870 14.204 3.865 1.00 0.00 C ATOM 553 CE1 HIS A 38 -4.456 15.877 3.936 1.00 0.00 C ATOM 554 NE2 HIS A 38 -5.592 15.467 3.402 1.00 0.00 N ATOM 0 H HIS A 38 -3.841 10.522 6.615 1.00 0.00 H new ATOM 0 HA HIS A 38 -3.975 11.179 4.018 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -5.579 12.046 5.553 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -4.356 12.864 6.506 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -6.730 13.603 3.609 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -3.983 16.832 3.759 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -6.169 16.001 2.752 1.00 0.00 H new ATOM 563 N GLY A 39 -2.446 13.070 3.243 1.00 0.00 N ATOM 564 CA GLY A 39 -1.359 13.879 2.724 1.00 0.00 C ATOM 565 C GLY A 39 -0.043 13.127 2.687 1.00 0.00 C ATOM 566 O GLY A 39 0.718 13.147 3.653 1.00 0.00 O ATOM 0 H GLY A 39 -3.244 12.971 2.616 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.609 14.216 1.718 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.247 14.771 3.341 1.00 0.00 H new ATOM 570 N GLY A 40 0.225 12.461 1.568 1.00 0.00 N ATOM 571 CA GLY A 40 1.457 11.707 1.431 1.00 0.00 C ATOM 572 C GLY A 40 1.532 10.952 0.119 1.00 0.00 C ATOM 573 O GLY A 40 0.638 11.063 -0.721 1.00 0.00 O ATOM 0 H GLY A 40 -0.389 12.430 0.754 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.306 12.387 1.504 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.542 11.002 2.258 1.00 0.00 H new ATOM 577 N MET A 41 2.601 10.183 -0.060 1.00 0.00 N ATOM 578 CA MET A 41 2.788 9.407 -1.280 1.00 0.00 C ATOM 579 C MET A 41 1.524 8.628 -1.629 1.00 0.00 C ATOM 580 O MET A 41 0.839 8.942 -2.602 1.00 0.00 O ATOM 581 CB MET A 41 3.967 8.444 -1.121 1.00 0.00 C ATOM 582 CG MET A 41 4.357 7.743 -2.413 1.00 0.00 C ATOM 583 SD MET A 41 5.248 8.824 -3.547 1.00 0.00 S ATOM 584 CE MET A 41 6.839 8.934 -2.731 1.00 0.00 C ATOM 0 H MET A 41 3.351 10.081 0.624 1.00 0.00 H new ATOM 0 HA MET A 41 3.001 10.101 -2.093 1.00 0.00 H new ATOM 0 HB2 MET A 41 4.828 8.995 -0.742 1.00 0.00 H new ATOM 0 HB3 MET A 41 3.714 7.694 -0.372 1.00 0.00 H new ATOM 0 HG2 MET A 41 4.977 6.877 -2.179 1.00 0.00 H new ATOM 0 HG3 MET A 41 3.459 7.369 -2.904 1.00 0.00 H new ATOM 0 HE1 MET A 41 7.584 9.305 -3.435 1.00 0.00 H new ATOM 0 HE2 MET A 41 6.767 9.617 -1.885 1.00 0.00 H new ATOM 0 HE3 MET A 41 7.135 7.947 -2.376 1.00 0.00 H new ATOM 594 N VAL A 42 1.220 7.611 -0.828 1.00 0.00 N ATOM 595 CA VAL A 42 0.038 6.788 -1.053 1.00 0.00 C ATOM 596 C VAL A 42 -1.231 7.634 -1.036 1.00 0.00 C ATOM 597 O VAL A 42 -2.014 7.614 -1.985 1.00 0.00 O ATOM 598 CB VAL A 42 -0.084 5.680 0.010 1.00 0.00 C ATOM 599 CG1 VAL A 42 -1.422 4.968 -0.113 1.00 0.00 C ATOM 600 CG2 VAL A 42 1.067 4.693 -0.116 1.00 0.00 C ATOM 0 H VAL A 42 1.776 7.338 -0.018 1.00 0.00 H new ATOM 0 HA VAL A 42 0.153 6.329 -2.035 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.033 6.140 0.997 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -1.490 4.189 0.646 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.230 5.685 0.030 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -1.506 4.519 -1.103 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.965 3.917 0.642 1.00 0.00 H new ATOM 0 HG22 VAL A 42 1.049 4.237 -1.106 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.012 5.217 0.025 1.00 0.00 H new ATOM 610 N ALA A 43 -1.427 8.376 0.048 1.00 0.00 N ATOM 611 CA ALA A 43 -2.599 9.231 0.187 1.00 0.00 C ATOM 612 C ALA A 43 -2.926 9.932 -1.127 1.00 0.00 C ATOM 613 O ALA A 43 -4.070 9.918 -1.579 1.00 0.00 O ATOM 614 CB ALA A 43 -2.379 10.253 1.293 1.00 0.00 C ATOM 0 H ALA A 43 -0.789 8.402 0.843 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.448 8.601 0.453 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.262 10.885 1.386 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.202 9.736 2.236 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.515 10.871 1.050 1.00 0.00 H new ATOM 620 N GLN A 44 -1.914 10.545 -1.733 1.00 0.00 N ATOM 621 CA GLN A 44 -2.096 11.253 -2.994 1.00 0.00 C ATOM 622 C GLN A 44 -2.262 10.272 -4.150 1.00 0.00 C ATOM 623 O GLN A 44 -3.077 10.487 -5.046 1.00 0.00 O ATOM 624 CB GLN A 44 -0.907 12.177 -3.261 1.00 0.00 C ATOM 625 CG GLN A 44 -0.827 13.356 -2.305 1.00 0.00 C ATOM 626 CD GLN A 44 -2.096 14.185 -2.294 1.00 0.00 C ATOM 627 OE1 GLN A 44 -3.007 13.936 -1.503 1.00 0.00 O ATOM 628 NE2 GLN A 44 -2.163 15.178 -3.173 1.00 0.00 N ATOM 0 H GLN A 44 -0.961 10.565 -1.371 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.003 11.853 -2.917 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.015 11.599 -3.190 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -0.971 12.552 -4.283 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -0.628 12.989 -1.298 1.00 0.00 H new ATOM 0 HG3 GLN A 44 0.014 13.990 -2.585 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.385 15.349 -3.810 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.993 15.770 -3.211 1.00 0.00 H new ATOM 637 N GLN A 45 -1.482 9.195 -4.123 1.00 0.00 N ATOM 638 CA GLN A 45 -1.543 8.182 -5.170 1.00 0.00 C ATOM 639 C GLN A 45 -2.687 7.206 -4.917 1.00 0.00 C ATOM 640 O GLN A 45 -2.590 6.329 -4.061 1.00 0.00 O ATOM 641 CB GLN A 45 -0.217 7.423 -5.251 1.00 0.00 C ATOM 642 CG GLN A 45 0.838 8.128 -6.086 1.00 0.00 C ATOM 643 CD GLN A 45 2.228 7.561 -5.872 1.00 0.00 C ATOM 644 OE1 GLN A 45 2.397 6.534 -5.213 1.00 0.00 O ATOM 645 NE2 GLN A 45 3.232 8.229 -6.427 1.00 0.00 N ATOM 0 H GLN A 45 -0.801 9.002 -3.388 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.724 8.686 -6.119 1.00 0.00 H new ATOM 0 HB2 GLN A 45 0.169 7.275 -4.243 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -0.399 6.434 -5.671 1.00 0.00 H new ATOM 0 HG2 GLN A 45 0.575 