USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 967 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 NoAdj-H: A 52 HIS HE2 : A 52 HIS NE2 : A 129 ZNZN :(H bumps) USER MOD NoAdj-H: A 58 HIS HD1 : A 58 HIS ND1 : A 129 ZNZN :(H bumps) USER MOD NoAdj-H: A 113 HIS HE2 : A 113 HIS NE2 : A 130 ZNZN :(H bumps) USER MOD NoAdj-H: A 119 HIS HD1 : A 119 HIS ND1 : A 130 ZNZN :(H bumps) USER MOD Set 1.1: A 35 GLN : amide:sc= 1.02 K(o=2.2,f=-3.8) USER MOD Set 1.2: A 37 LYS NZ :NH3+ 158:sc= 1.2 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= 0.382 K(o=0.38,f=-3.3!) USER MOD Single : A 17 LYS NZ :NH3+ 179:sc= 1.29 (180deg=1.29) USER MOD Single : A 21 ASN : amide:sc= 0.828 K(o=0.83,f=-3.6!) USER MOD Single : A 22 SER OG : rot 76:sc= 0.949 USER MOD Single : A 27 ASN : amide:sc= 0.861 K(o=0.86,f=-0.0015) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= 0.337 K(o=0.34,f=-2.3!) USER MOD Single : A 32 SER OG : rot -39:sc= 0.809 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -16:sc= 0.196 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.18 K(o=-0.18,f=-2.1) USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 1.13 (180deg=1.11) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= 0.831 K(o=0.83,f=-1.1) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= 0.887 K(o=0.89,f=-3.8!) USER MOD Single : A 61 LYS NZ :NH3+ -170:sc= 1.21 (180deg=1.17) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.219 K(o=-0.22,f=-1.7) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 177:sc= 1.01 (180deg=0.999) USER MOD Single : A 96 CYS SG : rot -41:sc= 0.252 USER MOD Single : A 101 ASN : amide:sc= 0.994 K(o=0.99,f=-3.6!) USER MOD Single : A 102 MET CE :methyl -155:sc= -0.0184 (180deg=-0.0282) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0.00916 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 79:sc= 0.00744 USER MOD Single : A 114 TYR OH : rot 122:sc= 0.612 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0.973 K(o=0.97,f=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -41.524 7.726 13.845 1.00 1.00 N ATOM 2 CA ALA A 2 -40.270 7.292 14.471 1.00 1.00 C ATOM 3 C ALA A 2 -39.042 7.685 13.620 1.00 1.00 C ATOM 4 O ALA A 2 -39.166 8.030 12.441 1.00 1.00 O ATOM 5 CB ALA A 2 -40.332 5.768 14.665 1.00 1.00 C ATOM 0 HA ALA A 2 -40.157 7.791 15.434 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -39.409 5.423 15.130 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -41.177 5.517 15.306 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -40.455 5.283 13.697 1.00 1.00 H new ATOM 11 N ASP A 3 -37.848 7.606 14.214 1.00 1.00 N ATOM 12 CA ASP A 3 -36.559 7.913 13.567 1.00 1.00 C ATOM 13 C ASP A 3 -35.440 6.952 14.017 1.00 1.00 C ATOM 14 O ASP A 3 -34.616 6.521 13.211 1.00 1.00 O ATOM 15 CB ASP A 3 -36.184 9.370 13.876 1.00 1.00 C ATOM 16 CG ASP A 3 -34.879 9.791 13.176 1.00 1.00 C ATOM 17 OD1 ASP A 3 -34.892 9.987 11.937 1.00 1.00 O ATOM 18 OD2 ASP A 3 -33.845 9.951 13.868 1.00 1.00 O ATOM 0 H ASP A 3 -37.743 7.319 15.187 1.00 1.00 H new ATOM 0 HA ASP A 3 -36.669 7.778 12.491 1.00 1.00 H new ATOM 0 HB2 ASP A 3 -36.994 10.028 13.559 1.00 1.00 H new ATOM 0 HB3 ASP A 3 -36.074 9.495 14.953 1.00 1.00 H new ATOM 23 N GLU A 4 -35.455 6.548 15.290 1.00 1.00 N ATOM 24 CA GLU A 4 -34.538 5.570 15.897 1.00 1.00 C ATOM 25 C GLU A 4 -34.708 4.141 15.335 1.00 1.00 C ATOM 26 O GLU A 4 -33.834 3.288 15.507 1.00 1.00 O ATOM 27 CB GLU A 4 -34.697 5.582 17.432 1.00 1.00 C ATOM 28 CG GLU A 4 -36.097 5.228 17.974 1.00 1.00 C ATOM 29 CD GLU A 4 -37.043 6.446 18.040 1.00 1.00 C ATOM 30 OE1 GLU A 4 -37.638 6.812 16.995 1.00 1.00 O ATOM 31 OE2 GLU A 4 -37.192 7.047 19.131 1.00 1.00 O ATOM 0 H GLU A 4 -36.136 6.908 15.959 1.00 1.00 H new ATOM 0 HA GLU A 4 -33.526 5.876 15.633 1.00 1.00 H new ATOM 0 HB2 GLU A 4 -33.978 4.881 17.856 1.00 1.00 H new ATOM 0 HB3 GLU A 4 -34.429 6.574 17.797 1.00 1.00 H new ATOM 0 HG2 GLU A 4 -36.543 4.462 17.340 1.00 1.00 H new ATOM 0 HG3 GLU A 4 -35.997 4.798 18.971 1.00 1.00 H new ATOM 38 N PHE A 5 -35.824 3.879 14.644 1.00 1.00 N ATOM 39 CA PHE A 5 -36.161 2.603 14.000 1.00 1.00 C ATOM 40 C PHE A 5 -35.369 2.343 12.694 1.00 1.00 C ATOM 41 O PHE A 5 -35.465 1.260 12.110 1.00 1.00 O ATOM 42 CB PHE A 5 -37.682 2.600 13.756 1.00 1.00 C ATOM 43 CG PHE A 5 -38.280 1.249 13.403 1.00 1.00 C ATOM 44 CD1 PHE A 5 -38.400 0.255 14.394 1.00 1.00 C ATOM 45 CD2 PHE A 5 -38.732 0.987 12.095 1.00 1.00 C ATOM 46 CE1 PHE A 5 -38.962 -0.996 14.077 1.00 1.00 C ATOM 47 CE2 PHE A 5 -39.294 -0.265 11.778 1.00 1.00 C ATOM 48 CZ PHE A 5 -39.408 -1.256 12.769 1.00 1.00 C ATOM 0 H PHE A 5 -36.550 4.583 14.512 1.00 1.00 H new ATOM 0 HA PHE A 5 -35.872 1.784 14.659 1.00 1.00 H new ATOM 0 HB2 PHE A 5 -38.178 2.976 14.651 1.00 1.00 H new ATOM 0 HB3 PHE A 5 -37.906 3.300 12.951 1.00 1.00 H new ATOM 0 HD1 PHE A 5 -38.060 0.453 15.400 1.00 1.00 H new ATOM 0 HD2 PHE A 5 -38.647 1.748 11.333 1.00 1.00 H new ATOM 0 HE1 PHE A 5 -39.051 -1.756 14.839 1.00 1.00 H new ATOM 0 HE2 PHE A 5 -39.637 -0.464 10.774 1.00 1.00 H new ATOM 0 HZ PHE A 5 -39.838 -2.216 12.526 1.00 1.00 H new ATOM 58 N GLY A 6 -34.578 3.317 12.227 1.00 1.00 N ATOM 59 CA GLY A 6 -33.771 3.246 11.003 1.00 1.00 C ATOM 60 C GLY A 6 -32.518 4.133 11.037 1.00 1.00 C ATOM 61 O GLY A 6 -32.050 4.535 12.107 1.00 1.00 O ATOM 0 H GLY A 6 -34.479 4.210 12.710 1.00 1.00 H new ATOM 0 HA2 GLY A 6 -33.469 2.212 10.837 1.00 1.00 H new ATOM 0 HA3 GLY A 6 -34.389 3.538 10.154 1.00 1.00 H new ATOM 65 N ASN A 7 -31.963 4.426 9.857 1.00 1.00 N ATOM 66 CA ASN A 7 -30.759 5.249 9.668 1.00 1.00 C ATOM 67 C ASN A 7 -30.866 6.115 8.387 1.00 1.00 C ATOM 68 O ASN A 7 -31.710 5.871 7.519 1.00 1.00 O ATOM 69 CB ASN A 7 -29.539 4.298 9.651 1.00 1.00 C ATOM 70 CG ASN A 7 -28.181 4.981 9.774 1.00 1.00 C ATOM 71 OD1 ASN A 7 -28.053 6.163 10.064 1.00 1.00 O ATOM 72 ND2 ASN A 7 -27.113 4.251 9.551 1.00 1.00 N ATOM 0 H ASN A 7 -32.350 4.087 8.977 1.00 1.00 H new ATOM 0 HA ASN A 7 -30.645 5.960 10.486 1.00 1.00 H new ATOM 0 HB2 ASN A 7 -29.644 3.584 10.468 1.00 1.00 H new ATOM 0 HB3 ASN A 7 -29.557 3.726 8.723 1.00 1.00 H new ATOM 0 HD21 ASN A 7 -26.185 4.670 9.620 1.00 1.00 H new ATOM 0 HD22 ASN A 7 -27.211 3.265 9.309 1.00 1.00 H new ATOM 79 N GLY A 8 -29.997 7.120 8.264 1.00 1.00 N ATOM 80 CA GLY A 8 -29.923 8.049 7.127 1.00 1.00 C ATOM 81 C GLY A 8 -28.926 9.202 7.320 1.00 1.00 C ATOM 82 O GLY A 8 -28.415 9.747 6.341 1.00 1.00 O ATOM 0 H GLY A 8 -29.297 7.320 8.979 1.00 1.00 H new ATOM 0 HA2 GLY A 8 -29.646 7.490 6.233 1.00 1.00 H new ATOM 0 HA3 GLY A 8 -30.914 8.466 6.948 1.00 1.00 H new ATOM 86 N ASP A 9 -28.622 9.569 8.572 1.00 1.00 N ATOM 87 CA ASP A 9 -27.667 10.635 8.927 1.00 1.00 C ATOM 88 C ASP A 9 -26.188 10.260 8.665 1.00 1.00 C ATOM 89 O ASP A 9 -25.322 11.137 8.601 1.00 1.00 O ATOM 90 CB ASP A 9 -27.884 10.991 10.406 1.00 1.00 C ATOM 91 CG ASP A 9 -27.095 12.238 10.845 1.00 1.00 C ATOM 92 OD1 ASP A 9 -27.385 13.348 10.337 1.00 1.00 O ATOM 93 OD2 ASP A 9 -26.214 12.120 11.732 1.00 1.00 O ATOM 0 H ASP A 9 -29.042 9.124 9.388 1.00 1.00 H new ATOM 0 HA ASP A 9 -27.861 11.492 8.282 1.00 1.00 H new ATOM 0 HB2 ASP A 9 -28.947 11.159 10.582 1.00 1.00 H new ATOM 0 HB3 ASP A 9 -27.589 10.144 11.025 1.00 1.00 H new ATOM 98 N ALA A 10 -25.891 8.965 8.505 1.00 1.00 N ATOM 99 CA ALA A 10 -24.554 8.431 8.230 1.00 1.00 C ATOM 100 C ALA A 10 -23.954 8.903 6.881 1.00 1.00 C ATOM 101 O ALA A 10 -24.654 9.403 5.994 1.00 1.00 O ATOM 102 CB ALA A 10 -24.634 6.899 8.307 1.00 1.00 C ATOM 0 H ALA A 10 -26.601 8.235 8.566 1.00 1.00 H new ATOM 0 HA ALA A 10 -23.868 8.821 8.982 1.00 1.00 H new ATOM 0 HB1 ALA A 10 -23.651 6.473 8.106 1.00 1.00 H new ATOM 0 HB2 ALA A 10 -24.962 6.601 9.303 1.00 1.00 H new ATOM 0 HB3 ALA A 10 -25.346 6.534 7.567 1.00 1.00 H new ATOM 108 N LEU A 11 -22.642 8.702 6.720 1.00 1.00 N ATOM 109 CA LEU A 11 -21.839 9.046 5.551 1.00 1.00 C ATOM 110 C LEU A 11 -20.692 8.033 5.367 1.00 1.00 C ATOM 111 O LEU A 11 -20.529 7.093 6.143 1.00 1.00 O ATOM 112 CB LEU A 11 -21.344 10.512 5.664 1.00 1.00 C ATOM 113 CG LEU A 11 -20.179 10.808 6.637 1.00 1.00 C ATOM 114 CD1 LEU A 11 -19.752 12.268 6.489 1.00 1.00 C ATOM 115 CD2 LEU A 11 -20.519 10.572 8.110 1.00 1.00 C ATOM 0 H LEU A 11 -22.081 8.267 7.452 1.00 1.00 H new ATOM 0 HA LEU A 11 -22.451 8.984 4.651 1.00 1.00 H new ATOM 0 HB2 LEU A 11 -21.041 10.841 4.670 1.00 1.00 H new ATOM 0 HB3 LEU A 11 -22.192 11.130 5.959 1.00 1.00 H new ATOM 0 HG LEU A 11 -19.385 10.112 6.367 1.00 1.00 H new ATOM 0 HD11 LEU A 11 -18.931 12.478 7.174 1.00 1.00 H new ATOM 0 HD12 LEU A 11 -19.426 12.450 5.465 1.00 1.00 H new ATOM 0 HD13 LEU A 11 -20.595 12.919 6.722 1.00 1.00 H new ATOM 0 HD21 LEU A 11 -19.649 10.802 8.726 1.00 1.00 H new ATOM 0 HD22 LEU A 11 -21.349 11.216 8.399 1.00 1.00 H new ATOM 0 HD23 LEU A 11 -20.801 9.529 8.256 1.00 1.00 H new ATOM 127 N ASP A 12 -19.886 8.245 4.333 1.00 1.00 N ATOM 128 CA ASP A 12 -18.718 7.436 3.928 1.00 1.00 C ATOM 129 C ASP A 12 -17.507 7.495 4.899 1.00 1.00 C ATOM 130 O ASP A 12 -16.386 7.132 4.534 1.00 1.00 O ATOM 131 CB ASP A 12 -18.307 7.857 2.505 1.00 1.00 C ATOM 132 CG ASP A 12 -19.431 7.624 1.482 1.00 1.00 C ATOM 133 OD1 ASP A 12 -19.606 6.469 1.026 1.00 1.00 O ATOM 134 OD2 ASP A 12 -20.139 8.597 1.127 1.00 1.00 O ATOM 0 H ASP A 12 -20.032 9.037 3.707 1.00 1.00 H new ATOM 0 HA ASP A 12 -19.029 6.392 3.958 1.00 1.00 H new ATOM 0 HB2 ASP A 12 -18.032 8.912 2.505 1.00 1.00 H new ATOM 0 HB3 ASP A 12 -17.422 7.297 2.204 1.00 1.00 H new ATOM 139 N LEU A 13 -17.719 7.946 6.140 1.00 1.00 N ATOM 140 CA LEU A 13 -16.726 8.089 7.210 1.00 1.00 C ATOM 141 C LEU A 13 -17.319 7.671 8.571 1.00 1.00 C ATOM 142 O LEU A 13 -18.530 7.821 8.777 1.00 1.00 O ATOM 143 CB LEU A 13 -16.274 9.563 7.327 1.00 1.00 C ATOM 144 CG LEU A 13 -15.446 10.102 6.147 1.00 1.00 C ATOM 145 CD1 LEU A 13 -16.298 10.860 5.124 1.00 1.00 C ATOM 146 CD2 LEU A 13 -14.390 11.078 6.668 1.00 1.00 C ATOM 0 H LEU A 13 -18.648 8.239 6.443 1.00 1.00 H new ATOM 0 HA LEU A 13 -15.882 7.447 6.959 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -17.160 10.188 7.441 1.00 1.00 H new ATOM 0 HB3 LEU A 13 -15.687 9.673 8.239 1.00 1.00 H new ATOM 0 HG LEU A 13 -14.999 9.235 5.660 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -15.662 11.217 4.314 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -17.060 10.193 4.720 1.00 1.00 H new ATOM 0 HD13 LEU A 13 -16.779 11.709 5.609 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -13.804 11.460 5.832 1.00 1.00 H new ATOM 0 HD22 LEU A 13 -14.881 11.908 7.176 1.00 1.00 H new ATOM 0 HD23 LEU A 13 -13.732 10.563 7.368 1.00 1.00 H new ATOM 158 N PRO A 14 -16.495 7.196 9.527 1.00 1.00 N ATOM 159 CA PRO A 14 -16.961 6.879 10.876 1.00 1.00 C ATOM 160 C PRO A 14 -17.351 8.168 11.630 1.00 1.00 C ATOM 161 O PRO A 14 -16.913 9.266 11.279 1.00 1.00 O ATOM 162 CB PRO A 14 -15.795 6.132 11.535 1.00 1.00 C ATOM 163 CG PRO A 14 -14.560 6.676 10.824 1.00 1.00 C ATOM 164 CD PRO A 14 -15.059 6.977 9.411 1.00 1.00 C ATOM 0 HA PRO A 14 -17.861 6.264 10.881 1.00 1.00 H new ATOM 0 HB2 PRO A 14 -15.754 6.322 12.608 1.00 1.00 H new ATOM 0 HB3 PRO A 14 -15.888 5.054 11.406 1.00 1.00 H new ATOM 0 HG2 PRO A 14 -14.178 7.572 11.313 1.00 1.00 H new ATOM 0 HG3 PRO A 14 -13.749 5.948 10.816 1.00 1.00 H new ATOM 0 HD2 PRO A 14 -14.563 7.857 9.002 1.00 1.00 H new ATOM 0 HD3 PRO A 14 -14.845 6.148 8.737 1.00 1.00 H new ATOM 172 N VAL A 15 -18.186 8.040 12.669 1.00 1.00 N ATOM 173 CA VAL A 15 -18.700 9.183 13.465 1.00 1.00 C ATOM 174 C VAL A 15 -18.778 8.890 14.978 1.00 1.00 C ATOM 175 O VAL A 15 -19.550 9.487 15.728 1.00 1.00 O ATOM 176 CB VAL A 15 -20.014 9.688 12.817 1.00 1.00 C ATOM 177 CG1 VAL A 15 -21.205 8.742 13.027 1.00 1.00 C ATOM 178 CG2 VAL A 15 -20.396 11.117 13.222 1.00 1.00 C ATOM 0 H VAL A 15 -18.532 7.136 12.991 1.00 1.00 H new ATOM 0 HA VAL A 15 -17.984 10.004 13.431 1.00 1.00 H new ATOM 0 HB VAL A 15 -19.784 9.701 11.752 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -22.090 9.159 12.547 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -20.979 7.770 12.589 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -21.393 8.625 14.094 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -21.326 11.399 12.728 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -20.530 11.165 14.303 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -19.604 11.804 12.923 1.00 1.00 H new ATOM 188 N GLY A 16 -17.949 7.953 15.443 1.00 1.00 N ATOM 189 CA GLY A 16 -17.846 7.537 16.846 1.00 1.00 C ATOM 190 C GLY A 16 -16.839 6.404 17.056 1.00 1.00 C ATOM 191 O GLY A 16 -16.375 5.791 16.089 1.00 1.00 O ATOM 0 H GLY A 16 -17.308 7.445 14.833 1.00 1.00 H new ATOM 0 HA2 GLY A 16 -17.554 8.394 17.454 1.00 1.00 H new ATOM 0 HA3 GLY A 16 -18.826 7.216 17.198 1.00 1.00 H new ATOM 195 N LYS A 17 -16.502 6.110 18.320 1.00 1.00 N ATOM 196 CA LYS A 17 -15.526 5.062 18.689 1.00 1.00 C ATOM 197 C LYS A 17 -15.885 3.688 18.122 1.00 1.00 C ATOM 198 O LYS A 17 -15.020 2.988 17.599 1.00 1.00 O ATOM 199 CB LYS A 17 -15.356 4.966 20.215 1.00 1.00 C ATOM 200 CG LYS A 17 -14.965 6.298 20.867 1.00 1.00 C ATOM 201 CD LYS A 17 -14.310 6.064 22.236 1.00 1.00 C ATOM 202 CE LYS A 17 -13.928 7.393 22.900 1.00 1.00 C ATOM 203 NZ LYS A 17 -13.102 7.167 24.113 1.00 1.00 N ATOM 0 H LYS A 17 -16.900 6.594 19.125 1.00 1.00 H new ATOM 0 HA LYS A 17 -14.580 5.366 18.241 1.00 1.00 H new ATOM 0 HB2 LYS A 17 -16.288 4.614 20.656 1.00 1.00 H new ATOM 0 HB3 LYS A 17 -14.594 4.221 20.443 1.00 1.00 H new ATOM 0 HG2 LYS A 17 -14.276 6.838 20.217 1.00 1.00 H new ATOM 0 HG3 LYS A 17 -15.850 6.924 20.984 1.00 1.00 H new ATOM 0 HD2 LYS A 17 -14.996 5.515 22.882 1.00 1.00 H new ATOM 0 HD3 LYS A 17 -13.421 5.445 22.116 1.00 1.00 H new ATOM 0 HE2 LYS A 17 -13.377 8.012 22.192 1.00 1.00 H new ATOM 0 HE3 LYS A 17 -14.831 7.942 23.168 1.00 1.00 H new ATOM 0 HZ1 LYS A 17 -12.844 8.083 24.533 1.00 1.00 H new ATOM 0 HZ2 LYS A 17 -13.645 6.610 24.804 1.00 1.00 H new ATOM 0 HZ3 LYS A 17 -12.238 6.649 23.853 1.00 1.00 H new ATOM 217 N ASP A 18 -17.164 3.320 18.195 1.00 1.00 N ATOM 218 CA ASP A 18 -17.686 2.049 17.675 1.00 1.00 C ATOM 219 C ASP A 18 -17.493 1.922 16.156 1.00 1.00 C ATOM 220 O ASP A 18 -17.078 0.867 15.672 1.00 