USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1089 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 HIS : no HD1:sc= -0.58 X(o=-1.2,f=-0.91) USER MOD Set 1.2: A 110 SER OG : rot 80:sc= -0.683 USER MOD Set 1.3: A 114 LYS NZ :NH3+ 165:sc= 0.0793 (180deg=0) USER MOD Set 2.1: A 54 THR OG1 : rot 180:sc= -0.828 USER MOD Set 2.2: A 57 MET CE :methyl -163:sc= -3.15! (180deg=-3.84!) USER MOD Single : A 1 GLY N :NH3+ -125:sc= 0.0413 (180deg=0) USER MOD Single : A 5 SER OG : rot 52:sc= 0.165 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0478 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.347 X(o=-0.35,f=-0.44) USER MOD Single : A 29 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.044) USER MOD Single : A 30 GLN : amide:sc= -0.0476 X(o=-0.048,f=0) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 33 ASN : amide:sc= -0.0232 K(o=-0.023,f=-0.87) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN :FLIP amide:sc= -0.602 F(o=-1.3,f=-0.6) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.456 K(o=-0.46,f=-1.1) USER MOD Single : A 42 GLN : amide:sc= -0.298 X(o=-0.3,f=0) USER MOD Single : A 46 HIS : no HD1:sc= -0.957 X(o=-0.96,f=-0.86) USER MOD Single : A 48 GLN : amide:sc= 0.0116 X(o=0.012,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.163 K(o=-0.16,f=-0.97) USER MOD Single : A 56 SER OG : rot 180:sc= -0.16 USER MOD Single : A 60 SER OG : rot -36:sc= 0.118 USER MOD Single : A 64 GLN : amide:sc= -0.0217 X(o=-0.022,f=0) USER MOD Single : A 66 GLN : amide:sc= -2.33! C(o=-2.3!,f=-3.4!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 MET CE :methyl 143:sc= -2.42! (180deg=-3.39!) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 81 MET CE :methyl 167:sc= -1.64 (180deg=-2) USER MOD Single : A 82 HIS : no HE2:sc= -7.34! C(o=-7.3!,f=-12!) USER MOD Single : A 84 THR OG1 : rot -22:sc= 0.848 USER MOD Single : A 88 LYS NZ :NH3+ 176:sc= -1.46 (180deg=-1.51) USER MOD Single : A 90 THR OG1 : rot -80:sc= -2.83! USER MOD Single : A 92 MET CE :methyl 148:sc= -1.27 (180deg=-3.65!) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 115:sc= 0.128 USER MOD Single : A 104 MET CE :methyl 168:sc= -8.13! (180deg=-8.69!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 HIS : no HE2:sc= -1.2 K(o=-1.2,f=-3.9!) USER MOD Single : A 126 GLN : amide:sc= -0.262 K(o=-0.26,f=-2.7!) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0.122 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.0159 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.0186 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -29.997 -10.443 36.825 1.00 0.00 N ATOM 2 CA GLY A 1 -31.113 -11.247 37.394 1.00 0.00 C ATOM 3 C GLY A 1 -31.804 -12.106 36.350 1.00 0.00 C ATOM 4 O GLY A 1 -31.216 -12.410 35.311 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.124 -10.637 37.355 1.00 0.00 H new ATOM 0 H2 GLY A 1 -29.859 -10.698 35.826 1.00 0.00 H new ATOM 0 H3 GLY A 1 -30.227 -9.431 36.895 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -30.727 -11.886 38.188 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -31.843 -10.578 37.850 1.00 0.00 H new ATOM 10 N PRO A 2 -33.062 -12.514 36.597 1.00 0.00 N ATOM 11 CA PRO A 2 -33.825 -13.347 35.659 1.00 0.00 C ATOM 12 C PRO A 2 -33.915 -12.722 34.271 1.00 0.00 C ATOM 13 O PRO A 2 -34.313 -11.566 34.125 1.00 0.00 O ATOM 14 CB PRO A 2 -35.213 -13.431 36.298 1.00 0.00 C ATOM 15 CG PRO A 2 -34.982 -13.171 37.746 1.00 0.00 C ATOM 16 CD PRO A 2 -33.839 -12.199 37.811 1.00 0.00 C ATOM 0 HA PRO A 2 -33.355 -14.318 35.505 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -35.892 -12.695 35.867 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -35.663 -14.411 36.139 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -35.874 -12.757 38.216 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -34.742 -14.093 38.275 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -34.188 -11.166 37.810 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -33.246 -12.334 38.715 1.00 0.00 H new ATOM 24 N LEU A 3 -33.540 -13.493 33.254 1.00 0.00 N ATOM 25 CA LEU A 3 -33.576 -13.014 31.877 1.00 0.00 C ATOM 26 C LEU A 3 -34.878 -13.418 31.193 1.00 0.00 C ATOM 27 O LEU A 3 -35.305 -12.783 30.227 1.00 0.00 O ATOM 28 CB LEU A 3 -32.383 -13.562 31.092 1.00 0.00 C ATOM 29 CG LEU A 3 -32.141 -15.065 31.242 1.00 0.00 C ATOM 30 CD1 LEU A 3 -32.031 -15.725 29.875 1.00 0.00 C ATOM 31 CD2 LEU A 3 -30.889 -15.324 32.064 1.00 0.00 C ATOM 0 H LEU A 3 -33.208 -14.452 33.358 1.00 0.00 H new ATOM 0 HA LEU A 3 -33.520 -11.926 31.897 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -32.529 -13.337 30.036 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -31.485 -13.032 31.409 1.00 0.00 H new ATOM 0 HG LEU A 3 -32.991 -15.501 31.767 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -31.859 -16.794 30.000 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -32.956 -15.569 29.320 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -31.199 -15.285 29.325 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -30.733 -16.398 32.160 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -30.029 -14.875 31.568 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -31.007 -14.884 33.054 1.00 0.00 H new ATOM 43 N GLY A 4 -35.505 -14.475 31.700 1.00 0.00 N ATOM 44 CA GLY A 4 -36.753 -14.945 31.124 1.00 0.00 C ATOM 45 C GLY A 4 -37.960 -14.531 31.943 1.00 0.00 C ATOM 46 O GLY A 4 -37.907 -14.511 33.173 1.00 0.00 O ATOM 0 H GLY A 4 -35.172 -15.015 32.499 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -36.853 -14.554 30.112 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -36.727 -16.032 31.045 1.00 0.00 H new ATOM 50 N SER A 5 -39.052 -14.202 31.259 1.00 0.00 N ATOM 51 CA SER A 5 -40.279 -13.788 31.931 1.00 0.00 C ATOM 52 C SER A 5 -41.050 -14.998 32.449 1.00 0.00 C ATOM 53 O SER A 5 -41.981 -15.478 31.801 1.00 0.00 O ATOM 54 CB SER A 5 -41.157 -12.977 30.976 1.00 0.00 C ATOM 55 OG SER A 5 -41.290 -13.628 29.724 1.00 0.00 O ATOM 0 H SER A 5 -39.112 -14.214 30.241 1.00 0.00 H new ATOM 0 HA SER A 5 -40.007 -13.164 32.782 1.00 0.00 H new ATOM 0 HB2 SER A 5 -42.142 -12.831 31.419 1.00 0.00 H new ATOM 0 HB3 SER A 5 -40.723 -11.988 30.830 1.00 0.00 H new ATOM 0 HG SER A 5 -41.584 -14.552 29.865 1.00 0.00 H new ATOM 61 N ALA A 6 -40.654 -15.485 33.620 1.00 0.00 N ATOM 62 CA ALA A 6 -41.303 -16.640 34.229 1.00 0.00 C ATOM 63 C ALA A 6 -41.952 -16.266 35.559 1.00 0.00 C ATOM 64 O ALA A 6 -41.900 -15.111 35.981 1.00 0.00 O ATOM 65 CB ALA A 6 -40.299 -17.765 34.427 1.00 0.00 C ATOM 0 H ALA A 6 -39.885 -15.097 34.167 1.00 0.00 H new ATOM 0 HA ALA A 6 -42.088 -16.983 33.555 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -40.797 -18.621 34.882 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -39.885 -18.057 33.462 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -39.495 -17.424 35.079 1.00 0.00 H new ATOM 71 N ALA A 7 -42.560 -17.250 36.214 1.00 0.00 N ATOM 72 CA ALA A 7 -43.218 -17.022 37.496 1.00 0.00 C ATOM 73 C ALA A 7 -42.683 -17.972 38.564 1.00 0.00 C ATOM 74 O ALA A 7 -43.327 -18.192 39.590 1.00 0.00 O ATOM 75 CB ALA A 7 -44.725 -17.179 37.352 1.00 0.00 C ATOM 0 H ALA A 7 -42.611 -18.212 35.879 1.00 0.00 H new ATOM 0 HA ALA A 7 -43.000 -16.002 37.812 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -45.203 -17.006 38.316 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -45.099 -16.456 36.627 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -44.955 -18.188 37.009 1.00 0.00 H new ATOM 81 N ALA A 8 -41.502 -18.531 38.312 1.00 0.00 N ATOM 82 CA ALA A 8 -40.873 -19.457 39.249 1.00 0.00 C ATOM 83 C ALA A 8 -41.784 -20.643 39.548 1.00 0.00 C ATOM 84 O ALA A 8 -41.703 -21.247 40.619 1.00 0.00 O ATOM 85 CB ALA A 8 -40.499 -18.735 40.535 1.00 0.00 C ATOM 0 H ALA A 8 -40.961 -18.358 37.465 1.00 0.00 H new ATOM 0 HA ALA A 8 -39.965 -19.842 38.785 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -40.031 -19.438 41.224 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -39.801 -17.929 40.310 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -41.397 -18.320 40.994 1.00 0.00 H new ATOM 91 N ALA A 9 -42.649 -20.975 38.595 1.00 0.00 N ATOM 92 CA ALA A 9 -43.573 -22.092 38.754 1.00 0.00 C ATOM 93 C ALA A 9 -43.462 -23.063 37.583 1.00 0.00 C ATOM 94 O ALA A 9 -43.146 -24.239 37.768 1.00 0.00 O ATOM 95 CB ALA A 9 -45.000 -21.581 38.885 1.00 0.00 C ATOM 0 H ALA A 9 -42.729 -20.486 37.704 1.00 0.00 H new ATOM 0 HA ALA A 9 -43.306 -22.628 39.665 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -45.679 -22.425 39.003 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -45.075 -20.930 39.756 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -45.270 -21.021 37.990 1.00 0.00 H new ATOM 101 N THR A 10 -43.721 -22.563 36.380 1.00 0.00 N ATOM 102 CA THR A 10 -43.647 -23.384 35.177 1.00 0.00 C ATOM 103 C THR A 10 -43.129 -22.568 33.994 1.00 0.00 C ATOM 104 O THR A 10 -43.677 -21.514 33.674 1.00 0.00 O ATOM 105 CB THR A 10 -45.022 -23.969 34.846 1.00 0.00 C ATOM 106 OG1 THR A 10 -45.086 -24.354 33.483 1.00 0.00 O ATOM 107 CG2 THR A 10 -46.163 -23.010 35.108 1.00 0.00 C ATOM 0 H THR A 10 -43.984 -21.592 36.212 1.00 0.00 H new ATOM 0 HA THR A 10 -42.950 -24.201 35.366 1.00 0.00 H new ATOM 0 HB THR A 10 -45.137 -24.829 35.506 1.00 0.00 H new ATOM 0 HG1 THR A 10 -45.971 -24.727 33.290 1.00 0.00 H new ATOM 0 HG21 THR A 10 -47.108 -23.490 34.852 1.00 0.00 H new ATOM 0 HG22 THR A 10 -46.171 -22.733 36.162 1.00 0.00 H new ATOM 0 HG23 THR A 10 -46.033 -22.115 34.499 1.00 0.00 H new ATOM 115 N PRO A 11 -42.063 -23.046 33.325 1.00 0.00 N ATOM 116 CA PRO A 11 -41.479 -22.349 32.174 1.00 0.00 C ATOM 117 C PRO A 11 -42.390 -22.387 30.951 1.00 0.00 C ATOM 118 O PRO A 11 -42.251 -23.252 30.087 1.00 0.00 O ATOM 119 CB PRO A 11 -40.186 -23.123 31.906 1.00 0.00 C ATOM 120 CG PRO A 11 -40.444 -24.487 32.446 1.00 0.00 C ATOM 121 CD PRO A 11 -41.344 -24.298 33.637 1.00 0.00 C ATOM 0 HA PRO A 11 -41.320 -21.290 32.376 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -39.957 -23.155 30.841 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -39.335 -22.656 32.401 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -40.917 -25.121 31.696 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -39.513 -24.975 32.734 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -42.030 -25.136 33.760 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -40.774 -24.215 34.562 1.00 0.00 H new ATOM 129 N ALA A 12 -43.324 -21.442 30.887 1.00 0.00 N ATOM 130 CA ALA A 12 -44.260 -21.366 29.771 1.00 0.00 C ATOM 131 C ALA A 12 -43.673 -20.558 28.618 1.00 0.00 C ATOM 132 O ALA A 12 -44.059 -19.410 28.391 1.00 0.00 O ATOM 133 CB ALA A 12 -45.578 -20.759 30.230 1.00 0.00 C ATOM 0 H ALA A 12 -43.452 -20.719 31.595 1.00 0.00 H new ATOM 0 HA ALA A 12 -44.445 -22.378 29.412 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -46.268 -20.708 29.388 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -46.010 -21.379 31.016 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -45.401 -19.755 30.616 1.00 0.00 H new ATOM 139 N VAL A 13 -42.741 -21.165 27.891 1.00 0.00 N ATOM 140 CA VAL A 13 -42.101 -20.504 26.760 1.00 0.00 C ATOM 141 C VAL A 13 -42.651 -21.024 25.436 1.00 0.00 C ATOM 142 O VAL A 13 -42.842 -22.228 25.262 1.00 0.00 O ATOM 143 CB VAL A 13 -40.573 -20.702 26.782 1.00 0.00 C ATOM 144 CG1 VAL A 13 -39.918 -19.716 27.736 1.00 0.00 C ATOM 145 CG2 VAL A 13 -40.225 -22.133 27.160 1.00 0.00 C ATOM 0 H VAL A 13 -42.412 -22.115 28.065 1.00 0.00 H new ATOM 0 HA VAL A 13 -42.322 -19.441 26.850 1.00 0.00 H new ATOM 0 HB VAL A 13 -40.187 -20.511 25.781 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -38.839 -19.872 27.737 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -40.137 -18.698 27.414 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -40.308 -19.870 28.742 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -39.142 -22.253 27.170 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -40.624 -22.355 28.150 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -40.659 -22.818 26.431 1.00 0.00 H new ATOM 155 N ARG A 14 -42.904 -20.108 24.507 1.00 0.00 N ATOM 156 CA ARG A 14 -43.433 -20.473 23.198 1.00 0.00 C ATOM 157 C ARG A 14 -42.320 -20.516 22.155 1.00 0.00 C ATOM 158 O ARG A 14 -41.908 -19.483 21.629 1.00 0.00 O ATOM 159 CB ARG A 14 -44.514 -19.480 22.769 1.00 0.00 C ATOM 160 CG ARG A 14 -45.562 -20.085 21.849 1.00 0.00 C ATOM 161 CD ARG A 14 -46.949 -20.026 22.469 1.00 0.00 C ATOM 162 NE ARG A 14 -47.376 -18.653 22.728 1.00 0.00 N ATOM 163 CZ ARG A 14 -48.340 -18.329 23.584 1.00 0.00 C ATOM 164 NH1 ARG A 14 -48.977 -19.275 24.262 1.00 0.00 N ATOM 165 NH2 ARG A 14 -48.670 -17.057 23.762 1.00 0.00 N ATOM 0 H ARG A 14 -42.751 -19.108 24.636 1.00 0.00 H new ATOM 0 HA ARG A 14 -43.873 -21.468 23.274 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -45.006 -19.085 23.657 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -44.042 -18.637 22.264 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -45.564 -19.552 20.898 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -45.303 -21.121 21.633 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -47.664 -20.508 21.803 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -46.953 -20.589 23.402 1.00 0.00 H new ATOM 0 HE ARG A 14 -46.908 -17.900 22.223 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -48.728 -20.255 24.127 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -49.716 -19.022 24.918 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -48.184 -16.326 23.242 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -49.410 -16.809 24.419 1.00 0.00 H new ATOM 179 N THR A 15 -41.837 -21.720 21.864 1.00 0.00 N ATOM 180 CA THR A 15 -40.770 -21.899 20.886 1.00 0.00 C ATOM 181 C THR A 15 -41.342 -22.170 19.497 1.00 0.00 C ATOM 182 O THR A 15 -41.240 -23.282 18.978 1.00 0.00 O ATOM 183 CB THR A 15 -39.853 -23.049 21.309 1.00 0.00 C ATOM 184 OG1 THR A 15 -40.592 -24.068 21.958 1.00 0.00 O ATOM 185 CG2 THR A 15 -38.743 -22.619 22.244 1.00 0.00 C ATOM 0 H THR A 15 -42.167 -22.585 22.291 1.00 0.00 H new ATOM 0 HA THR A 15 -40.190 -20.977 20.844 1.00 0.00 H new ATOM 0 HB THR A 15 -39.405 -23.414 20.385 1.00 0.00 H new ATOM 0 HG1 THR A 15 -39.988 -24.794 22.219 1.00 0.00 H new ATOM 0 HG21 THR A 15 -38.131 -23.483 22.504 1.00 0.00 H new ATOM 0 HG22 THR A 15 -38.123 -21.870 21.752 1.00 0.00 H new ATOM 0 HG23 THR A 15 -39.175 -22.194 23.150 1.00 0.00 H new ATOM 193 N VAL A 16 -41.940 -21.144 18.899 1.00 0.00 N ATOM 194 CA VAL A 16 -42.528 -21.268 17.568 1.00 0.00 C ATOM 195 C VAL A 16 -41.711 -20.508 16.516 1.00 0.00 C ATOM 196 O VAL A 16 -41.347 -21.080 15.488 1.00 0.00 O ATOM 197 CB VAL A 16 -43.988 -20.771 17.543 1.00 0.00 C ATOM 198 CG1 VAL A 16 -44.614 -21.007 16.176 1.00 0.00 C ATOM 199 CG2 VAL A 16 -44.801 -21.452 18.633 1.00 0.00 C ATOM 0 H VAL A 16 -42.031 -20.217 19.315 1.00 0.00 H new ATOM 0 HA VAL A 16 -42.515 -22.330 17.322 1.00 0.00 H new ATOM 0 HB VAL A 16 -43.989 -19.698 17.735 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -45.644 -20.649 16.181 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -44.046 -20.468 15.418 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -44.601 -22.073 15.949 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -45.828 -21.090 18.601 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -44.791 -22.530 18.474 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -44.367 -21.225 19.607 1.00 0.00 H new ATOM 209 N PRO A 17 -41.409 -19.210 16.744 1.00 0.00 N ATOM 210 CA PRO A 17 -40.634 -18.407 15.788 1.00 0.00 C ATOM 211 C PRO A 17 -39.281 -19.034 15.470 1.00 0.00 C ATOM 212 O PRO A 17 -38.791 -19.887 16.211 1.00 0.00 O ATOM 213 CB PRO A 17 -40.445 -17.066 16.505 1.00 0.00 C ATOM 214 CG PRO A 17 -41.550 -17.005 17.500 1.00 0.00 C ATOM 215 CD PRO A 17 -41.791 -18.422 17.933 1.00 0.00 C ATOM 0 HA PRO A 17 -41.144 -18.320 14.828 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -39.471 -17.012 16.992 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -40.498 -16.233 15.805 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -41.277 -16.378 18.349 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -42.449 -16.573 17.060 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -41.187 -18.686 18.801 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -42.833 -18.587 18.207 1.00 0.00 H new ATOM 223 N GLN A 18 -38.683 -18.606 14.362 1.00 0.00 N ATOM 224 CA GLN A 18 -37.386 -19.125 13.943 1.00 0.00 C ATOM 225 C GLN A 18 -36.261 -18.509 14.767 1.00 0.00 C ATOM 226 O GLN A 18 -36.499 -17.651 15.618 1.00 0.00 O ATOM 227 CB GLN A 18 -37.157 -18.843 12.457 1.00 0.00 C ATOM 228 CG GLN A 18 -37.527 -20.006 11.551 1.00 