USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1031 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 64 SER OG : rot 180:sc= -0.49 USER MOD Set 1.2: A 65 SER OG : rot 180:sc=-0.00944 USER MOD Set 2.1: A 11 ASN : amide:sc= 0.109 K(o=-1.9,f=-6) USER MOD Set 2.2: A 12 HIS : no HE2:sc= -2.02! C(o=-1.9!,f=-12!) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS :FLIP no HD1:sc= -6.57! C(o=-12!,f=-6.6!) USER MOD Single : A 6 HIS : no HD1:sc= -2.17! C(o=-2.2!,f=-2.7!) USER MOD Single : A 16 GLN : amide:sc= -0.012 K(o=-0.012,f=-1.7!) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 157:sc= -0.119 (180deg=-0.827) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 153:sc= -0.0628 (180deg=-0.2) USER MOD Single : A 25 GLN : amide:sc= -1.58 X(o=-1.6,f=-1.4) USER MOD Single : A 28 SER OG : rot -71:sc= 1.05! USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 SER OG : rot 160:sc= -0.263 USER MOD Single : A 36 GLN : amide:sc= -0.659 X(o=-0.66,f=-0.19) USER MOD Single : A 38 MET CE :methyl 145:sc= -2.2! (180deg=-4.79!) USER MOD Single : A 39 GLN : amide:sc= -2.74! C(o=-2.7!,f=-3.5!) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0452 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.072) USER MOD Single : A 51 THR OG1 : rot -130:sc= -0.594 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= -3.51! C(o=-4.6!,f=-3.5!) USER MOD Single : A 60 GLN : amide:sc= -0.0481 X(o=-0.048,f=-0.063) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot 67:sc= -1.56 USER MOD Single : A 69 SER OG : rot 180:sc= 0.00265 USER MOD Single : A 71 HIS : no HD1:sc= -1.44 X(o=-1.4,f=-1.5) USER MOD Single : A 72 HIS : no HD1:sc= -4.11! C(o=-4.1!,f=-3.8!) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 74 GLN : amide:sc= -0.238 K(o=-0.24,f=-0.91) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= -0.0346 USER MOD Single : A 84 THR OG1 : rot -67:sc= -0.445! USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0298 USER MOD Single : A 89 SER OG : rot -44:sc= 0.5 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.046 X(o=-0.046,f=-0.26) USER MOD Single : A 100 GLN : amide:sc= -1.21 K(o=-1.2,f=-2.7!) USER MOD Single : A 102 ASN : amide:sc= -1.24 K(o=-1.2,f=-1.8!) USER MOD Single : A 103 ASN : amide:sc= -3.39! C(o=-3.4!,f=-8.4!) USER MOD Single : A 105 GLN : amide:sc= -0.369 X(o=-0.37,f=0) USER MOD Single : A 106 GLN : amide:sc= -0.0976 X(o=-0.098,f=-0.6) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 113 TYR OH : rot -140:sc= 1.22 USER MOD Single : A 114 GLN : amide:sc= -1.44 K(o=-1.4,f=-2.5) USER MOD Single : A 115 GLN : amide:sc= -0.0567 X(o=-0.057,f=0) USER MOD Single : A 127 SER OG : rot -45:sc= 0.0128 USER MOD Single : A 129 LYS NZ :NH3+ 139:sc= -0.991 (180deg=-1.69!) USER MOD Single : A 132 SER OG : rot -95:sc= -0.343 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 4.287 9.576 1.314 1.00 0.00 N ATOM 2 CA PRO A 1 5.645 10.122 1.624 1.00 0.00 C ATOM 3 C PRO A 1 5.689 10.583 3.095 1.00 0.00 C ATOM 4 O PRO A 1 5.180 11.632 3.462 1.00 0.00 O ATOM 5 CB PRO A 1 5.912 11.286 0.652 1.00 0.00 C ATOM 6 CG PRO A 1 4.840 11.208 -0.438 1.00 0.00 C ATOM 7 CD PRO A 1 3.788 10.197 0.045 1.00 0.00 C ATOM 0 H2 PRO A 1 3.644 9.776 2.080 1.00 0.00 H new ATOM 0 H3 PRO A 1 4.329 8.562 1.217 1.00 0.00 H new ATOM 0 HA PRO A 1 6.419 9.365 1.497 1.00 0.00 H new ATOM 0 HB2 PRO A 1 5.865 12.243 1.172 1.00 0.00 H new ATOM 0 HB3 PRO A 1 6.909 11.207 0.219 1.00 0.00 H new ATOM 0 HG2 PRO A 1 4.388 12.185 -0.606 1.00 0.00 H new ATOM 0 HG3 PRO A 1 5.275 10.890 -1.386 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.833 10.694 0.214 1.00 0.00 H new ATOM 0 HD3 PRO A 1 3.620 9.432 -0.713 1.00 0.00 H new ATOM 17 N VAL A 2 6.322 9.798 3.925 1.00 0.00 N ATOM 18 CA VAL A 2 6.446 10.134 5.373 1.00 0.00 C ATOM 19 C VAL A 2 7.747 9.518 5.903 1.00 0.00 C ATOM 20 O VAL A 2 8.089 8.398 5.582 1.00 0.00 O ATOM 21 CB VAL A 2 5.240 9.562 6.134 1.00 0.00 C ATOM 22 CG1 VAL A 2 4.999 8.106 5.710 1.00 0.00 C ATOM 23 CG2 VAL A 2 5.502 9.624 7.644 1.00 0.00 C ATOM 0 H VAL A 2 6.767 8.921 3.655 1.00 0.00 H new ATOM 0 HA VAL A 2 6.468 11.215 5.514 1.00 0.00 H new ATOM 0 HB VAL A 2 4.356 10.155 5.898 1.00 0.00 H new ATOM 0 HG11 VAL A 2 4.143 7.706 6.253 1.00 0.00 H new ATOM 0 HG12 VAL A 2 4.800 8.067 4.639 1.00 0.00 H new ATOM 0 HG13 VAL A 2 5.883 7.510 5.937 1.00 0.00 H new ATOM 0 HG21 VAL A 2 4.644 9.217 8.179 1.00 0.00 H new ATOM 0 HG22 VAL A 2 6.390 9.039 7.884 1.00 0.00 H new ATOM 0 HG23 VAL A 2 5.659 10.660 7.944 1.00 0.00 H new ATOM 33 N MET A 3 8.499 10.246 6.683 1.00 0.00 N ATOM 34 CA MET A 3 9.794 9.701 7.194 1.00 0.00 C ATOM 35 C MET A 3 9.603 9.070 8.580 1.00 0.00 C ATOM 36 O MET A 3 8.938 9.617 9.438 1.00 0.00 O ATOM 37 CB MET A 3 10.796 10.850 7.250 1.00 0.00 C ATOM 38 CG MET A 3 10.653 11.686 5.968 1.00 0.00 C ATOM 39 SD MET A 3 12.121 12.722 5.756 1.00 0.00 S ATOM 40 CE MET A 3 11.597 14.081 6.830 1.00 0.00 C ATOM 0 H MET A 3 8.275 11.193 6.989 1.00 0.00 H new ATOM 0 HA MET A 3 10.164 8.918 6.532 1.00 0.00 H new ATOM 0 HB2 MET A 3 10.613 11.469 8.128 1.00 0.00 H new ATOM 0 HB3 MET A 3 11.811 10.463 7.338 1.00 0.00 H new ATOM 0 HG2 MET A 3 10.530 11.031 5.106 1.00 0.00 H new ATOM 0 HG3 MET A 3 9.760 12.309 6.025 1.00 0.00 H new ATOM 0 HE1 MET A 3 12.370 14.850 6.847 1.00 0.00 H new ATOM 0 HE2 MET A 3 10.669 14.508 6.450 1.00 0.00 H new ATOM 0 HE3 MET A 3 11.436 13.705 7.840 1.00 0.00 H new ATOM 50 N HIS A 4 10.157 7.894 8.771 1.00 0.00 N ATOM 51 CA HIS A 4 10.007 7.152 10.066 1.00 0.00 C ATOM 52 C HIS A 4 11.111 7.569 11.065 1.00 0.00 C ATOM 53 O HIS A 4 12.138 8.063 10.645 1.00 0.00 O ATOM 54 CB HIS A 4 10.132 5.654 9.753 1.00 0.00 C ATOM 55 CG HIS A 4 11.403 5.410 8.989 1.00 0.00 C ATOM 56 ND1 HIS A 4 11.760 5.675 7.691 1.00 0.00 N flip ATOM 57 CD2 HIS A 4 12.511 4.816 9.573 1.00 0.00 C flip ATOM 58 CE1 HIS A 4 13.068 5.253 7.469 1.00 0.00 C flip ATOM 59 NE2 HIS A 4 13.473 4.743 8.635 1.00 0.00 N flip ATOM 0 H HIS A 4 10.717 7.409 8.070 1.00 0.00 H new ATOM 0 HA HIS A 4 9.042 7.380 10.520 1.00 0.00 H new ATOM 0 HB2 HIS A 4 10.133 5.077 10.677 1.00 0.00 H new ATOM 0 HB3 HIS A 4 9.274 5.320 9.170 1.00 0.00 H new ATOM 0 HD2 HIS A 4 12.588 4.474 10.595 1.00 0.00 H new ATOM 0 HE1 HIS A 4 13.633 5.323 6.551 1.00 0.00 H new ATOM 0 HE2 HIS A 4 14.399 4.346 8.795 1.00 0.00 H new ATOM 67 N PRO A 5 10.894 7.355 12.366 1.00 0.00 N ATOM 68 CA PRO A 5 11.913 7.716 13.376 1.00 0.00 C ATOM 69 C PRO A 5 13.152 6.824 13.212 1.00 0.00 C ATOM 70 O PRO A 5 13.213 5.987 12.336 1.00 0.00 O ATOM 71 CB PRO A 5 11.239 7.489 14.747 1.00 0.00 C ATOM 72 CG PRO A 5 9.826 6.896 14.478 1.00 0.00 C ATOM 73 CD PRO A 5 9.652 6.768 12.944 1.00 0.00 C ATOM 0 HA PRO A 5 12.251 8.747 13.272 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.831 6.808 15.358 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.163 8.427 15.298 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.723 5.922 14.957 1.00 0.00 H new ATOM 0 HG3 PRO A 5 9.054 7.541 14.898 1.00 0.00 H new ATOM 0 HD2 PRO A 5 9.532 5.727 12.646 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.766 7.302 12.601 1.00 0.00 H new ATOM 81 N HIS A 6 14.145 7.037 14.039 1.00 0.00 N ATOM 82 CA HIS A 6 15.412 6.251 13.945 1.00 0.00 C ATOM 83 C HIS A 6 16.224 6.806 12.777 1.00 0.00 C ATOM 84 O HIS A 6 17.172 7.542 12.965 1.00 0.00 O ATOM 85 CB HIS A 6 15.117 4.755 13.736 1.00 0.00 C ATOM 86 CG HIS A 6 13.887 4.373 14.514 1.00 0.00 C ATOM 87 ND1 HIS A 6 13.647 4.846 15.795 1.00 0.00 N ATOM 88 CD2 HIS A 6 12.822 3.562 14.209 1.00 0.00 C ATOM 89 CE1 HIS A 6 12.480 4.322 16.209 1.00 0.00 C ATOM 90 NE2 HIS A 6 11.935 3.531 15.281 1.00 0.00 N ATOM 0 H HIS A 6 14.130 7.732 14.785 1.00 0.00 H new ATOM 0 HA HIS A 6 15.975 6.342 14.874 1.00 0.00 H new ATOM 0 HB2 HIS A 6 14.969 4.547 12.676 1.00 0.00 H new ATOM 0 HB3 HIS A 6 15.967 4.157 14.063 1.00 0.00 H new ATOM 0 HD2 HIS A 6 12.692 3.029 13.279 1.00 0.00 H new ATOM 0 HE1 HIS A 6 12.037 4.517 17.175 1.00 0.00 H new ATOM 0 HE2 HIS A 6 11.057 3.015 15.344 1.00 0.00 H new ATOM 98 N GLY A 7 15.848 6.486 11.572 1.00 0.00 N ATOM 99 CA GLY A 7 16.593 7.030 10.404 1.00 0.00 C ATOM 100 C GLY A 7 16.667 8.556 10.533 1.00 0.00 C ATOM 101 O GLY A 7 17.735 9.136 10.550 1.00 0.00 O ATOM 0 H GLY A 7 15.063 5.876 11.346 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.596 6.605 10.365 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.093 6.753 9.476 1.00 0.00 H new ATOM 105 N ALA A 8 15.536 9.214 10.622 1.00 0.00 N ATOM 106 CA ALA A 8 15.529 10.705 10.749 1.00 0.00 C ATOM 107 C ALA A 8 14.352 11.099 11.666 1.00 0.00 C ATOM 108 O ALA A 8 13.637 10.229 12.120 1.00 0.00 O ATOM 109 CB ALA A 8 15.365 11.299 9.333 1.00 0.00 C ATOM 0 H ALA A 8 14.613 8.780 10.612 1.00 0.00 H new ATOM 0 HA ALA A 8 16.453 11.086 11.185 1.00 0.00 H new ATOM 0 HB1 ALA A 8 15.356 12.387 9.394 1.00 0.00 H new ATOM 0 HB2 ALA A 8 16.196 10.977 8.705 1.00 0.00 H new ATOM 0 HB3 ALA A 8 14.427 10.952 8.899 1.00 0.00 H new ATOM 115 N PRO A 9 14.155 12.381 11.913 1.00 0.00 N ATOM 116 CA PRO A 9 13.041 12.816 12.766 1.00 0.00 C ATOM 117 C PRO A 9 11.776 12.467 11.992 1.00 0.00 C ATOM 118 O PRO A 9 11.740 12.707 10.801 1.00 0.00 O ATOM 119 CB PRO A 9 13.207 14.342 12.896 1.00 0.00 C ATOM 120 CG PRO A 9 14.524 14.722 12.162 1.00 0.00 C ATOM 121 CD PRO A 9 14.978 13.474 11.375 1.00 0.00 C ATOM 0 HA PRO A 9 13.006 12.358 13.754 1.00 0.00 H new ATOM 0 HB2 PRO A 9 12.356 14.861 12.455 1.00 0.00 H new ATOM 0 HB3 PRO A 9 13.251 14.637 13.944 1.00 0.00 H new ATOM 0 HG2 PRO A 9 14.361 15.564 11.489 1.00 0.00 H new ATOM 0 HG3 PRO A 9 15.289 15.027 12.876 1.00 0.00 H new ATOM 0 HD2 PRO A 9 14.819 13.600 10.304 1.00 0.00 H new ATOM 0 HD3 PRO A 9 16.041 13.279 11.519 1.00 0.00 H new ATOM 129 N PRO A 10 10.780 11.882 12.604 1.00 0.00 N ATOM 130 CA PRO A 10 9.608 11.514 11.823 1.00 0.00 C ATOM 131 C PRO A 10 8.828 12.759 11.407 1.00 0.00 C ATOM 132 O PRO A 10 8.463 13.581 12.224 1.00 0.00 O ATOM 133 CB PRO A 10 8.784 10.612 12.751 1.00 0.00 C ATOM 134 CG PRO A 10 9.338 10.835 14.187 1.00 0.00 C ATOM 135 CD PRO A 10 10.715 11.527 14.038 1.00 0.00 C ATOM 0 HA PRO A 10 9.867 11.002 10.896 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.725 10.866 12.700 1.00 0.00 H new ATOM 0 HB3 PRO A 10 8.876 9.566 12.458 1.00 0.00 H new ATOM 0 HG2 PRO A 10 8.657 11.453 14.772 1.00 0.00 H new ATOM 0 HG3 PRO A 10 9.438 9.886 14.713 1.00 0.00 H new ATOM 0 HD2 PRO A 10 10.789 12.410 14.672 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.530 10.861 14.322 1.00 0.00 H new ATOM 143 N ASN A 11 8.574 12.903 10.138 1.00 0.00 N ATOM 144 CA ASN A 11 7.820 14.098 9.672 1.00 0.00 C ATOM 145 C ASN A 11 7.182 13.820 8.317 1.00 0.00 C ATOM 146 O ASN A 11 7.744 13.151 7.473 1.00 0.00 O ATOM 147 CB ASN A 11 8.774 15.288 9.553 1.00 0.00 C ATOM 148 CG ASN A 11 7.984 16.536 9.152 1.00 0.00 C ATOM 149 OD1 ASN A 11 6.828 16.673 9.496 1.00 0.00 O ATOM 150 ND2 ASN A 11 8.565 17.457 8.432 1.00 0.00 N ATOM 0 H ASN A 11 8.854 12.249 9.407 1.00 0.00 H new ATOM 0 HA ASN A 11 7.035 14.327 10.393 1.00 0.00 H new ATOM 0 HB2 ASN A 11 9.283 15.456 10.502 1.00 0.00 H new ATOM 0 HB3 ASN A 11 9.544 15.078 8.811 1.00 0.00 H new ATOM 0 HD21 ASN A 11 8.048 18.292 8.158 1.00 0.00 H new ATOM 0 HD22 ASN A 11 9.536 17.341 8.143 1.00 0.00 H new ATOM 157 N HIS A 12 6.010 14.350 8.101 1.00 0.00 N ATOM 158 CA HIS A 12 5.320 14.148 6.799 1.00 0.00 C ATOM 159 C HIS A 12 5.705 15.294 5.868 1.00 0.00 C ATOM 160 O HIS A 12 5.904 16.411 6.303 1.00 0.00 O ATOM 161 CB HIS A 12 3.805 14.151 7.015 1.00 0.00 C ATOM 162 CG HIS A 12 3.399 15.421 7.711 1.00 0.00 C ATOM 163 ND1 HIS A 12 4.327 16.350 8.155 1.00 0.00 N ATOM 164 CD2 HIS A 12 2.169 15.930 8.047 1.00 0.00 C ATOM 165 CE1 HIS A 12 3.647 17.360 8.728 1.00 0.00 C ATOM 166 NE2 HIS A 12 2.328 17.154 8.689 1.00 0.00 N ATOM 0 H HIS A 12 5.498 14.918 8.776 1.00 0.00 H new ATOM 0 HA HIS A 12 5.614 13.193 6.363 1.00 0.00 H new ATOM 0 HB2 HIS A 12 3.291 14.068 6.058 1.00 0.00 H new ATOM 0 HB3 HIS A 12 3.510 13.287 7.611 1.00 0.00 H new ATOM 0 HD1 HIS A 12 5.341 16.281 8.064 1.00 0.00 H new ATOM 0 HD2 HIS A 12 1.222 15.453 7.844 1.00 0.00 H new ATOM 0 HE1 HIS A 12 4.111 18.231 9.166 1.00 0.00 H new ATOM 174 N ARG A 13 5.813 15.026 4.591 1.00 0.00 N ATOM 175 CA ARG A 13 6.188 16.104 3.613 1.00 0.00 C ATOM 176 C ARG A 13 4.986 16.370 2.680 1.00 0.00 C ATOM 177 O ARG A 13 4.796 15.643 1.727 1.00 0.00 O ATOM 178 CB ARG A 13 7.401 15.646 2.784 1.00 0.00 C ATOM 179 CG ARG A 13 7.141 14.267 2.148 1.00 0.00 C ATOM 180 CD ARG A 13 8.464 13.508 1.982 1.00 0.00 C ATOM 181 NE ARG A 13 9.446 14.363 1.258 1.00 0.00 N ATOM 182 CZ ARG A 13 10.714 14.054 1.274 1.00 0.00 C ATOM 183 NH1 ARG A 13 11.119 13.000 1.929 1.00 0.00 N ATOM 184 NH2 ARG A 13 11.576 14.798 0.637 1.00 0.00 N ATOM 0 H ARG A 13 5.658 14.106 4.178 1.00 0.00 H new ATOM 0 HA ARG A 13 6.448 17.018 4.147 1.00 0.00 H new ATOM 0 HB2 ARG A 13 7.611 16.377 2.004 1.00 0.00 H new ATOM 0 HB3 ARG A 13 8.284 15.597 3.421 1.00 0.00 H new ATOM 0 HG2 ARG A 13 6.458 13.692 2.773 1.00 0.00 H new ATOM 0 HG3 ARG A 13 6.658 14.390 1.178 1.00 0.00 H new ATOM 0 HD2 ARG A 13 8.860 13.230 2.959 1.00 0.00 H new ATOM 0 HD3 ARG A 13 8.297 12.583 1.431 1.00 0.00 H new ATOM 0 HE ARG A 13 9.128 15.189 0.751 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.445 12.419 2.427 1.00 0.00 H new ATOM 0 HH12 ARG A 13 12.110 12.757 1.942 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.259 15.622 0.126 1.00 0.00 H new ATOM 0 HH22 ARG A 13 12.567 14.556 0.650 1.00 0.00 H new ATOM 198 N PRO A 14 4.182 17.382 2.974 1.00 0.00 N ATOM 199 CA PRO A 14 3.000 17.677 2.143 1.00 0.00 C ATOM 200 C PRO A 14 3.439 18.126 0.741 1.00 0.00 C ATOM 201 O PRO A 14 3.668 17.317 -0.133 1.00 0.00 O ATOM 202 CB PRO A 14 2.242 18.791 2.918 1.00 0.00 C ATOM 203 CG PRO A 14 3.128 19.213 4.122 1.00 0.00 C ATOM 204 CD PRO A 14 4.371 18.299 4.125 1.00 0.00 C ATOM 0 HA PRO A 14 2.358 16.811 1.983 1.00 0.00 H new ATOM 0 HB2 PRO A 14 2.047 19.644 2.268 1.00 0.00 H new ATOM 0 HB3 PRO A 14 1.275 18.426 3.264 1.00 0.00 H new ATOM 0 HG2 PRO A 14 3.421 20.259 4.034 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.577 19.114 5.057 1.00 0.00 H new ATOM 0 HD2 PRO A 14 5.287 18.880 4.019 1.00 0.00 H new ATOM 0 HD3 PRO A 14 4.451 17.745 5.061 1.00 0.00 H new ATOM 212 N TRP A 15 3.531 19.408 0.528 1.00 0.00 N ATOM 213 CA TRP A 15 3.929 19.946 -0.806 1.00 0.00 C ATOM 214 C TRP A 15 2.764 19.761 -1.782 1.00 0.00 C ATOM 215 O TRP A 15 2.525 20.585 -2.641 1.00 0.00 O ATOM 216 CB TRP A 15 5.180 19.212 -1.327 1.00 0.00 C ATOM 217 CG TRP A 15 5.915 20.084 -2.299 1.00 0.00 C ATOM 218 CD1 TRP A 15 5.500 20.366 -3.555 1.00 0.00 C ATOM 219 CD2 TRP A 15 7.178 20.787 -2.117 1.00 0.00 C ATOM 220 NE1 TRP A 15 6.428 21.198 -4.156 1.00 0.00 N ATOM 221 CE2 TRP A 15 7.480 21.486 -3.310 1.00 0.00 C ATOM 222 CE3 TRP A 15 8.082 20.885 -1.044 1.00 0.00 C ATOM 223 CZ2 TRP A 15 8.638 22.255 -3.434 1.00 0.00 C ATOM 224 CZ3 TRP A 15 9.249 21.658 -1.165 1.00 0.00 C ATOM 225 CH2 TRP A 15 9.526 22.342 -2.358 1.00 0.00 C ATOM 0 H TRP A 15 3.344 20.120 1.234 1.00 0.00 H new ATOM 0 HA TRP A 15 4.168 21.006 -0.716 1.00 0.00 H new ATOM 0 HB2 TRP A 15 5.832 18.951 -0.494 1.00 0.00 H new ATOM 0 HB3 TRP A 15 4.890 18.279 -1.810 1.00 0.00 H new ATOM 0 HD1 TRP A 15 4.593 20.001 -4.014 1.00 0.00 H new ATOM 0 HE1 TRP A 15 6.345 21.555 -5.108 1.00 0.00 H new ATOM 0 HE3 TRP A 15 7.878 20.363 -0.121 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 8.847 22.779 -4.