1.00 O ATOM 221 CB ASP A 18 -19.173 1.911 18.034 1.00 1.00 C ATOM 222 CG ASP A 18 -19.392 1.789 19.550 1.00 1.00 C ATOM 223 OD1 ASP A 18 -19.238 0.671 20.097 1.00 1.00 O ATOM 224 OD2 ASP A 18 -19.723 2.811 20.197 1.00 1.00 O ATOM 0 H ASP A 18 -17.882 3.904 18.624 1.00 1.00 H new ATOM 0 HA ASP A 18 -17.119 1.243 18.141 1.00 1.00 H new ATOM 0 HB2 ASP A 18 -19.718 2.777 17.658 1.00 1.00 H new ATOM 0 HB3 ASP A 18 -19.586 1.033 17.537 1.00 1.00 H new ATOM 229 N ALA A 19 -17.738 3.001 15.399 1.00 1.00 N ATOM 230 CA ALA A 19 -17.539 3.021 13.951 1.00 1.00 C ATOM 231 C ALA A 19 -16.048 2.928 13.589 1.00 1.00 C ATOM 232 O ALA A 19 -15.687 2.153 12.705 1.00 1.00 O ATOM 233 CB ALA A 19 -18.171 4.286 13.360 1.00 1.00 C ATOM 0 H ALA A 19 -18.080 3.884 15.779 1.00 1.00 H new ATOM 0 HA ALA A 19 -18.029 2.147 13.521 1.00 1.00 H new ATOM 0 HB1 ALA A 19 -18.021 4.298 12.280 1.00 1.00 H new ATOM 0 HB2 ALA A 19 -19.239 4.295 13.578 1.00 1.00 H new ATOM 0 HB3 ALA A 19 -17.703 5.166 13.801 1.00 1.00 H new ATOM 239 N VAL A 20 -15.175 3.670 14.285 1.00 1.00 N ATOM 240 CA VAL A 20 -13.717 3.606 14.064 1.00 1.00 C ATOM 241 C VAL A 20 -13.193 2.198 14.363 1.00 1.00 C ATOM 242 O VAL A 20 -12.451 1.637 13.559 1.00 1.00 O ATOM 243 CB VAL A 20 -12.965 4.671 14.889 1.00 1.00 C ATOM 244 CG1 VAL A 20 -11.444 4.487 14.795 1.00 1.00 C ATOM 245 CG2 VAL A 20 -13.295 6.081 14.382 1.00 1.00 C ATOM 0 H VAL A 20 -15.453 4.328 15.013 1.00 1.00 H new ATOM 0 HA VAL A 20 -13.528 3.828 13.014 1.00 1.00 H new ATOM 0 HB VAL A 20 -13.287 4.549 15.923 1.00 1.00 H new ATOM 0 HG11 VAL A 20 -10.947 5.255 15.388 1.00 1.00 H new ATOM 0 HG12 VAL A 20 -11.172 3.502 15.175 1.00 1.00 H new ATOM 0 HG13 VAL A 20 -11.131 4.573 13.755 1.00 1.00 H new ATOM 0 HG21 VAL A 20 -12.755 6.817 14.977 1.00 1.00 H new ATOM 0 HG22 VAL A 20 -12.998 6.171 13.337 1.00 1.00 H new ATOM 0 HG23 VAL A 20 -14.367 6.258 14.471 1.00 1.00 H new ATOM 255 N ASN A 21 -13.608 1.584 15.477 1.00 1.00 N ATOM 256 CA ASN A 21 -13.224 0.218 15.816 1.00 1.00 C ATOM 257 C ASN A 21 -13.712 -0.776 14.745 1.00 1.00 C ATOM 258 O ASN A 21 -12.924 -1.595 14.273 1.00 1.00 O ATOM 259 CB ASN A 21 -13.780 -0.095 17.211 1.00 1.00 C ATOM 260 CG ASN A 21 -13.567 -1.548 17.588 1.00 1.00 C ATOM 261 OD1 ASN A 21 -12.454 -2.053 17.630 1.00 1.00 O ATOM 262 ND2 ASN A 21 -14.636 -2.264 17.835 1.00 1.00 N ATOM 0 H ASN A 21 -14.219 2.024 16.165 1.00 1.00 H new ATOM 0 HA ASN A 21 -12.139 0.118 15.837 1.00 1.00 H new ATOM 0 HB2 ASN A 21 -13.296 0.546 17.948 1.00 1.00 H new ATOM 0 HB3 ASN A 21 -14.845 0.135 17.238 1.00 1.00 H new ATOM 0 HD21 ASN A 21 -14.545 -3.253 18.065 1.00 1.00 H new ATOM 0 HD22 ASN A 21 -15.559 -1.832 17.797 1.00 1.00 H new ATOM 269 N SER A 22 -14.975 -0.681 14.318 1.00 1.00 N ATOM 270 CA SER A 22 -15.535 -1.542 13.262 1.00 1.00 C ATOM 271 C SER A 22 -14.752 -1.408 11.950 1.00 1.00 C ATOM 272 O SER A 22 -14.402 -2.411 11.331 1.00 1.00 O ATOM 273 CB SER A 22 -17.014 -1.220 13.011 1.00 1.00 C ATOM 274 OG SER A 22 -17.787 -1.423 14.183 1.00 1.00 O ATOM 0 H SER A 22 -15.641 -0.006 14.693 1.00 1.00 H new ATOM 0 HA SER A 22 -15.450 -2.570 13.614 1.00 1.00 H new ATOM 0 HB2 SER A 22 -17.113 -0.186 12.681 1.00 1.00 H new ATOM 0 HB3 SER A 22 -17.395 -1.849 12.207 1.00 1.00 H new ATOM 0 HG SER A 22 -17.634 -0.684 14.808 1.00 1.00 H new ATOM 280 N LEU A 23 -14.414 -0.176 11.554 1.00 1.00 N ATOM 281 CA LEU A 23 -13.618 0.132 10.363 1.00 1.00 C ATOM 282 C LEU A 23 -12.220 -0.504 10.428 1.00 1.00 C ATOM 283 O LEU A 23 -11.765 -1.064 9.429 1.00 1.00 O ATOM 284 CB LEU A 23 -13.567 1.665 10.227 1.00 1.00 C ATOM 285 CG LEU A 23 -12.896 2.207 8.956 1.00 1.00 C ATOM 286 CD1 LEU A 23 -13.679 1.841 7.695 1.00 1.00 C ATOM 287 CD2 LEU A 23 -12.847 3.731 9.054 1.00 1.00 C ATOM 0 H LEU A 23 -14.696 0.658 12.069 1.00 1.00 H new ATOM 0 HA LEU A 23 -14.081 -0.298 9.475 1.00 1.00 H new ATOM 0 HB2 LEU A 23 -14.587 2.047 10.267 1.00 1.00 H new ATOM 0 HB3 LEU A 23 -13.041 2.069 11.092 1.00 1.00 H new ATOM 0 HG LEU A 23 -11.901 1.767 8.884 1.00 1.00 H new ATOM 0 HD11 LEU A 23 -13.169 2.244 6.820 1.00 1.00 H new ATOM 0 HD12 LEU A 23 -13.744 0.756 7.609 1.00 1.00 H new ATOM 0 HD13 LEU A 23 -14.683 2.261 7.755 1.00 1.00 H new ATOM 0 HD21 LEU A 23 -12.374 4.138 8.161 1.00 1.00 H new ATOM 0 HD22 LEU A 23 -13.861 4.123 9.138 1.00 1.00 H new ATOM 0 HD23 LEU A 23 -12.272 4.021 9.933 1.00 1.00 H new ATOM 299 N ILE A 24 -11.566 -0.470 11.596 1.00 1.00 N ATOM 300 CA ILE A 24 -10.264 -1.117 11.823 1.00 1.00 C ATOM 301 C ILE A 24 -10.415 -2.646 11.726 1.00 1.00 C ATOM 302 O ILE A 24 -9.650 -3.284 11.004 1.00 1.00 O ATOM 303 CB ILE A 24 -9.660 -0.681 13.181 1.00 1.00 C ATOM 304 CG1 ILE A 24 -9.280 0.819 13.172 1.00 1.00 C ATOM 305 CG2 ILE A 24 -8.405 -1.509 13.510 1.00 1.00 C ATOM 306 CD1 ILE A 24 -9.067 1.393 14.579 1.00 1.00 C ATOM 0 H ILE A 24 -11.928 0.012 12.419 1.00 1.00 H new ATOM 0 HA ILE A 24 -9.567 -0.797 11.048 1.00 1.00 H new ATOM 0 HB ILE A 24 -10.423 -0.851 13.941 1.00 1.00 H new ATOM 0 HG12 ILE A 24 -8.369 0.954 12.589 1.00 1.00 H new ATOM 0 HG13 ILE A 24 -10.066 1.384 12.670 1.00 1.00 H new ATOM 0 HG21 ILE A 24 -7.997 -1.186 14.468 1.00 1.00 H new ATOM 0 HG22 ILE A 24 -8.670 -2.565 13.566 1.00 1.00 H new ATOM 0 HG23 ILE A 24 -7.658 -1.363 12.730 1.00 1.00 H new ATOM 0 HD11 ILE A 24 -8.803 2.448 14.505 1.00 1.00 H new ATOM 0 HD12 ILE A 24 -9.985 1.288 15.158 1.00 1.00 H new ATOM 0 HD13 ILE A 24 -8.262 0.851 15.075 1.00 1.00 H new ATOM 318 N ARG A 25 -11.410 -3.242 12.405 1.00 1.00 N ATOM 319 CA ARG A 25 -11.696 -4.694 12.375 1.00 1.00 C ATOM 320 C ARG A 25 -11.947 -5.210 10.950 1.00 1.00 C ATOM 321 O ARG A 25 -11.399 -6.241 10.564 1.00 1.00 O ATOM 322 CB ARG A 25 -12.905 -5.021 13.280 1.00 1.00 C ATOM 323 CG ARG A 25 -12.583 -5.528 14.698 1.00 1.00 C ATOM 324 CD ARG A 25 -11.846 -4.547 15.620 1.00 1.00 C ATOM 325 NE ARG A 25 -10.380 -4.618 15.476 1.00 1.00 N ATOM 326 CZ ARG A 25 -9.496 -3.837 16.070 1.00 1.00 C ATOM 327 NH1 ARG A 25 -9.824 -2.808 16.797 1.00 1.00 N ATOM 328 NH2 ARG A 25 -8.230 -4.089 15.949 1.00 1.00 N ATOM 0 H ARG A 25 -12.052 -2.722 13.003 1.00 1.00 H new ATOM 0 HA ARG A 25 -10.810 -5.204 12.754 1.00 1.00 H new ATOM 0 HB2 ARG A 25 -13.517 -4.124 13.369 1.00 1.00 H new ATOM 0 HB3 ARG A 25 -13.513 -5.774 12.778 1.00 1.00 H new ATOM 0 HG2 ARG A 25 -13.518 -5.813 15.180 1.00 1.00 H new ATOM 0 HG3 ARG A 25 -11.981 -6.432 14.609 1.00 1.00 H new ATOM 0 HD2 ARG A 25 -12.179 -3.532 15.403 1.00 1.00 H new ATOM 0 HD3 ARG A 25 -12.115 -4.757 16.655 1.00 1.00 H new ATOM 0 HE ARG A 25 -10.013 -5.341 14.857 1.00 1.00 H new ATOM 0 HH11 ARG A 25 -10.807 -2.571 16.931 1.00 1.00 H new ATOM 0 HH12 ARG A 25 -9.098 -2.239 17.233 1.00 1.00 H new ATOM 0 HH21 ARG A 25 -7.920 -4.888 15.396 1.00 1.00 H new ATOM 0 HH22 ARG A 25 -7.544 -3.488 16.406 1.00 1.00 H new ATOM 342 N GLU A 26 -12.755 -4.497 10.167 1.00 1.00 N ATOM 343 CA GLU A 26 -13.094 -4.849 8.777 1.00 1.00 C ATOM 344 C GLU A 26 -11.935 -4.651 7.776 1.00 1.00 C ATOM 345 O GLU A 26 -12.005 -5.158 6.654 1.00 1.00 O ATOM 346 CB GLU A 26 -14.324 -4.042 8.323 1.00 1.00 C ATOM 347 CG GLU A 26 -15.617 -4.539 8.986 1.00 1.00 C ATOM 348 CD GLU A 26 -16.841 -3.746 8.484 1.00 1.00 C ATOM 349 OE1 GLU A 26 -17.383 -4.087 7.403 1.00 1.00 O ATOM 350 OE2 GLU A 26 -17.284 -2.792 9.167 1.00 1.00 O ATOM 0 H GLU A 26 -13.206 -3.638 10.483 1.00 1.00 H new ATOM 0 HA GLU A 26 -13.312 -5.917 8.777 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -14.175 -2.989 8.563 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -14.423 -4.111 7.240 1.00 1.00 H new ATOM 0 HG2 GLU A 26 -15.754 -5.599 8.772 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -15.535 -4.440 10.068 1.00 1.00 H new ATOM 357 N ASN A 27 -10.873 -3.931 8.158 1.00 1.00 N ATOM 358 CA ASN A 27 -9.711 -3.624 7.310 1.00 1.00 C ATOM 359 C ASN A 27 -8.365 -3.892 8.023 1.00 1.00 C ATOM 360 O ASN A 27 -7.394 -3.154 7.843 1.00 1.00 O ATOM 361 CB ASN A 27 -9.831 -2.175 6.812 1.00 1.00 C ATOM 362 CG ASN A 27 -11.069 -1.920 5.974 1.00 1.00 C ATOM 363 OD1 ASN A 27 -11.103 -2.174 4.778 1.00 1.00 O ATOM 364 ND2 ASN A 27 -12.119 -1.409 6.575 1.00 1.00 N ATOM 0 H ASN A 27 -10.795 -3.533 9.094 1.00 1.00 H new ATOM 0 HA ASN A 27 -9.714 -4.298 6.453 1.00 1.00 H new ATOM 0 HB2 ASN A 27 -9.840 -1.504 7.671 1.00 1.00 H new ATOM 0 HB3 ASN A 27 -8.947 -1.928 6.224 1.00 1.00 H new ATOM 0 HD21 ASN A 27 -12.970 -1.222 6.044 1.00 1.00 H new ATOM 0 HD22 ASN A 27 -12.084 -1.200 7.573 1.00 1.00 H new ATOM 371 N SER A 28 -8.298 -4.944 8.847 1.00 1.00 N ATOM 372 CA SER A 28 -7.110 -5.334 9.632 1.00 1.00 C ATOM 373 C SER A 28 -5.815 -5.530 8.821 1.00 1.00 C ATOM 374 O SER A 28 -4.716 -5.492 9.381 1.00 1.00 O ATOM 375 CB SER A 28 -7.420 -6.596 10.444 1.00 1.00 C ATOM 376 OG SER A 28 -7.758 -7.677 9.587 1.00 1.00 O ATOM 0 H SER A 28 -9.090 -5.569 8.994 1.00 1.00 H new ATOM 0 HA SER A 28 -6.904 -4.486 10.285 1.00 1.00 H new ATOM 0 HB2 SER A 28 -6.556 -6.864 11.052 1.00 1.00 H new ATOM 0 HB3 SER A 28 -8.243 -6.399 11.130 1.00 1.00 H new ATOM 0 HG SER A 28 -7.951 -8.473 10.125 1.00 1.00 H new ATOM 382 N HIS A 29 -5.919 -5.708 7.499 1.00 1.00 N ATOM 383 CA HIS A 29 -4.800 -5.841 6.559 1.00 1.00 C ATOM 384 C HIS A 29 -4.098 -4.506 6.232 1.00 1.00 C ATOM 385 O HIS A 29 -2.986 -4.523 5.699 1.00 1.00 O ATOM 386 CB HIS A 29 -5.317 -6.512 5.274 1.00 1.00 C ATOM 387 CG HIS A 29 -6.368 -5.723 4.521 1.00 1.00 C ATOM 388 ND1 HIS A 29 -7.625 -5.354 5.014 1.00 1.00 N ATOM 389 CD2 HIS A 29 -6.258 -5.285 3.233 1.00 1.00 C ATOM 390 CE1 HIS A 29 -8.237 -4.696 4.013 1.00 1.00 C ATOM 391 NE2 HIS A 29 -7.438 -4.639 2.935 1.00 1.00 N ATOM 0 H HIS A 29 -6.825 -5.766 7.035 1.00 1.00 H new ATOM 0 HA HIS A 29 -4.039 -6.456 7.039 1.00 1.00 H new ATOM 0 HB2 HIS A 29 -4.472 -6.690 4.609 1.00 1.00 H new ATOM 0 HB3 HIS A 29 -5.731 -7.487 5.532 1.00 1.00 H new ATOM 0 HD2 HIS A 29 -5.411 -5.419 2.576 1.00 1.00 H new ATOM 0 HE1 HIS A 29 -9.229 -4.274 4.068 1.00 1.00 H new ATOM 0 HE2 HIS A 29 -7.666 -4.193 2.046 1.00 1.00 H new ATOM 399 N ILE A 30 -4.722 -3.362 6.546 1.00 1.00 N ATOM 400 CA ILE A 30 -4.204 -2.000 6.280 1.00 1.00 C ATOM 401 C ILE A 30 -4.374 -1.010 7.446 1.00 1.00 C ATOM 402 O ILE A 30 -3.638 -0.022 7.512 1.00 1.00 O ATOM 403 CB ILE A 30 -4.839 -1.403 4.999 1.00 1.00 C ATOM 404 CG1 ILE A 30 -6.386 -1.456 5.030 1.00 1.00 C ATOM 405 CG2 ILE A 30 -4.260 -2.079 3.746 1.00 1.00 C ATOM 406 CD1 ILE A 30 -7.080 -0.748 3.860 1.00 1.00 C ATOM 0 H ILE A 30 -5.632 -3.352 7.008 1.00 1.00 H new ATOM 0 HA ILE A 30 -3.131 -2.135 6.144 1.00 1.00 H new ATOM 0 HB ILE A 30 -4.577 -0.346 4.960 1.00 1.00 H new ATOM 0 HG12 ILE A 30 -6.699 -2.500 5.041 1.00 1.00 H new ATOM 0 HG13 ILE A 30 -6.732 -1.010 5.962 1.00 1.00 H new ATOM 0 HG21 ILE A 30 -4.717 -1.647 2.856 1.00 1.00 H new ATOM 0 HG22 ILE A 30 -3.182 -1.922 3.713 1.00 1.00 H new ATOM 0 HG23 ILE A 30 -4.470 -3.148 3.780 1.00 1.00 H new ATOM 0 HD11 ILE A 30 -8.161 -0.839 3.969 1.00 1.00 H new ATOM 0 HD12 ILE A 30 -6.803 0.306 3.857 1.00 1.00 H new ATOM 0 HD13 ILE A 30 -6.770 -1.207 2.921 1.00 1.00 H new ATOM 418 N PHE A 31 -5.301 -1.257 8.372 1.00 1.00 N ATOM 419 CA PHE A 31 -5.582 -0.416 9.542 1.00 1.00 C ATOM 420 C PHE A 31 -5.365 -1.214 10.837 1.00 1.00 C ATOM 421 O PHE A 31 -5.504 -2.439 10.862 1.00 1.00 O ATOM 422 CB PHE A 31 -7.050 0.062 9.500 1.00 1.00 C ATOM 423 CG PHE A 31 -7.543 0.858 8.297 1.00 1.00 C ATOM 424 CD1 PHE A 31 -6.671 1.510 7.400 1.00 1.00 C ATOM 425 CD2 PHE A 31 -8.932 0.942 8.082 1.00 1.00 C ATOM 426 CE1 PHE A 31 -7.180 2.149 6.255 1.00 1.00 C ATOM 427 CE2 PHE A 31 -9.443 1.580 6.940 1.00 1.00 C ATOM 428 CZ PHE A 31 -8.565 2.164 6.014 1.00 1.00 C ATOM 0 H PHE A 31 -5.902 -2.080 8.328 1.00 1.00 H new ATOM 0 HA PHE A 31 -4.907 0.439 9.522 1.00 1.00 H new ATOM 0 HB2 PHE A 31 -7.684 -0.820 9.591 1.00 1.00 H new ATOM 0 HB3 PHE A 31 -7.221 0.671 10.388 1.00 1.00 H new ATOM 0 HD1 PHE A 31 -5.608 1.519 7.593 1.00 1.00 H new ATOM 0 HD2 PHE A 31 -9.611 0.511 8.803 1.00 1.00 H new ATOM 0 HE1 PHE A 31 -6.506 2.629 5.560 1.00 1.00 H new ATOM 0 HE2 PHE A 31 -10.509 1.621 6.775 1.00 1.00 H new ATOM 0 HZ PHE A 31 -8.953 2.624 5.117 1.00 1.00 H new ATOM 438 N SER A 32 -5.049 -0.521 11.930 1.00 1.00 N ATOM 439 CA SER A 32 -4.845 -1.110 13.259 1.00 1.00 C ATOM 440 C SER A 32 -5.079 -0.073 14.362 1.00 1.00 C ATOM 441 O SER A 32 -5.199 1.125 14.101 1.00 1.00 O ATOM 442 CB SER A 32 -3.434 -1.706 13.375 1.00 1.00 C ATOM 443 OG SER A 32 -2.455 -0.688 13.352 1.00 1.00 O ATOM 0 H SER A 32 -4.924 0.491 11.919 1.00 1.00 H new ATOM 0 HA SER A 32 -5.573 -1.911 13.387 1.00 1.00 H new ATOM 0 HB2 SER A 32 -3.350 -2.276 14.300 1.00 1.00 H new ATOM 0 HB3 SER A 32 -3.260 -2.402 12.555 1.00 1.00 H new ATOM 0 HG SER A 32 -2.710 -0.003 12.699 1.00 1.00 H new ATOM 449 N ASP A 33 -5.129 -0.519 15.618 1.00 1.00 N ATOM 450 CA ASP A 33 -5.331 0.369 16.770 1.00 1.00 C ATOM 451 C ASP A 33 -4.158 1.338 17.030 1.00 1.00 C ATOM 452 O ASP A 33 -4.296 2.250 17.848 1.00 1.00 O ATOM 453 CB ASP A 33 -5.622 -0.469 18.021 1.00 1.00 C ATOM 454 CG ASP A 33 -6.852 -1.353 17.818 1.00 1.00 C ATOM 455 OD1 ASP A 33 -7.989 -0.824 17.797 1.00 1.00 O ATOM 456 OD2 ASP A 33 -6.689 -2.577 17.629 1.00 1.00 O ATOM 0 H ASP A 33 -5.031 -1.503 15.868 1.00 1.00 H new ATOM 0 HA ASP A 33 -6.186 1.001 16.529 1.00 1.00 H new ATOM 0 HB2 ASP A 33 -4.758 -1.091 18.255 1.00 1.00 H new ATOM 0 HB3 ASP A 33 -5.781 0.190 18.875 1.00 1.00 H new ATOM 461 N THR A 34 -3.013 1.150 16.356 1.00 1.00 N ATOM 462 CA THR A 34 -1.786 1.951 16.535 1.00 1.00 C ATOM 463 C THR A 34 -1.111 2.420 15.236 1.00 1.00 C ATOM 464 O THR A 34 -0.084 3.097 15.311 1.00 1.00 O ATOM 465 CB THR A 34 -0.757 1.199 17.399 1.00 1.00 C ATOM 466 OG1 THR A 34 -0.454 -0.059 16.828 1.00 1.00 O ATOM 467 CG2 THR A 34 -1.251 0.956 18.828 1.00 1.00 C ATOM 0 H THR A 34 -2.909 0.419 15.653 1.00 1.00 H new ATOM 0 HA THR A 34 -2.130 2.854 17.039 1.00 1.00 H new ATOM 0 HB THR A 34 0.127 1.836 17.435 1.00 1.00 H new ATOM 0 HG1 THR A 34 0.203 -0.523 17.388 1.00 1.00 H new ATOM 0 HG21 THR A 34 -0.486 0.423 19.392 1.00 1.00 H new ATOM 0 HG22 THR A 34 -1.456 1.912 19.310 1.00 1.00 H new ATOM 0 HG23 THR A 34 -2.163 0.360 18.801 1.00 1.00 H new ATOM 475 N GLN A 35 -1.646 2.117 14.046 1.00 1.00 N