8.046 -7.141 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.841 9.190 -5.839 1.00 0.00 H new ATOM 0 HE21 GLN A 45 3.046 9.075 -6.965 1.00 0.00 H new ATOM 0 HE22 GLN A 45 4.190 7.896 -6.316 1.00 0.00 H new ATOM 654 N GLY A 46 -3.772 7.366 -5.669 1.00 0.00 N ATOM 655 CA GLY A 46 -4.920 6.492 -5.511 1.00 0.00 C ATOM 656 C GLY A 46 -4.574 5.034 -5.738 1.00 0.00 C ATOM 657 O GLY A 46 -5.282 4.140 -5.272 1.00 0.00 O ATOM 0 H GLY A 46 -3.876 8.085 -6.385 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -5.330 6.613 -4.508 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -5.699 6.791 -6.212 1.00 0.00 H new ATOM 661 N LEU A 47 -3.483 4.791 -6.457 1.00 0.00 N ATOM 662 CA LEU A 47 -3.045 3.430 -6.746 1.00 0.00 C ATOM 663 C LEU A 47 -3.253 2.523 -5.538 1.00 0.00 C ATOM 664 O LEU A 47 -3.790 1.421 -5.661 1.00 0.00 O ATOM 665 CB LEU A 47 -1.571 3.424 -7.156 1.00 0.00 C ATOM 666 CG LEU A 47 -1.212 4.266 -8.381 1.00 0.00 C ATOM 667 CD1 LEU A 47 0.280 4.559 -8.408 1.00 0.00 C ATOM 668 CD2 LEU A 47 -1.641 3.560 -9.658 1.00 0.00 C ATOM 0 H LEU A 47 -2.886 5.519 -6.850 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.647 3.048 -7.571 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.978 3.776 -6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.272 2.394 -7.348 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.747 5.213 -8.316 1.00 0.00 H new ATOM 0 HD11 LEU A 47 0.517 5.159 -9.287 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.560 5.107 -7.508 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.834 3.621 -8.449 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.378 4.174 -10.519 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -1.134 2.598 -9.730 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.719 3.402 -9.642 1.00 0.00 H new ATOM 680 N LEU A 48 -2.826 2.993 -4.372 1.00 0.00 N ATOM 681 CA LEU A 48 -2.966 2.225 -3.139 1.00 0.00 C ATOM 682 C LEU A 48 -3.998 2.863 -2.215 1.00 0.00 C ATOM 683 O LEU A 48 -4.127 4.087 -2.162 1.00 0.00 O ATOM 684 CB LEU A 48 -1.619 2.120 -2.424 1.00 0.00 C ATOM 685 CG LEU A 48 -0.417 1.770 -3.302 1.00 0.00 C ATOM 686 CD1 LEU A 48 0.882 2.123 -2.596 1.00 0.00 C ATOM 687 CD2 LEU A 48 -0.441 0.294 -3.674 1.00 0.00 C ATOM 0 H LEU A 48 -2.380 3.902 -4.254 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.309 1.224 -3.400 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.418 3.071 -1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.704 1.366 -1.642 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.478 2.357 -4.219 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.726 1.867 -3.237 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.901 3.192 -2.382 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.952 1.564 -1.663 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.421 0.062 -4.299 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.405 -0.310 -2.768 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -1.356 0.072 -4.222 1.00 0.00 H new ATOM 699 N HIS A 49 -4.730 2.027 -1.485 1.00 0.00 N ATOM 700 CA HIS A 49 -5.748 2.509 -0.560 1.00 0.00 C ATOM 701 C HIS A 49 -6.046 1.466 0.513 1.00 0.00 C ATOM 702 O HIS A 49 -5.612 0.318 0.415 1.00 0.00 O ATOM 703 CB HIS A 49 -7.030 2.860 -1.316 1.00 0.00 C ATOM 704 CG HIS A 49 -7.063 4.271 -1.817 1.00 0.00 C ATOM 705 ND1 HIS A 49 -6.691 5.352 -1.046 1.00 0.00 N ATOM 706 CD2 HIS A 49 -7.426 4.776 -3.019 1.00 0.00 C ATOM 707 CE1 HIS A 49 -6.825 6.460 -1.752 1.00 0.00 C ATOM 708 NE2 HIS A 49 -7.270 6.138 -2.953 1.00 0.00 N ATOM 0 H HIS A 49 -4.636 1.012 -1.517 1.00 0.00 H new ATOM 0 HA HIS A 49 -5.365 3.406 -0.073 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -7.141 2.181 -2.161 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -7.885 2.696 -0.660 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -7.774 4.212 -3.872 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -6.608 7.460 -1.406 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -7.466 6.795 -3.709 1.00 0.00 H new ATOM 717 N VAL A 50 -6.788 1.874 1.538 1.00 0.00 N ATOM 718 CA VAL A 50 -7.144 0.974 2.629 1.00 0.00 C ATOM 719 C VAL A 50 -7.831 -0.282 2.104 1.00 0.00 C ATOM 720 O VAL A 50 -8.981 -0.237 1.670 1.00 0.00 O ATOM 721 CB VAL A 50 -8.071 1.666 3.647 1.00 0.00 C ATOM 722 CG1 VAL A 50 -8.541 0.675 4.701 1.00 0.00 C ATOM 723 CG2 VAL A 50 -7.364 2.848 4.292 1.00 0.00 C ATOM 0 H VAL A 50 -7.154 2.821 1.636 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.215 0.695 3.126 1.00 0.00 H new ATOM 0 HB VAL A 50 -8.948 2.040 3.119 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.194 1.182 5.411 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -9.088 -0.136 4.220 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -7.678 0.268 5.228 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.033 3.325 5.008 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.469 2.500 4.808 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -7.083 3.567 3.523 1.00 0.00 H new ATOM 733 N GLY A 51 -7.117 -1.402 2.148 1.00 0.00 N ATOM 734 CA GLY A 51 -7.674 -2.656 1.675 1.00 0.00 C ATOM 735 C GLY A 51 -6.812 -3.309 0.613 1.00 0.00 C ATOM 736 O GLY A 51 -7.305 -4.085 -0.206 1.00 0.00 O ATOM 0 H GLY A 51 -6.163 -1.464 2.503 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.789 -3.339 2.516 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -8.671 -2.478 1.271 1.00 0.00 H new ATOM 740 N ASP A 52 -5.521 -2.995 0.626 1.00 0.00 N ATOM 741 CA ASP A 52 -4.588 -3.557 -0.344 1.00 0.00 C ATOM 742 C ASP A 52 -3.673 -4.585 0.315 1.00 0.00 C ATOM 743 O ASP A 52 -2.992 -4.286 1.296 1.00 0.00 O ATOM 744 CB ASP A 52 -3.751 -2.446 -0.981 1.00 0.00 C ATOM 745 CG ASP A 52 -4.396 -1.881 -2.231 1.00 0.00 C ATOM 746 OD1 ASP A 52 -5.189 -2.605 -2.868 1.00 0.00 O ATOM 747 OD2 ASP A 52 -4.107 -0.715 -2.573 1.00 0.00 O ATOM 0 H ASP A 52 -5.097 -2.355 1.297 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.167 -4.057 -1.121 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -3.605 -1.644 -0.257 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -2.764 -2.836 -1.229 1.00 0.00 H new ATOM 752 N ILE A 53 -3.664 -5.796 -0.230 1.00 0.00 N ATOM 753 CA ILE A 53 -2.834 -6.868 0.305 1.00 0.00 C ATOM 754 C ILE A 53 -1.515 -6.973 -0.455 1.00 0.00 C ATOM 755 O ILE A 53 -1.502 -7.111 -1.678 1.00 0.00 O ATOM 756 CB ILE A 53 -3.558 -8.226 0.243 1.00 0.00 C ATOM 757 CG1 ILE A 53 -4.936 -8.123 0.899 1.00 0.00 C ATOM 758 CG2 ILE A 53 -2.723 -9.303 0.919 1.00 0.00 C ATOM 759 CD1 ILE A 53 -5.746 -9.398 0.808 1.00 0.00 C ATOM 0 H ILE A 53 -4.222 -6.060 -1.042 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.632 -6.620 1.347 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.693 -8.502 -0.803 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.811 -7.856 1.948 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -5.494 -7.313 0.428 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.248 -10.257 0.867 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -1.762 -9.390 0.412 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.560 -9.035 1.963 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -6.711 -9.252 1.294 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.903 -9.656 -0.239 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -5.209 -10.206 1.304 1.00 0.00 H new ATOM 771 N ILE A 54 -0.410 -6.909 0.279 1.00 0.00 N ATOM 772 CA ILE A 54 0.914 -7.000 -0.325 1.00 0.00 C ATOM 773 C ILE A 54 1.467 -8.417 -0.226 1.00 0.00 C ATOM 774 O ILE A 54 1.344 -9.073 0.809 1.00 0.00 O ATOM 775 CB ILE A 54 1.905 -6.026 0.341 1.00 0.00 C ATOM 776 CG1 ILE A 54 1.296 -4.625 0.428 1.00 0.00 C ATOM 777 CG2 ILE A 54 3.215 -5.993 -0.432 1.00 0.00 C ATOM 778 CD1 ILE A 54 2.145 -3.645 1.206 1.00 0.00 C ATOM 0 H ILE A 54 -0.405 -6.795 1.293 1.00 0.00 H new ATOM 0 HA ILE A 54 0.801 -6.729 -1.375 1.00 0.00 H new ATOM 0 HB ILE A 54 2.111 -6.375 1.353 1.00 0.00 H new ATOM 0 HG12 ILE A 54 1.144 -4.241 -0.580 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.314 -4.693 0.895 1.00 0.00 H new ATOM 0 HG21 ILE A 54 3.905 -5.301 0.051 1.00 0.00 H new ATOM 0 HG22 ILE A 54 3.654 -6.991 -0.447 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.026 -5.664 -1.454 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.652 -2.673 1.227 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.276 -4.007 2.226 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.119 -3.548 0.727 1.00 0.00 H new ATOM 790 N LYS A 55 2.080 -8.884 -1.309 1.00 0.00 N ATOM 791 CA LYS A 55 2.656 -10.223 -1.345 1.00 0.00 C ATOM 792 C LYS A 55 4.180 -10.161 -1.302 1.00 0.00 C ATOM 793 O LYS A 55 4.809 -10.759 -0.430 1.00 0.00 O ATOM 794 CB LYS A 55 2.200 -10.963 -2.604 1.00 0.00 C ATOM 795 CG LYS A 55 0.902 -11.729 -2.423 1.00 0.00 C ATOM 796 CD LYS A 55 1.150 -13.128 -1.884 1.00 0.00 C ATOM 797 CE LYS A 55 1.361 -14.130 -3.010 1.00 0.00 C ATOM 798 NZ LYS A 55 2.782 -14.176 -3.452 1.00 0.00 N ATOM 0 H LYS A 55 2.191 -8.354 -2.174 1.00 0.00 H new ATOM 0 HA LYS A 55 2.307 -10.765 -0.466 1.00 0.00 H new ATOM 0 HB2 LYS A 55 2.078 -10.244 -3.414 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.982 -11.658 -2.910 1.00 0.00 H new ATOM 0 HG2 LYS A 55 0.250 -11.185 -1.739 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.380 -11.793 -3.378 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.025 -13.119 -1.235 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.303 -13.439 -1.273 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.052 -15.121 -2.677 1.00 0.00 H new ATOM 0 HE3 LYS A 55 0.726 -13.865 -3.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.988 -15.109 -3.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.947 -13.438 -4.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.405 -14.013 -2.635 1.00 0.00 H new ATOM 812 N GLU A 56 4.764 -9.433 -2.248 1.00 0.00 N ATOM 813 CA GLU A 56 6.214 -9.293 -2.316 1.00 0.00 C ATOM 814 C GLU A 56 6.605 -7.882 -2.744 1.00 0.00 C ATOM 815 O GLU A 56 5.871 -7.216 -3.474 1.00 0.00 O ATOM 816 CB GLU A 56 6.802 -10.315 -3.293 1.00 0.00 C ATOM 817 CG GLU A 56 8.266 -10.630 -3.036 1.00 0.00 C ATOM 818 CD GLU A 56 8.454 -11.753 -2.034 1.00 0.00 C ATOM 819 OE1 GLU A 56 7.616 -11.874 -1.116 1.00 0.00 O ATOM 820 OE2 GLU A 56 9.438 -12.509 -2.167 1.00 0.00 O ATOM 0 H GLU A 56 4.256 -8.932 -2.977 1.00 0.00 H new ATOM 0 HA GLU A 56 6.618 -9.477 -1.321 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.224 -11.237 -3.232 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.693 -9.937 -4.310 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.746 -10.903 -3.976 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.768 -9.734 -2.670 1.00 0.00 H new ATOM 827 N VAL A 57 7.768 -7.431 -2.283 1.00 0.00 N ATOM 828 CA VAL A 57 8.258 -6.099 -2.617 1.00 0.00 C ATOM 829 C VAL A 57 9.706 -6.149 -3.092 1.00 0.00 C ATOM 830 O VAL A 57 10.609 -6.484 -2.326 1.00 0.00 O ATOM 831 CB VAL A 57 8.157 -5.145 -1.412 1.00 0.00 C ATOM 832 CG1 VAL A 57 8.945 -3.870 -1.672 1.00 0.00 C ATOM 833 CG2 VAL A 57 6.701 -4.828 -1.104 1.00 0.00 C ATOM 0 H VAL A 57 8.388 -7.969 -1.677 1.00 0.00 H new ATOM 0 HA VAL A 57 7.627 -5.723 -3.422 1.00 0.00 H new ATOM 0 HB VAL A 57 8.589 -5.640 -0.542 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.862 -3.209 -0.810 1.00 0.00 H new ATOM 0 HG12 VAL A 57 9.993 -4.118 -1.839 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.546 -3.369 -2.554 1.00 