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 9.937 21.726 -0.335 1.00 0.00 H new ATOM 0 HH2 TRP A 15 10.424 22.935 -2.445 1.00 0.00 H new ATOM 236 N GLN A 16 2.035 18.685 -1.645 1.00 0.00 N ATOM 237 CA GLN A 16 0.880 18.434 -2.553 1.00 0.00 C ATOM 238 C GLN A 16 0.159 17.163 -2.107 1.00 0.00 C ATOM 239 O GLN A 16 -0.302 16.389 -2.922 1.00 0.00 O ATOM 240 CB GLN A 16 1.386 18.227 -3.982 1.00 0.00 C ATOM 241 CG GLN A 16 2.397 17.080 -3.999 1.00 0.00 C ATOM 242 CD GLN A 16 3.079 17.017 -5.366 1.00 0.00 C ATOM 243 OE1 GLN A 16 3.153 18.007 -6.068 1.00 0.00 O ATOM 244 NE2 GLN A 16 3.584 15.887 -5.778 1.00 0.00 N ATOM 0 H GLN A 16 2.192 17.966 -0.939 1.00 0.00 H new ATOM 0 HA GLN A 16 0.203 19.287 -2.518 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.552 18.002 -4.646 1.00 0.00 H new ATOM 0 HB3 GLN A 16 1.850 19.141 -4.352 1.00 0.00 H new ATOM 0 HG2 GLN A 16 3.141 17.227 -3.216 1.00 0.00 H new ATOM 0 HG3 GLN A 16 1.895 16.136 -3.788 1.00 0.00 H new ATOM 0 HE21 GLN A 16 3.522 15.056 -5.190 1.00 0.00 H new ATOM 0 HE22 GLN A 16 4.041 15.834 -6.689 1.00 0.00 H new ATOM 253 N MET A 17 0.074 16.918 -0.827 1.00 0.00 N ATOM 254 CA MET A 17 -0.601 15.670 -0.375 1.00 0.00 C ATOM 255 C MET A 17 -2.066 15.725 -0.808 1.00 0.00 C ATOM 256 O MET A 17 -2.827 14.797 -0.618 1.00 0.00 O ATOM 257 CB MET A 17 -0.502 15.556 1.150 1.00 0.00 C ATOM 258 CG MET A 17 -1.354 14.384 1.646 1.00 0.00 C ATOM 259 SD MET A 17 -0.817 13.913 3.308 1.00 0.00 S ATOM 260 CE MET A 17 -1.836 15.099 4.218 1.00 0.00 C ATOM 0 H MET A 17 0.437 17.518 -0.086 1.00 0.00 H new ATOM 0 HA MET A 17 -0.121 14.798 -0.820 1.00 0.00 H new ATOM 0 HB2 MET A 17 0.537 15.411 1.445 1.00 0.00 H new ATOM 0 HB3 MET A 17 -0.839 16.483 1.614 1.00 0.00 H new ATOM 0 HG2 MET A 17 -2.407 14.665 1.658 1.00 0.00 H new ATOM 0 HG3 MET A 17 -1.258 13.537 0.967 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.661 14.984 5.288 1.00 0.00 H new ATOM 0 HE2 MET A 17 -1.573 16.112 3.915 1.00 0.00 H new ATOM 0 HE3 MET A 17 -2.888 14.917 4.001 1.00 0.00 H new ATOM 270 N LYS A 18 -2.457 16.827 -1.388 1.00 0.00 N ATOM 271 CA LYS A 18 -3.865 16.995 -1.843 1.00 0.00 C ATOM 272 C LYS A 18 -4.211 15.945 -2.894 1.00 0.00 C ATOM 273 O LYS A 18 -5.313 15.918 -3.408 1.00 0.00 O ATOM 274 CB LYS A 18 -4.040 18.392 -2.443 1.00 0.00 C ATOM 275 CG LYS A 18 -2.965 18.630 -3.505 1.00 0.00 C ATOM 276 CD LYS A 18 -3.181 19.999 -4.155 1.00 0.00 C ATOM 277 CE LYS A 18 -2.155 20.202 -5.271 1.00 0.00 C ATOM 278 NZ LYS A 18 -2.286 19.106 -6.273 1.00 0.00 N ATOM 0 H LYS A 18 -1.852 17.628 -1.568 1.00 0.00 H new ATOM 0 HA LYS A 18 -4.531 16.872 -0.989 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.031 18.487 -2.886 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -3.967 19.147 -1.660 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -1.975 18.583 -3.052 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.007 17.846 -4.261 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.191 20.066 -4.559 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -3.083 20.787 -3.409 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -2.310 21.168 -5.751 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -1.147 20.211 -4.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -1.900 19.422 -7.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -1.759 18.271 -5.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.290 18.859 -6.388 1.00 0.00 H new ATOM 292 N ASP A 19 -3.294 15.060 -3.202 1.00 0.00 N ATOM 293 CA ASP A 19 -3.594 13.995 -4.210 1.00 0.00 C ATOM 294 C ASP A 19 -3.986 12.711 -3.477 1.00 0.00 C ATOM 295 O ASP A 19 -4.819 11.958 -3.948 1.00 0.00 O ATOM 296 CB ASP A 19 -2.385 13.767 -5.115 1.00 0.00 C ATOM 297 CG ASP A 19 -1.267 13.087 -4.321 1.00 0.00 C ATOM 298 OD1 ASP A 19 -0.960 13.565 -3.242 1.00 0.00 O ATOM 299 OD2 ASP A 19 -0.738 12.102 -4.807 1.00 0.00 O ATOM 0 H ASP A 19 -2.356 15.029 -2.802 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.425 14.308 -4.842 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -2.668 13.148 -5.967 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -2.033 14.718 -5.515 1.00 0.00 H new ATOM 304 N LEU A 20 -3.463 12.466 -2.304 1.00 0.00 N ATOM 305 CA LEU A 20 -3.908 11.249 -1.575 1.00 0.00 C ATOM 306 C LEU A 20 -5.310 11.541 -1.046 1.00 0.00 C ATOM 307 O LEU A 20 -6.127 10.660 -0.896 1.00 0.00 O ATOM 308 CB LEU A 20 -2.958 10.905 -0.423 1.00 0.00 C ATOM 309 CG LEU A 20 -1.514 11.161 -0.857 1.00 0.00 C ATOM 310 CD1 LEU A 20 -0.561 10.741 0.264 1.00 0.00 C ATOM 311 CD2 LEU A 20 -1.210 10.345 -2.116 1.00 0.00 C ATOM 0 H LEU A 20 -2.765 13.041 -1.832 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.909 10.387 -2.242 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -3.198 11.508 0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -3.082 9.861 -0.135 1.00 0.00 H new ATOM 0 HG LEU A 20 -1.380 12.222 -1.068 1.00 0.00 H new ATOM 0 HD11 LEU A 20 0.468 10.924 -0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -0.778 11.320 1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.693 9.680 0.476 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -0.181 10.526 -2.427 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.344 9.284 -1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.889 10.643 -2.915 1.00 0.00 H new ATOM 323 N GLN A 21 -5.610 12.788 -0.782 1.00 0.00 N ATOM 324 CA GLN A 21 -6.973 13.132 -0.303 1.00 0.00 C ATOM 325 C GLN A 21 -7.931 12.937 -1.476 1.00 0.00 C ATOM 326 O GLN A 21 -8.986 12.349 -1.341 1.00 0.00 O ATOM 327 CB GLN A 21 -7.005 14.593 0.153 1.00 0.00 C ATOM 328 CG GLN A 21 -8.384 14.923 0.729 1.00 0.00 C ATOM 329 CD GLN A 21 -8.428 16.398 1.133 1.00 0.00 C ATOM 330 OE1 GLN A 21 -8.471 17.271 0.288 1.00 0.00 O ATOM 331 NE2 GLN A 21 -8.420 16.716 2.398 1.00 0.00 N ATOM 0 H GLN A 21 -4.970 13.576 -0.879 1.00 0.00 H new ATOM 0 HA GLN A 21 -7.259 12.501 0.538 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -6.235 14.766 0.905 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -6.784 15.251 -0.687 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -9.158 14.714 -0.009 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -8.589 14.292 1.594 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -8.384 15.984 3.108 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -8.450 17.696 2.678 1.00 0.00 H new ATOM 340 N ALA A 22 -7.551 13.404 -2.643 1.00 0.00 N ATOM 341 CA ALA A 22 -8.418 13.220 -3.843 1.00 0.00 C ATOM 342 C ALA A 22 -8.862 11.759 -3.892 1.00 0.00 C ATOM 343 O ALA A 22 -9.987 11.428 -4.245 1.00 0.00 O ATOM 344 CB ALA A 22 -7.612 13.542 -5.103 1.00 0.00 C ATOM 0 H ALA A 22 -6.678 13.904 -2.812 1.00 0.00 H new ATOM 0 HA ALA A 22 -9.284 13.880 -3.789 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.242 13.409 -5.982 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.265 14.574 -5.059 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.754 12.873 -5.167 1.00 0.00 H new ATOM 350 N ILE A 23 -7.999 10.877 -3.472 1.00 0.00 N ATOM 351 CA ILE A 23 -8.386 9.452 -3.439 1.00 0.00 C ATOM 352 C ILE A 23 -9.441 9.319 -2.336 1.00 0.00 C ATOM 353 O ILE A 23 -10.456 8.685 -2.526 1.00 0.00 O ATOM 354 CB ILE A 23 -7.139 8.567 -3.162 1.00 0.00 C ATOM 355 CG1 ILE A 23 -6.421 8.220 -4.491 1.00 0.00 C ATOM 356 CG2 ILE A 23 -7.541 7.266 -2.438 1.00 0.00 C ATOM 357 CD1 ILE A 23 -5.623 9.431 -4.980 1.00 0.00 C ATOM 0 H ILE A 23 -7.052 11.084 -3.154 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.795 9.116 -4.392 1.00 0.00 H new ATOM 0 HB ILE A 23 -6.460 9.130 -2.521 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.755 7.369 -4.344 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.152 7.926 -5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.652 6.662 -2.254 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.016 7.510 -1.488 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.239 6.705 -3.059 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.120 9.182 -5.914 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.299 10.270 -5.144 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.881 9.704 -4.230 1.00 0.00 H new ATOM 369 N LYS A 24 -9.232 9.947 -1.199 1.00 0.00 N ATOM 370 CA LYS A 24 -10.225 9.898 -0.082 1.00 0.00 C ATOM 371 C LYS A 24 -11.499 10.673 -0.449 1.00 0.00 C ATOM 372 O LYS A 24 -12.454 10.720 0.314 1.00 0.00 O ATOM 373 CB LYS A 24 -9.577 10.537 1.159 1.00 0.00 C ATOM 374 CG LYS A 24 -10.284 10.068 2.437 1.00 0.00 C ATOM 375 CD LYS A 24 -9.914 10.993 3.600 1.00 0.00 C ATOM 376 CE LYS A 24 -8.399 10.965 3.817 1.00 0.00 C ATOM 377 NZ LYS A 24 -8.078 11.543 5.153 1.00 0.00 N ATOM 0 H LYS A 24 -8.399 10.500 -0.999 1.00 0.00 H new ATOM 0 HA LYS A 24 -10.503 8.862 0.113 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.521 10.271 1.202 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.630 11.623 1.085 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -11.364 10.069 2.288 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.995 9.043 2.669 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.242 12.010 3.387 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.427 10.676 4.508 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -8.031 9.941 3.754 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.898 11.533 3.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.186 11.137 5.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.979 12.575 5.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.844 11.321 5.820 1.00 0.00 H new ATOM 391 N GLN A 25 -11.588 11.205 -1.632 1.00 0.00 N ATOM 392 CA GLN A 25 -12.855 11.885 -2.019 1.00 0.00 C ATOM 393 C GLN A 25 -13.734 10.803 -2.618 1.00 0.00 C ATOM 394 O GLN A 25 -14.949 10.788 -2.487 1.00 0.00 O ATOM 395 CB GLN A 25 -12.575 12.966 -3.066 1.00 0.00 C ATOM 396 CG GLN A 25 -11.795 14.110 -2.416 1.00 0.00 C ATOM 397 CD GLN A 25 -11.557 15.216 -3.446 1.00 0.00 C ATOM 398 OE1 GLN A 25 -10.521 15.851 -3.444 1.00 0.00 O ATOM 399 NE2 GLN A 25 -12.480 15.476 -4.331 1.00 0.00 N ATOM 0 H GLN A 25 -10.853 11.201 -2.339 1.00 0.00 H new ATOM 0 HA GLN A 25 -13.329 12.369 -1.165 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -12.005 12.547 -3.895 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -13.512 13.339 -3.480 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -12.350 14.505 -1.565 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -10.842 13.743 -2.034 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -13.350 14.943 -4.333 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -12.332 16.212 -5.021 1.00 0.00 H new ATOM 408 N GLU A 26 -13.088 9.871 -3.268 1.00 0.00 N ATOM 409 CA GLU A 26 -13.815 8.736 -3.895 1.00 0.00 C ATOM 410 C GLU A 26 -13.984 7.583 -2.885 1.00 0.00 C ATOM 411 O GLU A 26 -14.821 6.705 -3.074 1.00 0.00 O ATOM 412 CB GLU A 26 -13.023 8.254 -5.113 1.00 0.00 C ATOM 413 CG GLU A 26 -13.269 9.194 -6.298 1.00 0.00 C ATOM 414 CD GLU A 26 -12.809 10.606 -5.933 1.00 0.00 C ATOM 415 OE1 GLU A 26 -11.615 10.851 -5.985 1.00 0.00 O ATOM 416 OE2 GLU A 26 -13.658 11.419 -5.609 1.00 0.00 O ATOM 0 H GLU A 26 -12.076 9.851 -3.391 1.00 0.00 H new ATOM 0 HA GLU A 26 -14.806 9.067 -4.206 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -11.959 8.222 -4.877 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -13.322 7.239 -5.374 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -12.728 8.839 -7.176 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.328 9.201 -6.557 1.00 0.00 H new ATOM 423 N VAL A 27 -13.294 7.597 -1.762 1.00 0.00 N ATOM 424 CA VAL A 27 -13.557 6.512 -0.781 1.00 0.00 C ATOM 425 C VAL A 27 -14.912 6.831 -0.202 1.00 0.00 C ATOM 426 O VAL A 27 -15.771 5.984 -0.058 1.00 0.00 O ATOM 427 CB VAL A 27 -12.518 6.477 0.347 1.00 0.00 C ATOM 428 CG1 VAL A 27 -11.115 6.371 -0.253 1.00 0.00 C ATOM 429 CG2 VAL A 27 -12.635 7.718 1.226 1.00 0.00 C ATOM 0 H VAL A 27 -12.590 8.286 -1.498 1.00 0.00 H new ATOM 0 HA VAL A 27 -13.510 5.538 -1.268 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.704 5.605 0.974 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -10.377 6.346 0.549 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -11.040 5.458 -0.844 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.927 7.233 -0.893 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.889 7.673 2.020 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.468 8.609 0.621 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -13.631 7.759 1.666 1.00 0.00 H new ATOM 439 N SER A 28 -15.124 8.117 0.080 1.00 0.00 N ATOM 440 CA SER A 28 -16.459 8.538 0.588 1.00 0.00 C ATOM 441 C SER A 28 -17.446 7.960 -0.416 1.00 0.00 C ATOM 442 O SER A 28 -18.029 6.941 -0.165 1.00 0.00 O ATOM 443 CB SER A 28 -16.561 10.066 0.626 1.00 0.00 C ATOM 444 OG SER A 28 -16.469 10.579 -0.696 1.00 0.00 O ATOM 0 H SER A 28 -14.436 8.863 -0.023 1.00 0.00 H new ATOM 0 HA SER A 28 -16.648 8.190 1.603 1.00 0.00 H new ATOM 0 HB2 SER A 28 -17.505 10.367 1.080 1.00 0.00 H new ATOM 0 HB3 SER A 28 -15.764 10.479 1.244 1.00 0.00 H new ATOM 0 HG SER A 28 -15.553 10.470 -1.026 1.00 0.00 H new ATOM 450 N GLN A 29 -17.591 8.621 -1.552 1.00 0.00 N ATOM 451 CA GLN A 29 -18.495 8.152 -2.669 1.00 0.00 C ATOM 452 C GLN A 29 -19.090 6.760 -2.412 1.00 0.00 C ATOM 453 O GLN A 29 -20.286 6.557 -2.479 1.00 0.00 O ATOM 454 CB GLN A 29 -17.644 8.046 -3.936 1.00 0.00 C ATOM 455 CG GLN A 29 -18.555 7.803 -5.141 1.00 0.00 C ATOM 456 CD GLN A 29 -17.715 7.780 -6.419 1.00 0.00 C ATOM 457 OE1 GLN A 29 -17.478 6.731 -6.984 1.00 0.00 O ATOM 458 NE2 GLN A 29 -17.251 8.900 -6.900 1.00 0.00 N ATOM 0 H GLN A 29 -17.104 9.494 -1.757 1.00 0.00 H new ATOM 0 HA GLN A 29 -19.316 8.864 -2.753 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -17.070 8.961 -4.079 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -16.927 7.231 -3.838 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -19.085 6.858 -5.025 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -19.310 8.587 -5.203 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.450 9.780 -6.425 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -16.689 8.895 -7.751 1.00 0.00 H new ATOM 467 N ALA A 30 -18.243 5.803 -2.093 1.00 0.00 N ATOM 468 CA ALA A 30 -18.734 4.413 -1.799 1.00 0.00 C ATOM 469 C ALA A 30 -18.988 4.252 -0.299 1.00 0.00 C ATOM 470 O ALA A 30 -19.328 5.182 0.401 1.00 0.00 O ATOM 471 CB ALA A 30 -17.669 3.397 -2.231 1.00 0.00 C ATOM 0 H ALA A 30 -17.233 5.925 -2.024 1.00 0.00 H new ATOM 0 HA ALA A 30 -19.662 4.242 -2.345 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -18.022 2.388 -2.019 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.481 3.499 -3.300 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.746 3.581 -1.681 1.00 0.00 H new ATOM 477 N ALA A 31 -18.817 3.066 0.194 1.00 0.00 N ATOM 478 CA ALA A 31 -19.018 2.810 1.650 1.00 0.00 C ATOM 479 C ALA A 31 -17.669 3.088 2.344 1.00 0.00 C ATOM 480 O ALA A 31 -16.707 3.379 1.663 1.00 0.00 O ATOM 481 CB ALA A 31 -19.453 1.338 1.826 1.00 0.00 C ATOM 0 H ALA A 31 -18.543 2.249 -0.351 1.00 0.00 H new ATOM 0 HA ALA A 31 -19.788 3.446 2.086 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -19.606 1.128 2.885 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -20.383 1.166 1.284 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -18.677 0.680 1.434 1.00 0.00 H new ATOM 487 N PRO A 32 -17.616 3.003 3.659 1.00 0.00 N ATOM 488 CA PRO A 32 -16.352 3.250 4.387 1.00 0.00 C ATOM 489 C PRO A 32 -15.314 2.183 3.985 1.00 0.00 C ATOM 490 O PRO A 32 -14.671 1.569 4.814 1.00 0.00 O ATOM 491 CB PRO A 32 -16.733 3.157 5.887 1.00 0.00 C ATOM 492 CG PRO A 32 -18.260 2.859 5.964 1.00 0.00 C ATOM 493 CD PRO A 32 -18.776 2.678 4.518 1.00 0.00 C ATOM 0 HA PRO A 32 -15.903 4.217 4.161 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -16.163 2.369 6.379 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -16.498 