0.00 C ATOM 229 CD GLN A 18 -36.442 -20.327 10.542 1.00 0.00 C ATOM 230 OE1 GLN A 18 -35.338 -20.729 10.907 1.00 0.00 O ATOM 231 NE2 GLN A 18 -36.755 -20.155 9.262 1.00 0.00 N ATOM 0 H GLN A 18 -39.076 -17.901 13.738 1.00 0.00 H new ATOM 0 HA GLN A 18 -37.384 -20.203 14.107 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -37.740 -17.969 12.168 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -36.108 -18.592 12.301 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -37.724 -20.888 12.160 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -38.451 -19.771 11.023 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -37.683 -19.819 9.005 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -36.067 -20.359 8.537 1.00 0.00 H new ATOM 240 N TYR A 19 -35.034 -18.951 14.507 1.00 0.00 N ATOM 241 CA TYR A 19 -33.871 -18.440 15.222 1.00 0.00 C ATOM 242 C TYR A 19 -33.640 -16.967 14.907 1.00 0.00 C ATOM 243 O TYR A 19 -34.143 -16.085 15.604 1.00 0.00 O ATOM 244 CB TYR A 19 -32.627 -19.257 14.864 1.00 0.00 C ATOM 245 CG TYR A 19 -31.525 -19.172 15.898 1.00 0.00 C ATOM 246 CD1 TYR A 19 -31.654 -19.800 17.130 1.00 0.00 C ATOM 247 CD2 TYR A 19 -30.360 -18.460 15.642 1.00 0.00 C ATOM 248 CE1 TYR A 19 -30.652 -19.722 18.078 1.00 0.00 C ATOM 249 CE2 TYR A 19 -29.353 -18.379 16.585 1.00 0.00 C ATOM 250 CZ TYR A 19 -29.504 -19.011 17.801 1.00 0.00 C ATOM 251 OH TYR A 19 -28.503 -18.932 18.742 1.00 0.00 O ATOM 0 H TYR A 19 -34.820 -19.661 13.807 1.00 0.00 H new ATOM 0 HA TYR A 19 -34.062 -18.535 16.291 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -32.913 -20.301 14.736 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -32.241 -18.912 13.905 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -32.552 -20.358 17.350 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -30.239 -17.962 14.691 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -30.768 -20.216 19.032 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -28.452 -17.823 16.370 1.00 0.00 H new ATOM 0 HH TYR A 19 -27.763 -18.395 18.388 1.00 0.00 H new ATOM 261 N LYS A 20 -32.880 -16.710 13.850 1.00 0.00 N ATOM 262 CA LYS A 20 -32.578 -15.345 13.435 1.00 0.00 C ATOM 263 C LYS A 20 -33.706 -14.773 12.582 1.00 0.00 C ATOM 264 O LYS A 20 -34.750 -15.403 12.412 1.00 0.00 O ATOM 265 CB LYS A 20 -31.263 -15.306 12.655 1.00 0.00 C ATOM 266 CG LYS A 20 -30.350 -14.160 13.058 1.00 0.00 C ATOM 267 CD LYS A 20 -28.976 -14.662 13.476 1.00 0.00 C ATOM 268 CE LYS A 20 -28.152 -13.562 14.124 1.00 0.00 C ATOM 269 NZ LYS A 20 -27.717 -13.930 15.500 1.00 0.00 N ATOM 0 H LYS A 20 -32.460 -17.431 13.263 1.00 0.00 H new ATOM 0 HA LYS A 20 -32.479 -14.733 14.332 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -30.735 -16.248 12.801 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -31.484 -15.226 11.591 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -30.247 -13.465 12.224 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -30.802 -13.606 13.881 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -29.088 -15.492 14.173 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -28.448 -15.047 12.604 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -27.276 -13.355 13.510 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -28.738 -12.644 14.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -27.158 -13.153 15.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -28.553 -14.103 16.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -27.136 -14.792 15.462 1.00 0.00 H new ATOM 283 N TYR A 21 -33.489 -13.575 12.047 1.00 0.00 N ATOM 284 CA TYR A 21 -34.485 -12.919 11.210 1.00 0.00 C ATOM 285 C TYR A 21 -34.345 -13.354 9.755 1.00 0.00 C ATOM 286 O TYR A 21 -35.270 -13.200 8.958 1.00 0.00 O ATOM 287 CB TYR A 21 -34.345 -11.397 11.315 1.00 0.00 C ATOM 288 CG TYR A 21 -35.495 -10.637 10.695 1.00 0.00 C ATOM 289 CD1 TYR A 21 -36.716 -10.530 11.350 1.00 0.00 C ATOM 290 CD2 TYR A 21 -35.359 -10.023 9.457 1.00 0.00 C ATOM 291 CE1 TYR A 21 -37.769 -9.834 10.787 1.00 0.00 C ATOM 292 CE2 TYR A 21 -36.407 -9.327 8.887 1.00 0.00 C ATOM 293 CZ TYR A 21 -37.610 -9.235 9.556 1.00 0.00 C ATOM 294 OH TYR A 21 -38.657 -8.542 8.989 1.00 0.00 O ATOM 0 H TYR A 21 -32.631 -13.039 12.179 1.00 0.00 H new ATOM 0 HA TYR A 21 -35.473 -13.213 11.565 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -34.263 -11.120 12.366 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -33.417 -11.092 10.832 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -36.844 -10.998 12.315 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -34.418 -10.091 8.931 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -38.712 -9.760 11.309 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -36.285 -8.857 7.922 1.00 0.00 H new ATOM 0 HH TYR A 21 -38.379 -8.181 8.122 1.00 0.00 H new ATOM 304 N ALA A 22 -33.182 -13.901 9.417 1.00 0.00 N ATOM 305 CA ALA A 22 -32.918 -14.361 8.059 1.00 0.00 C ATOM 306 C ALA A 22 -33.633 -15.679 7.778 1.00 0.00 C ATOM 307 O ALA A 22 -33.389 -16.684 8.447 1.00 0.00 O ATOM 308 CB ALA A 22 -31.422 -14.511 7.832 1.00 0.00 C ATOM 0 H ALA A 22 -32.407 -14.037 10.066 1.00 0.00 H new ATOM 0 HA ALA A 22 -33.304 -13.612 7.367 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -31.241 -14.855 6.814 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -30.933 -13.549 7.982 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -31.018 -15.237 8.537 1.00 0.00 H new ATOM 314 N ALA A 23 -34.518 -15.667 6.787 1.00 0.00 N ATOM 315 CA ALA A 23 -35.270 -16.861 6.417 1.00 0.00 C ATOM 316 C ALA A 23 -34.384 -17.859 5.678 1.00 0.00 C ATOM 317 O ALA A 23 -33.705 -17.508 4.713 1.00 0.00 O ATOM 318 CB ALA A 23 -36.472 -16.485 5.563 1.00 0.00 C ATOM 0 H ALA A 23 -34.732 -14.843 6.225 1.00 0.00 H new ATOM 0 HA ALA A 23 -35.624 -17.336 7.332 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -37.024 -17.386 5.294 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -37.123 -15.815 6.125 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -36.132 -15.984 4.657 1.00 0.00 H new ATOM 324 N GLY A 24 -34.396 -19.105 6.142 1.00 0.00 N ATOM 325 CA GLY A 24 -33.589 -20.137 5.517 1.00 0.00 C ATOM 326 C GLY A 24 -34.300 -20.806 4.357 1.00 0.00 C ATOM 327 O GLY A 24 -34.259 -22.029 4.217 1.00 0.00 O ATOM 0 H GLY A 24 -34.950 -19.418 6.939 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -32.655 -19.699 5.163 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -33.327 -20.889 6.261 1.00 0.00 H new ATOM 331 N VAL A 25 -34.954 -20.003 3.523 1.00 0.00 N ATOM 332 CA VAL A 25 -35.680 -20.526 2.370 1.00 0.00 C ATOM 333 C VAL A 25 -34.979 -20.157 1.067 1.00 0.00 C ATOM 334 O VAL A 25 -34.048 -19.352 1.057 1.00 0.00 O ATOM 335 CB VAL A 25 -37.127 -20.001 2.331 1.00 0.00 C ATOM 336 CG1 VAL A 25 -37.944 -20.608 3.462 1.00 0.00 C ATOM 337 CG2 VAL A 25 -37.149 -18.482 2.404 1.00 0.00 C ATOM 0 H VAL A 25 -34.996 -18.989 3.624 1.00 0.00 H new ATOM 0 HA VAL A 25 -35.700 -21.611 2.473 1.00 0.00 H new ATOM 0 HB VAL A 25 -37.577 -20.301 1.385 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -38.964 -20.226 3.420 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -37.958 -21.693 3.359 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -37.496 -20.340 4.419 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -38.181 -18.131 2.375 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -36.681 -18.156 3.333 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -36.601 -18.069 1.557 1.00 0.00 H new ATOM 347 N ARG A 26 -35.431 -20.755 -0.031 1.00 0.00 N ATOM 348 CA ARG A 26 -34.850 -20.490 -1.342 1.00 0.00 C ATOM 349 C ARG A 26 -35.346 -19.160 -1.898 1.00 0.00 C ATOM 350 O ARG A 26 -36.527 -18.833 -1.791 1.00 0.00 O ATOM 351 CB ARG A 26 -35.194 -21.622 -2.313 1.00 0.00 C ATOM 352 CG ARG A 26 -33.982 -22.206 -3.020 1.00 0.00 C ATOM 353 CD ARG A 26 -33.401 -23.381 -2.252 1.00 0.00 C ATOM 354 NE ARG A 26 -32.551 -22.947 -1.147 1.00 0.00 N ATOM 355 CZ ARG A 26 -31.326 -22.453 -1.306 1.00 0.00 C ATOM 356 NH1 ARG A 26 -30.810 -22.330 -2.521 1.00 0.00 N ATOM 357 NH2 ARG A 26 -30.617 -22.082 -0.249 1.00 0.00 N ATOM 0 H ARG A 26 -36.198 -21.427 -0.038 1.00 0.00 H new ATOM 0 HA ARG A 26 -33.767 -20.434 -1.228 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -35.703 -22.416 -1.767 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -35.895 -21.249 -3.060 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -34.265 -22.529 -4.022 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -33.221 -21.434 -3.137 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -34.212 -23.997 -1.865 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -32.821 -24.007 -2.931 1.00 0.00 H new ATOM 0 HE ARG A 26 -32.918 -23.027 -0.199 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -31.352 -22.614 -3.337 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -29.871 -21.951 -2.640 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -31.011 -22.175 0.687 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -29.678 -21.703 -0.372 1.00 0.00 H new ATOM 371 N ASN A 27 -34.433 -18.397 -2.493 1.00 0.00 N ATOM 372 CA ASN A 27 -34.776 -17.102 -3.066 1.00 0.00 C ATOM 373 C ASN A 27 -35.565 -17.271 -4.364 1.00 0.00 C ATOM 374 O ASN A 27 -35.259 -18.147 -5.173 1.00 0.00 O ATOM 375 CB ASN A 27 -33.509 -16.285 -3.331 1.00 0.00 C ATOM 376 CG ASN A 27 -32.373 -16.655 -2.396 1.00 0.00 C ATOM 377 OD1 ASN A 27 -31.475 -17.412 -2.763 1.00 0.00 O ATOM 378 ND2 ASN A 27 -32.408 -16.120 -1.181 1.00 0.00 N ATOM 0 H ASN A 27 -33.451 -18.654 -2.590 1.00 0.00 H new ATOM 0 HA ASN A 27 -35.400 -16.570 -2.348 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -33.191 -16.438 -4.362 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -33.735 -15.224 -3.221 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -31.670 -16.332 -0.509 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -33.172 -15.497 -0.920 1.00 0.00 H new ATOM 385 N PRO A 28 -36.589 -16.427 -4.583 1.00 0.00 N ATOM 386 CA PRO A 28 -37.419 -16.491 -5.789 1.00 0.00 C ATOM 387 C PRO A 28 -36.743 -15.846 -6.995 1.00 0.00 C ATOM 388 O PRO A 28 -37.384 -15.587 -8.013 1.00 0.00 O ATOM 389 CB PRO A 28 -38.663 -15.700 -5.390 1.00 0.00 C ATOM 390 CG PRO A 28 -38.166 -14.694 -4.409 1.00 0.00 C ATOM 391 CD PRO A 28 -37.028 -15.351 -3.671 1.00 0.00 C ATOM 0 HA PRO A 28 -37.622 -17.517 -6.095 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -39.122 -15.219 -6.254 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -39.420 -16.347 -4.946 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -37.830 -13.789 -4.916 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -38.957 -14.398 -3.720 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -36.222 -14.645 -3.468 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -37.352 -15.749 -2.710 1.00 0.00 H new ATOM 399 N GLN A 29 -35.446 -15.583 -6.869 1.00 0.00 N ATOM 400 CA GLN A 29 -34.683 -14.961 -7.949 1.00 0.00 C ATOM 401 C GLN A 29 -33.966 -16.014 -8.787 1.00 0.00 C ATOM 402 O GLN A 29 -33.603 -17.079 -8.286 1.00 0.00 O ATOM 403 CB GLN A 29 -33.665 -13.962 -7.387 1.00 0.00 C ATOM 404 CG GLN A 29 -33.757 -13.766 -5.881 1.00 0.00 C ATOM 405 CD GLN A 29 -33.375 -12.363 -5.450 1.00 0.00 C ATOM 406 OE1 GLN A 29 -32.490 -12.177 -4.616 1.00 0.00 O ATOM 407 NE2 GLN A 29 -34.045 -11.367 -6.017 1.00 0.00 N ATOM 0 H GLN A 29 -34.901 -15.790 -6.032 1.00 0.00 H new ATOM 0 HA GLN A 29 -35.386 -14.427 -8.588 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -32.660 -14.303 -7.638 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -33.807 -12.999 -7.878 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -34.774 -13.979 -5.552 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -33.105 -14.485 -5.384 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -34.772 -11.567 -6.704 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -33.833 -10.401 -5.765 1.00 0.00 H new ATOM 416 N GLN A 30 -33.763 -15.706 -10.065 1.00 0.00 N ATOM 417 CA GLN A 30 -33.089 -16.624 -10.976 1.00 0.00 C ATOM 418 C GLN A 30 -31.577 -16.583 -10.770 1.00 0.00 C ATOM 419 O GLN A 30 -31.093 -16.085 -9.754 1.00 0.00 O ATOM 420 CB GLN A 30 -33.426 -16.274 -12.427 1.00 0.00 C ATOM 421 CG GLN A 30 -34.904 -16.007 -12.663 1.00 0.00 C ATOM 422 CD GLN A 30 -35.274 -16.035 -14.133 1.00 0.00 C ATOM 423 OE1 GLN A 30 -36.259 -16.661 -14.526 1.00 0.00 O ATOM 424 NE2 GLN A 30 -34.485 -15.352 -14.955 1.00 0.00 N ATOM 0 H GLN A 30 -34.056 -14.827 -10.492 1.00 0.00 H new ATOM 0 HA GLN A 30 -33.440 -17.633 -10.761 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -32.855 -15.393 -12.721 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -33.106 -17.092 -13.073 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -35.494 -16.752 -12.129 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -35.165 -15.035 -12.245 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -33.679 -14.847 -14.586 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -34.685 -15.332 -15.955 1.00 0.00 H new ATOM 433 N HIS A 31 -30.837 -17.107 -11.743 1.00 0.00 N ATOM 434 CA HIS A 31 -29.379 -17.130 -11.670 1.00 0.00 C ATOM 435 C HIS A 31 -28.817 -15.717 -11.548 1.00 0.00 C ATOM 436 O HIS A 31 -27.812 -15.495 -10.872 1.00 0.00 O ATOM 437 CB HIS A 31 -28.800 -17.817 -12.910 1.00 0.00 C ATOM 438 CG HIS A 31 -27.445 -18.413 -12.685 1.00 0.00 C ATOM 439 ND1 HIS A 31 -26.298 -17.740 -13.033 1.00 0.00 N ATOM 440 CD2 HIS A 31 -27.110 -19.614 -12.152 1.00 0.00 C ATOM 441 CE1 HIS A 31 -25.297 -18.538 -12.705 1.00 0.00 C ATOM 442 NE2 HIS A 31 -25.741 -19.683 -12.168 1.00 0.00 N ATOM 0 H HIS A 31 -31.223 -17.521 -12.591 1.00 0.00 H new ATOM 0 HA HIS A 31 -29.092 -17.692 -10.781 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -29.484 -18.602 -13.234 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -28.739 -17.092 -13.722 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -27.790 -20.369 -11.786 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -24.254 -18.298 -12.851 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -25.169 -20.459 -11.834 1.00 0.00 H new ATOM 450 N LEU A 32 -29.474 -14.765 -12.202 1.00 0.00 N ATOM 451 CA LEU A 32 -29.042 -13.372 -12.162 1.00 0.00 C ATOM 452 C LEU A 32 -29.579 -12.672 -10.917 1.00 0.00 C ATOM 453 O LEU A 32 -30.753 -12.813 -10.573 1.00 0.00 O ATOM 454 CB LEU A 32 -29.513 -12.636 -13.419 1.00 0.00 C ATOM 455 CG LEU A 32 -28.718 -11.377 -13.769 1.00 0.00 C ATOM 456 CD1 LEU A 32 -27.382 -11.745 -14.397 1.00 0.00 C ATOM 457 CD2 LEU A 32 -29.520 -10.482 -14.702 1.00 0.00 C ATOM 0 H LEU A 32 -30.307 -14.932 -12.766 1.00 0.00 H new ATOM 0 HA LEU A 32 -27.953 -13.355 -12.125 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -29.465 -13.324 -14.263 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -30.560 -12.362 -13.290 1.00 0.00 H new ATOM 0 HG LEU A 32 -28.523 -10.827 -12.849 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -26.831 -10.836 -14.639 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -26.803 -12.344 -13.695 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -27.554 -12.318 -15.308 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -28.939 -9.591 -14.940 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -29.747 -11.024 -15.620 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -30.450 -10.189 -14.215 1.00 0.00 H new ATOM 469 N ASN A 33 -28.712 -11.921 -10.245 1.00 0.00 N ATOM 470 CA ASN A 33 -29.098 -11.204 -9.035 1.00 0.00 C ATOM 471 C ASN A 33 -29.774 -9.881 -9.377 1.00 0.00 C ATOM 472 O ASN A 33 -29.295 -9.128 -10.226 1.00 0.00 O ATOM 473 CB ASN A 33 -27.873 -10.951 -8.154 1.00 0.00 C ATOM 474 CG ASN A 33 -28.250 -10.623 -6.723 1.00 0.00 C ATOM 475 OD1 ASN A 33 -29.187 -11.196 -6.167 1.00 0.00 O ATOM 476 ND2 ASN A 33 -27.520 -9.694 -6.116 1.00 0.00 N ATOM 0 H ASN A 33 -27.738 -11.793 -10.518 1.00 0.00 H new ATOM 0 HA ASN A 33 -29.809 -11.823 -8.488 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -27.232 -11.833 -8.165 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -27.292 -10.129 -8.572 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -27.728 -9.431 -5.153 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -26.752 -9.244 -6.613 1.00 0.00 H new ATOM 483 N ALA A 34 -30.890 -9.602 -8.710 1.00 0.00 N ATOM 484 CA ALA A 34 -31.632 -8.368 -8.939 1.00 0.00 C ATOM 485 C ALA A 34 -31.035 -7.214 -8.145 1.00 0.00 C ATOM 486 O ALA A 34 -30.197 -6.465 -8.646 1.00 0.00 O ATOM 487 CB ALA A 34 -33.102 -8.561 -8.594 1.00 0.00 C ATOM 0 H ALA A 34 -31.300 -10.215 -8.006 1.00 0.00 H new ATOM 0 HA ALA A 34 -31.556 -8.116 -9.997 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -33.642 -7.631 -8.770 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -33.522 -9.349 -9.219 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -33.196 -8.842 -7.545 1.00 0.00 H new ATOM 493 N GLN A 35 -31.470 -7.085 -6.902 1.00 0.00 N ATOM 494 CA GLN A 35 -30.984 -6.028 -6.023 1.00 0.00 C ATOM 495 C GLN A 35 -29.759 -6.495 -5.237 1.00 0.00 C ATOM 496 O GLN A 35 -29.662 -7.666 -4.870 1.00 0.00 O ATOM 497 CB GLN A 35 -32.088 -5.587 -5.061 1.00 0.00 C ATOM 498 CG GLN A 35 -32.878 -4.385 -5.554 1.00 0.00 C ATOM 499 CD GLN A 35 -33.182 -3.392 -4.449 1.00 0.00 C ATOM 500 OE1 GLN A 35 -32.809 -2.222 -4.530 1.00 0.00 O ATOM 501 NE2 GLN A 35 -33.865 -3.854 -3.407 1.00 0.00 N ATOM 0 H GLN A 35 -32.162 -7.701 -6.475 1.00 0.00 H new ATOM 0 HA GLN A 35 -30.694 -5.179 -6.641 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -32.772 -6.420 -4.899 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -31.643 -5.348 -4.095 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -32.316 -3.884 -6.342 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -33.813 -4.727 -5.997 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -34.155 -4.832 -3.380 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -34.099 -3.231 -2.634 1.00 0.00 H new ATOM 510 N PRO A 36 -28.800 -5.587 -4.971 1.00 0.00 N ATOM 511 CA PRO A 36 -28.880 -4.181 -5.389 1.00 0.00 C ATOM 512 C PRO A 36 -28.547 -3.993 -6.866 1.00 0.00 C ATOM 513 O PRO A 36 -27.561 -4.536 -7.364 1.00 0.00 O ATOM 514 CB PRO A 36 -27.827 -3.503 -4.517 1.00 0.00 C ATOM 515 CG PRO A 36 -26.807 -4.561 -4.278 1.00 0.00 C ATOM 516 CD PRO A 36 -27.558 -5.866 -4.223 1.00 0.00 C ATOM 0 HA PRO A 36 -29.885 -3.774 -5.272 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -27.393 -2.638 -5.019 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -28.256 -3.146 -3.581 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -26.064 -4.573 -5.076 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -26.271 -4.381 -3.346 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -26.989 -6.675 -4.680 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -27.768 -6.164 -3.196 1.00 0.00 H new ATOM 524 N GLN A 37 -29.377 -3.221 -7.560 1.00 0.00 N ATOM 525 CA GLN A 37 -29.167 -2.956 -8.979 1.00 0.00 C ATOM 526 C GLN A 37 -27.993 -2.007 -9.186 1.00 0.00 C ATOM 527 O GLN A 37 -27.358 -1.573 -8.225 1.00 0.00 O ATOM 528 CB GLN A 37 -30.434 -2.362 -9.599 1.00 0.00 C ATOM 529 CG GLN A 37 -31.037 -3.225 -10.695 1.00 0.00 C ATOM 530 CD GLN A 37 -30.367 -3.014 -12.039 1.00 0.00 C ATOM 531 OE1 GLN A 37 -30.444 -1.792 -12.554 1.00 0.00 O flip ATOM 532 NE2 GLN A 37 -29.787 -3.939 -12.608 1.00 0.00 N flip ATOM 0 H GLN A 37 -30.201 -2.768 -7.163 1.00 0.00 H new ATOM 0 HA GLN A 37 -28.938 -3.901 -9.471 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -31.177 -2.213 -8.815 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -30.202 -1.379 -10.009 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -30.954 -4.275 -10.413 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -32.100 -3.002 -10.784 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -29.752 -4.862 -12.176 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -29.341 -3.782 -13.512 1.00 0.00 H new ATOM 541 N VAL A 38 -27.710 -1.688 -10.444 1.00 0.00 N ATOM 542 CA VAL A 38 -26.609 -0.789 -10.776 1.00 0.00 C ATOM 543 C VAL A 38 -27.004 0.670 -10.537 1.00 0.00 C ATOM 544 O VAL A 38 -27.498 1.353 -11.436 1.00 0.00 O ATOM 545 CB VAL A 38 -26.145 -0.980 -12.237 1.00 0.00 C ATOM 546 CG1 VAL A 38 -27.327 -0.923 -13.195 1.00 0.00 C ATOM 547 CG2 VAL A 38 -25.090 0.053 -12.611 1.00 0.00 C ATOM 0 H VAL A 38 -28.227 -2.038 -11.251 1.00 0.00 H new ATOM 0 HA VAL A 38 -25.776 -1.039 -10.119 1.00 0.00 H new ATOM 0 HB VAL A 38 -25.693 -1.968 -12.321 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -26.974 -1.060 -14.217 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -28.035 -1.714 -12.947 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -27.819 0.046 -13.108 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -24.779 -0.102 -13.644 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -25.507 1.054 -12.504 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -24.228 -0.053 -11.953 1.00 0.00 H new ATOM 557 N THR A 39 -26.807 1.132 -9.307 1.00 0.00 N ATOM 558 CA THR A 39 -27.140 2.504 -8.940 1.00 0.00 C ATOM 559 C THR A 39 -25.878 3.320 -8.681 1.00 0.00 C ATOM 560 O THR A 39 -25.592 4.283 -9.392 1.00 0.00 O ATOM 561 CB THR A 39 -28.035 2.518 -7.699 1.00 0.00 C ATOM 562 OG1 THR A 39 -28.424 1.202 -7.348 1.00 0.00 O ATOM 563 CG2 THR A 39 -29.294 3.338 -7.875 1.00 0.00 C ATOM 0 H THR A 39 -26.418 0.576 -8.546 1.00 0.00 H new ATOM 0 HA THR A 39 -27.678 2.957 -9.773 1.00 0.00 H new ATOM 0 HB THR A 39 -27.432 2.975 -6.914 1.00 0.00 H new ATOM 0 HG1 THR A 39 -28.994 1.231 -6.551 1.00 0.00 H new ATOM 0 HG21 THR A 39 -29.881 3.304 -6.957 1.00 0.00 H new ATOM 0 HG22 THR A 39 -29.027 4.371 -8.097 1.00 0.00 H new ATOM 0 HG23 THR A 39 -29.882 2.930 -8.697 1.00 0.00 H new ATOM 571 N MET A 40 -25.129 2.927 -7.656 1.00 0.00 N ATOM 572 CA MET A 40 -23.896 3.620 -7.297 1.00 0.00 C ATOM 573 C MET A 40 -22.710 3.057 -8.071 1.00 0.00 C ATOM 574 O MET A 40 -22.679 1.871 -8.404 1.00 0.00 O ATOM 575 CB MET A 40 -23.642 3.503 -5.794 1.00 0.00 C ATOM 576 CG MET A 40 -24.650 4.261 -4.945 1.00 0.00 C ATOM 577 SD MET A 40 -25.733 3.165 -4.009 1.00 0.00 S ATOM 578 CE MET A 40 -25.690 3.944 -2.398 1.00 0.00 C ATOM 0 H MET A 40 -25.354 2.132 -7.059 1.00 0.00 H new ATOM 0 HA MET A 40 -24.010 4.672 -7.559 1.00 0.00 H new ATOM 0 HB2 MET A 40 -23.661 2.450 -5.512 1.00 0.00 H new ATOM 0 HB3 MET A 40 -22.641 3.875 -5.573 1.00 0.00 H new ATOM 0 HG2 MET A 40 -24.118 4.916 -4.255 1.00 0.00 H new ATOM 0 HG3 MET A 40 -25.255 4.900 -5.589 1.00 0.00 H new ATOM 0 HE1 MET A 40 -26.314 3.381 -1.705 1.00 0.00 H new ATOM 0 HE2 MET A 40 -24.664 3.962 -2.030 1.00 0.00 H new ATOM 0 HE3 MET A 40 -26.065 4.964 -2.477 1.00 0.00 H new ATOM 588 N GLN A 41 -21.735 3.915 -8.357 1.00 0.00 N ATOM 589 CA GLN A 41 -20.547 3.505 -9.094 1.00 0.00 C ATOM 590 C GLN A 41 -19.279 3.979 -8.388 1.00 0.00 C ATOM 591 O GLN A 41 -19.298 4.274 -7.193 1.00 0.00 O ATOM 592 CB GLN A 41 -20.593 4.057 -10.520 1.00 0.00 C ATOM 593 CG GLN A 41 -20.784 5.564 -10.586 1.00 0.00 C ATOM 594 CD GLN A 41 -22.242 5.970 -10.510 1.00 0.00 C ATOM 595 OE1 GLN A 41 -22.708 6.465 -9.484 1.00 0.00 O ATOM 596 NE2 GLN A 41 -22.973 5.761 -11.600 1.00 0.00 N ATOM 0 H GLN A 41 -21.746 4.899 -8.089 1.00 0.00 H new ATOM 0 HA GLN A 41 -20.530 2.416 -9.135 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -19.667 3.794 -11.032 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -21.405 3.573 -11.062 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -20.237 6.032 -9.768 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -20.353 5.941 -11.514 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -22.546 5.348 -12.429 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -23.961 6.014 -11.608 1.00 0.00 H new ATOM 605 N GLN A 42 -18.180 4.045 -9.133 1.00 0.00 N ATOM 606 CA GLN A 42 -16.904 4.482 -8.576 1.00 0.00 C ATOM 607 C GLN A 42 -17.020 5.884 -7.978 1.00 0.00 C ATOM 608 O GLN A 42 -17.580 6.787 -8.603 1.00 0.00 O ATOM 609 CB GLN A 42 -15.821 4.463 -9.657 1.00 0.00 C ATOM 610 CG GLN A 42 -16.196 5.242 -10.908 1.00 0.00 C ATOM 611 CD GLN A 42 -15.990 4.441 -12.179 1.00 0.00 C ATOM 612 OE1 GLN A 42 -15.204 4.823 -13.047 1.00 0.00 O ATOM 613 NE2 GLN A 42 -16.700 3.324 -12.298 1.00 0.00 N ATOM 0 H GLN A 42 -18.147 3.802 -10.123 1.00 0.00 H new ATOM 0 HA GLN A 42 -16.627 3.791 -7.780 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -14.900 4.876 -9.244 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -15.612 3.429 -9.932 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -17.240 5.548 -10.841 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -15.599 6.153 -10.957 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -17.340 3.045 -11.554 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -16.605 2.746 -13.133 1.00 0.00 H new ATOM 622 N PRO A 43 -16.497 6.084 -6.754 1.00 0.00 N ATOM 623 CA PRO A 43 -16.552 7.385 -6.077 1.00 0.00 C ATOM 624 C PRO A 43 -15.635 8.416 -6.728 1.00 0.00 C ATOM 625 O PRO A 43 -14.519 8.098 -7.138 1.00 0.00 O ATOM 626 CB PRO A 43 -16.078 7.068 -4.658 1.00 0.00 C ATOM 627 CG PRO A 43 -15.218 5.862 -4.808 1.00 0.00 C ATOM 628 CD PRO A 43 -15.814 5.064 -5.935 1.00 0.00 C ATOM 0 HA PRO A 43 -17.549 7.824 -6.119 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.520 7.902 -4.231 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -16.920 6.874 -3.993 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.188 6.142 -5.031 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -15.198 5.280 -3.886 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -15.047 4.539 -6.505 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.511 4.310 -5.569 1.00 0.00 H new ATOM 636 N ALA A 44 -16.114 9.654 -6.815 1.00 0.00 N ATOM 637 CA ALA A 44 -15.338 10.734 -7.415 1.00 0.00 C ATOM 638 C ALA A 44 -14.269 11.241 -6.454 1.00 0.00 C ATOM 639 O ALA A 44 -14.544 12.071 -5.585 1.00 0.00 O ATOM 640 CB ALA A 44 -16.255 11.873 -7.837 1.00 0.00 C ATOM 0 H ALA A 44 -17.035 9.934 -6.478 1.00 0.00 H new ATOM 0 HA ALA A 44 -14.837 10.340 -8.299 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -15.662 12.671 -8.283 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -16.978 11.507 -8.566 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -16.783 12.257 -6.964 1.00 0.00 H new ATOM 646 N VAL A 45 -13.048 10.742 -6.616 1.00 0.00 N ATOM 647 CA VAL A 45 -11.936 11.147 -5.764 1.00 0.00 C ATOM 648 C VAL A 45 -11.154 12.296 -6.394 1.00 0.00 C ATOM 649 O VAL A 45 -10.230 12.074 -7.177 1.00 0.00 O ATOM 650 CB VAL A 45 -10.975 9.973 -5.492 1.00 0.00 C ATOM 651 CG1 VAL A 45 -9.953 10.353 -4.431 1.00 0.00 C ATOM 652 CG2 VAL A 45 -11.749 8.731 -5.076 1.00 0.00 C ATOM 0 H VAL A 45 -12.803 10.056 -7.330 1.00 0.00 H new ATOM 0 HA VAL A 45 -12.366 11.477 -4.818 1.00 0.00 H new ATOM 0 HB VAL A 45 -10.440 9.746 -6.414 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -9.284 9.511 -4.253 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -9.374 11.211 -4.774 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -10.468 10.609 -3.505 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.052 7.914 -4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -12.314 8.942 -4.168 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -12.436 8.447 -5.873 1.00 0.00 H new ATOM 662 N HIS A 46 -11.532 13.523 -6.047 1.00 0.00 N ATOM 663 CA HIS A 46 -10.863 14.706 -6.576 1.00 0.00 C ATOM 664 C HIS A 46 -10.009 15.372 -5.503 1.00 0.00 C ATOM 665 O HIS A 46 -9.656 16.546 -5.615 1.00 0.00 O ATOM 666 CB HIS A 46 -11.892 15.701 -7.117 1.00 0.00 C ATOM 667 CG HIS A 46 -12.585 15.234 -8.359 1.00 0.00 C ATOM 668 ND1 HIS A 46 -13.511 14.218 -8.325 1.00 0.00 N ATOM 669 CD2 HIS A 46 -12.457 15.673 -9.635 1.00 0.00 C ATOM 670 CE1 HIS A 46 -13.922 14.060 -9.571 1.00 0.00 C ATOM 671 NE2 HIS A 46 -13.310 14.920 -10.398 1.00 0.00 N ATOM 0 H HIS A 46 -12.297 13.723 -5.403 1.00 0.00 H new ATOM 0 HA HIS A 46 -10.211 14.391 -7.390 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -12.638 15.894 -6.346 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -11.394 16.649 -7.324 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -11.808 16.463 -9.983 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -14.656 13.332 -9.883 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -13.453 14.999 -11.405 1.00 0.00 H new ATOM 679 N VAL A 47 -9.679 14.612 -4.463 1.00 0.00 N ATOM 680 CA VAL A 47 -8.866 15.125 -3.365 1.00 0.00 C ATOM 681 C VAL A 47 -7.416 14.664 -3.495 1.00 0.00 C ATOM 682 O VAL A 47 -6.852 14.081 -2.569 1.00 0.00 O ATOM 683 CB VAL A 47 -9.417 14.679 -1.996 1.00 0.00 C ATOM 684 CG1 VAL A 47 -8.969 15.638 -0.903 1.00 0.00 C ATOM 685 CG2 VAL A 47 -10.934 14.575 -2.034 1.00 0.00 C ATOM 0 H VAL A 47 -9.962 13.638 -4.357 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.906 16.213 -3.423 1.00 0.00 H new ATOM 0 HB VAL A 47 -9.016 13.691 -1.770 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -9.367 15.308 0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -7.880 15.655 -0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.338 16.639 -1.124 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.302 14.259 -1.058 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -11.359 15.547 -2.285 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.230 13.845 -2.787 1.00 0.00 H new ATOM 695 N GLN A 48 -6.819 14.930 -4.653 1.00 0.00 N ATOM 696 CA GLN A 48 -5.436 14.545 -4.909 1.00 0.00 C ATOM 697 C GLN A 48 -4.474 15.637 -4.453 1.00 0.00 C ATOM 698 O GLN A 48 -3.274 15.573 -4.720 1.00 0.00 O ATOM 699 CB GLN A 48 -5.232 14.260 -6.399 1.00 0.00 C ATOM 700 CG GLN A 48 -4.059 13.338 -6.689 1.00 0.00 C ATOM 701 CD GLN A 48 -3.278 13.755 -7.918 1.00 0.00 C ATOM 702 OE1 GLN A 48 -3.292 13.069 -8.940 1.00 0.00 O ATOM 703 NE2 GLN A 48 -2.588 14.887 -7.825 1.00 0.00 N ATOM 0 H GLN A 48 -7.273 15.411 -5.430 1.00 0.00 H new ATOM 0 HA GLN A 48 -5.226 13.639 -4.340 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -6.141 13.815 -6.803 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.079 15.204 -6.923 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -3.392 13.323 -5.827 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -4.427 12.321 -6.825 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -2.605 15.425 -6.958 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -2.042 15.218 -8.620 1.00 0.00 H new ATOM 712 N GLY A 49 -5.010 16.638 -3.762 1.00 0.00 N ATOM 713 CA GLY A 49 -4.186 17.734 -3.283 1.00 0.00 C ATOM 714 C GLY A 49 -3.468 17.401 -1.990 1.00 0.00 C ATOM 715 O GLY A 49 -2.492 18.059 -1.629 1.00 0.00 O ATOM 0 H GLY A 49 -5.999 16.710 -3.525 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -3.452 17.992 -4.046 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -4.811 18.614 -3.131 1.00 0.00 H new ATOM 719 N GLN A 50 -3.950 16.379 -1.290 1.00 0.00 N ATOM 720 CA GLN A 50 -3.348 15.964 -0.028 1.00 0.00 C ATOM 721 C GLN A 50 -2.448 14.747 -0.226 1.00 0.00 C ATOM 722 O GLN A 50 -2.893 13.705 -0.709 1.00 0.00 O ATOM 723 CB GLN A 50 -4.436 15.646 1.001 1.00 0.00 C ATOM 724 CG GLN A 50 -4.889 16.858 1.799 1.00 0.00 C ATOM 725 CD GLN A 50 -5.054 16.557 3.276 1.00 0.00 C ATOM 726 OE1 GLN A 50 -4.276 15.801 3.858 1.00 0.00 O ATOM 727 NE2 GLN A 50 -6.071 17.149 3.891 1.00 0.00 N ATOM 0 H GLN A 50 -4.756 15.823 -1.575 1.00 0.00 H new ATOM 0 HA GLN A 50 -2.737 16.788 0.341 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -5.296 15.217 0.487 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -4.064 14.887 1.689 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -4.163 17.662 1.675 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.836 17.219 1.398 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.691 17.768 3.370 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.232 16.984 4.885 1.00 0.00 H new ATOM 736 N GLU A 51 -1.180 14.889 0.150 1.00 0.00 N ATOM 737 CA GLU A 51 -0.214 13.805 0.013 1.00 0.00 C ATOM 738 C GLU A 51 -0.364 12.792 1.147 1.00 0.00 C ATOM 739 O GLU A 51 -0.535 13.168 2.306 1.00 0.00 O ATOM 740 CB GLU A 51 1.210 14.365 0.002 1.00 0.00 C ATOM 741 CG GLU A 51 1.438 15.423 -1.065 1.00 0.00 C ATOM 742 CD GLU A 51 2.062 16.687 -0.508 1.00 0.00 C ATOM 743 OE1 GLU A 51 1.464 17.288 0.410 1.00 0.00 O ATOM 744 OE2 GLU A 51 3.146 17.077 -0.989 1.00 0.00 O ATOM 0 H GLU A 51 -0.798 15.745 0.552 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.408 13.297 -0.931 1.00 0.00 H new ATOM 0 HB2 GLU A 51 1.431 14.793 0.980 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.913 13.546 -0.154 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.084 15.016 -1.843 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.487 15.669 -1.537 1.00 0.00 H new ATOM 751 N PRO A 52 -0.292 11.485 0.827 1.00 0.00 N ATOM 752 CA PRO A 52 -0.432 10.420 1.822 1.00 0.00 C ATOM 753 C PRO A 52 0.858 10.167 2.597 1.00 0.00 C ATOM 754 O PRO A 52 1.937 10.584 2.179 1.00 0.00 O ATOM 755 CB PRO A 52 -0.789 9.205 0.970 1.00 0.00 C ATOM 756 CG PRO A 52 -0.104 9.449 -0.331 1.00 0.00 C ATOM 757 CD PRO A 52 -0.097 10.943 -0.533 1.00 0.00 C ATOM 0 HA PRO A 52 -1.171 10.665 2.585 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.445 8.280 1.433 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -1.867 9.114 0.840 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.912 9.054 -0.315 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -0.628 8.949 -1.146 1.00 0.00 H new ATOM 0 HD2 PRO A 52 0.843 11.283 -0.968 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -0.893 