USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1182 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 44 HIS HE2 : A 44 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 49 HIS HE2 : A 49 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 81 HIS HE2 : A 81 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 85 HIS HE2 : A 85 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 111 HIS HE2 : A 111 HIS NE2 : A 601 ZNZN :(H bumps) USER MOD NoAdj-H: A 115 HIS HE2 : A 115 HIS NE2 : A 601 ZNZN :(H bumps) USER MOD NoAdj-H: A 141 HIS HE2 : A 141 HIS NE2 : A 801 ZNZN :(H bumps) USER MOD NoAdj-H: A 145 HIS HE2 : A 145 HIS NE2 : A 801 ZNZN :(H bumps) USER MOD Set 1.1: A 58 HIS : no HD1:sc= -0.867 X(o=-2.3,f=-2.7) USER MOD Set 1.2: A 75 LYS NZ :NH3+ -164:sc= -1.43 (180deg=-2.11!) USER MOD Single : A 1 GLY N :NH3+ 138:sc= 0.00851 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 LYS NZ :NH3+ -158:sc=-0.00903 (180deg=-0.443) USER MOD Single : A 12 GLN : amide:sc= -3.25 K(o=-3.3,f=-4.8!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -14.7! C(o=-15!,f=-24!) USER MOD Single : A 25 SER OG : rot -120:sc= -2.36 USER MOD Single : A 28 LYS NZ :NH3+ -150:sc= 0 (180deg=-1.22) USER MOD Single : A 29 LYS NZ :NH3+ -166:sc= -0.101 (180deg=-0.504) USER MOD Single : A 30 SER OG : rot 35:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= -0.848 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0798 USER MOD Single : A 38 MET CE :methyl 168:sc= -2.09! (180deg=-2.64!) USER MOD Single : A 39 HIS : no HD1:sc= -0.266 K(o=-0.27,f=-0.81) USER MOD Single : A 43 THR OG1 : rot 75:sc= 0.00736 USER MOD Single : A 46 THR OG1 : rot 96:sc= 1.13 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -2.14 K(o=-2.1,f=-0.87) USER MOD Single : A 56 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.16) USER MOD Single : A 57 ASN : amide:sc= -0.0413 K(o=-0.041,f=-1.3) USER MOD Single : A 61 TYR OH : rot 180:sc= -1.53 USER MOD Single : A 70 LYS NZ :NH3+ -118:sc= -1.4 (180deg=-4!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 30:sc= -0.258 USER MOD Single : A 77 LYS NZ :NH3+ -154:sc= -0.18 (180deg=-0.536) USER MOD Single : A 80 ASN : amide:sc= -0.757 K(o=-0.76,f=-1.9!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -1.09 USER MOD Single : A 89 LYS NZ :NH3+ -153:sc=-0.000275 (180deg=-0.0947) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot -40:sc= 0.132 USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -154:sc= -0.0345 (180deg=-0.522) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -59:sc= 1.07 USER MOD Single : A 119 LYS NZ :NH3+ -170:sc= 0.0127 (180deg=0.00309) USER MOD Single : A 122 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0179) USER MOD Single : A 134 ASN : amide:sc= -10.5! C(o=-10!,f=-20!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 MET CE :methyl -128:sc= -0.438 (180deg=-2.07) USER MOD Single : A 143 HIS : no HD1:sc= -8.46! C(o=-8.5!,f=-9.8!) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0.0125 USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 170:sc= -0.0268 (180deg=-0.198) USER MOD Single : A 150 SER OG : rot 180:sc= -0.659 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.098 15.727 -41.494 1.00 0.00 N ATOM 2 CA GLY A 1 -1.842 15.429 -42.891 1.00 0.00 C ATOM 3 C GLY A 1 -2.779 16.171 -43.824 1.00 0.00 C ATOM 4 O GLY A 1 -3.968 16.311 -43.538 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.043 14.851 -40.936 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.388 16.403 -41.147 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.047 16.141 -41.396 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.812 15.691 -43.132 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.945 14.356 -43.055 1.00 0.00 H new ATOM 8 N SER A 2 -2.243 16.648 -44.942 1.00 0.00 N ATOM 9 CA SER A 2 -3.038 17.385 -45.918 1.00 0.00 C ATOM 10 C SER A 2 -3.209 16.577 -47.200 1.00 0.00 C ATOM 11 O SER A 2 -2.234 16.098 -47.780 1.00 0.00 O ATOM 12 CB SER A 2 -2.380 18.730 -46.232 1.00 0.00 C ATOM 13 OG SER A 2 -3.133 19.454 -47.191 1.00 0.00 O ATOM 0 H SER A 2 -1.261 16.538 -45.195 1.00 0.00 H new ATOM 0 HA SER A 2 -4.024 17.563 -45.488 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.289 19.317 -45.318 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.370 18.566 -46.607 1.00 0.00 H new ATOM 0 HG SER A 2 -2.693 20.310 -47.374 1.00 0.00 H new ATOM 19 N SER A 3 -4.455 16.430 -47.638 1.00 0.00 N ATOM 20 CA SER A 3 -4.756 15.677 -48.850 1.00 0.00 C ATOM 21 C SER A 3 -6.215 15.861 -49.256 1.00 0.00 C ATOM 22 O SER A 3 -7.029 16.359 -48.479 1.00 0.00 O ATOM 23 CB SER A 3 -4.457 14.191 -48.640 1.00 0.00 C ATOM 24 OG SER A 3 -5.237 13.658 -47.584 1.00 0.00 O ATOM 0 H SER A 3 -5.273 16.823 -47.172 1.00 0.00 H new ATOM 0 HA SER A 3 -4.123 16.058 -49.651 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.661 13.642 -49.560 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.398 14.058 -48.417 1.00 0.00 H new ATOM 0 HG SER A 3 -5.029 12.707 -47.471 1.00 0.00 H new ATOM 30 N GLY A 4 -6.538 15.456 -50.480 1.00 0.00 N ATOM 31 CA GLY A 4 -7.899 15.584 -50.970 1.00 0.00 C ATOM 32 C GLY A 4 -8.345 14.374 -51.766 1.00 0.00 C ATOM 33 O GLY A 4 -8.578 14.468 -52.972 1.00 0.00 O ATOM 0 H GLY A 4 -5.882 15.041 -51.142 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.574 15.729 -50.126 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.975 16.474 -51.595 1.00 0.00 H new ATOM 37 N SER A 5 -8.463 13.235 -51.093 1.00 0.00 N ATOM 38 CA SER A 5 -8.879 11.999 -51.747 1.00 0.00 C ATOM 39 C SER A 5 -9.848 11.218 -50.865 1.00 0.00 C ATOM 40 O SER A 5 -9.774 11.277 -49.638 1.00 0.00 O ATOM 41 CB SER A 5 -7.660 11.135 -52.075 1.00 0.00 C ATOM 42 OG SER A 5 -6.833 11.765 -53.038 1.00 0.00 O ATOM 0 H SER A 5 -8.277 13.141 -50.095 1.00 0.00 H new ATOM 0 HA SER A 5 -9.389 12.261 -52.674 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.088 10.948 -51.166 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.988 10.166 -52.451 1.00 0.00 H new ATOM 0 HG SER A 5 -6.060 11.194 -53.229 1.00 0.00 H new ATOM 48 N SER A 6 -10.757 10.485 -51.501 1.00 0.00 N ATOM 49 CA SER A 6 -11.744 9.694 -50.776 1.00 0.00 C ATOM 50 C SER A 6 -11.063 8.727 -49.812 1.00 0.00 C ATOM 51 O SER A 6 -9.842 8.733 -49.669 1.00 0.00 O ATOM 52 CB SER A 6 -12.626 8.917 -51.756 1.00 0.00 C ATOM 53 OG SER A 6 -11.914 7.840 -52.339 1.00 0.00 O ATOM 0 H SER A 6 -10.830 10.423 -52.516 1.00 0.00 H new ATOM 0 HA SER A 6 -12.368 10.377 -50.199 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.505 8.537 -51.236 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.983 9.587 -52.538 1.00 0.00 H new ATOM 0 HG SER A 6 -12.500 7.358 -52.960 1.00 0.00 H new ATOM 59 N GLY A 7 -11.865 7.897 -49.151 1.00 0.00 N ATOM 60 CA GLY A 7 -11.324 6.937 -48.208 1.00 0.00 C ATOM 61 C GLY A 7 -10.789 7.595 -46.952 1.00 0.00 C ATOM 62 O GLY A 7 -9.733 8.226 -46.977 1.00 0.00 O ATOM 0 H GLY A 7 -12.880 7.873 -49.252 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.101 6.222 -47.937 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.524 6.373 -48.688 1.00 0.00 H new ATOM 66 N GLN A 8 -11.520 7.450 -45.851 1.00 0.00 N ATOM 67 CA GLN A 8 -11.114 8.039 -44.581 1.00 0.00 C ATOM 68 C GLN A 8 -10.562 6.973 -43.639 1.00 0.00 C ATOM 69 O GLN A 8 -10.917 5.797 -43.717 1.00 0.00 O ATOM 70 CB GLN A 8 -12.295 8.754 -43.924 1.00 0.00 C ATOM 71 CG GLN A 8 -12.897 9.852 -44.787 1.00 0.00 C ATOM 72 CD GLN A 8 -14.339 10.151 -44.428 1.00 0.00 C ATOM 73 OE1 GLN A 8 -14.620 11.044 -43.627 1.00 0.00 O ATOM 74 NE2 GLN A 8 -15.264 9.405 -45.020 1.00 0.00 N ATOM 0 H GLN A 8 -12.396 6.930 -45.813 1.00 0.00 H new ATOM 0 HA GLN A 8 -10.326 8.765 -44.782 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.068 8.022 -43.690 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -11.968 9.185 -42.978 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -12.304 10.760 -44.679 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.841 9.557 -45.835 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -14.987 8.676 -45.677 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -16.251 9.561 -44.818 1.00 0.00 H new ATOM 83 N PRO A 9 -9.673 7.392 -42.727 1.00 0.00 N ATOM 84 CA PRO A 9 -9.053 6.489 -41.752 1.00 0.00 C ATOM 85 C PRO A 9 -10.046 5.999 -40.703 1.00 0.00 C ATOM 86 O PRO A 9 -11.256 6.167 -40.855 1.00 0.00 O ATOM 87 CB PRO A 9 -7.973 7.356 -41.102 1.00 0.00 C ATOM 88 CG PRO A 9 -8.457 8.755 -41.271 1.00 0.00 C ATOM 89 CD PRO A 9 -9.204 8.780 -42.576 1.00 0.00 C ATOM 0 HA PRO A 9 -8.667 5.585 -42.222 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -7.845 7.106 -40.049 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -7.006 7.211 -41.584 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.105 9.046 -40.445 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -7.624 9.457 -41.285 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -10.035 9.484 -42.550 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -8.559 9.079 -43.403 1.00 0.00 H new ATOM 97 N ILE A 10 -9.526 5.395 -39.640 1.00 0.00 N ATOM 98 CA ILE A 10 -10.368 4.883 -38.566 1.00 0.00 C ATOM 99 C ILE A 10 -10.490 5.896 -37.433 1.00 0.00 C ATOM 100 O ILE A 10 -9.518 6.561 -37.072 1.00 0.00 O ATOM 101 CB ILE A 10 -9.816 3.561 -38.000 1.00 0.00 C ATOM 102 CG1 ILE A 10 -9.472 2.598 -39.138 1.00 0.00 C ATOM 103 CG2 ILE A 10 -10.823 2.930 -37.051 1.00 0.00 C ATOM 104 CD1 ILE A 10 -8.451 1.549 -38.754 1.00 0.00 C ATOM 0 H ILE A 10 -8.526 5.248 -39.499 1.00 0.00 H new ATOM 0 HA ILE A 10 -11.353 4.702 -38.996 1.00 0.00 H new ATOM 0 HB ILE A 10 -8.904 3.774 -37.442 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -10.383 2.102 -39.471 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -9.093 3.170 -39.985 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -10.419 1.997 -36.659 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.023 3.613 -36.226 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -11.750 2.727 -37.587 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -8.255 0.902 -39.609 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -7.525 2.037 -38.449 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -8.836 0.952 -37.927 1.00 0.00 H new ATOM 116 N LYS A 11 -11.690 6.008 -36.873 1.00 0.00 N ATOM 117 CA LYS A 11 -11.940 6.938 -35.778 1.00 0.00 C ATOM 118 C LYS A 11 -11.597 6.302 -34.435 1.00 0.00 C ATOM 119 O LYS A 11 -12.247 5.349 -34.006 1.00 0.00 O ATOM 120 CB LYS A 11 -13.405 7.383 -35.785 1.00 0.00 C ATOM 121 CG LYS A 11 -14.389 6.238 -35.615 1.00 0.00 C ATOM 122 CD LYS A 11 -15.740 6.571 -36.225 1.00 0.00 C ATOM 123 CE LYS A 11 -16.868 5.841 -35.511 1.00 0.00 C ATOM 124 NZ LYS A 11 -16.501 4.434 -35.187 1.00 0.00 N ATOM 0 H LYS A 11 -12.505 5.466 -37.160 1.00 0.00 H new ATOM 0 HA LYS A 11 -11.301 7.809 -35.921 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -13.560 8.106 -34.984 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.616 7.896 -36.723 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -13.988 5.339 -36.084 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -14.512 6.016 -34.555 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -15.910 7.646 -36.172 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -15.741 6.300 -37.281 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -17.120 6.371 -34.593 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -17.760 5.849 -36.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.366 3.871 -35.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -15.942 4.033 -35.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -15.939 4.415 -34.312 1.00 0.00 H new ATOM 138 N GLN A 12 -10.573 6.836 -33.777 1.00 0.00 N ATOM 139 CA GLN A 12 -10.146 6.320 -32.482 1.00 0.00 C ATOM 140 C GLN A 12 -10.459 7.314 -31.369 1.00 0.00 C ATOM 141 O GLN A 12 -10.238 8.515 -31.518 1.00 0.00 O ATOM 142 CB GLN A 12 -8.647 6.013 -32.501 1.00 0.00 C ATOM 143 CG GLN A 12 -8.236 4.926 -31.521 1.00 0.00 C ATOM 144 CD GLN A 12 -8.240 5.404 -30.083 1.00 0.00 C ATOM 145 OE1 GLN A 12 -7.960 6.570 -29.804 1.00 0.00 O ATOM 146 NE2 GLN A 12 -8.559 4.504 -29.160 1.00 0.00 N ATOM 0 H GLN A 12 -10.024 7.625 -34.119 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.696 5.400 -32.287 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.359 5.710 -33.508 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.095 6.925 -32.272 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -8.914 4.078 -31.620 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -7.239 4.569 -31.778 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.784 3.548 -29.436 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -8.579 4.769 -28.175 1.00 0.00 H new ATOM 155 N GLU A 13 -10.975 6.805 -30.255 1.00 0.00 N ATOM 156 CA GLU A 13 -11.320 7.650 -29.117 1.00 0.00 C ATOM 157 C GLU A 13 -10.085 7.960 -28.276 1.00 0.00 C ATOM 158 O GLU A 13 -9.337 7.059 -27.895 1.00 0.00 O ATOM 159 CB GLU A 13 -12.383 6.970 -28.252 1.00 0.00 C ATOM 160 CG GLU A 13 -11.805 6.049 -27.190 1.00 0.00 C ATOM 161 CD GLU A 13 -12.849 5.135 -26.580 1.00 0.00 C ATOM 162 OE1 GLU A 13 -13.092 4.050 -27.149 1.00 0.00 O ATOM 163 OE2 GLU A 13 -13.423 5.503 -25.534 1.00 0.00 O ATOM 0 H GLU A 13 -11.163 5.812 -30.116 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.721 8.588 -29.501 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.989 7.735 -27.767 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.050 6.396 -28.895 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -11.012 5.445 -27.631 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -11.349 6.649 -26.403 1.00 0.00 H new ATOM 170 N LEU A 14 -9.878 9.241 -27.991 1.00 0.00 N ATOM 171 CA LEU A 14 -8.734 9.672 -27.195 1.00 0.00 C ATOM 172 C LEU A 14 -9.176 10.129 -25.809 1.00 0.00 C ATOM 173 O LEU A 14 -10.330 10.508 -25.608 1.00 0.00 O ATOM 174 CB LEU A 14 -7.991 10.806 -27.906 1.00 0.00 C ATOM 175 CG LEU A 14 -7.828 10.656 -29.419 1.00 0.00 C ATOM 176 CD1 LEU A 14 -7.425 11.982 -30.046 1.00 0.00 C ATOM 177 CD2 LEU A 14 -6.802 9.579 -29.740 1.00 0.00 C ATOM 0 H LEU A 14 -10.487 9.999 -28.299 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.062 8.822 -27.080 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.518 11.739 -27.708 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -7.000 10.899 -27.461 1.00 0.00 H new ATOM 0 HG LEU A 14 -8.787 10.354 -29.841 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.314 11.856 -31.123 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.194 12.728 -29.845 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.478 12.313 -29.620 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.699 9.486 -30.821 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -5.840 9.852 -29.306 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.131 8.627 -29.323 1.00 0.00 H new ATOM 189 N SER A 15 -8.250 10.092 -24.856 1.00 0.00 N ATOM 190 CA SER A 15 -8.544 10.501 -23.488 1.00 0.00 C ATOM 191 C SER A 15 -7.571 11.580 -23.022 1.00 0.00 C ATOM 192 O SER A 15 -6.386 11.551 -23.356 1.00 0.00 O ATOM 193 CB SER A 15 -8.476 9.296 -22.547 1.00 0.00 C ATOM 194 OG SER A 15 -9.098 8.162 -23.126 1.00 0.00 O ATOM 0 H SER A 15 -7.290 9.783 -25.006 1.00 0.00 H new ATOM 0 HA SER A 15 -9.553 10.913 -23.467 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.435 9.067 -22.319 1.00 0.00 H new ATOM 0 HB3 SER A 15 -8.963 9.540 -21.603 1.00 0.00 H new ATOM 0 HG SER A 15 -9.040 7.405 -22.506 1.00 0.00 H new ATOM 200 N CYS A 16 -8.081 12.533 -22.248 1.00 0.00 N ATOM 201 CA CYS A 16 -7.259 13.622 -21.735 1.00 0.00 C ATOM 202 C CYS A 16 -7.435 13.772 -20.226 1.00 0.00 C ATOM 203 O CYS A 16 -8.412 14.358 -19.758 1.00 0.00 O ATOM 204 CB CYS A 16 -7.621 14.934 -22.434 1.00 0.00 C ATOM 205 SG CYS A 16 -7.153 16.428 -21.502 1.00 0.00 S ATOM 0 H CYS A 16 -9.059 12.573 -21.963 1.00 0.00 H new ATOM 0 HA CYS A 16 -6.215 13.384 -21.940 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -7.134 14.960 -23.409 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -8.696 14.953 -22.614 1.00 0.00 H new ATOM 210 N LYS A 17 -6.481 13.240 -19.470 1.00 0.00 N ATOM 211 CA LYS A 17 -6.527 13.315 -18.014 1.00 0.00 C ATOM 212 C LYS A 17 -5.745 14.522 -17.506 1.00 0.00 C ATOM 213 O LYS A 17 -4.521 14.474 -17.388 1.00 0.00 O ATOM 214 CB LYS A 17 -5.963 12.032 -17.399 1.00 0.00 C ATOM 215 CG LYS A 17 -6.233 10.789 -18.229 1.00 0.00 C ATOM 216 CD LYS A 17 -7.699 10.683 -18.614 1.00 0.00 C ATOM 217 CE LYS A 17 -8.550 10.217 -17.443 1.00 0.00 C ATOM 218 NZ LYS A 17 -8.625 8.731 -17.369 1.00 0.00 N ATOM 0 H LYS A 17 -5.666 12.752 -19.841 1.00 0.00 H new ATOM 0 HA LYS A 17 -7.569 13.427 -17.714 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.887 12.145 -17.268 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.392 11.896 -16.406 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.620 10.812 -19.130 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.939 9.903 -17.666 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.056 11.652 -18.962 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.809 9.986 -19.445 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -8.134 10.606 -16.514 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -9.555 10.627 -17.