4.089 6.401 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -18.445 1.960 6.552 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -18.785 3.677 6.458 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -19.122 1.659 4.346 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -19.618 3.339 4.313 1.00 0.00 H new ATOM 501 N GLY A 33 -15.159 1.959 2.707 1.00 0.00 N ATOM 502 CA GLY A 33 -14.188 0.938 2.220 1.00 0.00 C ATOM 503 C GLY A 33 -14.684 0.398 0.878 1.00 0.00 C ATOM 504 O GLY A 33 -14.751 1.112 -0.103 1.00 0.00 O ATOM 0 H GLY A 33 -15.671 2.447 1.972 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.198 1.380 2.108 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.095 0.128 2.943 1.00 0.00 H new ATOM 508 N SER A 34 -15.069 -0.849 0.834 1.00 0.00 N ATOM 509 CA SER A 34 -15.604 -1.433 -0.429 1.00 0.00 C ATOM 510 C SER A 34 -14.520 -1.407 -1.524 1.00 0.00 C ATOM 511 O SER A 34 -13.499 -0.772 -1.346 1.00 0.00 O ATOM 512 CB SER A 34 -16.827 -0.591 -0.863 1.00 0.00 C ATOM 513 OG SER A 34 -16.581 0.004 -2.133 1.00 0.00 O ATOM 0 H SER A 34 -15.035 -1.492 1.625 1.00 0.00 H new ATOM 0 HA SER A 34 -15.900 -2.470 -0.272 1.00 0.00 H new ATOM 0 HB2 SER A 34 -17.714 -1.222 -0.913 1.00 0.00 H new ATOM 0 HB3 SER A 34 -17.028 0.183 -0.122 1.00 0.00 H new ATOM 0 HG SER A 34 -17.433 0.257 -2.546 1.00 0.00 H new ATOM 519 N PRO A 35 -14.768 -2.072 -2.637 1.00 0.00 N ATOM 520 CA PRO A 35 -13.805 -2.086 -3.756 1.00 0.00 C ATOM 521 C PRO A 35 -13.485 -0.646 -4.216 1.00 0.00 C ATOM 522 O PRO A 35 -12.359 -0.336 -4.510 1.00 0.00 O ATOM 523 CB PRO A 35 -14.502 -2.895 -4.877 1.00 0.00 C ATOM 524 CG PRO A 35 -15.838 -3.441 -4.297 1.00 0.00 C ATOM 525 CD PRO A 35 -16.002 -2.859 -2.875 1.00 0.00 C ATOM 0 HA PRO A 35 -12.851 -2.532 -3.475 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.690 -2.263 -5.745 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -13.866 -3.714 -5.211 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.677 -3.150 -4.929 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -15.825 -4.530 -4.266 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -16.890 -2.231 -2.806 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.114 -3.651 -2.135 1.00 0.00 H new ATOM 533 N GLN A 36 -14.464 0.217 -4.322 1.00 0.00 N ATOM 534 CA GLN A 36 -14.191 1.622 -4.795 1.00 0.00 C ATOM 535 C GLN A 36 -12.882 2.160 -4.189 1.00 0.00 C ATOM 536 O GLN A 36 -12.164 2.919 -4.808 1.00 0.00 O ATOM 537 CB GLN A 36 -15.344 2.525 -4.375 1.00 0.00 C ATOM 538 CG GLN A 36 -15.258 3.850 -5.139 1.00 0.00 C ATOM 539 CD GLN A 36 -15.670 3.627 -6.595 1.00 0.00 C ATOM 540 OE1 GLN A 36 -16.841 3.668 -6.920 1.00 0.00 O ATOM 541 NE2 GLN A 36 -14.752 3.392 -7.491 1.00 0.00 N ATOM 0 H GLN A 36 -15.440 0.017 -4.104 1.00 0.00 H new ATOM 0 HA GLN A 36 -14.094 1.611 -5.881 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -16.296 2.036 -4.580 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -15.304 2.709 -3.301 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -15.908 4.592 -4.676 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -14.242 4.243 -5.093 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -13.770 3.358 -7.218 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -15.016 3.243 -8.465 1.00 0.00 H new ATOM 550 N PHE A 37 -12.558 1.733 -3.003 1.00 0.00 N ATOM 551 CA PHE A 37 -11.284 2.155 -2.341 1.00 0.00 C ATOM 552 C PHE A 37 -10.108 1.469 -3.067 1.00 0.00 C ATOM 553 O PHE A 37 -9.017 1.995 -3.116 1.00 0.00 O ATOM 554 CB PHE A 37 -11.358 1.740 -0.863 1.00 0.00 C ATOM 555 CG PHE A 37 -10.605 2.700 0.038 1.00 0.00 C ATOM 556 CD1 PHE A 37 -9.226 2.849 -0.102 1.00 0.00 C ATOM 557 CD2 PHE A 37 -11.286 3.420 1.029 1.00 0.00 C ATOM 558 CE1 PHE A 37 -8.522 3.715 0.739 1.00 0.00 C ATOM 559 CE2 PHE A 37 -10.584 4.291 1.870 1.00 0.00 C ATOM 560 CZ PHE A 37 -9.200 4.438 1.726 1.00 0.00 C ATOM 0 H PHE A 37 -13.131 1.096 -2.449 1.00 0.00 H new ATOM 0 HA PHE A 37 -11.135 3.234 -2.394 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -12.402 1.694 -0.552 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -10.947 0.737 -0.748 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -8.700 2.293 -0.864 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -12.353 3.303 1.144 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -7.454 3.826 0.627 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -11.110 4.849 2.630 1.00 0.00 H new ATOM 0 HZ PHE A 37 -8.656 5.108 2.375 1.00 0.00 H new ATOM 570 N MET A 38 -10.326 0.365 -3.704 1.00 0.00 N ATOM 571 CA MET A 38 -9.227 -0.265 -4.491 1.00 0.00 C ATOM 572 C MET A 38 -9.084 0.533 -5.795 1.00 0.00 C ATOM 573 O MET A 38 -8.006 0.941 -6.173 1.00 0.00 O ATOM 574 CB MET A 38 -9.586 -1.751 -4.792 1.00 0.00 C ATOM 575 CG MET A 38 -9.184 -2.168 -6.228 1.00 0.00 C ATOM 576 SD MET A 38 -7.400 -1.951 -6.439 1.00 0.00 S ATOM 577 CE MET A 38 -7.141 -3.301 -7.617 1.00 0.00 C ATOM 0 H MET A 38 -11.215 -0.135 -3.719 1.00 0.00 H new ATOM 0 HA MET A 38 -8.288 -0.253 -3.938 1.00 0.00 H new ATOM 0 HB2 MET A 38 -9.083 -2.398 -4.073 1.00 0.00 H new ATOM 0 HB3 MET A 38 -10.658 -1.899 -4.659 1.00 0.00 H new ATOM 0 HG2 MET A 38 -9.459 -3.207 -6.407 1.00 0.00 H new ATOM 0 HG3 MET A 38 -9.724 -1.565 -6.958 1.00 0.00 H new ATOM 0 HE1 MET A 38 -6.366 -3.019 -8.329 1.00 0.00 H new ATOM 0 HE2 MET A 38 -6.831 -4.198 -7.080 1.00 0.00 H new ATOM 0 HE3 MET A 38 -8.070 -3.501 -8.152 1.00 0.00 H new ATOM 587 N GLN A 39 -10.171 0.736 -6.481 1.00 0.00 N ATOM 588 CA GLN A 39 -10.134 1.479 -7.775 1.00 0.00 C ATOM 589 C GLN A 39 -9.249 2.719 -7.649 1.00 0.00 C ATOM 590 O GLN A 39 -8.459 3.027 -8.516 1.00 0.00 O ATOM 591 CB GLN A 39 -11.563 1.907 -8.137 1.00 0.00 C ATOM 592 CG GLN A 39 -11.643 2.272 -9.625 1.00 0.00 C ATOM 593 CD GLN A 39 -10.843 3.549 -9.886 1.00 0.00 C ATOM 594 OE1 GLN A 39 -10.975 4.521 -9.168 1.00 0.00 O ATOM 595 NE2 GLN A 39 -10.013 3.590 -10.893 1.00 0.00 N ATOM 0 H GLN A 39 -11.097 0.416 -6.199 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.724 0.834 -8.552 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -12.260 1.099 -7.915 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.860 2.761 -7.529 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -11.251 1.455 -10.231 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -12.683 2.416 -9.919 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.902 2.775 -11.496 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -9.476 4.437 -11.077 1.00 0.00 H new ATOM 604 N THR A 40 -9.395 3.434 -6.575 1.00 0.00 N ATOM 605 CA THR A 40 -8.605 4.662 -6.358 1.00 0.00 C ATOM 606 C THR A 40 -7.188 4.326 -5.900 1.00 0.00 C ATOM 607 O THR A 40 -6.249 4.988 -6.296 1.00 0.00 O ATOM 608 CB THR A 40 -9.319 5.481 -5.307 1.00 0.00 C ATOM 609 OG1 THR A 40 -9.622 4.644 -4.199 1.00 0.00 O ATOM 610 CG2 THR A 40 -10.624 6.063 -5.871 1.00 0.00 C ATOM 0 H THR A 40 -10.046 3.210 -5.822 1.00 0.00 H new ATOM 0 HA THR A 40 -8.518 5.222 -7.289 1.00 0.00 H new ATOM 0 HB THR A 40 -8.673 6.303 -4.998 1.00 0.00 H new ATOM 0 HG1 THR A 40 -10.084 5.167 -3.511 1.00 0.00 H new ATOM 0 HG21 THR A 40 -11.124 6.649 -5.100 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.398 6.703 -6.724 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.277 5.250 -6.189 1.00 0.00 H new ATOM 618 N ILE A 41 -6.983 3.317 -5.129 1.00 0.00 N ATOM 619 CA ILE A 41 -5.576 2.995 -4.754 1.00 0.00 C ATOM 620 C ILE A 41 -4.961 2.249 -5.928 1.00 0.00 C ATOM 621 O ILE A 41 -3.770 2.020 -5.992 1.00 0.00 O ATOM 622 CB ILE A 41 -5.546 2.120 -3.505 1.00 0.00 C ATOM 623 CG1 ILE A 41 -6.270 2.843 -2.355 1.00 0.00 C ATOM 624 CG2 ILE A 41 -4.095 1.820 -3.118 1.00 0.00 C ATOM 625 CD1 ILE A 41 -5.349 3.877 -1.671 1.00 0.00 C ATOM 0 H ILE A 41 -7.702 2.705 -4.743 1.00 0.00 H new ATOM 0 HA ILE A 41 -5.018 3.906 -4.534 1.00 0.00 H new ATOM 0 HB ILE A 41 -6.055 1.177 -3.706 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -7.159 3.343 -2.740 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.609 2.113 -1.620 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.078 1.195 -2.225 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.601 1.297 -3.937 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.572 2.755 -2.916 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.891 4.369 -0.864 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.473 3.371 -1.264 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -5.032 4.621 -2.402 1.00 0.00 H new ATOM 637 N ARG A 42 -5.789 1.875 -6.864 1.00 0.00 N ATOM 638 CA ARG A 42 -5.299 1.142 -8.056 1.00 0.00 C ATOM 639 C ARG A 42 -4.530 2.086 -8.973 1.00 0.00 C ATOM 640 O ARG A 42 -3.427 1.795 -9.381 1.00 0.00 O ATOM 641 CB ARG A 42 -6.486 0.580 -8.836 1.00 0.00 C ATOM 642 CG ARG A 42 -5.983 -0.421 -9.877 1.00 0.00 C ATOM 643 CD ARG A 42 -7.159 -0.923 -10.717 1.00 0.00 C ATOM 644 NE ARG A 42 -8.239 -1.419 -9.819 1.00 0.00 N ATOM 645 CZ ARG A 42 -9.440 -1.617 -10.291 1.00 0.00 C ATOM 646 NH1 ARG A 42 -9.693 -1.379 -11.549 1.00 0.00 N ATOM 647 NH2 ARG A 42 -10.387 -2.055 -9.508 1.00 0.00 N ATOM 0 H ARG A 42 -6.794 2.050 -6.850 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.646 0.335 -7.722 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.185 0.093 -8.155 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.029 1.388 -9.326 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -5.239 0.050 -10.519 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -5.492 -1.259 -9.383 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.538 -0.119 -11.348 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -6.829 -1.722 -11.382 1.00 0.00 H new ATOM 0 HE ARG A 42 -8.040 -1.604 -8.836 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.953 -1.039 -12.163 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -10.631 -1.533 -11.919 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -10.190 -2.243 -8.525 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.325 -2.209 -9.879 1.00 0.00 H new ATOM 661 N LEU A 43 -5.111 3.208 -9.329 1.00 0.00 N ATOM 662 CA LEU A 43 -4.408 4.150 -10.261 1.00 0.00 C ATOM 663 C LEU A 43 -3.626 5.209 -9.481 1.00 0.00 C ATOM 664 O LEU A 43 -2.844 5.937 -10.046 1.00 0.00 O ATOM 665 CB LEU A 43 -5.434 4.807 -11.220 1.00 0.00 C ATOM 666 CG LEU A 43 -6.106 6.048 -10.602 1.00 0.00 C ATOM 667 CD1 LEU A 43 -7.118 6.614 -11.600 1.00 0.00 C ATOM 668 CD2 LEU A 43 -6.840 5.661 -9.320 1.00 0.00 C ATOM 0 H LEU A 43 -6.034 3.511 -9.018 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.690 3.585 -10.855 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -4.932 5.092 -12.145 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.199 4.077 -11.484 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.344 6.792 -10.371 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.599 7.493 -11.171 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.604 6.894 -12.520 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.872 5.859 -11.821 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.312 6.544 -8.890 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.603 4.917 -9.548 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.130 5.245 -8.605 1.00 0.00 H new ATOM 680 N ALA A 44 -3.793 5.290 -8.191 1.00 0.00 N ATOM 681 CA ALA A 44 -3.009 6.303 -7.416 1.00 0.00 C ATOM 682 C ALA A 44 -1.672 5.680 -7.008 1.00 0.00 C ATOM 683 O ALA A 44 -0.634 6.301 -7.142 1.00 0.00 O ATOM 684 CB ALA A 44 -3.789 6.759 -6.182 1.00 0.00 C ATOM 0 H ALA A 44 -4.428 4.710 -7.642 1.00 0.00 H new ATOM 0 HA ALA A 44 -2.830 7.181 -8.037 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -3.202 7.495 -5.632 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -4.733 7.206 -6.493 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.988 5.901 -5.540 1.00 0.00 H new ATOM 690 N VAL A 45 -1.663 4.466 -6.541 1.00 0.00 N ATOM 691 CA VAL A 45 -0.371 3.837 -6.165 1.00 0.00 C ATOM 692 C VAL A 45 0.285 3.264 -7.425 1.00 0.00 C ATOM 693 O VAL A 45 1.485 3.141 -7.504 1.00 0.00 O ATOM 694 CB VAL A 45 -0.619 2.722 -5.137 1.00 0.00 C ATOM 695 CG1 VAL A 45 0.626 1.836 -5.006 1.00 0.00 C ATOM 696 CG2 VAL A 45 -0.927 3.354 -3.777 1.00 0.00 C ATOM 0 H VAL A 45 -2.490 3.885 -6.404 1.00 0.00 H new ATOM 0 HA VAL A 45 0.291 4.579 -5.719 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.459 2.112 -5.469 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.438 1.050 -4.275 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.856 1.386 -5.972 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.471 2.442 -4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.104 2.568 -3.042 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.081 3.964 -3.459 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -1.815 3.980 -3.860 1.00 0.00 H new ATOM 706 N GLN A 46 -0.482 2.922 -8.424 1.00 0.00 N ATOM 707 CA GLN A 46 0.139 2.368 -9.660 1.00 0.00 C ATOM 708 C GLN A 46 0.675 3.507 -10.534 1.00 0.00 C ATOM 709 O GLN A 46 1.518 3.296 -11.384 1.00 0.00 O ATOM 710 CB GLN A 46 -0.901 1.579 -10.457 1.00 0.00 C ATOM 711 CG GLN A 46 -0.221 0.895 -11.645 1.00 0.00 C ATOM 712 CD GLN A 46 -1.213 -0.045 -12.330 1.00 0.00 C ATOM 713 OE1 GLN A 46 -1.717 0.255 -13.394 1.00 0.00 O ATOM 714 NE2 GLN A 46 -1.518 -1.180 -11.762 1.00 0.00 N ATOM 0 H GLN A 46 -1.499 3.001 -8.439 1.00 0.00 H new ATOM 0 HA GLN A 46 0.959 1.710 -9.372 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -1.376 0.835 -9.818 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.688 2.246 -10.809 1.00 0.00 H new ATOM 0 HG2 GLN A 46 0.136 1.643 -12.353 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.651 0.336 -11.306 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -1.096 -1.433 -10.869 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -2.179 -1.814 -12.211 1.00 0.00 H new ATOM 723 N GLN A 47 0.178 4.710 -10.362 1.00 0.00 N ATOM 724 CA GLN A 47 0.655 5.838 -11.223 1.00 0.00 C ATOM 725 C GLN A 47 1.880 6.524 -10.620 1.00 0.00 C ATOM 726 O GLN A 47 2.953 6.525 -11.188 1.00 0.00 O ATOM 727 CB GLN A 47 -0.464 6.878 -11.358 1.00 0.00 C ATOM 728 CG GLN A 47 -1.564 6.336 -12.280 1.00 0.00 C ATOM 729 CD GLN A 47 -1.104 6.422 -13.737 1.00 0.00 C ATOM 730 OE1 GLN A 47 -1.188 7.467 -14.352 1.00 0.00 O ATOM 731 NE2 GLN A 47 -0.619 5.360 -14.319 1.00 0.00 N ATOM 0 H GLN A 47 -0.530 4.957 -9.670 1.00 0.00 H new ATOM 0 HA GLN A 47 0.927 5.426 -12.195 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -0.879 7.109 -10.377 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -0.063 7.808 -11.762 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -1.792 5.302 -12.021 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -2.481 6.909 -12.144 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -0.548 4.483 -13.803 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -0.310 5.407 -15.290 1.00 0.00 H new ATOM 740 N PHE A 48 1.708 7.140 -9.479 1.00 0.00 N ATOM 741 CA PHE A 48 2.839 7.869 -8.838 1.00 0.00 C ATOM 742 C PHE A 48 3.700 6.910 -8.020 1.00 0.00 C ATOM 743 O PHE A 48 4.698 7.315 -7.460 1.00 0.00 O ATOM 744 CB PHE A 48 2.280 8.952 -7.912 1.00 0.00 C ATOM 745 CG PHE A 48 1.470 9.941 -8.715 1.00 0.00 C ATOM 746 CD1 PHE A 48 0.123 9.681 -8.992 1.00 0.00 C ATOM 747 CD2 PHE A 48 2.066 11.119 -9.181 1.00 0.00 C ATOM 748 CE1 PHE A 48 -0.629 10.600 -9.735 1.00 0.00 C ATOM 749 CE2 PHE A 48 1.315 12.037 -9.924 1.00 0.00 C ATOM 750 CZ PHE A 48 -0.032 11.778 -10.201 1.00 0.00 C ATOM 0 H PHE A 48 0.829 7.169 -8.963 1.00 0.00 H new ATOM 0 HA PHE A 48 3.453 8.319 -9.618 1.00 0.00 H new ATOM 0 HB2 PHE A 48 1.657 8.499 -7.141 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.096 9.465 -7.402 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -0.337 