11.259 -1.207 1.00 0.00 H new ATOM 765 N LEU A 53 0.734 9.474 3.726 1.00 0.00 N ATOM 766 CA LEU A 53 1.883 9.151 4.567 1.00 0.00 C ATOM 767 C LEU A 53 2.632 7.937 4.021 1.00 0.00 C ATOM 768 O LEU A 53 2.018 6.952 3.607 1.00 0.00 O ATOM 769 CB LEU A 53 1.415 8.853 5.993 1.00 0.00 C ATOM 770 CG LEU A 53 2.043 9.684 7.124 1.00 0.00 C ATOM 771 CD1 LEU A 53 3.341 9.048 7.595 1.00 0.00 C ATOM 772 CD2 LEU A 53 2.272 11.126 6.702 1.00 0.00 C ATOM 0 H LEU A 53 -0.156 9.124 4.081 1.00 0.00 H new ATOM 0 HA LEU A 53 2.556 10.009 4.569 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.335 8.992 6.031 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.608 7.800 6.199 1.00 0.00 H new ATOM 0 HG LEU A 53 1.338 9.696 7.956 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.771 9.650 8.396 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.140 8.042 7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.043 8.995 6.763 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.717 11.681 7.528 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.944 11.152 5.844 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.320 11.581 6.431 1.00 0.00 H new ATOM 784 N THR A 54 3.959 8.018 4.022 1.00 0.00 N ATOM 785 CA THR A 54 4.806 6.920 3.561 1.00 0.00 C ATOM 786 C THR A 54 6.270 7.236 3.827 1.00 0.00 C ATOM 787 O THR A 54 6.587 8.250 4.444 1.00 0.00 O ATOM 788 CB THR A 54 4.600 6.633 2.070 1.00 0.00 C ATOM 789 OG1 THR A 54 3.614 7.487 1.515 1.00 0.00 O ATOM 790 CG2 THR A 54 4.184 5.203 1.794 1.00 0.00 C ATOM 0 H THR A 54 4.475 8.839 4.339 1.00 0.00 H new ATOM 0 HA THR A 54 4.519 6.028 4.119 1.00 0.00 H new ATOM 0 HB THR A 54 5.570 6.812 1.606 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.503 7.283 0.563 1.00 0.00 H new ATOM 0 HG21 THR A 54 4.054 5.063 0.721 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.954 4.523 2.158 1.00 0.00 H new ATOM 0 HG23 THR A 54 3.244 4.993 2.304 1.00 0.00 H new ATOM 798 N ALA A 55 7.157 6.371 3.349 1.00 0.00 N ATOM 799 CA ALA A 55 8.589 6.543 3.563 1.00 0.00 C ATOM 800 C ALA A 55 9.050 7.953 3.205 1.00 0.00 C ATOM 801 O ALA A 55 9.853 8.549 3.923 1.00 0.00 O ATOM 802 CB ALA A 55 9.368 5.513 2.768 1.00 0.00 C ATOM 0 H ALA A 55 6.909 5.542 2.809 1.00 0.00 H new ATOM 0 HA ALA A 55 8.784 6.394 4.625 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.435 5.654 2.938 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.079 4.512 3.088 1.00 0.00 H new ATOM 0 HB3 ALA A 55 9.151 5.632 1.707 1.00 0.00 H new ATOM 808 N SER A 56 8.544 8.480 2.095 1.00 0.00 N ATOM 809 CA SER A 56 8.904 9.823 1.654 1.00 0.00 C ATOM 810 C SER A 56 8.539 10.856 2.718 1.00 0.00 C ATOM 811 O SER A 56 9.379 11.653 3.142 1.00 0.00 O ATOM 812 CB SER A 56 8.198 10.158 0.338 1.00 0.00 C ATOM 813 OG SER A 56 8.531 9.222 -0.673 1.00 0.00 O ATOM 0 H SER A 56 7.884 7.998 1.485 1.00 0.00 H new ATOM 0 HA SER A 56 9.982 9.852 1.496 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.119 10.163 0.492 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.479 11.161 0.016 1.00 0.00 H new ATOM 0 HG SER A 56 8.066 9.457 -1.503 1.00 0.00 H new ATOM 819 N MET A 57 7.286 10.817 3.160 1.00 0.00 N ATOM 820 CA MET A 57 6.803 11.738 4.182 1.00 0.00 C ATOM 821 C MET A 57 7.641 11.616 5.447 1.00 0.00 C ATOM 822 O MET A 57 7.957 12.611 6.098 1.00 0.00 O ATOM 823 CB MET A 57 5.340 11.439 4.513 1.00 0.00 C ATOM 824 CG MET A 57 4.343 11.920 3.467 1.00 0.00 C ATOM 825 SD MET A 57 5.094 12.261 1.863 1.00 0.00 S ATOM 826 CE MET A 57 4.757 10.726 1.006 1.00 0.00 C ATOM 0 H MET A 57 6.585 10.156 2.825 1.00 0.00 H new ATOM 0 HA MET A 57 6.887 12.753 3.794 1.00 0.00 H new ATOM 0 HB2 MET A 57 5.222 10.363 4.640 1.00 0.00 H new ATOM 0 HB3 MET A 57 5.095 11.902 5.469 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.566 11.166 3.343 1.00 0.00 H new ATOM 0 HG3 MET A 57 3.854 12.824 3.830 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.401 10.650 0.130 1.00 0.00 H new ATOM 0 HE2 MET A 57 4.952 9.886 1.673 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.713 10.706 0.692 1.00 0.00 H new ATOM 836 N LEU A 58 7.987 10.381 5.787 1.00 0.00 N ATOM 837 CA LEU A 58 8.788 10.100 6.969 1.00 0.00 C ATOM 838 C LEU A 58 10.156 10.758 6.871 1.00 0.00 C ATOM 839 O LEU A 58 10.646 11.347 7.833 1.00 0.00 O ATOM 840 CB LEU A 58 8.954 8.591 7.126 1.00 0.00 C ATOM 841 CG LEU A 58 7.647 7.801 7.144 1.00 0.00 C ATOM 842 CD1 LEU A 58 7.903 6.346 6.777 1.00 0.00 C ATOM 843 CD2 LEU A 58 6.975 7.911 8.504 1.00 0.00 C ATOM 0 H LEU A 58 7.722 9.552 5.255 1.00 0.00 H new ATOM 0 HA LEU A 58 8.274 10.508 7.839 1.00 0.00 H new ATOM 0 HB2 LEU A 58 9.574 8.221 6.310 1.00 0.00 H new ATOM 0 HB3 LEU A 58 9.494 8.394 8.052 1.00 0.00 H new ATOM 0 HG LEU A 58 6.972 8.226 6.401 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.962 5.796 6.794 1.00 0.00 H new ATOM 0 HD12 LEU A 58 8.336 6.293 5.778 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.594 5.906 7.496 1.00 0.00 H new ATOM 0 HD21 LEU A 58 6.045 7.342 8.498 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.639 7.513 9.271 1.00 0.00 H new ATOM 0 HD23 LEU A 58 6.758 8.957 8.719 1.00 0.00 H new ATOM 855 N ALA A 59 10.770 10.641 5.699 1.00 0.00 N ATOM 856 CA ALA A 59 12.086 11.218 5.459 1.00 0.00 C ATOM 857 C ALA A 59 12.052 12.736 5.607 1.00 0.00 C ATOM 858 O ALA A 59 13.091 13.380 5.750 1.00 0.00 O ATOM 859 CB ALA A 59 12.590 10.830 4.077 1.00 0.00 C ATOM 0 H ALA A 59 10.375 10.149 4.897 1.00 0.00 H new ATOM 0 HA ALA A 59 12.773 10.821 6.206 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.574 11.269 3.912 1.00 0.00 H new ATOM 0 HB2 ALA A 59 12.660 9.745 4.007 1.00 0.00 H new ATOM 0 HB3 ALA A 59 11.897 11.199 3.320 1.00 0.00 H new ATOM 865 N SER A 60 10.848 13.299 5.578 1.00 0.00 N ATOM 866 CA SER A 60 10.675 14.742 5.714 1.00 0.00 C ATOM 867 C SER A 60 10.903 15.185 7.157 1.00 0.00 C ATOM 868 O SER A 60 10.943 16.380 7.449 1.00 0.00 O ATOM 869 CB SER A 60 9.274 15.155 5.261 1.00 0.00 C ATOM 870 OG SER A 60 9.194 16.556 5.061 1.00 0.00 O ATOM 0 H SER A 60 9.978 12.779 5.462 1.00 0.00 H new ATOM 0 HA SER A 60 11.415 15.231 5.080 1.00 0.00 H new ATOM 0 HB2 SER A 60 9.020 14.638 4.336 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.542 14.849 6.008 1.00 0.00 H new ATOM 0 HG SER A 60 9.746 17.014 5.729 1.00 0.00 H new ATOM 876 N ALA A 61 11.067 14.215 8.052 1.00 0.00 N ATOM 877 CA ALA A 61 11.295 14.507 9.463 1.00 0.00 C ATOM 878 C ALA A 61 12.454 13.678 10.019 1.00 0.00 C ATOM 879 O ALA A 61 12.271 12.898 10.954 1.00 0.00 O ATOM 880 CB ALA A 61 10.025 14.245 10.263 1.00 0.00 C ATOM 0 H ALA A 61 11.046 13.221 7.825 1.00 0.00 H new ATOM 0 HA ALA A 61 11.562 15.560 9.554 1.00 0.00 H new ATOM 0 HB1 ALA A 61 10.206 14.466 11.315 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.223 14.882 9.891 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.737 13.199 10.156 1.00 0.00 H new ATOM 886 N PRO A 62 13.672 13.844 9.462 1.00 0.00 N ATOM 887 CA PRO A 62 14.850 13.084 9.902 1.00 0.00 C ATOM 888 C PRO A 62 15.129 13.224 11.406 1.00 0.00 C ATOM 889 O PRO A 62 15.239 12.216 12.105 1.00 0.00 O ATOM 890 CB PRO A 62 15.996 13.661 9.065 1.00 0.00 C ATOM 891 CG PRO A 62 15.336 14.255 7.870 1.00 0.00 C ATOM 892 CD PRO A 62 13.990 14.742 8.334 1.00 0.00 C ATOM 0 HA PRO A 62 14.711 12.013 9.757 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.553 14.413 9.623 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.706 12.885 8.779 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.929 15.075 7.465 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.230 13.516 7.076 1.00 0.00 H new ATOM 0 HD2 PRO A 62 14.027 15.785 8.649 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.243 14.674 7.543 1.00 0.00 H new ATOM 900 N PRO A 63 15.233 14.462 11.944 1.00 0.00 N ATOM 901 CA PRO A 63 15.509 14.681 13.355 1.00 0.00 C ATOM 902 C PRO A 63 14.245 14.953 14.162 1.00 0.00 C ATOM 903 O PRO A 63 14.302 15.556 15.234 1.00 0.00 O ATOM 904 CB PRO A 63 16.381 15.930 13.306 1.00 0.00 C ATOM 905 CG PRO A 63 15.839 16.724 12.157 1.00 0.00 C ATOM 906 CD PRO A 63 15.136 15.750 11.233 1.00 0.00 C ATOM 0 HA PRO A 63 15.965 13.816 13.837 1.00 0.00 H new ATOM 0 HB2 PRO A 63 16.322 16.491 14.239 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.430 15.676 13.152 1.00 0.00 H new ATOM 0 HG2 PRO A 63 15.146 17.488 12.510 1.00 0.00 H new ATOM 0 HG3 PRO A 63 16.643 17.240 11.633 1.00 0.00 H new ATOM 0 HD2 PRO A 63 14.098 16.037 11.064 1.00 0.00 H new ATOM 0 HD3 PRO A 63 15.618 15.706 10.256 1.00 0.00 H new ATOM 914 N GLN A 64 13.102 14.522 13.636 1.00 0.00 N ATOM 915 CA GLN A 64 11.829 14.757 14.305 1.00 0.00 C ATOM 916 C GLN A 64 11.030 13.465 14.478 1.00 0.00 C ATOM 917 O GLN A 64 11.213 12.742 15.458 1.00 0.00 O ATOM 918 CB GLN A 64 11.005 15.783 13.522 1.00 0.00 C ATOM 919 CG GLN A 64 11.697 17.125 13.360 1.00 0.00 C ATOM 920 CD GLN A 64 11.339 18.104 14.462 1.00 0.00 C ATOM 921 OE1 GLN A 64 12.182 18.471 15.280 1.00 0.00 O ATOM 922 NE2 GLN A 64 10.082 18.530 14.489 1.00 0.00 N ATOM 0 H GLN A 64 13.032 14.012 12.755 1.00 0.00 H new ATOM 0 HA GLN A 64 12.046 15.147 15.299 1.00 0.00 H new ATOM 0 HB2 GLN A 64 10.780 15.379 12.535 1.00 0.00 H new ATOM 0 HB3 GLN A 64 10.052 15.934 14.029 1.00 0.00 H new ATOM 0 HG2 GLN A 64 12.776 16.974 13.350 1.00 0.00 H new ATOM 0 HG3 GLN A 64 11.426 17.555 12.396 1.00 0.00 H new ATOM 0 HE21 GLN A 64 9.416 18.199 13.791 1.00 0.00 H new ATOM 0 HE22 GLN A 64 9.782 19.188 15.208 1.00 0.00 H new ATOM 931 N GLU A 65 10.123 13.197 13.542 1.00 0.00 N ATOM 932 CA GLU A 65 9.258 12.025 13.628 1.00 0.00 C ATOM 933 C GLU A 65 9.657 10.946 12.624 1.00 0.00 C ATOM 934 O GLU A 65 8.797 10.267 12.063 1.00 0.00 O ATOM 935 CB GLU A 65 7.800 12.431 13.396 1.00 0.00 C ATOM 936 CG GLU A 65 7.540 13.921 13.560 1.00 0.00 C ATOM 937 CD GLU A 65 6.496 14.218 14.619 1.00 0.00 C ATOM 938 OE1 GLU A 65 5.366 13.703 14.498 1.00 0.00 O ATOM 939 OE2 GLU A 65 6.810 14.968 15.567 1.00 0.00 O ATOM 0 H GLU A 65 9.969 13.775 12.716 1.00 0.00 H new ATOM 0 HA GLU A 65 9.371 11.608 14.629 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.505 12.129 12.391 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.166 11.883 14.092 1.00 0.00 H new ATOM 0 HG2 GLU A 65 8.472 14.422 13.823 1.00 0.00 H new ATOM 0 HG3 GLU A 65 7.213 14.336 12.607 1.00 0.00 H new ATOM 946 N GLN A 66 10.957 10.775 12.415 1.00 0.00 N ATOM 947 CA GLN A 66 11.445 9.761 11.486 1.00 0.00 C ATOM 948 C GLN A 66 11.214 8.363 12.038 1.00 0.00 C ATOM 949 O GLN A 66 11.240 7.379 11.299 1.00 0.00 O ATOM 950 CB GLN A 66 12.929 9.959 11.207 1.00 0.00 C ATOM 951 CG GLN A 66 13.241 10.120 9.732 1.00 0.00 C ATOM 952 CD GLN A 66 14.667 9.737 9.386 1.00 0.00 C ATOM 953 OE1 GLN A 66 15.500 9.536 10.270 1.00 0.00 O ATOM 954 NE2 GLN A 66 14.955 9.634 8.094 1.00 0.00 N ATOM 0 H GLN A 66 11.688 11.320 12.872 1.00 0.00 H new ATOM 0 HA GLN A 66 10.888 9.869 10.555 1.00 0.00 H new ATOM 0 HB2 GLN A 66 13.279 10.840 11.745 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.483 9.106 11.598 1.00 0.00 H new ATOM 0 HG2 GLN A 66 12.554 9.505 9.151 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.067 11.156 9.440 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.233 9.810 7.395 1.00 0.00 H new ATOM 0 HE22 GLN A 66 15.898 9.379 7.800 1.00 0.00 H new ATOM 963 N LYS A 67 10.990 8.286 13.342 1.00 0.00 N ATOM 964 CA LYS A 67 10.747 7.010 14.006 1.00 0.00 C ATOM 965 C LYS A 67 9.531 7.091 14.924 1.00 0.00 C ATOM 966 O LYS A 67 9.405 6.313 15.869 1.00 0.00 O ATOM 967 CB LYS A 67 11.981 6.587 14.808 1.00 0.00 C ATOM 968 CG LYS A 67 12.250 7.467 16.020 1.00 0.00 C ATOM 969 CD LYS A 67 13.606 8.150 15.927 1.00 0.00 C ATOM 970 CE LYS A 67 13.676 9.370 16.831 1.00 0.00 C ATOM 971 NZ LYS A 67 13.799 10.632 16.053 1.00 0.00 N ATOM 0 H LYS A 67 10.971 9.094 13.964 1.00 0.00 H new ATOM 0 HA LYS A 67 10.546 6.263 13.238 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.853 5.556 15.139 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.853 6.606 14.154 1.00 0.00 H new ATOM 0 HG2 LYS A 67 11.467 8.221 16.104 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.208 6.862 16.926 1.00 0.00 H new ATOM 0 HD2 LYS A 67 14.390 7.445 16.204 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.795 8.448 14.896 1.00 0.00 H new ATOM 0 HE2 LYS A 67 12.782 9.413 17.453 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.528 9.274 17.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 13.844 11.440 16.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.666 10.603 15.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 12.974 10.737 15.429 1.00 0.00 H new ATOM 985 N GLN A 68 8.630 8.027 14.634 1.00 0.00 N ATOM 986 CA GLN A 68 7.441 8.211 15.460 1.00 0.00 C ATOM 987 C GLN A 68 6.164 8.294 14.622 1.00 0.00 C ATOM 988 O GLN A 68 5.196 7.580 14.887 1.00 0.00 O ATOM 989 CB GLN A 68 7.585 9.477 16.307 1.00 0.00 C ATOM 990 CG GLN A 68 6.454 9.676 17.303 1.00 0.00 C ATOM 991 CD GLN A 68 6.407 11.084 17.862 1.00 0.00 C ATOM 992 OE1 GLN A 68 7.104 11.406 18.823 1.00 0.00 O ATOM 993 NE2 GLN A 68 5.578 11.931 17.263 1.00 0.00 N ATOM 0 H GLN A 68 8.700 8.664 13.841 1.00 0.00 H new ATOM 0 HA GLN A 68 7.356 7.338 16.107 1.00 0.00 H new ATOM 0 HB2 GLN A 68 8.531 9.437 16.847 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.632 10.343 15.646 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.504 9.450 16.818 1.00 0.00 H new ATOM 0 HG3 GLN A 68 6.569 8.968 18.123 1.00 0.00 H new ATOM 0 HE21 GLN A 68 5.018 11.621 16.469 1.00 0.00 H new ATOM 0 HE22 GLN A 68 5.501 12.892 17.597 1.00 0.00 H new ATOM 1002 N MET A 69 6.153 9.184 13.632 1.00 0.00 N ATOM 1003 CA MET A 69 4.967 9.393 12.802 1.00 0.00 C ATOM 1004 C MET A 69 4.791 8.295 11.755 1.00 0.00 C ATOM 1005 O MET A 69 4.025 8.451 10.804 1.00 0.00 O ATOM 1006 CB MET A 69 5.036 10.758 12.115 1.00 0.00 C ATOM 1007 CG MET A 69 5.973 10.798 10.917 1.00 0.00 C ATOM 1008 SD MET A 69 5.253 11.652 9.502 1.00 0.00 S ATOM 1009 CE MET A 69 6.691 12.500 8.854 1.00 0.00 C ATOM 0 H MET A 69 6.950 9.771 13.385 1.00 0.00 H new ATOM 0 HA MET A 69 4.102 9.357 13.464 1.00 0.00 H new ATOM 0 HB2 MET A 69 4.035 11.042 11.791 1.00 0.00 H new ATOM 0 HB3 MET A 69 5.359 11.504 12.842 1.00 0.00 H new ATOM 0 HG2 MET A 69 6.901 11.294 11.202 1.00 0.00 H new ATOM 0 HG3 MET A 69 6.232 9.779 10.629 1.00 0.00 H new ATOM 0 HE1 MET A 69 6.650 12.506 7.765 1.00 0.00 H new ATOM 0 HE2 MET A 69 6.705 13.526 9.222 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.595 11.985 9.180 1.00 0.00 H new ATOM 1019 N LEU A 70 5.497 7.188 11.933 1.00 0.00 N ATOM 1020 CA LEU A 70 5.403 6.061 11.009 1.00 0.00 C ATOM 1021 C LEU A 70 4.293 5.123 11.441 1.00 0.00 C ATOM 1022 O LEU A 70 3.688 4.431 10.624 1.00 0.00 O ATOM 1023 CB LEU A 70 6.728 5.298 10.950 1.00 0.00 C ATOM 1024 CG LEU A 70 7.737 5.685 12.030 1.00 0.00 C ATOM 1025 CD1 LEU A 70 8.836 4.640 12.138 1.00 0.00 C ATOM 1026 CD2 LEU A 70 8.315 7.058 11.735 1.00 0.00 C ATOM 0 H LEU A 70 6.143 7.043 12.709 1.00 0.00 H new ATOM 0 HA LEU A 70 5.179 6.451 10.016 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.521 4.231 11.031 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.182 5.461 9.973 1.00 0.00 H new ATOM 0 HG LEU A 70 7.224 5.727 12.991 1.00 0.00 H new ATOM 0 HD11 LEU A 70 9.544 4.935 12.913 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.397 3.676 12.395 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.356 4.559 11.183 1.00 0.00 H new ATOM 0 HD21 LEU A 70 9.033 7.325 12.510 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.816 7.042 10.767 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.512 7.794 11.716 1.00 0.00 H new ATOM 1038 N GLY A 71 4.044 5.099 12.741 1.00 0.00 N ATOM 1039 CA GLY A 71 2.993 4.270 13.275 1.00 0.00 C ATOM 1040 C GLY A 71 2.121 5.034 14.249 1.00 0.00 C ATOM 1041 O GLY A 71 1.298 4.447 14.952 1.00 0.00 O ATOM 0 H GLY A 71 4.556 5.643 13.436 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.380 3.888 12.459 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.429 3.406 13.777 1.00 0.00 H new ATOM 1045 N GLU A 72 2.292 6.357 14.276 1.00 0.00 N ATOM 1046 CA GLU A 72 1.515 7.208 15.173 1.00 0.00 C ATOM 1047 C GLU A 72 0.901 8.399 14.433 1.00 0.00 C ATOM 1048 O GLU A 72 0.189 9.206 15.030 1.00 0.00 O ATOM 1049 CB GLU A 72 2.393 7.706 16.323 1.00 0.00 C ATOM 1050 CG GLU A 72 2.904 6.593 17.224 1.00 0.00 C ATOM 1051 CD GLU A 72 3.104 7.049 18.657 1.00 0.00 C ATOM 1052 OE1 GLU A 72 3.929 7.960 18.880 1.00 0.00 O ATOM 1053 OE2 GLU A 72 2.436 6.494 19.555 1.00 0.00 O ATOM 0 H GLU A 72 2.959 6.859 13.689 1.00 0.00 H new ATOM 0 HA GLU A 72 0.700 6.606 15.573 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.244 8.248 15.911 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.823 