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.214 8.453 -16.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.045 8.361 -18.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.668 8.341 -17.252 1.00 0.00 H new ATOM 232 N TRP A 18 -6.460 15.600 -17.206 1.00 0.00 N ATOM 233 CA TRP A 18 -5.831 16.819 -16.709 1.00 0.00 C ATOM 234 C TRP A 18 -6.111 17.008 -15.223 1.00 0.00 C ATOM 235 O TRP A 18 -7.267 17.054 -14.800 1.00 0.00 O ATOM 236 CB TRP A 18 -6.333 18.032 -17.494 1.00 0.00 C ATOM 237 CG TRP A 18 -5.597 19.296 -17.168 1.00 0.00 C ATOM 238 CD1 TRP A 18 -5.554 19.931 -15.959 1.00 0.00 C ATOM 239 CD2 TRP A 18 -4.801 20.080 -18.064 1.00 0.00 C ATOM 240 NE1 TRP A 18 -4.778 21.062 -16.050 1.00 0.00 N ATOM 241 CE2 TRP A 18 -4.304 21.175 -17.330 1.00 0.00 C ATOM 242 CE3 TRP A 18 -4.457 19.961 -19.413 1.00 0.00 C ATOM 243 CZ2 TRP A 18 -3.484 22.144 -17.903 1.00 0.00 C ATOM 244 CZ3 TRP A 18 -3.644 20.924 -19.980 1.00 0.00 C ATOM 245 CH2 TRP A 18 -3.164 22.003 -19.226 1.00 0.00 C ATOM 0 H TRP A 18 -7.474 15.655 -17.298 1.00 0.00 H new ATOM 0 HA TRP A 18 -4.754 16.726 -16.847 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -6.239 17.830 -18.561 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.394 18.175 -17.289 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.056 19.594 -15.064 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.586 21.712 -15.288 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -4.820 19.132 -20.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.114 22.977 -17.324 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -3.374 20.843 -21.023 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -2.529 22.738 -19.698 1.00 0.00 H new ATOM 256 N ILE A 19 -5.047 17.118 -14.434 1.00 0.00 N ATOM 257 CA ILE A 19 -5.180 17.304 -12.995 1.00 0.00 C ATOM 258 C ILE A 19 -4.547 18.618 -12.549 1.00 0.00 C ATOM 259 O ILE A 19 -3.329 18.784 -12.611 1.00 0.00 O ATOM 260 CB ILE A 19 -4.532 16.145 -12.215 1.00 0.00 C ATOM 261 CG1 ILE A 19 -5.092 14.804 -12.694 1.00 0.00 C ATOM 262 CG2 ILE A 19 -4.761 16.317 -10.721 1.00 0.00 C ATOM 263 CD1 ILE A 19 -4.922 13.685 -11.690 1.00 0.00 C ATOM 0 H ILE A 19 -4.084 17.081 -14.768 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.248 17.326 -12.778 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.458 16.157 -12.401 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.152 14.922 -12.919 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -4.598 14.525 -13.625 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.297 15.490 -10.184 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.319 17.257 -10.391 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.831 16.328 -10.516 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.342 12.765 -12.096 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -3.862 13.540 -11.483 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.440 13.943 -10.766 1.00 0.00 H new ATOM 275 N ASP A 20 -5.382 19.548 -12.098 1.00 0.00 N ATOM 276 CA ASP A 20 -4.904 20.847 -11.639 1.00 0.00 C ATOM 277 C ASP A 20 -4.587 20.813 -10.147 1.00 0.00 C ATOM 278 O ASP A 20 -5.371 20.301 -9.349 1.00 0.00 O ATOM 279 CB ASP A 20 -5.946 21.929 -11.928 1.00 0.00 C ATOM 280 CG ASP A 20 -5.607 23.250 -11.266 1.00 0.00 C ATOM 281 OD1 ASP A 20 -4.664 23.923 -11.732 1.00 0.00 O ATOM 282 OD2 ASP A 20 -6.286 23.611 -10.282 1.00 0.00 O ATOM 0 H ASP A 20 -6.393 19.426 -12.041 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.988 21.082 -12.181 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.025 22.075 -13.005 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.922 21.591 -11.580 1.00 0.00 H new ATOM 287 N GLU A 21 -3.433 21.360 -9.780 1.00 0.00 N ATOM 288 CA GLU A 21 -3.013 21.390 -8.384 1.00 0.00 C ATOM 289 C GLU A 21 -3.994 22.195 -7.537 1.00 0.00 C ATOM 290 O GLU A 21 -4.154 21.942 -6.344 1.00 0.00 O ATOM 291 CB GLU A 21 -1.609 21.988 -8.263 1.00 0.00 C ATOM 292 CG GLU A 21 -0.575 21.294 -9.134 1.00 0.00 C ATOM 293 CD GLU A 21 0.181 20.211 -8.390 1.00 0.00 C ATOM 294 OE1 GLU A 21 0.763 20.515 -7.328 1.00 0.00 O ATOM 295 OE2 GLU A 21 0.192 19.058 -8.871 1.00 0.00 O ATOM 0 H GLU A 21 -2.773 21.788 -10.429 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.997 20.365 -8.015 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.648 23.044 -8.532 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.289 21.936 -7.222 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.070 20.856 -10.001 1.00 0.00 H new ATOM 0 HG3 GLU A 21 0.133 22.033 -9.510 1.00 0.00 H new ATOM 302 N ALA A 22 -4.649 23.167 -8.164 1.00 0.00 N ATOM 303 CA ALA A 22 -5.616 24.009 -7.470 1.00 0.00 C ATOM 304 C ALA A 22 -7.042 23.540 -7.736 1.00 0.00 C ATOM 305 O ALA A 22 -7.989 24.320 -7.640 1.00 0.00 O ATOM 306 CB ALA A 22 -5.449 25.461 -7.891 1.00 0.00 C ATOM 0 H ALA A 22 -4.527 23.391 -9.152 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.429 23.929 -6.399 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.177 26.078 -7.365 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.442 25.798 -7.644 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.608 25.549 -8.966 1.00 0.00 H new ATOM 312 N GLN A 23 -7.188 22.262 -8.072 1.00 0.00 N ATOM 313 CA GLN A 23 -8.499 21.691 -8.353 1.00 0.00 C ATOM 314 C GLN A 23 -9.394 21.747 -7.119 1.00 0.00 C ATOM 315 O GLN A 23 -9.021 21.269 -6.047 1.00 0.00 O ATOM 316 CB GLN A 23 -8.357 20.244 -8.829 1.00 0.00 C ATOM 317 CG GLN A 23 -7.529 19.375 -7.897 1.00 0.00 C ATOM 318 CD GLN A 23 -6.767 18.291 -8.633 1.00 0.00 C ATOM 319 OE1 GLN A 23 -5.681 17.887 -8.216 1.00 0.00 O ATOM 320 NE2 GLN A 23 -7.333 17.813 -9.735 1.00 0.00 N ATOM 0 H GLN A 23 -6.414 21.603 -8.156 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.963 22.282 -9.143 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -9.350 19.806 -8.934 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -7.900 20.239 -9.818 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.824 20.003 -7.352 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -8.184 18.915 -7.158 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -8.234 18.177 -10.044 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -6.866 17.082 -10.272 1.00 0.00 H new ATOM 329 N LEU A 24 -10.575 22.333 -7.277 1.00 0.00 N ATOM 330 CA LEU A 24 -11.524 22.453 -6.175 1.00 0.00 C ATOM 331 C LEU A 24 -12.346 21.177 -6.024 1.00 0.00 C ATOM 332 O LEU A 24 -13.348 21.154 -5.310 1.00 0.00 O ATOM 333 CB LEU A 24 -12.451 23.648 -6.402 1.00 0.00 C ATOM 334 CG LEU A 24 -11.932 25.002 -5.917 1.00 0.00 C ATOM 335 CD1 LEU A 24 -12.027 25.099 -4.402 1.00 0.00 C ATOM 336 CD2 LEU A 24 -10.498 25.219 -6.378 1.00 0.00 C ATOM 0 H LEU A 24 -10.899 22.733 -8.158 1.00 0.00 H new ATOM 0 HA LEU A 24 -10.959 22.610 -5.256 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.660 23.723 -7.469 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.400 23.446 -5.905 1.00 0.00 H new ATOM 0 HG LEU A 24 -12.555 25.785 -6.350 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.653 26.069 -4.075 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -13.067 24.989 -4.095 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.429 24.308 -3.949 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.145 26.187 -6.024 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -9.863 24.431 -5.974 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.458 25.194 -7.467 1.00 0.00 H new ATOM 348 N SER A 25 -11.915 20.117 -6.701 1.00 0.00 N ATOM 349 CA SER A 25 -12.612 18.838 -6.643 1.00 0.00 C ATOM 350 C SER A 25 -11.706 17.750 -6.077 1.00 0.00 C ATOM 351 O SER A 25 -10.639 17.469 -6.623 1.00 0.00 O ATOM 352 CB SER A 25 -13.101 18.437 -8.037 1.00 0.00 C ATOM 353 OG SER A 25 -12.420 19.163 -9.045 1.00 0.00 O ATOM 0 H SER A 25 -11.086 20.119 -7.296 1.00 0.00 H new ATOM 0 HA SER A 25 -13.471 18.950 -5.982 1.00 0.00 H new ATOM 0 HB2 SER A 25 -12.946 17.368 -8.187 1.00 0.00 H new ATOM 0 HB3 SER A 25 -14.173 18.618 -8.116 1.00 0.00 H new ATOM 0 HG SER A 25 -13.067 19.679 -9.570 1.00 0.00 H new ATOM 359 N ARG A 26 -12.138 17.142 -4.977 1.00 0.00 N ATOM 360 CA ARG A 26 -11.366 16.085 -4.334 1.00 0.00 C ATOM 361 C ARG A 26 -12.194 14.811 -4.200 1.00 0.00 C ATOM 362 O ARG A 26 -13.415 14.848 -4.044 1.00 0.00 O ATOM 363 CB ARG A 26 -10.886 16.542 -2.956 1.00 0.00 C ATOM 364 CG ARG A 26 -9.670 17.452 -3.004 1.00 0.00 C ATOM 365 CD ARG A 26 -8.377 16.662 -2.877 1.00 0.00 C ATOM 366 NE ARG A 26 -7.327 17.433 -2.218 1.00 0.00 N ATOM 367 CZ ARG A 26 -6.767 18.516 -2.747 1.00 0.00 C ATOM 368 NH1 ARG A 26 -7.156 18.953 -3.937 1.00 0.00 N ATOM 369 NH2 ARG A 26 -5.817 19.164 -2.085 1.00 0.00 N ATOM 0 H ARG A 26 -13.019 17.363 -4.512 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.500 15.870 -4.960 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -11.700 17.064 -2.452 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.649 15.665 -2.354 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -9.667 18.008 -3.942 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.731 18.185 -2.199 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -8.564 15.748 -2.313 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -8.038 16.361 -3.868 1.00 0.00 H new ATOM 0 HE ARG A 26 -7.005 17.123 -1.301 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -7.886 18.458 -4.448 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -6.725 19.784 -4.341 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -5.516 18.831 -1.169 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -5.388 19.995 -2.492 1.00 0.00 H new ATOM 383 N PRO A 27 -11.517 13.655 -4.264 1.00 0.00 N ATOM 384 CA PRO A 27 -10.064 13.598 -4.450 1.00 0.00 C ATOM 385 C PRO A 27 -9.641 14.035 -5.849 1.00 0.00 C ATOM 386 O PRO A 27 -10.363 13.820 -6.822 1.00 0.00 O ATOM 387 CB PRO A 27 -9.735 12.119 -4.230 1.00 0.00 C ATOM 388 CG PRO A 27 -10.996 11.398 -4.563 1.00 0.00 C ATOM 389 CD PRO A 27 -12.117 12.314 -4.158 1.00 0.00 C ATOM 0 HA PRO A 27 -9.540 14.271 -3.771 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -8.914 11.797 -4.870 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -9.431 11.930 -3.201 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.045 11.169 -5.628 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -11.055 10.449 -4.030 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -12.980 12.207 -4.815 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.460 12.106 -3.144 1.00 0.00 H new ATOM 397 N LYS A 28 -8.467 14.650 -5.942 1.00 0.00 N ATOM 398 CA LYS A 28 -7.947 15.117 -7.222 1.00 0.00 C ATOM 399 C LYS A 28 -8.376 14.189 -8.354 1.00 0.00 C ATOM 400 O LYS A 28 -7.877 13.070 -8.477 1.00 0.00 O ATOM 401 CB LYS A 28 -6.420 15.206 -7.172 1.00 0.00 C ATOM 402 CG LYS A 28 -5.901 16.184 -6.132 1.00 0.00 C ATOM 403 CD LYS A 28 -4.442 16.532 -6.372 1.00 0.00 C ATOM 404 CE LYS A 28 -4.126 17.951 -5.927 1.00 0.00 C ATOM 405 NZ LYS A 28 -4.046 18.063 -4.444 1.00 0.00 N ATOM 0 H LYS A 28 -7.857 14.837 -5.146 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.357 16.109 -7.414 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.014 14.217 -6.963 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.049 15.502 -8.153 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -6.501 17.093 -6.155 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.014 15.753 -5.137 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.806 15.830 -5.832 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.210 16.422 -7.431 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.180 18.267 -6.367 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.894 18.628 -6.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.335 19.018 -4.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -4.678 17.362 -4.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.069 17.887 -4.135 1.00 0.00 H new ATOM 419 N LYS A 29 -9.303 14.662 -9.181 1.00 0.00 N ATOM 420 CA LYS A 29 -9.797 13.877 -10.305 1.00 0.00 C ATOM 421 C LYS A 29 -9.222 14.389 -11.622 1.00 0.00 C ATOM 422 O LYS A 29 -8.420 15.323 -11.638 1.00 0.00 O ATOM 423 CB LYS A 29 -11.326 13.923 -10.353 1.00 0.00 C ATOM 424 CG LYS A 29 -11.877 15.171 -11.021 1.00 0.00 C ATOM 425 CD LYS A 29 -11.191 16.426 -10.508 1.00 0.00 C ATOM 426 CE LYS A 29 -11.729 17.674 -11.192 1.00 0.00 C ATOM 427 NZ LYS A 29 -11.737 17.533 -12.675 1.00 0.00 N ATOM 0 H LYS A 29 -9.727 15.586 -9.093 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.474 12.845 -10.164 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.691 13.045 -10.886 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -11.715 13.864 -9.336 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.743 15.097 -12.100 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -12.949 15.240 -10.837 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -11.338 16.508 -9.431 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -10.117 16.351 -10.678 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -12.741 17.873 -10.840 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -11.120 18.533 -10.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -11.880 18.466 -13.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -10.828 17.138 -12.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -12.509 16.896 -12.959 1.00 0.00 H new ATOM 441 N SER A 30 -9.637 13.773 -12.724 1.00 0.00 N ATOM 442 CA SER A 30 -9.160 14.166 -14.045 1.00 0.00 C ATOM 443 C SER A 30 -10.293 14.758 -14.877 1.00 0.00 C ATOM 444 O SER A 30 -11.455 14.380 -14.724 1.00 0.00 O ATOM 445 CB SER A 30 -8.555 12.962 -14.770 1.00 0.00 C ATOM 446 OG SER A 30 -9.347 11.802 -14.583 1.00 0.00 O ATOM 0 H SER A 30 -10.302 13.000 -12.729 1.00 0.00 H new ATOM 0 HA SER A 30 -8.391 14.928 -13.916 1.00 0.00 H new ATOM 0 HB2 SER A 30 -8.470 13.180 -15.835 1.00 0.00 H new ATOM 0 HB3 SER A 30 -7.546 12.780 -14.400 1.00 0.00 H new ATOM 0 HG SER A 30 -10.293 12.055 -14.543 1.00 0.00 H new ATOM 452 N CYS A 31 -9.947 15.690 -15.759 1.00 0.00 N ATOM 453 CA CYS A 31 -10.932 16.337 -16.616 1.00 0.00 C ATOM 454 C CYS A 31 -11.741 15.301 -17.392 1.00 0.00 C ATOM 455 O CYS A 31 -11.319 14.154 -17.542 1.00 0.00 O ATOM 456 CB CYS A 31 -10.243 17.295 -17.588 1.00 0.00 C ATOM 457 SG CYS A 31 -10.015 16.618 -19.264 1.00 0.00 S ATOM 0 H CYS A 31 -8.990 16.014 -15.899 1.00 0.00 H new ATOM 0 HA CYS A 31 -11.613 16.903 -15.981 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -10.829 18.212 -17.655 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -9.269 17.568 -17.183 1.00 0.00 H new ATOM 462 N ASP A 32 -12.904 15.715 -17.884 1.00 0.00 N ATOM 463 CA ASP A 32 -13.771 14.824 -18.646 1.00 0.00 C ATOM 464 C ASP A 32 -13.964 15.340 -20.069 1.00 0.00 C ATOM 465 O ASP A 32 -14.498 16.430 -20.278 1.00 0.00 O ATOM 466 CB ASP A 32 -15.128 14.683 -17.954 1.00 0.00 C ATOM 467 CG ASP A 32 -16.061 13.745 -18.694 1.00 0.00 C ATOM 468 OD1 ASP A 32 -16.143 13.848 -19.937 1.00 0.00 O ATOM 469 OD2 ASP A 32 -16.708 12.908 -18.032 1.00 0.00 O ATOM 0 H ASP A 32 -13.268 16.661 -17.769 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.293 13.846 -18.694 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -14.978 14.316 -16.939 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -15.594 15.665 -17.872 1.00 0.00 H new ATOM 474 N ARG A 33 -13.524 14.551 -21.044 1.00 0.00 N ATOM 475 CA ARG A 33 -13.646 14.929 -22.447 1.00 0.00 C ATOM 476 C ARG A 33 -13.204 13.787 -23.358 1.00 0.00 C ATOM 477 O ARG A 33 -12.405 12.937 -22.963 1.00 0.00 O ATOM 478 CB ARG A 33 -12.811 16.178 -22.734 1.00 0.00 C ATOM 479 CG ARG A 33 -13.100 16.804 -24.089 1.00 0.00 C ATOM 480 CD ARG A 33 -14.564 17.192 -24.223 1.00 0.00 C ATOM 481 NE ARG A 33 -14.767 18.221 -25.239 1.00 0.00 N ATOM 482 CZ ARG A 33 -14.894 17.959 -26.535 1.00 0.00 C ATOM 483 NH1 ARG A 33 -14.839 16.708 -26.971 1.00 0.00 N ATOM 484 NH2 ARG A 33 -15.076 18.950 -27.399 1.00 0.00 N ATOM 0 H ARG A 33 -13.080 13.646 -20.888 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.695 15.147 -22.650 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.997 16.917 -21.954 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.754 15.918 -22.681 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -12.475 17.687 -24.224 