8.772 -8.633 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.105 11.319 -8.967 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -1.669 10.400 -9.948 1.00 0.00 H new ATOM 0 HE2 PHE A 48 1.775 12.945 -10.284 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.611 12.487 -10.774 1.00 0.00 H new ATOM 760 N ASP A 49 3.336 5.646 -7.968 1.00 0.00 N ATOM 761 CA ASP A 49 4.143 4.635 -7.196 1.00 0.00 C ATOM 762 C ASP A 49 4.921 5.285 -6.039 1.00 0.00 C ATOM 763 O ASP A 49 6.132 5.361 -6.094 1.00 0.00 O ATOM 764 CB ASP A 49 5.153 3.980 -8.135 1.00 0.00 C ATOM 765 CG ASP A 49 4.419 3.109 -9.156 1.00 0.00 C ATOM 766 OD1 ASP A 49 3.922 3.658 -10.125 1.00 0.00 O ATOM 767 OD2 ASP A 49 4.366 1.907 -8.952 1.00 0.00 O ATOM 0 H ASP A 49 2.509 5.268 -8.430 1.00 0.00 H new ATOM 0 HA ASP A 49 3.448 3.904 -6.783 1.00 0.00 H new ATOM 0 HB2 ASP A 49 5.736 4.745 -8.648 1.00 0.00 H new ATOM 0 HB3 ASP A 49 5.855 3.373 -7.563 1.00 0.00 H new ATOM 772 N PRO A 50 4.222 5.737 -5.028 1.00 0.00 N ATOM 773 CA PRO A 50 4.880 6.375 -3.877 1.00 0.00 C ATOM 774 C PRO A 50 5.894 5.396 -3.271 1.00 0.00 C ATOM 775 O PRO A 50 5.855 4.211 -3.533 1.00 0.00 O ATOM 776 CB PRO A 50 3.730 6.702 -2.897 1.00 0.00 C ATOM 777 CG PRO A 50 2.393 6.374 -3.625 1.00 0.00 C ATOM 778 CD PRO A 50 2.752 5.650 -4.941 1.00 0.00 C ATOM 0 HA PRO A 50 5.436 7.276 -4.135 1.00 0.00 H new ATOM 0 HB2 PRO A 50 3.825 6.114 -1.984 1.00 0.00 H new ATOM 0 HB3 PRO A 50 3.761 7.752 -2.605 1.00 0.00 H new ATOM 0 HG2 PRO A 50 1.760 5.744 -3.000 1.00 0.00 H new ATOM 0 HG3 PRO A 50 1.833 7.286 -3.829 1.00 0.00 H new ATOM 0 HD2 PRO A 50 2.417 4.613 -4.926 1.00 0.00 H new ATOM 0 HD3 PRO A 50 2.276 6.127 -5.798 1.00 0.00 H new ATOM 786 N THR A 51 6.800 5.875 -2.466 1.00 0.00 N ATOM 787 CA THR A 51 7.802 4.954 -1.858 1.00 0.00 C ATOM 788 C THR A 51 7.162 4.227 -0.675 1.00 0.00 C ATOM 789 O THR A 51 6.069 4.553 -0.256 1.00 0.00 O ATOM 790 CB THR A 51 9.013 5.755 -1.372 1.00 0.00 C ATOM 791 OG1 THR A 51 8.593 6.725 -0.423 1.00 0.00 O ATOM 792 CG2 THR A 51 9.675 6.451 -2.562 1.00 0.00 C ATOM 0 H THR A 51 6.891 6.856 -2.204 1.00 0.00 H new ATOM 0 HA THR A 51 8.129 4.228 -2.603 1.00 0.00 H new ATOM 0 HB THR A 51 9.730 5.081 -0.903 1.00 0.00 H new ATOM 0 HG1 THR A 51 8.959 7.601 -0.667 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.537 7.021 -2.216 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.001 5.704 -3.286 1.00 0.00 H new ATOM 0 HG23 THR A 51 8.960 7.125 -3.033 1.00 0.00 H new ATOM 800 N ALA A 52 7.830 3.253 -0.126 1.00 0.00 N ATOM 801 CA ALA A 52 7.247 2.525 1.035 1.00 0.00 C ATOM 802 C ALA A 52 6.920 3.548 2.128 1.00 0.00 C ATOM 803 O ALA A 52 6.087 3.332 2.990 1.00 0.00 O ATOM 804 CB ALA A 52 8.268 1.513 1.554 1.00 0.00 C ATOM 0 H ALA A 52 8.749 2.930 -0.428 1.00 0.00 H new ATOM 0 HA ALA A 52 6.340 1.995 0.742 1.00 0.00 H new ATOM 0 HB1 ALA A 52 7.848 0.976 2.404 1.00 0.00 H new ATOM 0 HB2 ALA A 52 8.513 0.805 0.763 1.00 0.00 H new ATOM 0 HB3 ALA A 52 9.172 2.036 1.866 1.00 0.00 H new ATOM 810 N LYS A 53 7.572 4.675 2.066 1.00 0.00 N ATOM 811 CA LYS A 53 7.331 5.758 3.058 1.00 0.00 C ATOM 812 C LYS A 53 5.833 6.044 3.138 1.00 0.00 C ATOM 813 O LYS A 53 5.209 5.894 4.171 1.00 0.00 O ATOM 814 CB LYS A 53 8.057 7.012 2.595 1.00 0.00 C ATOM 815 CG LYS A 53 9.550 6.708 2.438 1.00 0.00 C ATOM 816 CD LYS A 53 10.317 8.005 2.158 1.00 0.00 C ATOM 817 CE LYS A 53 11.811 7.775 2.395 1.00 0.00 C ATOM 818 NZ LYS A 53 12.549 9.054 2.197 1.00 0.00 N ATOM 0 H LYS A 53 8.273 4.894 1.358 1.00 0.00 H new ATOM 0 HA LYS A 53 7.696 5.455 4.039 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.643 7.356 1.647 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.912 7.816 3.316 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.932 6.237 3.344 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.703 6.001 1.623 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.146 8.327 1.131 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.953 8.802 2.806 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.976 7.400 3.405 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.186 7.016 1.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.564 8.897 2.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.401 9.393 1.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.197 9.765 2.869 1.00 0.00 H new ATOM 832 N ASP A 54 5.230 6.412 2.044 1.00 0.00 N ATOM 833 CA ASP A 54 3.765 6.653 2.051 1.00 0.00 C ATOM 834 C ASP A 54 3.088 5.436 2.683 1.00 0.00 C ATOM 835 O ASP A 54 2.281 5.567 3.580 1.00 0.00 O ATOM 836 CB ASP A 54 3.288 6.826 0.593 1.00 0.00 C ATOM 837 CG ASP A 54 2.068 7.756 0.520 1.00 0.00 C ATOM 838 OD1 ASP A 54 1.540 8.104 1.563 1.00 0.00 O ATOM 839 OD2 ASP A 54 1.686 8.107 -0.584 1.00 0.00 O ATOM 0 H ASP A 54 5.690 6.556 1.145 1.00 0.00 H new ATOM 0 HA ASP A 54 3.516 7.549 2.619 1.00 0.00 H new ATOM 0 HB2 ASP A 54 4.098 7.234 -0.012 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.034 5.853 0.172 1.00 0.00 H new ATOM 844 N LEU A 55 3.395 4.261 2.203 1.00 0.00 N ATOM 845 CA LEU A 55 2.763 3.017 2.754 1.00 0.00 C ATOM 846 C LEU A 55 2.621 3.126 4.283 1.00 0.00 C ATOM 847 O LEU A 55 1.713 2.575 4.871 1.00 0.00 O ATOM 848 CB LEU A 55 3.643 1.808 2.379 1.00 0.00 C ATOM 849 CG LEU A 55 2.796 0.536 2.163 1.00 0.00 C ATOM 850 CD1 LEU A 55 1.925 0.267 3.395 1.00 0.00 C ATOM 851 CD2 LEU A 55 1.902 0.680 0.910 1.00 0.00 C ATOM 0 H LEU A 55 4.061 4.104 1.447 1.00 0.00 H new ATOM 0 HA LEU A 55 1.767 2.889 2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 55 4.203 2.032 1.471 1.00 0.00 H new ATOM 0 HB3 LEU A 55 4.374 1.630 3.168 1.00 0.00 H new ATOM 0 HG LEU A 55 3.473 -0.305 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.332 -0.633 3.232 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.563 0.128 4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.260 1.114 3.563 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.314 -0.228 0.777 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.233 1.531 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 55 2.529 0.839 0.032 1.00 0.00 H new ATOM 863 N GLN A 56 3.488 3.859 4.931 1.00 0.00 N ATOM 864 CA GLN A 56 3.357 4.009 6.411 1.00 0.00 C ATOM 865 C GLN A 56 2.260 5.039 6.710 1.00 0.00 C ATOM 866 O GLN A 56 1.496 4.886 7.638 1.00 0.00 O ATOM 867 CB GLN A 56 4.688 4.478 7.024 1.00 0.00 C ATOM 868 CG GLN A 56 5.631 3.284 7.208 1.00 0.00 C ATOM 869 CD GLN A 56 6.000 2.704 5.843 1.00 0.00 C ATOM 870 OE1 GLN A 56 5.324 1.692 5.374 1.00 0.00 O flip ATOM 871 NE2 GLN A 56 6.916 3.174 5.198 1.00 0.00 N flip ATOM 0 H GLN A 56 4.272 4.355 4.507 1.00 0.00 H new ATOM 0 HA GLN A 56 3.095 3.046 6.849 1.00 0.00 H new ATOM 0 HB2 GLN A 56 5.153 5.223 6.378 1.00 0.00 H new ATOM 0 HB3 GLN A 56 4.506 4.959 7.985 1.00 0.00 H new ATOM 0 HG2 GLN A 56 6.531 3.597 7.736 1.00 0.00 H new ATOM 0 HG3 GLN A 56 5.152 2.521 7.821 1.00 0.00 H new ATOM 0 HE21 GLN A 56 7.445 3.965 5.565 1.00 0.00 H new ATOM 0 HE22 GLN A 56 7.156 2.777 4.290 1.00 0.00 H new ATOM 880 N ASP A 57 2.177 6.088 5.929 1.00 0.00 N ATOM 881 CA ASP A 57 1.124 7.130 6.175 1.00 0.00 C ATOM 882 C ASP A 57 -0.192 6.753 5.474 1.00 0.00 C ATOM 883 O ASP A 57 -1.231 7.302 5.782 1.00 0.00 O ATOM 884 CB ASP A 57 1.608 8.494 5.665 1.00 0.00 C ATOM 885 CG ASP A 57 0.469 9.514 5.742 1.00 0.00 C ATOM 886 OD1 ASP A 57 -0.355 9.522 4.842 1.00 0.00 O ATOM 887 OD2 ASP A 57 0.441 10.270 6.699 1.00 0.00 O ATOM 0 H ASP A 57 2.789 6.270 5.134 1.00 0.00 H new ATOM 0 HA ASP A 57 0.943 7.187 7.248 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.454 8.835 6.261 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.958 8.404 4.637 1.00 0.00 H new ATOM 892 N LEU A 58 -0.182 5.817 4.561 1.00 0.00 N ATOM 893 CA LEU A 58 -1.466 5.423 3.893 1.00 0.00 C ATOM 894 C LEU A 58 -2.111 4.290 4.694 1.00 0.00 C ATOM 895 O LEU A 58 -3.319 4.152 4.715 1.00 0.00 O ATOM 896 CB LEU A 58 -1.207 4.956 2.453 1.00 0.00 C ATOM 897 CG LEU A 58 -0.971 6.166 1.529 1.00 0.00 C ATOM 898 CD1 LEU A 58 -0.188 5.718 0.291 1.00 0.00 C ATOM 899 CD2 LEU A 58 -2.311 6.763 1.075 1.00 0.00 C ATOM 0 H LEU A 58 0.647 5.311 4.249 1.00 0.00 H new ATOM 0 HA LEU A 58 -2.131 6.286 3.859 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.339 4.297 2.428 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.057 4.377 2.094 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.408 6.919 2.080 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.021 6.574 -0.363 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.772 5.303 0.598 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.757 4.958 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.127 7.617 0.423 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.880 6.008 0.532 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.878 7.088 1.947 1.00 0.00 H new ATOM 911 N LEU A 59 -1.333 3.508 5.388 1.00 0.00 N ATOM 912 CA LEU A 59 -1.917 2.412 6.216 1.00 0.00 C ATOM 913 C LEU A 59 -2.183 2.957 7.621 1.00 0.00 C ATOM 914 O LEU A 59 -2.930 2.390 8.390 1.00 0.00 O ATOM 915 CB LEU A 59 -0.927 1.243 6.290 1.00 0.00 C ATOM 916 CG LEU A 59 -1.617 -0.007 6.861 1.00 0.00 C ATOM 917 CD1 LEU A 59 -2.607 -0.603 5.839 1.00 0.00 C ATOM 918 CD2 LEU A 59 -0.546 -1.047 7.210 1.00 0.00 C ATOM 0 H LEU A 59 -0.316 3.579 5.419 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.848 2.058 5.772 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.534 1.027 5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.078 1.516 6.917 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.177 0.272 7.754 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.083 -1.486 6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.369 0.138 5.596 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.070 -0.882 4.932 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.023 -1.939 7.616 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.011 -1.311 6.311 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.137 -0.632 7.951 1.00 0.00 H new ATOM 930 N GLN A 60 -1.556 4.042 7.974 1.00 0.00 N ATOM 931 CA GLN A 60 -1.756 4.615 9.338 1.00 0.00 C ATOM 932 C GLN A 60 -2.786 5.747 9.306 1.00 0.00 C ATOM 933 O GLN A 60 -3.377 6.083 10.313 1.00 0.00 O ATOM 934 CB GLN A 60 -0.426 5.195 9.811 1.00 0.00 C ATOM 935 CG GLN A 60 0.577 4.057 10.030 1.00 0.00 C ATOM 936 CD GLN A 60 0.257 3.336 11.342 1.00 0.00 C ATOM 937 OE1 GLN A 60 -0.369 2.295 11.339 1.00 0.00 O ATOM 938 NE2 GLN A 60 0.663 3.850 12.471 1.00 0.00 N ATOM 0 H GLN A 60 -0.911 4.560 7.377 1.00 0.00 H new ATOM 0 HA GLN A 60 -2.111 3.829 10.005 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -0.040 5.898 9.072 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -0.568 5.752 10.737 1.00 0.00 H new ATOM 0 HG2 GLN A 60 0.533 3.355 9.197 1.00 0.00 H new ATOM 0 HG3 GLN A 60 1.592 4.454 10.059 1.00 0.00 H new ATOM 0 HE21 GLN A 60 1.189 4.724 12.474 1.00 0.00 H new ATOM 0 HE22 GLN A 60 0.455 3.378 13.351 1.00 0.00 H new ATOM 947 N TYR A 61 -2.976 6.363 8.160 1.00 0.00 N ATOM 948 CA TYR A 61 -3.937 7.512 8.054 1.00 0.00 C ATOM 949 C TYR A 61 -5.195 7.111 7.271 1.00 0.00 C ATOM 950 O TYR A 61 -6.302 7.321 7.726 1.00 0.00 O ATOM 951 CB TYR A 61 -3.232 8.678 7.337 1.00 0.00 C ATOM 952 CG TYR A 61 -3.868 9.995 7.729 1.00 0.00 C ATOM 953 CD1 TYR A 61 -5.058 10.409 7.120 1.00 0.00 C ATOM 954 CD2 TYR A 61 -3.264 10.801 8.703 1.00 0.00 C ATOM 955 CE1 TYR A 61 -5.644 11.628 7.483 1.00 0.00 C ATOM 956 CE2 TYR A 61 -3.850 12.020 9.065 1.00 0.00 C ATOM 957 CZ TYR A 61 -5.040 12.433 8.455 1.00 0.00 C ATOM 958 OH TYR A 61 -5.617 13.635 8.813 1.00 0.00 O ATOM 0 H TYR A 61 -2.504 6.118 7.289 1.00 0.00 H new ATOM 0 HA TYR A 61 -4.245 7.810 9.056 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -2.173 8.686 7.595 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -3.296 8.542 6.257 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -5.525 9.788 6.370 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -2.346 10.482 9.175 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -6.562 11.947 7.013 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -3.384 12.642 9.815 1.00 0.00 H new ATOM 0 HH TYR A 61 -5.070 14.068 9.501 1.00 0.00 H new ATOM 968 N LEU A 62 -5.049 6.555 6.095 1.00 0.00 N ATOM 969 CA LEU A 62 -6.267 6.178 5.313 1.00 0.00 C ATOM 970 C LEU A 62 -6.897 4.933 5.945 1.00 0.00 C ATOM 971 O LEU A 62 -8.096 4.747 5.888 1.00 0.00 O ATOM 972 CB LEU A 62 -5.899 5.930 3.828 1.00 0.00 C ATOM 973 CG LEU A 62 -6.323 7.132 2.965 1.00 0.00 C ATOM 974 CD1 LEU A 62 -5.497 8.358 3.352 1.00 0.00 C ATOM 975 CD2 LEU A 62 -6.090 6.815 1.486 1.00 0.00 C ATOM 0 H LEU A 62 -4.156 6.348 5.648 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.991 6.993 5.339 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.825 5.767 3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.391 5.025 3.470 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.381 7.335 3.132 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.799 9.208 2.740 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -5.663 8.591 4.404 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.439 8.151 3.189 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.392 7.669 0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.033 6.607 1.321 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.679 5.943 1.204 1.00 0.00 H new ATOM 987 N CYS A 63 -6.111 4.100 6.576 1.00 0.00 N ATOM 988 CA CYS A 63 -6.677 2.890 7.249 1.00 0.00 C ATOM 989 C CYS A 63 -6.669 3.149 8.757 1.00 0.00 C ATOM 990 O CYS A 63 -6.930 4.249 9.202 1.00 0.00 O ATOM 991 CB CYS A 63 -5.816 1.668 6.922 1.00 0.00 C ATOM 992 SG CYS A 63 -5.434 1.658 5.153 1.00 0.00 S ATOM 0 H CYS A 63 -5.099 4.205 6.655 1.00 0.00 H new ATOM 0 HA CYS A 63 -7.693 2.697 6.903 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -4.895 1.692 7.504 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -6.343 0.754 7.197 1.00 0.00 H new ATOM 0 HG CYS A 63 -4.668 2.669 4.869 1.00 0.00 H new ATOM 998 N SER A 64 -6.370 2.161 9.550 1.00 0.00 N ATOM 999 CA SER A 64 -6.348 2.384 11.023 1.00 0.00 C ATOM 1000 C SER A 64 -5.657 1.210 11.717 1.00 0.00 C ATOM 1001 O SER A 64 -5.305 0.227 11.096 1.00 0.00 O ATOM 1002 CB SER A 64 -7.779 2.513 11.540 1.00 0.00 C ATOM 1003 OG SER A 64 -7.777 2.413 12.958 1.00 0.00 O ATOM 0 H SER A 64 -6.141 1.214 9.247 1.00 0.00 H new ATOM 0 HA SER A 64 -5.798 3.300 11.239 1.00 0.00 H new ATOM 0 HB2 SER A 64 -8.204 3.468 11.232 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.405 1.731 11.110 1.00 0.00 H new ATOM 0 HG SER A 64 -8.694 2.497 13.293 1.00 0.00 H new ATOM 1009 N SER A 65 -5.446 1.323 13.003 1.00 0.00 N ATOM 1010 CA SER A 65 -4.763 0.237 13.767 1.00 0.00 C ATOM 1011 C SER A 65 -5.242 -1.142 13.302 1.00 0.00 C ATOM 1012 O SER A 65 -4.516 -1.869 12.652 1.00 0.00 O ATOM 1013 CB SER A 65 -5.065 0.400 15.256 1.00 0.00 C ATOM 1014 OG SER A 65 -6.472 0.475 15.444 1.00 0.00 O ATOM 0 H SER A 65 -5.721 2.131 13.562 1.00 0.00 H new ATOM 0 HA SER A 65 -3.690 0.310 13.590 1.00 0.00 H new ATOM 0 HB2 SER A 65 -4.656 -0.441 15.816 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.587 1.301 15.639 1.00 0.00 H new ATOM 0 HG SER A 65 -6.669 0.578 16.398 1.00 0.00 H new ATOM 1020 N LEU A 66 -6.445 -1.523 13.640 1.00 0.00 N ATOM 1021 CA LEU A 66 -6.944 -2.866 13.227 1.00 0.00 C ATOM 1022 C LEU A 66 -6.664 -3.103 11.741 1.00 0.00 C ATOM 1023 O LEU A 66 -5.841 -3.915 11.391 1.00 0.00 O ATOM 1024 CB LEU A 66 -8.459 -2.945 13.483 1.00 0.00 C ATOM 1025 CG LEU A 66 -8.748 -3.235 14.968 1.00 0.00 C ATOM 1026 CD1 LEU A 66 -8.304 -4.663 15.347 1.00 0.00 C ATOM 1027 CD2 LEU A 66 -8.015 -2.212 15.845 1.00 0.00 C ATOM 0 H