8.415 16.923 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.198 5.763 17.206 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.849 6.217 16.831 1.00 0.00 H new ATOM 1060 N ARG A 73 1.164 8.495 13.130 1.00 0.00 N ATOM 1061 CA ARG A 73 0.622 9.582 12.316 1.00 0.00 C ATOM 1062 C ARG A 73 -0.097 9.031 11.092 1.00 0.00 C ATOM 1063 O ARG A 73 -0.942 9.702 10.500 1.00 0.00 O ATOM 1064 CB ARG A 73 1.736 10.532 11.879 1.00 0.00 C ATOM 1065 CG ARG A 73 1.285 11.979 11.753 1.00 0.00 C ATOM 1066 CD ARG A 73 0.948 12.335 10.314 1.00 0.00 C ATOM 1067 NE ARG A 73 0.985 13.777 10.082 1.00 0.00 N ATOM 1068 CZ ARG A 73 1.903 14.380 9.333 1.00 0.00 C ATOM 1069 NH1 ARG A 73 2.858 13.670 8.745 1.00 0.00 N ATOM 1070 NH2 ARG A 73 1.869 15.696 9.169 1.00 0.00 N ATOM 0 H ARG A 73 1.748 7.835 12.617 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.094 10.134 12.925 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.553 10.476 12.598 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.132 10.198 10.920 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.412 12.145 12.384 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.072 12.639 12.117 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.653 11.842 9.644 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.044 11.954 10.069 1.00 0.00 H new ATOM 0 HE ARG A 73 0.266 14.353 10.519 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.889 12.658 8.867 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.560 14.137 8.171 1.00 0.00 H new ATOM 0 HH21 ARG A 73 1.138 16.247 9.618 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.574 16.157 8.594 1.00 0.00 H new ATOM 1084 N LEU A 74 0.240 7.800 10.722 1.00 0.00 N ATOM 1085 CA LEU A 74 -0.379 7.149 9.577 1.00 0.00 C ATOM 1086 C LEU A 74 -1.776 6.669 9.914 1.00 0.00 C ATOM 1087 O LEU A 74 -2.549 6.313 9.030 1.00 0.00 O ATOM 1088 CB LEU A 74 0.459 5.957 9.139 1.00 0.00 C ATOM 1089 CG LEU A 74 1.306 6.203 7.909 1.00 0.00 C ATOM 1090 CD1 LEU A 74 2.680 5.592 8.091 1.00 0.00 C ATOM 1091 CD2 LEU A 74 0.611 5.655 6.673 1.00 0.00 C ATOM 0 H LEU A 74 0.940 7.233 11.201 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.439 7.879 8.770 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.112 5.666 9.962 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.204 5.114 8.945 1.00 0.00 H new ATOM 0 HG LEU A 74 1.433 7.277 7.770 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.281 5.775 7.200 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.167 6.043 8.956 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.583 4.518 8.248 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.231 5.839 5.795 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.455 4.583 6.789 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.352 6.150 6.547 1.00 0.00 H new ATOM 1103 N PHE A 75 -2.067 6.627 11.204 1.00 0.00 N ATOM 1104 CA PHE A 75 -3.351 6.148 11.697 1.00 0.00 C ATOM 1105 C PHE A 75 -4.523 6.621 10.824 1.00 0.00 C ATOM 1106 O PHE A 75 -5.299 5.799 10.333 1.00 0.00 O ATOM 1107 CB PHE A 75 -3.541 6.590 13.151 1.00 0.00 C ATOM 1108 CG PHE A 75 -4.632 5.856 13.872 1.00 0.00 C ATOM 1109 CD1 PHE A 75 -4.934 4.544 13.548 1.00 0.00 C ATOM 1110 CD2 PHE A 75 -5.345 6.475 14.886 1.00 0.00 C ATOM 1111 CE1 PHE A 75 -5.936 3.867 14.214 1.00 0.00 C ATOM 1112 CE2 PHE A 75 -6.347 5.801 15.557 1.00 0.00 C ATOM 1113 CZ PHE A 75 -6.643 4.495 15.220 1.00 0.00 C ATOM 0 H PHE A 75 -1.423 6.923 11.938 1.00 0.00 H new ATOM 0 HA PHE A 75 -3.345 5.059 11.647 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.604 6.448 13.689 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.761 7.657 13.170 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -4.380 4.045 12.766 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -5.115 7.495 15.155 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -6.167 2.846 13.948 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -6.898 6.295 16.344 1.00 0.00 H new ATOM 0 HZ PHE A 75 -7.426 3.966 15.742 1.00 0.00 H new ATOM 1123 N PRO A 76 -4.666 7.944 10.589 1.00 0.00 N ATOM 1124 CA PRO A 76 -5.752 8.477 9.760 1.00 0.00 C ATOM 1125 C PRO A 76 -5.569 8.136 8.285 1.00 0.00 C ATOM 1126 O PRO A 76 -6.529 8.125 7.515 1.00 0.00 O ATOM 1127 CB PRO A 76 -5.671 9.998 9.966 1.00 0.00 C ATOM 1128 CG PRO A 76 -4.734 10.201 11.111 1.00 0.00 C ATOM 1129 CD PRO A 76 -3.809 9.020 11.106 1.00 0.00 C ATOM 0 HA PRO A 76 -6.715 8.052 10.043 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.305 10.496 9.068 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.653 10.416 10.185 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -4.178 11.132 10.999 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.278 10.266 12.053 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.941 9.188 10.469 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.433 8.795 12.104 1.00 0.00 H new ATOM 1137 N LEU A 77 -4.326 7.861 7.900 1.00 0.00 N ATOM 1138 CA LEU A 77 -4.006 7.540 6.514 1.00 0.00 C ATOM 1139 C LEU A 77 -4.346 6.091 6.177 1.00 0.00 C ATOM 1140 O LEU A 77 -4.681 5.780 5.033 1.00 0.00 O ATOM 1141 CB LEU A 77 -2.520 7.797 6.240 1.00 0.00 C ATOM 1142 CG LEU A 77 -2.118 9.265 6.054 1.00 0.00 C ATOM 1143 CD1 LEU A 77 -3.237 10.072 5.407 1.00 0.00 C ATOM 1144 CD2 LEU A 77 -1.723 9.868 7.389 1.00 0.00 C ATOM 0 H LEU A 77 -3.524 7.854 8.530 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.613 8.186 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.941 7.384 7.066 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.235 7.246 5.344 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.260 9.300 5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.918 11.108 5.290 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.470 9.652 4.429 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.125 10.035 6.039 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.439 10.911 7.247 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.566 9.812 8.077 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.880 9.315 7.803 1.00 0.00 H new ATOM 1156 N ILE A 78 -4.240 5.200 7.160 1.00 0.00 N ATOM 1157 CA ILE A 78 -4.535 3.790 6.928 1.00 0.00 C ATOM 1158 C ILE A 78 -6.020 3.582 6.676 1.00 0.00 C ATOM 1159 O ILE A 78 -6.404 2.829 5.782 1.00 0.00 O ATOM 1160 CB ILE A 78 -4.103 2.894 8.095 1.00 0.00 C ATOM 1161 CG1 ILE A 78 -2.766 3.361 8.671 1.00 0.00 C ATOM 1162 CG2 ILE A 78 -4.012 1.451 7.626 1.00 0.00 C ATOM 1163 CD1 ILE A 78 -1.604 3.192 7.719 1.00 0.00 C ATOM 0 H ILE A 78 -3.956 5.426 8.113 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.960 3.504 6.047 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.849 2.962 8.887 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.847 4.412 8.949 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.560 2.804 9.585 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.705 0.817 8.458 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -4.986 1.125 7.261 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.280 1.375 6.822 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.689 3.544 8.195 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.496 2.139 7.460 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -1.788 3.771 6.814 1.00 0.00 H new ATOM 1175 N GLN A 79 -6.850 4.262 7.463 1.00 0.00 N ATOM 1176 CA GLN A 79 -8.298 4.186 7.299 1.00 0.00 C ATOM 1177 C GLN A 79 -8.682 4.442 5.844 1.00 0.00 C ATOM 1178 O GLN A 79 -9.783 4.113 5.406 1.00 0.00 O ATOM 1179 CB GLN A 79 -8.978 5.217 8.200 1.00 0.00 C ATOM 1180 CG GLN A 79 -9.450 4.655 9.529 1.00 0.00 C ATOM 1181 CD GLN A 79 -10.318 5.628 10.301 1.00 0.00 C ATOM 1182 OE1 GLN A 79 -11.470 5.333 10.620 1.00 0.00 O ATOM 1183 NE2 GLN A 79 -9.769 6.797 10.607 1.00 0.00 N ATOM 0 H GLN A 79 -6.544 4.872 8.221 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.629 3.186 7.580 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -8.283 6.035 8.389 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.832 5.640 7.671 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.010 3.737 9.352 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.584 4.388 10.134 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -8.811 7.000 10.323 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -10.305 7.492 11.126 1.00 0.00 H new ATOM 1192 N ALA A 80 -7.752 5.039 5.111 1.00 0.00 N ATOM 1193 CA ALA A 80 -7.941 5.330 3.694 1.00 0.00 C ATOM 1194 C ALA A 80 -7.646 4.100 2.844 1.00 0.00 C ATOM 1195 O ALA A 80 -8.349 3.821 1.872 1.00 0.00 O ATOM 1196 CB ALA A 80 -7.040 6.480 3.272 1.00 0.00 C ATOM 0 H ALA A 80 -6.848 5.335 5.479 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.982 5.615 3.539 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.189 6.689 2.213 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.286 7.368 3.855 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -5.999 6.209 3.445 1.00 0.00 H new ATOM 1202 N MET A 81 -6.583 3.384 3.202 1.00 0.00 N ATOM 1203 CA MET A 81 -6.186 2.182 2.476 1.00 0.00 C ATOM 1204 C MET A 81 -7.199 1.068 2.697 1.00 0.00 C ATOM 1205 O MET A 81 -7.590 0.367 1.762 1.00 0.00 O ATOM 1206 CB MET A 81 -4.801 1.717 2.935 1.00 0.00 C ATOM 1207 CG MET A 81 -3.828 2.855 3.193 1.00 0.00 C ATOM 1208 SD MET A 81 -2.701 2.507 4.551 1.00 0.00 S ATOM 1209 CE MET A 81 -1.206 2.111 3.655 1.00 0.00 C ATOM 0 H MET A 81 -5.981 3.616 3.992 1.00 0.00 H new ATOM 0 HA MET A 81 -6.148 2.421 1.413 1.00 0.00 H new ATOM 0 HB2 MET A 81 -4.909 1.129 3.847 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.380 1.056 2.177 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.252 3.048 2.288 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.388 3.764 3.414 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.361 2.098 4.344 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.310 1.131 3.190 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.034 2.862 2.884 1.00 0.00 H new ATOM 1219 N HIS A 82 -7.616 0.919 3.945 1.00 0.00 N ATOM 1220 CA HIS A 82 -8.581 -0.102 4.323 1.00 0.00 C ATOM 1221 C HIS A 82 -9.835 0.543 4.897 1.00 0.00 C ATOM 1222 O HIS A 82 -9.758 1.615 5.490 1.00 0.00 O ATOM 1223 CB HIS A 82 -7.955 -1.036 5.360 1.00 0.00 C ATOM 1224 CG HIS A 82 -7.245 -2.205 4.757 1.00 0.00 C ATOM 1225 ND1 HIS A 82 -7.443 -3.481 5.219 1.00 0.00 N ATOM 1226 CD2 HIS A 82 -6.345 -2.236 3.743 1.00 0.00 C ATOM 1227 CE1 HIS A 82 -6.677 -4.260 4.474 1.00 0.00 C ATOM 1228 NE2 HIS A 82 -5.986 -3.546 3.576 1.00 0.00 N ATOM 0 H HIS A 82 -7.297 1.499 4.721 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.858 -0.675 3.438 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -7.252 -0.469 5.970 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -8.736 -1.400 6.028 1.00 0.00 H new ATOM 0 HD1 HIS A 82 -8.056 -3.770 5.981 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -5.982 -1.391 3.177 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -6.616 -5.333 4.576 1.00 0.00 H new ATOM 1236 N PRO A 83 -11.013 -0.090 4.723 1.00 0.00 N ATOM 1237 CA PRO A 83 -12.276 0.442 5.253 1.00 0.00 C ATOM 1238 C PRO A 83 -12.230 0.590 6.771 1.00 0.00 C ATOM 1239 O PRO A 83 -12.763 -0.245 7.503 1.00 0.00 O ATOM 1240 CB PRO A 83 -13.318 -0.606 4.842 1.00 0.00 C ATOM 1241 CG PRO A 83 -12.535 -1.841 4.554 1.00 0.00 C ATOM 1242 CD PRO A 83 -11.205 -1.377 4.034 1.00 0.00 C ATOM 0 HA PRO A 83 -12.497 1.438 4.868 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -14.042 -0.775 5.639 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -13.879 -0.282 3.965 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -12.413 -2.444 5.454 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -13.045 -2.464 3.819 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -10.410 -2.084 4.270 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -11.214 -1.258 2.951 1.00 0.00 H new ATOM 1250 N THR A 84 -11.563 1.648 7.230 1.00 0.00 N ATOM 1251 CA THR A 84 -11.400 1.906 8.655 1.00 0.00 C ATOM 1252 C THR A 84 -10.963 0.640 9.391 1.00 0.00 C ATOM 1253 O THR A 84 -11.364 0.401 10.531 1.00 0.00 O ATOM 1254 CB THR A 84 -12.702 2.445 9.255 1.00 0.00 C ATOM 1255 OG1 THR A 84 -13.654 1.406 9.408 1.00 0.00 O ATOM 1256 CG2 THR A 84 -13.340 3.535 8.420 1.00 0.00 C ATOM 0 H THR A 84 -11.124 2.344 6.627 1.00 0.00 H new ATOM 0 HA THR A 84 -10.621 2.659 8.775 1.00 0.00 H new ATOM 0 HB THR A 84 -12.421 2.867 10.220 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.430 0.666 8.806 1.00 0.00 H new ATOM 0 HG21 THR A 84 -14.258 3.872 8.902 1.00 0.00 H new ATOM 0 HG22 THR A 84 -12.650 4.373 8.327 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.572 3.145 7.429 1.00 0.00 H new ATOM 1264 N LEU A 85 -10.140 -0.168 8.726 1.00 0.00 N ATOM 1265 CA LEU A 85 -9.657 -1.419 9.303 1.00 0.00 C ATOM 1266 C LEU A 85 -8.370 -1.203 10.091 1.00 0.00 C ATOM 1267 O LEU A 85 -7.780 -2.156 10.600 1.00 0.00 O ATOM 1268 CB LEU A 85 -9.419 -2.451 8.202 1.00 0.00 C ATOM 1269 CG LEU A 85 -10.362 -3.657 8.232 1.00 0.00 C ATOM 1270 CD1 LEU A 85 -11.727 -3.279 7.677 1.00 0.00 C ATOM 1271 CD2 LEU A 85 -9.767 -4.818 7.449 1.00 0.00 C ATOM 0 H LEU A 85 -9.794 0.022 7.786 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.421 -1.788 9.987 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.515 -1.957 7.235 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.392 -2.809 8.276 1.00 0.00 H new ATOM 0 HG LEU A 85 -10.488 -3.972 9.268 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.385 -4.148 7.706 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -12.156 -2.479 8.280 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -11.620 -2.939 6.647 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.450 -5.667 7.481 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.611 -4.516 6.413 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -8.813 -5.104 7.891 1.00 0.00 H new ATOM 1283 N ALA A 86 -7.939 0.051 10.178 1.00 0.00 N ATOM 1284 CA ALA A 86 -6.726 0.398 10.913 1.00 0.00 C ATOM 1285 C ALA A 86 -6.862 0.025 12.391 1.00 0.00 C ATOM 1286 O ALA A 86 -6.958 -1.154 12.733 1.00 0.00 O ATOM 1287 CB ALA A 86 -6.415 1.879 10.745 1.00 0.00 C ATOM 0 H ALA A 86 -8.412 0.846 9.748 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.893 -0.174 10.503 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.508 2.125 11.298 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.268 2.102 9.688 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.246 2.471 11.129 1.00 0.00 H new ATOM 1293 N GLY A 87 -6.862 1.026 13.266 1.00 0.00 N ATOM 1294 CA GLY A 87 -6.999 0.766 14.688 1.00 0.00 C ATOM 1295 C GLY A 87 -5.850 -0.044 15.259 1.00 0.00 C ATOM 1296 O GLY A 87 -5.821 -0.318 16.459 1.00 0.00 O ATOM 0 H GLY A 87 -6.770 2.011 13.017 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.066 1.715 15.220 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.934 0.234 14.866 1.00 0.00 H new ATOM 1300 N LYS A 88 -4.900 -0.430 14.405 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.768 -1.228 14.843 1.00 0.00 C ATOM 1302 C LYS A 88 -2.761 -1.466 13.714 1.00 0.00 C ATOM 1303 O LYS A 88 -1.607 -1.785 13.977 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.265 -2.571 15.386 1.00 0.00 C ATOM 1305 CG LYS A 88 -3.154 -3.512 15.815 1.00 0.00 C ATOM 1306 CD LYS A 88 -2.297 -2.900 16.911 1.00 0.00 C ATOM 1307 CE LYS A 88 -0.839 -2.888 16.502 1.00 0.00 C ATOM 1308 NZ LYS A 88 0.015 -3.674 17.437 1.00 0.00 N ATOM 0 H LYS A 88 -4.897 -0.201 13.411 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.255 -0.673 15.629 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.920 -2.387 16.237 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.867 -3.061 14.620 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -3.585 -4.448 16.169 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.529 -3.754 14.956 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.631 -1.883 17.117 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.417 -3.468 17.834 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.743 -3.295 15.495 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.482 -1.859 16.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.992 -3.694 17.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.002 -3.231 18.