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.835 16.102 -24.879 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -15.151 16.310 -24.478 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -14.933 17.553 -23.263 1.00 0.00 H new ATOM 0 HE ARG A 33 -14.814 19.194 -24.937 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -14.699 15.943 -26.311 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -14.937 16.510 -27.967 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -15.118 19.914 -27.068 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -15.173 18.748 -28.394 1.00 0.00 H new ATOM 498 N THR A 34 -13.729 13.774 -24.579 1.00 0.00 N ATOM 499 CA THR A 34 -13.391 12.737 -25.545 1.00 0.00 C ATOM 500 C THR A 34 -13.248 13.318 -26.947 1.00 0.00 C ATOM 501 O THR A 34 -13.807 14.371 -27.254 1.00 0.00 O ATOM 502 CB THR A 34 -14.454 11.623 -25.569 1.00 0.00 C ATOM 503 OG1 THR A 34 -15.757 12.184 -25.371 1.00 0.00 O ATOM 504 CG2 THR A 34 -14.175 10.585 -24.493 1.00 0.00 C ATOM 0 H THR A 34 -14.390 14.471 -24.922 1.00 0.00 H new ATOM 0 HA THR A 34 -12.438 12.312 -25.232 1.00 0.00 H new ATOM 0 HB THR A 34 -14.413 11.134 -26.542 1.00 0.00 H new ATOM 0 HG1 THR A 34 -16.427 11.469 -25.389 1.00 0.00 H new ATOM 0 HG21 THR A 34 -14.939 9.808 -24.530 1.00 0.00 H new ATOM 0 HG22 THR A 34 -13.195 10.138 -24.663 1.00 0.00 H new ATOM 0 HG23 THR A 34 -14.190 11.063 -23.514 1.00 0.00 H new ATOM 512 N PHE A 35 -12.497 12.624 -27.796 1.00 0.00 N ATOM 513 CA PHE A 35 -12.280 13.072 -29.167 1.00 0.00 C ATOM 514 C PHE A 35 -12.057 11.884 -30.098 1.00 0.00 C ATOM 515 O PHE A 35 -11.614 10.819 -29.668 1.00 0.00 O ATOM 516 CB PHE A 35 -11.080 14.019 -29.233 1.00 0.00 C ATOM 517 CG PHE A 35 -10.884 14.826 -27.982 1.00 0.00 C ATOM 518 CD1 PHE A 35 -10.160 14.313 -26.917 1.00 0.00 C ATOM 519 CD2 PHE A 35 -11.422 16.098 -27.870 1.00 0.00 C ATOM 520 CE1 PHE A 35 -9.979 15.053 -25.764 1.00 0.00 C ATOM 521 CE2 PHE A 35 -11.243 16.843 -26.719 1.00 0.00 C ATOM 522 CZ PHE A 35 -10.520 16.320 -25.666 1.00 0.00 C ATOM 0 H PHE A 35 -12.029 11.749 -27.559 1.00 0.00 H new ATOM 0 HA PHE A 35 -13.173 13.605 -29.494 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -10.178 13.437 -29.426 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -11.208 14.697 -30.077 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -9.733 13.324 -26.989 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -11.988 16.512 -28.691 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -9.415 14.641 -24.940 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -11.668 17.833 -26.644 1.00 0.00 H new ATOM 0 HZ PHE A 35 -10.378 16.901 -24.767 1.00 0.00 H new ATOM 532 N SER A 36 -12.367 12.075 -31.377 1.00 0.00 N ATOM 533 CA SER A 36 -12.204 11.019 -32.369 1.00 0.00 C ATOM 534 C SER A 36 -10.880 11.170 -33.111 1.00 0.00 C ATOM 535 O SER A 36 -10.275 10.184 -33.534 1.00 0.00 O ATOM 536 CB SER A 36 -13.366 11.042 -33.364 1.00 0.00 C ATOM 537 OG SER A 36 -13.170 12.040 -34.352 1.00 0.00 O ATOM 0 H SER A 36 -12.732 12.951 -31.750 1.00 0.00 H new ATOM 0 HA SER A 36 -12.200 10.062 -31.848 1.00 0.00 H new ATOM 0 HB2 SER A 36 -13.460 10.067 -33.841 1.00 0.00 H new ATOM 0 HB3 SER A 36 -14.300 11.229 -32.834 1.00 0.00 H new ATOM 0 HG SER A 36 -13.925 12.034 -34.977 1.00 0.00 H new ATOM 543 N THR A 37 -10.434 12.412 -33.266 1.00 0.00 N ATOM 544 CA THR A 37 -9.182 12.694 -33.957 1.00 0.00 C ATOM 545 C THR A 37 -8.173 13.350 -33.022 1.00 0.00 C ATOM 546 O THR A 37 -8.534 13.856 -31.960 1.00 0.00 O ATOM 547 CB THR A 37 -9.407 13.611 -35.175 1.00 0.00 C ATOM 548 OG1 THR A 37 -9.651 14.953 -34.739 1.00 0.00 O ATOM 549 CG2 THR A 37 -10.581 13.123 -36.010 1.00 0.00 C ATOM 0 H THR A 37 -10.921 13.239 -32.922 1.00 0.00 H new ATOM 0 HA THR A 37 -8.788 11.737 -34.299 1.00 0.00 H new ATOM 0 HB THR A 37 -8.508 13.587 -35.791 1.00 0.00 H new ATOM 0 HG1 THR A 37 -9.791 15.530 -35.519 1.00 0.00 H new ATOM 0 HG21 THR A 37 -10.721 13.786 -36.864 1.00 0.00 H new ATOM 0 HG22 THR A 37 -10.380 12.112 -36.364 1.00 0.00 H new ATOM 0 HG23 THR A 37 -11.485 13.121 -35.401 1.00 0.00 H new ATOM 557 N MET A 38 -6.906 13.337 -33.424 1.00 0.00 N ATOM 558 CA MET A 38 -5.844 13.932 -32.621 1.00 0.00 C ATOM 559 C MET A 38 -6.046 15.438 -32.483 1.00 0.00 C ATOM 560 O MET A 38 -6.114 15.967 -31.373 1.00 0.00 O ATOM 561 CB MET A 38 -4.478 13.644 -33.247 1.00 0.00 C ATOM 562 CG MET A 38 -3.346 14.453 -32.636 1.00 0.00 C ATOM 563 SD MET A 38 -3.188 14.194 -30.859 1.00 0.00 S ATOM 564 CE MET A 38 -3.524 12.439 -30.741 1.00 0.00 C ATOM 0 H MET A 38 -6.590 12.921 -34.300 1.00 0.00 H new ATOM 0 HA MET A 38 -5.881 13.485 -31.627 1.00 0.00 H new ATOM 0 HB2 MET A 38 -4.255 12.583 -33.139 1.00 0.00 H new ATOM 0 HB3 MET A 38 -4.526 13.852 -34.316 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.409 14.184 -33.123 1.00 0.00 H new ATOM 0 HG3 MET A 38 -3.515 15.512 -32.831 1.00 0.00 H new ATOM 0 HE1 MET A 38 -3.258 12.084 -29.745 1.00 0.00 H new ATOM 0 HE2 MET A 38 -4.584 12.259 -30.920 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.935 11.905 -31.486 1.00 0.00 H new ATOM 574 N HIS A 39 -6.140 16.124 -33.618 1.00 0.00 N ATOM 575 CA HIS A 39 -6.335 17.570 -33.624 1.00 0.00 C ATOM 576 C HIS A 39 -7.388 17.980 -32.599 1.00 0.00 C ATOM 577 O HIS A 39 -7.186 18.919 -31.830 1.00 0.00 O ATOM 578 CB HIS A 39 -6.749 18.044 -35.017 1.00 0.00 C ATOM 579 CG HIS A 39 -5.878 17.514 -36.114 1.00 0.00 C ATOM 580 ND1 HIS A 39 -4.580 17.098 -35.909 1.00 0.00 N ATOM 581 CD2 HIS A 39 -6.127 17.333 -37.432 1.00 0.00 C ATOM 582 CE1 HIS A 39 -4.066 16.685 -37.054 1.00 0.00 C ATOM 583 NE2 HIS A 39 -4.985 16.816 -37.994 1.00 0.00 N ATOM 0 H HIS A 39 -6.084 15.702 -34.545 1.00 0.00 H new ATOM 0 HA HIS A 39 -5.390 18.041 -33.355 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -7.779 17.741 -35.204 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -6.728 19.134 -35.042 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -7.051 17.554 -37.946 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -3.065 16.305 -37.197 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -4.866 16.573 -38.977 1.00 0.00 H new ATOM 591 N GLU A 40 -8.512 17.270 -32.596 1.00 0.00 N ATOM 592 CA GLU A 40 -9.597 17.563 -31.666 1.00 0.00 C ATOM 593 C GLU A 40 -9.097 17.547 -30.224 1.00 0.00 C ATOM 594 O GLU A 40 -9.435 18.425 -29.429 1.00 0.00 O ATOM 595 CB GLU A 40 -10.731 16.549 -31.836 1.00 0.00 C ATOM 596 CG GLU A 40 -11.540 16.749 -33.106 1.00 0.00 C ATOM 597 CD GLU A 40 -12.548 17.875 -32.984 1.00 0.00 C ATOM 598 OE1 GLU A 40 -12.216 18.905 -32.362 1.00 0.00 O ATOM 599 OE2 GLU A 40 -13.670 17.726 -33.513 1.00 0.00 O ATOM 0 H GLU A 40 -8.695 16.489 -33.226 1.00 0.00 H new ATOM 0 HA GLU A 40 -9.974 18.561 -31.890 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.311 15.543 -31.837 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.398 16.615 -30.976 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -10.863 16.960 -33.934 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -12.062 15.824 -33.349 1.00 0.00 H new ATOM 606 N LEU A 41 -8.292 16.543 -29.895 1.00 0.00 N ATOM 607 CA LEU A 41 -7.745 16.412 -28.549 1.00 0.00 C ATOM 608 C LEU A 41 -6.854 17.601 -28.204 1.00 0.00 C ATOM 609 O LEU A 41 -6.995 18.209 -27.143 1.00 0.00 O ATOM 610 CB LEU A 41 -6.950 15.111 -28.425 1.00 0.00 C ATOM 611 CG LEU A 41 -6.073 14.977 -27.180 1.00 0.00 C ATOM 612 CD1 LEU A 41 -6.868 15.311 -25.927 1.00 0.00 C ATOM 613 CD2 LEU A 41 -5.492 13.573 -27.086 1.00 0.00 C ATOM 0 H LEU A 41 -8.004 15.808 -30.541 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.578 16.391 -27.846 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.651 14.277 -28.442 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.315 15.012 -29.305 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.249 15.686 -27.262 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -6.227 15.210 -25.051 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.235 16.335 -25.991 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.713 14.628 -25.839 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.870 13.495 -26.194 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.303 12.847 -27.028 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.886 13.370 -27.969 1.00 0.00 H new ATOM 625 N VAL A 42 -5.937 17.928 -29.109 1.00 0.00 N ATOM 626 CA VAL A 42 -5.024 19.047 -28.903 1.00 0.00 C ATOM 627 C VAL A 42 -5.790 20.340 -28.648 1.00 0.00 C ATOM 628 O VAL A 42 -5.546 21.035 -27.661 1.00 0.00 O ATOM 629 CB VAL A 42 -4.095 19.244 -30.115 1.00 0.00 C ATOM 630 CG1 VAL A 42 -3.239 20.488 -29.936 1.00 0.00 C ATOM 631 CG2 VAL A 42 -3.225 18.013 -30.324 1.00 0.00 C ATOM 0 H VAL A 42 -5.806 17.434 -29.992 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.420 18.807 -28.028 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.710 19.382 -31.004 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.589 20.610 -30.803 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -3.883 21.362 -29.839 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.630 20.385 -29.038 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.574 18.169 -31.185 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.617 17.842 -29.436 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.860 17.145 -30.502 1.00 0.00 H new ATOM 641 N THR A 43 -6.718 20.659 -29.544 1.00 0.00 N ATOM 642 CA THR A 43 -7.520 21.870 -29.417 1.00 0.00 C ATOM 643 C THR A 43 -8.128 21.983 -28.024 1.00 0.00 C ATOM 644 O THR A 43 -8.423 23.081 -27.552 1.00 0.00 O ATOM 645 CB THR A 43 -8.650 21.908 -30.463 1.00 0.00 C ATOM 646 OG1 THR A 43 -8.098 22.055 -31.776 1.00 0.00 O ATOM 647 CG2 THR A 43 -9.611 23.053 -30.180 1.00 0.00 C ATOM 0 H THR A 43 -6.933 20.095 -30.366 1.00 0.00 H new ATOM 0 HA THR A 43 -6.849 22.712 -29.587 1.00 0.00 H new ATOM 0 HB THR A 43 -9.201 20.969 -30.404 1.00 0.00 H new ATOM 0 HG1 THR A 43 -7.707 21.204 -32.064 1.00 0.00 H new ATOM 0 HG21 THR A 43 -10.400 23.060 -30.932 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.052 22.922 -29.192 1.00 0.00 H new ATOM 0 HG23 THR A 43 -9.070 23.999 -30.214 1.00 0.00 H new ATOM 655 N HIS A 44 -8.312 20.841 -27.369 1.00 0.00 N ATOM 656 CA HIS A 44 -8.884 20.812 -26.028 1.00 0.00 C ATOM 657 C HIS A 44 -7.813 21.079 -24.974 1.00 0.00 C ATOM 658 O HIS A 44 -7.878 22.069 -24.246 1.00 0.00 O ATOM 659 CB HIS A 44 -9.551 19.462 -25.764 1.00 0.00 C ATOM 660 CG HIS A 44 -9.840 19.209 -24.316 1.00 0.00 C ATOM 661 ND1 HIS A 44 -11.029 19.560 -23.713 1.00 0.00 N ATOM 662 CD2 HIS A 44 -9.085 18.635 -23.349 1.00 0.00 C ATOM 663 CE1 HIS A 44 -10.994 19.214 -22.439 1.00 0.00 C ATOM 664 NE2 HIS A 44 -9.825 18.651 -22.193 1.00 0.00 N ATOM 0 H HIS A 44 -8.073 19.924 -27.745 1.00 0.00 H new ATOM 0 HA HIS A 44 -9.636 21.599 -25.964 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -10.483 19.411 -26.326 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -8.907 18.668 -26.142 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -11.814 20.016 -24.178 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.087 18.239 -23.466 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -11.786 19.366 -21.721 1.00 0.00 H new ATOM 672 N VAL A 45 -6.830 20.188 -24.898 1.00 0.00 N ATOM 673 CA VAL A 45 -5.745 20.327 -23.934 1.00 0.00 C ATOM 674 C VAL A 45 -5.069 21.688 -24.061 1.00 0.00 C ATOM 675 O VAL A 45 -4.426 22.165 -23.124 1.00 0.00 O ATOM 676 CB VAL A 45 -4.687 19.222 -24.116 1.00 0.00 C ATOM 677 CG1 VAL A 45 -3.679 19.255 -22.977 1.00 0.00 C ATOM 678 CG2 VAL A 45 -5.354 17.858 -24.210 1.00 0.00 C ATOM 0 H VAL A 45 -6.763 19.362 -25.493 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.189 20.235 -22.943 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.152 19.405 -25.048 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -2.940 18.467 -23.123 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -3.179 20.224 -22.961 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.195 19.098 -22.030 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.593 17.089 -24.338 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -5.916 17.664 -23.296 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.033 17.843 -25.063 1.00 0.00 H new ATOM 688 N THR A 46 -5.218 22.311 -25.226 1.00 0.00 N ATOM 689 CA THR A 46 -4.621 23.617 -25.476 1.00 0.00 C ATOM 690 C THR A 46 -5.600 24.740 -25.152 1.00 0.00 C ATOM 691 O THR A 46 -5.303 25.622 -24.347 1.00 0.00 O ATOM 692 CB THR A 46 -4.166 23.756 -26.941 1.00 0.00 C ATOM 693 OG1 THR A 46 -3.549 22.540 -27.379 1.00 0.00 O ATOM 694 CG2 THR A 46 -3.189 24.911 -27.097 1.00 0.00 C ATOM 0 H THR A 46 -5.747 21.932 -26.011 1.00 0.00 H new ATOM 0 HA THR A 46 -3.751 23.697 -24.824 1.00 0.00 H new ATOM 0 HB THR A 46 -5.044 23.959 -27.554 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.209 21.990 -27.851 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.882 24.989 -28.140 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.671 25.839 -26.790 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.313 24.733 -26.473 1.00 0.00 H new ATOM 702 N MET A 47 -6.770 24.700 -25.782 1.00 0.00 N ATOM 703 CA MET A 47 -7.793 25.714 -25.558 1.00 0.00 C ATOM 704 C MET A 47 -8.691 25.331 -24.386 1.00 0.00 C ATOM 705 O MET A 47 -8.924 26.134 -23.483 1.00 0.00 O ATOM 706 CB MET A 47 -8.637 25.904 -26.820 1.00 0.00 C ATOM 707 CG MET A 47 -7.817 25.943 -28.099 1.00 0.00 C ATOM 708 SD MET A 47 -8.736 26.626 -29.493 1.00 0.00 S ATOM 709 CE MET A 47 -7.535 27.777 -30.158 1.00 0.00 C ATOM 0 H MET A 47 -7.033 23.976 -26.451 1.00 0.00 H new ATOM 0 HA MET A 47 -7.293 26.652 -25.318 1.00 0.00 H new ATOM 0 HB2 MET A 47 -9.362 25.093 -26.888 1.00 0.00 H new ATOM 0 HB3 MET A 47 -9.203 26.831 -26.733 1.00 0.00 H new ATOM 0 HG2 MET A 47 -6.920 26.540 -27.933 1.00 0.00 H new ATOM 0 HG3 MET A 47 -7.487 24.934 -28.346 1.00 0.00 H new ATOM 0 HE1 MET A 47 -7.956 28.280 -31.028 1.00 0.00 H new ATOM 0 HE2 MET A 47 -7.281 28.517 -29.399 1.00 0.00 H new ATOM 0 HE3 MET A 47 -6.636 27.235 -30.452 1.00 0.00 H new ATOM 719 N GLU A 48 -9.191 24.099 -24.406 1.00 0.00 N ATOM 720 CA GLU A 48 -10.063 23.612 -23.344 1.00 0.00 C ATOM 721 C GLU A 48 -9.281 23.398 -22.052 1.00 0.00 C ATOM 722 O GLU A 48 -9.824 22.921 -21.056 1.00 0.00 O ATOM 723 CB GLU A 48 -10.737 22.305 -23.767 1.00 0.00 C ATOM 724 CG GLU A 48 -11.640 22.451 -24.981 1.00 0.00 C ATOM 725 CD GLU A 48 -13.008 23.000 -24.628 1.00 0.00 C ATOM 726 OE1 GLU A 48 -13.541 22.625 -23.563 1.00 0.00 O ATOM 727 OE2 GLU A 48 -13.547 23.804 -25.417 1.00 0.00 O ATOM 0 H GLU A 48 -9.007 23.421 -25.145 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.829 24.366 -23.164 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -9.968 21.563 -23.984 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.324 21.922 -22.932 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -11.164 23.111 -25.706 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.756 21.480 -25.462 1.00 0.00 H new ATOM 734 N HIS A 49 -8.000 23.755 -22.077 1.00 0.00 N ATOM 735 CA HIS A 49 -7.141 23.603 -20.908 1.00 0.00 C ATOM 736 C HIS A 49 -6.158 24.764 -20.800 1.00 0.00 C ATOM 737 O HIS A 49 -6.313 25.645 -19.954 1.00 0.00 O ATOM 738 CB HIS A 49 -6.379 22.279 -20.978 1.00 0.00 C ATOM 739 CG HIS A 49 -7.038 21.167 -20.221 1.00 0.00 C ATOM 740 ND1 HIS A 49 -7.831 21.378 -19.113 1.00 0.00 N ATOM 741 CD2 HIS A 49 -7.021 19.829 -20.421 1.00 0.00 C ATOM 742 CE1 HIS A 49 -8.271 20.216 -18.662 1.00 0.00 C ATOM 743 NE2 HIS A 49 -7.794 19.260 -19.439 1.00 0.00 N ATOM 0 H HIS A 49 -7.535 24.151 -22.894 1.00 0.00 H new ATOM 0 HA HIS A 49 -7.774 23.603 -20.021 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.274 21.984 -22.022 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -5.373 22.427 -20.586 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -8.045 22.288 -18.705 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -6.497 19.306 -21.207 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -8.911 20.073 -17.804 1.00 0.00 H new ATOM 751 N VAL A 50 -5.147 24.760 -21.663 1.00 0.00 N ATOM 752 CA VAL A 50 -4.139 25.813 -21.666 1.00 0.00 C ATOM 753 C VAL A 50 -4.728 27.135 -22.145 1.00 0.00 C ATOM 754 O VAL A 50 -4.046 28.160 -22.163 1.00 0.00 O ATOM 755 CB VAL A 50 -2.942 25.442 -22.561 1.00 0.00 C ATOM 756 CG1 VAL A 50 -2.023 26.639 -22.747 1.00 0.00 C ATOM 757 CG2 VAL A 50 -2.183 24.262 -21.973 1.00 0.00 C ATOM 0 H VAL A 50 -5.004 24.038 -22.370 1.00 0.00 H new ATOM 0 HA VAL A 50 -3.793 25.924 -20.638 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.320 25.149 -23.541 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.183 26.358 -23.382 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.576 27.453 -23.216 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.650 