0.00 H new ATOM 0 HG21 VAL A 57 6.648 -4.153 -0.250 1.00 0.00 H new ATOM 0 HG22 VAL A 57 6.241 -4.353 -1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 57 6.169 -5.750 -0.871 1.00 0.00 H new ATOM 843 N ASN A 58 9.919 -5.813 -4.360 1.00 0.00 N ATOM 844 CA ASN A 58 11.258 -5.820 -4.937 1.00 0.00 C ATOM 845 C ASN A 58 11.877 -7.212 -4.860 1.00 0.00 C ATOM 846 O ASN A 58 13.085 -7.357 -4.680 1.00 0.00 O ATOM 847 CB ASN A 58 12.153 -4.811 -4.214 1.00 0.00 C ATOM 848 CG ASN A 58 11.941 -3.393 -4.707 1.00 0.00 C ATOM 849 OD1 ASN A 58 11.445 -3.175 -5.812 1.00 0.00 O ATOM 850 ND2 ASN A 58 12.316 -2.419 -3.885 1.00 0.00 N ATOM 0 H ASN A 58 9.182 -5.533 -5.007 1.00 0.00 H new ATOM 0 HA ASN A 58 11.175 -5.536 -5.986 1.00 0.00 H new ATOM 0 HB2 ASN A 58 11.953 -4.854 -3.143 1.00 0.00 H new ATOM 0 HB3 ASN A 58 13.197 -5.089 -4.355 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.197 -1.444 -4.161 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.723 -2.646 -2.978 1.00 0.00 H new ATOM 857 N GLY A 59 11.039 -8.235 -4.999 1.00 0.00 N ATOM 858 CA GLY A 59 11.521 -9.602 -4.943 1.00 0.00 C ATOM 859 C GLY A 59 11.956 -10.007 -3.549 1.00 0.00 C ATOM 860 O GLY A 59 12.870 -10.815 -3.387 1.00 0.00 O ATOM 0 H GLY A 59 10.035 -8.141 -5.149 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.735 -10.275 -5.285 1.00 0.00 H new ATOM 0 HA3 GLY A 59 12.360 -9.717 -5.630 1.00 0.00 H new ATOM 864 N GLN A 60 11.302 -9.442 -2.539 1.00 0.00 N ATOM 865 CA GLN A 60 11.629 -9.747 -1.151 1.00 0.00 C ATOM 866 C GLN A 60 10.363 -9.907 -0.316 1.00 0.00 C ATOM 867 O GLN A 60 9.370 -9.206 -0.509 1.00 0.00 O ATOM 868 CB GLN A 60 12.509 -8.645 -0.558 1.00 0.00 C ATOM 869 CG GLN A 60 13.982 -8.792 -0.904 1.00 0.00 C ATOM 870 CD GLN A 60 14.658 -9.901 -0.122 1.00 0.00 C ATOM 871 OE1 GLN A 60 14.758 -11.035 -0.591 1.00 0.00 O ATOM 872 NE2 GLN A 60 15.126 -9.579 1.078 1.00 0.00 N ATOM 0 H GLN A 60 10.543 -8.771 -2.656 1.00 0.00 H new ATOM 0 HA GLN A 60 12.177 -10.689 -1.132 1.00 0.00 H new ATOM 0 HB2 GLN A 60 12.155 -7.678 -0.914 1.00 0.00 H new ATOM 0 HB3 GLN A 60 12.397 -8.646 0.526 1.00 0.00 H new ATOM 0 HG2 GLN A 60 14.082 -8.992 -1.971 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.493 -7.850 -0.707 1.00 0.00 H new ATOM 0 HE21 GLN A 60 15.021 -8.626 1.427 1.00 0.00 H new ATOM 0 HE22 GLN A 60 15.590 -10.284 1.650 1.00 0.00 H new ATOM 881 N PRO A 61 10.396 -10.854 0.634 1.00 0.00 N ATOM 882 CA PRO A 61 9.259 -11.128 1.518 1.00 0.00 C ATOM 883 C PRO A 61 9.012 -9.999 2.513 1.00 0.00 C ATOM 884 O PRO A 61 9.921 -9.579 3.228 1.00 0.00 O ATOM 885 CB PRO A 61 9.680 -12.404 2.251 1.00 0.00 C ATOM 886 CG PRO A 61 11.169 -12.387 2.217 1.00 0.00 C ATOM 887 CD PRO A 61 11.546 -11.728 0.919 1.00 0.00 C ATOM 0 HA PRO A 61 8.326 -11.226 0.963 1.00 0.00 H new ATOM 0 HB2 PRO A 61 9.308 -12.413 3.275 1.00 0.00 H new ATOM 0 HB3 PRO A 61 9.283 -13.292 1.759 1.00 0.00 H new ATOM 0 HG2 PRO A 61 11.572 -11.836 3.066 1.00 0.00 H new ATOM 0 HG3 PRO A 61 11.572 -13.398 2.273 1.00 0.00 H new ATOM 0 HD2 PRO A 61 12.471 -11.158 1.011 1.00 0.00 H new ATOM 0 HD3 PRO A 61 11.700 -12.460 0.126 1.00 0.00 H new ATOM 895 N VAL A 62 7.776 -9.512 2.553 1.00 0.00 N ATOM 896 CA VAL A 62 7.409 -8.432 3.462 1.00 0.00 C ATOM 897 C VAL A 62 7.312 -8.933 4.899 1.00 0.00 C ATOM 898 O VAL A 62 7.683 -8.230 5.838 1.00 0.00 O ATOM 899 CB VAL A 62 6.067 -7.793 3.061 1.00 0.00 C ATOM 900 CG1 VAL A 62 6.161 -7.179 1.672 1.00 0.00 C ATOM 901 CG2 VAL A 62 4.947 -8.821 3.123 1.00 0.00 C ATOM 0 H VAL A 62 7.012 -9.848 1.967 1.00 0.00 H new ATOM 0 HA VAL A 62 8.195 -7.680 3.395 1.00 0.00 H new ATOM 0 HB VAL A 62 5.838 -6.997 3.770 1.00 0.00 H new ATOM 0 HG11 VAL A 62 5.203 -6.732 1.406 1.00 0.00 H new ATOM 0 HG12 VAL A 62 6.934 -6.411 1.665 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.413 -7.954 0.948 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.006 -8.352 2.836 1.00 0.00 H new ATOM 0 HG22 VAL A 62 5.167 -9.640 2.439 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.865 -9.209 4.138 1.00 0.00 H new ATOM 911 N GLY A 63 6.811 -10.153 5.062 1.00 0.00 N ATOM 912 CA GLY A 63 6.674 -10.728 6.388 1.00 0.00 C ATOM 913 C GLY A 63 5.357 -10.363 7.045 1.00 0.00 C ATOM 914 O GLY A 63 4.652 -9.468 6.581 1.00 0.00 O ATOM 0 H GLY A 63 6.497 -10.754 4.300 1.00 0.00 H new ATOM 0 HA2 GLY A 63 6.754 -11.813 6.320 1.00 0.00 H new ATOM 0 HA3 GLY A 63 7.497 -10.386 7.016 1.00 0.00 H new ATOM 918 N SER A 64 5.025 -11.060 8.127 1.00 0.00 N ATOM 919 CA SER A 64 3.781 -10.809 8.845 1.00 0.00 C ATOM 920 C SER A 64 3.973 -9.725 9.902 1.00 0.00 C ATOM 921 O SER A 64 3.442 -9.819 11.008 1.00 0.00 O ATOM 922 CB SER A 64 3.279 -12.095 9.503 1.00 0.00 C ATOM 923 OG SER A 64 4.121 -12.482 10.576 1.00 0.00 O ATOM 0 H SER A 64 5.600 -11.802 8.525 1.00 0.00 H new ATOM 0 HA SER A 64 3.039 -10.464 8.126 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.263 -11.947 9.869 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.238 -12.894 8.763 1.00 0.00 H new ATOM 0 HG SER A 64 3.777 -13.306 10.981 1.00 0.00 H new ATOM 929 N ASP A 65 4.738 -8.696 9.552 1.00 0.00 N ATOM 930 CA ASP A 65 5.001 -7.593 10.469 1.00 0.00 C ATOM 931 C ASP A 65 4.771 -6.250 9.782 1.00 0.00 C ATOM 932 O ASP A 65 5.527 -5.836 8.903 1.00 0.00 O ATOM 933 CB ASP A 65 6.434 -7.671 10.997 1.00 0.00 C ATOM 934 CG ASP A 65 6.759 -9.028 11.590 1.00 0.00 C ATOM 935 OD1 ASP A 65 6.492 -9.229 12.794 1.00 0.00 O ATOM 936 OD2 ASP A 65 7.280 -9.889 10.851 1.00 0.00 O ATOM 0 H ASP A 65 5.186 -8.603 8.641 1.00 0.00 H new ATOM 0 HA ASP A 65 4.309 -7.676 11.307 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.129 -7.456 10.186 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.581 -6.902 11.755 1.00 0.00 H new ATOM 941 N PRO A 66 3.701 -5.551 10.191 1.00 0.00 N ATOM 942 CA PRO A 66 3.346 -4.245 9.629 1.00 0.00 C ATOM 943 C PRO A 66 4.334 -3.154 10.029 1.00 0.00 C ATOM 944 O PRO A 66 4.818 -2.402 9.183 1.00 0.00 O ATOM 945 CB PRO A 66 1.967 -3.963 10.229 1.00 0.00 C ATOM 946 CG PRO A 66 1.936 -4.750 11.494 1.00 0.00 C ATOM 947 CD PRO A 66 2.756 -5.983 11.235 1.00 0.00 C ATOM 0 HA PRO A 66 3.358 -4.254 8.539 1.00 0.00 H new ATOM 0 HB2 PRO A 66 1.829 -2.899 10.421 1.00 0.00 H new ATOM 0 HB3 PRO A 66 1.170 -4.271 9.552 1.00 0.00 H new ATOM 0 HG2 PRO A 66 2.349 -4.174 12.322 1.00 0.00 H new ATOM 0 HG3 PRO A 66 0.913 -5.011 11.766 1.00 0.00 H new ATOM 0 HD2 PRO A 66 3.275 -6.317 12.134 1.00 0.00 H new ATOM 0 HD3 PRO A 66 2.137 -6.814 10.898 1.00 0.00 H new ATOM 955 N ARG A 67 4.628 -3.074 11.322 1.00 0.00 N ATOM 956 CA ARG A 67 5.558 -2.075 11.834 1.00 0.00 C ATOM 957 C ARG A 67 6.950 -2.273 11.242 1.00 0.00 C ATOM 958 O ARG A 67 7.725 -1.325 11.121 1.00 0.00 O ATOM 959 CB ARG A 67 5.627 -2.145 13.361 1.00 0.00 C ATOM 960 CG ARG A 67 4.276 -1.985 14.039 1.00 0.00 C ATOM 961 CD ARG A 67 4.333 -2.401 15.500 1.00 0.00 C ATOM 962 NE ARG A 67 3.374 -1.663 16.318 1.00 0.00 N ATOM 963 CZ ARG A 67 3.307 -1.762 17.641 1.00 0.00 C ATOM 964 NH1 ARG A 67 4.139 -2.562 18.293 1.00 0.00 N ATOM 965 NH2 ARG A 67 2.407 -1.058 18.315 1.00 0.00 N ATOM 0 H ARG A 67 4.236 -3.689 12.035 1.00 0.00 H new ATOM 0 HA ARG A 67 5.193 -1.091 11.538 1.00 0.00 H new ATOM 0 HB2 ARG A 67 6.060 -3.102 13.653 1.00 0.00 H new ATOM 0 HB3 ARG A 67 6.300 -1.367 13.722 1.00 0.00 H new ATOM 0 HG2 ARG A 67 3.953 -0.946 13.968 1.00 0.00 H new ATOM 0 HG3 ARG A 67 3.532 -2.587 13.517 1.00 0.00 H new ATOM 0 HD2 ARG A 67 4.132 -3.469 15.581 1.00 0.00 H new ATOM 0 HD3 ARG A 67 5.340 -2.236 15.885 1.00 0.00 H new ATOM 0 HE ARG A 67 2.720 -1.037 15.848 1.00 0.00 H new ATOM 0 HH11 ARG A 67 4.833 -3.104 17.779 1.00 0.00 H new ATOM 0 HH12 ARG A 67 4.085 -2.636 19.309 1.00 0.00 H new ATOM 0 HH21 ARG A 67 1.766 -0.440 17.817 1.00 0.00 H new ATOM 0 HH22 ARG A 67 2.356 -1.135 19.331 1.00 0.00 H new ATOM 979 N ALA A 68 7.260 -3.513 10.876 1.00 0.00 N ATOM 980 CA ALA A 68 8.558 -3.835 10.295 1.00 0.00 C ATOM 981 C ALA A 68 8.580 -3.537 8.800 1.00 0.00 C ATOM 982 O ALA A 68 9.630 -3.230 8.233 1.00 0.00 O ATOM 983 CB ALA A 68 8.901 -5.296 10.549 1.00 0.00 C ATOM 0 H ALA A 68 6.631 -4.310 10.971 1.00 0.00 H new ATOM 0 HA ALA A 68 9.309 -3.207 10.775 1.00 0.00 H new ATOM 0 HB1 ALA A 68 9.872 -5.523 10.110 1.00 0.00 H new ATOM 0 HB2 ALA A 68 8.936 -5.480 11.623 1.00 0.00 H new ATOM 0 HB3 ALA A 68 8.141 -5.932 10.096 1.00 0.00 H new ATOM 989 N LEU A 69 7.417 -3.629 8.166 1.00 0.00 N ATOM 990 CA LEU A 69 7.302 -3.369 6.735 1.00 0.00 C ATOM 991 C LEU A 69 7.490 -1.885 6.434 1.00 0.00 C ATOM 992 O LEU A 69 8.382 -1.504 5.677 1.00 0.00 O ATOM 993 CB LEU A 69 5.941 -3.838 6.219 1.00 0.00 C ATOM 994 CG LEU A 69 5.394 -3.095 4.999 1.00 0.00 C ATOM 995 CD1 LEU A 69 6.261 -3.361 3.778 1.00 0.00 C ATOM 996 CD2 LEU A 69 3.952 -3.500 4.730 1.00 0.00 C ATOM 0 H LEU A 69 6.539 -3.882 8.620 1.00 0.00 H new ATOM 0 HA LEU A 69 8.088 -3.926 6.225 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.014 -4.897 5.972 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.217 -3.748 7.029 1.00 0.00 H new ATOM 0 HG LEU A 69 5.417 -2.026 5.209 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.856 -2.824 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.278 -3.020 3.973 1.00 0.00 H new ATOM 0 HD13 LEU A 69 6.271 -4.430 3.565 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.579 -2.962 3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.904 -4.573 4.541 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.338 -3.256 5.597 1.00 0.00 H new ATOM 1008 N GLN A 70 6.645 -1.054 7.035 1.00 0.00 N ATOM 1009 CA GLN A 70 6.719 0.388 6.832 1.00 0.00 C ATOM 1010 C GLN A 70 8.157 0.882 6.954 1.00 0.00 C ATOM 1011 O GLN A 70 8.512 1.927 6.410 1.00 0.00 O ATOM 1012 CB GLN A 70 5.832 1.113 7.845 1.00 0.00 C ATOM 1013 CG GLN A 70 4.380 0.662 7.815 1.00 0.00 C ATOM 1014 CD GLN A 70 3.660 0.926 9.122 1.00 0.00 C ATOM 1015 OE1 GLN A 70 3.794 1.998 9.713 1.00 0.00 O ATOM 1016 NE2 GLN A 70 2.889 -0.053 9.582 1.00 0.00 N ATOM 0 H GLN A 70 5.902 -1.354 7.666 1.00 0.00 H new ATOM 0 HA GLN A 70 6.363 0.606 5.825 1.00 0.00 H new ATOM 0 HB2 GLN A 70 6.233 0.953 8.846 1.00 0.00 H new ATOM 0 HB3 GLN A 70 5.875 2.185 7.652 1.00 0.00 H new ATOM 0 HG2 GLN A 70 3.860 1.178 7.008 1.00 0.00 H new ATOM 0 HG3 GLN A 70 4.339 -0.404 7.591 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.807 -0.925 9.060 1.00 0.00 H new ATOM 0 HE22 GLN A 70 2.379 0.068 10.457 1.00 0.00 H new ATOM 1025 N GLU A 71 8.980 0.122 7.671 1.00 0.00 N ATOM 1026 CA GLU A 71 10.379 0.484 7.864 1.00 0.00 C ATOM 1027 C GLU A 71 11.225 0.043 6.673 1.00 0.00 C ATOM 1028 O GLU A 71 12.181 0.719 6.292 1.00 0.00 O ATOM 1029 CB GLU A 71 10.919 -0.147 9.149 1.00 0.00 C ATOM 1030 CG GLU A 71 12.379 0.178 9.420 1.00 0.00 C ATOM 1031 CD GLU A 71 13.322 -0.544 8.478 1.00 0.00 C ATOM 1032 OE1 GLU A 71 12.928 -1.597 7.935 1.00 0.00 O ATOM 1033 OE2 GLU A 71 14.454 -0.055 8.283 1.00 0.00 O ATOM 0 H GLU A 71 8.702 -0.747 8.127 1.00 0.00 H new ATOM 0 HA GLU A 71 10.439 1.569 7.947 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.317 0.193 9.992 1.00 0.00 H new ATOM 0 HB3 GLU A 71 10.801 -1.229 9.090 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.531 1.253 9.327 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.622 -0.091 10.448 1.00 0.00 H new ATOM 1040 N LEU A 72 10.866 -1.095 6.090 1.00 0.00 N ATOM 1041 CA LEU A 72 11.591 -1.629 4.942 1.00 0.00 C ATOM 1042 C LEU A 72 