LEU A 66 -7.102 -0.963 14.183 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.429 -3.631 13.808 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.931 -2.006 13.192 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.897 -3.727 12.863 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.822 -3.156 15.133 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.519 -4.843 16.400 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -8.846 -5.386 14.737 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.234 -4.770 15.171 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -8.221 -2.419 16.895 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -6.942 -2.281 15.665 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.360 -1.208 15.599 1.00 0.00 H new ATOM 1039 N VAL A 67 -7.401 -2.453 10.873 1.00 0.00 N ATOM 1040 CA VAL A 67 -7.238 -2.681 9.397 1.00 0.00 C ATOM 1041 C VAL A 67 -5.775 -3.000 9.039 1.00 0.00 C ATOM 1042 O VAL A 67 -5.500 -3.923 8.298 1.00 0.00 O ATOM 1043 CB VAL A 67 -7.697 -1.441 8.632 1.00 0.00 C ATOM 1044 CG1 VAL A 67 -7.503 -1.665 7.131 1.00 0.00 C ATOM 1045 CG2 VAL A 67 -9.177 -1.183 8.921 1.00 0.00 C ATOM 0 H VAL A 67 -8.115 -1.768 11.123 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.851 -3.537 9.115 1.00 0.00 H new ATOM 0 HB VAL A 67 -7.108 -0.580 8.950 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -7.831 -0.780 6.586 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -6.449 -1.849 6.924 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.091 -2.526 6.813 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -9.505 -0.298 8.376 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.765 -2.044 8.604 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.316 -1.023 9.990 1.00 0.00 H new ATOM 1055 N ALA A 68 -4.833 -2.255 9.572 1.00 0.00 N ATOM 1056 CA ALA A 68 -3.396 -2.539 9.267 1.00 0.00 C ATOM 1057 C ALA A 68 -3.112 -4.006 9.596 1.00 0.00 C ATOM 1058 O ALA A 68 -2.436 -4.703 8.865 1.00 0.00 O ATOM 1059 CB ALA A 68 -2.497 -1.632 10.114 1.00 0.00 C ATOM 0 H ALA A 68 -4.997 -1.469 10.200 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.192 -2.347 8.214 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.452 -1.843 9.888 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.714 -0.589 9.886 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -2.685 -1.819 11.171 1.00 0.00 H new ATOM 1065 N SER A 69 -3.685 -4.491 10.663 1.00 0.00 N ATOM 1066 CA SER A 69 -3.533 -5.923 11.032 1.00 0.00 C ATOM 1067 C SER A 69 -4.079 -6.771 9.883 1.00 0.00 C ATOM 1068 O SER A 69 -3.355 -7.385 9.125 1.00 0.00 O ATOM 1069 CB SER A 69 -4.390 -6.188 12.282 1.00 0.00 C ATOM 1070 OG SER A 69 -4.053 -5.241 13.287 1.00 0.00 O ATOM 0 H SER A 69 -4.261 -3.945 11.304 1.00 0.00 H new ATOM 0 HA SER A 69 -2.488 -6.166 11.225 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.449 -6.113 12.035 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.219 -7.201 12.647 1.00 0.00 H new ATOM 0 HG SER A 69 -4.597 -5.404 14.086 1.00 0.00 H new ATOM 1076 N LEU A 70 -5.380 -6.791 9.779 1.00 0.00 N ATOM 1077 CA LEU A 70 -6.107 -7.557 8.731 1.00 0.00 C ATOM 1078 C LEU A 70 -5.447 -7.508 7.347 1.00 0.00 C ATOM 1079 O LEU A 70 -5.107 -8.515 6.758 1.00 0.00 O ATOM 1080 CB LEU A 70 -7.499 -6.895 8.582 1.00 0.00 C ATOM 1081 CG LEU A 70 -8.107 -6.589 9.961 1.00 0.00 C ATOM 1082 CD1 LEU A 70 -9.587 -6.241 9.792 1.00 0.00 C ATOM 1083 CD2 LEU A 70 -7.983 -7.811 10.881 1.00 0.00 C ATOM 0 H LEU A 70 -5.996 -6.280 10.412 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.128 -8.600 9.046 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.409 -5.974 8.006 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.163 -7.556 8.025 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.571 -5.751 10.406 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.023 -6.023 10.767 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.684 -5.367 9.148 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -10.110 -7.084 9.341 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.417 -7.580 11.854 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.512 -8.655 10.438 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -6.931 -8.068 11.005 1.00 0.00 H new ATOM 1095 N HIS A 71 -5.419 -6.336 6.767 1.00 0.00 N ATOM 1096 CA HIS A 71 -4.956 -6.218 5.356 1.00 0.00 C ATOM 1097 C HIS A 71 -3.548 -6.804 5.169 1.00 0.00 C ATOM 1098 O HIS A 71 -3.325 -7.691 4.354 1.00 0.00 O ATOM 1099 CB HIS A 71 -5.026 -4.731 4.941 1.00 0.00 C ATOM 1100 CG HIS A 71 -3.979 -4.394 3.909 1.00 0.00 C ATOM 1101 ND1 HIS A 71 -2.748 -3.866 4.261 1.00 0.00 N ATOM 1102 CD2 HIS A 71 -3.966 -4.496 2.540 1.00 0.00 C ATOM 1103 CE1 HIS A 71 -2.052 -3.670 3.129 1.00 0.00 C ATOM 1104 NE2 HIS A 71 -2.747 -4.038 2.049 1.00 0.00 N ATOM 0 H HIS A 71 -5.696 -5.460 7.209 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.609 -6.802 4.707 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -6.016 -4.510 4.542 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -4.889 -4.100 5.819 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -4.778 -4.874 1.936 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -1.052 -3.264 3.096 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -2.449 -3.993 1.075 1.00 0.00 H new ATOM 1112 N HIS A 72 -2.579 -6.290 5.889 1.00 0.00 N ATOM 1113 CA HIS A 72 -1.201 -6.810 5.697 1.00 0.00 C ATOM 1114 C HIS A 72 -1.187 -8.269 6.132 1.00 0.00 C ATOM 1115 O HIS A 72 -0.304 -9.022 5.781 1.00 0.00 O ATOM 1116 CB HIS A 72 -0.183 -5.977 6.478 1.00 0.00 C ATOM 1117 CG HIS A 72 1.164 -6.644 6.428 1.00 0.00 C ATOM 1118 ND1 HIS A 72 2.207 -6.146 5.664 1.00 0.00 N ATOM 1119 CD2 HIS A 72 1.653 -7.770 7.042 1.00 0.00 C ATOM 1120 CE1 HIS A 72 3.262 -6.964 5.836 1.00 0.00 C ATOM 1121 NE2 HIS A 72 2.978 -7.971 6.666 1.00 0.00 N ATOM 0 H HIS A 72 -2.684 -5.551 6.584 1.00 0.00 H new ATOM 0 HA HIS A 72 -0.914 -6.738 4.648 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -0.119 -4.974 6.056 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -0.507 -5.867 7.513 1.00 0.00 H new ATOM 0 HD2 HIS A 72 1.094 -8.404 7.715 1.00 0.00 H new ATOM 0 HE1 HIS A 72 4.221 -6.823 5.361 1.00 0.00 H new ATOM 0 HE2 HIS A 72 3.598 -8.725 6.961 1.00 0.00 H new ATOM 1129 N GLN A 73 -2.204 -8.693 6.844 1.00 0.00 N ATOM 1130 CA GLN A 73 -2.274 -10.128 7.231 1.00 0.00 C ATOM 1131 C GLN A 73 -2.131 -10.903 5.923 1.00 0.00 C ATOM 1132 O GLN A 73 -1.224 -11.690 5.749 1.00 0.00 O ATOM 1133 CB GLN A 73 -3.622 -10.442 7.908 1.00 0.00 C ATOM 1134 CG GLN A 73 -3.472 -11.644 8.847 1.00 0.00 C ATOM 1135 CD GLN A 73 -4.858 -12.157 9.244 1.00 0.00 C ATOM 1136 OE1 GLN A 73 -5.839 -11.450 9.121 1.00 0.00 O ATOM 1137 NE2 GLN A 73 -4.982 -13.367 9.719 1.00 0.00 N ATOM 0 H GLN A 73 -2.977 -8.112 7.168 1.00 0.00 H new ATOM 0 HA GLN A 73 -1.497 -10.396 7.947 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -3.967 -9.573 8.469 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.377 -10.654 7.151 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -2.907 -12.435 8.355 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.910 -11.357 9.736 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.159 -13.961 9.823 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -5.902 -13.718 9.986 1.00 0.00 H new ATOM 1146 N GLN A 74 -3.019 -10.658 4.985 1.00 0.00 N ATOM 1147 CA GLN A 74 -2.912 -11.354 3.667 1.00 0.00 C ATOM 1148 C GLN A 74 -1.455 -11.227 3.222 1.00 0.00 C ATOM 1149 O GLN A 74 -0.691 -12.170 3.269 1.00 0.00 O ATOM 1150 CB GLN A 74 -3.820 -10.650 2.656 1.00 0.00 C ATOM 1151 CG GLN A 74 -5.283 -10.816 3.074 1.00 0.00 C ATOM 1152 CD GLN A 74 -5.700 -12.281 2.919 1.00 0.00 C ATOM 1153 OE1 GLN A 74 -5.362 -12.921 1.944 1.00 0.00 O ATOM 1154 NE2 GLN A 74 -6.427 -12.841 3.847 1.00 0.00 N ATOM 0 H GLN A 74 -3.804 -10.013 5.076 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.211 -12.400 3.739 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -3.566 -9.592 2.599 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -3.666 -11.068 1.661 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.414 -10.498 4.108 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -5.921 -10.179 2.461 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.711 -12.304 4.666 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.711 -13.816 3.753 1.00 0.00 H new ATOM 1163 N LEU A 75 -1.064 -10.010 2.856 1.00 0.00 N ATOM 1164 CA LEU A 75 0.357 -9.705 2.474 1.00 0.00 C ATOM 1165 C LEU A 75 1.319 -10.562 3.297 1.00 0.00 C ATOM 1166 O LEU A 75 2.046 -11.364 2.747 1.00 0.00 O ATOM 1167 CB LEU A 75 0.611 -8.213 2.781 1.00 0.00 C ATOM 1168 CG LEU A 75 1.736 -7.659 1.893 1.00 0.00 C ATOM 1169 CD1 LEU A 75 2.046 -6.220 2.307 1.00 0.00 C ATOM 1170 CD2 LEU A 75 2.994 -8.516 2.063 1.00 0.00 C ATOM 0 H LEU A 75 -1.690 -9.206 2.808 1.00 0.00 H new ATOM 0 HA LEU A 75 0.519 -9.921 1.418 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.303 -7.642 2.617 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.877 -8.093 3.831 1.00 0.00 H new ATOM 0 HG LEU A 75 1.419 -7.682 0.850 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.844 -5.824 1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.153 -5.607 2.188 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.363 -6.202 3.350 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.791 -8.122 1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.311 -8.493 3.106 1.00 0.00 H new ATOM 0 HD23 LEU A 75 2.776 -9.544 1.772 1.00 0.00 H new ATOM 1182 N ASP A 76 1.318 -10.392 4.600 1.00 0.00 N ATOM 1183 CA ASP A 76 2.212 -11.190 5.507 1.00 0.00 C ATOM 1184 C ASP A 76 2.600 -12.519 4.850 1.00 0.00 C ATOM 1185 O ASP A 76 3.727 -12.746 4.440 1.00 0.00 O ATOM 1186 CB ASP A 76 1.416 -11.494 6.801 1.00 0.00 C ATOM 1187 CG ASP A 76 2.385 -11.796 7.951 1.00 0.00 C ATOM 1188 OD1 ASP A 76 2.838 -10.855 8.580 1.00 0.00 O ATOM 1189 OD2 ASP A 76 2.655 -12.964 8.180 1.00 0.00 O ATOM 0 H ASP A 76 0.723 -9.720 5.084 1.00 0.00 H new ATOM 0 HA ASP A 76 3.120 -10.625 5.716 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.786 -10.643 7.059 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.753 -12.344 6.639 1.00 0.00 H new ATOM 1194 N SER A 77 1.641 -13.393 4.745 1.00 0.00 N ATOM 1195 CA SER A 77 1.882 -14.712 4.129 1.00 0.00 C ATOM 1196 C SER A 77 1.850 -14.602 2.610 1.00 0.00 C ATOM 1197 O SER A 77 2.477 -15.385 1.924 1.00 0.00 O ATOM 1198 CB SER A 77 0.777 -15.662 4.562 1.00 0.00 C ATOM 1199 OG SER A 77 0.903 -15.932 5.952 1.00 0.00 O ATOM 0 H SER A 77 0.686 -13.240 5.068 1.00 0.00 H new ATOM 0 HA SER A 77 2.859 -15.078 4.445 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.198 -15.222 4.353 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.837 -16.590 3.993 1.00 0.00 H new ATOM 0 HG SER A 77 0.190 -16.543 6.232 1.00 0.00 H new ATOM 1205 N LEU A 78 1.114 -13.663 2.058 1.00 0.00 N ATOM 1206 CA LEU A 78 1.063 -13.575 0.577 1.00 0.00 C ATOM 1207 C LEU A 78 2.495 -13.574 0.067 1.00 0.00 C ATOM 1208 O LEU A 78 2.903 -14.447 -0.672 1.00 0.00 O ATOM 1209 CB LEU A 78 0.317 -12.297 0.142 1.00 0.00 C ATOM 1210 CG LEU A 78 -0.558 -12.595 -1.075 1.00 0.00 C ATOM 1211 CD1 LEU A 78 -1.543 -11.441 -1.304 1.00 0.00 C ATOM 1212 CD2 LEU A 78 0.326 -12.762 -2.312 1.00 0.00 C ATOM 0 H LEU A 78 0.560 -12.971 2.563 1.00 0.00 H new ATOM 0 HA LEU A 78 0.520 -14.423 0.158 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.299 -11.928 0.962 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.033 -11.511 -0.098 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.116 -13.514 -0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.164 -11.660 -2.173 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.177 -11.324 -0.425 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.989 -10.518 -1.477 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.299 -12.975 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.887 -11.844 -2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.021 -13.587 -2.154 1.00 0.00 H new ATOM 1224 N ILE A 79 3.288 -12.633 0.514 1.00 0.00 N ATOM 1225 CA ILE A 79 4.711 -12.610 0.126 1.00 0.00 C ATOM 1226 C ILE A 79 5.268 -14.009 0.388 1.00 0.00 C ATOM 1227 O ILE A 79 5.806 -14.647 -0.496 1.00 0.00 O ATOM 1228 CB ILE A 79 5.413 -11.540 1.015 1.00 0.00 C ATOM 1229 CG1 ILE A 79 5.534 -10.200 0.255 1.00 0.00 C ATOM 1230 CG2 ILE A 79 6.808 -11.999 1.463 1.00 0.00 C ATOM 1231 CD1 ILE A 79 6.361 -10.354 -1.032 1.00 0.00 C ATOM 0 H ILE A 79 2.998 -11.878 1.136 1.00 0.00 H new ATOM 0 HA ILE A 79 4.867 -12.355 -0.922 1.00 0.00 H new ATOM 0 HB ILE A 79 4.795 -11.404 1.903 1.00 0.00 H new ATOM 0 HG12 ILE A 79 4.539 -9.830 0.007 1.00 0.00 H new ATOM 0 HG13 ILE A 79 5.999 -9.455 0.901 1.00 0.00 H new ATOM 0 HG21 ILE A 79 7.265 -11.226 2.081 1.00 0.00 H new ATOM 0 HG22 ILE A 79 6.720 -12.920 2.040 1.00 0.00 H new ATOM 0 HG23 ILE A 79 7.431 -12.178 0.587 1.00 0.00 H new ATOM 0 HD11 ILE A 79 6.425 -9.392 -1.541 1.00 0.00 H new ATOM 0 HD12 ILE A 79 7.364 -10.699 -0.781 1.00 0.00 H new ATOM 0 HD13 ILE A 79 5.881 -11.080 -1.688 1.00 0.00 H new ATOM 1243 N SER A 80 5.152 -14.489 1.600 1.00 0.00 N ATOM 1244 CA SER A 80 5.687 -15.842 1.896 1.00 0.00 C ATOM 1245 C SER A 80 5.216 -16.826 0.823 1.00 0.00 C ATOM 1246 O SER A 80 6.003 -17.563 0.252 1.00 0.00 O ATOM 1247 CB SER A 80 5.187 -16.309 3.262 1.00 0.00 C ATOM 1248 OG SER A 80 5.335 -15.254 4.204 1.00 0.00 O ATOM 0 H SER A 80 4.715 -14.006 2.385 1.00 0.00 H new ATOM 0 HA SER A 80 6.776 -15.801 1.903 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.141 -16.609 3.196 1.00 0.00 H new ATOM 0 HB3 SER A 80 5.749 -17.184 3.588 1.00 0.00 H new ATOM 0 HG SER A 80 5.013 -15.551 5.081 1.00 0.00 H new ATOM 1254 N GLU A 81 3.938 -16.869 0.552 1.00 0.00 N ATOM 1255 CA GLU A 81 3.442 -17.836 -0.454 1.00 0.00 C ATOM 1256 C GLU A 81 3.774 -17.388 -1.876 1.00 0.00 C ATOM 1257 O GLU A 81 3.900 -18.210 -2.763 1.00 0.00 O ATOM 1258 CB GLU A 81 1.924 -17.966 -0.319 1.00 0.00 C ATOM 1259 CG GLU A 81 1.575 -18.487 1.076 1.00 0.00 C ATOM 1260 CD GLU A 81 0.055 -18.542 1.234 1.00 0.00 C ATOM 1261 OE1 GLU A 81 -0.538 -17.495 1.437 1.00 0.00 O ATOM 1262 OE2 GLU A 81 -0.492 -19.629 1.148 1.00 0.00 O ATOM 0 H GLU A 81 3.226 -16.279 0.983 1.00 0.00 H new ATOM 0 HA GLU A 81 3.931 -18.793 -0.272 1.00 0.00 H new ATOM 0 HB2 GLU A 81 1.450 -16.999 -0.486 1.00 0.00 H new ATOM 0 HB3 GLU A 81 1.538 -18.646 -1.079 1.00 0.00 H new ATOM 0 HG2 GLU A 81 2.003 -19.479 1.223 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.007 -17.837 1.837 1.00 0.00 H new ATOM 1269 N ALA A 82 3.861 -16.106 -2.149 1.00 0.00 N ATOM 1270 CA ALA A 82 4.114 -15.712 -3.569 1.00 0.00 C ATOM 1271 C ALA A 82 5.571 -15.968 -3.921 1.00 0.00 C ATOM 1272 O ALA A 82 5.886 -16.518 -4.949 1.00 0.00 O ATOM 1273 CB ALA A 82 3.790 -14.231 -3.771 1.00 0.00 C ATOM 0 H ALA A 82 3.772 -15.343 -1.478 1.00 0.00 H new ATOM 0 HA ALA A 82 3.473 -16.307 -4.220 1.00 0.00 H new ATOM 0 HB1 ALA A 82 3.978 -13.956 -4.809 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.742 -14.052 -3.532 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.419 -13.628 -3.116 1.00 0.00 H new ATOM 1279 N GLU A 83 6.470 -15.537 -3.066 1.00 0.00 N ATOM 1280 CA GLU A 83 7.915 -15.723 -3.368 1.00 0.00 C ATOM 1281 C GLU A 83 8.154 -17.200 -3.634 1.00 0.00 C ATOM 1282 O GLU A 83 8.923 -17.574 -4.496 1.00 0.00 O ATOM 1283 CB GLU A 83 8.781 -15.246 -2.200 1.00 0.00 C ATOM 1284 CG GLU A 83 8.739 -13.721 -2.110 1.00 0.00 C ATOM 1285 CD GLU A 83 9.730 -13.250 -1.044 1.00 0.00 C ATOM 1286 OE1 GLU A 83 10.753 -13.897 -0.889 1.00 0.00 O ATOM 1287 OE2 GLU A 83 9.451 -12.252 -0.401 1.00 0.00 O ATOM 0 H GLU A 83 6.263 -15.070 -2.183 1.00 0.00 H new ATOM 0 HA GLU A 83 8.189 -15.132 -4.242 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.423 -15.684 -1.268 1.00 0.00 H new ATOM 0 HB3 GLU A 83 9.809 -15.583 -2.337 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.989 -13.281 -3.075 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.732 -13.388 -1.859 1.00 0.00 H new ATOM 1294 N THR A 84 7.468 -18.045 -2.917 1.00 0.00 N ATOM 1295 CA THR A 84 7.621 -19.500 -3.150 1.00 0.00 C ATOM 1296 C THR A 84 7.312 -19.767 -4.631 1.00 0.00 C ATOM 1297 O THR A 84 8.029 -20.470 -5.315 1.00 0.00 O ATOM 1298 CB THR A 84 6.617 -20.247 -2.235 1.00 0.00 C ATOM 1299 OG1 THR A 84 6.013 -19.309 -1.357 1.00 0.00 O ATOM 1300 CG2 THR A 84 7.333 -21.319 -1.402 1.00 0.00 C ATOM 0 H THR A 84 6.810 -17.788 -2.182 1.00 0.00 H new ATOM 0 HA THR A 84 8.629 -19.846 -2.921 1.00 0.00 H new ATOM 0 HB THR A 84 5.865 -20.732 -2.858 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.685 -18.967 -0.731 1.00 0.00 H new ATOM 0 HG21 THR A 84 6.609 -21.830 -0.767 1.00 0.00 H new ATOM 0 HG22 THR A 84 7.806 -22.041 -2.067 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.093 -20.848 -0.779 1.00 0.00 H new ATOM 1308 N ARG A 85 6.224 -19.214 -5.109 1.00 0.00 N ATOM 1309 CA ARG A 85 5.805 -19.417 -6.528 1.00 0.00 C ATOM 1310 C ARG A 85 7.018 -19.411 -7.469 1.00 0.00 C ATOM 1311 O ARG A 85 7.025 -20.089 -8.477 1.00 0.00 O ATOM 1312 CB ARG A 85 4.795 -18.306 -6.912 1.00 0.00 C ATOM 1313 CG ARG A 85 5.488 -17.105 -7.597 1.00 0.00 C ATOM 1314 CD ARG A 85 5.728 -17.382 -9.097 1.00 0.00 C ATOM 1315 NE ARG A 85 4.824 -16.519 -9.908 1.00 0.00 N ATOM 1316 CZ ARG A 85 5.053 -16.349 -11.181 1.00 0.00 C ATOM 1317 NH1 ARG A 85 6.079 -16.929 -11.742 1.00 0.00 N ATOM 1318 NH2 ARG A 85 4.258 -15.600 -11.894 1.00 0.00 N ATOM 0 H ARG A 85 5.599 -18.620 -4.564 1.00 0.00 H new ATOM 0 HA ARG A 85 5.328 -20.392 -6.630 1.00 0.00 H new ATOM 0 HB2 ARG A 85 4.039 -18.718 -7.581 1.00 0.00 H new ATOM 0 HB3 ARG A 85 4.276 -17.963 -6.017 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.872 -16.213 -7.483 1.00 0.00 H new ATOM 0 HG3 ARG A 85 6.439 -16.901 -7.105 1.00 0.00 H new ATOM 0 HD2 ARG A 85 6.768 -17.181 -9.354 1.00 0.00 H new ATOM 0 HD3 ARG A 85 5.542 -18.433 -9.319 1.00 0.00 H new ATOM 0 HE ARG A 85 4.026 -16.061 -9.468 1.00 0.00 H new ATOM 0 HH11 ARG A 85 6.701 -17.515 -11.185 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.259 -16.796 -12.737 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.456 -15.146 -11.456 1.00 0.00 H new ATOM 0 HH22 ARG A 85 4.438 -15.468 -12.889 1.00 0.00 H new ATOM 1332 N GLY A 86 8.045 -18.661 -7.150 1.00 0.00 N ATOM 1333 CA GLY A 86 9.263 -18.623 -8.029 1.00 0.00 C ATOM 1334 C GLY A 86 9.318 -17.308 -8.825 1.00 0.00 C ATOM 1335 O GLY A 86 9.361 -17.314 -10.039 1.00 0.00 O ATOM 0 H GLY A 86 8.095 -18.072 -6.319 1.00 0.00 H new ATOM 0 HA2 GLY A 86 10.161 -18.723 -7.419 1.00 0.00 H new ATOM 0 HA3 GLY A 86 9.249 -19.469 -8.716 1.00 0.00 H new ATOM 1339 N ILE A 87 9.332 -16.184 -8.156 1.00 0.00 N ATOM 1340 CA ILE A 87 9.404 -14.877 -8.882 1.00 0.00 C ATOM 1341 C ILE A 87 10.788 -14.733 -9.541 1.00 0.00 C ATOM 1342 O ILE A 87 11.282 -15.636 -10.187 1.00 0.00 O ATOM 1343 CB ILE A 87 9.197 -13.725 -7.877 1.00 0.00 C ATOM 1344 CG1 ILE A 87 7.912 -13.972 -7.064 1.00 0.00 C ATOM 1345 CG2 ILE A 87 9.120 -12.349 -8.598 1.00 0.00 C ATOM 1346 CD1 ILE A 87 6.681 -14.023 -7.982 1.00 0.00 C ATOM 0 H ILE A 87 9.297 -16.113 -7.139 1.00 0.00 H new ATOM 0 HA ILE A 87 8.629 -14.841 -9.648 1.00 0.00 H new ATOM 0 HB ILE A 87 10.055 -13.699 -7.205 1.00 0.00 H new ATOM 0 HG12 ILE A 87 8.000 -14.909 -6.515 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.787 -13.180 -6.325 1.00 0.00 H new ATOM 0 HG21 ILE A 87 8.974 -11.560 -7.861 1.00 0.00 H new ATOM 0 HG22 ILE A 87 10.048 -12.171 -9.142 1.00 0.00 H new ATOM 0 HG23 ILE A 87 8.284 -12.351 -9.298 1.00 0.00 H new ATOM 0 HD11 ILE A 87 5.787 -14.198 -7.383 1.00 0.00 H new ATOM 0 HD12 ILE A 87 6.583 -13.075 -8.512 1.00 0.00 H new ATOM 0 HD13 ILE A 87 6.799 -14.831 -8.704 1.00 0.00 H new ATOM 1358 N THR A 88 11.407 -13.596 -9.370 1.00 0.00 N ATOM 1359 CA THR A 88 12.750 -13.366 -9.965 1.00 0.00 C ATOM 1360 C THR A 88 13.788 -14.049 -9.083 1.00 0.00 C ATOM 1361 O THR A 88 14.759 -13.450 -8.667 1.00 0.00 O ATOM 1362 CB THR A 88 13.036 -11.862 -10.025 1.00 0.00 C ATOM 1363 OG1 THR A 88 12.624 -11.255 -8.809 1.00 0.00 O ATOM 1364 CG2 THR A 88 12.271 -11.237 -11.194 1.00 0.00 C ATOM 0 H THR A 88 11.034 -12.810 -8.838 1.00 0.00 H new ATOM 0 HA THR A 88 12.788 -13.773 -10.975 1.00 0.00 H new ATOM 0 HB THR A 88 14.105 -11.702 -10.169 1.00 0.00 H new ATOM 0 HG1 THR A 88 12.808 -10.293 -8.845 1.00 0.00 H new ATOM 0 HG21 THR A 88 12.477 -10.167 -11.233 1.00 0.00 H new ATOM 0 HG22 THR A 88 12.589 -11.702 -12.127 1.00 0.00 H new ATOM 0 HG23 THR A 88 11.202 -11.396 -11.055 1.00 0.00 H new ATOM 1372 N SER A 89 13.580 -15.299 -8.782 1.00 0.00 N ATOM 1373 CA SER A 89 14.545 -16.021 -7.911 1.00 0.00 C ATOM 1374 C SER A 89 14.811 -15.177 -6.662 1.00 0.00 C ATOM 1375 O SER A 89 15.721 -15.451 -5.918 1.00 0.00 O ATOM 1376 CB SER A 89 15.852 -16.262 -8.667 1.00 0.00 C ATOM 1377 OG SER A 89 16.675 -17.145 -7.916 1.00 0.00 O ATOM 0 H SER A 89 12.784 -15.851 -9.101 1.00 0.00 H new ATOM 0 HA SER A 89 14.129 -16.986 -7.621 1.00 0.00 H new ATOM 0 HB2 SER A 89 15.644 -16.687 -9.649 1.00 0.00 H new ATOM 0 HB3 SER A 89 16.369 -15.317 -8.832 1.00 0.00 H new ATOM 0 HG SER A 89 16.663 -16.880 -6.973 1.00 0.00 H new ATOM 1383 N TYR A 90 13.956 -14.205 -6.418 1.00 0.00 N ATOM 1384 CA TYR A 90 14.020 -13.316 -5.199 1.00 0.00 C ATOM 1385 C TYR A 90 15.428 -13.068 -4.619 1.00 0.00 C ATOM 1386 O TYR A 90 16.297 -13.909 -4.606 1.00 0.00 O ATOM 1387 CB TYR A 90 13.166 -13.968 -4.102 1.00 0.00 C ATOM 1388 CG TYR A 90 13.432 -15.454 -4.084 1.00 0.00 C ATOM 1389 CD1 TYR A 90 14.470 -15.969 -3.298 1.00 0.00 C ATOM 1390 CD2 TYR A 90 12.643 -16.317 -4.854 1.00 0.00 C ATOM 1391 CE1 TYR A 90 14.719 -17.346 -3.281 1.00 0.00 C ATOM 1392 CE2 TYR A 90 12.893 -17.695 -4.838 1.00 0.00 C ATOM 1393 CZ TYR A 90 13.930 -18.209 -4.051 1.00 0.00 C ATOM 1394 OH TYR A 90 14.176 -19.567 -4.035 1.00 0.00 O ATOM 0 H TYR A 90 13.181 -13.981 -7.042 1.00 0.00 H new ATOM 0 HA TYR A 90 13.660 -12.339 -5.523 1.00 0.00 H new ATOM 0 HB2 TYR A 90 13.404 -13.532 -3.132 1.00 0.00 H new ATOM 0 HB3 TYR A 90 12.109 -13.778 -4.286 1.00 0.00 H new ATOM 0 HD1 TYR A 90 15.079 -15.303 -2.704 1.00 0.00 H new ATOM 0 HD2 TYR A 90 11.842 -15.920 -5.460 1.00 0.00 H new ATOM 0 HE1 TYR A 90 15.519 -17.743 -2.674 1.00 0.00 H new ATOM 0 HE2 TYR A 90 12.286 -18.361 -5.433 1.00 0.00 H new ATOM 0 HH TYR A 90 13.538 -20.022 -4.623 1.00 0.00 H new ATOM 1404 N ASN A 91 15.596 -11.927 -4.003 1.00 0.00 N ATOM 1405 CA ASN A 91 16.870 -11.655 -3.288 1.00 0.00 C ATOM 1406 C ASN A 91 16.833 -10.246 -2.645 1.00 0.00 C ATOM 1407 O ASN A 91 17.255 -10.103 -1.523 1.00 0.00 O ATOM 1408 CB ASN A 91 18.096 -11.906 -4.201 1.00 0.00 C ATOM 1409 CG ASN A 91 19.071 -10.721 -4.174 1.00 0.00 C ATOM 1410 OD1 ASN A 91 19.738 -10.490 -3.186 1.00 0.00 O ATOM 1411 ND2 ASN A 91 19.180 -9.959 -5.228 1.00 0.00 N ATOM 0 H ASN A 91 14.906 -11.176 -3.966 1.00 0.00 H new ATOM 0 HA ASN A 91 16.983 -12.362 -2.466 1.00 0.00 H new ATOM 0 HB2 ASN A 91 18.612 -12.810 -3.878 1.00 0.00 H new ATOM 0 HB3 ASN A 91 17.760 -12.079 -5.223 1.00 0.00 H new ATOM 0 HD21 ASN A 91 19.826 -9.169 -5.222 1.00 0.00 H new ATOM 0 HD22 ASN A 91 18.620 -10.153 -6.058 1.00 0.00 H new ATOM 1418 N PRO A 92 16.318 -9.241 -3.322 1.00 0.00 N ATOM 1419 CA PRO A 92 16.235 -7.904 -2.706 1.00 0.00 C ATOM 1420 C PRO A 92 15.244 -7.956 -1.539 1.00 0.00 C ATOM 1421 O PRO A 92 15.447 -7.339 -0.512 1.00 0.00 O ATOM 1422 CB PRO A 92 15.753 -6.968 -3.837 1.00 0.00 C ATOM 1423 CG PRO A 92 15.633 -7.836 -5.126 1.00 0.00 C ATOM 1424 CD PRO A 92 15.820 -9.316 -4.710 1.00 0.00 C ATOM 0 HA PRO A 92 17.183 -7.552 -2.299 1.00 0.00 H new ATOM 0 HB2 PRO A 92 14.793 -6.519 -3.583 1.00 0.00 H new ATOM 0 HB3 PRO A 92 16.457 -6.150 -3.987 1.00 0.00 H new ATOM 0 HG2 PRO A 92 14.661 -7.690 -5.597 1.00 0.00 H new ATOM 0 HG3 PRO A 92 16.388 -7.545 -5.856 1.00 0.00 H new ATOM 0 HD2 PRO A 92 14.882 -9.868 -4.767 1.00 0.00 H new ATOM 0 HD3 PRO A 92 16.530 -9.826 -5.361 1.00 0.00 H new ATOM 1432 N LEU A 93 14.197 -8.728 -1.671 1.00 0.00 N ATOM 1433 CA LEU A 93 13.235 -8.856 -0.543 1.00 0.00 C ATOM 1434 C LEU A 93 14.039 -9.301 0.663 1.00 0.00 C ATOM 1435 O LEU A 93 14.019 -8.655 1.679 1.00 0.00 O ATOM 1436 CB LEU A 93 12.152 -9.891 -0.891 1.00 0.00 C ATOM 1437 CG LEU A 93 11.783 -9.761 -2.392 1.00 0.00 C ATOM 1438 CD1 LEU A 93 12.565 -10.793 -3.220 1.00 0.00 C ATOM 1439 CD2 LEU A 93 10.274 -9.982 -2.591 1.00 0.00 C ATOM 0 H LEU A 93 13.970 -9.270 -2.505 1.00 0.00 H new ATOM 0 HA LEU A 93 12.728 -7.912 -0.341 1.00 0.00 H new ATOM 0 HB2 LEU A 93 12.513 -10.897 -0.679 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.269 -9.732 -0.272 1.00 0.00 H new ATOM 0 HG LEU A 93 12.045 -8.757 -2.726 1.00 0.00 H new ATOM 0 HD11 LEU A 93 12.298 -10.693 -4.272 1.00 0.00 H new ATOM 0 HD12 LEU A 93 13.635 -10.622 -3.099 1.00 0.00 H new ATOM 0 HD13 LEU A 93 12.317 -11.798 -2.877 1.00 0.00 H new ATOM 0 HD21 LEU A 93 10.029 -9.888 -3.649 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.003 -10.979 -2.243 1.00 0.00 H new ATOM 0 HD23 LEU A 93 9.719 -9.236 -2.022 1.00 0.00 H new ATOM 1451 N ALA A 94 14.739 -10.409 0.501 1.00 0.00 N ATOM 1452 CA ALA A 94 15.623 -11.004 1.570 1.00 0.00 C ATOM 1453 C ALA A 94 15.735 -10.066 2.771 1.00 0.00 C ATOM 1454 O ALA A 94 15.434 -10.416 3.895 1.00 0.00 O ATOM 1455 CB ALA A 94 17.009 -11.186 0.963 1.00 0.00 C ATOM 0 H ALA A 94 14.732 -10.947 -0.366 1.00 0.00 H new ATOM 0 HA ALA A 94 15.201 -11.949 1.911 1.00 0.00 H new ATOM 0 HB1 ALA A 94 17.679 -11.615 1.708 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.945 -11.854 0.104 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.396 -10.219 0.642 1.00 0.00 H new ATOM 1461 N GLY A 95 16.116 -8.847 2.501 1.00 0.00 N ATOM 1462 CA GLY A 95 16.203 -7.816 3.573 1.00 0.00 C ATOM 1463 C GLY A 95 14.772 -7.552 4.074 1.00 0.00 C ATOM 1464 O GLY A 95 13.927 -8.414 3.943 1.00 0.00 O ATOM 0 H GLY A 95 16.374 -8.518 1.571 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.837 -8.163 4.389 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.650 -6.899 3.189 1.00 0.00 H new ATOM 1468 N PRO A 96 14.508 -6.393 4.636 1.00 0.00 N ATOM 1469 CA PRO A 96 13.143 -6.101 5.116 1.00 0.00 C ATOM 1470 C PRO A 96 12.233 -5.942 3.879 1.00 0.00 C ATOM 1471 O PRO A 96 12.728 -5.927 2.769 1.00 0.00 O ATOM 1472 CB PRO A 96 13.286 -4.791 5.918 1.00 0.00 C ATOM 1473 CG PRO A 96 14.758 -4.296 5.739 1.00 0.00 C ATOM 1474 CD PRO A 96 15.502 -5.338 4.868 1.00 0.00 C ATOM 0 HA PRO A 96 12.702 -6.878 5.741 1.00 0.00 H new ATOM 0 HB2 PRO A 96 12.582 -4.041 5.558 1.00 0.00 H new ATOM 0 HB3 PRO A 96 13.062 -4.959 6.972 1.00 0.00 H new ATOM 0 HG2 PRO A 96 14.777 -3.316 5.262 1.00 0.00 H new ATOM 0 HG3 PRO A 96 15.246 -4.189 6.708 1.00 0.00 H new ATOM 0 HD2 PRO A 96 15.844 -4.901 3.930 1.00 0.00 H new ATOM 0 HD3 PRO A 96 16.383 -5.727 5.379 1.00 0.00 H new ATOM 1482 N LEU A 97 10.933 -5.814 4.010 1.00 0.00 N ATOM 1483 CA LEU A 97 10.100 -5.653 2.772 1.00 0.00 C ATOM 1484 C LEU A 97 10.239 -4.207 2.277 1.00 0.00 C ATOM 1485 O LEU A 97 10.617 -3.970 1.143 1.00 0.00 O ATOM 1486 CB LEU A 97 8.625 -5.960 3.068 1.00 0.00 C ATOM 1487 CG LEU A 97 8.447 -7.406 3.579 1.00 0.00 C ATOM 1488 CD1 LEU A 97 9.077 -8.403 2.593 1.00 0.00 C ATOM 1489 CD2 LEU A 97 9.086 -7.573 4.975 1.00 0.00 C ATOM 0 H LEU A 97 10.423 -5.813 4.893 1.00 0.00 H new ATOM 0 HA LEU A 97 10.446 -6.350 2.009 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.247 -5.259 3.813 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.032 -5.815 2.165 1.00 0.00 H new ATOM 0 HG LEU A 97 7.379 -7.611 3.657 1.00 0.00 H new ATOM 0 HD11 LEU A 97 8.944 -9.418 2.967 1.00 0.00 H new ATOM 0 HD12 LEU A 97 8.594 -8.308 1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.141 -8.191 2.491 1.00 0.00 H new ATOM 0 HD21 LEU A 97 8.950 -8.599 5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.151 -7.348 4.917 1.00 0.00 H new ATOM 0 HD23 LEU A 97 8.609 -6.890 5.678 1.00 0.00 H new ATOM 1501 N ARG A 98 9.901 -3.243 3.105 1.00 0.00 N ATOM 1502 CA ARG A 98 9.999 -1.798 2.699 1.00 0.00 C ATOM 1503 C ARG A 98 11.264 -1.595 1.838 1.00 0.00 C ATOM 1504 O ARG A 98 11.354 -0.704 1.023 1.00 0.00 O ATOM 1505 CB ARG A 98 10.096 -0.950 3.995 1.00 0.00 C ATOM 1506 CG ARG A 98 10.956 0.302 3.771 1.00 0.00 C ATOM 1507 CD ARG A 98 10.719 1.315 4.890 1.00 0.00 C ATOM 1508 NE ARG A 98 11.681 2.442 4.734 1.00 0.00 N ATOM 1509 CZ ARG A 98 11.482 3.567 5.361 1.00 0.00 C ATOM 1510 NH1 ARG A 98 10.443 3.707 6.138 1.00 0.00 N ATOM 1511 NH2 ARG A 98 12.324 4.552 5.208 1.00 0.00 N ATOM 0 H ARG A 98 9.558 -3.396 4.053 1.00 0.00 H new ATOM 0 HA ARG A 98 9.129 -1.497 2.116 1.00 0.00 H new ATOM 0 HB2 ARG A 98 9.097 -0.656 4.317 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.525 -1.552 4.796 1.00 0.00 H new ATOM 0 HG2 ARG A 98 12.010 0.026 3.738 1.00 0.00 H new ATOM 0 HG3 ARG A 98 10.713 0.751 2.808 1.00 0.00 H new ATOM 0 HD2 ARG A 98 9.695 1.686 4.852 1.00 0.00 H new ATOM 0 HD3 ARG A 98 10.850 0.840 5.862 1.00 0.00 H new ATOM 0 HE ARG A 98 12.499 2.333 4.134 1.00 0.00 H new ATOM 0 HH11 ARG A 98 9.786 2.936 6.255 1.00 0.00 H new ATOM 0 HH12 ARG A 98 10.288 4.588 6.628 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.135 4.440 4.599 1.00 0.00 H new ATOM 0 HH22 ARG A 98 12.171 5.434 5.697 1.00 0.00 H new ATOM 1525 N VAL A 99 12.216 -2.461 2.035 1.00 0.00 N ATOM 1526 CA VAL A 99 13.489 -2.401 1.264 1.00 0.00 C ATOM 1527 C VAL A 99 13.250 -3.006 -0.125 1.00 0.00 C ATOM 1528 O VAL A 99 13.712 -2.490 -1.123 1.00 0.00 O ATOM 1529 CB VAL A 99 14.589 -3.171 2.043 1.00 0.00 C ATOM 1530 CG1 VAL A 99 15.560 -3.880 1.081 1.00 0.00 C ATOM 1531 CG2 VAL A 99 15.384 -2.175 2.906 1.00 0.00 C ATOM 0 H VAL A 99 12.165 -3.223 2.711 1.00 0.00 H new ATOM 0 HA VAL A 99 13.823 -1.371 1.138 1.00 0.00 H new ATOM 0 HB VAL A 99 14.106 -3.923 2.666 1.00 0.00 H new ATOM 0 HG11 VAL A 99 16.319 -4.411 1.656 1.00 0.00 H new ATOM 0 HG12 VAL A 99 15.008 -4.591 0.465 1.00 0.00 H new ATOM 0 HG13 VAL A 99 16.041 -3.141 0.440 1.00 0.00 H new ATOM 0 HG21 VAL A 99 16.159 -2.708 3.457 1.00 0.00 H new ATOM 0 HG22 VAL A 99 15.846 -1.425 2.264 1.00 0.00 H new ATOM 0 HG23 VAL A 99 14.711 -1.685 3.610 1.00 0.00 H new ATOM 1541 N GLN A 100 12.538 -4.093 -0.193 1.00 0.00 N ATOM 1542 CA GLN A 100 12.273 -4.731 -1.510 1.00 0.00 C ATOM 1543 C GLN A 100 11.854 -3.668 -2.535 1.00 0.00 C ATOM 1544 O GLN A 100 12.388 -3.610 -3.625 1.00 0.00 O ATOM 1545 CB GLN A 100 11.180 -5.819 -1.348 1.00 0.00 C ATOM 1546 CG GLN A 100 9.763 -5.261 -1.567 1.00 0.00 C ATOM 1547 CD GLN A 100 8.739 -6.347 -1.231 1.00 0.00 C ATOM 1548 OE1 GLN A 100 8.279 -6.439 -0.110 1.00 0.00 O ATOM 1549 NE2 GLN A 100 8.359 -7.179 -2.162 1.00 0.00 N ATOM 0 H GLN A 100 12.126 -4.569 0.610 1.00 0.00 H new ATOM 0 HA GLN A 100 13.182 -5.208 -1.876 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.365 -6.625 -2.059 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.247 -6.252 -0.350 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.602 -4.385 -0.938 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.642 -4.937 -2.601 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.745 -7.102 -3.103 1.00 0.00 H new ATOM 0 HE22 GLN A 100 7.676 -7.906 -1.949 1.00 0.00 H new ATOM 1558 N ALA A 101 10.879 -2.850 -2.215 1.00 0.00 N ATOM 1559 CA ALA A 101 10.409 -1.824 -3.208 1.00 0.00 C ATOM 