26.966 -21.776 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.340 24.013 -22.618 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.815 24.524 -20.981 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.849 23.402 -21.898 1.00 0.00 H new ATOM 767 N GLY A 51 -5.999 27.106 -22.532 1.00 0.00 N ATOM 768 CA GLY A 51 -6.659 28.308 -23.005 1.00 0.00 C ATOM 769 C GLY A 51 -6.110 28.786 -24.335 1.00 0.00 C ATOM 770 O GLY A 51 -5.461 28.028 -25.055 1.00 0.00 O ATOM 0 H GLY A 51 -6.584 26.270 -22.526 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.728 28.117 -23.104 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.544 29.098 -22.263 1.00 0.00 H new ATOM 774 N GLY A 52 -6.371 30.047 -24.663 1.00 0.00 N ATOM 775 CA GLY A 52 -5.893 30.603 -25.916 1.00 0.00 C ATOM 776 C GLY A 52 -4.556 31.302 -25.767 1.00 0.00 C ATOM 777 O GLY A 52 -3.798 31.045 -24.832 1.00 0.00 O ATOM 0 H GLY A 52 -6.905 30.694 -24.083 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.802 29.805 -26.653 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.628 31.310 -26.300 1.00 0.00 H new ATOM 781 N PRO A 53 -4.250 32.208 -26.707 1.00 0.00 N ATOM 782 CA PRO A 53 -2.994 32.964 -26.699 1.00 0.00 C ATOM 783 C PRO A 53 -2.936 33.979 -25.563 1.00 0.00 C ATOM 784 O PRO A 53 -1.958 34.036 -24.819 1.00 0.00 O ATOM 785 CB PRO A 53 -3.001 33.678 -28.053 1.00 0.00 C ATOM 786 CG PRO A 53 -4.441 33.789 -28.416 1.00 0.00 C ATOM 787 CD PRO A 53 -5.107 32.565 -27.851 1.00 0.00 C ATOM 0 HA PRO A 53 -2.130 32.317 -26.547 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.533 34.660 -27.985 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -2.447 33.112 -28.802 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -4.879 34.697 -28.002 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -4.568 33.838 -29.497 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -6.130 32.773 -27.537 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.156 31.759 -28.584 1.00 0.00 H new ATOM 795 N GLU A 54 -3.991 34.779 -25.435 1.00 0.00 N ATOM 796 CA GLU A 54 -4.058 35.792 -24.388 1.00 0.00 C ATOM 797 C GLU A 54 -3.750 35.185 -23.023 1.00 0.00 C ATOM 798 O GLU A 54 -3.322 35.884 -22.104 1.00 0.00 O ATOM 799 CB GLU A 54 -5.442 36.445 -24.368 1.00 0.00 C ATOM 800 CG GLU A 54 -5.556 37.599 -23.386 1.00 0.00 C ATOM 801 CD GLU A 54 -5.785 37.132 -21.962 1.00 0.00 C ATOM 802 OE1 GLU A 54 -6.807 36.459 -21.714 1.00 0.00 O ATOM 803 OE2 GLU A 54 -4.942 37.441 -21.094 1.00 0.00 O ATOM 0 H GLU A 54 -4.810 34.745 -26.043 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.308 36.553 -24.605 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -5.679 36.806 -25.369 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -6.187 35.690 -24.117 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -4.646 38.197 -23.426 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -6.378 38.249 -23.688 1.00 0.00 H new ATOM 810 N GLN A 55 -3.972 33.880 -22.898 1.00 0.00 N ATOM 811 CA GLN A 55 -3.719 33.180 -21.644 1.00 0.00 C ATOM 812 C GLN A 55 -2.335 33.518 -21.101 1.00 0.00 C ATOM 813 O GLN A 55 -1.326 33.011 -21.588 1.00 0.00 O ATOM 814 CB GLN A 55 -3.846 31.669 -21.846 1.00 0.00 C ATOM 815 CG GLN A 55 -4.261 30.920 -20.590 1.00 0.00 C ATOM 816 CD GLN A 55 -5.766 30.779 -20.465 1.00 0.00 C ATOM 817 OE1 GLN A 55 -6.263 29.875 -19.793 1.00 0.00 O ATOM 818 NE2 GLN A 55 -6.500 31.675 -21.114 1.00 0.00 N ATOM 0 H GLN A 55 -4.326 33.287 -23.649 1.00 0.00 H new ATOM 0 HA GLN A 55 -4.463 33.507 -20.918 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -4.576 31.476 -22.632 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -2.891 31.276 -22.195 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -3.806 29.929 -20.595 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -3.875 31.443 -19.715 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -6.046 32.408 -21.659 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -7.518 31.631 -21.067 1.00 0.00 H new ATOM 827 N ASN A 56 -2.296 34.378 -20.089 1.00 0.00 N ATOM 828 CA ASN A 56 -1.035 34.785 -19.480 1.00 0.00 C ATOM 829 C ASN A 56 -0.298 33.582 -18.898 1.00 0.00 C ATOM 830 O ASN A 56 0.683 33.107 -19.469 1.00 0.00 O ATOM 831 CB ASN A 56 -1.285 35.823 -18.384 1.00 0.00 C ATOM 832 CG ASN A 56 -0.093 35.987 -17.460 1.00 0.00 C ATOM 833 OD1 ASN A 56 -0.163 35.662 -16.275 1.00 0.00 O ATOM 834 ND2 ASN A 56 1.008 36.496 -18.001 1.00 0.00 N ATOM 0 H ASN A 56 -3.123 34.807 -19.673 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.412 35.229 -20.257 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -1.520 36.783 -18.843 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -2.156 35.528 -17.800 1.00 0.00 H new ATOM 0 HD21 ASN A 56 1.842 36.632 -17.429 1.00 0.00 H new ATOM 0 HD22 ASN A 56 1.020 36.751 -18.988 1.00 0.00 H new ATOM 841 N ASN A 57 -0.779 33.095 -17.760 1.00 0.00 N ATOM 842 CA ASN A 57 -0.167 31.947 -17.100 1.00 0.00 C ATOM 843 C ASN A 57 -0.638 30.641 -17.733 1.00 0.00 C ATOM 844 O ASN A 57 -1.723 30.145 -17.425 1.00 0.00 O ATOM 845 CB ASN A 57 -0.500 31.952 -15.607 1.00 0.00 C ATOM 846 CG ASN A 57 0.153 30.803 -14.865 1.00 0.00 C ATOM 847 OD1 ASN A 57 1.235 30.346 -15.234 1.00 0.00 O ATOM 848 ND2 ASN A 57 -0.503 30.330 -13.812 1.00 0.00 N ATOM 0 H ASN A 57 -1.591 33.477 -17.275 1.00 0.00 H new ATOM 0 HA ASN A 57 0.913 32.022 -17.224 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -0.175 32.895 -15.168 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -1.581 31.896 -15.479 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -0.113 29.557 -13.273 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -1.397 30.740 -13.542 1.00 0.00 H new ATOM 855 N HIS A 58 0.184 30.088 -18.619 1.00 0.00 N ATOM 856 CA HIS A 58 -0.147 28.839 -19.295 1.00 0.00 C ATOM 857 C HIS A 58 0.690 27.687 -18.748 1.00 0.00 C ATOM 858 O HIS A 58 1.894 27.609 -18.994 1.00 0.00 O ATOM 859 CB HIS A 58 0.074 28.975 -20.802 1.00 0.00 C ATOM 860 CG HIS A 58 1.180 29.918 -21.162 1.00 0.00 C ATOM 861 ND1 HIS A 58 1.009 30.989 -22.012 1.00 0.00 N ATOM 862 CD2 HIS A 58 2.479 29.947 -20.780 1.00 0.00 C ATOM 863 CE1 HIS A 58 2.154 31.635 -22.140 1.00 0.00 C ATOM 864 NE2 HIS A 58 3.062 31.023 -21.401 1.00 0.00 N ATOM 0 H HIS A 58 1.085 30.486 -18.886 1.00 0.00 H new ATOM 0 HA HIS A 58 -1.199 28.622 -19.108 1.00 0.00 H new ATOM 0 HB2 HIS A 58 0.295 27.992 -21.219 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -0.850 29.318 -21.267 1.00 0.00 H new ATOM 0 HD2 HIS A 58 2.966 29.253 -20.111 1.00 0.00 H new ATOM 0 HE1 HIS A 58 2.320 32.514 -22.746 1.00 0.00 H new ATOM 0 HE2 HIS A 58 4.038 31.304 -21.307 1.00 0.00 H new ATOM 872 N VAL A 59 0.045 26.794 -18.003 1.00 0.00 N ATOM 873 CA VAL A 59 0.730 25.646 -17.422 1.00 0.00 C ATOM 874 C VAL A 59 -0.090 24.372 -17.594 1.00 0.00 C ATOM 875 O VAL A 59 -1.315 24.388 -17.474 1.00 0.00 O ATOM 876 CB VAL A 59 1.014 25.862 -15.923 1.00 0.00 C ATOM 877 CG1 VAL A 59 1.955 24.788 -15.398 1.00 0.00 C ATOM 878 CG2 VAL A 59 1.589 27.250 -15.685 1.00 0.00 C ATOM 0 H VAL A 59 -0.951 26.844 -17.788 1.00 0.00 H new ATOM 0 HA VAL A 59 1.676 25.540 -17.952 1.00 0.00 H new ATOM 0 HB VAL A 59 0.074 25.785 -15.377 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.144 24.957 -14.338 1.00 0.00 H new ATOM 0 HG12 VAL A 59 1.499 23.807 -15.534 1.00 0.00 H new ATOM 0 HG13 VAL A 59 2.896 24.830 -15.946 1.00 0.00 H new ATOM 0 HG21 VAL A 59 1.784 27.386 -14.621 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.520 27.358 -16.241 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.876 28.002 -16.022 1.00 0.00 H new ATOM 888 N CYS A 60 0.595 23.268 -17.875 1.00 0.00 N ATOM 889 CA CYS A 60 -0.069 21.984 -18.064 1.00 0.00 C ATOM 890 C CYS A 60 0.288 21.016 -16.940 1.00 0.00 C ATOM 891 O CYS A 60 1.439 20.598 -16.808 1.00 0.00 O ATOM 892 CB CYS A 60 0.320 21.379 -19.415 1.00 0.00 C ATOM 893 SG CYS A 60 0.619 19.583 -19.367 1.00 0.00 S ATOM 0 H CYS A 60 1.609 23.237 -17.977 1.00 0.00 H new ATOM 0 HA CYS A 60 -1.146 22.154 -18.045 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -0.472 21.586 -20.135 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.219 21.877 -19.778 1.00 0.00 H new ATOM 898 N TYR A 61 -0.705 20.665 -16.132 1.00 0.00 N ATOM 899 CA TYR A 61 -0.496 19.748 -15.017 1.00 0.00 C ATOM 900 C TYR A 61 -1.220 18.427 -15.255 1.00 0.00 C ATOM 901 O TYR A 61 -2.419 18.308 -15.001 1.00 0.00 O ATOM 902 CB TYR A 61 -0.983 20.381 -13.712 1.00 0.00 C ATOM 903 CG TYR A 61 -0.598 21.835 -13.563 1.00 0.00 C ATOM 904 CD1 TYR A 61 -1.331 22.836 -14.190 1.00 0.00 C ATOM 905 CD2 TYR A 61 0.500 22.210 -12.798 1.00 0.00 C ATOM 906 CE1 TYR A 61 -0.983 24.166 -14.058 1.00 0.00 C ATOM 907 CE2 TYR A 61 0.855 23.537 -12.659 1.00 0.00 C ATOM 908 CZ TYR A 61 0.110 24.512 -13.291 1.00 0.00 C ATOM 909 OH TYR A 61 0.461 25.836 -13.157 1.00 0.00 O ATOM 0 H TYR A 61 -1.663 21.001 -16.228 1.00 0.00 H new ATOM 0 HA TYR A 61 0.573 19.547 -14.940 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -2.068 20.294 -13.659 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -0.577 19.818 -12.871 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -2.188 22.569 -14.791 1.00 0.00 H new ATOM 0 HD2 TYR A 61 1.086 21.450 -12.303 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.563 24.931 -14.553 1.00 0.00 H new ATOM 0 HE2 TYR A 61 1.711 23.810 -12.059 1.00 0.00 H new ATOM 0 HH TYR A 61 1.253 25.908 -12.584 1.00 0.00 H new ATOM 919 N TRP A 62 -0.483 17.436 -15.744 1.00 0.00 N ATOM 920 CA TRP A 62 -1.053 16.122 -16.017 1.00 0.00 C ATOM 921 C TRP A 62 -0.922 15.209 -14.802 1.00 0.00 C ATOM 922 O TRP A 62 0.049 15.297 -14.052 1.00 0.00 O ATOM 923 CB TRP A 62 -0.364 15.485 -17.225 1.00 0.00 C ATOM 924 CG TRP A 62 -1.284 14.645 -18.059 1.00 0.00 C ATOM 925 CD1 TRP A 62 -1.473 13.296 -17.964 1.00 0.00 C ATOM 926 CD2 TRP A 62 -2.139 15.099 -19.114 1.00 0.00 C ATOM 927 NE1 TRP A 62 -2.394 12.884 -18.898 1.00 0.00 N ATOM 928 CE2 TRP A 62 -2.818 13.971 -19.615 1.00 0.00 C ATOM 929 CE3 TRP A 62 -2.398 16.349 -19.683 1.00 0.00 C ATOM 930 CZ2 TRP A 62 -3.736 14.057 -20.657 1.00 0.00 C ATOM 931 CZ3 TRP A 62 -3.310 16.433 -20.718 1.00 0.00 C ATOM 932 CH2 TRP A 62 -3.971 15.293 -21.196 1.00 0.00 C ATOM 0 H TRP A 62 0.511 17.518 -15.960 1.00 0.00 H new ATOM 0 HA TRP A 62 -2.112 16.252 -16.239 1.00 0.00 H new ATOM 0 HB2 TRP A 62 0.063 16.272 -17.847 1.00 0.00 H new ATOM 0 HB3 TRP A 62 0.465 14.868 -16.878 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -0.973 12.648 -17.259 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -2.710 11.924 -19.035 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -1.895 17.233 -19.321 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -4.245 13.180 -21.027 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -3.517 17.394 -21.166 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -4.679 15.392 -22.005 1.00 0.00 H new ATOM 943 N GLU A 63 -1.905 14.334 -14.616 1.00 0.00 N ATOM 944 CA GLU A 63 -1.898 13.406 -13.491 1.00 0.00 C ATOM 945 C GLU A 63 -0.484 12.906 -13.207 1.00 0.00 C ATOM 946 O GLU A 63 -0.163 12.529 -12.081 1.00 0.00 O ATOM 947 CB GLU A 63 -2.823 12.221 -13.773 1.00 0.00 C ATOM 948 CG GLU A 63 -2.985 11.280 -12.591 1.00 0.00 C ATOM 949 CD GLU A 63 -4.035 10.213 -12.834 1.00 0.00 C ATOM 950 OE1 GLU A 63 -4.484 10.077 -13.991 1.00 0.00 O ATOM 951 OE2 GLU A 63 -4.407 9.515 -11.868 1.00 0.00 O ATOM 0 H GLU A 63 -2.716 14.248 -15.229 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.260 13.938 -12.611 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.804 12.598 -14.064 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.432 11.660 -14.622 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.029 10.802 -12.379 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.256 11.857 -11.707 1.00 0.00 H new ATOM 958 N GLU A 64 0.355 12.906 -14.238 1.00 0.00 N ATOM 959 CA GLU A 64 1.734 12.451 -14.100 1.00 0.00 C ATOM 960 C GLU A 64 2.655 13.210 -15.050 1.00 0.00 C ATOM 961 O GLU A 64 3.464 12.611 -15.760 1.00 0.00 O ATOM 962 CB GLU A 64 1.828 10.948 -14.372 1.00 0.00 C ATOM 963 CG GLU A 64 1.112 10.513 -15.640 1.00 0.00 C ATOM 964 CD GLU A 64 1.991 10.619 -16.871 1.00 0.00 C ATOM 965 OE1 GLU A 64 3.122 10.090 -16.841 1.00 0.00 O ATOM 966 OE2 GLU A 64 1.546 11.230 -17.866 1.00 0.00 O ATOM 0 H GLU A 64 0.105 13.216 -15.177 1.00 0.00 H new ATOM 0 HA GLU A 64 2.054 12.648 -13.077 1.00 0.00 H new ATOM 0 HB2 GLU A 64 2.878 10.665 -14.443 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.408 10.407 -13.524 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.774 9.483 -15.527 1.00 0.00 H new ATOM 0 HG3 GLU A 64 0.222 11.127 -15.779 1.00 0.00 H new ATOM 973 N CYS A 65 2.527 14.532 -15.059 1.00 0.00 N ATOM 974 CA CYS A 65 3.346 15.375 -15.922 1.00 0.00 C ATOM 975 C CYS A 65 4.694 15.672 -15.272 1.00 0.00 C ATOM 976 O CYS A 65 4.783 15.982 -14.083 1.00 0.00 O ATOM 977 CB CYS A 65 2.617 16.684 -16.233 1.00 0.00 C ATOM 978 SG CYS A 65 3.550 17.816 -17.313 1.00 0.00 S ATOM 0 H CYS A 65 1.863 15.044 -14.478 1.00 0.00 H new ATOM 0 HA CYS A 65 3.523 14.836 -16.853 1.00 0.00 H new ATOM 0 HB2 CYS A 65 1.662 16.452 -16.705 1.00 0.00 H new ATOM 0 HB3 CYS A 65 2.393 17.194 -15.296 1.00 0.00 H new ATOM 983 N PRO A 66 5.769 15.577 -16.068 1.00 0.00 N ATOM 984 CA PRO A 66 7.131 15.833 -15.592 1.00 0.00 C ATOM 985 C PRO A 66 7.370 17.306 -15.281 1.00 0.00 C ATOM 986 O PRO A 66 8.240 17.649 -14.480 1.00 0.00 O ATOM 987 CB PRO A 66 8.007 15.385 -16.765 1.00 0.00 C ATOM 988 CG PRO A 66 7.132 15.519 -17.963 1.00 0.00 C ATOM 989 CD PRO A 66 5.737 15.213 -17.494 1.00 0.00 C ATOM 0 HA PRO A 66 7.342 15.309 -14.660 1.00 0.00 H new ATOM 0 HB2 PRO A 66 8.898 16.007 -16.854 1.00 0.00 H new ATOM 0 HB3 PRO A 66 8.347 14.357 -16.636 1.00 0.00 H new ATOM 0 HG2 PRO A 66 7.192 16.525 -18.379 1.00 0.00 H new ATOM 0 HG3 PRO A 66 7.439 14.830 -18.750 1.00 0.00 H new ATOM 0 HD2 PRO A 66 4.993 15.793 -18.040 1.00 0.00 H new ATOM 0 HD3 PRO A 66 5.487 14.161 -17.635 1.00 0.00 H new ATOM 997 N ARG A 67 6.592 18.174 -15.920 1.00 0.00 N ATOM 998 CA ARG A 67 6.720 19.612 -15.713 1.00 0.00 C ATOM 999 C ARG A 67 6.305 19.995 -14.295 1.00 0.00 C ATOM 1000 O ARG A 67 6.864 20.917 -13.703 1.00 0.00 O ATOM 1001 CB ARG A 67 5.868 20.373 -16.729 1.00 0.00 C ATOM 1002 CG ARG A 67 6.099 19.936 -18.166 1.00 0.00 C ATOM 1003 CD ARG A 67 7.562 20.064 -18.560 1.00 0.00 C ATOM 1004 NE ARG A 67 8.039 21.440 -18.453 1.00 0.00 N ATOM 1005 CZ ARG A 67 9.207 21.852 -18.933 1.00 0.00 C ATOM 1006 NH1 ARG A 67 10.013 20.999 -19.550 1.00 0.00 N ATOM 1007 NH2 ARG A 67 9.571 23.121 -18.797 1.00 0.00 N ATOM 0 H ARG A 67 5.867 17.907 -16.585 1.00 0.00 H new ATOM 0 HA ARG A 67 7.767 19.883 -15.853 1.00 0.00 H new ATOM 0 HB2 ARG A 67 4.815 20.237 -16.482 1.00 0.00 H new ATOM 0 HB3 ARG A 67 6.081 21.439 -16.643 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.777 18.902 -18.289 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.487 20.542 -18.834 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.167 19.420 -17.922 1.00 0.00 H new ATOM 0 HD3 ARG A 67 7.694 19.713 -19.584 1.00 0.00 H new ATOM 0 HE ARG A 67 7.443 22.122 -17.984 1.00 0.00 H new ATOM 0 HH11 ARG A 67 9.737 20.023 -19.657 1.00 0.00 H new ATOM 0 HH12 ARG A 67 10.909 21.319 -19.917 1.00 0.00 H new ATOM 0 HH21 ARG A 67 8.954 23.781 -18.324 1.00 0.00 H new ATOM 0 HH22 ARG A 67 10.468 23.437 -19.166 1.00 0.00 H new ATOM 1021 N GLU A 68 5.320 19.281 -13.759 1.00 0.00 N ATOM 1022 CA GLU A 68 4.829 19.549 -12.412 1.00 0.00 C ATOM 1023 C GLU A 68 4.444 21.017 -12.255 1.00 0.00 C ATOM 1024 O GLU A 68 4.394 21.541 -11.143 1.00 0.00 O ATOM 1025 CB GLU A 68 5.890 19.175 -11.375 1.00 0.00 C ATOM 1026 CG GLU A 68 6.580 17.851 -11.660 1.00 0.00 C ATOM 1027 CD GLU A 68 7.706 17.558 -10.687 1.00 0.00 C ATOM 1028 OE1 GLU A 68 7.539 17.849 -9.484 1.00 0.00 O ATOM 1029 OE2 GLU A 68 8.752 17.039 -11.129 1.00 0.00 O ATOM 0 H GLU A 68 4.847 18.514 -14.236 1.00 0.00 H new ATOM 0 HA GLU A 68 3.941 18.939 -12.249 1.00 0.00 H new ATOM 0 HB2 GLU A 68 6.640 19.965 -11.334 1.00 0.00 H new ATOM 0 HB3 GLU A 68 5.423 19.127 -10.391 1.00 0.00 H new ATOM 0 HG2 GLU A 68 5.846 17.046 -11.614 1.00 0.00 H new ATOM 0 HG3 GLU A 68 6.976 17.863 -12.675 1.00 0.00 H new ATOM 1036 N GLY A 69 4.173 21.675 -13.378 1.00 0.00 N ATOM 1037 CA GLY A 69 3.796 23.076 -13.344 1.00 0.00 C ATOM 1038 C GLY A 69 4.824 23.969 -14.010 1.00 0.00 C ATOM 1039 O GLY A 69 4.506 25.073 -14.453 1.00 0.00 O ATOM 0 H GLY A 69 4.208 21.263 -14.310 1.00 0.00 H new ATOM 0 HA2 GLY A 69 2.834 23.202 -13.840 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.664 23.389 -12.308 1.00 0.00 H new ATOM 1043 N LYS A 70 6.063 23.493 -14.079 1.00 0.00 N ATOM 1044 CA LYS A 70 7.143 24.255 -14.695 1.00 0.00 C ATOM 1045 C LYS A 70 6.725 24.783 -16.063 1.00 0.00 C ATOM 1046 O LYS A 70 6.818 24.076 -17.067 1.00 0.00 O ATOM 1047 CB LYS A 70 8.394 23.385 -14.832 1.00 0.00 C ATOM 1048 CG LYS A 70 9.351 23.506 -13.659 1.00 0.00 C ATOM 1049 CD LYS A 70 8.944 22.596 -12.512 1.00 0.00 C ATOM 1050 CE LYS A 70 9.504 21.193 -12.688 1.00 0.00 C ATOM 1051 NZ LYS A 70 9.047 20.274 -11.608 1.00 0.00 N ATOM 0 H LYS A 70 6.344 22.582 -13.716 1.00 0.00 H new ATOM 0 HA LYS A 70 7.368 25.105 -14.051 1.00 0.00 H new ATOM 0 HB2 LYS A 70 8.092 22.343 -14.937 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.918 23.659 -15.747 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.360 23.254 -13.984 1.00 0.00 H new ATOM 0 HG3 LYS A 70 9.376 24.540 -13.314 1.00 0.00 H new ATOM 0 HD2 LYS A 70 9.299 23.015 -11.570 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.857 22.550 -12.451 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.196 20.798 -13.656 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.593 21.235 -12.