11.618 -0.620 3.799 1.00 0.00 C ATOM 1043 O LEU A 72 12.650 -0.422 3.155 1.00 0.00 O ATOM 1044 CB LEU A 72 10.950 -2.935 4.471 1.00 0.00 C ATOM 1045 CG LEU A 72 9.859 -2.801 3.407 1.00 0.00 C ATOM 1046 CD1 LEU A 72 10.467 -2.437 2.062 1.00 0.00 C ATOM 1047 CD2 LEU A 72 9.057 -4.090 3.301 1.00 0.00 C ATOM 0 H LEU A 72 10.077 -1.666 6.393 1.00 0.00 H new ATOM 0 HA LEU A 72 12.617 -1.827 5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 72 11.735 -3.581 4.078 1.00 0.00 H new ATOM 0 HB3 LEU A 72 10.524 -3.441 5.338 1.00 0.00 H new ATOM 0 HG LEU A 72 9.183 -2.000 3.705 1.00 0.00 H new ATOM 0 HD11 LEU A 72 9.676 -2.346 1.318 1.00 0.00 H new ATOM 0 HD12 LEU A 72 10.996 -1.488 2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 72 11.165 -3.216 1.756 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.285 -3.977 2.540 1.00 0.00 H new ATOM 0 HD22 LEU A 72 9.721 -4.910 3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.590 -4.308 4.261 1.00 0.00 H new ATOM 1059 N LEU A 73 10.479 0.017 3.551 1.00 0.00 N ATOM 1060 CA LEU A 73 10.372 1.008 2.486 1.00 0.00 C ATOM 1061 C LEU A 73 11.205 2.244 2.807 1.00 0.00 C ATOM 1062 O LEU A 73 11.992 2.707 1.980 1.00 0.00 O ATOM 1063 CB LEU A 73 8.910 1.405 2.277 1.00 0.00 C ATOM 1064 CG LEU A 73 7.973 0.291 1.807 1.00 0.00 C ATOM 1065 CD1 LEU A 73 6.558 0.539 2.306 1.00 0.00 C ATOM 1066 CD2 LEU A 73 7.993 0.182 0.289 1.00 0.00 C ATOM 0 H LEU A 73 9.616 -0.135 4.073 1.00 0.00 H new ATOM 0 HA LEU A 73 10.756 0.562 1.568 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.525 1.805 3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.875 2.214 1.548 1.00 0.00 H new ATOM 0 HG LEU A 73 8.324 -0.653 2.224 1.00 0.00 H new ATOM 0 HD11 LEU A 73 5.905 -0.263 1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 73 6.556 0.567 3.396 1.00 0.00 H new ATOM 0 HD13 LEU A 73 6.197 1.492 1.918 1.00 0.00 H new ATOM 0 HD21 LEU A 73 7.321 -0.616 -0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 73 7.667 1.126 -0.148 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.006 -0.043 -0.046 1.00 0.00 H new ATOM 1078 N ARG A 74 11.029 2.773 4.014 1.00 0.00 N ATOM 1079 CA ARG A 74 11.766 3.956 4.444 1.00 0.00 C ATOM 1080 C ARG A 74 13.190 3.938 3.898 1.00 0.00 C ATOM 1081 O ARG A 74 13.737 4.976 3.527 1.00 0.00 O ATOM 1082 CB ARG A 74 11.795 4.036 5.972 1.00 0.00 C ATOM 1083 CG ARG A 74 12.534 5.253 6.503 1.00 0.00 C ATOM 1084 CD ARG A 74 12.118 5.578 7.930 1.00 0.00 C ATOM 1085 NE ARG A 74 13.193 6.222 8.680 1.00 0.00 N ATOM 1086 CZ ARG A 74 13.116 6.510 9.974 1.00 0.00 C ATOM 1087 NH1 ARG A 74 12.020 6.213 10.658 1.00 0.00 N ATOM 1088 NH2 ARG A 74 14.136 7.097 10.587 1.00 0.00 N ATOM 0 H ARG A 74 10.383 2.402 4.711 1.00 0.00 H new ATOM 0 HA ARG A 74 11.256 4.835 4.050 1.00 0.00 H new ATOM 0 HB2 ARG A 74 10.771 4.051 6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 74 12.265 3.135 6.366 1.00 0.00 H new ATOM 0 HG2 ARG A 74 13.608 5.072 6.468 1.00 0.00 H new ATOM 0 HG3 ARG A 74 12.334 6.110 5.860 1.00 0.00 H new ATOM 0 HD2 ARG A 74 11.246 6.231 7.913 1.00 0.00 H new ATOM 0 HD3 ARG A 74 11.820 4.661 8.439 1.00 0.00 H new ATOM 0 HE ARG A 74 14.050 6.464 8.183 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.233 5.762 10.190 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.963 6.435 11.652 1.00 0.00 H new ATOM 0 HH21 ARG A 74 14.981 7.328 10.064 1.00 0.00 H new ATOM 0 HH22 ARG A 74 14.075 7.318 11.581 1.00 0.00 H new ATOM 1102 N ASN A 75 13.786 2.750 3.851 1.00 0.00 N ATOM 1103 CA ASN A 75 15.147 2.597 3.351 1.00 0.00 C ATOM 1104 C ASN A 75 15.155 2.439 1.833 1.00 0.00 C ATOM 1105 O ASN A 75 15.988 3.024 1.142 1.00 0.00 O ATOM 1106 CB ASN A 75 15.820 1.388 4.004 1.00 0.00 C ATOM 1107 CG ASN A 75 16.543 1.752 5.287 1.00 0.00 C ATOM 1108 OD1 ASN A 75 17.744 2.021 5.281 1.00 0.00 O ATOM 1109 ND2 ASN A 75 15.812 1.761 6.395 1.00 0.00 N ATOM 0 H ASN A 75 13.347 1.880 4.153 1.00 0.00 H new ATOM 0 HA ASN A 75 15.705 3.498 3.608 1.00 0.00 H new ATOM 0 HB2 ASN A 75 15.068 0.628 4.217 1.00 0.00 H new ATOM 0 HB3 ASN A 75 16.529 0.948 3.303 1.00 0.00 H new ATOM 0 HD21 ASN A 75 16.243 1.998 7.289 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.819 1.531 6.353 1.00 0.00 H new ATOM 1116 N ALA A 76 14.220 1.644 1.322 1.00 0.00 N ATOM 1117 CA ALA A 76 14.117 1.411 -0.113 1.00 0.00 C ATOM 1118 C ALA A 76 14.127 2.726 -0.885 1.00 0.00 C ATOM 1119 O ALA A 76 13.276 3.589 -0.670 1.00 0.00 O ATOM 1120 CB ALA A 76 12.857 0.619 -0.430 1.00 0.00 C ATOM 0 H ALA A 76 13.523 1.151 1.881 1.00 0.00 H new ATOM 0 HA ALA A 76 14.985 0.831 -0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.793 0.452 -1.505 1.00 0.00 H new ATOM 0 HB2 ALA A 76 12.892 -0.341 0.085 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.982 1.178 -0.097 1.00 0.00 H new ATOM 1126 N SER A 77 15.095 2.872 -1.784 1.00 0.00 N ATOM 1127 CA SER A 77 15.218 4.084 -2.585 1.00 0.00 C ATOM 1128 C SER A 77 15.103 3.766 -4.073 1.00 0.00 C ATOM 1129 O SER A 77 15.178 2.607 -4.479 1.00 0.00 O ATOM 1130 CB SER A 77 16.553 4.775 -2.301 1.00 0.00 C ATOM 1131 OG SER A 77 16.668 5.982 -3.035 1.00 0.00 O ATOM 0 H SER A 77 15.806 2.166 -1.976 1.00 0.00 H new ATOM 0 HA SER A 77 14.404 4.755 -2.311 1.00 0.00 H new ATOM 0 HB2 SER A 77 16.638 4.984 -1.235 1.00 0.00 H new ATOM 0 HB3 SER A 77 17.374 4.107 -2.561 1.00 0.00 H new ATOM 0 HG SER A 77 17.529 6.406 -2.835 1.00 0.00 H new ATOM 1137 N GLY A 78 14.920 4.806 -4.881 1.00 0.00 N ATOM 1138 CA GLY A 78 14.797 4.618 -6.315 1.00 0.00 C ATOM 1139 C GLY A 78 13.447 4.056 -6.713 1.00 0.00 C ATOM 1140 O GLY A 78 12.464 4.214 -5.989 1.00 0.00 O ATOM 0 H GLY A 78 14.855 5.775 -4.568 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.952 5.573 -6.818 1.00 0.00 H new ATOM 0 HA3 GLY A 78 15.583 3.945 -6.659 1.00 0.00 H new ATOM 1144 N SER A 79 13.397 3.399 -7.867 1.00 0.00 N ATOM 1145 CA SER A 79 12.156 2.816 -8.363 1.00 0.00 C ATOM 1146 C SER A 79 11.809 1.543 -7.597 1.00 0.00 C ATOM 1147 O SER A 79 12.307 0.462 -7.910 1.00 0.00 O ATOM 1148 CB SER A 79 12.272 2.511 -9.857 1.00 0.00 C ATOM 1149 OG SER A 79 12.211 3.699 -10.627 1.00 0.00 O ATOM 0 H SER A 79 14.202 3.257 -8.477 1.00 0.00 H new ATOM 0 HA SER A 79 11.356 3.541 -8.209 1.00 0.00 H new ATOM 0 HB2 SER A 79 13.211 1.994 -10.054 1.00 0.00 H new ATOM 0 HB3 SER A 79 11.469 1.838 -10.157 1.00 0.00 H new ATOM 0 HG SER A 79 12.289 3.477 -11.578 1.00 0.00 H new ATOM 1155 N VAL A 80 10.952 1.680 -6.590 1.00 0.00 N ATOM 1156 CA VAL A 80 10.537 0.542 -5.779 1.00 0.00 C ATOM 1157 C VAL A 80 9.257 -0.083 -6.323 1.00 0.00 C ATOM 1158 O VAL A 80 8.324 0.624 -6.707 1.00 0.00 O ATOM 1159 CB VAL A 80 10.312 0.951 -4.311 1.00 0.00 C ATOM 1160 CG1 VAL A 80 9.832 -0.238 -3.493 1.00 0.00 C ATOM 1161 CG2 VAL A 80 11.587 1.535 -3.721 1.00 0.00 C ATOM 0 H VAL A 80 10.532 2.568 -6.317 1.00 0.00 H new ATOM 0 HA VAL A 80 11.343 -0.190 -5.825 1.00 0.00 H new ATOM 0 HB VAL A 80 9.539 1.718 -4.279 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.678 0.070 -2.459 1.00 0.00 H new ATOM 0 HG12 VAL A 80 8.893 -0.608 -3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.580 -1.030 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 80 11.411 1.819 -2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 80 12.382 0.790 -3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 80 11.883 2.415 -4.293 1.00 0.00 H new ATOM 1171 N ILE A 81 9.219 -1.411 -6.352 1.00 0.00 N ATOM 1172 CA ILE A 81 8.053 -2.131 -6.847 1.00 0.00 C ATOM 1173 C ILE A 81 7.305 -2.816 -5.708 1.00 0.00 C ATOM 1174 O ILE A 81 7.915 -3.419 -4.825 1.00 0.00 O ATOM 1175 CB ILE A 81 8.446 -3.187 -7.897 1.00 0.00 C ATOM 1176 CG1 ILE A 81 8.887 -2.508 -9.195 1.00 0.00 C ATOM 1177 CG2 ILE A 81 7.285 -4.135 -8.155 1.00 0.00 C ATOM 1178 CD1 ILE A 81 9.821 -1.338 -8.979 1.00 0.00 C ATOM 0 H ILE A 81 9.983 -2.010 -6.038 1.00 0.00 H new ATOM 0 HA ILE A 81 7.401 -1.392 -7.314 1.00 0.00 H new ATOM 0 HB ILE A 81 9.284 -3.768 -7.511 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.380 -3.243 -9.831 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.004 -2.163 -9.733 1.00 0.00 H new ATOM 0 HG21 ILE A 81 7.578 -4.875 -8.899 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.015 -4.640 -7.228 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.429 -3.570 -8.523 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.092 -0.906 -9.942 1.00 0.00 H new ATOM 0 HD12 ILE A 81 9.324 -0.583 -8.370 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.721 -1.681 -8.469 1.00 0.00 H new ATOM 1190 N LEU A 82 5.980 -2.720 -5.736 1.00 0.00 N ATOM 1191 CA LEU A 82 5.148 -3.332 -4.706 1.00 0.00 C ATOM 1192 C LEU A 82 4.047 -4.184 -5.331 1.00 0.00 C ATOM 1193 O LEU A 82 3.230 -3.690 -6.109 1.00 0.00 O ATOM 1194 CB LEU A 82 4.529 -2.254 -3.815 1.00 0.00 C ATOM 1195 CG LEU A 82 5.508 -1.261 -3.185 1.00 0.00 C ATOM 1196 CD1 LEU A 82 4.759 -0.076 -2.595 1.00 0.00 C ATOM 1197 CD2 LEU A 82 6.351 -1.946 -2.120 1.00 0.00 C ATOM 0 H LEU A 82 5.459 -2.225 -6.460 1.00 0.00 H new ATOM 0 HA LEU A 82 5.782 -3.978 -4.098 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.804 -1.694 -4.406 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.976 -2.746 -3.015 1.00 0.00 H new ATOM 0 HG LEU A 82 6.174 -0.892 -3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 82 5.471 0.620 -2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.200 0.430 -3.382 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.069 -0.427 -1.828 1.00 0.00 H new ATOM 0 HD21 LEU A 82 7.041 -1.225 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.700 -2.344 -1.341 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.916 -2.761 -2.572 1.00 0.00 H new ATOM 1209 N LYS A 83 4.030 -5.467 -4.985 1.00 0.00 N ATOM 1210 CA LYS A 83 3.029 -6.388 -5.509 1.00 0.00 C ATOM 1211 C LYS A 83 1.775 -6.379 -4.640 1.00 0.00 C ATOM 1212 O LYS A 83 1.811 -6.782 -3.478 1.00 0.00 O ATOM 1213 CB LYS A 83 3.600 -7.806 -5.584 1.00 0.00 C ATOM 1214 CG LYS A 83 2.944 -8.670 -6.647 1.00 0.00 C ATOM 1215 CD LYS A 83 3.850 -9.813 -7.073 1.00 0.00 C ATOM 1216 CE LYS A 83 3.195 -10.674 -8.142 1.00 0.00 C ATOM 1217 NZ LYS A 83 2.175 -11.593 -7.566 1.00 0.00 N ATOM 0 H LYS A 83 4.699 -5.893 -4.343 1.00 0.00 H new ATOM 0 HA LYS A 83 2.758 -6.059 -6.512 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.670 -7.748 -5.784 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.483 -8.288 -4.613 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.006 -9.071 -6.263 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.697 -8.057 -7.514 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.790 -9.412 -7.453 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.093 -10.428 -6.207 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.726 -10.032 -8.888 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.959 -11.256 -8.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.376 -12.568 -7.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.205 -11.538 -6.