1560 C ALA A 101 11.140 -0.488 -3.021 1.00 0.00 C ATOM 1561 O ALA A 101 11.381 0.218 -3.979 1.00 0.00 O ATOM 1562 CB ALA A 101 8.903 -1.618 -3.054 1.00 0.00 C ATOM 0 H ALA A 101 10.391 -2.845 -1.319 1.00 0.00 H new ATOM 0 HA ALA A 101 10.632 -2.190 -4.210 1.00 0.00 H new ATOM 0 HB1 ALA A 101 8.562 -0.874 -3.774 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.386 -2.561 -3.234 1.00 0.00 H new ATOM 0 HB3 ALA A 101 8.685 -1.272 -2.044 1.00 0.00 H new ATOM 1568 N ASN A 102 11.511 -0.125 -1.826 1.00 0.00 N ATOM 1569 CA ASN A 102 12.236 1.170 -1.655 1.00 0.00 C ATOM 1570 C ASN A 102 13.631 1.032 -2.268 1.00 0.00 C ATOM 1571 O ASN A 102 14.608 1.513 -1.728 1.00 0.00 O ATOM 1572 CB ASN A 102 12.369 1.512 -0.169 1.00 0.00 C ATOM 1573 CG ASN A 102 12.998 2.899 -0.020 1.00 0.00 C ATOM 1574 OD1 ASN A 102 14.182 3.018 0.223 1.00 0.00 O ATOM 1575 ND2 ASN A 102 12.250 3.959 -0.156 1.00 0.00 N ATOM 0 H ASN A 102 11.349 -0.657 -0.971 1.00 0.00 H new ATOM 0 HA ASN A 102 11.679 1.966 -2.149 1.00 0.00 H new ATOM 0 HB2 ASN A 102 11.390 1.492 0.309 1.00 0.00 H new ATOM 0 HB3 ASN A 102 12.984 0.766 0.333 1.00 0.00 H new ATOM 0 HD21 ASN A 102 12.659 4.888 -0.058 1.00 0.00 H new ATOM 0 HD22 ASN A 102 11.256 3.859 -0.360 1.00 0.00 H new ATOM 1582 N ASN A 103 13.728 0.363 -3.393 1.00 0.00 N ATOM 1583 CA ASN A 103 15.050 0.162 -4.065 1.00 0.00 C ATOM 1584 C ASN A 103 14.947 0.621 -5.532 1.00 0.00 C ATOM 1585 O ASN A 103 14.645 -0.184 -6.391 1.00 0.00 O ATOM 1586 CB ASN A 103 15.385 -1.332 -4.039 1.00 0.00 C ATOM 1587 CG ASN A 103 15.798 -1.739 -2.623 1.00 0.00 C ATOM 1588 OD1 ASN A 103 15.538 -1.027 -1.673 1.00 0.00 O ATOM 1589 ND2 ASN A 103 16.435 -2.863 -2.440 1.00 0.00 N ATOM 0 H ASN A 103 12.936 -0.057 -3.879 1.00 0.00 H new ATOM 0 HA ASN A 103 15.822 0.735 -3.552 1.00 0.00 H new ATOM 0 HB2 ASN A 103 14.521 -1.915 -4.359 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.191 -1.547 -4.740 1.00 0.00 H new ATOM 0 HD21 ASN A 103 16.714 -3.144 -1.500 1.00 0.00 H new ATOM 0 HD22 ASN A 103 16.653 -3.461 -3.237 1.00 0.00 H new ATOM 1596 N PRO A 104 15.183 1.894 -5.797 1.00 0.00 N ATOM 1597 CA PRO A 104 15.090 2.418 -7.175 1.00 0.00 C ATOM 1598 C PRO A 104 16.009 1.623 -8.116 1.00 0.00 C ATOM 1599 O PRO A 104 15.707 1.445 -9.279 1.00 0.00 O ATOM 1600 CB PRO A 104 15.515 3.901 -7.067 1.00 0.00 C ATOM 1601 CG PRO A 104 15.627 4.237 -5.553 1.00 0.00 C ATOM 1602 CD PRO A 104 15.556 2.903 -4.779 1.00 0.00 C ATOM 0 HA PRO A 104 14.088 2.325 -7.593 1.00 0.00 H new ATOM 0 HB2 PRO A 104 16.468 4.066 -7.569 1.00 0.00 H new ATOM 0 HB3 PRO A 104 14.783 4.547 -7.552 1.00 0.00 H new ATOM 0 HG2 PRO A 104 16.563 4.754 -5.343 1.00 0.00 H new ATOM 0 HG3 PRO A 104 14.820 4.902 -5.246 1.00 0.00 H new ATOM 0 HD2 PRO A 104 16.513 2.663 -4.316 1.00 0.00 H new ATOM 0 HD3 PRO A 104 14.818 2.949 -3.979 1.00 0.00 H new ATOM 1610 N GLN A 105 17.117 1.135 -7.629 1.00 0.00 N ATOM 1611 CA GLN A 105 18.023 0.350 -8.514 1.00 0.00 C ATOM 1612 C GLN A 105 17.319 -0.952 -8.907 1.00 0.00 C ATOM 1613 O GLN A 105 17.749 -1.666 -9.791 1.00 0.00 O ATOM 1614 CB GLN A 105 19.325 0.036 -7.775 1.00 0.00 C ATOM 1615 CG GLN A 105 19.984 1.342 -7.326 1.00 0.00 C ATOM 1616 CD GLN A 105 21.270 1.029 -6.559 1.00 0.00 C ATOM 1617 OE1 GLN A 105 22.291 1.649 -6.783 1.00 0.00 O ATOM 1618 NE2 GLN A 105 21.264 0.088 -5.655 1.00 0.00 N ATOM 0 H GLN A 105 17.432 1.244 -6.665 1.00 0.00 H new ATOM 0 HA GLN A 105 18.259 0.926 -9.409 1.00 0.00 H new ATOM 0 HB2 GLN A 105 19.122 -0.597 -6.911 1.00 0.00 H new ATOM 0 HB3 GLN A 105 20.000 -0.520 -8.426 1.00 0.00 H new ATOM 0 HG2 GLN A 105 20.207 1.965 -8.192 1.00 0.00 H new ATOM 0 HG3 GLN A 105 19.300 1.908 -6.694 1.00 0.00 H new ATOM 0 HE21 GLN A 105 20.407 -0.433 -5.467 1.00 0.00 H new ATOM 0 HE22 GLN A 105 22.116 -0.127 -5.137 1.00 0.00 H new ATOM 1627 N GLN A 106 16.228 -1.253 -8.254 1.00 0.00 N ATOM 1628 CA GLN A 106 15.459 -2.494 -8.571 1.00 0.00 C ATOM 1629 C GLN A 106 13.978 -2.217 -8.312 1.00 0.00 C ATOM 1630 O GLN A 106 13.429 -2.613 -7.303 1.00 0.00 O ATOM 1631 CB GLN A 106 15.933 -3.637 -7.669 1.00 0.00 C ATOM 1632 CG GLN A 106 17.456 -3.758 -7.750 1.00 0.00 C ATOM 1633 CD GLN A 106 17.906 -5.035 -7.037 1.00 0.00 C ATOM 1634 OE1 GLN A 106 17.754 -5.161 -5.838 1.00 0.00 O ATOM 1635 NE2 GLN A 106 18.458 -5.994 -7.729 1.00 0.00 N ATOM 0 H GLN A 106 15.832 -0.685 -7.505 1.00 0.00 H new ATOM 0 HA GLN A 106 15.614 -2.779 -9.612 1.00 0.00 H new ATOM 0 HB2 GLN A 106 15.627 -3.452 -6.639 1.00 0.00 H new ATOM 0 HB3 GLN A 106 15.467 -4.573 -7.976 1.00 0.00 H new ATOM 0 HG2 GLN A 106 17.775 -3.779 -8.792 1.00 0.00 H new ATOM 0 HG3 GLN A 106 17.925 -2.888 -7.291 1.00 0.00 H new ATOM 0 HE21 GLN A 106 18.586 -5.888 -8.735 1.00 0.00 H new ATOM 0 HE22 GLN A 106 18.762 -6.849 -7.263 1.00 0.00 H new ATOM 1644 N GLN A 107 13.334 -1.512 -9.204 1.00 0.00 N ATOM 1645 CA GLN A 107 11.894 -1.176 -9.003 1.00 0.00 C ATOM 1646 C GLN A 107 10.992 -2.296 -9.539 1.00 0.00 C ATOM 1647 O GLN A 107 9.791 -2.237 -9.402 1.00 0.00 O ATOM 1648 CB GLN A 107 11.572 0.128 -9.737 1.00 0.00 C ATOM 1649 CG GLN A 107 11.909 -0.019 -11.222 1.00 0.00 C ATOM 1650 CD GLN A 107 11.700 1.322 -11.928 1.00 0.00 C ATOM 1651 OE1 GLN A 107 12.144 2.348 -11.452 1.00 0.00 O ATOM 1652 NE2 GLN A 107 11.038 1.358 -13.052 1.00 0.00 N ATOM 0 H GLN A 107 13.745 -1.153 -10.066 1.00 0.00 H new ATOM 0 HA GLN A 107 11.709 -1.062 -7.935 1.00 0.00 H new ATOM 0 HB2 GLN A 107 10.517 0.373 -9.616 1.00 0.00 H new ATOM 0 HB3 GLN A 107 12.142 0.950 -9.305 1.00 0.00 H new ATOM 0 HG2 GLN A 107 12.942 -0.347 -11.341 1.00 0.00 H new ATOM 0 HG3 GLN A 107 11.277 -0.783 -11.675 1.00 0.00 H new ATOM 0 HE21 GLN A 107 10.665 0.497 -13.452 1.00 0.00 H new ATOM 0 HE22 GLN A 107 10.894 2.247 -13.531 1.00 0.00 H new ATOM 1661 N GLY A 108 11.544 -3.315 -10.148 1.00 0.00 N ATOM 1662 CA GLY A 108 10.681 -4.425 -10.675 1.00 0.00 C ATOM 1663 C GLY A 108 9.646 -4.800 -9.614 1.00 0.00 C ATOM 1664 O GLY A 108 8.455 -4.637 -9.785 1.00 0.00 O ATOM 0 H GLY A 108 12.545 -3.430 -10.304 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.183 -4.111 -11.592 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.294 -5.291 -10.926 1.00 0.00 H new ATOM 1668 N LEU A 109 10.120 -5.271 -8.507 1.00 0.00 N ATOM 1669 CA LEU A 109 9.206 -5.628 -7.392 1.00 0.00 C ATOM 1670 C LEU A 109 8.223 -4.474 -7.153 1.00 0.00 C ATOM 1671 O LEU A 109 7.036 -4.694 -7.060 1.00 0.00 O ATOM 1672 CB LEU A 109 10.019 -5.896 -6.122 1.00 0.00 C ATOM 1673 CG LEU A 109 11.129 -6.924 -6.407 1.00 0.00 C ATOM 1674 CD1 LEU A 109 11.687 -7.435 -5.081 1.00 0.00 C ATOM 1675 CD2 LEU A 109 10.573 -8.117 -7.205 1.00 0.00 C ATOM 0 H LEU A 109 11.111 -5.427 -8.320 1.00 0.00 H new ATOM 0 HA LEU A 109 8.649 -6.529 -7.650 1.00 0.00 H new ATOM 0 HB2 LEU A 109 10.459 -4.966 -5.760 1.00 0.00 H new ATOM 0 HB3 LEU A 109 9.364 -6.267 -5.334 1.00 0.00 H new ATOM 0 HG LEU A 109 11.912 -6.441 -6.992 1.00 0.00 H new ATOM 0 HD11 LEU A 109 12.474 -8.164 -5.274 1.00 0.00 H new ATOM 0 HD12 LEU A 109 12.097 -6.600 -4.513 1.00 0.00 H new ATOM 0 HD13 LEU A 109 10.889 -7.906 -4.508 1.00 0.00 H new ATOM 0 HD21 LEU A 109 11.373 -8.832 -7.396 1.00 0.00 H new ATOM 0 HD22 LEU A 109 9.783 -8.602 -6.632 1.00 0.00 H new ATOM 0 HD23 LEU A 109 10.168 -7.763 -8.153 1.00 0.00 H new ATOM 1687 N ARG A 110 8.690 -3.261 -7.010 1.00 0.00 N ATOM 1688 CA ARG A 110 7.739 -2.128 -6.731 1.00 0.00 C ATOM 1689 C ARG A 110 6.486 -2.240 -7.618 1.00 0.00 C ATOM 1690 O ARG A 110 5.393 -1.936 -7.180 1.00 0.00 O ATOM 1691 CB ARG A 110 8.446 -0.767 -6.942 1.00 0.00 C ATOM 1692 CG ARG A 110 7.459 0.424 -6.861 1.00 0.00 C ATOM 1693 CD ARG A 110 7.005 0.668 -5.415 1.00 0.00 C ATOM 1694 NE ARG A 110 5.901 1.668 -5.407 1.00 0.00 N ATOM 1695 CZ ARG A 110 5.156 1.809 -4.345 1.00 0.00 C ATOM 1696 NH1 ARG A 110 5.388 1.085 -3.284 1.00 0.00 N ATOM 1697 NH2 ARG A 110 4.178 2.673 -4.344 1.00 0.00 N ATOM 0 H ARG A 110 9.674 -3.001 -7.072 1.00 0.00 H new ATOM 0 HA ARG A 110 7.421 -2.190 -5.690 1.00 0.00 H new ATOM 0 HB2 ARG A 110 9.224 -0.643 -6.189 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.939 -0.763 -7.914 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.936 1.323 -7.252 1.00 0.00 H new ATOM 0 HG3 ARG A 110 6.591 0.224 -7.489 1.00 0.00 H new ATOM 0 HD2 ARG A 110 6.668 -0.266 -4.965 1.00 0.00 H new ATOM 0 HD3 ARG A 110 7.841 1.028 -4.815 1.00 0.00 H new ATOM 0 HE ARG A 110 5.727 2.243 -6.232 1.00 0.00 H new ATOM 0 HH11 ARG A 110 6.152 0.409 -3.285 1.00 0.00 H new ATOM 0 HH12 ARG A 110 4.806 1.195 -2.454 1.00 0.00 H new ATOM 0 HH21 ARG A 110 3.996 3.238 -5.173 1.00 0.00 H new ATOM 0 HH22 ARG A 110 3.596 2.783 -3.514 1.00 0.00 H new ATOM 1711 N ARG A 111 6.609 -2.691 -8.843 1.00 0.00 N ATOM 1712 CA ARG A 111 5.386 -2.826 -9.700 1.00 0.00 C ATOM 1713 C ARG A 111 4.728 -4.178 -9.409 1.00 0.00 C ATOM 1714 O ARG A 111 3.516 -4.295 -9.411 1.00 0.00 O ATOM 1715 CB ARG A 111 5.730 -2.721 -11.193 1.00 0.00 C ATOM 1716 CG ARG A 111 6.658 -1.504 -11.463 1.00 0.00 C ATOM 1717 CD ARG A 111 8.059 -1.988 -11.853 1.00 0.00 C ATOM 1718 NE ARG A 111 8.023 -2.532 -13.241 1.00 0.00 N ATOM 1719 CZ ARG A 111 9.136 -2.737 -13.893 1.00 0.00 C ATOM 1720 NH1 ARG A 111 10.280 -2.462 -13.332 1.00 0.00 N ATOM 1721 NH2 ARG A 111 9.102 -3.219 -15.105 1.00 0.00 N ATOM 0 H ARG A 111 7.487 -2.968 -9.282 1.00 0.00 H new ATOM 0 HA ARG A 111 4.701 -2.012 -9.463 1.00 0.00 H new ATOM 0 HB2 ARG A 111 6.220 -3.637 -11.523 1.00 0.00 H new ATOM 0 HB3 ARG A 111 4.814 -2.621 -11.775 1.00 0.00 H new ATOM 0 HG2 ARG A 111 6.242 -0.889 -12.261 1.00 0.00 H new ATOM 0 HG3 ARG A 111 6.716 -0.876 -10.574 1.00 0.00 H new ATOM 0 HD2 ARG A 111 8.771 -1.165 -11.791 1.00 0.00 H new ATOM 0 HD3 ARG A 111 8.398 -2.756 -11.158 1.00 0.00 H new ATOM 0 HE ARG A 111 7.128 -2.744 -13.682 1.00 0.00 H new ATOM 0 HH11 ARG A 111 10.306 -2.087 -12.384 1.00 0.00 H new ATOM 0 HH12 ARG A 111 11.149 -2.622 -13.841 1.00 0.00 H new ATOM 0 HH21 ARG A 111 8.207 -3.435 -15.543 1.00 0.00 H new ATOM 0 HH22 ARG A 111 9.971 -3.379 -15.615 1.00 0.00 H new ATOM 1735 N GLU A 112 5.489 -5.192 -9.120 1.00 0.00 N ATOM 1736 CA GLU A 112 4.849 -6.495 -8.794 1.00 0.00 C ATOM 1737 C GLU A 112 4.234 -6.372 -7.404 1.00 0.00 C ATOM 1738 O GLU A 112 3.121 -6.788 -7.157 1.00 0.00 O ATOM 1739 CB GLU A 112 5.890 -7.616 -8.806 1.00 0.00 C ATOM 1740 CG GLU A 112 5.176 -8.968 -8.770 1.00 0.00 C ATOM 1741 CD GLU A 112 6.209 -10.088 -8.642 1.00 0.00 C ATOM 1742 OE1 GLU A 112 6.753 -10.245 -7.562 1.00 0.00 O ATOM 1743 OE2 GLU A 112 6.437 -10.771 -9.628 1.00 0.00 O ATOM 0 H GLU A 112 6.509 -5.179 -9.095 1.00 0.00 H new ATOM 0 HA GLU A 112 4.085 -6.737 -9.533 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.510 -7.543 -9.699 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.555 -7.520 -7.948 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.481 -9.002 -7.931 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.587 -9.104 -9.677 1.00 0.00 H new ATOM 1750 N TYR A 113 4.958 -5.777 -6.500 1.00 0.00 N ATOM 1751 CA TYR A 113 4.436 -5.587 -5.122 1.00 0.00 C ATOM 1752 C TYR A 113 3.014 -5.028 -5.204 1.00 0.00 C ATOM 1753 O TYR A 113 2.059 -5.686 -4.843 1.00 0.00 O ATOM 1754 CB TYR A 113 5.332 -4.599 -4.371 1.00 0.00 C ATOM 1755 CG TYR A 113 4.759 -4.335 -2.999 1.00 0.00 C ATOM 1756 CD1 TYR A 113 5.111 -5.159 -1.924 1.00 0.00 C ATOM 1757 CD2 TYR A 113 3.877 -3.265 -2.803 1.00 0.00 C ATOM 1758 CE1 TYR A 113 4.581 -4.913 -0.651 1.00 0.00 C ATOM 1759 CE2 TYR A 113 3.348 -3.019 -1.530 1.00 0.00 C ATOM 1760 CZ TYR A 113 3.700 -3.843 -0.455 1.00 0.00 C ATOM 1761 OH TYR A 113 3.179 -3.600 0.800 1.00 0.00 O ATOM 0 H TYR A 113 5.897 -5.411 -6.659 1.00 0.00 H new ATOM 0 HA TYR A 113 4.428 -6.540 -4.593 1.00 0.00 H new ATOM 0 HB2 TYR A 113 6.341 -5.002 -4.283 1.00 0.00 H new ATOM 0 HB3 TYR A 113 5.409 -3.666 -4.929 1.00 0.00 H new ATOM 0 HD1 TYR A 113 5.791 -5.984 -2.076 1.00 0.00 H new ATOM 0 HD2 TYR A 113 3.605 -2.630 -3.633 1.00 0.00 H new ATOM 0 HE1 TYR A 113 4.852 -5.549 0.179 1.00 0.00 H new ATOM 0 HE2 TYR A 113 2.668 -2.193 -1.378 1.00 0.00 H new ATOM 0 HH TYR A 113 2.236 -3.345 0.719 1.00 0.00 H new ATOM 1771 N GLN A 114 2.868 -3.809 -5.659 1.00 0.00 N ATOM 1772 CA GLN A 114 1.510 -3.196 -5.747 1.00 0.00 C ATOM 1773 C GLN A 114 0.505 -4.198 -6.322 1.00 0.00 C ATOM 1774 O GLN A 114 -0.639 -4.243 -5.916 1.00 0.00 O ATOM 1775 CB GLN A 114 1.555 -1.957 -6.643 1.00 0.00 C ATOM 1776 CG GLN A 114 2.246 -2.303 -7.957 1.00 0.00 C ATOM 1777 CD GLN A 114 2.352 -1.048 -8.825 1.00 0.00 C ATOM 1778 OE1 GLN A 114 2.492 0.047 -8.317 1.00 0.00 O ATOM 1779 NE2 GLN A 114 2.290 -1.160 -10.124 1.00 0.00 N ATOM 0 H GLN A 114 3.633 -3.212 -5.974 1.00 0.00 H new ATOM 0 HA GLN A 114 1.195 -2.912 -4.743 1.00 0.00 H new ATOM 0 HB2 GLN A 114 0.544 -1.598 -6.835 1.00 0.00 H new ATOM 0 HB3 GLN A 114 2.090 -1.151 -6.140 1.00 0.00 H new ATOM 0 HG2 GLN A 114 3.239 -2.708 -7.762 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.685 -3.075 -8.483 1.00 0.00 H new ATOM 0 HE21 GLN A 114 2.173 -2.079 -10.552 1.00 0.00 H new ATOM 0 HE22 GLN A 114 2.359 -0.329 -10.711 1.00 0.00 H new ATOM 1788 N GLN A 115 0.917 -4.998 -7.265 1.00 0.00 N ATOM 1789 CA GLN A 115 -0.026 -5.988 -7.860 1.00 0.00 C ATOM 1790 C GLN A 115 -0.521 -6.941 -6.769 1.00 0.00 C ATOM 1791 O GLN A 115 -1.693 -7.263 -6.693 1.00 0.00 O ATOM 1792 CB GLN A 115 0.692 -6.786 -8.953 1.00 0.00 C ATOM 1793 CG GLN A 115 -0.340 -7.497 -9.829 1.00 0.00 C ATOM 1794 CD GLN A 115 0.376 -8.269 -10.939 1.00 0.00 C ATOM 1795 OE1 GLN A 115 0.167 -9.454 -11.103 1.00 0.00 O ATOM 1796 NE2 GLN A 115 1.218 -7.642 -11.714 1.00 0.00 N ATOM 0 H GLN A 115 1.862 -5.010 -7.649 1.00 0.00 H new ATOM 0 HA GLN A 115 -0.877 -5.464 -8.296 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.304 -6.120 -9.562 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.366 -7.515 -8.502 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -0.937 -8.179 -9.224 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -1.027 -6.770 -10.262 1.00 0.00 H new ATOM 0 HE21 GLN A 115 1.394 -6.647 -11.577 1.00 0.00 H new ATOM 0 HE22 GLN A 115 1.700 -8.147 -12.457 1.00 0.00 H new ATOM 1805 N LEU A 116 0.358 -7.382 -5.912 1.00 0.00 N ATOM 1806 CA LEU A 116 -0.060 -8.304 -4.816 1.00 0.00 C ATOM 1807 C LEU A 116 -0.593 -7.476 -3.647 1.00 0.00 C ATOM 1808 O LEU A 116 -1.272 -7.979 -2.772 1.00 0.00 O ATOM 1809 CB LEU A 116 1.145 -9.129 -4.353 1.00 0.00 C ATOM 1810 CG LEU A 116 1.902 -9.672 -5.569 1.00 0.00 C ATOM 1811 CD1 LEU A 116 3.115 -10.477 -5.096 1.00 0.00 C ATOM 1812 CD2 LEU A 116 0.977 -10.578 -6.390 1.00 0.00 C ATOM 0 H LEU A 116 1.350 -7.144 -5.923 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.838 -8.977 -5.176 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.808 -8.512 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.812 -9.954 -3.723 1.00 0.00 H new ATOM 0 HG LEU A 116 2.235 -8.839 -6.189 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.654 -10.864 -5.960 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.775 -9.833 -4.515 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.780 -11.308 -4.475 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.518 -10.963 -7.254 1.00 0.00 H new ATOM 0 HD22 LEU A 116 0.641 -11.411 -5.772 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.113 -10.005 -6.728 1.00 0.00 H new ATOM 1824 N TRP A 117 -0.302 -6.204 -3.635 1.00 0.00 N ATOM 1825 CA TRP A 117 -0.796 -5.329 -2.538 1.00 0.00 C ATOM 1826 C TRP A 117 -2.229 -4.887 -2.852 1.00 0.00 C ATOM 1827 O TRP A 117 -3.071 -4.830 -1.981 1.00 0.00 O ATOM 1828 CB TRP A 117 0.108 -4.090 -2.429 1.00 0.00 C ATOM 1829 CG TRP A 117 0.066 -3.538 -1.039 1.00 0.00 C ATOM 1830 CD1 TRP A 117 0.566 -4.150 0.057 1.00 0.00 C ATOM 1831 CD2 TRP A 117 -0.499 -2.276 -0.584 1.00 0.00 C ATOM 1832 NE1 TRP A 117 0.345 -3.342 1.157 1.00 0.00 N ATOM 1833 CE2 TRP A 117 -0.310 -2.176 0.813 1.00 0.00 C ATOM 1834 CE3 TRP A 117 -1.152 -1.219 -1.243 1.00 0.00 C ATOM 1835 CZ2 TRP A 117 -0.753 -1.065 1.533 1.00 0.00 C ATOM 1836 CZ3 TRP A 117 -1.599 -0.100 -0.523 1.00 0.00 C ATOM 1837 CH2 TRP A 117 -1.400 -0.023 0.863 1.00 0.00 C ATOM 0 H TRP A 117 0.260 -5.732 -4.343 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.779 -5.876 -1.596 1.00 0.00 H new ATOM 0 HB2 TRP A 117 1.132 -4.354 -2.692 1.00 0.00 H new ATOM 0 HB3 TRP A 117 -0.217 -3.330 -3.139 1.00 0.00 H new ATOM 0 HD1 TRP A 117 1.057 -5.112 0.071 1.00 0.00 H new ATOM 0 HE1 TRP A 117 0.631 -3.578 2.107 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -1.311 -1.269 -2.