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.870 19.932 -11.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 8.404 20.783 -10.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.548 19.465 -12.029 1.00 0.00 H new ATOM 1065 N SER A 71 6.265 26.029 -16.097 1.00 0.00 N ATOM 1066 CA SER A 71 5.831 26.651 -17.342 1.00 0.00 C ATOM 1067 C SER A 71 6.968 26.685 -18.358 1.00 0.00 C ATOM 1068 O SER A 71 8.054 26.160 -18.109 1.00 0.00 O ATOM 1069 CB SER A 71 5.324 28.070 -17.079 1.00 0.00 C ATOM 1070 OG SER A 71 6.400 28.957 -16.826 1.00 0.00 O ATOM 0 H SER A 71 6.183 26.628 -15.276 1.00 0.00 H new ATOM 0 HA SER A 71 5.018 26.053 -17.753 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.754 28.421 -17.939 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.645 28.065 -16.227 1.00 0.00 H new ATOM 0 HG SER A 71 6.050 29.858 -16.663 1.00 0.00 H new ATOM 1076 N PHE A 72 6.711 27.306 -19.504 1.00 0.00 N ATOM 1077 CA PHE A 72 7.712 27.408 -20.560 1.00 0.00 C ATOM 1078 C PHE A 72 8.042 28.868 -20.857 1.00 0.00 C ATOM 1079 O PHE A 72 7.306 29.775 -20.467 1.00 0.00 O ATOM 1080 CB PHE A 72 7.216 26.717 -21.832 1.00 0.00 C ATOM 1081 CG PHE A 72 7.046 25.232 -21.679 1.00 0.00 C ATOM 1082 CD1 PHE A 72 5.952 24.712 -21.005 1.00 0.00 C ATOM 1083 CD2 PHE A 72 7.978 24.357 -22.211 1.00 0.00 C ATOM 1084 CE1 PHE A 72 5.794 23.347 -20.863 1.00 0.00 C ATOM 1085 CE2 PHE A 72 7.825 22.990 -22.072 1.00 0.00 C ATOM 1086 CZ PHE A 72 6.731 22.484 -21.398 1.00 0.00 C ATOM 0 H PHE A 72 5.818 27.746 -19.726 1.00 0.00 H new ATOM 0 HA PHE A 72 8.619 26.911 -20.215 1.00 0.00 H new ATOM 0 HB2 PHE A 72 6.263 27.156 -22.126 1.00 0.00 H new ATOM 0 HB3 PHE A 72 7.920 26.913 -22.641 1.00 0.00 H new ATOM 0 HD1 PHE A 72 5.215 25.381 -20.586 1.00 0.00 H new ATOM 0 HD2 PHE A 72 8.835 24.747 -22.741 1.00 0.00 H new ATOM 0 HE1 PHE A 72 4.938 22.955 -20.334 1.00 0.00 H new ATOM 0 HE2 PHE A 72 8.560 22.319 -22.490 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.608 21.417 -21.289 1.00 0.00 H new ATOM 1096 N LYS A 73 9.154 29.088 -21.550 1.00 0.00 N ATOM 1097 CA LYS A 73 9.583 30.436 -21.901 1.00 0.00 C ATOM 1098 C LYS A 73 8.774 30.976 -23.076 1.00 0.00 C ATOM 1099 O LYS A 73 8.841 32.163 -23.394 1.00 0.00 O ATOM 1100 CB LYS A 73 11.074 30.445 -22.248 1.00 0.00 C ATOM 1101 CG LYS A 73 11.921 29.603 -21.309 1.00 0.00 C ATOM 1102 CD LYS A 73 12.365 30.399 -20.093 1.00 0.00 C ATOM 1103 CE LYS A 73 13.552 31.293 -20.414 1.00 0.00 C ATOM 1104 NZ LYS A 73 13.956 32.121 -19.244 1.00 0.00 N ATOM 0 H LYS A 73 9.775 28.349 -21.880 1.00 0.00 H new ATOM 0 HA LYS A 73 9.413 31.080 -21.039 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.204 30.080 -23.267 1.00 0.00 H new ATOM 0 HB3 LYS A 73 11.437 31.473 -22.229 1.00 0.00 H new ATOM 0 HG2 LYS A 73 11.351 28.732 -20.986 1.00 0.00 H new ATOM 0 HG3 LYS A 73 12.797 29.232 -21.842 1.00 0.00 H new ATOM 0 HD2 LYS A 73 11.536 31.009 -19.734 1.00 0.00 H new ATOM 0 HD3 LYS A 73 12.631 29.715 -19.287 1.00 0.00 H new ATOM 0 HE2 LYS A 73 14.394 30.678 -20.732 1.00 0.00 H new ATOM 0 HE3 LYS A 73 13.300 31.945 -21.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 14.768 32.716 -19.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 13.161 32.727 -18.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 14.221 31.499 -18.454 1.00 0.00 H new ATOM 1118 N ALA A 74 8.011 30.097 -23.716 1.00 0.00 N ATOM 1119 CA ALA A 74 7.186 30.486 -24.854 1.00 0.00 C ATOM 1120 C ALA A 74 5.937 29.617 -24.949 1.00 0.00 C ATOM 1121 O ALA A 74 5.796 28.632 -24.225 1.00 0.00 O ATOM 1122 CB ALA A 74 7.991 30.401 -26.142 1.00 0.00 C ATOM 0 H ALA A 74 7.947 29.110 -23.466 1.00 0.00 H new ATOM 0 HA ALA A 74 6.867 31.518 -24.705 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.363 30.694 -26.983 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.849 31.070 -26.079 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.338 29.378 -26.287 1.00 0.00 H new ATOM 1128 N LYS A 75 5.031 29.989 -25.847 1.00 0.00 N ATOM 1129 CA LYS A 75 3.792 29.244 -26.039 1.00 0.00 C ATOM 1130 C LYS A 75 4.051 27.944 -26.794 1.00 0.00 C ATOM 1131 O LYS A 75 3.677 26.864 -26.336 1.00 0.00 O ATOM 1132 CB LYS A 75 2.774 30.094 -26.801 1.00 0.00 C ATOM 1133 CG LYS A 75 1.371 29.511 -26.798 1.00 0.00 C ATOM 1134 CD LYS A 75 0.732 29.603 -25.422 1.00 0.00 C ATOM 1135 CE LYS A 75 -0.012 30.917 -25.240 1.00 0.00 C ATOM 1136 NZ LYS A 75 0.897 32.090 -25.356 1.00 0.00 N ATOM 0 H LYS A 75 5.132 30.803 -26.454 1.00 0.00 H new ATOM 0 HA LYS A 75 3.388 28.999 -25.056 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.745 31.091 -26.362 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.108 30.209 -27.832 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.754 30.042 -27.523 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.408 28.468 -27.114 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.042 28.771 -25.284 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.501 29.510 -24.655 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.801 30.994 -25.988 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.496 30.928 -24.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.428 32.932 -24.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.772 31.905 -24.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.126 32.254 -26.357 1.00 0.00 H new ATOM 1150 N TYR A 76 4.693 28.055 -27.952 1.00 0.00 N ATOM 1151 CA TYR A 76 5.000 26.889 -28.771 1.00 0.00 C ATOM 1152 C TYR A 76 5.767 25.844 -27.965 1.00 0.00 C ATOM 1153 O TYR A 76 5.650 24.644 -28.211 1.00 0.00 O ATOM 1154 CB TYR A 76 5.815 27.301 -29.998 1.00 0.00 C ATOM 1155 CG TYR A 76 7.257 27.632 -29.684 1.00 0.00 C ATOM 1156 CD1 TYR A 76 7.627 28.912 -29.291 1.00 0.00 C ATOM 1157 CD2 TYR A 76 8.249 26.664 -29.780 1.00 0.00 C ATOM 1158 CE1 TYR A 76 8.943 29.219 -29.004 1.00 0.00 C ATOM 1159 CE2 TYR A 76 9.567 26.961 -29.494 1.00 0.00 C ATOM 1160 CZ TYR A 76 9.909 28.240 -29.107 1.00 0.00 C ATOM 1161 OH TYR A 76 11.221 28.541 -28.821 1.00 0.00 O ATOM 0 H TYR A 76 5.011 28.941 -28.344 1.00 0.00 H new ATOM 0 HA TYR A 76 4.058 26.450 -29.100 1.00 0.00 H new ATOM 0 HB2 TYR A 76 5.787 26.494 -30.730 1.00 0.00 H new ATOM 0 HB3 TYR A 76 5.345 28.168 -30.462 1.00 0.00 H new ATOM 0 HD1 TYR A 76 6.873 29.681 -29.208 1.00 0.00 H new ATOM 0 HD2 TYR A 76 7.985 25.662 -30.084 1.00 0.00 H new ATOM 0 HE1 TYR A 76 9.214 30.220 -28.701 1.00 0.00 H new ATOM 0 HE2 TYR A 76 10.326 26.196 -29.573 1.00 0.00 H new ATOM 0 HH TYR A 76 11.254 29.253 -28.148 1.00 0.00 H new ATOM 1171 N LYS A 77 6.552 26.311 -27.000 1.00 0.00 N ATOM 1172 CA LYS A 77 7.338 25.419 -26.155 1.00 0.00 C ATOM 1173 C LYS A 77 6.431 24.530 -25.311 1.00 0.00 C ATOM 1174 O LYS A 77 6.696 23.339 -25.140 1.00 0.00 O ATOM 1175 CB LYS A 77 8.264 26.230 -25.245 1.00 0.00 C ATOM 1176 CG LYS A 77 9.312 27.028 -26.001 1.00 0.00 C ATOM 1177 CD LYS A 77 10.220 26.124 -26.818 1.00 0.00 C ATOM 1178 CE LYS A 77 10.941 25.115 -25.936 1.00 0.00 C ATOM 1179 NZ LYS A 77 11.485 25.746 -24.702 1.00 0.00 N ATOM 0 H LYS A 77 6.661 27.302 -26.783 1.00 0.00 H new ATOM 0 HA LYS A 77 7.941 24.783 -26.803 1.00 0.00 H new ATOM 0 HB2 LYS A 77 7.663 26.913 -24.644 1.00 0.00 H new ATOM 0 HB3 LYS A 77 8.764 25.553 -24.553 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.820 27.743 -26.661 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.910 27.604 -25.296 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.631 25.597 -27.569 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.951 26.729 -27.354 1.00 0.00 H new ATOM 0 HE2 LYS A 77 10.253 24.315 -25.662 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.754 24.657 -26.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.301 25.198 -24.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.786 26.719 -24.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 10.749 25.763 -23.967 1.00 0.00 H new ATOM 1193 N LEU A 78 5.359 25.114 -24.787 1.00 0.00 N ATOM 1194 CA LEU A 78 4.411 24.373 -23.962 1.00 0.00 C ATOM 1195 C LEU A 78 3.489 23.518 -24.825 1.00 0.00 C ATOM 1196 O LEU A 78 3.387 22.307 -24.632 1.00 0.00 O ATOM 1197 CB LEU A 78 3.582 25.338 -23.112 1.00 0.00 C ATOM 1198 CG LEU A 78 2.282 24.777 -22.534 1.00 0.00 C ATOM 1199 CD1 LEU A 78 2.548 23.483 -21.780 1.00 0.00 C ATOM 1200 CD2 LEU A 78 1.618 25.800 -21.624 1.00 0.00 C ATOM 0 H LEU A 78 5.125 26.098 -24.919 1.00 0.00 H new ATOM 0 HA LEU A 78 4.978 23.713 -23.305 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.202 25.688 -22.287 1.00 0.00 H new ATOM 0 HB3 LEU A 78 3.339 26.210 -23.720 1.00 0.00 H new ATOM 0 HG LEU A 78 1.604 24.560 -23.359 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.612 23.098 -21.376 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.979 22.748 -22.460 1.00 0.00 H new ATOM 0 HD13 LEU A 78 3.244 23.674 -20.964 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.694 25.384 -21.222 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.291 26.049 -20.804 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.392 26.701 -22.194 1.00 0.00 H new ATOM 1212 N VAL A 79 2.820 24.157 -25.780 1.00 0.00 N ATOM 1213 CA VAL A 79 1.909 23.455 -26.676 1.00 0.00 C ATOM 1214 C VAL A 79 2.523 22.150 -27.171 1.00 0.00 C ATOM 1215 O VAL A 79 1.879 21.102 -27.148 1.00 0.00 O ATOM 1216 CB VAL A 79 1.534 24.326 -27.890 1.00 0.00 C ATOM 1217 CG1 VAL A 79 0.882 23.480 -28.973 1.00 0.00 C ATOM 1218 CG2 VAL A 79 0.617 25.463 -27.466 1.00 0.00 C ATOM 0 H VAL A 79 2.892 25.160 -25.953 1.00 0.00 H new ATOM 0 HA VAL A 79 1.008 23.235 -26.103 1.00 0.00 H new ATOM 0 HB VAL A 79 2.446 24.759 -28.301 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.624 24.112 -29.823 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.576 22.704 -29.296 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.022 23.017 -28.578 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.362 26.068 -28.336 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.294 25.053 -27.030 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.125 26.084 -26.728 1.00 0.00 H new ATOM 1228 N ASN A 80 3.772 22.222 -27.619 1.00 0.00 N ATOM 1229 CA ASN A 80 4.473 21.045 -28.121 1.00 0.00 C ATOM 1230 C ASN A 80 4.655 20.009 -27.016 1.00 0.00 C ATOM 1231 O ASN A 80 4.555 18.805 -27.256 1.00 0.00 O ATOM 1232 CB ASN A 80 5.836 21.443 -28.692 1.00 0.00 C ATOM 1233 CG ASN A 80 6.865 20.338 -28.553 1.00 0.00 C ATOM 1234 OD1 ASN A 80 6.573 19.168 -28.799 1.00 0.00 O ATOM 1235 ND2 ASN A 80 8.078 20.706 -28.156 1.00 0.00 N ATOM 0 H ASN A 80 4.320 23.082 -27.645 1.00 0.00 H new ATOM 0 HA ASN A 80 3.869 20.603 -28.914 1.00 0.00 H new ATOM 0 HB2 ASN A 80 5.724 21.702 -29.745 1.00 0.00 H new ATOM 0 HB3 ASN A 80 6.195 22.336 -28.181 1.00 0.00 H new ATOM 0 HD21 ASN A 80 8.812 20.007 -28.044 1.00 0.00 H new ATOM 0 HD22 ASN A 80 8.275 21.688 -27.963 1.00 0.00 H new ATOM 1242 N HIS A 81 4.922 20.484 -25.804 1.00 0.00 N ATOM 1243 CA HIS A 81 5.116 19.599 -24.661 1.00 0.00 C ATOM 1244 C HIS A 81 3.855 18.787 -24.382 1.00 0.00 C ATOM 1245 O HIS A 81 3.930 17.637 -23.947 1.00 0.00 O ATOM 1246 CB HIS A 81 5.500 20.409 -23.422 1.00 0.00 C ATOM 1247 CG HIS A 81 4.989 19.823 -22.142 1.00 0.00 C ATOM 1248 ND1 HIS A 81 5.582 18.746 -21.517 1.00 0.00 N ATOM 1249 CD2 HIS A 81 3.934 20.171 -21.368 1.00 0.00 C ATOM 1250 CE1 HIS A 81 4.913 18.456 -20.415 1.00 0.00 C ATOM 1251 NE2 HIS A 81 3.909 19.306 -20.301 1.00 0.00 N ATOM 0 H HIS A 81 5.009 21.477 -25.588 1.00 0.00 H new ATOM 0 HA HIS A 81 5.925 18.909 -24.900 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.586 20.484 -23.369 1.00 0.00 H new ATOM 0 HB3 HIS A 81 5.115 21.423 -23.527 1.00 0.00 H new ATOM 0 HD1 HIS A 81 6.408 18.251 -21.853 1.00 0.00 H new ATOM 0 HD2 HIS A 81 3.241 20.978 -21.555 1.00 0.00 H new ATOM 0 HE1 HIS A 81 5.148 17.659 -19.725 1.00 0.00 H new ATOM 1259 N ILE A 82 2.700 19.392 -24.634 1.00 0.00 N ATOM 1260 CA ILE A 82 1.424 18.725 -24.410 1.00 0.00 C ATOM 1261 C ILE A 82 1.275 17.506 -25.314 1.00 0.00 C ATOM 1262 O ILE A 82 0.631 16.522 -24.946 1.00 0.00 O ATOM 1263 CB ILE A 82 0.239 19.678 -24.654 1.00 0.00 C ATOM 1264 CG1 ILE A 82 0.514 21.042 -24.017 1.00 0.00 C ATOM 1265 CG2 ILE A 82 -1.046 19.079 -24.101 1.00 0.00 C ATOM 1266 CD1 ILE A 82 -0.703 21.938 -23.958 1.00 0.00 C ATOM 0 H ILE A 82 2.621 20.343 -24.994 1.00 0.00 H new ATOM 0 HA ILE A 82 1.414 18.406 -23.368 1.00 0.00 H new ATOM 0 HB ILE A 82 0.119 19.817 -25.728 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.894 20.892 -23.006 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.299 21.546 -24.581 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.874 19.765 -24.281 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.247 18.129 -24.596 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.939 18.914 -23.029 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.434 22.887 -23.495 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -1.071 22.119 -24.968 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.482 21.455 -23.369 1.00 0.00 H new ATOM 1278 N ARG A 83 1.875 17.576 -26.497 1.00 0.00 N ATOM 1279 CA ARG A 83 1.810 16.478 -27.454 1.00 0.00 C ATOM 1280 C ARG A 83 2.419 15.208 -26.866 1.00 0.00 C ATOM 1281 O ARG A 83 2.212 14.111 -27.384 1.00 0.00 O ATOM 1282 CB ARG A 83 2.539 16.855 -28.745 1.00 0.00 C ATOM 1283 CG ARG A 83 2.163 18.229 -29.278 1.00 0.00 C ATOM 1284 CD ARG A 83 0.659 18.368 -29.447 1.00 0.00 C ATOM 1285 NE ARG A 83 0.081 17.234 -30.163 1.00 0.00 N ATOM 1286 CZ ARG A 83 0.092 17.116 -31.486 1.00 0.00 C ATOM 1287 NH1 ARG A 83 0.650 18.058 -32.234 1.00 0.00 N ATOM 1288 NH2 ARG A 83 -0.454 16.054 -32.063 1.00 0.00 N ATOM 0 H ARG A 83 2.412 18.382 -26.816 1.00 0.00 H new ATOM 0 HA ARG A 83 0.761 16.287 -27.679 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.614 16.825 -28.567 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.321 16.107 -29.507 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.526 18.997 -28.595 1.00 0.00 H new ATOM 0 HG3 ARG A 83 2.655 18.396 -30.236 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.191 18.454 -28.467 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.439 19.288 -29.988 1.00 0.00 H new ATOM 0 HE ARG A 83 -0.355 16.491 -29.617 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.072 18.876 -31.794 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.657 17.965 -33.250 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.883 15.327 -31.491 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.445 15.964 -33.079 1.00 0.00 H new ATOM 1302 N VAL A 84 3.171 15.366 -25.782 1.00 0.00 N ATOM 1303 CA VAL A 84 3.809 14.233 -25.123 1.00 0.00 C ATOM 1304 C VAL A 84 2.839 13.524 -24.185 1.00 0.00 C ATOM 1305 O VAL A 84 3.117 12.427 -23.699 1.00 0.00 O ATOM 1306 CB VAL A 84 5.049 14.674 -24.323 1.00 0.00 C ATOM 1307 CG1 VAL A 84 5.905 15.625 -25.146 1.00 0.00 C ATOM 1308 CG2 VAL A 84 4.634 15.319 -23.009 1.00 0.00 C ATOM 0 H VAL A 84 3.353 16.268 -25.341 1.00 0.00 H new ATOM 0 HA VAL A 84 4.119 13.544 -25.909 1.00 0.00 H new ATOM 0 HB VAL A 84 5.646 13.791 -24.095 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.776 15.926 -24.564 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.232 15.124 -26.057 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.321 16.507 -25.407 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.523 15.624 -22.457 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.015 16.193 -23.212 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.066 14.602 -22.415 1.00 0.00 H new ATOM 1318 N HIS A 85 1.697 14.158 -23.934 1.00 0.00 N ATOM 1319 CA HIS A 85 0.683 13.588 -23.054 1.00 0.00 C ATOM 1320 C HIS A 85 -0.386 12.856 -23.860 1.00 0.00 C ATOM 1321 O HIS A 85 -1.205 12.124 -23.304 1.00 0.00 O ATOM 1322 