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -0.349 -4.646 17.505 1.00 0.00 H new ATOM 1322 N ILE A 89 -3.193 -1.323 12.459 1.00 0.00 N ATOM 1323 CA ILE A 89 -2.315 -1.574 11.324 1.00 0.00 C ATOM 1324 C ILE A 89 -0.981 -0.837 11.461 1.00 0.00 C ATOM 1325 O ILE A 89 0.005 -1.415 11.907 1.00 0.00 O ATOM 1326 CB ILE A 89 -2.979 -1.185 9.992 1.00 0.00 C ATOM 1327 CG1 ILE A 89 -4.305 -1.934 9.825 1.00 0.00 C ATOM 1328 CG2 ILE A 89 -2.039 -1.491 8.836 1.00 0.00 C ATOM 1329 CD1 ILE A 89 -5.149 -1.441 8.669 1.00 0.00 C ATOM 0 H ILE A 89 -4.139 -1.037 12.208 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.123 -2.647 11.321 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.188 -0.115 9.996 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.096 -2.994 9.683 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.880 -1.843 10.746 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.516 -1.213 7.896 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.117 -0.923 8.957 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.810 -2.557 8.825 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.070 -2.021 8.618 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.391 -0.389 8.818 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.594 -1.558 7.738 1.00 0.00 H new ATOM 1341 N THR A 90 -0.950 0.428 11.052 1.00 0.00 N ATOM 1342 CA THR A 90 0.271 1.238 11.121 1.00 0.00 C ATOM 1343 C THR A 90 0.852 1.229 12.530 1.00 0.00 C ATOM 1344 O THR A 90 2.069 1.179 12.704 1.00 0.00 O ATOM 1345 CB THR A 90 -0.036 2.664 10.656 1.00 0.00 C ATOM 1346 OG1 THR A 90 0.731 2.982 9.508 1.00 0.00 O ATOM 1347 CG2 THR A 90 0.219 3.743 11.687 1.00 0.00 C ATOM 0 H THR A 90 -1.757 0.919 10.668 1.00 0.00 H new ATOM 0 HA THR A 90 1.023 0.807 10.459 1.00 0.00 H new ATOM 0 HB THR A 90 -1.107 2.657 10.451 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.640 3.228 9.780 1.00 0.00 H new ATOM 0 HG21 THR A 90 -0.028 4.717 11.264 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.401 3.561 12.565 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.270 3.729 11.976 1.00 0.00 H new ATOM 1355 N GLY A 91 -0.018 1.262 13.535 1.00 0.00 N ATOM 1356 CA GLY A 91 0.450 1.189 14.904 1.00 0.00 C ATOM 1357 C GLY A 91 1.263 -0.068 15.122 1.00 0.00 C ATOM 1358 O GLY A 91 2.198 -0.094 15.922 1.00 0.00 O ATOM 0 H GLY A 91 -1.029 1.337 13.426 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.056 2.065 15.134 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.400 1.202 15.586 1.00 0.00 H new ATOM 1362 N MET A 92 0.919 -1.100 14.360 1.00 0.00 N ATOM 1363 CA MET A 92 1.637 -2.369 14.406 1.00 0.00 C ATOM 1364 C MET A 92 2.949 -2.248 13.667 1.00 0.00 C ATOM 1365 O MET A 92 3.946 -2.858 14.039 1.00 0.00 O ATOM 1366 CB MET A 92 0.810 -3.483 13.761 1.00 0.00 C ATOM 1367 CG MET A 92 1.001 -4.835 14.424 1.00 0.00 C ATOM 1368 SD MET A 92 -0.484 -5.854 14.368 1.00 0.00 S ATOM 1369 CE MET A 92 -0.770 -5.924 12.603 1.00 0.00 C ATOM 0 H MET A 92 0.142 -1.082 13.699 1.00 0.00 H new ATOM 0 HA MET A 92 1.819 -2.615 15.452 1.00 0.00 H new ATOM 0 HB2 MET A 92 -0.245 -3.212 13.801 1.00 0.00 H new ATOM 0 HB3 MET A 92 1.079 -3.562 12.708 1.00 0.00 H new ATOM 0 HG2 MET A 92 1.818 -5.364 13.933 1.00 0.00 H new ATOM 0 HG3 MET A 92 1.296 -4.687 15.463 1.00 0.00 H new ATOM 0 HE1 MET A 92 -1.224 -6.881 12.346 1.00 0.00 H new ATOM 0 HE2 MET A 92 -1.439 -5.114 12.310 1.00 0.00 H new ATOM 0 HE3 MET A 92 0.179 -5.819 12.076 1.00 0.00 H new ATOM 1379 N LEU A 93 2.922 -1.463 12.602 1.00 0.00 N ATOM 1380 CA LEU A 93 4.079 -1.268 11.747 1.00 0.00 C ATOM 1381 C LEU A 93 5.283 -0.766 12.532 1.00 0.00 C ATOM 1382 O LEU A 93 6.404 -0.750 12.024 1.00 0.00 O ATOM 1383 CB LEU A 93 3.718 -0.298 10.637 1.00 0.00 C ATOM 1384 CG LEU A 93 3.079 -0.946 9.406 1.00 0.00 C ATOM 1385 CD1 LEU A 93 4.073 -1.875 8.725 1.00 0.00 C ATOM 1386 CD2 LEU A 93 1.817 -1.705 9.795 1.00 0.00 C ATOM 0 H LEU A 93 2.096 -0.943 12.307 1.00 0.00 H new ATOM 0 HA LEU A 93 4.360 -2.229 11.317 1.00 0.00 H new ATOM 0 HB2 LEU A 93 3.032 0.450 11.035 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.620 0.230 10.326 1.00 0.00 H new ATOM 0 HG LEU A 93 2.801 -0.160 8.704 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.606 -2.330 7.851 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.949 -1.306 8.414 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.377 -2.656 9.422 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.377 -2.159 8.907 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.068 -2.485 10.514 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.101 -1.016 10.243 1.00 0.00 H new ATOM 1398 N LEU A 94 5.051 -0.373 13.776 1.00 0.00 N ATOM 1399 CA LEU A 94 6.129 0.056 14.646 1.00 0.00 C ATOM 1400 C LEU A 94 6.408 -1.030 15.672 1.00 0.00 C ATOM 1401 O LEU A 94 6.843 -0.756 16.792 1.00 0.00 O ATOM 1402 CB LEU A 94 5.765 1.367 15.339 1.00 0.00 C ATOM 1403 CG LEU A 94 6.433 2.611 14.750 1.00 0.00 C ATOM 1404 CD1 LEU A 94 6.026 2.800 13.295 1.00 0.00 C ATOM 1405 CD2 LEU A 94 6.085 3.845 15.569 1.00 0.00 C ATOM 0 H LEU A 94 4.125 -0.343 14.203 1.00 0.00 H new ATOM 0 HA LEU A 94 7.026 0.227 14.051 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.684 1.497 15.295 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.034 1.292 16.393 1.00 0.00 H new ATOM 0 HG LEU A 94 7.513 2.470 14.787 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.511 3.690 12.894 1.00 0.00 H new ATOM 0 HD12 LEU A 94 6.331 1.928 12.716 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.944 2.917 13.232 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.570 4.719 15.134 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.005 3.990 15.567 1.00 0.00 H new ATOM 0 HD23 LEU A 94 6.431 3.711 16.594 1.00 0.00 H new ATOM 1417 N GLU A 95 6.124 -2.270 15.277 1.00 0.00 N ATOM 1418 CA GLU A 95 6.304 -3.419 16.155 1.00 0.00 C ATOM 1419 C GLU A 95 6.077 -4.740 15.417 1.00 0.00 C ATOM 1420 O GLU A 95 6.154 -5.809 16.023 1.00 0.00 O ATOM 1421 CB GLU A 95 5.344 -3.325 17.344 1.00 0.00 C ATOM 1422 CG GLU A 95 3.912 -3.712 17.004 1.00 0.00 C ATOM 1423 CD GLU A 95 3.065 -3.957 18.236 1.00 0.00 C ATOM 1424 OE1 GLU A 95 3.064 -3.092 19.138 1.00 0.00 O ATOM 1425 OE2 GLU A 95 2.403 -5.014 18.301 1.00 0.00 O ATOM 0 H GLU A 95 5.767 -2.502 14.350 1.00 0.00 H new ATOM 0 HA GLU A 95 7.335 -3.404 16.509 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.706 -3.971 18.144 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.354 -2.305 17.729 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.458 -2.921 16.407 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.919 -4.611 16.388 1.00 0.00 H new ATOM 1432 N ILE A 96 5.808 -4.672 14.110 1.00 0.00 N ATOM 1433 CA ILE A 96 5.562 -5.887 13.326 1.00 0.00 C ATOM 1434 C ILE A 96 6.796 -6.788 13.281 1.00 0.00 C ATOM 1435 O ILE A 96 7.629 -6.782 14.188 1.00 0.00 O ATOM 1436 CB ILE A 96 5.173 -5.583 11.862 1.00 0.00 C ATOM 1437 CG1 ILE A 96 6.359 -4.995 11.099 1.00 0.00 C ATOM 1438 CG2 ILE A 96 3.969 -4.667 11.769 1.00 0.00 C ATOM 1439 CD1 ILE A 96 6.736 -3.602 11.524 1.00 0.00 C ATOM 0 H ILE A 96 5.755 -3.803 13.578 1.00 0.00 H new ATOM 0 HA ILE A 96 4.735 -6.385 13.832 1.00 0.00 H new ATOM 0 HB ILE A 96 4.894 -6.530 11.400 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.221 -5.649 11.230 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.124 -4.987 10.035 1.00 0.00 H new ATOM 0 HG21 ILE A 96 3.733 -4.482 10.721 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.115 -5.138 12.256 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.192 -3.722 12.263 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.586 -3.259 10.934 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.891 -2.932 11.366 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.005 -3.604 12.580 1.00 0.00 H new ATOM 1451 N ASP A 97 6.919 -7.519 12.174 1.00 0.00 N ATOM 1452 CA ASP A 97 8.063 -8.372 11.911 1.00 0.00 C ATOM 1453 C ASP A 97 9.365 -7.590 12.044 1.00 0.00 C ATOM 1454 O ASP A 97 10.452 -8.169 12.023 1.00 0.00 O ATOM 1455 CB ASP A 97 7.943 -8.926 10.492 1.00 0.00 C ATOM 1456 CG ASP A 97 8.734 -10.203 10.291 1.00 0.00 C ATOM 1457 OD1 ASP A 97 8.758 -11.039 11.219 1.00 0.00 O ATOM 1458 OD2 ASP A 97 9.329 -10.367 9.206 1.00 0.00 O ATOM 0 H ASP A 97 6.219 -7.532 11.432 1.00 0.00 H new ATOM 0 HA ASP A 97 8.077 -9.184 12.638 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.893 -9.115 10.268 1.00 0.00 H new ATOM 0 HB3 ASP A 97 8.289 -8.174 9.783 1.00 0.00 H new ATOM 1463 N ASN A 98 9.230 -6.267 12.143 1.00 0.00 N ATOM 1464 CA ASN A 98 10.361 -5.353 12.259 1.00 0.00 C ATOM 1465 C ASN A 98 10.981 -5.084 10.896 1.00 0.00 C ATOM 1466 O ASN A 98 11.587 -4.035 10.674 1.00 0.00 O ATOM 1467 CB ASN A 98 11.417 -5.882 13.233 1.00 0.00 C ATOM 1468 CG ASN A 98 11.520 -5.039 14.489 1.00 0.00 C ATOM 1469 OD1 ASN A 98 11.165 -5.484 15.581 1.00 0.00 O ATOM 1470 ND2 ASN A 98 12.007 -3.813 14.340 1.00 0.00 N ATOM 0 H ASN A 98 8.324 -5.798 12.145 1.00 0.00 H new ATOM 0 HA ASN A 98 9.981 -4.413 12.660 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.173 -6.908 13.507 1.00 0.00 H new ATOM 0 HB3 ASN A 98 12.386 -5.907 12.735 1.00 0.00 H new ATOM 0 HD21 ASN A 98 12.099 -3.199 15.149 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.289 -3.485 13.416 1.00 0.00 H new ATOM 1477 N SER A 99 10.803 -6.024 9.975 1.00 0.00 N ATOM 1478 CA SER A 99 11.303 -5.858 8.619 1.00 0.00 C ATOM 1479 C SER A 99 10.441 -4.850 7.874 1.00 0.00 C ATOM 1480 O SER A 99 10.922 -4.119 7.010 1.00 0.00 O ATOM 1481 CB SER A 99 11.316 -7.194 7.879 1.00 0.00 C ATOM 1482 OG SER A 99 11.666 -8.257 8.748 1.00 0.00 O ATOM 0 H SER A 99 10.318 -6.905 10.143 1.00 0.00 H new ATOM 0 HA SER A 99 12.327 -5.488 8.667 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.334 -7.383 7.446 1.00 0.00 H new ATOM 0 HB3 SER A 99 12.025 -7.148 7.052 1.00 0.00 H new ATOM 0 HG SER A 99 10.903 -8.865 8.845 1.00 0.00 H new ATOM 1488 N GLU A 100 9.162 -4.807 8.238 1.00 0.00 N ATOM 1489 CA GLU A 100 8.231 -3.854 7.653 1.00 0.00 C ATOM 1490 C GLU A 100 8.514 -2.463 8.189 1.00 0.00 C ATOM 1491 O GLU A 100 8.369 -1.478 7.476 1.00 0.00 O ATOM 1492 CB GLU A 100 6.791 -4.251 7.960 1.00 0.00 C ATOM 1493 CG GLU A 100 6.377 -5.574 7.347 1.00 0.00 C ATOM 1494 CD GLU A 100 6.813 -6.767 8.171 1.00 0.00 C ATOM 1495 OE1 GLU A 100 7.954 -7.236 7.977 1.00 0.00 O ATOM 1496 OE2 GLU A 100 6.007 -7.240 8.999 1.00 0.00 O ATOM 0 H GLU A 100 8.749 -5.424 8.937 1.00 0.00 H new ATOM 0 HA GLU A 100 8.364 -3.856 6.571 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.662 -4.306 9.041 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.123 -3.469 7.598 1.00 0.00 H new ATOM 0 HG2 GLU A 100 5.293 -5.593 7.234 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.803 -5.654 6.347 1.00 0.00 H new ATOM 1503 N LEU A 101 8.946 -2.397 9.443 1.00 0.00 N ATOM 1504 CA LEU A 101 9.287 -1.127 10.070 1.00 0.00 C ATOM 1505 C LEU A 101 10.499 -0.508 9.385 1.00 0.00 C ATOM 1506 O LEU A 101 10.691 0.705 9.415 1.00 0.00 O ATOM 1507 CB LEU A 101 9.568 -1.335 11.564 1.00 0.00 C ATOM 1508 CG LEU A 101 9.760 -0.060 12.401 1.00 0.00 C ATOM 1509 CD1 LEU A 101 11.223 0.362 12.402 1.00 0.00 C ATOM 1510 CD2 LEU A 101 8.875 1.072 11.896 1.00 0.00 C ATOM 0 H LEU A 101 9.068 -3.210 10.046 1.00 0.00 H new ATOM 0 HA LEU A 101 8.443 -0.446 9.964 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.743 -1.905 11.992 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.464 -1.948 11.662 1.00 0.00 H new ATOM 0 HG LEU A 101 9.462 -0.283 13.425 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.340 1.266 12.999 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.832 -0.436 12.828 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.546 0.558 11.380 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.034 1.959 12.509 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.127 1.297 10.860 1.00 0.00 H new ATOM 0 HD23 LEU A 101 7.829 0.771 11.958 1.00 0.00 H new ATOM 1522 N LEU A 102 11.306 -1.354 8.753 1.00 0.00 N ATOM 1523 CA LEU A 102 12.504 -0.900 8.053 1.00 0.00 C ATOM 1524 C LEU A 102 12.198 -0.552 6.606 1.00 0.00 C ATOM 1525 O LEU A 102 12.596 0.502 6.115 1.00 0.00 O ATOM 1526 CB LEU A 102 13.587 -1.981 8.108 1.00 0.00 C ATOM 1527 CG LEU A 102 14.721 -1.711 9.099 1.00 0.00 C ATOM 1528 CD1 LEU A 102 14.283 -2.048 10.516 1.00 0.00 C ATOM 1529 CD2 LEU A 102 15.961 -2.504 8.719 1.00 0.00 C ATOM 0 H LEU A 102 11.152 -2.361 8.711 1.00 0.00 H new ATOM 0 HA LEU A 102 12.863 -0.000 8.552 1.00 0.00 H new ATOM 0 HB2 LEU A 102 13.118 -2.931 8.365 1.00 0.00 H new ATOM 0 HB3 LEU A 102 14.015 -2.096 7.112 1.00 0.00 H new ATOM 0 HG LEU A 102 14.967 -0.650 9.060 1.00 0.00 H new ATOM 0 HD11 LEU A 102 15.102 -1.850 11.207 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.424 -1.435 10.787 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.009 -3.101 10.571 1.00 0.00 H new ATOM 0 HD21 LEU A 102 16.757 -2.300 9.435 1.00 0.00 H new ATOM 0 HD22 LEU A 102 15.729 -3.569 8.729 1.00 0.00 H new ATOM 0 HD23 LEU A 102 16.287 -2.213 7.721 1.00 0.00 H new ATOM 1541 N HIS A 103 11.499 -1.446 5.924 1.00 0.00 N ATOM 1542 CA HIS A 103 11.169 -1.243 4.527 1.00 0.00 C ATOM 1543 C HIS A 103 10.184 -0.089 4.352 1.00 0.00 C ATOM 1544 O HIS A 103 10.283 0.679 3.396 1.00 0.00 O ATOM 1545 CB HIS A 103 10.590 -2.534 3.949 1.00 0.00 C ATOM 1546 CG HIS A 103 11.208 -2.940 2.645 1.00 0.00 C ATOM 1547 ND1 HIS A 103 11.440 -4.260 2.345 1.00 0.00 N ATOM 1548 CD2 HIS A 103 11.624 -2.170 1.609 1.00 0.00 C ATOM 1549 CE1 HIS A 103 11.984 -4.269 1.141 1.00 0.00 C ATOM 1550 NE2 HIS A 103 12.115 -3.024 0.657 1.00 0.00 N ATOM 0 H HIS A 103 11.150 -2.320 6.318 1.00 0.00 H new ATOM 0 HA HIS A 103 12.080 -0.981 3.988 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.726 -3.339 4.672 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.516 -2.410 3.809 1.00 0.00 H new ATOM 0 HD2 HIS A 103 11.577 -1.093 1.547 1.00 0.00 H new ATOM 0 HE1 HIS A 103 12.284 -5.163 0.614 1.00 0.00 H new ATOM 0 HE2 HIS A 103 12.506 -2.763 -0.248 1.00 0.00 H new ATOM 1558 N MET A 104 9.243 0.035 5.284 1.00 0.00 N ATOM 1559 CA MET A 104 8.244 1.100 5.230 1.00 0.00 C ATOM 1560 C MET A 104 8.904 2.477 5.255 1.00 0.00 C ATOM 1561 O MET A 104 8.418 3.416 4.628 1.00 0.00 O ATOM 1562 CB MET A 104 7.263 0.971 6.395 1.00 0.00 C ATOM 1563 CG MET A 104 7.879 1.325 7.734 1.00 0.00 C ATOM 1564 SD MET A 104 6.852 2.450 8.695 1.00 0.00 S ATOM 1565 CE MET A 104 5.257 1.660 8.519 1.00 0.00 C ATOM 0 H MET A 104 9.151 -0.588 6.086 1.00 0.00 H new ATOM 0 HA MET A 104 7.699 0.998 4.292 1.00 0.00 H new ATOM 0 HB2 MET A 104 6.406 1.619 6.214 1.00 0.00 H new ATOM 0 HB3 MET A 104 6.887 -0.051 6.434 1.00 0.00 H new ATOM 0 HG2 MET A 104 8.044 0.412 8.306 1.00 0.00 H new ATOM 0 HG3 MET A 104 8.856 1.781 7.571 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.552 2.103 9.222 1.00 0.00 H new ATOM 0 HE2 MET A 104 4.892 1.800 7.502 1.00 0.00 H new ATOM 0 HE3 MET A 104 5.354 0.594 8.726 1.00 0.00 H new ATOM 1575 N LEU A 105 10.003 2.597 5.999 1.00 0.00 N ATOM 1576 CA LEU A 105 10.735 3.856 6.080 1.00 0.00 C ATOM 1577 C LEU A 105 11.739 3.948 4.947 1.00 0.00 C ATOM 1578 O LEU A 105 12.339 4.997 4.713 1.00 0.00 O ATOM 1579 CB LEU A 105 11.482 3.969 7.413 1.00 0.00 C ATOM 1580 CG LEU A 105 10.693 3.545 8.650 1.00 0.00 C ATOM 1581 CD1 LEU A 105 11.606 3.493 9.866 1.00 0.00 C ATOM 1582 CD2 LEU A 105 9.540 4.498 8.893 1.00 0.00 C ATOM 0 H LEU A 105 10.403 1.839 6.552 1.00 0.00 H new ATOM 0 HA LEU A 105 10.013 4.669 6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.386 3.362 7.355 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.800 5.003 7.544 1.00 0.00 H new ATOM 0 HG LEU A 105 10.286 2.548 8.479 1.00 0.00 H new ATOM 0 HD11 LEU A 105 11.030 3.189 10.740 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.406 2.773 9.690 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.037 4.479 10.040 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.987 4.182 9.778 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.927 5.505 9.047 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.875 4.493 8.029 1.00 0.00 H new ATOM 1594 N GLU A 106 11.934 2.828 4.268 1.00 0.00 N ATOM 1595 CA GLU A 106 12.929 2.745 3.218 1.00 0.00 C ATOM 1596 C GLU A 106 12.305 2.739 1.826 1.00 0.00 C ATOM 1597 O GLU A 106 13.015 2.822 0.824 1.00 0.00 O ATOM 1598 CB GLU A 106 13.763 1.479 3.425 1.00 0.00 C ATOM 1599 CG GLU A 106 14.835 1.637 4.482 1.00 0.00 C ATOM 1600 CD GLU A 106 15.762 2.805 4.212 1.00 0.00 C ATOM 1601 OE1 GLU A 106 16.491 2.761 3.199 1.00 0.00 O ATOM 1602 OE2 GLU A 106 15.760 3.763 5.011 1.00 0.00 O ATOM 0 H GLU A 106 11.414 1.965 4.428 1.00 0.00 H new ATOM 0 HA GLU A 106 13.560 3.632 3.278 1.00 0.00 H new ATOM 0 HB2 GLU A 106 13.103 0.659 3.706 1.00 0.00 H new ATOM 0 HB3 GLU A 106 14.231 1.202 2.481 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.362 1.772 5.455 1.00 0.00 H new ATOM 0 HG3 GLU A 106 15.421 0.720 4.538 1.00 0.00 H new ATOM 1609 N SER A 107 10.982 2.645 1.765 1.00 0.00 N ATOM 1610 CA SER A 107 10.287 2.610 0.480 1.00 0.00 C ATOM 1611 C SER A 107 8.924 3.296 0.559 1.00 0.00 C ATOM 1612 O SER A 107 8.134 3.021 1.462 1.00 0.00 O ATOM 1613 CB SER A 107 10.112 1.164 0.022 1.00 0.00 C ATOM 1614 