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.230 -11.316 -7.900 1.00 0.00 H new ATOM 1231 N ILE A 84 0.668 -5.918 -5.213 1.00 0.00 N ATOM 1232 CA ILE A 84 -0.597 -5.859 -4.491 1.00 0.00 C ATOM 1233 C ILE A 84 -1.559 -6.937 -4.980 1.00 0.00 C ATOM 1234 O ILE A 84 -1.428 -7.443 -6.095 1.00 0.00 O ATOM 1235 CB ILE A 84 -1.268 -4.481 -4.642 1.00 0.00 C ATOM 1236 CG1 ILE A 84 -0.224 -3.368 -4.545 1.00 0.00 C ATOM 1237 CG2 ILE A 84 -2.346 -4.298 -3.583 1.00 0.00 C ATOM 1238 CD1 ILE A 84 0.511 -3.342 -3.223 1.00 0.00 C ATOM 0 H ILE A 84 0.622 -5.580 -6.174 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.368 -6.029 -3.439 1.00 0.00 H new ATOM 0 HB ILE A 84 -1.738 -4.428 -5.624 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.499 -3.488 -5.351 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.714 -2.407 -4.698 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.811 -3.319 -3.703 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.102 -5.075 -3.695 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.898 -4.368 -2.592 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.235 -2.528 -3.225 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -0.202 -3.191 -2.413 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.030 -4.289 -3.077 1.00 0.00 H new ATOM 1250 N LEU A 85 -2.528 -7.283 -4.139 1.00 0.00 N ATOM 1251 CA LEU A 85 -3.514 -8.300 -4.485 1.00 0.00 C ATOM 1252 C LEU A 85 -4.864 -7.990 -3.846 1.00 0.00 C ATOM 1253 O LEU A 85 -4.941 -7.258 -2.858 1.00 0.00 O ATOM 1254 CB LEU A 85 -3.031 -9.681 -4.038 1.00 0.00 C ATOM 1255 CG LEU A 85 -2.235 -10.480 -5.070 1.00 0.00 C ATOM 1256 CD1 LEU A 85 -0.750 -10.170 -4.954 1.00 0.00 C ATOM 1257 CD2 LEU A 85 -2.485 -11.971 -4.899 1.00 0.00 C ATOM 0 H LEU A 85 -2.651 -6.874 -3.213 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.636 -8.298 -5.568 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.413 -9.557 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.900 -10.270 -3.743 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.570 -10.188 -6.065 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.199 -10.748 -5.696 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.586 -9.106 -5.127 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.400 -10.434 -3.956 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.910 -12.524 -5.642 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.178 -12.279 -3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.546 -12.180 -5.033 1.00 0.00 H new ATOM 1269 N SER A 86 -5.926 -8.552 -4.414 1.00 0.00 N ATOM 1270 CA SER A 86 -7.273 -8.334 -3.900 1.00 0.00 C ATOM 1271 C SER A 86 -7.667 -9.437 -2.923 1.00 0.00 C ATOM 1272 O SER A 86 -7.005 -10.471 -2.836 1.00 0.00 O ATOM 1273 CB SER A 86 -8.278 -8.275 -5.053 1.00 0.00 C ATOM 1274 OG SER A 86 -7.890 -7.312 -6.018 1.00 0.00 O ATOM 0 H SER A 86 -5.880 -9.162 -5.230 1.00 0.00 H new ATOM 0 HA SER A 86 -7.283 -7.382 -3.369 1.00 0.00 H new ATOM 0 HB2 SER A 86 -8.355 -9.255 -5.523 1.00 0.00 H new ATOM 0 HB3 SER A 86 -9.267 -8.029 -4.666 1.00 0.00 H new ATOM 0 HG SER A 86 -8.547 -7.294 -6.745 1.00 0.00 H new ATOM 1280 N GLY A 87 -8.752 -9.209 -2.189 1.00 0.00 N ATOM 1281 CA GLY A 87 -9.217 -10.192 -1.227 1.00 0.00 C ATOM 1282 C GLY A 87 -10.726 -10.191 -1.081 1.00 0.00 C ATOM 1283 O GLY A 87 -11.436 -9.444 -1.754 1.00 0.00 O ATOM 0 H GLY A 87 -9.317 -8.362 -2.243 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -8.886 -11.183 -1.536 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -8.761 -9.991 -0.258 1.00 0.00 H new ATOM 1287 N PRO A 88 -11.237 -11.046 -0.183 1.00 0.00 N ATOM 1288 CA PRO A 88 -12.677 -11.161 0.070 1.00 0.00 C ATOM 1289 C PRO A 88 -13.242 -9.932 0.773 1.00 0.00 C ATOM 1290 O PRO A 88 -12.998 -9.718 1.961 1.00 0.00 O ATOM 1291 CB PRO A 88 -12.781 -12.391 0.976 1.00 0.00 C ATOM 1292 CG PRO A 88 -11.455 -12.478 1.650 1.00 0.00 C ATOM 1293 CD PRO A 88 -10.450 -11.967 0.655 1.00 0.00 C ATOM 0 HA PRO A 88 -13.248 -11.246 -0.855 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -13.587 -12.281 1.701 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -12.992 -13.291 0.399 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -11.441 -11.880 2.561 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -11.231 -13.505 1.939 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -9.622 -11.455 1.146 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -10.019 -12.777 0.067 1.00 0.00 H new ATOM 1301 N SER A 89 -13.997 -9.127 0.033 1.00 0.00 N ATOM 1302 CA SER A 89 -14.594 -7.917 0.586 1.00 0.00 C ATOM 1303 C SER A 89 -15.873 -8.243 1.352 1.00 0.00 C ATOM 1304 O SER A 89 -16.086 -7.756 2.462 1.00 0.00 O ATOM 1305 CB SER A 89 -14.897 -6.916 -0.531 1.00 0.00 C ATOM 1306 OG SER A 89 -13.710 -6.294 -0.993 1.00 0.00 O ATOM 0 H SER A 89 -14.210 -9.291 -0.951 1.00 0.00 H new ATOM 0 HA SER A 89 -13.879 -7.473 1.279 1.00 0.00 H new ATOM 0 HB2 SER A 89 -15.389 -7.427 -1.358 1.00 0.00 H new ATOM 0 HB3 SER A 89 -15.591 -6.158 -0.167 1.00 0.00 H new ATOM 0 HG SER A 89 -13.930 -5.660 -1.707 1.00 0.00 H new ATOM 1312 N SER A 90 -16.721 -9.070 0.750 1.00 0.00 N ATOM 1313 CA SER A 90 -17.981 -9.459 1.372 1.00 0.00 C ATOM 1314 C SER A 90 -17.768 -10.600 2.363 1.00 0.00 C ATOM 1315 O SER A 90 -18.232 -10.544 3.501 1.00 0.00 O ATOM 1316 CB SER A 90 -18.994 -9.878 0.305 1.00 0.00 C ATOM 1317 OG SER A 90 -18.527 -10.996 -0.430 1.00 0.00 O ATOM 0 H SER A 90 -16.558 -9.484 -0.168 1.00 0.00 H new ATOM 0 HA SER A 90 -18.371 -8.597 1.914 1.00 0.00 H new ATOM 0 HB2 SER A 90 -19.945 -10.121 0.778 1.00 0.00 H new ATOM 0 HB3 SER A 90 -19.179 -9.045 -0.373 1.00 0.00 H new ATOM 0 HG SER A 90 -19.193 -11.245 -1.104 1.00 0.00 H new ATOM 1323 N GLY A 91 -17.062 -11.636 1.920 1.00 0.00 N ATOM 1324 CA GLY A 91 -16.799 -12.776 2.779 1.00 0.00 C ATOM 1325 C GLY A 91 -16.370 -12.365 4.173 1.00 0.00 C ATOM 1326 O GLY A 91 -15.668 -13.108 4.859 1.00 0.00 O ATOM 0 H GLY A 91 -16.668 -11.706 0.982 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -17.696 -13.392 2.845 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -16.021 -13.393 2.330 1.00 0.00 H new TER 1330 GLY A 91