CB HIS A 85 0.038 14.685 -22.206 1.00 0.00 C ATOM 1323 CG HIS A 85 1.003 15.389 -21.303 1.00 0.00 C ATOM 1324 ND1 HIS A 85 1.829 14.726 -20.420 1.00 0.00 N ATOM 1325 CD2 HIS A 85 1.273 16.707 -21.151 1.00 0.00 C ATOM 1326 CE1 HIS A 85 2.563 15.606 -19.762 1.00 0.00 C ATOM 1327 NE2 HIS A 85 2.245 16.815 -20.188 1.00 0.00 N ATOM 0 H HIS A 85 1.451 15.066 -24.328 1.00 0.00 H new ATOM 0 HA HIS A 85 1.171 12.870 -22.395 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.429 15.416 -22.866 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.757 14.247 -21.603 1.00 0.00 H new ATOM 0 HD1 HIS A 85 1.867 13.714 -20.294 1.00 0.00 H new ATOM 0 HD2 HIS A 85 0.810 17.522 -21.688 1.00 0.00 H new ATOM 0 HE1 HIS A 85 3.298 15.376 -19.005 1.00 0.00 H new ATOM 1335 N THR A 86 -0.373 13.059 -25.173 1.00 0.00 N ATOM 1336 CA THR A 86 -1.342 12.421 -26.055 1.00 0.00 C ATOM 1337 C THR A 86 -0.983 10.960 -26.300 1.00 0.00 C ATOM 1338 O THR A 86 -1.598 10.056 -25.735 1.00 0.00 O ATOM 1339 CB THR A 86 -1.434 13.149 -27.410 1.00 0.00 C ATOM 1340 OG1 THR A 86 -0.132 13.573 -27.827 1.00 0.00 O ATOM 1341 CG2 THR A 86 -2.359 14.353 -27.315 1.00 0.00 C ATOM 0 H THR A 86 0.299 13.661 -25.650 1.00 0.00 H new ATOM 0 HA THR A 86 -2.309 12.477 -25.555 1.00 0.00 H new ATOM 0 HB THR A 86 -1.842 12.454 -28.144 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.199 14.034 -28.689 1.00 0.00 H new ATOM 0 HG21 THR A 86 -2.408 14.851 -28.283 1.00 0.00 H new ATOM 0 HG22 THR A 86 -3.357 14.023 -27.025 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.976 15.048 -26.568 1.00 0.00 H new ATOM 1349 N GLY A 87 0.018 10.734 -27.146 1.00 0.00 N ATOM 1350 CA GLY A 87 0.441 9.380 -27.450 1.00 0.00 C ATOM 1351 C GLY A 87 0.995 8.659 -26.237 1.00 0.00 C ATOM 1352 O GLY A 87 1.396 7.499 -26.326 1.00 0.00 O ATOM 0 H GLY A 87 0.543 11.465 -27.626 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -0.405 8.819 -27.847 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.201 9.407 -28.231 1.00 0.00 H new ATOM 1356 N GLU A 88 1.018 9.349 -25.101 1.00 0.00 N ATOM 1357 CA GLU A 88 1.530 8.767 -23.865 1.00 0.00 C ATOM 1358 C GLU A 88 0.619 7.646 -23.374 1.00 0.00 C ATOM 1359 O GLU A 88 -0.592 7.670 -23.598 1.00 0.00 O ATOM 1360 CB GLU A 88 1.661 9.843 -22.785 1.00 0.00 C ATOM 1361 CG GLU A 88 2.898 9.686 -21.917 1.00 0.00 C ATOM 1362 CD GLU A 88 4.127 10.326 -22.532 1.00 0.00 C ATOM 1363 OE1 GLU A 88 4.416 10.042 -23.714 1.00 0.00 O ATOM 1364 OE2 GLU A 88 4.800 11.111 -21.832 1.00 0.00 O ATOM 0 H GLU A 88 0.689 10.310 -25.011 1.00 0.00 H new ATOM 0 HA GLU A 88 2.515 8.348 -24.071 1.00 0.00 H new ATOM 0 HB2 GLU A 88 1.684 10.823 -23.261 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.776 9.818 -22.149 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.711 10.132 -20.940 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.089 8.626 -21.752 1.00 0.00 H new ATOM 1371 N LYS A 89 1.209 6.663 -22.703 1.00 0.00 N ATOM 1372 CA LYS A 89 0.454 5.532 -22.178 1.00 0.00 C ATOM 1373 C LYS A 89 0.085 5.755 -20.715 1.00 0.00 C ATOM 1374 O LYS A 89 0.688 6.570 -20.015 1.00 0.00 O ATOM 1375 CB LYS A 89 1.263 4.241 -22.320 1.00 0.00 C ATOM 1376 CG LYS A 89 0.815 3.366 -23.477 1.00 0.00 C ATOM 1377 CD LYS A 89 1.993 2.916 -24.325 1.00 0.00 C ATOM 1378 CE LYS A 89 1.803 1.496 -24.835 1.00 0.00 C ATOM 1379 NZ LYS A 89 1.113 1.468 -26.154 1.00 0.00 N ATOM 0 H LYS A 89 2.210 6.627 -22.510 1.00 0.00 H new ATOM 0 HA LYS A 89 -0.465 5.442 -22.756 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.315 4.494 -22.453 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.187 3.671 -21.394 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.289 2.493 -23.091 1.00 0.00 H new ATOM 0 HG3 LYS A 89 0.108 3.916 -24.098 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.114 3.594 -25.170 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.909 2.973 -23.737 1.00 0.00 H new ATOM 0 HE2 LYS A 89 2.774 1.009 -24.923 1.00 0.00 H new ATOM 0 HE3 LYS A 89 1.224 0.924 -24.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 0.603 0.568 -26.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 0.438 2.257 -26.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 1.816 1.560 -26.915 1.00 0.00 H new ATOM 1393 N PRO A 90 -0.928 5.016 -20.239 1.00 0.00 N ATOM 1394 CA PRO A 90 -1.397 5.115 -18.854 1.00 0.00 C ATOM 1395 C PRO A 90 -0.389 4.552 -17.858 1.00 0.00 C ATOM 1396 O PRO A 90 -0.017 5.218 -16.893 1.00 0.00 O ATOM 1397 CB PRO A 90 -2.677 4.274 -18.853 1.00 0.00 C ATOM 1398 CG PRO A 90 -2.495 3.305 -19.969 1.00 0.00 C ATOM 1399 CD PRO A 90 -1.692 4.026 -21.017 1.00 0.00 C ATOM 0 HA PRO A 90 -1.550 6.150 -18.548 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -2.812 3.760 -17.901 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -3.559 4.895 -19.008 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -1.976 2.409 -19.627 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -3.457 2.983 -20.367 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -1.034 3.346 -21.558 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -2.334 4.505 -21.757 1.00 0.00 H new ATOM 1407 N PHE A 91 0.050 3.321 -18.100 1.00 0.00 N ATOM 1408 CA PHE A 91 1.015 2.668 -17.223 1.00 0.00 C ATOM 1409 C PHE A 91 1.773 1.573 -17.969 1.00 0.00 C ATOM 1410 O PHE A 91 1.204 0.812 -18.752 1.00 0.00 O ATOM 1411 CB PHE A 91 0.308 2.073 -16.003 1.00 0.00 C ATOM 1412 CG PHE A 91 -1.171 1.896 -16.195 1.00 0.00 C ATOM 1413 CD1 PHE A 91 -1.670 1.349 -17.366 1.00 0.00 C ATOM 1414 CD2 PHE A 91 -2.062 2.276 -15.205 1.00 0.00 C ATOM 1415 CE1 PHE A 91 -3.031 1.185 -17.545 1.00 0.00 C ATOM 1416 CE2 PHE A 91 -3.424 2.114 -15.378 1.00 0.00 C ATOM 1417 CZ PHE A 91 -3.909 1.567 -16.550 1.00 0.00 C ATOM 0 H PHE A 91 -0.247 2.756 -18.896 1.00 0.00 H new ATOM 0 HA PHE A 91 1.731 3.419 -16.889 1.00 0.00 H new ATOM 0 HB2 PHE A 91 0.754 1.106 -15.770 1.00 0.00 H new ATOM 0 HB3 PHE A 91 0.480 2.719 -15.142 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -0.988 1.047 -18.148 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -1.688 2.704 -14.287 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.407 0.758 -18.463 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -4.108 2.415 -14.598 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.972 1.438 -16.688 1.00 0.00 H new ATOM 1427 N PRO A 92 3.089 1.492 -17.722 1.00 0.00 N ATOM 1428 CA PRO A 92 3.954 0.495 -18.359 1.00 0.00 C ATOM 1429 C PRO A 92 3.674 -0.919 -17.861 1.00 0.00 C ATOM 1430 O PRO A 92 2.633 -1.181 -17.258 1.00 0.00 O ATOM 1431 CB PRO A 92 5.362 0.936 -17.953 1.00 0.00 C ATOM 1432 CG PRO A 92 5.171 1.691 -16.683 1.00 0.00 C ATOM 1433 CD PRO A 92 3.833 2.367 -16.800 1.00 0.00 C ATOM 0 HA PRO A 92 3.800 0.452 -19.437 1.00 0.00 H new ATOM 0 HB2 PRO A 92 6.019 0.078 -17.809 1.00 0.00 H new ATOM 0 HB3 PRO A 92 5.818 1.561 -18.721 1.00 0.00 H new ATOM 0 HG2 PRO A 92 5.196 1.021 -15.823 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.967 2.422 -16.540 1.00 0.00 H new ATOM 0 HD2 PRO A 92 3.337 2.446 -15.833 1.00 0.00 H new ATOM 0 HD3 PRO A 92 3.927 3.379 -17.194 1.00 0.00 H new ATOM 1441 N CYS A 93 4.609 -1.827 -18.117 1.00 0.00 N ATOM 1442 CA CYS A 93 4.463 -3.215 -17.695 1.00 0.00 C ATOM 1443 C CYS A 93 5.064 -3.428 -16.308 1.00 0.00 C ATOM 1444 O CYS A 93 6.172 -2.984 -16.010 1.00 0.00 O ATOM 1445 CB CYS A 93 5.136 -4.150 -18.703 1.00 0.00 C ATOM 1446 SG CYS A 93 4.974 -5.919 -18.299 1.00 0.00 S ATOM 0 H CYS A 93 5.476 -1.627 -18.615 1.00 0.00 H new ATOM 0 HA CYS A 93 3.398 -3.445 -17.650 1.00 0.00 H new ATOM 0 HB2 CYS A 93 4.707 -3.973 -19.689 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.195 -3.898 -18.766 1.00 0.00 H new ATOM 1451 N PRO A 94 4.315 -4.125 -15.440 1.00 0.00 N ATOM 1452 CA PRO A 94 4.753 -4.414 -14.071 1.00 0.00 C ATOM 1453 C PRO A 94 5.905 -5.411 -14.030 1.00 0.00 C ATOM 1454 O PRO A 94 6.378 -5.785 -12.956 1.00 0.00 O ATOM 1455 CB PRO A 94 3.504 -5.011 -13.418 1.00 0.00 C ATOM 1456 CG PRO A 94 2.720 -5.581 -14.550 1.00 0.00 C ATOM 1457 CD PRO A 94 2.984 -4.685 -15.729 1.00 0.00 C ATOM 0 HA PRO A 94 5.130 -3.524 -13.567 1.00 0.00 H new ATOM 0 HB2 PRO A 94 3.766 -5.780 -12.691 1.00 0.00 H new ATOM 0 HB3 PRO A 94 2.934 -4.250 -12.885 1.00 0.00 H new ATOM 0 HG2 PRO A 94 3.028 -6.605 -14.761 1.00 0.00 H new ATOM 0 HG3 PRO A 94 1.657 -5.610 -14.313 1.00 0.00 H new ATOM 0 HD2 PRO A 94 2.977 -5.241 -16.666 1.00 0.00 H new ATOM 0 HD3 PRO A 94 2.229 -3.903 -15.817 1.00 0.00 H new ATOM 1465 N PHE A 95 6.354 -5.840 -15.205 1.00 0.00 N ATOM 1466 CA PHE A 95 7.451 -6.796 -15.302 1.00 0.00 C ATOM 1467 C PHE A 95 8.783 -6.076 -15.494 1.00 0.00 C ATOM 1468 O PHE A 95 8.942 -5.238 -16.382 1.00 0.00 O ATOM 1469 CB PHE A 95 7.210 -7.765 -16.461 1.00 0.00 C ATOM 1470 CG PHE A 95 8.100 -8.974 -16.427 1.00 0.00 C ATOM 1471 CD1 PHE A 95 9.478 -8.838 -16.477 1.00 0.00 C ATOM 1472 CD2 PHE A 95 7.560 -10.247 -16.343 1.00 0.00 C ATOM 1473 CE1 PHE A 95 10.300 -9.949 -16.446 1.00 0.00 C ATOM 1474 CE2 PHE A 95 8.376 -11.362 -16.311 1.00 0.00 C ATOM 1475 CZ PHE A 95 9.748 -11.212 -16.362 1.00 0.00 C ATOM 0 H PHE A 95 5.975 -5.541 -16.103 1.00 0.00 H new ATOM 0 HA PHE A 95 7.493 -7.360 -14.370 1.00 0.00 H new ATOM 0 HB2 PHE A 95 6.169 -8.089 -16.442 1.00 0.00 H new ATOM 0 HB3 PHE A 95 7.363 -7.238 -17.403 1.00 0.00 H new ATOM 0 HD1 PHE A 95 9.915 -7.852 -16.541 1.00 0.00 H new ATOM 0 HD2 PHE A 95 6.488 -10.370 -16.302 1.00 0.00 H new ATOM 0 HE1 PHE A 95 11.373 -9.829 -16.487 1.00 0.00 H new ATOM 0 HE2 PHE A 95 7.942 -12.349 -16.246 1.00 0.00 H new ATOM 0 HZ PHE A 95 10.388 -12.081 -16.336 1.00 0.00 H new ATOM 1485 N PRO A 96 9.764 -6.411 -14.642 1.00 0.00 N ATOM 1486 CA PRO A 96 11.099 -5.809 -14.698 1.00 0.00 C ATOM 1487 C PRO A 96 11.884 -6.251 -15.928 1.00 0.00 C ATOM 1488 O PRO A 96 12.037 -7.445 -16.182 1.00 0.00 O ATOM 1489 CB PRO A 96 11.772 -6.321 -13.422 1.00 0.00 C ATOM 1490 CG PRO A 96 11.064 -7.594 -13.105 1.00 0.00 C ATOM 1491 CD PRO A 96 9.644 -7.402 -13.560 1.00 0.00 C ATOM 0 HA PRO A 96 11.053 -4.722 -14.766 1.00 0.00 H new ATOM 0 HB2 PRO A 96 12.838 -6.489 -13.576 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.677 -5.602 -12.608 1.00 0.00 H new ATOM 0 HG2 PRO A 96 11.528 -8.437 -13.618 1.00 0.00 H new ATOM 0 HG3 PRO A 96 11.106 -7.809 -12.037 1.00 0.00 H new ATOM 0 HD2 PRO A 96 9.206 -8.335 -13.916 1.00 0.00 H new ATOM 0 HD3 PRO A 96 9.009 -7.040 -12.752 1.00 0.00 H new ATOM 1499 N GLY A 97 12.380 -5.280 -16.689 1.00 0.00 N ATOM 1500 CA GLY A 97 13.143 -5.590 -17.883 1.00 0.00 C ATOM 1501 C GLY A 97 12.263 -5.765 -19.105 1.00 0.00 C ATOM 1502 O GLY A 97 12.760 -5.947 -20.217 1.00 0.00 O ATOM 0 H GLY A 97 12.267 -4.284 -16.499 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.862 -4.792 -18.068 1.00 0.00 H new ATOM 0 HA3 GLY A 97 13.715 -6.503 -17.718 1.00 0.00 H new ATOM 1506 N CYS A 98 10.951 -5.712 -18.899 1.00 0.00 N ATOM 1507 CA CYS A 98 9.999 -5.868 -19.992 1.00 0.00 C ATOM 1508 C CYS A 98 9.819 -4.555 -20.748 1.00 0.00 C ATOM 1509 O CYS A 98 9.492 -4.549 -21.934 1.00 0.00 O ATOM 1510 CB CYS A 98 8.649 -6.349 -19.455 1.00 0.00 C ATOM 1511 SG CYS A 98 7.488 -6.897 -20.747 1.00 0.00 S ATOM 0 H CYS A 98 10.523 -5.562 -17.985 1.00 0.00 H new ATOM 0 HA CYS A 98 10.395 -6.613 -20.682 1.00 0.00 H new ATOM 0 HB2 CYS A 98 8.819 -7.172 -18.761 1.00 0.00 H new ATOM 0 HB3 CYS A 98 8.188 -5.542 -18.886 1.00 0.00 H new ATOM 1516 N GLY A 99 10.035 -3.443 -20.052 1.00 0.00 N ATOM 1517 CA GLY A 99 9.892 -2.139 -20.673 1.00 0.00 C ATOM 1518 C GLY A 99 8.753 -2.095 -21.672 1.00 0.00 C ATOM 1519 O GLY A 99 8.791 -1.329 -22.636 1.00 0.00 O ATOM 0 H GLY A 99 10.307 -3.422 -19.069 1.00 0.00 H new ATOM 0 HA2 GLY A 99 9.723 -1.389 -19.901 1.00 0.00 H new ATOM 0 HA3 GLY A 99 10.823 -1.875 -21.176 1.00 0.00 H new ATOM 1523 N LYS A 100 7.736 -2.919 -21.444 1.00 0.00 N ATOM 1524 CA LYS A 100 6.580 -2.972 -22.332 1.00 0.00 C ATOM 1525 C LYS A 100 5.429 -2.139 -21.777 1.00 0.00 C ATOM 1526 O LYS A 100 5.251 -2.040 -20.562 1.00 0.00 O ATOM 1527 CB LYS A 100 6.127 -4.421 -22.527 1.00 0.00 C ATOM 1528 CG LYS A 100 4.789 -4.550 -23.234 1.00 0.00 C ATOM 1529 CD LYS A 100 4.912 -4.250 -24.719 1.00 0.00 C ATOM 1530 CE LYS A 100 3.920 -5.063 -25.536 1.00 0.00 C ATOM 1531 NZ LYS A 100 4.317 -5.145 -26.968 1.00 0.00 N ATOM 0 H LYS A 100 7.689 -3.560 -20.652 1.00 0.00 H new ATOM 0 HA LYS A 100 6.874 -2.557 -23.296 1.00 0.00 H new ATOM 0 HB2 LYS A 100 6.884 -4.956 -23.100 1.00 0.00 H new ATOM 0 HB3 LYS A 100 6.062 -4.907 -21.553 1.00 0.00 H new ATOM 0 HG2 LYS A 100 4.400 -5.559 -23.097 1.00 0.00 H new ATOM 0 HG3 LYS A 100 4.070 -3.867 -22.782 1.00 0.00 H new ATOM 0 HD2 LYS A 100 4.743 -3.187 -24.892 1.00 0.00 H new ATOM 0 HD3 LYS A 100 5.926 -4.469 -25.053 1.00 0.00 H new ATOM 0 HE2 LYS A 100 3.846 -6.068 -25.122 1.00 0.00 H new ATOM 0 HE3 LYS A 100 2.930 -4.613 -25.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 3.616 -5.707 -27.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 4.363 -4.187 -27.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 5.250 -5.598 -27.044 1.00 0.00 H new ATOM 1545 N ILE A 101 4.650 -1.543 -22.673 1.00 0.00 N ATOM 1546 CA ILE A 101 3.515 -0.721 -22.272 1.00 0.00 C ATOM 1547 C ILE A 101 2.333 -0.919 -23.214 1.00 0.00 C ATOM 1548 O ILE A 101 2.510 -1.179 -24.404 1.00 0.00 O ATOM 1549 CB ILE A 101 3.886 0.774 -22.240 1.00 0.00 C ATOM 1550 CG1 ILE A 101 5.314 0.956 -21.721 1.00 0.00 C ATOM 1551 CG2 ILE A 101 2.900 1.546 -21.375 1.00 0.00 C ATOM 1552 CD1 ILE A 101 5.715 2.405 -21.553 1.00 0.00 C ATOM 0 H ILE A 101 4.784 -1.614 -23.682 1.00 0.00 H new ATOM 0 HA ILE A 101 3.234 -1.039 -21.268 1.00 0.00 H new ATOM 0 HB ILE A 101 3.835 1.168 -23.255 1.00 0.00 H new ATOM 0 HG12 ILE A 101 5.411 0.447 -20.762 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.007 0.473 -22.410 1.00 0.00 H new ATOM 0 HG21 ILE A 101 3.175 2.601 -21.362 1.00 0.00 H new ATOM 0 HG22 ILE A 101 1.895 1.438 -21.784 1.00 0.00 H new ATOM 0 HG23 ILE A 101 2.922 1.153 -20.359 1.00 0.00 H new ATOM 0 HD11 ILE A 101 6.739 2.459 -21.182 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.650 2.914 -22.515 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.045 2.888 -20.841 1.00 0.00 H new ATOM 1564 N PHE A 102 1.125 -0.794 -22.673 1.00 0.00 N ATOM 1565 CA PHE A 102 -0.088 -0.959 -23.465 1.00 0.00 C ATOM 1566 C PHE A 102 -1.056 0.196 -23.225 1.00 0.00 C ATOM 1567 O PHE A 102 -1.444 0.469 -22.089 1.00 0.00 O ATOM 1568 CB PHE A 102 -0.768 -2.287 -23.126 1.00 0.00 C ATOM 1569 CG PHE A 102 0.189 -3.441 -23.024 1.00 0.00 C ATOM 1570 CD1 PHE A 102 1.141 -3.482 -22.018 1.00 0.00 C ATOM 1571 CD2 PHE A 102 0.135 -4.485 -23.934 1.00 0.00 C ATOM 1572 CE1 PHE A 102 2.023 -4.542 -21.923 1.00 0.00 C ATOM 1573 CE2 PHE A 102 1.014 -5.548 -23.843 1.00 0.00 C ATOM 1574 CZ PHE A 102 1.958 -5.577 -22.836 1.00 0.00 C ATOM 0 H PHE A 102 0.961 -0.579 -21.690 1.00 0.00 H new ATOM 0 HA PHE A 102 0.194 -0.961 -24.518 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -1.301 -2.182 -22.181 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -1.513 -2.510 -23.889 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.194 -2.677 -21.300 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -0.602 -4.468 -24.723 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.762 -4.561 -21.136 1.00 0.00 H new ATOM 0 HE2 PHE A 102 0.962 -6.355 -24.559 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.645 -6.407 -22.762 1.00 0.00 H new ATOM 1584 N ALA A 103 -1.441 0.872 -24.303 1.00 0.00 N ATOM 1585 CA ALA A 103 -2.363 1.996 -24.210 1.00 0.00 C ATOM 1586 C ALA A 103 -3.719 1.551 -23.672 1.00 0.00 C ATOM 1587 O ALA A 103 -4.540 2.377 -23.273 1.00 0.00 O ATOM 1588 CB ALA A 103 -2.525 2.659 -25.570 1.00 0.00 C ATOM 0 H ALA A 103 -1.128 0.660 -25.250 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.944 2.721 -23.512 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.217 3.497 -25.486 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.557 3.021 -25.916 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -2.918 1.935 -26.283 1.00 0.00 H new ATOM 1594 N ARG A 104 -3.946 0.242 -23.663 1.00 0.00 N ATOM 1595 CA ARG A 104 -5.203 -0.312 -23.175 1.00 0.00 C ATOM 1596 C ARG A 104 -4.996 -1.050 -21.856 1.00 0.00 C ATOM 1597 O ARG A 104 -4.089 -1.872 -21.729 1.00 0.00 O ATOM 1598 CB ARG A 104 -5.804 -1.261 -24.214 1.00 0.00 C ATOM 1599 CG ARG A 104 -5.418 -0.922 -25.644 1.00 0.00 C ATOM 1600 CD ARG A 104 -6.456 -1.424 -26.636 1.00 0.00 C ATOM 1601 NE ARG A 104 -6.019 -1.255 -28.019 1.00 0.00 N ATOM 1602 CZ ARG A 104 -5.938 -0.076 -28.625 1.00 0.00 C ATOM 1603 NH1 ARG A 104 -6.262 1.032 -27.974 1.00 0.00 N ATOM 1604 NH2 ARG A 104 -5.531 -0.003 -29.886 1.00 0.00 N ATOM 0 H ARG A 104 -3.276 -0.455 -23.988 1.00 0.00 H new