ATOM 476 CA GLN A 35 -1.061 2.532 12.757 1.00 1.00 C ATOM 477 C GLN A 35 -2.044 2.420 11.573 1.00 1.00 C ATOM 478 O GLN A 35 -2.819 1.465 11.487 1.00 1.00 O ATOM 479 CB GLN A 35 0.161 1.625 12.469 1.00 1.00 C ATOM 480 CG GLN A 35 1.048 2.079 11.296 1.00 1.00 C ATOM 481 CD GLN A 35 2.077 1.013 10.927 1.00 1.00 C ATOM 482 OE1 GLN A 35 1.745 -0.055 10.427 1.00 1.00 O ATOM 483 NE2 GLN A 35 3.354 1.248 11.141 1.00 1.00 N ATOM 0 H GLN A 35 -2.503 1.573 13.946 1.00 1.00 H new ATOM 0 HA GLN A 35 -0.787 3.583 12.846 1.00 1.00 H new ATOM 0 HB2 GLN A 35 0.774 1.571 13.369 1.00 1.00 H new ATOM 0 HB3 GLN A 35 -0.195 0.615 12.265 1.00 1.00 H new ATOM 0 HG2 GLN A 35 0.423 2.298 10.430 1.00 1.00 H new ATOM 0 HG3 GLN A 35 1.560 3.004 11.562 1.00 1.00 H new ATOM 0 HE21 GLN A 35 3.647 2.132 11.557 1.00 1.00 H new ATOM 0 HE22 GLN A 35 4.051 0.546 10.891 1.00 1.00 H new ATOM 492 N CYS A 36 -1.927 3.335 10.607 1.00 1.00 N ATOM 493 CA CYS A 36 -2.645 3.309 9.324 1.00 1.00 C ATOM 494 C CYS A 36 -1.615 3.185 8.188 1.00 1.00 C ATOM 495 O CYS A 36 -0.812 4.100 7.978 1.00 1.00 O ATOM 496 CB CYS A 36 -3.476 4.588 9.144 1.00 1.00 C ATOM 497 SG CYS A 36 -4.388 4.642 7.576 1.00 1.00 S ATOM 0 H CYS A 36 -1.310 4.142 10.697 1.00 1.00 H new ATOM 0 HA CYS A 36 -3.326 2.458 9.305 1.00 1.00 H new ATOM 0 HB2 CYS A 36 -4.183 4.672 9.970 1.00 1.00 H new ATOM 0 HB3 CYS A 36 -2.815 5.453 9.201 1.00 1.00 H new ATOM 502 N LYS A 37 -1.619 2.070 7.446 1.00 1.00 N ATOM 503 CA LYS A 37 -0.664 1.819 6.346 1.00 1.00 C ATOM 504 C LYS A 37 -0.981 2.588 5.061 1.00 1.00 C ATOM 505 O LYS A 37 -0.046 2.998 4.377 1.00 1.00 O ATOM 506 CB LYS A 37 -0.551 0.314 6.076 1.00 1.00 C ATOM 507 CG LYS A 37 0.173 -0.390 7.234 1.00 1.00 C ATOM 508 CD LYS A 37 0.306 -1.887 6.941 1.00 1.00 C ATOM 509 CE LYS A 37 1.262 -2.622 7.894 1.00 1.00 C ATOM 510 NZ LYS A 37 0.864 -2.509 9.322 1.00 1.00 N ATOM 0 H LYS A 37 -2.285 1.311 7.588 1.00 1.00 H new ATOM 0 HA LYS A 37 0.300 2.202 6.682 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -1.545 -0.114 5.948 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -0.009 0.146 5.145 1.00 1.00 H new ATOM 0 HG2 LYS A 37 1.160 0.049 7.376 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -0.379 -0.241 8.162 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -0.679 -2.349 7.002 1.00 1.00 H new ATOM 0 HD3 LYS A 37 0.656 -2.018 5.917 1.00 1.00 H new ATOM 0 HE2 LYS A 37 1.303 -3.675 7.617 1.00 1.00 H new ATOM 0 HE3 LYS A 37 2.268 -2.221 7.771 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 1.287 -3.290 9.863 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 1.198 -1.601 9.705 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -0.172 -2.557 9.398 1.00 1.00 H new ATOM 524 N VAL A 38 -2.259 2.843 4.745 1.00 1.00 N ATOM 525 CA VAL A 38 -2.659 3.636 3.554 1.00 1.00 C ATOM 526 C VAL A 38 -2.102 5.062 3.630 1.00 1.00 C ATOM 527 O VAL A 38 -1.667 5.618 2.622 1.00 1.00 O ATOM 528 CB VAL A 38 -4.192 3.673 3.370 1.00 1.00 C ATOM 529 CG1 VAL A 38 -4.624 4.548 2.185 1.00 1.00 C ATOM 530 CG2 VAL A 38 -4.735 2.264 3.113 1.00 1.00 C ATOM 0 H VAL A 38 -3.048 2.511 5.300 1.00 1.00 H new ATOM 0 HA VAL A 38 -2.231 3.137 2.685 1.00 1.00 H new ATOM 0 HB VAL A 38 -4.593 4.093 4.292 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -5.711 4.538 2.102 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -4.282 5.571 2.344 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -4.187 4.158 1.266 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -5.817 2.309 2.986 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -4.280 1.858 2.210 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -4.496 1.622 3.960 1.00 1.00 H new ATOM 540 N CYS A 39 -2.079 5.641 4.831 1.00 1.00 N ATOM 541 CA CYS A 39 -1.558 6.975 5.119 1.00 1.00 C ATOM 542 C CYS A 39 -0.135 6.936 5.720 1.00 1.00 C ATOM 543 O CYS A 39 0.396 7.976 6.114 1.00 1.00 O ATOM 544 CB CYS A 39 -2.575 7.645 6.043 1.00 1.00 C ATOM 545 SG CYS A 39 -4.246 7.733 5.335 1.00 1.00 S ATOM 0 H CYS A 39 -2.438 5.173 5.663 1.00 1.00 H new ATOM 0 HA CYS A 39 -1.442 7.551 4.201 1.00 1.00 H new ATOM 0 HB2 CYS A 39 -2.616 7.097 6.984 1.00 1.00 H new ATOM 0 HB3 CYS A 39 -2.234 8.654 6.276 1.00 1.00 H new ATOM 550 N SER A 40 0.469 5.739 5.778 1.00 1.00 N ATOM 551 CA SER A 40 1.798 5.404 6.317 1.00 1.00 C ATOM 552 C SER A 40 2.175 6.214 7.566 1.00 1.00 C ATOM 553 O SER A 40 3.217 6.876 7.619 1.00 1.00 O ATOM 554 CB SER A 40 2.874 5.488 5.219 1.00 1.00 C ATOM 555 OG SER A 40 2.491 4.804 4.034 1.00 1.00 O ATOM 0 H SER A 40 -0.000 4.908 5.418 1.00 1.00 H new ATOM 0 HA SER A 40 1.744 4.370 6.657 1.00 1.00 H new ATOM 0 HB2 SER A 40 3.070 6.534 4.985 1.00 1.00 H new ATOM 0 HB3 SER A 40 3.806 5.066 5.594 1.00 1.00 H new ATOM 0 HG SER A 40 1.746 4.199 4.232 1.00 1.00 H new ATOM 561 N ALA A 41 1.291 6.179 8.565 1.00 1.00 N ATOM 562 CA ALA A 41 1.410 6.948 9.806 1.00 1.00 C ATOM 563 C ALA A 41 1.053 6.138 11.062 1.00 1.00 C ATOM 564 O ALA A 41 0.163 5.284 11.051 1.00 1.00 O ATOM 565 CB ALA A 41 0.512 8.188 9.685 1.00 1.00 C ATOM 0 H ALA A 41 0.451 5.601 8.533 1.00 1.00 H new ATOM 0 HA ALA A 41 2.455 7.233 9.932 1.00 1.00 H new ATOM 0 HB1 ALA A 41 0.583 8.779 10.598 1.00 1.00 H new ATOM 0 HB2 ALA A 41 0.836 8.791 8.837 1.00 1.00 H new ATOM 0 HB3 ALA A 41 -0.521 7.876 9.534 1.00 1.00 H new ATOM 571 N VAL A 42 1.742 6.444 12.164 1.00 1.00 N ATOM 572 CA VAL A 42 1.538 5.833 13.488 1.00 1.00 C ATOM 573 C VAL A 42 0.462 6.611 14.256 1.00 1.00 C ATOM 574 O VAL A 42 0.305 7.823 14.098 1.00 1.00 O ATOM 575 CB VAL A 42 2.876 5.792 14.265 1.00 1.00 C ATOM 576 CG1 VAL A 42 2.755 5.226 15.687 1.00 1.00 C ATOM 577 CG2 VAL A 42 3.900 4.918 13.525 1.00 1.00 C ATOM 0 H VAL A 42 2.482 7.146 12.164 1.00 1.00 H new ATOM 0 HA VAL A 42 1.192 4.806 13.369 1.00 1.00 H new ATOM 0 HB VAL A 42 3.192 6.833 14.331 1.00 1.00 H new ATOM 0 HG11 VAL A 42 3.735 5.231 16.165 1.00 1.00 H new ATOM 0 HG12 VAL A 42 2.066 5.841 16.266 1.00 1.00 H new ATOM 0 HG13 VAL A 42 2.379 4.204 15.641 1.00 1.00 H new ATOM 0 HG21 VAL A 42 4.835 4.900 14.085 1.00 1.00 H new ATOM 0 HG22 VAL A 42 3.513 3.903 13.432 1.00 1.00 H new ATOM 0 HG23 VAL A 42 4.080 5.330 12.532 1.00 1.00 H new ATOM 587 N LEU A 43 -0.284 5.897 15.098 1.00 1.00 N ATOM 588 CA LEU A 43 -1.412 6.367 15.904 1.00 1.00 C ATOM 589 C LEU A 43 -1.102 6.061 17.382 1.00 1.00 C ATOM 590 O LEU A 43 -1.562 5.070 17.945 1.00 1.00 O ATOM 591 CB LEU A 43 -2.708 5.709 15.372 1.00 1.00 C ATOM 592 CG LEU A 43 -2.961 5.903 13.861 1.00 1.00 C ATOM 593 CD1 LEU A 43 -4.139 5.054 13.391 1.00 1.00 C ATOM 594 CD2 LEU A 43 -3.240 7.363 13.514 1.00 1.00 C ATOM 0 H LEU A 43 -0.104 4.904 15.246 1.00 1.00 H new ATOM 0 HA LEU A 43 -1.565 7.444 15.830 1.00 1.00 H new ATOM 0 HB2 LEU A 43 -2.670 4.641 15.585 1.00 1.00 H new ATOM 0 HB3 LEU A 43 -3.557 6.114 15.923 1.00 1.00 H new ATOM 0 HG LEU A 43 -2.051 5.587 13.351 1.00 1.00 H new ATOM 0 HD11 LEU A 43 -4.296 5.209 12.324 1.00 1.00 H new ATOM 0 HD12 LEU A 43 -3.926 4.001 13.577 1.00 1.00 H new ATOM 0 HD13 LEU A 43 -5.037 5.345 13.936 1.00 1.00 H new ATOM 0 HD21 LEU A 43 -3.412 7.456 12.442 1.00 1.00 H new ATOM 0 HD22 LEU A 43 -4.123 7.703 14.054 1.00 1.00 H new ATOM 0 HD23 LEU A 43 -2.383 7.975 13.798 1.00 1.00 H new ATOM 606 N ILE A 44 -0.236 6.889 17.977 1.00 1.00 N ATOM 607 CA ILE A 44 0.323 6.743 19.341 1.00 1.00 C ATOM 608 C ILE A 44 -0.680 6.519 20.491 1.00 1.00 C ATOM 609 O ILE A 44 -0.286 6.005 21.542 1.00 1.00 O ATOM 610 CB ILE A 44 1.270 7.921 19.671 1.00 1.00 C ATOM 611 CG1 ILE A 44 0.529 9.279 19.673 1.00 1.00 C ATOM 612 CG2 ILE A 44 2.471 7.924 18.706 1.00 1.00 C ATOM 613 CD1 ILE A 44 1.381 10.453 20.173 1.00 1.00 C ATOM 0 H ILE A 44 0.116 7.722 17.504 1.00 1.00 H new ATOM 0 HA ILE A 44 0.870 5.802 19.291 1.00 1.00 H new ATOM 0 HB ILE A 44 1.646 7.778 20.684 1.00 1.00 H new ATOM 0 HG12 ILE A 44 0.187 9.496 18.661 1.00 1.00 H new ATOM 0 HG13 ILE A 44 -0.360 9.196 20.299 1.00 1.00 H new ATOM 0 HG21 ILE A 44 3.130 8.758 18.948 1.00 1.00 H new ATOM 0 HG22 ILE A 44 3.019 6.987 18.805 1.00 1.00 H new ATOM 0 HG23 ILE A 44 2.114 8.029 17.681 1.00 1.00 H new ATOM 0 HD11 ILE A 44 0.791 11.369 20.144 1.00 1.00 H new ATOM 0 HD12 ILE A 44 1.702 10.260 21.197 1.00 1.00 H new ATOM 0 HD13 ILE A 44 2.257 10.565 19.534 1.00 1.00 H new ATOM 625 N SER A 45 -1.957 6.869 20.316 1.00 1.00 N ATOM 626 CA SER A 45 -3.027 6.668 21.304 1.00 1.00 C ATOM 627 C SER A 45 -4.403 6.617 20.634 1.00 1.00 C ATOM 628 O SER A 45 -4.549 6.934 19.449 1.00 1.00 O ATOM 629 CB SER A 45 -3.011 7.795 22.344 1.00 1.00 C ATOM 630 OG SER A 45 -3.683 7.381 23.525 1.00 1.00 O ATOM 0 H SER A 45 -2.287 7.313 19.459 1.00 1.00 H new ATOM 0 HA SER A 45 -2.844 5.713 21.796 1.00 1.00 H new ATOM 0 HB2 SER A 45 -1.982 8.069 22.579 1.00 1.00 H new ATOM 0 HB3 SER A 45 -3.492 8.684 21.936 1.00 1.00 H new ATOM 0 HG SER A 45 -3.666 8.107 24.183 1.00 1.00 H new ATOM 636 N GLU A 46 -5.434 6.258 21.403 1.00 1.00 N ATOM 637 CA GLU A 46 -6.822 6.183 20.936 1.00 1.00 C ATOM 638 C GLU A 46 -7.297 7.522 20.352 1.00 1.00 C ATOM 639 O GLU A 46 -7.915 7.526 19.292 1.00 1.00 O ATOM 640 CB GLU A 46 -7.723 5.723 22.095 1.00 1.00 C ATOM 641 CG GLU A 46 -9.170 5.466 21.652 1.00 1.00 C ATOM 642 CD GLU A 46 -10.039 4.985 22.829 1.00 1.00 C ATOM 643 OE1 GLU A 46 -10.016 3.773 23.150 1.00 1.00 O ATOM 644 OE2 GLU A 46 -10.764 5.817 23.428 1.00 1.00 O ATOM 0 H GLU A 46 -5.326 6.007 22.386 1.00 1.00 H new ATOM 0 HA GLU A 46 -6.882 5.454 20.128 1.00 1.00 H new ATOM 0 HB2 GLU A 46 -7.313 4.811 22.529 1.00 1.00 H new ATOM 0 HB3 GLU A 46 -7.716 6.481 22.879 1.00 1.00 H new ATOM 0 HG2 GLU A 46 -9.593 6.380 21.235 1.00 1.00 H new ATOM 0 HG3 GLU A 46 -9.182 4.718 20.859 1.00 1.00 H new ATOM 651 N SER A 47 -6.980 8.662 20.975 1.00 1.00 N ATOM 652 CA SER A 47 -7.380 9.985 20.463 1.00 1.00 C ATOM 653 C SER A 47 -6.831 10.265 19.059 1.00 1.00 C ATOM 654 O SER A 47 -7.569 10.743 18.196 1.00 1.00 O ATOM 655 CB SER A 47 -6.941 11.104 21.412 1.00 1.00 C ATOM 656 OG SER A 47 -7.363 10.849 22.746 1.00 1.00 O ATOM 0 H SER A 47 -6.443 8.699 21.842 1.00 1.00 H new ATOM 0 HA SER A 47 -8.468 9.966 20.402 1.00 1.00 H new ATOM 0 HB2 SER A 47 -5.856 11.201 21.385 1.00 1.00 H new ATOM 0 HB3 SER A 47 -7.355 12.054 21.073 1.00 1.00 H new ATOM 0 HG SER A 47 -7.067 11.580 23.328 1.00 1.00 H new ATOM 662 N GLN A 48 -5.561 9.925 18.794 1.00 1.00 N ATOM 663 CA GLN A 48 -4.961 10.067 17.462 1.00 1.00 C ATOM 664 C GLN A 48 -5.642 9.121 16.468 1.00 1.00 C ATOM 665 O GLN A 48 -5.959 9.541 15.356 1.00 1.00 O ATOM 666 CB GLN A 48 -3.442 9.807 17.492 1.00 1.00 C ATOM 667 CG GLN A 48 -2.629 11.009 18.004 1.00 1.00 C ATOM 668 CD GLN A 48 -2.800 11.304 19.495 1.00 1.00 C ATOM 669 OE1 GLN A 48 -3.044 10.430 20.313 1.00 1.00 O ATOM 670 NE2 GLN A 48 -2.686 12.548 19.911 1.00 1.00 N ATOM 0 H GLN A 48 -4.924 9.546 19.495 1.00 1.00 H new ATOM 0 HA GLN A 48 -5.115 11.096 17.138 1.00 1.00 H new ATOM 0 HB2 GLN A 48 -3.241 8.944 18.127 1.00 1.00 H new ATOM 0 HB3 GLN A 48 -3.104 9.550 16.488 1.00 1.00 H new ATOM 0 HG2 GLN A 48 -1.573 10.830 17.801 1.00 1.00 H new ATOM 0 HG3 GLN A 48 -2.917 11.894 17.436 1.00 1.00 H new ATOM 0 HE21 GLN A 48 -2.483 13.292 19.244 1.00 1.00 H new ATOM 0 HE22 GLN A 48 -2.801 12.767 20.900 1.00 1.00 H new ATOM 679 N LYS A 49 -5.920 7.868 16.865 1.00 1.00 N ATOM 680 CA LYS A 49 -6.629 6.897 16.009 1.00 1.00 C ATOM 681 C LYS A 49 -8.031 7.402 15.641 1.00 1.00 C ATOM 682 O LYS A 49 -8.395 7.414 14.466 1.00 1.00 O ATOM 683 CB LYS A 49 -6.590 5.488 16.658 1.00 1.00 C ATOM 684 CG LYS A 49 -7.937 4.837 17.028 1.00 1.00 C ATOM 685 CD LYS A 49 -7.732 3.448 17.649 1.00 1.00 C ATOM 686 CE LYS A 49 -9.082 2.865 18.085 1.00 1.00 C ATOM 687 NZ LYS A 49 -8.938 1.581 18.826 1.00 1.00 N ATOM 0 H LYS A 49 -5.663 7.500 17.781 1.00 1.00 H new ATOM 0 HA LYS A 49 -6.115 6.798 15.053 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -6.069 4.817 15.975 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -5.987 5.552 17.564 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -8.472 5.476 17.730 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -8.559 4.751 16.137 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -7.256 2.784 16.927 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -7.063 3.519 18.507 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -9.599 3.588 18.715 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -9.706 2.705 17.206 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -9.870 1.273 19.171 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -8.547 0.856 18.191 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -8.297 1.716 19.634 1.00 1.00 H new ATOM 701 N LEU A 50 -8.787 7.883 16.627 1.00 1.00 N ATOM 702 CA LEU A 50 -10.132 8.437 16.449 1.00 1.00 C ATOM 703 C LEU A 50 -10.129 9.649 15.510 1.00 1.00 C ATOM 704 O LEU A 50 -10.979 9.733 14.626 1.00 1.00 O ATOM 705 CB LEU A 50 -10.739 8.790 17.821 1.00 1.00 C ATOM 706 CG LEU A 50 -11.120 7.574 18.690 1.00 1.00 C ATOM 707 CD1 LEU A 50 -11.655 8.051 20.038 1.00 1.00 C ATOM 708 CD2 LEU A 50 -12.196 6.690 18.065 1.00 1.00 C ATOM 0 H LEU A 50 -8.474 7.899 17.598 1.00 1.00 H new ATOM 0 HA LEU A 50 -10.755 7.677 15.976 1.00 1.00 H new ATOM 0 HB2 LEU A 50 -10.026 9.403 18.372 1.00 1.00 H new ATOM 0 HB3 LEU A 50 -11.629 9.400 17.663 1.00 1.00 H new ATOM 0 HG LEU A 50 -10.208 6.986 18.791 1.00 1.00 H new ATOM 0 HD11 LEU A 50 -11.923 7.189 20.649 1.00 1.00 H new ATOM 0 HD12 LEU A 50 -10.888 8.633 20.549 1.00 1.00 H new ATOM 0 HD13 LEU A 50 -12.537 8.672 19.880 1.00 1.00 H new ATOM 0 HD21 LEU A 50 -12.413 5.855 18.731 1.00 1.00 H new ATOM 0 HD22 LEU A 50 -13.102 7.275 17.909 1.00 1.00 H new ATOM 0 HD23 LEU A 50 -11.842 6.308 17.108 1.00 1.00 H new ATOM 720 N ALA A 51 -9.182 10.577 15.666 1.00 1.00 N ATOM 721 CA ALA A 51 -9.079 11.745 14.792 1.00 1.00 C ATOM 722 C ALA A 51 -8.647 11.372 13.363 1.00 1.00 C ATOM 723 O ALA A 51 -9.217 11.882 12.397 1.00 1.00 O ATOM 724 CB ALA A 51 -8.108 12.746 15.432 1.00 1.00 C ATOM 0 H ALA A 51 -8.471 10.540 16.396 1.00 1.00 H new ATOM 0 HA ALA A 51 -10.065 12.199 14.691 1.00 1.00 H new ATOM 0 HB1 ALA A 51 -8.018 13.625 14.794 1.00 1.00 H new ATOM 0 HB2 ALA A 51 -8.486 13.045 16.410 1.00 1.00 H new ATOM 0 HB3 ALA A 51 -7.129 12.280 15.548 1.00 1.00 H new ATOM 730 N HIS A 52 -7.669 10.471 13.214 1.00 1.00 N ATOM 731 CA HIS A 52 -7.171 10.038 11.909 1.00 1.00 C ATOM 732 C HIS A 52 -8.247 9.318 11.084 1.00 1.00 C ATOM 733 O HIS A 52 -8.491 9.697 9.940 1.00 1.00 O ATOM 734 CB HIS A 52 -5.934 9.148 12.109 1.00 1.00 C ATOM 735 CG HIS A 52 -5.213 8.836 10.822 1.00 1.00 C ATOM 736 ND1 HIS A 52 -4.059 9.441 10.372 1.00 1.00 N ATOM 737 CD2 HIS A 52 -5.591 7.930 9.867 1.00 1.00 C ATOM 738 CE1 HIS A 52 -3.758 8.927 9.168 1.00 1.00 C ATOM 739 NE2 HIS A 52 -4.671 8.008 8.817 1.00 1.00 N ATOM 0 H HIS A 52 -7.201 10.021 14.001 1.00 1.00 H new ATOM 0 HA HIS A 52 -6.892 10.924 11.338 1.00 1.00 H new ATOM 0 HB2 HIS A 52 -5.245 9.643 12.793 1.00 1.00 H new ATOM 0 HB3 HIS A 52 -6.238 8.215 12.583 1.00 1.00 H new ATOM 0 HD1 HIS A 52 -3.526 10.155 10.868 1.00 1.00 H new ATOM 0 HD2 HIS A 52 -6.447 7.273 9.916 1.00 1.00 H new ATOM 0 HE1 HIS A 52 -2.905 9.212 8.569 1.00 1.00 H new ATOM 747 N TYR A 53 -8.923 8.311 11.651 1.00 1.00 N ATOM 748 CA TYR A 53 -9.953 7.550 10.929 1.00 1.00 C ATOM 749 C TYR A 53 -11.213 8.368 10.586 1.00 1.00 C ATOM 750 O TYR A 53 -11.866 8.078 9.584 1.00 1.00 O ATOM 751 CB TYR A 53 -10.269 6.249 11.685 1.00 1.00 C ATOM 752 CG TYR A 53 -9.141 5.227 11.599 1.00 1.00 C ATOM 753 CD1 TYR A 53 -8.750 4.744 10.337 1.00 1.00 C ATOM 754 CD2 TYR A 53 -8.456 4.785 12.747 1.00 1.00 C ATOM 755 CE1 TYR A 53 -7.637 3.894 10.207 1.00 1.00 C ATOM 756 CE2 TYR A 53 -7.349 3.919 12.628 1.00 1.00 C ATOM 757 CZ TYR A 53 -6.921 3.494 11.353 1.00 1.00 C ATOM 758 OH TYR A 53 -5.819 2.708 11.224 1.00 1.00 O ATOM 0 H TYR A 53 -8.775 8.003 12.612 1.00 1.00 H new ATOM 0 HA TYR A 53 -9.539 7.291 9.954 1.00 1.00 H new ATOM 0 HB2 TYR A 53 -10.464 6.481 12.732 1.00 1.00 H new ATOM 0 HB3 TYR A 53 -11.181 5.811 11.280 1.00 1.00 H new ATOM 0 HD1 TYR A 53 -9.310 5.029 9.459 1.00 1.00 H new ATOM 0 HD2 TYR A 53 -8.780 5.111 13.724 1.00 1.00 H new ATOM 0 HE1 TYR A 53 -7.332 3.548 9.230 1.00 1.00 H new ATOM 0 HE2 TYR A 53 -6.829 3.582 13.513 1.00 1.00 H new ATOM 0 HH TYR A 53 -5.443 2.525 12.110 1.00 1.00 H new ATOM 768 N GLN A 54 -11.541 9.411 11.362 1.00 1.00 N ATOM 769 CA GLN A 54 -12.677 10.308 11.083 1.00 1.00 C ATOM 770 C GLN A 54 -12.313 11.472 10.131 1.00 1.00 C ATOM 771 O GLN A 54 -13.206 12.177 9.656 1.00 1.00 O ATOM 772 CB GLN A 54 -13.250 10.852 12.405 1.00 1.00 C ATOM 773 CG GLN A 54 -13.917 9.752 13.250 1.00 1.00 C ATOM 774 CD GLN A 54 -14.456 10.287 14.572 1.00 1.00 C ATOM 775 OE1 GLN A 54 -15.649 10.475 14.769 1.00 1.00 O ATOM 776 NE2 GLN A 54 -13.593 10.547 15.529 1.00 1.00 N ATOM 0 H GLN A 54 -11.024 9.659 12.206 1.00 1.00 H new ATOM 0 HA GLN A 54 -13.433 9.715 10.568 1.00 1.00 H new ATOM 0 HB2 GLN A 54 -12.449 11.315 12.982 1.00 1.00 H new ATOM 0 HB3 GLN A 54 -13.979 11.633 12.188 1.00 1.00 H new ATOM 0 HG2 GLN A 54 -14.732 9.304 12.682 1.00 1.00 H new ATOM 0 HG3 GLN A 54 -13.194 8.960 13.448 1.00 1.00 H new ATOM 0 HE21 GLN A 54 -12.597 10.393 15.373 1.00 1.00 H new ATOM 0 HE22 GLN A 54 -13.920 10.903 16.427 1.00 1.00 H new ATOM 785 N SER A 55 -11.024 11.700 9.847 1.00 1.00 N ATOM 786 CA SER A 55 -10.549 12.779 8.965 1.00 1.00 C ATOM 787 C SER A 55 -10.929 12.594 7.488 1.00 1.00 C ATOM 788 O SER A 55 -10.831 11.497 6.925 1.00 1.00 O ATOM 789 CB SER A 55 -9.024 12.903 9.066 1.00 1.00 C ATOM 790 OG SER A 55 -8.564 13.959 8.236 1.00 1.00 O ATOM 0 H SER A 55 -10.268 11.132 10.229 1.00 1.00 H new ATOM 0 HA SER A 55 -11.047 13.684 9.313 1.00 1.00 H new ATOM 0 HB2 SER A 55 -8.734 13.090 10.100 1.00 1.00 H new ATOM 0 HB3 SER A 55 -8.555 11.965 8.768 1.00 1.00 H new ATOM 0 HG SER A 55 -7.589 14.031 8.309 1.00 1.00 H new ATOM 796 N ARG A 56 -11.289 13.703 6.823 1.00 1.00 N ATOM 797 CA ARG A 56 -11.583 13.752 5.377 1.00 1.00 C ATOM 798 C ARG A 56 -10.351 13.403 4.532 1.00 1.00 C ATOM 799 O ARG A 56 -10.494 12.778 3.481 1.00 1.00 O ATOM 800 CB ARG A 56 -12.128 15.141 4.989 1.00 1.00 C ATOM 801 CG ARG A 56 -13.477 15.502 5.635 1.00 1.00 C ATOM 802 CD ARG A 56 -14.639 14.631 5.133 1.00 1.00 C ATOM 803 NE ARG A 56 -15.915 15.010 5.773 1.00 1.00 N ATOM 804 CZ ARG A 56 -16.833 15.843 5.311 1.00 1.00 C ATOM 805 NH1 ARG A 56 -16.701 16.470 4.176 1.00 1.00 N ATOM 806 NH2 ARG A 56 -17.919 16.066 5.993 1.00 1.00 N ATOM 0 H ARG A 56 -11.386 14.609 7.281 1.00 1.00 H new ATOM 0 HA ARG A 56 -12.345 13.000 5.169 1.00 1.00 H new ATOM 0 HB2 ARG A 56 -11.393 15.896 5.267 1.00 1.00 H new ATOM 0 HB3 ARG A 56 -12.235 15.185 3.905 1.00 1.00 H new ATOM 0 HG2 ARG A 56 -13.394 15.398 6.717 1.00 1.00 H new ATOM 0 HG3 ARG A 56 -13.702 16.549 5.432 1.00 1.00 H new ATOM 0 HD2 ARG A 56 -14.729 14.731 4.051 1.00 1.00 H new ATOM 0 HD3 ARG A 56 -14.425 13.582 5.339 1.00 1.00 H new ATOM 0 HE ARG A 56 -16.111 14.579 6.677 1.00 1.00 H new ATOM 0 HH11 ARG A 56 -15.866 16.326 3.608 1.00 1.00 H new ATOM 0 HH12 ARG A 56 -17.433 17.104 3.856 1.00 1.00 H new ATOM 0 HH21 ARG A 56 -18.065 15.598 6.887 1.00 1.00 H new ATOM 0 HH22 ARG A 56 -18.624 16.709 5.633 1.00 1.00 H new ATOM 820 N LYS A 57 -9.143 13.752 5.001 1.00 1.00 N ATOM 821 CA LYS A 57 -7.868 13.441 4.325 1.00 1.00 C ATOM 822 C LYS A 57 -7.646 11.929 4.232 1.00 1.00 C ATOM 823 O LYS A 57 -7.324 11.421 3.158 1.00 1.00 O ATOM 824 CB LYS A 57 -6.718 14.140 5.079 1.00 1.00 C ATOM 825 CG LYS A 57 -5.323 13.950 4.454 1.00 1.00 C ATOM 826 CD LYS A 57 -5.150 14.513 3.032 1.00 1.00 C ATOM 827 CE LYS A 57 -5.363 16.033 2.987 1.00 1.00 C ATOM 828 NZ LYS A 57 -5.070 16.591 1.641 1.00 1.00 N ATOM 0 H LYS A 57 -9.020 14.266 5.873 1.00 1.00 H new ATOM 0 HA LYS A 57 -7.899 13.815 3.302 1.00 1.00 H new ATOM 0 HB2 LYS A 57 -6.934 15.207 5.133 1.00 1.00 H new ATOM 0 HB3 LYS A 57 -6.695 13.768 6.103 1.00 1.00 H new ATOM 0 HG2 LYS A 57 -4.586 14.421 5.104 1.00 1.00 H new ATOM 0 HG3 LYS A 57 -5.096 12.884 4.434 1.00 1.00 H new ATOM 0 HD2 LYS A 57 -4.151 14.276 2.667 1.00 1.00 H new ATOM 0 HD3 LYS A 57 -5.858 14.027 2.361 1.00 1.00 H new ATOM 0 HE2 LYS A 57 -6.393 16.264 3.260 1.00 1.00 H new ATOM 0 HE3 LYS A 57 -4.722 16.512 3.727 1.00 1.00 H new ATOM 0 HZ1 LYS A 57 -5.225 17.619 1.650 1.00 1.00 H new ATOM 0 HZ2 LYS A 57 -4.080 16.392 1.391 1.00 1.00 H new ATOM 0 HZ3 LYS A 57 -5.699 16.152 0.939 1.00 1.00 H new ATOM 842 N HIS A 58 -7.886 11.207 5.332 1.00 1.00 N ATOM 843 CA HIS A 58 -7.792 9.741 5.383 1.00 1.00 C ATOM 844 C HIS A 58 -8.807 9.101 4.433 1.00 1.00 C ATOM 845 O HIS A 58 -8.436 8.270 3.607 1.00 1.00 O ATOM 846 CB HIS A 58 -8.017 9.263 6.827 1.00 1.00 C ATOM 847 CG HIS A 58 -8.233 7.774 6.946 1.00 1.00 C ATOM 848 ND1 HIS A 58 -7.230 6.812 7.069 1.00 1.00 N ATOM 849 CD2 HIS A 58 -9.443 7.143 6.882 1.00 1.00 C ATOM 850 CE1 HIS A 58 -7.857 5.625 7.069 1.00 1.00 C ATOM 851 NE2 HIS A 58 -9.186 5.793 6.960 1.00 1.00 N ATOM 0 H HIS A 58 -8.154 11.627 6.222 1.00 1.00 H new ATOM 0 HA HIS A 58 -6.797 9.435 5.060 1.00 1.00 H new ATOM 0 HB2 HIS A 58 -7.156 9.546 7.432 1.00 1.00 H new ATOM 0 HB3 HIS A 58 -8.882 9.781 7.241 1.00 1.00 H new ATOM 0 HD2 HIS A 58 -10.412 7.612 6.789 1.00 1.00 H new ATOM 0 HE1 HIS A 58 -7.362 4.668 7.146 1.00 1.00 H new ATOM 0 HE2 HIS A 58 -9.883 5.049 6.939 1.00 1.00 H new ATOM 859 N ALA A 59 -10.075 9.523 4.499 1.00 1.00 N ATOM 860 CA ALA A 59 -11.132 9.003 3.632 1.00 1.00 C ATOM 861 C ALA A 59 -10.819 9.199 2.139 1.00 1.00 C ATOM 862 O ALA A 59 -10.968 8.264 1.352 1.00 1.00 O ATOM 863 CB ALA A 59 -12.455 9.656 4.032 1.00 1.00 C ATOM 0 H ALA A 59 -10.395 10.235 5.156 1.00 1.00 H new ATOM 0 HA ALA A 59 -11.204 7.924 3.770 1.00 1.00 H new ATOM 0 HB1 ALA A 59 -13.254 9.279 3.394 1.00 1.00 H new ATOM 0 HB2 ALA A 59 -12.678 9.419 5.072 1.00 1.00 H new ATOM 0 HB3 ALA A 59 -12.377 10.737 3.915 1.00 1.00 H new ATOM 869 N ASN A 60 -10.337 10.385 1.741 1.00 1.00 N ATOM 870 CA ASN A 60 -9.954 10.653 0.354 1.00 1.00 C ATOM 871 C ASN A 60 -8.768 9.773 -0.089 1.00 1.00 C ATOM 872 O ASN A 60 -8.802 9.208 -1.183 1.00 1.00 O ATOM 873 CB ASN A 60 -9.652 12.149 0.185 1.00 1.00 C ATOM 874 CG ASN A 60 -9.429 12.504 -1.277 1.00 1.00 C ATOM 875 OD1 ASN A 60 -10.249 12.215 -2.140 1.00 1.00 O ATOM 876 ND2 ASN A 60 -8.322 13.127 -1.612 1.00 1.00 N ATOM 0 H ASN A 60 -10.204 11.178 2.369 1.00 1.00 H new ATOM 0 HA ASN A 60 -10.788 10.392 -0.298 1.00 1.00 H new ATOM 0 HB2 ASN A 60 -10.479 12.737 0.582 1.00 1.00 H new ATOM 0 HB3 ASN A 60 -8.767 12.412 0.765 1.00 1.00 H new ATOM 0 HD21 ASN A 60 -8.148 13.368 -2.588 1.00 1.00 H new ATOM 0 HD22 ASN A 60 -7.637 13.369 -0.896 1.00 1.00 H new ATOM 883 N LYS A 61 -7.735 9.607 0.754 1.00 1.00 N ATOM 884 CA LYS A 61 -6.587 8.743 0.447 1.00 1.00 C ATOM 885 C LYS A 61 -7.006 7.276 0.304 1.00 1.00 C ATOM 886 O LYS A 61 -6.581 6.612 -0.639 1.00 1.00 O ATOM 887 CB LYS A 61 -5.489 8.940 1.503 1.00 1.00 C ATOM 888 CG LYS A 61 -4.124 8.659 0.868 1.00 1.00 C ATOM 889 CD LYS A 61 -2.984 8.834 1.878 1.00 1.00 C ATOM 890 CE LYS A 61 -1.600 8.834 1.210 1.00 1.00 C ATOM 891 NZ LYS A 61 -1.261 7.527 0.588 1.00 1.00 N ATOM 0 H LYS A 61 -7.674 10.066 1.663 1.00 1.00 H new ATOM 0 HA LYS A 61 -6.177 9.033 -0.520 1.00 1.00 H new ATOM 0 HB2 LYS A 61 -5.520 9.958 1.892 1.00 1.00 H new ATOM 0 HB3 LYS A 61 -5.655 8.271 2.347 1.00 1.00 H new ATOM 0 HG2 LYS A 61 -4.108 7.643 0.473 1.00 1.00 H new ATOM 0 HG3 LYS A 61 -3.969 9.331 0.024 1.00 1.00 H new ATOM 0 HD2 LYS A 61 -3.123 9.770 2.419 1.00 1.00 H new ATOM 0 HD3 LYS A 61 -3.029 8.031 2.614 1.00 1.00 H new ATOM 0 HE2 LYS A 61 -1.569 9.613 0.448 1.00 1.00 H new ATOM 0 HE3 LYS A 61 -0.843 9.085 1.953 1.00 1.00 H new ATOM 0 HZ1 LYS A 61 -0.261 7.527 0.304 1.00 1.00 H new ATOM 0 HZ2 LYS A 61 -1.426 6.763 1.274 1.00 1.00 H new ATOM 0 HZ3 LYS A 61 -1.859 7.375 -0.249 1.00 1.00 H new ATOM 905 N VAL A 62 -7.889 6.783 1.181 1.00 1.00 N ATOM 906 CA VAL A 62 -8.459 5.424 1.097 1.00 1.00 C ATOM 907 C VAL A 62 -9.276 5.265 -0.187 1.00 1.00 C ATOM 908 O VAL A 62 -9.115 4.262 -0.878 1.00 1.00 O ATOM 909 CB VAL A 62 -9.285 5.088 2.353 1.00 1.00 C ATOM 910 CG1 VAL A 62 -10.070 3.775 2.227 1.00 1.00 C ATOM 911 CG2 VAL A 62 -8.350 4.934 3.558 1.00 1.00 C ATOM 0 H VAL A 62 -8.234 7.318 1.978 1.00 1.00 H new ATOM 0 HA VAL A 62 -7.639 4.707 1.057 1.00 1.00 H new ATOM 0 HB VAL A 62 -9.991 5.909 2.477 1.00 1.00 H new ATOM 0 HG11 VAL A 62 -10.630 3.597 3.145 1.00 1.00 H new ATOM 0 HG12 VAL A 62 -10.761 3.844 1.387 1.00 1.00 H new ATOM 0 HG13 VAL A 62 -9.376 2.951 2.059 1.00 1.00 H new ATOM 0 HG21 VAL A 62 -8.936 4.696 4.446 1.00 1.00 H new ATOM 0 HG22 VAL A 62 -7.639 4.130 3.367 1.00 1.00 H new ATOM 0 HG23 VAL A 62 -7.809 5.866 3.720 1.00 1.00 H new ATOM 921 N ARG A 63 -10.096 6.256 -0.567 1.00 1.00 N ATOM 922 CA ARG A 63 -10.859 6.252 -1.831 1.00 1.00 C ATOM 923 C ARG A 63 -9.927 6.131 -3.047 1.00 1.00 C ATOM 924 O ARG A 63 -10.191 5.331 -3.945 1.00 1.00 O ATOM 925 CB ARG A 63 -11.736 7.512 -1.879 1.00 1.00 C ATOM 926 CG ARG A 63 -12.589 7.599 -3.152 1.00 1.00 C ATOM 927 CD ARG A 63 -13.619 8.728 -3.052 1.00 1.00 C ATOM 928 NE ARG A 63 -12.998 10.069 -2.990 1.00 1.00 N ATOM 929 CZ ARG A 63 -13.634 11.227 -2.994 1.00 1.00 C ATOM 930 NH1 ARG A 63 -14.932 11.308 -3.084 1.00 1.00 N ATOM 931 NH2 ARG A 63 -12.970 12.341 -2.902 1.00 1.00 N ATOM 0 H ARG A 63 -10.252 7.091 -0.003 1.00 1.00 H new ATOM 0 HA ARG A 63 -11.508 5.377 -1.871 1.00 1.00 H new ATOM 0 HB2 ARG A 63 -12.391 7.526 -1.008 1.00 1.00 H new ATOM 0 HB3 ARG A 63 -11.099 8.394 -1.814 1.00 1.00 H new ATOM 0 HG2 ARG A 63 -11.944 7.767 -4.014 1.00 1.00 H new ATOM 0 HG3 ARG A 63 -13.100 6.650 -3.316 1.00 1.00 H new ATOM 0 HD2 ARG A 63 -14.286 8.682 -3.913 1.00 1.00 H new ATOM 0 HD3 ARG A 63 -14.233 8.576 -2.164 1.00 1.00 H new ATOM 0 HE ARG A 63 -11.980 10.103 -2.939 1.00 1.00 H new ATOM 0 HH11 ARG A 63 -15.492 10.459 -3.155 1.00 1.00 H new ATOM 0 HH12 ARG A 63 -15.387 12.221 -3.084 1.00 1.00 H new ATOM 0 HH21 ARG A 63 -11.953 12.324 -2.826 1.00 1.00 H new ATOM 0 HH22 ARG A 63 -13.466 13.232 -2.906 1.00 1.00 H new ATOM 945 N ARG A 64 -8.809 6.872 -3.048 1.00 1.00 N ATOM 946 CA ARG A 64 -7.774 6.823 -4.101 1.00 1.00 C ATOM 947 C ARG A 64 -7.099 5.444 -4.139 1.00 1.00 C ATOM 948 O ARG A 64 -6.981 4.847 -5.205 1.00 1.00 O ATOM 949 CB ARG A 64 -6.764 7.971 -3.871 1.00 1.00 C ATOM 950 CG ARG A 64 -6.145 8.557 -5.153 1.00 1.00 C ATOM 951 CD ARG A 64 -5.341 7.558 -5.993 1.00 1.00 C ATOM 952 NE ARG A 64 -4.663 8.225 -7.124 1.00 1.00 N ATOM 953 CZ ARG A 64 -3.440 8.726 -7.150 1.00 1.00 C ATOM 954 NH1 ARG A 64 -2.652 8.704 -6.112 1.00 1.00 N ATOM 955 NH2 ARG A 64 -2.978 9.270 -8.239 1.00 1.00 N ATOM 0 H ARG A 64 -8.591 7.536 -2.305 1.00 1.00 H new ATOM 0 HA ARG A 64 -8.232 6.966 -5.079 1.00 1.00 H new ATOM 0 HB2 ARG A 64 -7.265 8.772 -3.328 1.00 1.00 H new ATOM 0 HB3 ARG A 64 -5.961 7.606 -3.231 1.00 1.00 H new ATOM 0 HG2 ARG A 64 -6.944 8.969 -5.770 1.00 1.00 H new ATOM 0 HG3 ARG A 64 -5.494 9.387 -4.879 1.00 1.00 H new ATOM 0 HD2 ARG A 64 -4.601 7.064 -5.363 1.00 1.00 H new ATOM 0 HD3 ARG A 64 -6.006 6.782 -6.372 1.00 1.00 H new ATOM 0 HE ARG A 64 -5.202 8.309 -7.986 1.00 1.00 H new ATOM 0 HH11 ARG A 64 -2.972 8.289 -5.237 1.00 1.00 H new ATOM 0 HH12 ARG A 64 -1.715 9.102 -6.175 1.00 1.00 H new ATOM 0 HH21 ARG A 64 -3.560 9.311 -9.076 1.00 1.00 H new ATOM 0 HH22 ARG A 64 -2.034 9.656 -8.256 1.00 1.00 H new ATOM 969 N TYR A 65 -6.701 4.914 -2.982 1.00 1.00 N ATOM 970 CA TYR A 65 -6.087 3.587 -2.840 1.00 1.00 C ATOM 971 C TYR A 65 -7.023 2.458 -3.317 1.00 1.00 C ATOM 972 O TYR A 65 -6.601 1.574 -4.064 1.00 1.00 O ATOM 973 CB TYR A 65 -5.670 3.405 -1.373 1.00 1.00 C ATOM 974 CG TYR A 65 -5.094 2.043 -1.037 1.00 1.00 C ATOM 975 CD1 TYR A 65 -3.784 1.713 -1.434 1.00 1.00 C ATOM 976 CD2 TYR A 65 -5.873 1.105 -0.331 1.00 1.00 C ATOM 977 CE1 TYR A 65 -3.255 0.443 -1.131 1.00 1.00 C ATOM 978 CE2 TYR A 65 -5.349 -0.167 -0.028 1.00 1.00 C ATOM 979 CZ TYR A 65 -4.037 -0.502 -0.431 1.00 1.00 C ATOM 980 OH TYR A 65 -3.518 -1.730 -0.153 1.00 1.00 O ATOM 0 H TYR A 65 -6.798 5.405 -2.093 1.00 1.00 H new ATOM 0 HA TYR A 65 -5.208 3.525 -3.481 1.00 1.00 H new ATOM 0 HB2 TYR A 65 -4.932 4.167 -1.123 1.00 1.00 H new ATOM 0 HB3 TYR A 65 -6.539 3.582 -0.739 1.00 1.00 H new ATOM 0 HD1 TYR A 65 -3.185 2.434 -1.971 1.00 1.00 H new ATOM 0 HD2 TYR A 65 -6.875 1.362 -0.021 1.00 1.00 H new ATOM 0 HE1 TYR A 65 -2.250 