OG SER A 107 10.179 1.062 -1.390 1.00 0.00 O ATOM 0 H SER A 107 10.372 2.592 2.581 1.00 0.00 H new ATOM 0 HA SER A 107 10.895 3.153 -0.243 1.00 0.00 H new ATOM 0 HB2 SER A 107 10.886 0.541 0.471 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.153 0.783 0.372 1.00 0.00 H new ATOM 0 HG SER A 107 10.066 0.126 -1.656 1.00 0.00 H new ATOM 1620 N PRO A 108 8.622 4.190 -0.404 1.00 0.00 N ATOM 1621 CA PRO A 108 7.342 4.909 -0.444 1.00 0.00 C ATOM 1622 C PRO A 108 6.177 3.995 -0.812 1.00 0.00 C ATOM 1623 O PRO A 108 5.038 4.443 -0.940 1.00 0.00 O ATOM 1624 CB PRO A 108 7.559 5.963 -1.530 1.00 0.00 C ATOM 1625 CG PRO A 108 8.604 5.383 -2.417 1.00 0.00 C ATOM 1626 CD PRO A 108 9.505 4.576 -1.522 1.00 0.00 C ATOM 0 HA PRO A 108 7.079 5.328 0.527 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.639 6.161 -2.079 1.00 0.00 H new ATOM 0 HB3 PRO A 108 7.885 6.911 -1.102 1.00 0.00 H new ATOM 0 HG2 PRO A 108 8.157 4.756 -3.189 1.00 0.00 H new ATOM 0 HG3 PRO A 108 9.162 6.168 -2.928 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.906 3.703 -2.037 1.00 0.00 H new ATOM 0 HD3 PRO A 108 10.357 5.161 -1.177 1.00 0.00 H new ATOM 1634 N GLU A 109 6.474 2.712 -0.984 1.00 0.00 N ATOM 1635 CA GLU A 109 5.458 1.724 -1.330 1.00 0.00 C ATOM 1636 C GLU A 109 5.465 0.574 -0.334 1.00 0.00 C ATOM 1637 O GLU A 109 4.509 -0.195 -0.257 1.00 0.00 O ATOM 1638 CB GLU A 109 5.697 1.190 -2.743 1.00 0.00 C ATOM 1639 CG GLU A 109 5.727 2.276 -3.807 1.00 0.00 C ATOM 1640 CD GLU A 109 5.382 1.749 -5.186 1.00 0.00 C ATOM 1641 OE1 GLU A 109 4.199 1.427 -5.420 1.00 0.00 O ATOM 1642 OE2 GLU A 109 6.297 1.658 -6.033 1.00 0.00 O ATOM 0 H GLU A 109 7.415 2.330 -0.889 1.00 0.00 H new ATOM 0 HA GLU A 109 4.483 2.210 -1.294 1.00 0.00 H new ATOM 0 HB2 GLU A 109 6.642 0.648 -2.762 1.00 0.00 H new ATOM 0 HB3 GLU A 109 4.913 0.473 -2.989 1.00 0.00 H new ATOM 0 HG2 GLU A 109 5.024 3.064 -3.537 1.00 0.00 H new ATOM 0 HG3 GLU A 109 6.719 2.728 -3.832 1.00 0.00 H new ATOM 1649 N SER A 110 6.547 0.462 0.431 1.00 0.00 N ATOM 1650 CA SER A 110 6.649 -0.581 1.441 1.00 0.00 C ATOM 1651 C SER A 110 5.709 -0.296 2.585 1.00 0.00 C ATOM 1652 O SER A 110 4.988 -1.172 3.041 1.00 0.00 O ATOM 1653 CB SER A 110 8.071 -0.694 1.974 1.00 0.00 C ATOM 1654 OG SER A 110 8.628 -1.956 1.658 1.00 0.00 O ATOM 0 H SER A 110 7.359 1.077 0.370 1.00 0.00 H new ATOM 0 HA SER A 110 6.376 -1.525 0.970 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.688 0.097 1.548 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.071 -0.552 3.055 1.00 0.00 H new ATOM 0 HG SER A 110 8.939 -1.953 0.729 1.00 0.00 H new ATOM 1660 N LEU A 111 5.722 0.937 3.043 1.00 0.00 N ATOM 1661 CA LEU A 111 4.859 1.339 4.130 1.00 0.00 C ATOM 1662 C LEU A 111 3.406 1.012 3.821 1.00 0.00 C ATOM 1663 O LEU A 111 2.604 0.796 4.727 1.00 0.00 O ATOM 1664 CB LEU A 111 5.010 2.829 4.379 1.00 0.00 C ATOM 1665 CG LEU A 111 4.256 3.338 5.594 1.00 0.00 C ATOM 1666 CD1 LEU A 111 5.109 4.330 6.356 1.00 0.00 C ATOM 1667 CD2 LEU A 111 2.932 3.953 5.174 1.00 0.00 C ATOM 0 H LEU A 111 6.321 1.678 2.679 1.00 0.00 H new ATOM 0 HA LEU A 111 5.151 0.788 5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.068 3.060 4.499 1.00 0.00 H new ATOM 0 HB3 LEU A 111 4.664 3.370 3.498 1.00 0.00 H new ATOM 0 HG LEU A 111 4.038 2.501 6.257 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.559 4.690 7.226 1.00 0.00 H new ATOM 0 HD12 LEU A 111 6.028 3.844 6.683 1.00 0.00 H new ATOM 0 HD13 LEU A 111 5.354 5.172 5.708 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.402 4.314 6.056 1.00 0.00 H new ATOM 0 HD22 LEU A 111 3.117 4.786 4.496 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.326 3.201 4.669 1.00 0.00 H new ATOM 1679 N ARG A 112 3.075 0.980 2.538 1.00 0.00 N ATOM 1680 CA ARG A 112 1.714 0.698 2.107 1.00 0.00 C ATOM 1681 C ARG A 112 1.487 -0.804 1.925 1.00 0.00 C ATOM 1682 O ARG A 112 0.526 -1.360 2.452 1.00 0.00 O ATOM 1683 CB ARG A 112 1.412 1.451 0.809 1.00 0.00 C ATOM 1684 CG ARG A 112 0.667 0.624 -0.220 1.00 0.00 C ATOM 1685 CD ARG A 112 0.271 1.456 -1.429 1.00 0.00 C ATOM 1686 NE ARG A 112 0.441 0.719 -2.679 1.00 0.00 N ATOM 1687 CZ ARG A 112 -0.191 1.025 -3.808 1.00 0.00 C ATOM 1688 NH1 ARG A 112 -1.032 2.049 -3.847 1.00 0.00 N ATOM 1689 NH2 ARG A 112 0.019 0.304 -4.901 1.00 0.00 N ATOM 0 H ARG A 112 3.732 1.146 1.776 1.00 0.00 H new ATOM 0 HA ARG A 112 1.031 1.041 2.884 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.824 2.338 1.043 1.00 0.00 H new ATOM 0 HB3 ARG A 112 2.350 1.796 0.374 1.00 0.00 H new ATOM 0 HG2 ARG A 112 1.293 -0.209 -0.540 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.226 0.195 0.235 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -0.769 1.767 -1.330 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.874 2.363 -1.458 1.00 0.00 H new ATOM 0 HE ARG A 112 1.081 -0.075 -2.686 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.197 2.606 -3.009 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.514 2.280 -4.715 1.00 0.00 H new ATOM 0 HH21 ARG A 112 0.665 -0.485 -4.875 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.466 0.538 -5.767 1.00 0.00 H new ATOM 1703 N SER A 113 2.362 -1.449 1.159 1.00 0.00 N ATOM 1704 CA SER A 113 2.244 -2.880 0.901 1.00 0.00 C ATOM 1705 C SER A 113 2.413 -3.678 2.189 1.00 0.00 C ATOM 1706 O SER A 113 1.803 -4.733 2.362 1.00 0.00 O ATOM 1707 CB SER A 113 3.284 -3.324 -0.127 1.00 0.00 C ATOM 1708 OG SER A 113 3.212 -4.721 -0.355 1.00 0.00 O ATOM 0 H SER A 113 3.160 -1.003 0.706 1.00 0.00 H new ATOM 0 HA SER A 113 1.248 -3.071 0.502 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.124 -2.791 -1.064 1.00 0.00 H new ATOM 0 HB3 SER A 113 4.282 -3.061 0.224 1.00 0.00 H new ATOM 0 HG SER A 113 3.886 -4.980 -1.017 1.00 0.00 H new ATOM 1714 N LYS A 114 3.261 -3.175 3.078 1.00 0.00 N ATOM 1715 CA LYS A 114 3.502 -3.827 4.357 1.00 0.00 C ATOM 1716 C LYS A 114 2.374 -3.523 5.330 1.00 0.00 C ATOM 1717 O LYS A 114 2.062 -4.336 6.199 1.00 0.00 O ATOM 1718 CB LYS A 114 4.844 -3.389 4.948 1.00 0.00 C ATOM 1719 CG LYS A 114 6.031 -3.698 4.051 1.00 0.00 C ATOM 1720 CD LYS A 114 6.242 -5.196 3.894 1.00 0.00 C ATOM 1721 CE LYS A 114 6.658 -5.556 2.478 1.00 0.00 C ATOM 1722 NZ LYS A 114 8.058 -5.138 2.186 1.00 0.00 N ATOM 0 H LYS A 114 3.793 -2.317 2.935 1.00 0.00 H new ATOM 0 HA LYS A 114 3.537 -4.903 4.187 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.814 -2.317 5.141 1.00 0.00 H new ATOM 0 HB3 LYS A 114 4.987 -3.882 5.909 1.00 0.00 H new ATOM 0 HG2 LYS A 114 5.873 -3.248 3.071 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.930 -3.246 4.469 1.00 0.00 H new ATOM 0 HD2 LYS A 114 7.006 -5.532 4.595 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.322 -5.722 4.149 1.00 0.00 H new ATOM 0 HE2 LYS A 114 6.563 -6.632 2.335 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.982 -5.079 1.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 8.390 -5.614 1.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 8.091 -4.108 2.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 8.672 -5.400 2.984 1.00 0.00 H new ATOM 1736 N VAL A 115 1.761 -2.350 5.183 1.00 0.00 N ATOM 1737 CA VAL A 115 0.634 -1.988 6.034 1.00 0.00 C ATOM 1738 C VAL A 115 -0.567 -2.856 5.673 1.00 0.00 C ATOM 1739 O VAL A 115 -1.157 -3.505 6.536 1.00 0.00 O ATOM 1740 CB VAL A 115 0.274 -0.484 5.925 1.00 0.00 C ATOM 1741 CG1 VAL A 115 -1.234 -0.273 5.864 1.00 0.00 C ATOM 1742 CG2 VAL A 115 0.860 0.285 7.095 1.00 0.00 C ATOM 0 H VAL A 115 2.022 -1.645 4.493 1.00 0.00 H new ATOM 0 HA VAL A 115 0.921 -2.166 7.070 1.00 0.00 H new ATOM 0 HB VAL A 115 0.704 -0.107 4.997 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -1.449 0.793 5.788 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.638 -0.788 4.993 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.694 -0.673 6.768 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.599 1.339 7.005 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.458 -0.110 8.028 1.00 0.00 H new ATOM 0 HG23 VAL A 115 1.945 0.178 7.094 1.00 0.00 H new ATOM 1752 N ASP A 116 -0.877 -2.911 4.380 1.00 0.00 N ATOM 1753 CA ASP A 116 -1.970 -3.739 3.885 1.00 0.00 C ATOM 1754 C ASP A 116 -1.755 -5.196 4.281 1.00 0.00 C ATOM 1755 O ASP A 116 -2.697 -5.898 4.649 1.00 0.00 O ATOM 1756 CB ASP A 116 -2.072 -3.621 2.362 1.00 0.00 C ATOM 1757 CG ASP A 116 -3.455 -3.959 1.843 1.00 0.00 C ATOM 1758 OD1 ASP A 116 -3.839 -5.146 1.905 1.00 0.00 O ATOM 1759 OD2 ASP A 116 -4.155 -3.038 1.374 1.00 0.00 O ATOM 0 H ASP A 116 -0.384 -2.390 3.655 1.00 0.00 H new ATOM 0 HA ASP A 116 -2.900 -3.389 4.332 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -1.813 -2.606 2.062 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -1.342 -4.286 1.900 1.00 0.00 H new ATOM 1764 N GLU A 117 -0.502 -5.640 4.215 1.00 0.00 N ATOM 1765 CA GLU A 117 -0.153 -7.000 4.602 1.00 0.00 C ATOM 1766 C GLU A 117 -0.212 -7.138 6.115 1.00 0.00 C ATOM 1767 O GLU A 117 -0.503 -8.212 6.642 1.00 0.00 O ATOM 1768 CB GLU A 117 1.245 -7.363 4.095 1.00 0.00 C ATOM 1769 CG GLU A 117 1.262 -7.861 2.659 1.00 0.00 C ATOM 1770 CD GLU A 117 1.471 -9.359 2.563 1.00 0.00 C ATOM 1771 OE1 GLU A 117 2.461 -9.859 3.138 1.00 0.00 O ATOM 1772 OE2 GLU A 117 0.646 -10.033 1.911 1.00 0.00 O ATOM 0 H GLU A 117 0.286 -5.076 3.897 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.871 -7.685 4.152 1.00 0.00 H new ATOM 0 HB2 GLU A 117 1.890 -6.488 4.175 1.00 0.00 H new ATOM 0 HB3 GLU A 117 1.669 -8.131 4.742 1.00 0.00 H new ATOM 0 HG2 GLU A 117 0.321 -7.598 2.176 1.00 0.00 H new ATOM 0 HG3 GLU A 117 2.055 -7.352 2.111 1.00 0.00 H new ATOM 1779 N ALA A 118 0.052 -6.035 6.811 1.00 0.00 N ATOM 1780 CA ALA A 118 -0.014 -6.026 8.263 1.00 0.00 C ATOM 1781 C ALA A 118 -1.462 -6.108 8.714 1.00 0.00 C ATOM 1782 O ALA A 118 -1.751 -6.550 9.823 1.00 0.00 O ATOM 1783 CB ALA A 118 0.661 -4.791 8.837 1.00 0.00 C ATOM 0 H ALA A 118 0.312 -5.142 6.392 1.00 0.00 H new ATOM 0 HA ALA A 118 0.523 -6.897 8.639 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.595 -4.813 9.925 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.709 -4.776 8.537 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.164 -3.897 8.461 1.00 0.00 H new ATOM 1789 N VAL A 119 -2.370 -5.699 7.834 1.00 0.00 N ATOM 1790 CA VAL A 119 -3.791 -5.793 8.115 1.00 0.00 C ATOM 1791 C VAL A 119 -4.192 -7.244 8.229 1.00 0.00 C ATOM 1792 O VAL A 119 -4.861 -7.648 9.175 1.00 0.00 O ATOM 1793 CB VAL A 119 -4.638 -5.141 7.025 1.00 0.00 C ATOM 1794 CG1 VAL A 119 -6.085 -5.077 7.479 1.00 0.00 C ATOM 1795 CG2 VAL A 119 -4.094 -3.765 6.686 1.00 0.00 C ATOM 0 H VAL A 119 -2.144 -5.300 6.923 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.969 -5.265 9.052 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.592 -5.741 6.116 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.690 -4.612 6.701 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.452 -6.086 7.669 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.154 -4.488 8.393 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.708 -3.313 5.907 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.115 -3.136 7.576 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.068 -3.857 6.331 1.00 0.00 H new ATOM 1805 N ALA A 120 -3.767 -8.025 7.248 1.00 0.00 N ATOM 1806 CA ALA A 120 -4.026 -9.449 7.243 1.00 0.00 C ATOM 1807 C ALA A 120 -3.445 -10.077 8.503 1.00 0.00 C ATOM 1808 O ALA A 120 -3.933 -11.097 8.996 1.00 0.00 O ATOM 1809 CB ALA A 120 -3.414 -10.073 6.000 1.00 0.00 C ATOM 0 H ALA A 120 -3.238 -7.690 6.442 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.101 -9.629 7.229 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.610 -11.145 5.997 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.855 -9.621 5.111 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.338 -9.901 5.999 1.00 0.00 H new ATOM 1815 N VAL A 121 -2.412 -9.429 9.031 1.00 0.00 N ATOM 1816 CA VAL A 121 -1.741 -9.879 10.238 1.00 0.00 C ATOM 1817 C VAL A 121 -2.466 -9.371 11.483 1.00 0.00 C ATOM 1818 O VAL A 121 -2.464 -10.025 12.526 1.00 0.00 O ATOM 1819 CB VAL A 121 -0.276 -9.396 10.246 1.00 0.00 C ATOM 1820 CG1 VAL A 121 0.306 -9.418 11.647 1.00 0.00 C ATOM 1821 CG2 VAL A 121 0.562 -10.241 9.299 1.00 0.00 C ATOM 0 H VAL A 121 -2.019 -8.577 8.631 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.756 -10.969 10.250 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.258 -8.362 9.900 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.339 -9.072 11.617 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.278 -8.763 12.294 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.275 -10.435 12.038 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.594 -9.890 9.314 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.529 -11.283 9.616 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.165 -10.156 8.288 1.00 0.00 H new ATOM 1831 N LEU A 122 -3.091 -8.205 11.361 1.00 0.00 N ATOM 1832 CA LEU A 122 -3.841 -7.617 12.465 1.00 0.00 C ATOM 1833 C LEU A 122 -5.161 -8.358 12.645 1.00 0.00 C ATOM 1834 O LEU A 122 -5.596 -8.615 13.767 1.00 0.00 O ATOM 1835 CB LEU A 122 -4.079 -6.120 12.210 1.00 0.00 C ATOM 1836 CG LEU A 122 -5.544 -5.681 12.124 1.00 0.00 C ATOM 1837 CD1 LEU A 122 -5.931 -4.903 13.370 1.00 0.00 C ATOM 1838 CD2 LEU A 122 -5.779 -4.845 10.878 1.00 0.00 C ATOM 0 H LEU A 122 -3.093 -7.647 10.507 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.263 -7.714 13.384 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.596 -5.554 13.007 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.583 -5.846 11.279 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.171 -6.570 12.060 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -6.974 -4.596 13.298 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -5.798 -5.534 14.249 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.298 -4.020 13.459 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.825 -4.543 10.835 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.146 -3.958 10.910 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.534 -5.433 9.994 1.00 0.00 H new ATOM 1850 N GLN A 123 -5.782 -8.714 11.525 1.00 0.00 N ATOM 1851 CA GLN A 123 -7.037 -9.451 11.537 1.00 0.00 C ATOM 1852 C GLN A 123 -6.824 -10.842 12.126 1.00 0.00 C ATOM 1853 O GLN A 123 -7.716 -11.406 12.762 1.00 0.00 O ATOM 1854 CB GLN A 123 -7.594 -9.558 10.114 1.00 0.00 C ATOM 1855 CG GLN A 123 -8.146 -8.249 9.573 1.00 0.00 C ATOM 1856 CD GLN A 123 -9.632 -8.319 9.281 1.00 0.00 C ATOM 1857 OE1 GLN A 123 -10.458 -7.928 10.108 1.00 0.00 O ATOM 1858 NE2 GLN A 123 -9.980 -8.817 8.101 1.00 0.00 N ATOM 0 H GLN A 123 -5.431 -8.501 10.591 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.756 -8.916 12.158 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -6.805 -9.911 9.450 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.384 -10.309 10.098 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.958 -7.454 10.295 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -7.612 -7.983 8.660 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -9.262 -9.129 7.447 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -10.966 -8.888 7.848 1.00 0.00 H new ATOM 1867 N ALA A 124 -5.624 -11.377 11.921 1.00 0.00 N ATOM 1868 CA ALA A 124 -5.262 -12.693 12.437 1.00 0.00 C ATOM 1869 C ALA A 124 -4.911 -12.626 13.917 1.00 0.00 C ATOM 1870 O ALA A 124 -5.401 -13.413 14.713 1.00 0.00 O ATOM 1871 CB ALA A 124 -4.096 -13.259 11.641 1.00 0.00 C ATOM 0 H ALA A 124 -4.881 -10.915 11.397 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.123 -13.352 12.328 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.831 -14.241 12.032 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.381 -13.350 10.593 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.239 -12.591 11.727 1.00 0.00 H new ATOM 1877 N HIS A 125 -4.064 -11.686 14.293 1.00 0.00 N ATOM 1878 CA HIS A 125 -3.651 -11.575 15.682 1.00 0.00 C ATOM 1879 C HIS A 125 -4.808 -11.143 16.578 1.00 0.00 C ATOM 1880 O HIS A 125 -4.787 -11.378 17.786 1.00 0.00 O ATOM 1881 CB HIS A 125 -2.491 -10.583 15.812 1.00 0.00 C ATOM 1882 CG HIS A 125 -1.487 -10.961 16.856 1.00 0.00 C ATOM 1883 ND1 HIS A 125 -1.504 -10.391 18.106 1.00 0.00 N ATOM 1884 CD2 HIS A 125 -0.459 -11.843 16.783 1.00 0.00 C ATOM 1885 CE1 HIS A 125 -0.497 -10.936 18.766 1.00 0.00 C ATOM 1886 NE2 HIS A 125 0.163 -11.820 18.004 1.00 0.00 N ATOM 0 H HIS A 125 -3.652 -10.995 13.666 1.00 0.00 H new ATOM 0 HA HIS A 125 -3.322 -12.561 16.009 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -1.987 -10.500 14.849 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -2.893 -9.597 16.047 1.00 0.00 H new ATOM 0 HD1 HIS A 125 -2.159 -9.691 18.453 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -0.184 -12.445 