ATOM 0 HA ARG A 104 -5.894 0.514 -23.005 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -5.484 -2.279 -23.992 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -6.890 -1.242 -24.126 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -5.308 0.158 -25.746 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -4.449 -1.364 -25.875 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -6.659 -2.478 -26.446 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -7.392 -0.887 -26.484 1.00 0.00 H new ATOM 0 HE ARG A 104 -5.762 -2.088 -28.549 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -6.575 0.981 -27.004 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -6.199 1.936 -28.442 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -5.280 -0.853 -30.391 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -5.469 0.903 -30.350 1.00 0.00 H new ATOM 1618 N SER A 105 -5.844 -0.751 -20.877 1.00 0.00 N ATOM 1619 CA SER A 105 -5.752 -1.383 -19.566 1.00 0.00 C ATOM 1620 C SER A 105 -5.989 -2.886 -19.669 1.00 0.00 C ATOM 1621 O SER A 105 -5.320 -3.677 -19.006 1.00 0.00 O ATOM 1622 CB SER A 105 -6.765 -0.760 -18.604 1.00 0.00 C ATOM 1623 OG SER A 105 -6.483 0.611 -18.383 1.00 0.00 O ATOM 0 H SER A 105 -6.603 -0.075 -20.967 1.00 0.00 H new ATOM 0 HA SER A 105 -4.746 -1.218 -19.180 1.00 0.00 H new ATOM 0 HB2 SER A 105 -7.771 -0.867 -19.011 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.747 -1.296 -17.655 1.00 0.00 H new ATOM 0 HG SER A 105 -5.515 0.737 -18.300 1.00 0.00 H new ATOM 1629 N GLU A 106 -6.946 -3.272 -20.507 1.00 0.00 N ATOM 1630 CA GLU A 106 -7.273 -4.680 -20.697 1.00 0.00 C ATOM 1631 C GLU A 106 -6.095 -5.434 -21.308 1.00 0.00 C ATOM 1632 O GLU A 106 -5.901 -6.620 -21.047 1.00 0.00 O ATOM 1633 CB GLU A 106 -8.505 -4.825 -21.592 1.00 0.00 C ATOM 1634 CG GLU A 106 -8.774 -6.254 -22.032 1.00 0.00 C ATOM 1635 CD GLU A 106 -10.116 -6.411 -22.720 1.00 0.00 C ATOM 1636 OE1 GLU A 106 -11.137 -6.522 -22.008 1.00 0.00 O ATOM 1637 OE2 GLU A 106 -10.146 -6.423 -23.968 1.00 0.00 O ATOM 0 H GLU A 106 -7.508 -2.629 -21.065 1.00 0.00 H new ATOM 0 HA GLU A 106 -7.491 -5.111 -19.720 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -9.377 -4.448 -21.058 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -8.377 -4.200 -22.476 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -7.983 -6.576 -22.709 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -8.737 -6.911 -21.163 1.00 0.00 H new ATOM 1644 N ASN A 107 -5.313 -4.736 -22.125 1.00 0.00 N ATOM 1645 CA ASN A 107 -4.155 -5.338 -22.775 1.00 0.00 C ATOM 1646 C ASN A 107 -3.068 -5.667 -21.756 1.00 0.00 C ATOM 1647 O ASN A 107 -2.383 -6.684 -21.868 1.00 0.00 O ATOM 1648 CB ASN A 107 -3.598 -4.398 -23.846 1.00 0.00 C ATOM 1649 CG ASN A 107 -4.220 -4.639 -25.208 1.00 0.00 C ATOM 1650 OD1 ASN A 107 -5.373 -5.057 -25.310 1.00 0.00 O ATOM 1651 ND2 ASN A 107 -3.455 -4.377 -26.261 1.00 0.00 N ATOM 0 H ASN A 107 -5.460 -3.753 -22.353 1.00 0.00 H new ATOM 0 HA ASN A 107 -4.478 -6.266 -23.248 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.775 -3.365 -23.546 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.518 -4.529 -23.915 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.818 -4.521 -27.203 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.505 -4.032 -26.128 1.00 0.00 H new ATOM 1658 N LEU A 108 -2.916 -4.799 -20.761 1.00 0.00 N ATOM 1659 CA LEU A 108 -1.913 -4.996 -19.720 1.00 0.00 C ATOM 1660 C LEU A 108 -2.248 -6.215 -18.866 1.00 0.00 C ATOM 1661 O LEU A 108 -1.407 -7.090 -18.656 1.00 0.00 O ATOM 1662 CB LEU A 108 -1.815 -3.751 -18.837 1.00 0.00 C ATOM 1663 CG LEU A 108 -0.574 -3.655 -17.949 1.00 0.00 C ATOM 1664 CD1 LEU A 108 0.630 -4.271 -18.645 1.00 0.00 C ATOM 1665 CD2 LEU A 108 -0.294 -2.206 -17.579 1.00 0.00 C ATOM 0 H LEU A 108 -3.475 -3.952 -20.653 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.951 -5.167 -20.203 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.847 -2.871 -19.479 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.698 -3.712 -18.199 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.763 -4.214 -17.032 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.504 -4.193 -17.998 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.429 -5.321 -18.859 1.00 0.00 H new ATOM 0 HD13 LEU A 108 0.821 -3.741 -19.578 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.593 -2.157 -16.947 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -0.126 -1.625 -18.486 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -1.148 -1.797 -17.039 1.00 0.00 H new ATOM 1677 N LYS A 109 -3.482 -6.267 -18.377 1.00 0.00 N ATOM 1678 CA LYS A 109 -3.930 -7.380 -17.548 1.00 0.00 C ATOM 1679 C LYS A 109 -3.732 -8.710 -18.269 1.00 0.00 C ATOM 1680 O LYS A 109 -3.169 -9.652 -17.710 1.00 0.00 O ATOM 1681 CB LYS A 109 -5.404 -7.204 -17.176 1.00 0.00 C ATOM 1682 CG LYS A 109 -5.729 -5.832 -16.612 1.00 0.00 C ATOM 1683 CD LYS A 109 -6.981 -5.865 -15.750 1.00 0.00 C ATOM 1684 CE LYS A 109 -6.712 -6.518 -14.403 1.00 0.00 C ATOM 1685 NZ LYS A 109 -7.971 -6.771 -13.649 1.00 0.00 N ATOM 0 H LYS A 109 -4.190 -5.551 -18.540 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.330 -7.387 -16.638 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -6.017 -7.378 -18.061 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -5.678 -7.963 -16.443 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -4.888 -5.473 -16.019 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -5.868 -5.125 -17.430 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -7.346 -4.849 -15.597 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -7.768 -6.411 -16.270 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -6.184 -7.459 -14.555 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -6.057 -5.877 -13.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -7.746 -7.217 -12.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -8.463 -5.870 -13.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -8.585 -7.403 -14.201 1.00 0.00 H new ATOM 1699 N ILE A 110 -4.197 -8.779 -19.512 1.00 0.00 N ATOM 1700 CA ILE A 110 -4.069 -9.992 -20.309 1.00 0.00 C ATOM 1701 C ILE A 110 -2.604 -10.315 -20.587 1.00 0.00 C ATOM 1702 O ILE A 110 -2.243 -11.471 -20.805 1.00 0.00 O ATOM 1703 CB ILE A 110 -4.818 -9.868 -21.649 1.00 0.00 C ATOM 1704 CG1 ILE A 110 -6.326 -9.773 -21.408 1.00 0.00 C ATOM 1705 CG2 ILE A 110 -4.493 -11.050 -22.549 1.00 0.00 C ATOM 1706 CD1 ILE A 110 -7.098 -9.262 -22.603 1.00 0.00 C ATOM 0 H ILE A 110 -4.666 -8.009 -19.989 1.00 0.00 H new ATOM 0 HA ILE A 110 -4.513 -10.800 -19.727 1.00 0.00 H new ATOM 0 HB ILE A 110 -4.491 -8.956 -22.148 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -6.705 -10.758 -21.135 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -6.509 -9.115 -20.559 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -5.030 -10.948 -23.492 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -3.421 -11.076 -22.743 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.795 -11.975 -22.058 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -8.160 -9.221 -22.360 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -6.746 -8.264 -22.863 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -6.945 -9.932 -23.449 1.00 0.00 H new ATOM 1718 N HIS A 111 -1.764 -9.285 -20.575 1.00 0.00 N ATOM 1719 CA HIS A 111 -0.338 -9.458 -20.823 1.00 0.00 C ATOM 1720 C HIS A 111 0.383 -9.913 -19.557 1.00 0.00 C ATOM 1721 O HIS A 111 1.376 -10.638 -19.621 1.00 0.00 O ATOM 1722 CB HIS A 111 0.276 -8.154 -21.332 1.00 0.00 C ATOM 1723 CG HIS A 111 1.771 -8.188 -21.417 1.00 0.00 C ATOM 1724 ND1 HIS A 111 2.455 -8.969 -22.325 1.00 0.00 N ATOM 1725 CD2 HIS A 111 2.714 -7.531 -20.703 1.00 0.00 C ATOM 1726 CE1 HIS A 111 3.754 -8.791 -22.164 1.00 0.00 C ATOM 1727 NE2 HIS A 111 3.938 -7.923 -21.186 1.00 0.00 N ATOM 0 H HIS A 111 -2.047 -8.321 -20.396 1.00 0.00 H new ATOM 0 HA HIS A 111 -0.219 -10.228 -21.585 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -0.131 -7.932 -22.319 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -0.024 -7.339 -20.673 1.00 0.00 H new ATOM 0 HD1 HIS A 111 2.025 -9.587 -23.013 1.00 0.00 H new ATOM 0 HD2 HIS A 111 2.537 -6.829 -19.902 1.00 0.00 H new ATOM 0 HE1 HIS A 111 4.533 -9.273 -22.735 1.00 0.00 H new ATOM 1735 N LYS A 112 -0.124 -9.482 -18.407 1.00 0.00 N ATOM 1736 CA LYS A 112 0.469 -9.845 -17.125 1.00 0.00 C ATOM 1737 C LYS A 112 0.168 -11.299 -16.778 1.00 0.00 C ATOM 1738 O LYS A 112 1.004 -11.995 -16.201 1.00 0.00 O ATOM 1739 CB LYS A 112 -0.055 -8.926 -16.019 1.00 0.00 C ATOM 1740 CG LYS A 112 0.523 -7.522 -16.070 1.00 0.00 C ATOM 1741 CD LYS A 112 -0.456 -6.496 -15.523 1.00 0.00 C ATOM 1742 CE LYS A 112 -0.700 -6.698 -14.035 1.00 0.00 C ATOM 1743 NZ LYS A 112 -1.874 -7.577 -13.779 1.00 0.00 N ATOM 0 H LYS A 112 -0.945 -8.880 -18.336 1.00 0.00 H new ATOM 0 HA LYS A 112 1.549 -9.726 -17.206 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.141 -8.866 -16.092 1.00 0.00 H new ATOM 0 HB3 LYS A 112 0.175 -9.370 -15.050 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.448 -7.487 -15.494 1.00 0.00 H new ATOM 0 HG3 LYS A 112 0.779 -7.270 -17.099 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -0.068 -5.492 -15.696 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -1.401 -6.570 -16.061 1.00 0.00 H new ATOM 0 HE2 LYS A 112 0.188 -7.135 -13.578 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -0.860 -5.731 -13.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -2.278 -7.354 -12.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -2.593 -7.419 -14.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -1.573 -8.572 -13.797 1.00 0.00 H new ATOM 1757 N ARG A 113 -1.030 -11.752 -17.134 1.00 0.00 N ATOM 1758 CA ARG A 113 -1.440 -13.123 -16.860 1.00 0.00 C ATOM 1759 C ARG A 113 -0.483 -14.118 -17.511 1.00 0.00 C ATOM 1760 O ARG A 113 -0.193 -15.175 -16.950 1.00 0.00 O ATOM 1761 CB ARG A 113 -2.864 -13.363 -17.367 1.00 0.00 C ATOM 1762 CG ARG A 113 -3.099 -12.861 -18.782 1.00 0.00 C ATOM 1763 CD ARG A 113 -4.458 -13.295 -19.309 1.00 0.00 C ATOM 1764 NE ARG A 113 -5.546 -12.522 -18.715 1.00 0.00 N ATOM 1765 CZ ARG A 113 -6.804 -12.578 -19.140 1.00 0.00 C ATOM 1766 NH1 ARG A 113 -7.130 -13.365 -20.156 1.00 0.00 N ATOM 1767 NH2 ARG A 113 -7.738 -11.845 -18.548 1.00 0.00 N ATOM 0 H ARG A 113 -1.733 -11.189 -17.613 1.00 0.00 H new ATOM 0 HA ARG A 113 -1.415 -13.274 -15.781 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -3.079 -14.431 -17.329 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -3.568 -12.872 -16.695 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -3.031 -11.773 -18.799 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -2.315 -13.239 -19.438 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -4.481 -13.180 -20.393 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -4.608 -14.354 -19.098 1.00 0.00 H new ATOM 0 HE ARG A 113 -5.328 -11.906 -17.932 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -6.414 -13.930 -20.614 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.096 -13.406 -20.480 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -7.491 -11.238 -17.766 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -8.703 -11.888 -18.875 1.00 0.00 H new ATOM 1781 N THR A 114 0.004 -13.772 -18.698 1.00 0.00 N ATOM 1782 CA THR A 114 0.927 -14.634 -19.426 1.00 0.00 C ATOM 1783 C THR A 114 2.309 -14.627 -18.783 1.00 0.00 C ATOM 1784 O THR A 114 3.090 -15.564 -18.956 1.00 0.00 O ATOM 1785 CB THR A 114 1.056 -14.201 -20.899 1.00 0.00 C ATOM 1786 OG1 THR A 114 1.793 -15.184 -21.635 1.00 0.00 O ATOM 1787 CG2 THR A 114 1.752 -12.852 -21.008 1.00 0.00 C ATOM 0 H THR A 114 -0.225 -12.901 -19.176 1.00 0.00 H new ATOM 0 HA THR A 114 0.516 -15.643 -19.386 1.00 0.00 H new ATOM 0 HB THR A 114 0.054 -14.110 -21.317 1.00 0.00 H new ATOM 0 HG1 THR A 114 1.870 -14.903 -22.571 1.00 0.00 H new ATOM 0 HG21 THR A 114 1.832 -12.567 -22.057 1.00 0.00 H new ATOM 0 HG22 THR A 114 1.174 -12.100 -20.471 1.00 0.00 H new ATOM 0 HG23 THR A 114 2.750 -12.921 -20.574 1.00 0.00 H new ATOM 1795 N HIS A 115 2.606 -13.565 -18.040 1.00 0.00 N ATOM 1796 CA HIS A 115 3.895 -13.438 -17.370 1.00 0.00 C ATOM 1797 C HIS A 115 4.006 -14.427 -16.213 1.00 0.00 C ATOM 1798 O HIS A 115 5.063 -14.561 -15.595 1.00 0.00 O ATOM 1799 CB HIS A 115 4.088 -12.011 -16.857 1.00 0.00 C ATOM 1800 CG HIS A 115 4.792 -11.115 -17.829 1.00 0.00 C ATOM 1801 ND1 HIS A 115 5.938 -11.485 -18.499 1.00 0.00 N ATOM 1802 CD2 HIS A 115 4.505 -9.859 -18.243 1.00 0.00 C ATOM 1803 CE1 HIS A 115 6.327 -10.495 -19.283 1.00 0.00 C ATOM 1804 NE2 HIS A 115 5.474 -9.496 -19.146 1.00 0.00 N ATOM 0 H HIS A 115 1.972 -12.781 -17.887 1.00 0.00 H new ATOM 0 HA HIS A 115 4.677 -13.665 -18.094 1.00 0.00 H new ATOM 0 HB2 HIS A 115 3.113 -11.583 -16.622 1.00 0.00 H new ATOM 0 HB3 HIS A 115 4.656 -12.042 -15.927 1.00 0.00 H new ATOM 0 HD1 HIS A 115 6.412 -12.383 -18.404 1.00 0.00 H new ATOM 0 HD2 HIS A 115 3.669 -9.254 -17.923 1.00 0.00 H new ATOM 0 HE1 HIS A 115 7.195 -10.502 -19.926 1.00 0.00 H new ATOM 1812 N THR A 116 2.907 -15.117 -15.923 1.00 0.00 N ATOM 1813 CA THR A 116 2.879 -16.091 -14.839 1.00 0.00 C ATOM 1814 C THR A 116 3.570 -15.547 -13.594 1.00 0.00 C ATOM 1815 O THR A 116 4.135 -16.304 -12.805 1.00 0.00 O ATOM 1816 CB THR A 116 3.557 -17.411 -15.253 1.00 0.00 C ATOM 1817 OG1 THR A 116 3.626 -18.299 -14.132 1.00 0.00 O ATOM 1818 CG2 THR A 116 4.957 -17.155 -15.791 1.00 0.00 C ATOM 0 H THR A 116 2.024 -15.019 -16.424 1.00 0.00 H new ATOM 0 HA THR A 116 1.830 -16.284 -14.614 1.00 0.00 H new ATOM 0 HB THR A 116 2.960 -17.869 -16.042 1.00 0.00 H new ATOM 0 HG1 THR A 116 4.135 -17.875 -13.410 1.00 0.00 H new ATOM 0 HG21 THR A 116 5.416 -18.102 -16.077 1.00 0.00 H new ATOM 0 HG22 THR A 116 4.898 -16.503 -16.662 1.00 0.00 H new ATOM 0 HG23 THR A 116 5.561 -16.677 -15.020 1.00 0.00 H new ATOM 1826 N GLY A 117 3.519 -14.230 -13.422 1.00 0.00 N ATOM 1827 CA GLY A 117 4.144 -13.608 -12.269 1.00 0.00 C ATOM 1828 C GLY A 117 5.468 -14.252 -11.909 1.00 0.00 C ATOM 1829 O GLY A 117 5.691 -14.623 -10.757 1.00 0.00 O ATOM 0 H GLY A 117 3.056 -13.583 -14.060 1.00 0.00 H new ATOM 0 HA2 GLY A 117 4.302 -12.549 -12.473 1.00 0.00 H new ATOM 0 HA3 GLY A 117 3.469 -13.671 -11.416 1.00 0.00 H new ATOM 1833 N GLU A 118 6.347 -14.387 -12.896 1.00 0.00 N ATOM 1834 CA GLU A 118 7.655 -14.993 -12.677 1.00 0.00 C ATOM 1835 C GLU A 118 8.773 -14.021 -13.039 1.00 0.00 C ATOM 1836 O GLU A 118 8.789 -13.453 -14.131 1.00 0.00 O ATOM 1837 CB GLU A 118 7.792 -16.276 -13.501 1.00 0.00 C ATOM 1838 CG GLU A 118 9.200 -16.844 -13.512 1.00 0.00 C ATOM 1839 CD GLU A 118 9.222 -18.344 -13.734 1.00 0.00 C ATOM 1840 OE1 GLU A 118 8.430 -19.052 -13.077 1.00 0.00 O ATOM 1841 OE2 GLU A 118 10.031 -18.810 -14.564 1.00 0.00 O ATOM 0 H GLU A 118 6.177 -14.085 -13.855 1.00 0.00 H new ATOM 0 HA GLU A 118 7.740 -15.239 -11.618 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.109 -17.027 -13.104 1.00 0.00 H new ATOM 0 HB3 GLU A 118 7.483 -16.074 -14.526 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.779 -16.356 -14.296 1.00 0.00 H new ATOM 0 HG3 GLU A 118 9.688 -16.613 -12.565 1.00 0.00 H new ATOM 1848 N LYS A 119 9.708 -13.833 -12.114 1.00 0.00 N ATOM 1849 CA LYS A 119 10.832 -12.931 -12.333 1.00 0.00 C ATOM 1850 C LYS A 119 12.079 -13.705 -12.750 1.00 0.00 C ATOM 1851 O LYS A 119 12.335 -14.814 -12.281 1.00 0.00 O ATOM 1852 CB LYS A 119 11.121 -12.124 -11.065 1.00 0.00 C ATOM 1853 CG LYS A 119 9.972 -11.224 -10.643 1.00 0.00 C ATOM 1854 CD LYS A 119 9.014 -11.943 -9.710 1.00 0.00 C ATOM 1855 CE LYS A 119 7.788 -11.095 -9.407 1.00 0.00 C ATOM 1856 NZ LYS A 119 6.624 -11.928 -8.998 1.00 0.00 N ATOM 0 H LYS A 119 9.709 -14.294 -11.204 1.00 0.00 H new ATOM 0 HA LYS A 119 10.564 -12.247 -13.138 1.00 0.00 H new ATOM 0 HB2 LYS A 119 11.351 -12.812 -10.251 1.00 0.00 H new ATOM 0 HB3 LYS A 119 12.009 -11.514 -11.227 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.367 -10.337 -10.148 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.433 -10.882 -11.527 1.00 0.00 H new ATOM 0 HD2 LYS A 119 8.703 -12.885 -10.162 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.526 -12.189 -8.780 1.00 0.00 H new ATOM 0 HE2 LYS A 119 8.024 -10.386 -8.613 1.00 0.00 H new ATOM 0 HE3 LYS A 119 7.524 -10.510 -10.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.769 -11.337 -8.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 6.488 -12.696 -9.