0.192 -1.435 1.00 1.00 H new ATOM 0 HE2 TYR A 65 -5.949 -0.885 0.511 1.00 1.00 H new ATOM 0 HH TYR A 65 -4.181 -2.263 0.334 1.00 1.00 H new ATOM 990 N MET A 66 -8.308 2.507 -2.946 1.00 1.00 N ATOM 991 CA MET A 66 -9.327 1.538 -3.372 1.00 1.00 C ATOM 992 C MET A 66 -9.502 1.521 -4.899 1.00 1.00 C ATOM 993 O MET A 66 -9.674 0.453 -5.482 1.00 1.00 O ATOM 994 CB MET A 66 -10.666 1.830 -2.674 1.00 1.00 C ATOM 995 CG MET A 66 -10.639 1.361 -1.215 1.00 1.00 C ATOM 996 SD MET A 66 -10.630 -0.446 -1.025 1.00 1.00 S ATOM 997 CE MET A 66 -9.576 -0.585 0.440 1.00 1.00 C ATOM 0 H MET A 66 -8.676 3.233 -2.331 1.00 1.00 H new ATOM 0 HA MET A 66 -8.983 0.547 -3.077 1.00 1.00 H new ATOM 0 HB2 MET A 66 -10.874 2.899 -2.712 1.00 1.00 H new ATOM 0 HB3 MET A 66 -11.474 1.328 -3.206 1.00 1.00 H new ATOM 0 HG2 MET A 66 -9.755 1.773 -0.727 1.00 1.00 H new ATOM 0 HG3 MET A 66 -11.508 1.767 -0.697 1.00 1.00 H new ATOM 0 HE1 MET A 66 -9.458 -1.636 0.705 1.00 1.00 H new ATOM 0 HE2 MET A 66 -8.598 -0.153 0.227 1.00 1.00 H new ATOM 0 HE3 MET A 66 -10.036 -0.050 1.271 1.00 1.00 H new ATOM 1007 N ALA A 67 -9.391 2.673 -5.572 1.00 1.00 N ATOM 1008 CA ALA A 67 -9.451 2.775 -7.036 1.00 1.00 C ATOM 1009 C ALA A 67 -8.239 2.129 -7.762 1.00 1.00 C ATOM 1010 O ALA A 67 -8.217 2.068 -8.993 1.00 1.00 O ATOM 1011 CB ALA A 67 -9.614 4.255 -7.409 1.00 1.00 C ATOM 0 H ALA A 67 -9.255 3.572 -5.110 1.00 1.00 H new ATOM 0 HA ALA A 67 -10.310 2.199 -7.380 1.00 1.00 H new ATOM 0 HB1 ALA A 67 -9.661 4.354 -8.493 1.00 1.00 H new ATOM 0 HB2 ALA A 67 -10.533 4.642 -6.969 1.00 1.00 H new ATOM 0 HB3 ALA A 67 -8.764 4.822 -7.029 1.00 1.00 H new ATOM 1017 N ILE A 68 -7.237 1.644 -7.013 1.00 1.00 N ATOM 1018 CA ILE A 68 -5.993 1.010 -7.495 1.00 1.00 C ATOM 1019 C ILE A 68 -5.919 -0.473 -7.029 1.00 1.00 C ATOM 1020 O ILE A 68 -4.942 -1.175 -7.288 1.00 1.00 O ATOM 1021 CB ILE A 68 -4.777 1.904 -7.086 1.00 1.00 C ATOM 1022 CG1 ILE A 68 -4.940 3.339 -7.660 1.00 1.00 C ATOM 1023 CG2 ILE A 68 -3.415 1.341 -7.550 1.00 1.00 C ATOM 1024 CD1 ILE A 68 -3.907 4.370 -7.180 1.00 1.00 C ATOM 0 H ILE A 68 -7.272 1.685 -5.994 1.00 1.00 H new ATOM 0 HA ILE A 68 -5.972 0.951 -8.583 1.00 1.00 H new ATOM 0 HB ILE A 68 -4.776 1.919 -5.996 1.00 1.00 H new ATOM 0 HG12 ILE A 68 -4.892 3.283 -8.748 1.00 1.00 H new ATOM 0 HG13 ILE A 68 -5.935 3.702 -7.403 1.00 1.00 H new ATOM 0 HG21 ILE A 68 -2.617 2.012 -7.232 1.00 1.00 H new ATOM 0 HG22 ILE A 68 -3.259 0.356 -7.109 1.00 1.00 H new ATOM 0 HG23 ILE A 68 -3.407 1.257 -8.637 1.00 1.00 H new ATOM 0 HD11 ILE A 68 -4.114 5.335 -7.642 1.00 1.00 H new ATOM 0 HD12 ILE A 68 -3.966 4.466 -6.096 1.00 1.00 H new ATOM 0 HD13 ILE A 68 -2.907 4.041 -7.461 1.00 1.00 H new ATOM 1036 N ASN A 69 -6.968 -1.002 -6.381 1.00 1.00 N ATOM 1037 CA ASN A 69 -7.056 -2.389 -5.880 1.00 1.00 C ATOM 1038 C ASN A 69 -7.059 -3.519 -6.950 1.00 1.00 C ATOM 1039 O ASN A 69 -7.206 -4.692 -6.595 1.00 1.00 O ATOM 1040 CB ASN A 69 -8.262 -2.501 -4.923 1.00 1.00 C ATOM 1041 CG ASN A 69 -9.632 -2.589 -5.595 1.00 1.00 C ATOM 1042 OD1 ASN A 69 -9.799 -2.478 -6.803 1.00 1.00 O ATOM 1043 ND2 ASN A 69 -10.670 -2.810 -4.819 1.00 1.00 N ATOM 0 H ASN A 69 -7.809 -0.460 -6.183 1.00 1.00 H new ATOM 0 HA ASN A 69 -6.119 -2.570 -5.353 1.00 1.00 H new ATOM 0 HB2 ASN A 69 -8.126 -3.384 -4.298 1.00 1.00 H new ATOM 0 HB3 ASN A 69 -8.258 -1.637 -4.259 1.00 1.00 H new ATOM 0 HD21 ASN A 69 -11.603 -2.887 -5.225 1.00 1.00 H new ATOM 0 HD22 ASN A 69 -10.543 -2.904 -3.811 1.00 1.00 H new ATOM 1050 N GLN A 70 -6.915 -3.193 -8.241 1.00 1.00 N ATOM 1051 CA GLN A 70 -6.888 -4.138 -9.368 1.00 1.00 C ATOM 1052 C GLN A 70 -5.789 -5.217 -9.218 1.00 1.00 C ATOM 1053 O GLN A 70 -4.727 -4.974 -8.633 1.00 1.00 O ATOM 1054 CB GLN A 70 -6.725 -3.320 -10.665 1.00 1.00 C ATOM 1055 CG GLN A 70 -6.883 -4.149 -11.952 1.00 1.00 C ATOM 1056 CD GLN A 70 -6.866 -3.308 -13.233 1.00 1.00 C ATOM 1057 OE1 GLN A 70 -6.539 -2.127 -13.257 1.00 1.00 O ATOM 1058 NE2 GLN A 70 -7.221 -3.887 -14.361 1.00 1.00 N ATOM 0 H GLN A 70 -6.810 -2.224 -8.543 1.00 1.00 H new ATOM 0 HA GLN A 70 -7.824 -4.696 -9.394 1.00 1.00 H new ATOM 0 HB2 GLN A 70 -7.461 -2.516 -10.670 1.00 1.00 H new ATOM 0 HB3 GLN A 70 -5.741 -2.851 -10.666 1.00 1.00 H new ATOM 0 HG2 GLN A 70 -6.080 -4.885 -12.000 1.00 1.00 H new ATOM 0 HG3 GLN A 70 -7.821 -4.703 -11.904 1.00 1.00 H new ATOM 0 HE21 GLN A 70 -7.497 -4.869 -14.365 1.00 1.00 H new ATOM 0 HE22 GLN A 70 -7.220 -3.354 -15.230 1.00 1.00 H new ATOM 1067 N GLY A 71 -6.035 -6.410 -9.768 1.00 1.00 N ATOM 1068 CA GLY A 71 -5.125 -7.562 -9.725 1.00 1.00 C ATOM 1069 C GLY A 71 -5.377 -8.584 -10.843 1.00 1.00 C ATOM 1070 O GLY A 71 -5.936 -8.254 -11.892 1.00 1.00 O ATOM 0 H GLY A 71 -6.900 -6.608 -10.272 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -4.097 -7.206 -9.794 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -5.226 -8.059 -8.760 1.00 1.00 H new ATOM 1074 N GLU A 72 -4.941 -9.828 -10.621 1.00 1.00 N ATOM 1075 CA GLU A 72 -5.069 -10.962 -11.540 1.00 1.00 C ATOM 1076 C GLU A 72 -6.529 -11.249 -11.953 1.00 1.00 C ATOM 1077 O GLU A 72 -7.486 -10.962 -11.230 1.00 1.00 O ATOM 1078 CB GLU A 72 -4.406 -12.187 -10.874 1.00 1.00 C ATOM 1079 CG GLU A 72 -4.290 -13.456 -11.735 1.00 1.00 C ATOM 1080 CD GLU A 72 -3.477 -13.218 -13.022 1.00 1.00 C ATOM 1081 OE1 GLU A 72 -4.063 -12.735 -14.021 1.00 1.00 O ATOM 1082 OE2 GLU A 72 -2.255 -13.504 -13.040 1.00 1.00 O ATOM 0 H GLU A 72 -4.467 -10.083 -9.755 1.00 1.00 H new ATOM 0 HA GLU A 72 -4.563 -10.719 -12.474 1.00 1.00 H new ATOM 0 HB2 GLU A 72 -3.405 -11.900 -10.552 1.00 1.00 H new ATOM 0 HB3 GLU A 72 -4.971 -12.435 -9.975 1.00 1.00 H new ATOM 0 HG2 GLU A 72 -3.818 -14.246 -11.151 1.00 1.00 H new ATOM 0 HG3 GLU A 72 -5.288 -13.806 -11.998 1.00 1.00 H new ATOM 1089 N ASP A 73 -6.679 -11.848 -13.131 1.00 1.00 N ATOM 1090 CA ASP A 73 -7.939 -12.251 -13.781 1.00 1.00 C ATOM 1091 C ASP A 73 -8.622 -13.480 -13.121 1.00 1.00 C ATOM 1092 O ASP A 73 -9.006 -14.445 -13.788 1.00 1.00 O ATOM 1093 CB ASP A 73 -7.661 -12.447 -15.285 1.00 1.00 C ATOM 1094 CG ASP A 73 -8.942 -12.613 -16.127 1.00 1.00 C ATOM 1095 OD1 ASP A 73 -9.939 -11.891 -15.880 1.00 1.00 O ATOM 1096 OD2 ASP A 73 -8.942 -13.432 -17.079 1.00 1.00 O ATOM 0 H ASP A 73 -5.869 -12.085 -13.704 1.00 1.00 H new ATOM 0 HA ASP A 73 -8.673 -11.456 -13.646 1.00 1.00 H new ATOM 0 HB2 ASP A 73 -7.098 -11.591 -15.658 1.00 1.00 H new ATOM 0 HB3 ASP A 73 -7.030 -13.326 -15.419 1.00 1.00 H new ATOM 1101 N SER A 74 -8.760 -13.461 -11.793 1.00 1.00 N ATOM 1102 CA SER A 74 -9.381 -14.511 -10.971 1.00 1.00 C ATOM 1103 C SER A 74 -10.037 -13.907 -9.720 1.00 1.00 C ATOM 1104 O SER A 74 -9.527 -12.939 -9.148 1.00 1.00 O ATOM 1105 CB SER A 74 -8.319 -15.539 -10.565 1.00 1.00 C ATOM 1106 OG SER A 74 -8.923 -16.638 -9.901 1.00 1.00 O ATOM 0 H SER A 74 -8.427 -12.677 -11.232 1.00 1.00 H new ATOM 0 HA SER A 74 -10.157 -15.003 -11.558 1.00 1.00 H new ATOM 0 HB2 SER A 74 -7.785 -15.889 -11.449 1.00 1.00 H new ATOM 0 HB3 SER A 74 -7.582 -15.072 -9.912 1.00 1.00 H new ATOM 0 HG SER A 74 -8.233 -17.287 -9.649 1.00 1.00 H new ATOM 1112 N VAL A 75 -11.172 -14.469 -9.286 1.00 1.00 N ATOM 1113 CA VAL A 75 -11.946 -14.006 -8.118 1.00 1.00 C ATOM 1114 C VAL A 75 -12.741 -15.170 -7.484 1.00 1.00 C ATOM 1115 O VAL A 75 -13.336 -15.964 -8.219 1.00 1.00 O ATOM 1116 CB VAL A 75 -12.860 -12.827 -8.543 1.00 1.00 C ATOM 1117 CG1 VAL A 75 -13.981 -13.206 -9.522 1.00 1.00 C ATOM 1118 CG2 VAL A 75 -13.477 -12.092 -7.351 1.00 1.00 C ATOM 0 H VAL A 75 -11.591 -15.278 -9.745 1.00 1.00 H new ATOM 0 HA VAL A 75 -11.265 -13.645 -7.347 1.00 1.00 H new ATOM 0 HB VAL A 75 -12.174 -12.162 -9.067 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -14.569 -12.320 -9.763 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -13.545 -13.612 -10.435 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -14.626 -13.956 -9.064 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -14.106 -11.278 -7.711 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -14.082 -12.787 -6.768 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -12.684 -11.687 -6.723 1.00 1.00 H new ATOM 1128 N PRO A 76 -12.782 -15.310 -6.140 1.00 1.00 N ATOM 1129 CA PRO A 76 -13.501 -16.392 -5.447 1.00 1.00 C ATOM 1130 C PRO A 76 -15.034 -16.205 -5.367 1.00 1.00 C ATOM 1131 O PRO A 76 -15.712 -16.968 -4.676 1.00 1.00 O ATOM 1132 CB PRO A 76 -12.862 -16.438 -4.052 1.00 1.00 C ATOM 1133 CG PRO A 76 -12.531 -14.974 -3.783 1.00 1.00 C ATOM 1134 CD PRO A 76 -12.096 -14.473 -5.158 1.00 1.00 C ATOM 0 HA PRO A 76 -13.403 -17.326 -6.001 1.00 1.00 H new ATOM 0 HB2 PRO A 76 -13.547 -16.841 -3.306 1.00 1.00 H new ATOM 0 HB3 PRO A 76 -11.970 -17.064 -4.036 1.00 1.00 H new ATOM 0 HG2 PRO A 76 -13.395 -14.426 -3.406 1.00 1.00 H new ATOM 0 HG3 PRO A 76 -11.738 -14.867 -3.043 1.00 1.00 H new ATOM 0 HD2 PRO A 76 -12.360 -13.424 -5.290 1.00 1.00 H new ATOM 0 HD3 PRO A 76 -11.015 -14.546 -5.273 1.00 1.00 H new ATOM 1142 N ALA A 77 -15.602 -15.202 -6.047 1.00 1.00 N ATOM 1143 CA ALA A 77 -17.029 -14.844 -6.077 1.00 1.00 C ATOM 1144 C ALA A 77 -17.949 -15.838 -6.842 1.00 1.00 C ATOM 1145 O ALA A 77 -18.855 -15.424 -7.576 1.00 1.00 O ATOM 1146 CB ALA A 77 -17.126 -13.406 -6.617 1.00 1.00 C ATOM 0 H ALA A 77 -15.043 -14.578 -6.629 1.00 1.00 H new ATOM 0 HA ALA A 77 -17.419 -14.908 -5.061 1.00 1.00 H new ATOM 0 HB1 ALA A 77 -18.172 -13.101 -6.655 1.00 1.00 H new ATOM 0 HB2 ALA A 77 -16.576 -12.733 -5.960 1.00 1.00 H new ATOM 0 HB3 ALA A 77 -16.699 -13.364 -7.619 1.00 1.00 H new ATOM 1152 N LYS A 78 -17.731 -17.151 -6.681 1.00 1.00 N ATOM 1153 CA LYS A 78 -18.489 -18.254 -7.308 1.00 1.00 C ATOM 1154 C LYS A 78 -18.795 -19.370 -6.294 1.00 1.00 C ATOM 1155 O LYS A 78 -18.093 -19.513 -5.289 1.00 1.00 O ATOM 1156 CB LYS A 78 -17.711 -18.815 -8.515 1.00 1.00 C ATOM 1157 CG LYS A 78 -17.584 -17.796 -9.662 1.00 1.00 C ATOM 1158 CD LYS A 78 -16.870 -18.363 -10.896 1.00 1.00 C ATOM 1159 CE LYS A 78 -17.689 -19.456 -11.600 1.00 1.00 C ATOM 1160 NZ LYS A 78 -17.014 -19.933 -12.836 1.00 1.00 N ATOM 0 H LYS A 78 -16.983 -17.495 -6.079 1.00 1.00 H new ATOM 0 HA LYS A 78 -19.441 -17.855 -7.657 1.00 1.00 H new ATOM 0 HB2 LYS A 78 -16.715 -19.119 -8.192 1.00 1.00 H new ATOM 0 HB3 LYS A 78 -18.213 -19.710 -8.883 1.00 1.00 H new ATOM 0 HG2 LYS A 78 -18.579 -17.456 -9.950 1.00 1.00 H new ATOM 0 HG3 LYS A 78 -17.040 -16.922 -9.305 1.00 1.00 H new ATOM 0 HD2 LYS A 78 -16.669 -17.555 -11.599 1.00 1.00 H new ATOM 0 HD3 LYS A 78 -15.905 -18.772 -10.597 1.00 1.00 H new ATOM 0 HE2 LYS A 78 -17.839 -20.294 -10.920 1.00 1.00 H new ATOM 0 HE3 LYS A 78 -18.676 -19.068 -11.850 1.00 1.00 H new ATOM 0 HZ1 LYS A 78 -17.594 -20.670 -13.286 1.00 1.00 H new ATOM 0 HZ2 LYS A 78 -16.893 -19.137 -13.495 1.00 1.00 H new ATOM 0 HZ3 LYS A 78 -16.082 -20.326 -12.593 1.00 1.00 H new ATOM 1174 N LYS A 79 -19.836 -20.166 -6.566 1.00 1.00 N ATOM 1175 CA LYS A 79 -20.308 -21.287 -5.726 1.00 1.00 C ATOM 1176 C LYS A 79 -20.925 -22.408 -6.581 1.00 1.00 C ATOM 1177 O LYS A 79 -21.355 -22.167 -7.712 1.00 1.00 O ATOM 1178 CB LYS A 79 -21.307 -20.718 -4.693 1.00 1.00 C ATOM 1179 CG LYS A 79 -21.691 -21.710 -3.579 1.00 1.00 C ATOM 1180 CD LYS A 79 -22.447 -21.049 -2.416 1.00 1.00 C ATOM 1181 CE LYS A 79 -23.804 -20.477 -2.849 1.00 1.00 C ATOM 1182 NZ LYS A 79 -24.540 -19.888 -1.700 1.00 1.00 N ATOM 0 H LYS A 79 -20.398 -20.047 -7.409 1.00 1.00 H new ATOM 0 HA LYS A 79 -19.470 -21.745 -5.201 1.00 1.00 H new ATOM 0 HB2 LYS A 79 -20.875 -19.827 -4.238 1.00 1.00 H new ATOM 0 HB3 LYS A 79 -22.212 -20.404 -5.213 1.00 1.00 H new ATOM 0 HG2 LYS A 79 -22.309 -22.501 -4.003 1.00 1.00 H new ATOM 0 HG3 LYS A 79 -20.787 -22.183 -3.195 1.00 1.00 H new ATOM 0 HD2 LYS A 79 -22.601 -21.781 -1.624 1.00 1.00 H new ATOM 0 HD3 LYS A 79 -21.836 -20.250 -1.997 1.00 1.00 H new ATOM 0 HE2 LYS A 79 -23.651 -19.715 -3.613 1.00 1.00 H new ATOM 0 HE3 LYS A 79 -24.405 -21.266 -3.301 1.00 1.00 H new ATOM 0 HZ1 LYS A 79 -25.452 -19.511 -2.028 1.00 1.00 H new ATOM 0 HZ2 LYS A 79 -24.707 -20.621 -0.982 1.00 1.00 H new ATOM 0 HZ3 LYS A 79 -23.977 -19.119 -1.285 1.00 1.00 H new ATOM 1196 N PHE A 80 -20.975 -23.622 -6.035 1.00 1.00 N ATOM 1197 CA PHE A 80 -21.524 -24.831 -6.667 1.00 1.00 C ATOM 1198 C PHE A 80 -22.244 -25.731 -5.640 1.00 1.00 C ATOM 1199 O PHE A 80 -22.099 -25.549 -4.426 1.00 1.00 O ATOM 1200 CB PHE A 80 -20.392 -25.577 -7.401 1.00 1.00 C ATOM 1201 CG PHE A 80 -19.218 -25.998 -6.530 1.00 1.00 C ATOM 1202 CD1 PHE A 80 -18.140 -25.116 -6.317 1.00 1.00 C ATOM 1203 CD2 PHE A 80 -19.197 -27.276 -5.937 1.00 1.00 C ATOM 1204 CE1 PHE A 80 -17.059 -25.502 -5.503 1.00 1.00 C ATOM 1205 CE2 PHE A 80 -18.117 -27.662 -5.123 1.00 1.00 C ATOM 1206 CZ PHE A 80 -17.048 -26.775 -4.903 1.00 1.00 C ATOM 0 H PHE A 80 -20.619 -23.803 -5.097 1.00 1.00 H new ATOM 0 HA PHE A 80 -22.280 -24.542 -7.397 1.00 1.00 H new ATOM 0 HB2 PHE A 80 -20.811 -26.466 -7.872 1.00 1.00 H new ATOM 0 HB3 PHE A 80 -20.018 -24.939 -8.202 1.00 1.00 H new ATOM 0 HD1 PHE A 80 -18.143 -24.140 -6.780 1.00 1.00 H new ATOM 0 HD2 PHE A 80 -20.013 -27.962 -6.108 1.00 1.00 H new ATOM 0 HE1 PHE A 80 -16.237 -24.821 -5.339 1.00 1.00 H new ATOM 0 HE2 PHE A 80 -18.109 -28.641 -4.666 1.00 1.00 H new ATOM 0 HZ PHE A 80 -16.220 -27.070 -4.275 1.00 1.00 H new ATOM 1216 N LYS A 81 -23.041 -26.695 -6.124 1.00 1.00 N ATOM 1217 CA LYS A 81 -23.838 -27.626 -5.297 1.00 1.00 C ATOM 1218 C LYS A 81 -22.978 -28.497 -4.367 1.00 1.00 C ATOM 1219 O LYS A 81 -21.953 -29.042 -4.784 1.00 1.00 O ATOM 1220 CB LYS A 81 -24.709 -28.520 -6.200 1.00 1.00 C ATOM 1221 CG LYS A 81 -25.784 -27.727 -6.962 1.00 1.00 C ATOM 1222 CD LYS A 81 -26.664 -28.664 -7.801 1.00 1.00 C ATOM 1223 CE LYS A 81 -27.731 -27.856 -8.551 1.00 1.00 C ATOM 1224 NZ LYS A 81 -28.604 -28.735 -9.375 1.00 1.00 N ATOM 0 H LYS A 81 -23.155 -26.856 -7.125 1.00 1.00 H new ATOM 0 HA LYS A 81 -24.471 -27.012 -4.656 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -24.070 -29.038 -6.915 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -25.191 -29.285 -5.591 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -26.404 -27.175 -6.255 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -25.308 -26.991 -7.610 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -26.048 -29.215 -8.512 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -27.142 -29.401 -7.156 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -28.341 -27.304 -7.835 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -27.247 -27.119 -9.192 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -29.313 -28.156 -9.868 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -28.025 -29.242 -10.074 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -29.085 -29.422 -8.760 1.00 1.00 H new ATOM 1238 N ALA A 82 -23.428 -28.654 -3.122 1.00 1.00 N ATOM 1239 CA ALA A 82 -22.797 -29.465 -2.075 1.00 1.00 C ATOM 1240 C ALA A 82 -23.837 -29.947 -1.039 1.00 1.00 C ATOM 1241 O ALA A 82 -24.956 -29.424 -0.980 1.00 1.00 O ATOM 1242 CB ALA A 82 -21.700 -28.622 -1.404 1.00 1.00 C ATOM 0 H ALA A 82 -24.282 -28.199 -2.799 1.00 1.00 H new ATOM 0 HA ALA A 82 -22.356 -30.357 -2.520 1.00 1.00 H new ATOM 0 HB1 ALA A 82 -21.218 -29.208 -0.621 1.00 1.00 H new ATOM 0 HB2 ALA A 82 -20.958 -28.331 -2.148 1.00 1.00 H new ATOM 0 HB3 ALA A 82 -22.145 -27.728 -0.966 1.00 1.00 H new ATOM 1248 N ALA A 83 -23.468 -30.928 -0.208 1.00 1.00 N ATOM 1249 CA ALA A 83 -24.319 -31.498 0.844 1.00 1.00 C ATOM 1250 C ALA A 83 -23.488 -32.032 2.040 1.00 1.00 C ATOM 1251 O ALA A 83 -22.350 -32.478 1.838 1.00 1.00 O ATOM 1252 CB ALA A 83 -25.156 -32.627 0.221 1.00 1.00 C ATOM 0 H ALA A 83 -22.545 -31.359 -0.249 1.00 1.00 H new ATOM 0 HA ALA A 83 -24.966 -30.716 1.241 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -25.798 -33.068 0.984 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -25.772 -32.223 -0.582 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -24.492 -33.393 -0.181 1.00 1.00 H new ATOM 1258 N PRO A 84 -24.029 -32.009 3.277 1.00 1.00 N ATOM 1259 CA PRO A 84 -23.344 -32.505 4.475 1.00 1.00 C ATOM 1260 C PRO A 84 -23.313 -34.045 4.550 1.00 1.00 C ATOM 1261 O PRO A 84 -24.004 -34.742 3.800 1.00 1.00 O ATOM 1262 CB PRO A 84 -24.133 -31.904 5.645 1.00 1.00 C ATOM 1263 CG PRO A 84 -25.561 -31.839 5.104 1.00 1.00 C ATOM 1264 CD PRO A 84 -25.350 -31.498 3.630 1.00 1.00 C ATOM 0 HA PRO A 84 -22.294 -32.212 4.481 1.00 1.00 H new ATOM 0 HB2 PRO A 84 -24.068 -32.527 6.537 1.00 1.00 H new ATOM 0 HB3 PRO A 84 -23.760 -30.917 5.918 1.00 1.00 H new ATOM 0 HG2 PRO A 84 -26.084 -32.787 5.229 1.00 1.00 H new ATOM 0 HG3 PRO A 84 -26.153 -31.079 5.614 1.00 1.00 H new ATOM 0 HD2 PRO A 84 -26.122 -31.955 3.011 1.00 1.00 H new ATOM 0 HD3 PRO A 84 -25.407 -30.422 3.468 1.00 1.00 H new ATOM 1272 N ALA A 85 -22.530 -34.577 5.493 1.00 1.00 N ATOM 1273 CA ALA A 85 -22.386 -36.010 5.770 1.00 1.00 C ATOM 1274 C ALA A 85 -22.112 -36.273 7.267 1.00 1.00 C ATOM 1275 O ALA A 85 -21.604 -35.404 7.980 1.00 1.00 O ATOM 1276 CB ALA A 85 -21.252 -36.567 4.896 1.00 1.00 C ATOM 0 H ALA A 85 -21.957 -34.000 6.108 1.00 1.00 H new ATOM 0 HA ALA A 85 -23.320 -36.518 5.528 1.00 1.00 H new ATOM 0 HB1 ALA A 85 -21.132 -37.633 5.091 1.00 1.00 H new ATOM 0 HB2 ALA A 85 -21.495 -36.415 3.844 1.00 1.00 H new ATOM 0 HB3 ALA A 85 -20.323 -36.049 5.132 1.00 1.00 H new ATOM 1282 N GLU A 86 -22.454 -37.475 7.746 1.00 1.00 N ATOM 1283 CA GLU A 86 -22.301 -37.888 9.157 1.00 1.00 C ATOM 1284 C GLU A 86 -21.870 -39.368 9.320 1.00 1.00 C ATOM 1285 O GLU A 86 -21.806 -39.891 10.433 1.00 1.00 O ATOM 1286 CB GLU A 86 -23.637 -37.594 9.879 1.00 1.00 C ATOM 1287 CG GLU A 86 -23.551 -37.395 11.401 1.00 1.00 C ATOM 1288 CD GLU A 86 -22.774 -36.119 11.784 1.00 1.00 C ATOM 1289 OE1 GLU A 86 -23.377 -35.018 11.798 1.00 1.00 O ATOM 1290 OE2 GLU A 86 -21.562 -36.209 12.100 1.00 1.00 O ATOM 0 H GLU A 86 -22.853 -38.206 7.157 1.00 1.00 H new ATOM 0 HA GLU A 86 -21.490 -37.317 9.608 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -24.075 -36.698 9.440 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -24.324 -38.416 9.678 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -24.558 -37.342 11.815 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -23.066 -38.261 11.851 1.00 1.00 H new ATOM 1297 N ILE A 87 -21.547 -40.065 8.220 1.00 1.00 N ATOM 1298 CA ILE A 87 -21.141 -41.490 8.197 1.00 1.00 C ATOM 1299 C ILE A 87 -19.639 -41.661 8.538 1.00 1.00 C ATOM 1300 O ILE A 87 -18.941 -42.527 8.006 1.00 1.00 O ATOM 1301 CB ILE A 87 -21.572 -42.166 6.862 1.00 1.00 C ATOM 1302 CG1 ILE A 87 -22.966 -41.721 6.345 1.00 1.00 C ATOM 1303 CG2 ILE A 87 -21.591 -43.705 6.986 1.00 1.00 C ATOM 1304 CD1 ILE A 87 -24.142 -41.924 7.317 1.00 1.00 C ATOM 0 H ILE A 87 -21.560 -39.645 7.290 1.00 1.00 H new ATOM 0 HA ILE A 87 -21.673 -42.020 8.987 1.00 1.00 H new ATOM 0 HB ILE A 87 -20.820 -41.839 6.144 1.00 1.00 H new ATOM 0 HG12 ILE A 87 -22.914 -40.664 6.084 1.00 1.00 H new ATOM 0 HG13 ILE A 87 -23.182 -42.266 5.426 1.00 1.00 H new ATOM 0 HG21 ILE A 87 -21.896 -44.143 6.036 1.00 1.00 H new ATOM 0 HG22 ILE A 87 -20.594 -44.061 7.246 1.00 1.00 H new ATOM 0 HG23 ILE A 87 -22.296 -43.999 7.764 1.00 1.00 H new ATOM 0 HD11 ILE A 87 -25.064 -41.578 6.850 1.00 1.00 H new ATOM 0 HD12 ILE A 87 -24.234 -42.982 7.561 1.00 1.00 H new ATOM 0 HD13 ILE A 87 -23.962 -41.355 8.229 1.00 1.00 H new ATOM 1316 N SER A 88 -19.113 -40.817 9.433 1.00 1.00 N ATOM 1317 CA SER A 88 -17.709 -40.798 9.885 1.00 1.00 C ATOM 1318 C SER A 88 -17.224 -42.123 10.500 1.00 1.00 C ATOM 1319 O SER A 88 -16.022 -42.392 10.527 1.00 1.00 O ATOM 1320 CB SER A 88 -17.502 -39.665 10.898 1.00 1.00 C ATOM 1321 OG SER A 88 -17.934 -38.423 10.355 1.00 1.00 O ATOM 0 H SER A 88 -19.675 -40.095 9.884 1.00 1.00 H new ATOM 0 HA SER A 88 -17.112 -40.637 8.988 1.00 1.00 H new ATOM 0 HB2 SER A 88 -18.056 -39.881 11.812 1.00 1.00 H new ATOM 0 HB3 SER A 88 -16.449 -39.602 11.171 1.00 1.00 H new ATOM 0 HG SER A 88 -17.796 -37.712 11.015 1.00 1.00 H new ATOM 1327 N ASP A 89 -18.148 -42.967 10.973 1.00 1.00 N ATOM 1328 CA ASP A 89 -17.869 -44.300 11.528 1.00 1.00 C ATOM 1329 C ASP A 89 -17.293 -45.278 10.476 1.00 1.00 C ATOM 1330 O ASP A 89 -16.530 -46.183 10.818 1.00 1.00 O ATOM 1331 CB ASP A 89 -19.177 -44.847 12.117 1.00 1.00 C ATOM 1332 CG ASP A 89 -18.995 -46.226 12.770 1.00 1.00 C ATOM 1333 OD1 ASP A 89 -18.424 -46.298 13.886 1.00 1.00 O ATOM 1334 OD2 ASP A 89 -19.447 -47.232 12.175 1.00 1.00 O ATOM 0 H ASP A 89 -19.141 -42.736 10.981 1.00 1.00 H new ATOM 0 HA ASP A 89 -17.103 -44.206 12.298 1.00 1.00 H new ATOM 0 HB2 ASP A 89 -19.560 -44.145 12.858 1.00 1.00 H new ATOM 0 HB3 ASP A 89 -19.926 -44.918 11.328 1.00 1.00 H new ATOM 1339 N GLY A 90 -17.627 -45.081 9.192 1.00 1.00 N ATOM 1340 CA GLY A 90 -17.139 -45.878 8.058 1.00 1.00 C ATOM 1341 C GLY A 90 -17.651 -47.327 7.964 1.00 1.00 C ATOM 1342 O GLY A 90 -17.179 -48.075 7.106 1.00 1.00 O ATOM 0 H GLY A 90 -18.265 -44.338 8.906 1.00 1.00 H new ATOM 0 HA2 GLY A 90 -17.408 -45.361 7.137 1.00 1.00 H new ATOM 0 HA3 GLY A 90 -16.050 -45.903 8.103 1.00 1.00 H new ATOM 1346 N GLU A 91 -18.588 -47.745 8.824 1.00 1.00 N ATOM 1347 CA GLU A 91 -19.138 -49.113 8.865 1.00 1.00 C ATOM 1348 C GLU A 91 -20.661 -49.151 9.156 1.00 1.00 C ATOM 1349 O GLU A 91 -21.201 -50.164 9.603 1.00 1.00 O ATOM 1350 CB GLU A 91 -18.314 -49.954 9.866 1.00 1.00 C ATOM 1351 CG GLU A 91 -18.258 -51.441 9.485 1.00 1.00 C ATOM 1352 CD GLU A 91 -17.395 -52.233 10.487 1.00 1.00 C ATOM 1353 OE1 GLU A 91 -16.159 -52.328 10.289 1.00 1.00 O ATOM 1354 OE2 GLU A 91 -17.946 -52.778 11.475 1.00 1.00 O ATOM 0 H GLU A 91 -18.997 -47.130 9.528 1.00 1.00 H new ATOM 0 HA GLU A 91 -19.045 -49.554 7.873 1.00 1.00 H new ATOM 0 HB2 GLU A 91 -17.300 -49.558 9.919 1.00 1.00 H new ATOM 0 HB3 GLU A 91 -18.747 -49.854 10.861 1.00 1.00 H new ATOM 0 HG2 GLU A 91 -19.267 -51.853 9.463 1.00 1.00 H new ATOM 0 HG3 GLU A 91 -17.847 -51.548 8.481 1.00 1.00 H new ATOM 1361 N ASP A 92 -21.375 -48.043 8.909 1.00 1.00 N ATOM 1362 CA ASP A 92 -22.828 -47.939 9.118 1.00 1.00 C ATOM 1363 C ASP A 92 -23.602 -48.904 8.196 1.00 1.00 C ATOM 1364 O ASP A 92 -23.612 -48.747 6.970 1.00 1.00 O ATOM 1365 CB ASP A 92 -23.284 -46.483 8.927 1.00 1.00 C ATOM 1366 CG ASP A 92 -24.716 -46.249 9.442 1.00 1.00 C ATOM 1367 OD1 ASP A 92 -25.618 -47.064 9.139 1.00 1.00 O ATOM 1368 OD2 ASP A 92 -24.938 -45.248 10.166 1.00 1.00 O ATOM 0 H ASP A 92 -20.956 -47.184 8.554 1.00 1.00 H new ATOM 0 HA ASP A 92 -23.052 -48.236 10.142 1.00 1.00 H new ATOM 0 HB2 ASP A 92 -22.598 -45.818 9.451 1.00 1.00 H new ATOM 0 HB3 ASP A 92 -23.233 -46.224 7.869 1.00 1.00 H new ATOM 1373 N ARG A 93 -24.255 -49.914 8.785 1.00 1.00 N ATOM 1374 CA ARG A 93 -25.017 -50.961 8.078 1.00 1.00 C ATOM 1375 C ARG A 93 -26.096 -50.426 7.129 1.00 1.00 C ATOM 1376 O ARG A 93 -26.351 -51.031 6.092 1.00 1.00 O ATOM 1377 CB ARG A 93 -25.629 -51.939 9.099 1.00 1.00 C ATOM 1378 CG ARG A 93 -24.623 -52.569 10.083 1.00 1.00 C ATOM 1379 CD ARG A 93 -23.404 -53.242 9.433 1.00 1.00 C ATOM 1380 NE ARG A 93 -23.800 -54.367 8.562 1.00 1.00 N ATOM 1381 CZ ARG A 93 -23.235 -55.557 8.468 1.00 1.00 C ATOM 1382 NH1 ARG A 93 -22.161 -55.878 9.134 1.00 1.00 N ATOM 1383 NH2 ARG A 93 -23.752 -56.460 7.688 1.00 1.00 N ATOM 0 H ARG A 93 -24.270 -50.032 9.798 1.00 1.00 H new ATOM 0 HA ARG A 93 -24.302 -51.479 7.439 1.00 1.00 H new ATOM 0 HB2 ARG A 93 -26.393 -51.412 9.671 1.00 1.00 H new ATOM 0 HB3 ARG A 93 -26.133 -52.739 8.556 1.00 1.00 H new ATOM 0 HG2 ARG A 93 -24.270 -51.793 10.763 1.00 1.00 H new ATOM 0 HG3 ARG A 93 -25.146 -53.309 10.688 1.00 1.00 H new ATOM 0 HD2 ARG A 93 -22.851 -52.507 8.849 1.00 1.00 H new ATOM 0 HD3 ARG A 93 -22.730 -53.603 10.210 1.00 1.00 H new ATOM 0 HE ARG A 93 -24.608 -54.205 7.960 1.00 1.00 H new ATOM 0 HH11 ARG A 93 -21.725 -55.198 9.757 1.00 1.00 H new ATOM 0 HH12 ARG A 93 -21.757 -56.809 9.032 1.00 1.00 H new ATOM 0 HH21 ARG A 93 -24.592 -56.249 7.150 1.00 1.00 H new ATOM 0 HH22 ARG A 93 -23.317 -57.380 7.614 1.00 1.00 H new ATOM 1397 N SER A 94 -26.702 -49.276 7.428 1.00 1.00 N ATOM 1398 CA SER A 94 -27.720 -48.641 6.573 1.00 1.00 C ATOM 1399 C SER A 94 -27.139 -47.956 5.324 1.00 1.00 C ATOM 1400 O SER A 94 -27.902 -47.483 4.478 1.00 1.00 O ATOM 1401 CB SER A 94 -28.517 -47.613 7.380 1.00 1.00 C ATOM 1402 OG SER A 94 -29.229 -48.255 8.429 1.00 1.00 O ATOM 0 H SER A 94 -26.501 -48.750 8.278 1.00 1.00 H new ATOM 0 HA SER A 94 -28.365 -49.448 6.225 1.00 1.00 H new ATOM 0 HB2 SER A 94 -27.843 -46.864 7.794 1.00 1.00 H new ATOM 0 HB3 SER A 94 -29.214 -47.088 6.726 1.00 1.00 H new ATOM 0 HG SER A 94 -29.733 -47.587 8.939 1.00 1.00 H new ATOM 1408 N LYS A 95 -25.805 -47.888 5.202 1.00 1.00 N ATOM 1409 CA LYS A 95 -25.074 -47.244 4.095 1.00 1.00 C ATOM 1410 C LYS A 95 -23.989 -48.122 3.462 1.00 1.00 C ATOM 1411 O LYS A 95 -23.570 -47.825 2.343 1.00 1.00 O ATOM 1412 CB LYS A 95 -24.452 -45.931 4.602 1.00 1.00 C ATOM 1413 CG LYS A 95 -25.463 -44.830 4.967 1.00 1.00 C ATOM 1414 CD LYS A 95 -26.225 -44.268 3.757 1.00 1.00 C ATOM 1415 CE LYS A 95 -27.085 -43.075 4.193 1.00 1.00 C ATOM 1416 NZ LYS A 95 -27.698 -42.377 3.033 1.00 1.00 N ATOM 0 H LYS A 95 -25.180 -48.295 5.897 1.00 1.00 H new ATOM 0 HA LYS A 95 -25.803 -47.059 3.306 1.00 1.00 H new ATOM 0 HB2 LYS A 95 -23.844 -46.150 5.480 1.00 1.00 H new ATOM 0 HB3 LYS A 95 -23.779 -45.546 3.836 1.00 1.00 H new ATOM 0 HG2 LYS A 95 -26.180 -45.230 5.683 1.00 1.00 H new ATOM 0 HG3 LYS A 95 -24.936 -44.015 5.464 1.00 1.00 H new ATOM 0 HD2 LYS A 95 -25.521 -43.958 2.985 1.00 1.00 H new ATOM 0 HD3 LYS A 95 -26.856 -45.043 3.321 1.00 1.00 H new ATOM 0 HE2 LYS A 95 -27.871 -43.421 4.865 1.00 1.00 H new ATOM 0 HE3 LYS A 95 -26.471 -42.372 4.756 1.00 1.00 H new ATOM 0 HZ1 LYS A 95 -28.311 -41.609 3.374 1.00 1.00 H new ATOM 0 HZ2 LYS A 95 -26.949 -41.980 2.431 1.00 1.00 H new ATOM 0 HZ3 LYS A 95 -28.264 -43.053 2.481 1.00 1.00 H new ATOM 1430 N CYS A 96 -23.531 -49.186 4.121 1.00 1.00 N ATOM 1431 CA CYS A 96 -22.504 -50.090 3.591 1.00 1.00 C ATOM 1432 C CYS A 96 -22.612 -51.548 4.075 1.00 1.00 C ATOM 1433 O CYS A 96 -23.311 -51.875 5.035 1.00 1.00 O ATOM 1434 CB CYS A 96 -21.115 -49.493 3.878 1.00 1.00 C ATOM 1435 SG CYS A 96 -20.740 -49.548 5.654 1.00 1.00 S ATOM 0 H CYS A 96 -23.865 -49.450 5.048 1.00 1.00 H new ATOM 0 HA CYS A 96 -22.669 -50.161 2.516 1.00 1.00 H new ATOM 0 HB2 CYS A 96 -20.356 -50.046 3.325 1.00 1.00 H new ATOM 0 HB3 CYS A 96 -21.078 -48.462 3.526 1.00 1.00 H new ATOM 0 HG CYS A 96 -21.801 -49.223 6.332 1.00 1.00 H new ATOM 1441 N CYS A 97 -21.891 -52.428 3.377 1.00 1.00 N ATOM 1442 CA CYS A 97 -21.814 -53.867 3.615 1.00 1.00 C ATOM 1443 C CYS A 97 -20.365 -54.351 3.428 1.00 1.00 C ATOM 1444 O CYS A 97 -19.985 -54.711 2.311 1.00 1.00 O ATOM 1445 CB CYS A 97 -22.777 -54.572 2.649 1.00 1.00 C ATOM 1446 SG CYS A 97 -22.712 -56.382 2.661 1.00 1.00 S ATOM 0 H CYS A 97 -21.314 -52.137 2.588 1.00 1.00 H new ATOM 0 HA CYS A 97 -22.107 -54.104 4.638 1.00 1.00 H new ATOM 0 HB2 CYS A 97 -23.794 -54.261 2.887 1.00 1.00 H new ATOM 0 HB3 CYS A 97 -22.567 -54.225 1.637 1.00 1.00 H new ATOM 1451 N PRO A 98 -19.524 -54.375 4.481 1.00 1.00 N ATOM 1452 CA PRO A 98 -18.131 -54.822 4.367 1.00 1.00 C ATOM 1453 C PRO A 98 -17.997 -56.323 4.056 1.00 1.00 C ATOM 1454 O PRO A 98 -16.962 -56.752 3.547 1.00 1.00 O ATOM 1455 CB PRO A 98 -17.476 -54.439 5.699 1.00 1.00 C ATOM 1456 CG PRO A 98 -18.640 -54.458 6.689 1.00 1.00 C ATOM 1457 CD PRO A 98 -19.823 -53.974 5.852 1.00 1.00 C ATOM 0 HA PRO A 98 -17.637 -54.344 3.521 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -16.697 -55.148 5.982 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -17.009 -53.456 5.648 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -18.812 -55.458 7.088 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -18.455 -53.803 7.540 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -20.756 -54.421 6.196 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -19.940 -52.893 5.927 1.00 1.00 H new ATOM 1465 N VAL A 99 -19.046 -57.126 4.300 1.00 1.00 N ATOM 1466 CA VAL A 99 -19.097 -58.573 3.981 1.00 1.00 C ATOM 1467 C VAL A 99 -19.049 -58.824 2.460 1.00 1.00 C ATOM 1468 O VAL A 99 -18.650 -59.899 2.017 1.00 1.00 O ATOM 1469 CB VAL A 99 -20.348 -59.252 4.590 1.00 1.00 C ATOM 1470 CG1 VAL A 99 -20.173 -60.776 4.668 1.00 1.00 C ATOM 1471 CG2 VAL A 99 -20.653 -58.774 6.020 1.00 1.00 C ATOM 0 H VAL A 99 -19.904 -56.785 4.734 1.00 1.00 H new ATOM 0 HA VAL