15.930 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -0.239 -10.700 19.788 1.00 0.00 H new ATOM 1894 N GLN A 126 -5.812 -10.509 15.985 1.00 0.00 N ATOM 1895 CA GLN A 126 -6.971 -10.049 16.741 1.00 0.00 C ATOM 1896 C GLN A 126 -8.034 -11.139 16.843 1.00 0.00 C ATOM 1897 O GLN A 126 -8.599 -11.368 17.912 1.00 0.00 O ATOM 1898 CB GLN A 126 -7.569 -8.798 16.092 1.00 0.00 C ATOM 1899 CG GLN A 126 -6.789 -7.527 16.388 1.00 0.00 C ATOM 1900 CD GLN A 126 -7.498 -6.621 17.376 1.00 0.00 C ATOM 1901 OE1 GLN A 126 -8.691 -6.778 17.636 1.00 0.00 O ATOM 1902 NE2 GLN A 126 -6.765 -5.666 17.934 1.00 0.00 N ATOM 0 H GLN A 126 -5.848 -10.302 14.987 1.00 0.00 H new ATOM 0 HA GLN A 126 -6.634 -9.804 17.748 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -7.613 -8.944 15.013 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -8.595 -8.674 16.439 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -5.808 -7.791 16.783 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -6.622 -6.983 15.458 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.779 -5.571 17.690 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -7.187 -5.027 18.607 1.00 0.00 H new ATOM 1911 N ALA A 127 -8.309 -11.802 15.723 1.00 0.00 N ATOM 1912 CA ALA A 127 -9.320 -12.852 15.685 1.00 0.00 C ATOM 1913 C ALA A 127 -8.706 -14.237 15.869 1.00 0.00 C ATOM 1914 O ALA A 127 -9.231 -15.062 16.618 1.00 0.00 O ATOM 1915 CB ALA A 127 -10.096 -12.787 14.378 1.00 0.00 C ATOM 0 H ALA A 127 -7.846 -11.630 14.831 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.004 -12.683 16.517 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -10.848 -13.576 14.362 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.586 -11.817 14.294 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -9.411 -12.921 13.541 1.00 0.00 H new ATOM 1921 N LYS A 128 -7.606 -14.497 15.168 1.00 0.00 N ATOM 1922 CA LYS A 128 -6.942 -15.789 15.244 1.00 0.00 C ATOM 1923 C LYS A 128 -5.796 -15.766 16.248 1.00 0.00 C ATOM 1924 O LYS A 128 -5.548 -14.764 16.919 1.00 0.00 O ATOM 1925 CB LYS A 128 -6.428 -16.207 13.854 1.00 0.00 C ATOM 1926 CG LYS A 128 -4.941 -15.982 13.624 1.00 0.00 C ATOM 1927 CD LYS A 128 -4.371 -16.986 12.633 1.00 0.00 C ATOM 1928 CE LYS A 128 -4.851 -16.710 11.218 1.00 0.00 C ATOM 1929 NZ LYS A 128 -5.081 -17.968 10.454 1.00 0.00 N ATOM 0 H LYS A 128 -7.158 -13.828 14.542 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.672 -16.522 15.587 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -6.648 -17.264 13.705 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -6.985 -15.656 13.096 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -4.778 -14.970 13.252 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -4.409 -16.063 14.572 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.282 -16.949 12.662 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -4.663 -17.994 12.927 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -5.775 -16.133 11.254 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -4.114 -16.099 10.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -5.408 -17.736 9.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -4.193 -18.507 10.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -5.803 -18.540 10.937 1.00 0.00 H new ATOM 1943 N GLU A 129 -5.169 -16.916 16.390 1.00 0.00 N ATOM 1944 CA GLU A 129 -4.013 -17.075 17.262 1.00 0.00 C ATOM 1945 C GLU A 129 -2.732 -16.795 16.488 1.00 0.00 C ATOM 1946 O GLU A 129 -1.777 -17.572 16.543 1.00 0.00 O ATOM 1947 CB GLU A 129 -3.978 -18.490 17.846 1.00 0.00 C ATOM 1948 CG GLU A 129 -3.506 -18.542 19.290 1.00 0.00 C ATOM 1949 CD GLU A 129 -4.196 -19.632 20.088 1.00 0.00 C ATOM 1950 OE1 GLU A 129 -5.374 -19.443 20.456 1.00 0.00 O ATOM 1951 OE2 GLU A 129 -3.560 -20.677 20.339 1.00 0.00 O ATOM 0 H GLU A 129 -5.444 -17.770 15.905 1.00 0.00 H new ATOM 0 HA GLU A 129 -4.093 -16.362 18.082 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -4.976 -18.925 17.783 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -3.321 -19.110 17.235 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -2.429 -18.707 19.311 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -3.690 -17.578 19.764 1.00 0.00 H new ATOM 1958 N ALA A 130 -2.730 -15.698 15.741 1.00 0.00 N ATOM 1959 CA ALA A 130 -1.589 -15.346 14.906 1.00 0.00 C ATOM 1960 C ALA A 130 -0.310 -15.203 15.729 1.00 0.00 C ATOM 1961 O ALA A 130 0.790 -15.183 15.179 1.00 0.00 O ATOM 1962 CB ALA A 130 -1.871 -14.061 14.143 1.00 0.00 C ATOM 0 H ALA A 130 -3.506 -15.037 15.696 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.436 -16.158 14.195 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -1.010 -13.810 13.523 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -2.747 -14.199 13.509 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -2.058 -13.252 14.849 1.00 0.00 H new ATOM 1968 N ALA A 131 -0.463 -15.101 17.047 1.00 0.00 N ATOM 1969 CA ALA A 131 0.680 -14.952 17.939 1.00 0.00 C ATOM 1970 C ALA A 131 1.563 -16.198 17.921 1.00 0.00 C ATOM 1971 O ALA A 131 2.509 -16.288 17.138 1.00 0.00 O ATOM 1972 CB ALA A 131 0.209 -14.651 19.354 1.00 0.00 C ATOM 0 H ALA A 131 -1.367 -15.119 17.519 1.00 0.00 H new ATOM 0 HA ALA A 131 1.280 -14.114 17.583 1.00 0.00 H new ATOM 0 HB1 ALA A 131 1.073 -14.542 20.010 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -0.367 -13.726 19.357 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -0.417 -15.469 19.711 1.00 0.00 H new ATOM 1978 N GLN A 132 1.251 -17.155 18.792 1.00 0.00 N ATOM 1979 CA GLN A 132 2.022 -18.389 18.878 1.00 0.00 C ATOM 1980 C GLN A 132 1.684 -19.326 17.724 1.00 0.00 C ATOM 1981 O GLN A 132 0.518 -19.638 17.485 1.00 0.00 O ATOM 1982 CB GLN A 132 1.756 -19.087 20.213 1.00 0.00 C ATOM 1983 CG GLN A 132 2.480 -18.449 21.386 1.00 0.00 C ATOM 1984 CD GLN A 132 1.588 -18.270 22.598 1.00 0.00 C ATOM 1985 OE1 GLN A 132 1.696 -19.008 23.577 1.00 0.00 O ATOM 1986 NE2 GLN A 132 0.702 -17.283 22.541 1.00 0.00 N ATOM 0 H GLN A 132 0.471 -17.098 19.446 1.00 0.00 H new ATOM 0 HA GLN A 132 3.079 -18.132 18.813 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.684 -19.079 20.410 1.00 0.00 H new ATOM 0 HB3 GLN A 132 2.058 -20.131 20.134 1.00 0.00 H new ATOM 0 HG2 GLN A 132 3.336 -19.066 21.658 1.00 0.00 H new ATOM 0 HG3 GLN A 132 2.871 -17.478 21.082 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.646 -16.695 21.709 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.077 -17.113 23.329 1.00 0.00 H new ATOM 1995 N LYS A 133 2.714 -19.772 17.010 1.00 0.00 N ATOM 1996 CA LYS A 133 2.528 -20.676 15.882 1.00 0.00 C ATOM 1997 C LYS A 133 2.357 -22.114 16.361 1.00 0.00 C ATOM 1998 O LYS A 133 1.462 -22.827 15.906 1.00 0.00 O ATOM 1999 CB LYS A 133 3.716 -20.583 14.924 1.00 0.00 C ATOM 2000 CG LYS A 133 3.355 -20.880 13.478 1.00 0.00 C ATOM 2001 CD LYS A 133 3.941 -22.205 13.018 1.00 0.00 C ATOM 2002 CE LYS A 133 4.170 -22.222 11.516 1.00 0.00 C ATOM 2003 NZ LYS A 133 5.203 -23.218 11.122 1.00 0.00 N ATOM 0 H LYS A 133 3.686 -19.521 17.194 1.00 0.00 H new ATOM 0 HA LYS A 133 1.622 -20.377 15.355 1.00 0.00 H new ATOM 0 HB2 LYS A 133 4.144 -19.582 14.985 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.489 -21.280 15.248 1.00 0.00 H new ATOM 0 HG2 LYS A 133 2.271 -20.904 13.370 1.00 0.00 H new ATOM 0 HG3 LYS A 133 3.722 -20.077 12.838 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.885 -22.385 13.533 1.00 0.00 H new ATOM 0 HD3 LYS A 133 3.268 -23.017 13.294 1.00 0.00 H new ATOM 0 HE2 LYS A 133 3.233 -22.451 11.009 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.477 -21.230 11.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.329 -23.198 10.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.104 -22.985 11.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 4.899 -24.168 11.415 1.00 0.00 H new ATOM 2017 N ALA A 134 3.218 -22.531 17.282 1.00 0.00 N ATOM 2018 CA ALA A 134 3.160 -23.881 17.829 1.00 0.00 C ATOM 2019 C ALA A 134 2.067 -23.996 18.886 1.00 0.00 C ATOM 2020 O ALA A 134 2.182 -23.434 19.975 1.00 0.00 O ATOM 2021 CB ALA A 134 4.508 -24.274 18.414 1.00 0.00 C ATOM 0 H ALA A 134 3.965 -21.953 17.666 1.00 0.00 H new ATOM 0 HA ALA A 134 2.918 -24.566 17.016 1.00 0.00 H new ATOM 0 HB1 ALA A 134 4.448 -25.284 18.818 1.00 0.00 H new ATOM 0 HB2 ALA A 134 5.267 -24.240 17.633 1.00 0.00 H new ATOM 0 HB3 ALA A 134 4.775 -23.580 19.211 1.00 0.00 H new ATOM 2027 N VAL A 135 1.005 -24.725 18.554 1.00 0.00 N ATOM 2028 CA VAL A 135 -0.111 -24.910 19.476 1.00 0.00 C ATOM 2029 C VAL A 135 -0.083 -26.298 20.105 1.00 0.00 C ATOM 2030 O VAL A 135 0.528 -27.223 19.568 1.00 0.00 O ATOM 2031 CB VAL A 135 -1.467 -24.704 18.774 1.00 0.00 C ATOM 2032 CG1 VAL A 135 -1.811 -23.224 18.700 1.00 0.00 C ATOM 2033 CG2 VAL A 135 -1.455 -25.325 17.386 1.00 0.00 C ATOM 0 H VAL A 135 0.894 -25.196 17.656 1.00 0.00 H new ATOM 0 HA VAL A 135 0.001 -24.158 20.257 1.00 0.00 H new ATOM 0 HB VAL A 135 -2.236 -25.205 19.362 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -2.772 -23.098 18.201 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -1.869 -22.813 19.708 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -1.039 -22.699 18.138 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -2.422 -25.168 16.909 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -0.674 -24.859 16.786 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -1.260 -26.394 17.468 1.00 0.00 H new ATOM 2043 N ASN A 136 -0.750 -26.435 21.246 1.00 0.00 N ATOM 2044 CA ASN A 136 -0.808 -27.709 21.954 1.00 0.00 C ATOM 2045 C ASN A 136 -1.969 -28.560 21.448 1.00 0.00 C ATOM 2046 O ASN A 136 -2.446 -28.370 20.328 1.00 0.00 O ATOM 2047 CB ASN A 136 -0.949 -27.469 23.459 1.00 0.00 C ATOM 2048 CG ASN A 136 0.388 -27.470 24.173 1.00 0.00 C ATOM 2049 OD1 ASN A 136 1.195 -26.555 24.005 1.00 0.00 O ATOM 2050 ND2 ASN A 136 0.629 -28.497 24.978 1.00 0.00 N ATOM 0 H ASN A 136 -1.259 -25.677 21.701 1.00 0.00 H new ATOM 0 HA ASN A 136 0.120 -28.248 21.764 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -1.446 -26.514 23.627 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -1.588 -28.241 23.889 1.00 0.00 H new ATOM 0 HD21 ASN A 136 1.511 -28.550 25.487 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -0.068 -29.234 25.088 1.00 0.00 H new ATOM 2057 N SER A 137 -2.419 -29.499 22.276 1.00 0.00 N ATOM 2058 CA SER A 137 -3.525 -30.376 21.909 1.00 0.00 C ATOM 2059 C SER A 137 -4.867 -29.697 22.161 1.00 0.00 C ATOM 2060 O SER A 137 -5.697 -30.196 22.922 1.00 0.00 O ATOM 2061 CB SER A 137 -3.445 -31.684 22.700 1.00 0.00 C ATOM 2062 OG SER A 137 -2.471 -31.602 23.726 1.00 0.00 O ATOM 0 H SER A 137 -2.034 -29.671 23.205 1.00 0.00 H new ATOM 0 HA SER A 137 -3.446 -30.595 20.844 1.00 0.00 H new ATOM 0 HB2 SER A 137 -4.418 -31.909 23.136 1.00 0.00 H new ATOM 0 HB3 SER A 137 -3.200 -32.505 22.027 1.00 0.00 H new ATOM 0 HG SER A 137 -2.441 -32.450 24.217 1.00 0.00 H new ATOM 2068 N ALA A 138 -5.074 -28.552 21.517 1.00 0.00 N ATOM 2069 CA ALA A 138 -6.315 -27.801 21.670 1.00 0.00 C ATOM 2070 C ALA A 138 -7.436 -28.421 20.844 1.00 0.00 C ATOM 2071 O ALA A 138 -7.271 -29.492 20.259 1.00 0.00 O ATOM 2072 CB ALA A 138 -6.107 -26.348 21.274 1.00 0.00 C ATOM 0 H ALA A 138 -4.398 -28.124 20.884 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.607 -27.840 22.719 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -7.042 -25.801 21.394 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.342 -25.903 21.911 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -5.787 -26.297 20.233 1.00 0.00 H new ATOM 2078 N THR A 139 -8.577 -27.740 20.799 1.00 0.00 N ATOM 2079 CA THR A 139 -9.727 -28.222 20.045 1.00 0.00 C ATOM 2080 C THR A 139 -9.926 -27.402 18.775 1.00 0.00 C ATOM 2081 O THR A 139 -10.477 -26.301 18.814 1.00 0.00 O ATOM 2082 CB THR A 139 -10.989 -28.162 20.908 1.00 0.00 C ATOM 2083 OG1 THR A 139 -10.861 -27.173 21.914 1.00 0.00 O ATOM 2084 CG2 THR A 139 -11.308 -29.474 21.591 1.00 0.00 C ATOM 0 H THR A 139 -8.729 -26.852 21.277 1.00 0.00 H new ATOM 0 HA THR A 139 -9.538 -29.257 19.762 1.00 0.00 H new ATOM 0 HB THR A 139 -11.800 -27.922 20.220 1.00 0.00 H new ATOM 0 HG1 THR A 139 -11.678 -27.148 22.454 1.00 0.00 H new ATOM 0 HG21 THR A 139 -12.214 -29.363 22.187 1.00 0.00 H new ATOM 0 HG22 THR A 139 -11.461 -30.248 20.839 1.00 0.00 H new ATOM 0 HG23 THR A 139 -10.479 -29.757 22.240 1.00 0.00 H new ATOM 2092 N GLY A 140 -9.474 -27.946 17.649 1.00 0.00 N ATOM 2093 CA GLY A 140 -9.612 -27.255 16.381 1.00 0.00 C ATOM 2094 C GLY A 140 -10.776 -27.776 15.562 1.00 0.00 C ATOM 2095 O GLY A 140 -11.513 -26.999 14.954 1.00 0.00 O ATOM 0 H GLY A 140 -9.014 -28.855 17.593 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -9.749 -26.189 16.564 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -8.691 -27.365 15.809 1.00 0.00 H new ATOM 2099 N VAL A 141 -10.942 -29.096 15.546 1.00 0.00 N ATOM 2100 CA VAL A 141 -12.026 -29.721 14.795 1.00 0.00 C ATOM 2101 C VAL A 141 -13.170 -30.129 15.721 1.00 0.00 C ATOM 2102 O VAL A 141 -12.940 -30.573 16.846 1.00 0.00 O ATOM 2103 CB VAL A 141 -11.538 -30.962 14.025 1.00 0.00 C ATOM 2104 CG1 VAL A 141 -10.818 -30.552 12.749 1.00 0.00 C ATOM 2105 CG2 VAL A 141 -10.637 -31.819 14.902 1.00 0.00 C ATOM 0 H VAL A 141 -10.340 -29.752 16.044 1.00 0.00 H new ATOM 0 HA VAL A 141 -12.383 -28.979 14.081 1.00 0.00 H new ATOM 0 HB VAL A 141 -12.408 -31.557 13.749 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -10.481 -31.443 12.219 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -11.499 -29.987 12.112 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.958 -29.932 13.000 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -10.303 -32.691 14.339 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -9.771 -31.235 15.214 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -11.190 -32.146 15.782 1.00 0.00 H new ATOM 2115 N PRO A 142 -14.425 -29.983 15.258 1.00 0.00 N ATOM 2116 CA PRO A 142 -15.608 -30.335 16.053 1.00 0.00 C ATOM 2117 C PRO A 142 -15.605 -31.799 16.480 1.00 0.00 C ATOM 2118 O PRO A 142 -14.803 -32.596 15.994 1.00 0.00 O ATOM 2119 CB PRO A 142 -16.781 -30.059 15.105 1.00 0.00 C ATOM 2120 CG PRO A 142 -16.244 -29.106 14.093 1.00 0.00 C ATOM 2121 CD PRO A 142 -14.793 -29.458 13.930 1.00 0.00 C ATOM 0 HA PRO A 142 -15.653 -29.765 16.981 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -17.133 -30.977 14.635 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -17.628 -29.630 15.640 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -16.778 -29.198 13.147 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -16.361 -28.075 14.426 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -14.644 -30.202 13.147 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -14.195 -28.588 13.661 1.00 0.00 H new ATOM 2129 N THR A 143 -16.509 -32.144 17.390 1.00 0.00 N ATOM 2130 CA THR A 143 -16.617 -33.512 17.882 1.00 0.00 C ATOM 2131 C THR A 143 -17.682 -34.284 17.111 1.00 0.00 C ATOM 2132 O THR A 143 -18.730 -33.738 16.767 1.00 0.00 O ATOM 2133 CB THR A 143 -16.952 -33.513 19.374 1.00 0.00 C ATOM 2134 OG1 THR A 143 -16.966 -32.191 19.885 1.00 0.00 O ATOM 2135 CG2 THR A 143 -15.978 -34.317 20.208 1.00 0.00 C ATOM 0 H THR A 143 -17.178 -31.494 17.802 1.00 0.00 H new ATOM 0 HA THR A 143 -15.656 -34.004 17.731 1.00 0.00 H new ATOM 0 HB THR A 143 -17.936 -33.977 19.448 1.00 0.00 H new ATOM 0 HG1 THR A 143 -17.184 -32.212 20.840 1.00 0.00 H new ATOM 0 HG21 THR A 143 -16.275 -34.275 21.256 1.00 0.00 H new ATOM 0 HG22 THR A 143 -15.980 -35.354 19.872 1.00 0.00 H new ATOM 0 HG23 THR A 143 -14.976 -33.902 20.098 1.00 0.00 H new ATOM 2143 N VAL A 144 -17.404 -35.555 16.838 1.00 0.00 N ATOM 2144 CA VAL A 144 -18.339 -36.401 16.106 1.00 0.00 C ATOM 2145 C VAL A 144 -19.597 -36.666 16.925 1.00 0.00 C ATOM 2146 O VAL A 144 -20.604 -37.111 16.335 1.00 0.00 O ATOM 2147 CB VAL A 144 -17.699 -37.748 15.718 1.00 0.00 C ATOM 2148 CG1 VAL A 144 -16.630 -37.546 14.654 1.00 0.00 C ATOM 2149 CG2 VAL A 144 -17.120 -38.439 16.942 1.00 0.00 C ATOM 2150 OXT VAL A 144 -19.565 -36.427 18.151 1.00 0.00 O ATOM 0 H VAL A 144 -16.539 -36.021 17.113 1.00 0.00 H new ATOM 0 HA VAL A 144 -18.606 -35.861 15.197 1.00 0.00 H new ATOM 0 HB VAL A 144 -18.476 -38.390 15.302 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -16.190 -38.508 14.393 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -17.079 -37.100 13.767 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -15.854 -36.884 15.039 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -16.673 -39.388 16.647 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -16.358 -37.803 17.392 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -17.914 -38.622 17.666 1.00 0.00 H new TER 2160 VAL A 144