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -0.597 -1.011 2.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -2.099 0.706 -1.039 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -1.746 0.840 1.412 1.00 0.00 H new ATOM 1848 N LEU A 118 -2.527 -4.619 -4.097 1.00 0.00 N ATOM 1849 CA LEU A 118 -3.913 -4.220 -4.460 1.00 0.00 C ATOM 1850 C LEU A 118 -4.819 -5.439 -4.300 1.00 0.00 C ATOM 1851 O LEU A 118 -5.941 -5.316 -3.850 1.00 0.00 O ATOM 1852 CB LEU A 118 -3.946 -3.675 -5.894 1.00 0.00 C ATOM 1853 CG LEU A 118 -3.094 -2.390 -5.976 1.00 0.00 C ATOM 1854 CD1 LEU A 118 -2.745 -2.091 -7.438 1.00 0.00 C ATOM 1855 CD2 LEU A 118 -3.863 -1.193 -5.387 1.00 0.00 C ATOM 0 H LEU A 118 -1.869 -4.660 -4.875 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.268 -3.424 -3.805 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.563 -4.423 -6.588 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.973 -3.463 -6.190 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.181 -2.545 -5.401 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.144 -1.183 -7.490 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.180 -2.925 -7.855 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.662 -1.952 -8.010 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.247 -0.296 -5.453 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.785 -1.042 -5.948 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -4.102 -1.392 -4.342 1.00 0.00 H new ATOM 1867 N ALA A 119 -4.341 -6.626 -4.568 1.00 0.00 N ATOM 1868 CA ALA A 119 -5.207 -7.808 -4.306 1.00 0.00 C ATOM 1869 C ALA A 119 -5.526 -7.760 -2.811 1.00 0.00 C ATOM 1870 O ALA A 119 -6.634 -7.436 -2.436 1.00 0.00 O ATOM 1871 CB ALA A 119 -4.485 -9.108 -4.667 1.00 0.00 C ATOM 0 H ALA A 119 -3.415 -6.824 -4.946 1.00 0.00 H new ATOM 0 HA ALA A 119 -6.113 -7.782 -4.912 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -5.140 -9.956 -4.466 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.221 -9.096 -5.725 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.579 -9.199 -4.068 1.00 0.00 H new ATOM 1877 N ALA A 120 -4.598 -8.076 -1.953 1.00 0.00 N ATOM 1878 CA ALA A 120 -4.895 -8.022 -0.490 1.00 0.00 C ATOM 1879 C ALA A 120 -5.627 -6.721 -0.123 1.00 0.00 C ATOM 1880 O ALA A 120 -6.070 -6.584 0.992 1.00 0.00 O ATOM 1881 CB ALA A 120 -3.585 -8.083 0.300 1.00 0.00 C ATOM 0 H ALA A 120 -3.651 -8.368 -2.196 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.532 -8.871 -0.242 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.802 -8.044 1.368 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.064 -9.012 0.070 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.955 -7.237 0.026 1.00 0.00 H new ATOM 1887 N PHE A 121 -5.777 -5.775 -1.033 1.00 0.00 N ATOM 1888 CA PHE A 121 -6.516 -4.506 -0.693 1.00 0.00 C ATOM 1889 C PHE A 121 -7.885 -4.494 -1.401 1.00 0.00 C ATOM 1890 O PHE A 121 -8.803 -3.827 -0.969 1.00 0.00 O ATOM 1891 CB PHE A 121 -5.692 -3.273 -1.112 1.00 0.00 C ATOM 1892 CG PHE A 121 -6.038 -2.090 -0.230 1.00 0.00 C ATOM 1893 CD1 PHE A 121 -7.230 -1.385 -0.435 1.00 0.00 C ATOM 1894 CD2 PHE A 121 -5.165 -1.704 0.797 1.00 0.00 C ATOM 1895 CE1 PHE A 121 -7.548 -0.296 0.384 1.00 0.00 C ATOM 1896 CE2 PHE A 121 -5.484 -0.614 1.615 1.00 0.00 C ATOM 1897 CZ PHE A 121 -6.676 0.090 1.409 1.00 0.00 C ATOM 0 H PHE A 121 -5.423 -5.827 -1.988 1.00 0.00 H new ATOM 0 HA PHE A 121 -6.670 -4.468 0.385 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -4.627 -3.494 -1.035 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -5.893 -3.029 -2.155 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.904 -1.682 -1.225 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -4.246 -2.248 0.957 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.468 0.248 0.225 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -4.810 -0.316 2.405 1.00 0.00 H new ATOM 0 HZ PHE A 121 -6.923 0.931 2.040 1.00 0.00 H new ATOM 1907 N ALA A 122 -8.034 -5.227 -2.473 1.00 0.00 N ATOM 1908 CA ALA A 122 -9.351 -5.261 -3.195 1.00 0.00 C ATOM 1909 C ALA A 122 -10.148 -6.493 -2.775 1.00 0.00 C ATOM 1910 O ALA A 122 -11.363 -6.457 -2.769 1.00 0.00 O ATOM 1911 CB ALA A 122 -9.139 -5.270 -4.701 1.00 0.00 C ATOM 0 H ALA A 122 -7.302 -5.806 -2.884 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.911 -4.364 -2.929 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -10.106 -5.295 -5.204 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -8.598 -4.371 -4.998 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.561 -6.150 -4.982 1.00 0.00 H new ATOM 1917 N ALA A 123 -9.527 -7.545 -2.357 1.00 0.00 N ATOM 1918 CA ALA A 123 -10.329 -8.701 -1.870 1.00 0.00 C ATOM 1919 C ALA A 123 -10.544 -8.455 -0.381 1.00 0.00 C ATOM 1920 O ALA A 123 -10.721 -9.369 0.398 1.00 0.00 O ATOM 1921 CB ALA A 123 -9.546 -10.001 -2.073 1.00 0.00 C ATOM 0 H ALA A 123 -8.514 -7.663 -2.328 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.273 -8.793 -2.407 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -10.139 -10.843 -1.714 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -9.331 -10.134 -3.133 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -8.610 -9.953 -1.516 1.00 0.00 H new ATOM 1927 N LEU A 124 -10.433 -7.208 0.027 1.00 0.00 N ATOM 1928 CA LEU A 124 -10.521 -6.883 1.480 1.00 0.00 C ATOM 1929 C LEU A 124 -11.948 -7.063 2.059 1.00 0.00 C ATOM 1930 O LEU A 124 -12.111 -7.766 3.034 1.00 0.00 O ATOM 1931 CB LEU A 124 -10.047 -5.417 1.711 1.00 0.00 C ATOM 1932 CG LEU A 124 -8.701 -5.370 2.455 1.00 0.00 C ATOM 1933 CD1 LEU A 124 -8.150 -3.931 2.465 1.00 0.00 C ATOM 1934 CD2 LEU A 124 -8.877 -5.846 3.903 1.00 0.00 C ATOM 0 H LEU A 124 -10.286 -6.407 -0.587 1.00 0.00 H new ATOM 0 HA LEU A 124 -9.875 -7.587 2.005 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -9.951 -4.909 0.751 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -10.800 -4.876 2.284 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.001 -6.027 1.938 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.197 -3.910 2.994 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -8.003 -3.590 1.440 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.859 -3.273 2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.917 -5.808 4.418 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -9.589 -5.199 4.415 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.250 -6.870 3.907 1.00 0.00 H new ATOM 1946 N PRO A 125 -12.930 -6.342 1.482 1.00 0.00 N ATOM 1947 CA PRO A 125 -14.324 -6.330 1.989 1.00 0.00 C ATOM 1948 C PRO A 125 -14.934 -7.715 2.012 1.00 0.00 C ATOM 1949 O PRO A 125 -16.054 -7.946 1.600 1.00 0.00 O ATOM 1950 CB PRO A 125 -15.080 -5.371 1.061 1.00 0.00 C ATOM 1951 CG PRO A 125 -14.167 -5.095 -0.150 1.00 0.00 C ATOM 1952 CD PRO A 125 -12.748 -5.512 0.269 1.00 0.00 C ATOM 0 HA PRO A 125 -14.373 -5.998 3.026 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -16.024 -5.811 0.739 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -15.322 -4.444 1.580 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -14.496 -5.661 -1.021 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.196 -4.041 -0.425 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -12.253 -6.075 -0.523 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.127 -4.641 0.477 1.00 0.00 H new ATOM 1960 N GLY A 126 -14.218 -8.615 2.559 1.00 0.00 N ATOM 1961 CA GLY A 126 -14.743 -9.988 2.705 1.00 0.00 C ATOM 1962 C GLY A 126 -13.621 -10.940 3.083 1.00 0.00 C ATOM 1963 O GLY A 126 -13.872 -11.982 3.655 1.00 0.00 O ATOM 0 H GLY A 126 -13.276 -8.469 2.921 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -15.520 -10.009 3.469 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -15.204 -10.310 1.772 1.00 0.00 H new ATOM 1967 N SER A 127 -12.387 -10.623 2.779 1.00 0.00 N ATOM 1968 CA SER A 127 -11.264 -11.551 3.135 1.00 0.00 C ATOM 1969 C SER A 127 -10.395 -10.972 4.272 1.00 0.00 C ATOM 1970 O SER A 127 -9.475 -11.621 4.724 1.00 0.00 O ATOM 1971 CB SER A 127 -10.385 -11.740 1.891 1.00 0.00 C ATOM 1972 OG SER A 127 -9.692 -12.977 1.990 1.00 0.00 O ATOM 0 H SER A 127 -12.107 -9.766 2.302 1.00 0.00 H new ATOM 0 HA SER A 127 -11.685 -12.498 3.474 1.00 0.00 H new ATOM 0 HB2 SER A 127 -11.000 -11.725 0.991 1.00 0.00 H new ATOM 0 HB3 SER A 127 -9.675 -10.918 1.805 1.00 0.00 H new ATOM 0 HG SER A 127 -9.327 -13.076 2.894 1.00 0.00 H new ATOM 1978 N ALA A 128 -10.659 -9.769 4.738 1.00 0.00 N ATOM 1979 CA ALA A 128 -9.804 -9.195 5.837 1.00 0.00 C ATOM 1980 C ALA A 128 -10.231 -7.746 6.153 1.00 0.00 C ATOM 1981 O ALA A 128 -9.411 -6.856 6.245 1.00 0.00 O ATOM 1982 CB ALA A 128 -8.335 -9.201 5.372 1.00 0.00 C ATOM 0 H ALA A 128 -11.416 -9.168 4.412 1.00 0.00 H new ATOM 0 HA ALA A 128 -9.923 -9.798 6.737 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.703 -8.788 6.158 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.025 -10.224 5.158 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.236 -8.596 4.471 1.00 0.00 H new ATOM 1988 N LYS A 129 -11.504 -7.492 6.270 1.00 0.00 N ATOM 1989 CA LYS A 129 -11.977 -6.100 6.517 1.00 0.00 C ATOM 1990 C LYS A 129 -13.158 -6.107 7.494 1.00 0.00 C ATOM 1991 O LYS A 129 -13.305 -6.980 8.323 1.00 0.00 O ATOM 1992 CB LYS A 129 -12.431 -5.551 5.158 1.00 0.00 C ATOM 1993 CG LYS A 129 -12.334 -4.021 5.072 1.00 0.00 C ATOM 1994 CD LYS A 129 -13.084 -3.538 3.823 1.00 0.00 C ATOM 1995 CE LYS A 129 -12.631 -2.125 3.446 1.00 0.00 C ATOM 1996 NZ LYS A 129 -11.146 -2.084 3.316 1.00 0.00 N ATOM 0 H LYS A 129 -12.242 -8.193 6.205 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.187 -5.488 6.953 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -11.822 -5.994 4.370 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.461 -5.856 4.974 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -12.761 -3.567 5.966 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -11.290 -3.713 5.026 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -12.900 -4.220 2.993 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -14.158 -3.546 4.009 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -13.095 -1.824 2.507 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -12.958 -1.415 4.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -10.885 -1.505 2.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -10.734 -1.668 4.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -10.782 -3.050 3.190 1.00 0.00 H new ATOM 2010 N ASP A 130 -13.989 -5.121 7.357 1.00 0.00 N ATOM 2011 CA ASP A 130 -15.199 -4.961 8.206 1.00 0.00 C ATOM 2012 C ASP A 130 -15.808 -3.585 7.882 1.00 0.00 C ATOM 2013 O ASP A 130 -15.740 -2.680 8.690 1.00 0.00 O ATOM 2014 CB ASP A 130 -14.812 -5.014 9.695 1.00 0.00 C ATOM 2015 CG ASP A 130 -15.976 -4.514 10.557 1.00 0.00 C ATOM 2016 OD1 ASP A 130 -17.109 -4.816 10.220 1.00 0.00 O ATOM 2017 OD2 ASP A 130 -15.714 -3.838 11.538 1.00 0.00 O ATOM 0 H ASP A 130 -13.875 -4.385 6.660 1.00 0.00 H new ATOM 0 HA ASP A 130 -15.912 -5.762 8.008 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -14.553 -6.035 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -13.928 -4.401 9.872 1.00 0.00 H new ATOM 2022 N PRO A 131 -16.354 -3.455 6.692 1.00 0.00 N ATOM 2023 CA PRO A 131 -16.938 -2.182 6.227 1.00 0.00 C ATOM 2024 C PRO A 131 -18.374 -2.060 6.731 1.00 0.00 C ATOM 2025 O PRO A 131 -18.787 -1.069 7.297 1.00 0.00 O ATOM 2026 CB PRO A 131 -16.964 -2.351 4.693 1.00 0.00 C ATOM 2027 CG PRO A 131 -16.978 -3.877 4.425 1.00 0.00 C ATOM 2028 CD PRO A 131 -16.444 -4.555 5.704 1.00 0.00 C ATOM 0 HA PRO A 131 -16.387 -1.306 6.569 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -17.844 -1.873 4.264 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -16.092 -1.884 4.235 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -17.987 -4.221 4.197 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -16.355 -4.125 3.566 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -17.115 -5.343 6.046 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -15.471 -5.017 5.533 1.00 0.00 H new ATOM 2036 N SER A 132 -19.127 -3.087 6.452 1.00 0.00 N ATOM 2037 CA SER A 132 -20.574 -3.144 6.803 1.00 0.00 C ATOM 2038 C SER A 132 -21.231 -4.161 5.858 1.00 0.00 C ATOM 2039 O SER A 132 -22.363 -4.005 5.449 1.00 0.00 O ATOM 2040 CB SER A 132 -21.214 -1.760 6.597 1.00 0.00 C ATOM 2041 OG SER A 132 -20.573 -1.104 5.511 1.00 0.00 O ATOM 0 H SER A 132 -18.784 -3.922 5.976 1.00 0.00 H new ATOM 0 HA SER A 132 -20.709 -3.436 7.845 1.00 0.00 H new ATOM 0 HB2 SER A 132 -22.280 -1.866 6.395 1.00 0.00 H new ATOM 0 HB3 SER A 132 -21.119 -1.164 7.504 1.00 0.00 H new ATOM 0 HG SER A 132 -19.861 -0.524 5.853 1.00 0.00 H new ATOM 2047 N TRP A 133 -20.514 -5.201 5.505 1.00 0.00 N ATOM 2048 CA TRP A 133 -21.076 -6.230 4.584 1.00 0.00 C ATOM 2049 C TRP A 133 -21.375 -5.588 3.227 1.00 0.00 C ATOM 2050 O TRP A 133 -22.420 -5.007 3.016 1.00 0.00 O ATOM 2051 CB TRP A 133 -22.357 -6.824 5.180 1.00 0.00 C ATOM 2052 CG TRP A 133 -22.166 -7.040 6.648 1.00 0.00 C ATOM 2053 CD1 TRP A 133 -21.036 -7.515 7.221 1.00 0.00 C ATOM 2054 CD2 TRP A 133 -23.106 -6.800 7.735 1.00 0.00 C ATOM 2055 NE1 TRP A 133 -21.223 -7.582 8.590 1.00 0.00 N ATOM 2056 CE2 TRP A 133 -22.483 -7.152 8.955 1.00 0.00 C ATOM 2057 CE3 TRP A 133 -24.426 -6.316 7.780 1.00 0.00 C ATOM 2058 CZ2 TRP A 133 -23.145 -7.027 10.177 1.00 0.00 C ATOM 2059 CZ3 TRP A 133 -25.096 -6.190 9.008 1.00 0.00 C ATOM 2060 CH2 TRP A 133 -24.456 -6.545 10.204 1.00 0.00 C ATOM 0 H TRP A 133 -19.560 -5.379 5.818 1.00 0.00 H new ATOM 0 HA TRP A 133 -20.350 -7.032 4.451 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -23.198 -6.153 5.006 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -22.596 -7.768 4.690 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -20.135 -7.796 6.695 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -20.516 -7.909 9.249 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -24.928 -6.039 6.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -22.647 -7.301 11.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -26.110 -5.818 9.031 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -24.976 -6.446 11.145 1.00 0.00 H new ATOM 2071 N ALA A 134 -20.452 -5.695 2.310 1.00 0.00 N ATOM 2072 CA ALA A 134 -20.657 -5.099 0.959 1.00 0.00 C ATOM 2073 C ALA A 134 -19.452 -5.424 0.074 1.00 0.00 C ATOM 2074 O ALA A 134 -18.338 -5.195 0.515 1.00 0.00 O ATOM 2075 CB ALA A 134 -20.801 -3.580 1.086 1.00 0.00 C ATOM 2076 OXT ALA A 134 -19.664 -5.896 -1.031 1.00 0.00 O ATOM 0 H ALA A 134 -19.560 -6.172 2.440 1.00 0.00 H new ATOM 0 HA ALA A 134 -21.561 -5.512 0.512 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -20.951 -3.145 0.098 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -21.658 -3.347 1.719 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -19.897 -3.165 1.532 1.00 0.00 H new TER 2082 ALA A 134