A 99 -18.211 -59.020 4.432 1.00 1.00 H new ATOM 0 HB VAL A 99 -21.167 -58.977 3.926 1.00 1.00 H new ATOM 0 HG11 VAL A 99 -21.068 -61.223 5.100 1.00 1.00 H new ATOM 0 HG12 VAL A 99 -20.015 -61.176 3.666 1.00 1.00 H new ATOM 0 HG13 VAL A 99 -19.312 -61.012 5.293 1.00 1.00 H new ATOM 0 HG21 VAL A 99 -21.540 -59.285 6.393 1.00 1.00 H new ATOM 0 HG22 VAL A 99 -19.805 -58.999 6.667 1.00 1.00 H new ATOM 0 HG23 VAL A 99 -20.829 -57.698 6.014 1.00 1.00 H new ATOM 1481 N CYS A 100 -19.423 -57.818 1.661 1.00 1.00 N ATOM 1482 CA CYS A 100 -19.440 -57.842 0.190 1.00 1.00 C ATOM 1483 C CYS A 100 -18.677 -56.664 -0.459 1.00 1.00 C ATOM 1484 O CYS A 100 -18.491 -56.623 -1.676 1.00 1.00 O ATOM 1485 CB CYS A 100 -20.903 -57.811 -0.248 1.00 1.00 C ATOM 1486 SG CYS A 100 -21.904 -59.219 0.304 1.00 1.00 S ATOM 0 H CYS A 100 -19.737 -56.923 2.037 1.00 1.00 H new ATOM 0 HA CYS A 100 -18.928 -58.745 -0.142 1.00 1.00 H new ATOM 0 HB2 CYS A 100 -21.358 -56.894 0.125 1.00 1.00 H new ATOM 0 HB3 CYS A 100 -20.939 -57.765 -1.336 1.00 1.00 H new ATOM 1491 N ASN A 101 -18.259 -55.701 0.366 1.00 1.00 N ATOM 1492 CA ASN A 101 -17.567 -54.449 0.049 1.00 1.00 C ATOM 1493 C ASN A 101 -18.352 -53.563 -0.942 1.00 1.00 C ATOM 1494 O ASN A 101 -17.856 -53.186 -2.007 1.00 1.00 O ATOM 1495 CB ASN A 101 -16.097 -54.721 -0.331 1.00 1.00 C ATOM 1496 CG ASN A 101 -15.321 -55.387 0.792 1.00 1.00 C ATOM 1497 OD1 ASN A 101 -15.215 -56.603 0.871 1.00 1.00 O ATOM 1498 ND2 ASN A 101 -14.759 -54.622 1.701 1.00 1.00 N ATOM 0 H ASN A 101 -18.412 -55.787 1.371 1.00 1.00 H new ATOM 0 HA ASN A 101 -17.530 -53.836 0.950 1.00 1.00 H new ATOM 0 HB2 ASN A 101 -16.065 -55.356 -1.217 1.00 1.00 H new ATOM 0 HB3 ASN A 101 -15.613 -53.781 -0.595 1.00 1.00 H new ATOM 0 HD21 ASN A 101 -14.236 -55.043 2.469 1.00 1.00 H new ATOM 0 HD22 ASN A 101 -14.845 -53.608 1.638 1.00 1.00 H new ATOM 1505 N MET A 102 -19.592 -53.230 -0.566 1.00 1.00 N ATOM 1506 CA MET A 102 -20.528 -52.390 -1.339 1.00 1.00 C ATOM 1507 C MET A 102 -21.244 -51.343 -0.460 1.00 1.00 C ATOM 1508 O MET A 102 -21.141 -51.374 0.771 1.00 1.00 O ATOM 1509 CB MET A 102 -21.551 -53.276 -2.076 1.00 1.00 C ATOM 1510 CG MET A 102 -20.895 -54.177 -3.131 1.00 1.00 C ATOM 1511 SD MET A 102 -22.036 -54.920 -4.332 1.00 1.00 S ATOM 1512 CE MET A 102 -23.052 -55.954 -3.244 1.00 1.00 C ATOM 0 H MET A 102 -19.991 -53.548 0.317 1.00 1.00 H new ATOM 0 HA MET A 102 -19.940 -51.836 -2.071 1.00 1.00 H new ATOM 0 HB2 MET A 102 -22.079 -53.896 -1.351 1.00 1.00 H new ATOM 0 HB3 MET A 102 -22.296 -52.642 -2.557 1.00 1.00 H new ATOM 0 HG2 MET A 102 -20.152 -53.592 -3.674 1.00 1.00 H new ATOM 0 HG3 MET A 102 -20.360 -54.977 -2.620 1.00 1.00 H new ATOM 0 HE1 MET A 102 -23.476 -56.778 -3.817 1.00 1.00 H new ATOM 0 HE2 MET A 102 -22.434 -56.352 -2.439 1.00 1.00 H new ATOM 0 HE3 MET A 102 -23.858 -55.354 -2.820 1.00 1.00 H new ATOM 1522 N THR A 103 -21.971 -50.414 -1.092 1.00 1.00 N ATOM 1523 CA THR A 103 -22.701 -49.304 -0.443 1.00 1.00 C ATOM 1524 C THR A 103 -24.179 -49.220 -0.853 1.00 1.00 C ATOM 1525 O THR A 103 -24.590 -49.758 -1.885 1.00 1.00 O ATOM 1526 CB THR A 103 -22.011 -47.950 -0.699 1.00 1.00 C ATOM 1527 OG1 THR A 103 -21.834 -47.732 -2.085 1.00 1.00 O ATOM 1528 CG2 THR A 103 -20.638 -47.872 -0.029 1.00 1.00 C ATOM 0 H THR A 103 -22.075 -50.409 -2.107 1.00 1.00 H new ATOM 0 HA THR A 103 -22.676 -49.527 0.624 1.00 1.00 H new ATOM 0 HB THR A 103 -22.662 -47.187 -0.273 1.00 1.00 H new ATOM 0 HG1 THR A 103 -21.396 -46.867 -2.227 1.00 1.00 H new ATOM 0 HG21 THR A 103 -20.187 -46.901 -0.235 1.00 1.00 H new ATOM 0 HG22 THR A 103 -20.751 -47.998 1.048 1.00 1.00 H new ATOM 0 HG23 THR A 103 -19.996 -48.661 -0.422 1.00 1.00 H new ATOM 1536 N PHE A 104 -24.982 -48.548 -0.020 1.00 1.00 N ATOM 1537 CA PHE A 104 -26.432 -48.367 -0.162 1.00 1.00 C ATOM 1538 C PHE A 104 -26.859 -46.902 0.014 1.00 1.00 C ATOM 1539 O PHE A 104 -26.271 -46.164 0.809 1.00 1.00 O ATOM 1540 CB PHE A 104 -27.170 -49.226 0.879 1.00 1.00 C ATOM 1541 CG PHE A 104 -26.670 -50.648 1.042 1.00 1.00 C ATOM 1542 CD1 PHE A 104 -26.695 -51.538 -0.049 1.00 1.00 C ATOM 1543 CD2 PHE A 104 -26.189 -51.083 2.291 1.00 1.00 C ATOM 1544 CE1 PHE A 104 -26.248 -52.859 0.112 1.00 1.00 C ATOM 1545 CE2 PHE A 104 -25.764 -52.411 2.457 1.00 1.00 C ATOM 1546 CZ PHE A 104 -25.795 -53.298 1.367 1.00 1.00 C ATOM 0 H PHE A 104 -24.618 -48.091 0.816 1.00 1.00 H new ATOM 0 HA PHE A 104 -26.694 -48.677 -1.174 1.00 1.00 H new ATOM 0 HB2 PHE A 104 -27.105 -48.726 1.845 1.00 1.00 H new ATOM 0 HB3 PHE A 104 -28.225 -49.262 0.609 1.00 1.00 H new ATOM 0 HD1 PHE A 104 -27.058 -51.204 -1.010 1.00 1.00 H new ATOM 0 HD2 PHE A 104 -26.147 -50.395 3.122 1.00 1.00 H new ATOM 0 HE1 PHE A 104 -26.252 -53.537 -0.728 1.00 1.00 H new ATOM 0 HE2 PHE A 104 -25.414 -52.750 3.421 1.00 1.00 H new ATOM 0 HZ PHE A 104 -25.470 -54.320 1.495 1.00 1.00 H new ATOM 1556 N SER A 105 -27.907 -46.482 -0.698 1.00 1.00 N ATOM 1557 CA SER A 105 -28.468 -45.125 -0.607 1.00 1.00 C ATOM 1558 C SER A 105 -29.355 -44.903 0.629 1.00 1.00 C ATOM 1559 O SER A 105 -29.342 -43.804 1.191 1.00 1.00 O ATOM 1560 CB SER A 105 -29.273 -44.818 -1.876 1.00 1.00 C ATOM 1561 OG SER A 105 -30.212 -45.851 -2.143 1.00 1.00 O ATOM 0 H SER A 105 -28.398 -47.079 -1.363 1.00 1.00 H new ATOM 0 HA SER A 105 -27.621 -44.446 -0.507 1.00 1.00 H new ATOM 0 HB2 SER A 105 -29.795 -43.868 -1.760 1.00 1.00 H new ATOM 0 HB3 SER A 105 -28.596 -44.708 -2.723 1.00 1.00 H new ATOM 0 HG SER A 105 -30.715 -45.634 -2.955 1.00 1.00 H new ATOM 1567 N SER A 106 -30.098 -45.923 1.079 1.00 1.00 N ATOM 1568 CA SER A 106 -31.035 -45.849 2.219 1.00 1.00 C ATOM 1569 C SER A 106 -31.099 -47.158 3.035 1.00 1.00 C ATOM 1570 O SER A 106 -30.775 -48.220 2.494 1.00 1.00 O ATOM 1571 CB SER A 106 -32.447 -45.541 1.686 1.00 1.00 C ATOM 1572 OG SER A 106 -32.509 -44.294 1.008 1.00 1.00 O ATOM 0 H SER A 106 -30.067 -46.849 0.652 1.00 1.00 H new ATOM 0 HA SER A 106 -30.671 -45.064 2.882 1.00 1.00 H new ATOM 0 HB2 SER A 106 -32.758 -46.336 1.008 1.00 1.00 H new ATOM 0 HB3 SER A 106 -33.153 -45.536 2.517 1.00 1.00 H new ATOM 0 HG SER A 106 -33.422 -44.142 0.686 1.00 1.00 H new ATOM 1578 N PRO A 107 -31.545 -47.125 4.314 1.00 1.00 N ATOM 1579 CA PRO A 107 -31.655 -48.309 5.180 1.00 1.00 C ATOM 1580 C PRO A 107 -32.404 -49.503 4.568 1.00 1.00 C ATOM 1581 O PRO A 107 -31.980 -50.648 4.725 1.00 1.00 O ATOM 1582 CB PRO A 107 -32.367 -47.833 6.453 1.00 1.00 C ATOM 1583 CG PRO A 107 -32.090 -46.334 6.512 1.00 1.00 C ATOM 1584 CD PRO A 107 -31.966 -45.932 5.045 1.00 1.00 C ATOM 0 HA PRO A 107 -30.652 -48.696 5.360 1.00 1.00 H new ATOM 0 HB2 PRO A 107 -33.437 -48.037 6.408 1.00 1.00 H new ATOM 0 HB3 PRO A 107 -31.982 -48.342 7.336 1.00 1.00 H new ATOM 0 HG2 PRO A 107 -32.898 -45.796 7.008 1.00 1.00 H new ATOM 0 HG3 PRO A 107 -31.176 -46.117 7.065 1.00 1.00 H new ATOM 0 HD2 PRO A 107 -32.918 -45.561 4.664 1.00 1.00 H new ATOM 0 HD3 PRO A 107 -31.239 -45.128 4.925 1.00 1.00 H new ATOM 1592 N VAL A 108 -33.509 -49.255 3.852 1.00 1.00 N ATOM 1593 CA VAL A 108 -34.319 -50.312 3.215 1.00 1.00 C ATOM 1594 C VAL A 108 -33.515 -51.086 2.162 1.00 1.00 C ATOM 1595 O VAL A 108 -33.632 -52.307 2.066 1.00 1.00 O ATOM 1596 CB VAL A 108 -35.612 -49.735 2.598 1.00 1.00 C ATOM 1597 CG1 VAL A 108 -36.527 -50.841 2.058 1.00 1.00 C ATOM 1598 CG2 VAL A 108 -36.424 -48.936 3.629 1.00 1.00 C ATOM 0 H VAL A 108 -33.871 -48.314 3.696 1.00 1.00 H new ATOM 0 HA VAL A 108 -34.601 -51.014 4.000 1.00 1.00 H new ATOM 0 HB VAL A 108 -35.286 -49.085 1.786 1.00 1.00 H new ATOM 0 HG11 VAL A 108 -37.426 -50.394 1.632 1.00 1.00 H new ATOM 0 HG12 VAL A 108 -36.001 -51.404 1.287 1.00 1.00 H new ATOM 0 HG13 VAL A 108 -36.805 -51.512 2.871 1.00 1.00 H new ATOM 0 HG21 VAL A 108 -37.326 -48.546 3.158 1.00 1.00 H new ATOM 0 HG22 VAL A 108 -36.700 -49.587 4.458 1.00 1.00 H new ATOM 0 HG23 VAL A 108 -35.822 -48.107 4.003 1.00 1.00 H new ATOM 1608 N VAL A 109 -32.647 -50.400 1.409 1.00 1.00 N ATOM 1609 CA VAL A 109 -31.774 -51.019 0.393 1.00 1.00 C ATOM 1610 C VAL A 109 -30.789 -51.998 1.046 1.00 1.00 C ATOM 1611 O VAL A 109 -30.552 -53.080 0.506 1.00 1.00 O ATOM 1612 CB VAL A 109 -31.033 -49.947 -0.434 1.00 1.00 C ATOM 1613 CG1 VAL A 109 -30.204 -50.563 -1.567 1.00 1.00 C ATOM 1614 CG2 VAL A 109 -32.017 -48.958 -1.076 1.00 1.00 C ATOM 0 H VAL A 109 -32.526 -49.390 1.485 1.00 1.00 H new ATOM 0 HA VAL A 109 -32.404 -51.584 -0.294 1.00 1.00 H new ATOM 0 HB VAL A 109 -30.376 -49.435 0.269 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -29.701 -49.771 -2.122 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -29.461 -51.241 -1.147 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -30.860 -51.116 -2.239 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -31.464 -48.216 -1.651 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -32.696 -49.497 -1.737 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -32.591 -48.458 -0.296 1.00 1.00 H new ATOM 1624 N ALA A 110 -30.270 -51.666 2.236 1.00 1.00 N ATOM 1625 CA ALA A 110 -29.396 -52.558 2.998 1.00 1.00 C ATOM 1626 C ALA A 110 -30.130 -53.855 3.385 1.00 1.00 C ATOM 1627 O ALA A 110 -29.619 -54.951 3.156 1.00 1.00 O ATOM 1628 CB ALA A 110 -28.871 -51.826 4.237 1.00 1.00 C ATOM 0 H ALA A 110 -30.446 -50.772 2.694 1.00 1.00 H new ATOM 0 HA ALA A 110 -28.549 -52.842 2.373 1.00 1.00 H new ATOM 0 HB1 ALA A 110 -28.220 -52.491 4.804 1.00 1.00 H new ATOM 0 HB2 ALA A 110 -28.309 -50.945 3.928 1.00 1.00 H new ATOM 0 HB3 ALA A 110 -29.710 -51.520 4.862 1.00 1.00 H new ATOM 1634 N GLU A 111 -31.356 -53.744 3.915 1.00 1.00 N ATOM 1635 CA GLU A 111 -32.180 -54.910 4.272 1.00 1.00 C ATOM 1636 C GLU A 111 -32.495 -55.780 3.043 1.00 1.00 C ATOM 1637 O GLU A 111 -32.367 -57.004 3.112 1.00 1.00 O ATOM 1638 CB GLU A 111 -33.489 -54.475 4.952 1.00 1.00 C ATOM 1639 CG GLU A 111 -33.259 -53.771 6.295 1.00 1.00 C ATOM 1640 CD GLU A 111 -34.596 -53.501 7.010 1.00 1.00 C ATOM 1641 OE1 GLU A 111 -35.246 -52.464 6.729 1.00 1.00 O ATOM 1642 OE2 GLU A 111 -35.008 -54.323 7.864 1.00 1.00 O ATOM 0 H GLU A 111 -31.804 -52.848 4.108 1.00 1.00 H new ATOM 0 HA GLU A 111 -31.599 -55.507 4.974 1.00 1.00 H new ATOM 0 HB2 GLU A 111 -34.034 -53.806 4.286 1.00 1.00 H new ATOM 0 HB3 GLU A 111 -34.119 -55.350 5.110 1.00 1.00 H new ATOM 0 HG2 GLU A 111 -32.621 -54.387 6.929 1.00 1.00 H new ATOM 0 HG3 GLU A 111 -32.733 -52.830 6.132 1.00 1.00 H new ATOM 1649 N SER A 112 -32.850 -55.163 1.906 1.00 1.00 N ATOM 1650 CA SER A 112 -33.113 -55.866 0.640 1.00 1.00 C ATOM 1651 C SER A 112 -31.882 -56.631 0.139 1.00 1.00 C ATOM 1652 O SER A 112 -32.017 -57.742 -0.376 1.00 1.00 O ATOM 1653 CB SER A 112 -33.582 -54.892 -0.447 1.00 1.00 C ATOM 1654 OG SER A 112 -34.869 -54.384 -0.136 1.00 1.00 O ATOM 0 H SER A 112 -32.964 -54.152 1.838 1.00 1.00 H new ATOM 0 HA SER A 112 -33.905 -56.586 0.846 1.00 1.00 H new ATOM 0 HB2 SER A 112 -32.872 -54.070 -0.538 1.00 1.00 H new ATOM 0 HB3 SER A 112 -33.608 -55.399 -1.412 1.00 1.00 H new ATOM 0 HG SER A 112 -34.788 -53.680 0.541 1.00 1.00 H new ATOM 1660 N HIS A 113 -30.676 -56.079 0.315 1.00 1.00 N ATOM 1661 CA HIS A 113 -29.433 -56.761 -0.047 1.00 1.00 C ATOM 1662 C HIS A 113 -29.167 -57.958 0.885 1.00 1.00 C ATOM 1663 O HIS A 113 -28.882 -59.055 0.402 1.00 1.00 O ATOM 1664 CB HIS A 113 -28.263 -55.768 -0.020 1.00 1.00 C ATOM 1665 CG HIS A 113 -26.934 -56.436 -0.278 1.00 1.00 C ATOM 1666 ND1 HIS A 113 -26.458 -56.875 -1.492 1.00 1.00 N ATOM 1667 CD2 HIS A 113 -26.019 -56.808 0.670 1.00 1.00 C ATOM 1668 CE1 HIS A 113 -25.289 -57.504 -1.277 1.00 1.00 C ATOM 1669 NE2 HIS A 113 -24.974 -57.479 0.028 1.00 1.00 N ATOM 0 H HIS A 113 -30.537 -55.150 0.711 1.00 1.00 H new ATOM 0 HA HIS A 113 -29.533 -57.152 -1.060 1.00 1.00 H new ATOM 0 HB2 HIS A 113 -28.429 -54.995 -0.770 1.00 1.00 H new ATOM 0 HB3 HIS A 113 -28.234 -55.271 0.950 1.00 1.00 H new ATOM 0 HD1 HIS A 113 -26.912 -56.746 -2.396 1.00 1.00 H new ATOM 0 HD2 HIS A 113 -26.092 -56.616 1.730 1.00 1.00 H new ATOM 0 HE1 HIS A 113 -24.688 -57.965 -2.047 1.00 1.00 H new ATOM 1677 N TYR A 114 -29.282 -57.774 2.207 1.00 1.00 N ATOM 1678 CA TYR A 114 -29.036 -58.825 3.203 1.00 1.00 C ATOM 1679 C TYR A 114 -29.906 -60.083 3.029 1.00 1.00 C ATOM 1680 O TYR A 114 -29.426 -61.188 3.298 1.00 1.00 O ATOM 1681 CB TYR A 114 -29.167 -58.257 4.627 1.00 1.00 C ATOM 1682 CG TYR A 114 -28.208 -57.137 5.023 1.00 1.00 C ATOM 1683 CD1 TYR A 114 -26.950 -56.988 4.402 1.00 1.00 C ATOM 1684 CD2 TYR A 114 -28.572 -56.254 6.061 1.00 1.00 C ATOM 1685 CE1 TYR A 114 -26.078 -55.952 4.787 1.00 1.00 C ATOM 1686 CE2 TYR A 114 -27.694 -55.227 6.465 1.00 1.00 C ATOM 1687 CZ TYR A 114 -26.450 -55.069 5.819 1.00 1.00 C ATOM 1688 OH TYR A 114 -25.589 -54.102 6.233 1.00 1.00 O ATOM 0 H TYR A 114 -29.552 -56.881 2.619 1.00 1.00 H new ATOM 0 HA TYR A 114 -28.012 -59.160 3.035 1.00 1.00 H new ATOM 0 HB2 TYR A 114 -30.186 -57.889 4.751 1.00 1.00 H new ATOM 0 HB3 TYR A 114 -29.036 -59.078 5.332 1.00 1.00 H new ATOM 0 HD1 TYR A 114 -26.653 -57.675 3.624 1.00 1.00 H new ATOM 0 HD2 TYR A 114 -29.529 -56.365 6.549 1.00 1.00 H new ATOM 0 HE1 TYR A 114 -25.125 -55.835 4.292 1.00 1.00 H new ATOM 0 HE2 TYR A 114 -27.974 -54.562 7.269 1.00 1.00 H new ATOM 0 HH TYR A 114 -26.008 -53.223 6.125 1.00 1.00 H new ATOM 1698 N ILE A 115 -31.152 -59.950 2.556 1.00 1.00 N ATOM 1699 CA ILE A 115 -32.046 -61.099 2.293 1.00 1.00 C ATOM 1700 C ILE A 115 -31.828 -61.738 0.906 1.00 1.00 C ATOM 1701 O ILE A 115 -32.435 -62.769 0.602 1.00 1.00 O ATOM 1702 CB ILE A 115 -33.534 -60.752 2.560 1.00 1.00 C ATOM 1703 CG1 ILE A 115 -34.156 -59.639 1.685 1.00 1.00 C ATOM 1704 CG2 ILE A 115 -33.702 -60.368 4.043 1.00 1.00 C ATOM 1705 CD1 ILE A 115 -34.466 -60.035 0.236 1.00 1.00 C ATOM 0 H ILE A 115 -31.574 -59.046 2.343 1.00 1.00 H new ATOM 0 HA ILE A 115 -31.766 -61.868 3.013 1.00 1.00 H new ATOM 0 HB ILE A 115 -34.078 -61.657 2.288 1.00 1.00 H new ATOM 0 HG12 ILE A 115 -35.079 -59.303 2.157 1.00 1.00 H new ATOM 0 HG13 ILE A 115 -33.476 -58.787 1.673 1.00 1.00 H new ATOM 0 HG21 ILE A 115 -34.746 -60.122 4.239 1.00 1.00 H new ATOM 0 HG22 ILE A 115 -33.402 -61.206 4.672 1.00 1.00 H new ATOM 0 HG23 ILE A 115 -33.077 -59.504 4.268 1.00 1.00 H new ATOM 0 HD11 ILE A 115 -34.898 -59.183 -0.289 1.00 1.00 H new ATOM 0 HD12 ILE A 115 -33.546 -60.340 -0.263 1.00 1.00 H new ATOM 0 HD13 ILE A 115 -35.174 -60.863 0.229 1.00 1.00 H new ATOM 1717 N GLY A 116 -30.965 -61.158 0.063 1.00 1.00 N ATOM 1718 CA GLY A 116 -30.658 -61.648 -1.283 1.00 1.00 C ATOM 1719 C GLY A 116 -29.550 -62.707 -1.305 1.00 1.00 C ATOM 1720 O GLY A 116 -28.643 -62.709 -0.467 1.00 1.00 O ATOM 0 H GLY A 116 -30.448 -60.313 0.306 1.00 1.00 H new ATOM 0 HA2 GLY A 116 -31.562 -62.069 -1.724 1.00 1.00 H new ATOM 0 HA3 GLY A 116 -30.360 -60.807 -1.909 1.00 1.00 H new ATOM 1724 N LYS A 117 -29.603 -63.614 -2.290 1.00 1.00 N ATOM 1725 CA LYS A 117 -28.635 -64.718 -2.446 1.00 1.00 C ATOM 1726 C LYS A 117 -27.182 -64.251 -2.595 1.00 1.00 C ATOM 1727 O LYS A 117 -26.281 -64.940 -2.124 1.00 1.00 O ATOM 1728 CB LYS A 117 -29.039 -65.629 -3.622 1.00 1.00 C ATOM 1729 CG LYS A 117 -30.438 -66.263 -3.509 1.00 1.00 C ATOM 1730 CD LYS A 117 -30.624 -67.114 -2.240 1.00 1.00 C ATOM 1731 CE LYS A 117 -31.937 -67.912 -2.252 1.00 1.00 C ATOM 1732 NZ LYS A 117 -33.139 -67.041 -2.155 1.00 1.00 N ATOM 0 H LYS A 117 -30.325 -63.605 -3.010 1.00 1.00 H new ATOM 0 HA LYS A 117 -28.672 -65.286 -1.517 1.00 1.00 H new ATOM 0 HB2 LYS A 117 -28.994 -65.048 -4.543 1.00 1.00 H new ATOM 0 HB3 LYS A 117 -28.302 -66.427 -3.712 1.00 1.00 H new ATOM 0 HG2 LYS A 117 -31.189 -65.473 -3.521 1.00 1.00 H new ATOM 0 HG3 LYS A 117 -30.618 -66.886 -4.385 1.00 1.00 H new ATOM 0 HD2 LYS A 117 -29.785 -67.803 -2.143 1.00 1.00 H new ATOM 0 HD3 LYS A 117 -30.606 -66.464 -1.365 1.00 1.00 H new ATOM 0 HE2 LYS A 117 -31.992 -68.499 -3.169 1.00 1.00 H new ATOM 0 HE3 LYS A 117 -31.936 -68.617 -1.421 1.00 1.00 H new ATOM 0 HZ1 LYS A 117 -33.996 -67.630 -2.167 1.00 1.00 H new ATOM 0 HZ2 LYS A 117 -33.104 -66.499 -1.268 1.00 1.00 H new ATOM 0 HZ3 LYS A 117 -33.158 -66.385 -2.962 1.00 1.00 H new ATOM 1746 N THR A 118 -26.943 -63.081 -3.194 1.00 1.00 N ATOM 1747 CA THR A 118 -25.598 -62.489 -3.348 1.00 1.00 C ATOM 1748 C THR A 118 -24.922 -62.279 -1.990 1.00 1.00 C ATOM 1749 O THR A 118 -23.743 -62.602 -1.820 1.00 1.00 O ATOM 1750 CB THR A 118 -25.677 -61.149 -4.102 1.00 1.00 C ATOM 1751 OG1 THR A 118 -26.415 -61.318 -5.295 1.00 1.00 O ATOM 1752 CG2 THR A 118 -24.300 -60.603 -4.489 1.00 1.00 C ATOM 0 H THR A 118 -27.684 -62.505 -3.593 1.00 1.00 H new ATOM 0 HA THR A 118 -24.997 -63.190 -3.927 1.00 1.00 H new ATOM 0 HB THR A 118 -26.155 -60.442 -3.424 1.00 1.00 H new ATOM 0 HG1 THR A 118 -26.465 -60.464 -5.772 1.00 1.00 H new ATOM 0 HG21 THR A 118 -24.419 -59.657 -5.018 1.00 1.00 H new ATOM 0 HG22 THR A 118 -23.706 -60.444 -3.589 1.00 1.00 H new ATOM 0 HG23 THR A 118 -23.793 -61.319 -5.136 1.00 1.00 H new ATOM 1760 N HIS A 119 -25.669 -61.795 -0.992 1.00 1.00 N ATOM 1761 CA HIS A 119 -25.164 -61.619 0.372 1.00 1.00 C ATOM 1762 C HIS A 119 -24.937 -62.973 1.050 1.00 1.00 C ATOM 1763 O HIS A 119 -23.879 -63.201 1.631 1.00 1.00 O ATOM 1764 CB HIS A 119 -26.146 -60.761 1.177 1.00 1.00 C ATOM 1765 CG HIS A 119 -25.592 -60.360 2.519 1.00 1.00 C ATOM 1766 ND1 HIS A 119 -24.609 -59.392 2.723 1.00 1.00 N ATOM 1767 CD2 HIS A 119 -25.974 -60.868 3.727 1.00 1.00 C ATOM 1768 CE1 HIS A 119 -24.414 -59.339 4.050 1.00 1.00 C ATOM 1769 NE2 HIS A 119 -25.227 -60.206 4.678 1.00 1.00 N ATOM 0 H HIS A 119 -26.643 -61.514 -1.109 1.00 1.00 H new ATOM 0 HA HIS A 119 -24.202 -61.108 0.329 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -26.394 -59.866 0.607 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -27.074 -61.314 1.321 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -26.714 -61.635 3.903 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -23.704 -58.691 4.543 1.00 1.00 H new ATOM 0 HE2 HIS A 119 -25.282 -60.350 5.686 1.00 1.00 H new ATOM 1777 N ILE A 120 -25.899 -63.896 0.933 1.00 1.00 N ATOM 1778 CA ILE A 120 -25.831 -65.251 1.517 1.00 1.00 C ATOM 1779 C ILE A 120 -24.628 -66.044 0.981 1.00 1.00 C ATOM 1780 O ILE A 120 -23.941 -66.717 1.754 1.00 1.00 O ATOM 1781 CB ILE A 120 -27.184 -65.983 1.357 1.00 1.00 C ATOM 1782 CG1 ILE A 120 -28.271 -65.169 2.106 1.00 1.00 C ATOM 1783 CG2 ILE A 120 -27.111 -67.424 1.895 1.00 1.00 C ATOM 1784 CD1 ILE A 120 -29.687 -65.754 2.039 1.00 1.00 C ATOM 0 H ILE A 120 -26.764 -63.724 0.421 1.00 1.00 H new ATOM 0 HA ILE A 120 -25.656 -65.160 2.589 1.00 1.00 H new ATOM 0 HB ILE A 120 -27.434 -66.054 0.298 1.00 1.00 H new ATOM 0 HG12 ILE A 120 -27.980 -65.082 3.153 1.00 1.00 H new ATOM 0 HG13 ILE A 120 -28.293 -64.159 1.696 1.00 1.00 H new ATOM 0 HG21 ILE A 120 -28.078 -67.910 1.767 1.00 1.00 H new ATOM 0 HG22 ILE A 120 -26.351 -67.979 1.346 1.00 1.00 H new ATOM 0 HG23 ILE A 120 -26.852 -67.404 2.954 1.00 1.00 H new ATOM 0 HD11 ILE A 120 -30.372 -65.112 2.593 1.00 1.00 H new ATOM 0 HD12 ILE A 120 -30.007 -65.814 0.999 1.00 1.00 H new ATOM 0 HD13 ILE A 120 -29.690 -66.752 2.478 1.00 1.00 H new ATOM 1796 N LYS A 121 -24.304 -65.921 -0.313 1.00 1.00 N ATOM 1797 CA LYS A 121 -23.103 -66.526 -0.916 1.00 1.00 C ATOM 1798 C LYS A 121 -21.839 -66.000 -0.222 1.00 1.00 C ATOM 1799 O LYS A 121 -20.971 -66.781 0.165 1.00 1.00 O ATOM 1800 CB LYS A 121 -23.100 -66.241 -2.429 1.00 1.00 C ATOM 1801 CG LYS A 121 -21.940 -66.943 -3.158 1.00 1.00 C ATOM 1802 CD LYS A 121 -21.880 -66.610 -4.657 1.00 1.00 C ATOM 1803 CE LYS A 121 -23.103 -67.129 -5.426 1.00 1.00 C ATOM 1804 NZ LYS A 121 -22.983 -66.864 -6.884 1.00 1.00 N ATOM 0 H LYS A 121 -24.871 -65.395 -0.978 1.00 1.00 H new ATOM 0 HA LYS A 121 -23.115 -67.607 -0.776 1.00 1.00 H new ATOM 0 HB2 LYS A 121 -24.047 -66.568 -2.859 1.00 1.00 H new ATOM 0 HB3 LYS A 121 -23.030 -65.166 -2.593 1.00 1.00 H new ATOM 0 HG2 LYS A 121 -20.998 -66.656 -2.690 1.00 1.00 H new ATOM 0 HG3 LYS A 121 -22.041 -68.021 -3.035 1.00 1.00 H new ATOM 0 HD2 LYS A 121 -21.808 -65.530 -4.783 1.00 1.00 H new ATOM 0 HD3 LYS A 121 -20.976 -67.042 -5.086 1.00 1.00 H new ATOM 0 HE2 LYS A 121 -23.212 -68.200 -5.258 1.00 1.00 H new ATOM 0 HE3 LYS A 121 -24.005 -66.653 -5.042 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 -23.826 -67.227 -7.373 1.00 1.00 H new ATOM 0 HZ2 LYS A 121 -22.904 -65.840 -7.045 1.00 1.00 H new ATOM 0 HZ3 LYS A 121 -22.136 -67.339 -7.255 1.00 1.00 H new ATOM 1818 N ASN A 122 -21.768 -64.685 -0.002 1.00 1.00 N ATOM 1819 CA ASN A 122 -20.660 -64.051 0.710 1.00 1.00 C ATOM 1820 C ASN A 122 -20.567 -64.497 2.184 1.00 1.00 C ATOM 1821 O ASN A 122 -19.448 -64.653 2.666 1.00 1.00 O ATOM 1822 CB ASN A 122 -20.721 -62.526 0.542 1.00 1.00 C ATOM 1823 CG ASN A 122 -20.147 -62.091 -0.797 1.00 1.00 C ATOM 1824 OD1 ASN A 122 -18.949 -61.902 -0.951 1.00 1.00 O ATOM 1825 ND2 ASN A 122 -20.959 -61.950 -1.820 1.00 1.00 N ATOM 0 H ASN A 122 -22.483 -64.028 -0.315 1.00 1.00 H new ATOM 0 HA ASN A 122 -19.729 -64.392 0.257 1.00 1.00 H new ATOM 0 HB2 ASN A 122 -21.755 -62.191 0.622 1.00 1.00 H new ATOM 0 HB3 ASN A 122 -20.167 -62.047 1.350 1.00 1.00 H new ATOM 0 HD21 ASN A 122 -20.588 -61.685 -2.733 1.00 1.00 H new ATOM 0 HD22 ASN A 122 -21.960 -62.105 -1.702 1.00 1.00 H new ATOM 1832 N LEU A 123 -21.677 -64.775 2.889 1.00 1.00 N ATOM 1833 CA LEU A 123 -21.631 -65.295 4.274 1.00 1.00 C ATOM 1834 C LEU A 123 -20.793 -66.583 4.355 1.00 1.00 C ATOM 1835 O LEU A 123 -19.960 -66.739 5.252 1.00 1.00 O ATOM 1836 CB LEU A 123 -23.039 -65.613 4.828 1.00 1.00 C ATOM 1837 CG LEU A 123 -24.084 -64.488 4.866 1.00 1.00 C ATOM 1838 CD1 LEU A 123 -25.405 -65.034 5.414 1.00 1.00 C ATOM 1839 CD2 LEU A 123 -23.677 -63.300 5.726 1.00 1.00 C ATOM 0 H LEU A 123 -22.621 -64.649 2.525 1.00 1.00 H new ATOM 0 HA LEU A 123 -21.177 -64.505 4.873 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -23.452 -66.429 4.235 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -22.918 -65.987 5.845 1.00 1.00 H new ATOM 0 HG LEU A 123 -24.181 -64.135 3.839 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -26.146 -64.235 5.441 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -25.761 -65.838 4.770 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -25.250 -65.418 6.422 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -24.465 -62.547 5.703 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -23.521 -63.631 6.753 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -22.753 -62.870 5.339 1.00 1.00 H new ATOM 1851 N ARG A 124 -21.001 -67.499 3.396 1.00 1.00 N ATOM 1852 CA ARG A 124 -20.278 -68.779 3.296 1.00 1.00 C ATOM 1853 C ARG A 124 -18.814 -68.579 2.896 1.00 1.00 C ATOM 1854 O ARG A 124 -17.934 -69.184 3.506 1.00 1.00 O ATOM 1855 CB ARG A 124 -21.001 -69.724 2.319 1.00 1.00 C ATOM 1856 CG ARG A 124 -22.410 -70.094 2.819 1.00 1.00 C ATOM 1857 CD ARG A 124 -23.064 -71.196 1.977 1.00 1.00 C ATOM 1858 NE ARG A 124 -23.376 -70.753 0.603 1.00 1.00 N ATOM 1859 CZ ARG A 124 -23.821 -71.515 -0.381 1.00 1.00 C ATOM 1860 NH1 ARG A 124 -24.034 -72.792 -0.228 1.00 1.00 N ATOM 1861 NH2 ARG A 124 -24.070 -71.007 -1.555 1.00 1.00 N ATOM 0 H ARG A 124 -21.689 -67.369 2.654 1.00 1.00 H new ATOM 0 HA ARG A 124 -20.273 -69.239 4.284 1.00 1.00 H new ATOM 0 HB2 ARG A 124 -21.076 -69.248 1.341 1.00 1.00 H new ATOM 0 HB3 ARG A 124 -20.412 -70.632 2.188 1.00 1.00 H new ATOM 0 HG2 ARG A 124 -22.349 -70.423 3.856 1.00 1.00 H new ATOM 0 HG3 ARG A 124 -23.042 -69.206 2.803 1.00 1.00 H new ATOM 0 HD2 ARG A 124 -22.399 -72.058 1.934 1.00 1.00 H new ATOM 0 HD3 ARG A 124 -23.981 -71.525 2.466 1.00 1.00 H new ATOM 0 HE ARG A 124 -23.235 -69.765 0.394 1.00 1.00 H new ATOM 0 HH11 ARG A 124 -23.857 -73.234 0.674 1.00 1.00 H new ATOM 0 HH12 ARG A 124 -24.378 -73.349 -1.010 1.00 1.00 H new ATOM 0 HH21 ARG A 124 -23.922 -70.012 -1.722 1.00 1.00 H new ATOM 0 HH22 ARG A 124 -24.413 -71.605 -2.307 1.00 1.00 H new ATOM 1875 N LEU A 125 -18.541 -67.706 1.922 1.00 1.00 N ATOM 1876 CA LEU A 125 -17.175 -67.378 1.473 1.00 1.00 C ATOM 1877 C LEU A 125 -16.335 -66.706 2.579 1.00 1.00 C ATOM 1878 O LEU A 125 -15.136 -66.973 2.693 1.00 1.00 O ATOM 1879 CB LEU A 125 -17.239 -66.475 0.225 1.00 1.00 C ATOM 1880 CG LEU A 125 -17.788 -67.158 -1.044 1.00 1.00 C ATOM 1881 CD1 LEU A 125 -18.005 -66.112 -2.138 1.00 1.00 C ATOM 1882 CD2 LEU A 125 -16.834 -68.224 -1.588 1.00 1.00 C ATOM 0 H LEU A 125 -19.266 -67.199 1.415 1.00 1.00 H new ATOM 0 HA LEU A 125 -16.678 -68.316 1.224 1.00 1.00 H new ATOM 0 HB2 LEU A 125 -17.862 -65.610 0.452 1.00 1.00 H new ATOM 0 HB3 LEU A 125 -16.237 -66.100 0.014 1.00 1.00 H new ATOM 0 HG LEU A 125 -18.725 -67.640 -0.766 1.00 1.00 H new ATOM 0 HD11 LEU A 125 -18.393 -66.597 -3.034 1.00 1.00 H new ATOM 0 HD12 LEU A 125 -18.720 -65.366 -1.791 1.00 1.00 H new ATOM 0 HD13 LEU A 125 -17.057 -65.626 -2.370 1.00 1.00 H new ATOM 0 HD21 LEU A 125 -17.265 -68.676 -2.481 1.00 1.00 H new ATOM 0 HD22 LEU A 125 -15.879 -67.763 -1.839 1.00 1.00 H new ATOM 0 HD23 LEU A 125 -16.678 -68.993 -0.831 1.00 1.00 H new ATOM 1894 N ARG A 126 -16.960 -65.856 3.407 1.00 1.00 N ATOM 1895 CA ARG A 126 -16.340 -65.144 4.543 1.00 1.00 C ATOM 1896 C ARG A 126 -16.319 -65.969 5.839 1.00 1.00 C ATOM 1897 O ARG A 126 -15.706 -65.548 6.820 1.00 1.00 O ATOM 1898 CB ARG A 126 -17.105 -63.826 4.777 1.00 1.00 C ATOM 1899 CG ARG A 126 -16.989 -62.823 3.613 1.00 1.00 C ATOM 1900 CD ARG A 126 -15.614 -62.148 3.558 1.00 1.00 C ATOM 1901 NE ARG A 126 -15.488 -61.301 2.354 1.00 1.00 N ATOM 1902 CZ ARG A 126 -15.521 -59.982 2.283 1.00 1.00 C ATOM 1903 NH1 ARG A 126 -15.603 -59.223 3.338 1.00 1.00 N ATOM 1904 NH2 ARG A 126 -15.464 -59.387 1.129 1.00 1.00 N ATOM 0 H ARG A 126 -17.950 -65.634 3.303 1.00 1.00 H new ATOM 0 HA ARG A 126 -15.299 -64.955 4.282 1.00 1.00 H new ATOM 0 HB2 ARG A 126 -18.158 -64.053 4.945 1.00 1.00 H new ATOM 0 HB3 ARG A 126 -16.731 -63.357 5.687 1.00 1.00 H new ATOM 0 HG2 ARG A 126 -17.175 -63.340 2.672 1.00 1.00 H new ATOM 0 HG3 ARG A 126 -17.761 -62.061 3.716 1.00 1.00 H new ATOM 0 HD2 ARG A 126 -15.467 -61.541 4.451 1.00 1.00 H new ATOM 0 HD3 ARG A 126 -14.832 -62.907 3.556 1.00 1.00 H new ATOM 0 HE ARG A 126 -15.360 -61.794 1.470 1.00 1.00 H new ATOM 0 HH11 ARG A 126 -15.645 -59.643 4.267 1.00 1.00 H new ATOM 0 HH12 ARG A 126 -15.626 -58.208 3.236 1.00 1.00 H new ATOM 0 HH21 ARG A 126 -15.394 -59.938 0.274 1.00 1.00 H new ATOM 0 HH22 ARG A 126 -15.490 -58.369 1.078 1.00 1.00 H new ATOM 1918 N GLU A 127 -16.988 -67.125 5.848 1.00 1.00 N ATOM 1919 CA GLU A 127 -17.141 -68.040 6.992 1.00 1.00 C ATOM 1920 C GLU A 127 -17.696 -67.312 8.242 1.00 1.00 C ATOM 1921 O GLU A 127 -17.226 -67.483 9.370 1.00 1.00 O ATOM 1922 CB GLU A 127 -15.834 -68.835 7.207 1.00 1.00 C ATOM 1923 CG GLU A 127 -16.052 -70.181 7.950 1.00 1.00 C ATOM 1924 CD GLU A 127 -14.695 -71.048 8.080 1.00 1.00 C ATOM 1925 OE1 GLU A 127 -14.540 -70.397 9.144 1.00 1.00 O ATOM 1926 OE2 GLU A 127 -15.069 -71.554 6.992 1.00 1.00 O ATOM 0 H GLU A 127 -17.465 -67.470 5.015 1.00 1.00 H new ATOM 0 HA GLU A 127 -17.906 -68.785 6.773 1.00 1.00 H new ATOM 0 HB2 GLU A 127 -15.373 -69.032 6.239 1.00 1.00 H new ATOM 0 HB3 GLU A 127 -15.133 -68.223 7.775 1.00 1.00 H new ATOM 0 HG2 GLU A 127 -16.448 -69.982 8.946 1.00 1.00 H new ATOM 0 HG3 GLU A 127 -16.803 -70.767 7.420 1.00 1.00 H new ATOM 1933 N GLN A 128 -18.696 -66.447 8.020 1.00 1.00 N ATOM 1934 CA GLN A 128 -19.329 -65.600 9.035 1.00 1.00 C ATOM 1935 C GLN A 128 -20.831 -65.424 8.752 1.00 1.00 C ATOM 1936 O GLN A 128 -21.225 -64.861 7.724 1.00 1.00 O ATOM 1937 CB GLN A 128 -18.583 -64.253 9.069 1.00 1.00 C ATOM 1938 CG GLN A 128 -19.090 -63.320 10.179 1.00 1.00 C ATOM 1939 CD GLN A 128 -18.277 -62.027 10.262 1.00 1.00 C ATOM 1940 OE1 GLN A 128 -18.093 -61.305 9.290 1.00 1.00 O ATOM 1941 NE2 GLN A 128 -17.760 -61.674 11.422 1.00 1.00 N ATOM 0 H GLN A 128 -19.100 -66.315 7.093 1.00 1.00 H new ATOM 0 HA GLN A 128 -19.260 -66.072 10.015 1.00 1.00 H new ATOM 0 HB2 GLN A 128 -17.518 -64.436 9.213 1.00 1.00 H new ATOM 0 HB3 GLN A 128 -18.694 -63.757 8.105 1.00 1.00 H new ATOM 0 HG2 GLN A 128 -20.137 -63.078 9.998 1.00 1.00 H new ATOM 0 HG3 GLN A 128 -19.044 -63.839 11.137 1.00 1.00 H new ATOM 0 HE21 GLN A 128 -17.902 -62.262 12.244 1.00 1.00 H new ATOM 0 HE22 GLN A 128 -17.218 -60.813 11.498 1.00 1.00 H new TER 1950 GLN A 128 HETATM 1951 ZN ZN A 129 -5.153 6.778 7.212 1.00 1.00 ZN HETATM 1952 ZN ZN A 130 -23.571 -58.121 1.433 1.00 1.00 ZN