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.801 -12.334 -8.057 1.00 0.00 H new ATOM 1870 N PRO A 120 12.873 -13.109 -13.651 1.00 0.00 N ATOM 1871 CA PRO A 120 14.107 -13.725 -14.149 1.00 0.00 C ATOM 1872 C PRO A 120 15.196 -13.785 -13.083 1.00 0.00 C ATOM 1873 O PRO A 120 15.868 -14.804 -12.924 1.00 0.00 O ATOM 1874 CB PRO A 120 14.529 -12.799 -15.293 1.00 0.00 C ATOM 1875 CG PRO A 120 13.922 -11.481 -14.957 1.00 0.00 C ATOM 1876 CD PRO A 120 12.629 -11.788 -14.253 1.00 0.00 C ATOM 0 HA PRO A 120 13.951 -14.760 -14.455 1.00 0.00 H new ATOM 0 HB2 PRO A 120 15.614 -12.728 -15.365 1.00 0.00 H new ATOM 0 HB3 PRO A 120 14.169 -13.167 -16.254 1.00 0.00 H new ATOM 0 HG2 PRO A 120 14.585 -10.897 -14.318 1.00 0.00 H new ATOM 0 HG3 PRO A 120 13.746 -10.892 -15.857 1.00 0.00 H new ATOM 0 HD2 PRO A 120 12.396 -11.039 -13.497 1.00 0.00 H new ATOM 0 HD3 PRO A 120 11.789 -11.812 -14.948 1.00 0.00 H new ATOM 1884 N PHE A 121 15.365 -12.687 -12.354 1.00 0.00 N ATOM 1885 CA PHE A 121 16.373 -12.614 -11.303 1.00 0.00 C ATOM 1886 C PHE A 121 15.756 -12.146 -9.989 1.00 0.00 C ATOM 1887 O PHE A 121 15.050 -11.138 -9.945 1.00 0.00 O ATOM 1888 CB PHE A 121 17.503 -11.668 -11.715 1.00 0.00 C ATOM 1889 CG PHE A 121 18.215 -12.094 -12.967 1.00 0.00 C ATOM 1890 CD1 PHE A 121 17.640 -11.887 -14.211 1.00 0.00 C ATOM 1891 CD2 PHE A 121 19.460 -12.699 -12.901 1.00 0.00 C ATOM 1892 CE1 PHE A 121 18.293 -12.279 -15.364 1.00 0.00 C ATOM 1893 CE2 PHE A 121 20.117 -13.092 -14.051 1.00 0.00 C ATOM 1894 CZ PHE A 121 19.533 -12.880 -15.285 1.00 0.00 C ATOM 0 H PHE A 121 14.817 -11.835 -12.472 1.00 0.00 H new ATOM 0 HA PHE A 121 16.781 -13.614 -11.156 1.00 0.00 H new ATOM 0 HB2 PHE A 121 17.094 -10.668 -11.861 1.00 0.00 H new ATOM 0 HB3 PHE A 121 18.225 -11.601 -10.901 1.00 0.00 H new ATOM 0 HD1 PHE A 121 16.671 -11.414 -14.280 1.00 0.00 H new ATOM 0 HD2 PHE A 121 19.922 -12.865 -11.939 1.00 0.00 H new ATOM 0 HE1 PHE A 121 17.833 -12.115 -16.327 1.00 0.00 H new ATOM 0 HE2 PHE A 121 21.086 -13.564 -13.985 1.00 0.00 H new ATOM 0 HZ PHE A 121 20.046 -13.184 -16.186 1.00 0.00 H new ATOM 1904 N LYS A 122 16.026 -12.886 -8.918 1.00 0.00 N ATOM 1905 CA LYS A 122 15.500 -12.548 -7.601 1.00 0.00 C ATOM 1906 C LYS A 122 16.629 -12.373 -6.592 1.00 0.00 C ATOM 1907 O LYS A 122 17.512 -13.224 -6.478 1.00 0.00 O ATOM 1908 CB LYS A 122 14.536 -13.635 -7.121 1.00 0.00 C ATOM 1909 CG LYS A 122 13.801 -13.275 -5.841 1.00 0.00 C ATOM 1910 CD LYS A 122 13.018 -14.457 -5.296 1.00 0.00 C ATOM 1911 CE LYS A 122 12.362 -14.125 -3.964 1.00 0.00 C ATOM 1912 NZ LYS A 122 13.354 -14.077 -2.855 1.00 0.00 N ATOM 0 H LYS A 122 16.607 -13.724 -8.937 1.00 0.00 H new ATOM 0 HA LYS A 122 14.962 -11.604 -7.684 1.00 0.00 H new ATOM 0 HB2 LYS A 122 13.806 -13.834 -7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 122 15.093 -14.559 -6.963 1.00 0.00 H new ATOM 0 HG2 LYS A 122 14.517 -12.936 -5.093 1.00 0.00 H new ATOM 0 HG3 LYS A 122 13.122 -12.444 -6.032 1.00 0.00 H new ATOM 0 HD2 LYS A 122 12.254 -14.752 -6.016 1.00 0.00 H new ATOM 0 HD3 LYS A 122 13.685 -15.310 -5.172 1.00 0.00 H new ATOM 0 HE2 LYS A 122 11.854 -13.164 -4.039 1.00 0.00 H new ATOM 0 HE3 LYS A 122 11.600 -14.871 -3.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 12.860 -13.915 -1.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 13.869 -14.980 -2.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 14.027 -13.303 -3.025 1.00 0.00 H new ATOM 1926 N CYS A 123 16.596 -11.265 -5.859 1.00 0.00 N ATOM 1927 CA CYS A 123 17.616 -10.979 -4.858 1.00 0.00 C ATOM 1928 C CYS A 123 17.980 -12.238 -4.077 1.00 0.00 C ATOM 1929 O CYS A 123 17.109 -12.919 -3.537 1.00 0.00 O ATOM 1930 CB CYS A 123 17.126 -9.893 -3.897 1.00 0.00 C ATOM 1931 SG CYS A 123 18.408 -9.274 -2.760 1.00 0.00 S ATOM 0 H CYS A 123 15.873 -10.550 -5.940 1.00 0.00 H new ATOM 0 HA CYS A 123 18.507 -10.623 -5.375 1.00 0.00 H new ATOM 0 HB2 CYS A 123 16.736 -9.057 -4.478 1.00 0.00 H new ATOM 0 HB3 CYS A 123 16.296 -10.288 -3.311 1.00 0.00 H new ATOM 1936 N GLU A 124 19.274 -12.540 -4.022 1.00 0.00 N ATOM 1937 CA GLU A 124 19.753 -13.718 -3.308 1.00 0.00 C ATOM 1938 C GLU A 124 19.819 -13.454 -1.806 1.00 0.00 C ATOM 1939 O GLU A 124 20.073 -14.363 -1.015 1.00 0.00 O ATOM 1940 CB GLU A 124 21.133 -14.129 -3.825 1.00 0.00 C ATOM 1941 CG GLU A 124 21.207 -14.239 -5.339 1.00 0.00 C ATOM 1942 CD GLU A 124 22.363 -15.103 -5.805 1.00 0.00 C ATOM 1943 OE1 GLU A 124 23.526 -14.721 -5.561 1.00 0.00 O ATOM 1944 OE2 GLU A 124 22.103 -16.162 -6.414 1.00 0.00 O ATOM 0 H GLU A 124 20.008 -11.986 -4.463 1.00 0.00 H new ATOM 0 HA GLU A 124 19.049 -14.531 -3.487 1.00 0.00 H new ATOM 0 HB2 GLU A 124 21.870 -13.402 -3.485 1.00 0.00 H new ATOM 0 HB3 GLU A 124 21.406 -15.088 -3.385 1.00 0.00 H new ATOM 0 HG2 GLU A 124 20.272 -14.655 -5.715 1.00 0.00 H new ATOM 0 HG3 GLU A 124 21.308 -13.242 -5.768 1.00 0.00 H new ATOM 1951 N PHE A 125 19.588 -12.203 -1.421 1.00 0.00 N ATOM 1952 CA PHE A 125 19.623 -11.818 -0.014 1.00 0.00 C ATOM 1953 C PHE A 125 18.421 -12.386 0.735 1.00 0.00 C ATOM 1954 O PHE A 125 17.273 -12.110 0.387 1.00 0.00 O ATOM 1955 CB PHE A 125 19.647 -10.294 0.118 1.00 0.00 C ATOM 1956 CG PHE A 125 20.351 -9.811 1.354 1.00 0.00 C ATOM 1957 CD1 PHE A 125 21.724 -9.622 1.356 1.00 0.00 C ATOM 1958 CD2 PHE A 125 19.641 -9.547 2.514 1.00 0.00 C ATOM 1959 CE1 PHE A 125 22.375 -9.177 2.491 1.00 0.00 C ATOM 1960 CE2 PHE A 125 20.286 -9.101 3.652 1.00 0.00 C ATOM 1961 CZ PHE A 125 21.655 -8.918 3.641 1.00 0.00 C ATOM 0 H PHE A 125 19.375 -11.439 -2.062 1.00 0.00 H new ATOM 0 HA PHE A 125 20.531 -12.229 0.428 1.00 0.00 H new ATOM 0 HB2 PHE A 125 20.136 -9.869 -0.759 1.00 0.00 H new ATOM 0 HB3 PHE A 125 18.623 -9.921 0.124 1.00 0.00 H new ATOM 0 HD1 PHE A 125 22.292 -9.825 0.460 1.00 0.00 H new ATOM 0 HD2 PHE A 125 18.571 -9.691 2.529 1.00 0.00 H new ATOM 0 HE1 PHE A 125 23.445 -9.032 2.479 1.00 0.00 H new ATOM 0 HE2 PHE A 125 19.720 -8.896 4.549 1.00 0.00 H new ATOM 0 HZ PHE A 125 22.162 -8.573 4.530 1.00 0.00 H new ATOM 1971 N GLU A 126 18.695 -13.182 1.763 1.00 0.00 N ATOM 1972 CA GLU A 126 17.636 -13.791 2.561 1.00 0.00 C ATOM 1973 C GLU A 126 16.796 -12.722 3.256 1.00 0.00 C ATOM 1974 O GLU A 126 17.322 -11.720 3.737 1.00 0.00 O ATOM 1975 CB GLU A 126 18.232 -14.742 3.600 1.00 0.00 C ATOM 1976 CG GLU A 126 17.258 -15.130 4.700 1.00 0.00 C ATOM 1977 CD GLU A 126 15.965 -15.706 4.157 1.00 0.00 C ATOM 1978 OE1 GLU A 126 16.027 -16.704 3.410 1.00 0.00 O ATOM 1979 OE2 GLU A 126 14.890 -15.158 4.480 1.00 0.00 O ATOM 0 H GLU A 126 19.640 -13.421 2.063 1.00 0.00 H new ATOM 0 HA GLU A 126 16.990 -14.357 1.890 1.00 0.00 H new ATOM 0 HB2 GLU A 126 18.578 -15.645 3.097 1.00 0.00 H new ATOM 0 HB3 GLU A 126 19.107 -14.273 4.050 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.730 -15.861 5.357 1.00 0.00 H new ATOM 0 HG3 GLU A 126 17.034 -14.253 5.308 1.00 0.00 H new ATOM 1986 N GLY A 127 15.486 -12.946 3.303 1.00 0.00 N ATOM 1987 CA GLY A 127 14.594 -11.994 3.939 1.00 0.00 C ATOM 1988 C GLY A 127 14.492 -10.691 3.172 1.00 0.00 C ATOM 1989 O GLY A 127 14.133 -9.657 3.734 1.00 0.00 O ATOM 0 H GLY A 127 15.027 -13.769 2.912 1.00 0.00 H new ATOM 0 HA2 GLY A 127 13.602 -12.436 4.031 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.947 -11.790 4.950 1.00 0.00 H new ATOM 1993 N CYS A 128 14.810 -10.740 1.882 1.00 0.00 N ATOM 1994 CA CYS A 128 14.755 -9.555 1.035 1.00 0.00 C ATOM 1995 C CYS A 128 13.774 -9.754 -0.116 1.00 0.00 C ATOM 1996 O CYS A 128 13.726 -10.821 -0.727 1.00 0.00 O ATOM 1997 CB CYS A 128 16.145 -9.231 0.485 1.00 0.00 C ATOM 1998 SG CYS A 128 16.290 -7.563 -0.235 1.00 0.00 S ATOM 0 H CYS A 128 15.109 -11.588 1.401 1.00 0.00 H new ATOM 0 HA CYS A 128 14.409 -8.720 1.644 1.00 0.00 H new ATOM 0 HB2 CYS A 128 16.875 -9.333 1.288 1.00 0.00 H new ATOM 0 HB3 CYS A 128 16.404 -9.967 -0.276 1.00 0.00 H new ATOM 2003 N ASP A 129 12.993 -8.719 -0.406 1.00 0.00 N ATOM 2004 CA ASP A 129 12.013 -8.779 -1.484 1.00 0.00 C ATOM 2005 C ASP A 129 12.340 -7.761 -2.572 1.00 0.00 C ATOM 2006 O ASP A 129 12.140 -6.559 -2.392 1.00 0.00 O ATOM 2007 CB ASP A 129 10.607 -8.527 -0.939 1.00 0.00 C ATOM 2008 CG ASP A 129 9.534 -8.722 -1.992 1.00 0.00 C ATOM 2009 OD1 ASP A 129 9.222 -7.747 -2.708 1.00 0.00 O ATOM 2010 OD2 ASP A 129 9.006 -9.849 -2.101 1.00 0.00 O ATOM 0 H ASP A 129 13.020 -7.828 0.091 1.00 0.00 H new ATOM 0 HA ASP A 129 12.051 -9.777 -1.921 1.00 0.00 H new ATOM 0 HB2 ASP A 129 10.418 -9.201 -0.103 1.00 0.00 H new ATOM 0 HB3 ASP A 129 10.549 -7.511 -0.549 1.00 0.00 H new ATOM 2015 N ARG A 130 12.844 -8.249 -3.701 1.00 0.00 N ATOM 2016 CA ARG A 130 13.201 -7.382 -4.817 1.00 0.00 C ATOM 2017 C ARG A 130 13.081 -8.126 -6.144 1.00 0.00 C ATOM 2018 O ARG A 130 12.808 -9.326 -6.171 1.00 0.00 O ATOM 2019 CB ARG A 130 14.626 -6.852 -4.644 1.00 0.00 C ATOM 2020 CG ARG A 130 14.852 -6.132 -3.325 1.00 0.00 C ATOM 2021 CD ARG A 130 14.165 -4.776 -3.305 1.00 0.00 C ATOM 2022 NE ARG A 130 14.776 -3.839 -4.244 1.00 0.00 N ATOM 2023 CZ ARG A 130 14.649 -2.520 -4.155 1.00 0.00 C ATOM 2024 NH1 ARG A 130 13.936 -1.985 -3.173 1.00 0.00 N ATOM 2025 NH2 ARG A 130 15.235 -1.733 -5.048 1.00 0.00 N ATOM 0 H ARG A 130 13.014 -9.241 -3.867 1.00 0.00 H new ATOM 0 HA ARG A 130 12.507 -6.542 -4.827 1.00 0.00 H new ATOM 0 HB2 ARG A 130 15.326 -7.684 -4.718 1.00 0.00 H new ATOM 0 HB3 ARG A 130 14.853 -6.171 -5.464 1.00 0.00 H new ATOM 0 HG2 ARG A 130 14.475 -6.744 -2.506 1.00 0.00 H new ATOM 0 HG3 ARG A 130 15.921 -6.002 -3.159 1.00 0.00 H new ATOM 0 HD2 ARG A 130 13.110 -4.900 -3.551 1.00 0.00 H new ATOM 0 HD3 ARG A 130 14.210 -4.361 -2.298 1.00 0.00 H new ATOM 0 HE ARG A 130 15.331 -4.219 -5.011 1.00 0.00 H new ATOM 0 HH11 ARG A 130 13.484 -2.587 -2.484 1.00 0.00 H new ATOM 0 HH12 ARG A 130 13.840 -0.972 -3.106 1.00 0.00 H new ATOM 0 HH21 ARG A 130 15.784 -2.141 -5.805 1.00 0.00 H new ATOM 0 HH22 ARG A 130 15.136 -0.720 -4.978 1.00 0.00 H new ATOM 2039 N ARG A 131 13.286 -7.405 -7.241 1.00 0.00 N ATOM 2040 CA ARG A 131 13.199 -7.996 -8.571 1.00 0.00 C ATOM 2041 C ARG A 131 14.239 -7.386 -9.506 1.00 0.00 C ATOM 2042 O ARG A 131 14.465 -6.176 -9.496 1.00 0.00 O ATOM 2043 CB ARG A 131 11.797 -7.796 -9.150 1.00 0.00 C ATOM 2044 CG ARG A 131 10.682 -8.106 -8.166 1.00 0.00 C ATOM 2045 CD ARG A 131 9.322 -7.716 -8.724 1.00 0.00 C ATOM 2046 NE ARG A 131 8.288 -7.709 -7.693 1.00 0.00 N ATOM 2047 CZ ARG A 131 6.995 -7.546 -7.949 1.00 0.00 C ATOM 2048 NH1 ARG A 131 6.579 -7.377 -9.197 1.00 0.00 N ATOM 2049 NH2 ARG A 131 6.115 -7.552 -6.957 1.00 0.00 N ATOM 0 H ARG A 131 13.514 -6.411 -7.235 1.00 0.00 H new ATOM 0 HA ARG A 131 13.399 -9.064 -8.481 1.00 0.00 H new ATOM 0 HB2 ARG A 131 11.696 -6.764 -9.487 1.00 0.00 H new ATOM 0 HB3 ARG A 131 11.682 -8.431 -10.028 1.00 0.00 H new ATOM 0 HG2 ARG A 131 10.688 -9.170 -7.931 1.00 0.00 H new ATOM 0 HG3 ARG A 131 10.860 -7.572 -7.233 1.00 0.00 H new ATOM 0 HD2 ARG A 131 9.387 -6.728 -9.179 1.00 0.00 H new ATOM 0 HD3 ARG A 131 9.041 -8.413 -9.514 1.00 0.00 H new ATOM 0 HE ARG A 131 8.575 -7.836 -6.722 1.00 0.00 H new ATOM 0 HH11 ARG A 131 7.253 -7.372 -9.963 1.00 0.00 H new ATOM 0 HH12 ARG A 131 5.585 -7.252 -9.391 1.00 0.00 H new ATOM 0 HH21 ARG A 131 6.431 -7.682 -5.996 1.00 0.00 H new ATOM 0 HH22 ARG A 131 5.122 -7.427 -7.155 1.00 0.00 H new ATOM 2063 N PHE A 132 14.870 -8.233 -10.313 1.00 0.00 N ATOM 2064 CA PHE A 132 15.888 -7.778 -11.253 1.00 0.00 C ATOM 2065 C PHE A 132 15.735 -8.477 -12.601 1.00 0.00 C ATOM 2066 O PHE A 132 15.215 -9.590 -12.679 1.00 0.00 O ATOM 2067 CB PHE A 132 17.286 -8.035 -10.688 1.00 0.00 C ATOM 2068 CG PHE A 132 17.447 -7.594 -9.262 1.00 0.00 C ATOM 2069 CD1 PHE A 132 17.426 -6.249 -8.932 1.00 0.00 C ATOM 2070 CD2 PHE A 132 17.620 -8.525 -8.250 1.00 0.00 C ATOM 2071 CE1 PHE A 132 17.574 -5.839 -7.620 1.00 0.00 C ATOM 2072 CE2 PHE A 132 17.768 -8.122 -6.937 1.00 0.00 C ATOM 2073 CZ PHE A 132 17.746 -6.777 -6.621 1.00 0.00 C ATOM 0 H PHE A 132 14.694 -9.238 -10.335 1.00 0.00 H new ATOM 0 HA PHE A 132 15.756 -6.706 -11.402 1.00 0.00 H new ATOM 0 HB2 PHE A 132 17.507 -9.100 -10.758 1.00 0.00 H new ATOM 0 HB3 PHE A 132 18.020 -7.516 -11.305 1.00 0.00 H new ATOM 0 HD1 PHE A 132 17.292 -5.511 -9.709 1.00 0.00 H new ATOM 0 HD2 PHE A 132 17.639 -9.578 -8.491 1.00 0.00 H new ATOM 0 HE1 PHE A 132 17.555 -4.787 -7.377 1.00 0.00 H new ATOM 0 HE2 PHE A 132 17.901 -8.858 -6.158 1.00 0.00 H new ATOM 0 HZ PHE A 132 17.863 -6.460 -5.595 1.00 0.00 H new ATOM 2083 N ALA A 133 16.190 -7.815 -13.660 1.00 0.00 N ATOM 2084 CA ALA A 133 16.105 -8.372 -15.004 1.00 0.00 C ATOM 2085 C ALA A 133 17.493 -8.586 -15.598 1.00 0.00 C ATOM 2086 O ALA A 133 17.637 -9.179 -16.667 1.00 0.00 O ATOM 2087 CB ALA A 133 15.279 -7.463 -15.901 1.00 0.00 C ATOM 0 H ALA A 133 16.621 -6.892 -13.613 1.00 0.00 H new ATOM 0 HA ALA A 133 15.613 -9.342 -14.938 1.00 0.00 H new ATOM 0 HB1 ALA A 133 15.224 -7.892 -16.902 1.00 0.00 H new ATOM 0 HB2 ALA A 133 14.273 -7.365 -15.492 1.00 0.00 H new ATOM 0 HB3 ALA A 133 15.747 -6.480 -15.953 1.00 0.00 H new ATOM 2093 N ASN A 134 18.513 -8.100 -14.898 1.00 0.00 N ATOM 2094 CA ASN A 134 19.890 -8.237 -15.357 1.00 0.00 C ATOM 2095 C ASN A 134 20.817 -8.593 -14.199 1.00 0.00 C ATOM 2096 O ASN A 134 20.792 -7.949 -13.150 1.00 0.00 O ATOM 2097 CB ASN A 134 20.360 -6.941 -16.022 1.00 0.00 C ATOM 2098 CG ASN A 134 20.076 -5.719 -15.170 1.00 0.00 C ATOM 2099 OD1 ASN A 134 20.996 -5.024 -14.737 1.00 0.00 O ATOM 2100 ND2 ASN A 134 18.799 -5.451 -14.926 1.00 0.00 N ATOM 0 H ASN A 134 18.412 -7.608 -14.010 1.00 0.00 H new ATOM 0 HA ASN A 134 19.924 -9.045 -16.088 1.00 0.00 H new ATOM 0 HB2 ASN A 134 21.430 -7.004 -16.218 1.00 0.00 H new ATOM 0 HB3 ASN A 134 19.865 -6.831 -16.987 1.00 0.00 H new ATOM 0 HD21 ASN A 134 18.547 -4.641 -14.359 1.00 0.00 H new ATOM 0 HD22 ASN A 134 18.070 -6.055 -15.305 1.00 0.00 H new ATOM 2107 N SER A 135 21.636 -9.621 -14.397 1.00 0.00 N ATOM 2108 CA SER A 135 22.569 -10.065 -13.369 1.00 0.00 C ATOM 2109 C SER A 135 23.407 -8.897 -12.855 1.00 0.00 C ATOM 2110 O SER A 135 23.932 -8.938 -11.743 1.00 0.00 O ATOM 2111 CB SER A 135 23.484 -11.161 -13.919 1.00 0.00 C ATOM 2112 OG SER A 135 24.061 -10.772 -15.153 1.00 0.00 O ATOM 0 H SER A 135 21.672 -10.162 -15.261 1.00 0.00 H new ATOM 0 HA SER A 135 21.990 -10.468 -12.538 1.00 0.00 H new ATOM 0 HB2 SER A 135 24.272 -11.377 -13.198 1.00 0.00 H new ATOM 0 HB3 SER A 135 22.915 -12.081 -14.054 1.00 0.00 H new ATOM 0 HG SER A 135 24.643 -11.489 -15.483 1.00 0.00 H new ATOM 2118 N SER A 136 23.527 -7.858 -13.675 1.00 0.00 N ATOM 2119 CA SER A 136 24.303 -6.680 -13.307 1.00 0.00 C ATOM 2120 C SER A 136 23.553 -5.833 -12.283 1.00 0.00 C ATOM 2121 O SER A 136 24.129 -5.380 -11.294 1.00 0.00 O ATOM 2122 CB SER A 136 24.617 -5.842 -14.548 1.00 0.00 C ATOM 2123 OG SER A 136 25.290 -6.613 -15.527 1.00 0.00 O ATOM 0 H SER A 136 23.097 -7.808 -14.598 1.00 0.00 H new ATOM 0 HA SER A 136 25.238 -7.017 -12.859 1.00 0.00 H new ATOM 0 HB2 SER A 136 23.692 -5.445 -14.966 1.00 0.00 H new ATOM 0 HB3 SER A 136 25.233 -4.987 -14.267 1.00 0.00 H new ATOM 0 HG SER A 136 25.478 -6.055 -16.311 1.00 0.00 H new ATOM 2129 N ASP A 137 22.265 -5.623 -12.529 1.00 0.00 N ATOM 2130 CA ASP A 137 21.434 -4.831 -11.630 1.00 0.00 C ATOM 2131 C ASP A 137 21.322 -5.500 -10.263 1.00 0.00 C ATOM 2132 O ASP A 137 21.363 -4.833 -9.229 1.00 0.00 O ATOM 2133 CB ASP A 137 20.041 -4.633 -12.230 1.00 0.00 C ATOM 2134 CG ASP A 137 19.951 -3.383 -13.084 1.00 0.00 C ATOM 2135 OD1 ASP A 137 21.013 -2.837 -13.450 1.00 0.00 O ATOM 2136 OD2 ASP A 137 18.819 -2.952 -13.386 1.00 0.00 O ATOM 0 H ASP A 137 21.773 -5.990 -13.344 1.00 0.00 H new ATOM 0 HA ASP A 137 21.907 -3.858 -11.501 1.00 0.00 H new ATOM 0 HB2 ASP A 137 19.782 -5.502 -12.835 1.00 0.00 H new ATOM 0 HB3 ASP A 137 19.307 -4.574 -11.426 1.00 0.00 H new ATOM 2141 N ARG A 138 21.179 -6.822 -10.267 1.00 0.00 N ATOM 2142 CA ARG A 138 21.059 -7.581 -9.028 1.00 0.00 C ATOM 2143 C ARG A 138 22.279 -7.366 -8.138 1.00 0.00 C ATOM 2144 O ARG A 138 22.158 -6.922 -6.996 1.00 0.00 O ATOM 2145 CB ARG A 138 20.892 -9.071 -9.332 1.00 0.00 C ATOM 2146 CG ARG A 138 21.458 -9.979 -8.253 1.00 0.00 C ATOM 2147 CD ARG A 138 20.703 -11.298 -8.183 1.00 0.00 C ATOM 2148 NE ARG A 138 21.128 -12.227 -9.227 1.00 0.00 N ATOM 2149 CZ ARG A 138 22.190 -13.018 -9.119 1.00 0.00 C ATOM 2150 NH1 ARG A 138 22.931 -12.992 -8.020 1.00 0.00 N ATOM 2151 NH2 ARG A 138 22.513 -13.837 -10.112 1.00 0.00 N ATOM 0 H ARG A 138 21.143 -7.389 -11.114 1.00 0.00 H new ATOM 0 HA ARG A 138 20.176 -7.224 -8.497 1.00 0.00 H new ATOM 0 HB2 ARG A 138 19.832 -9.290 -9.461 1.00 0.00 H new ATOM 0 HB3 ARG A 138 21.382 -9.297 -10.279 1.00 0.00 H new ATOM 0 HG2 ARG A 138 22.512 -10.172 -8.454 1.00 0.00 H new ATOM 0 HG3 ARG A 138 21.404 -9.476 -7.287 1.00 0.00 H new ATOM 0 HD2 ARG A 138 20.860 -11.754 -7.206 1.00 0.00 H new ATOM 0 HD3 ARG A 138 19.634 -11.109 -8.279 1.00 0.00 H new ATOM 0 HE ARG A 138 20.579 -12.271 -10.086 1.00 0.00 H new ATOM 0 HH11 ARG A 138 22.686 -12.364 -7.255 1.00 0.00 H new ATOM 0 HH12 ARG A 138 23.746 -13.600 -7.940 1.00 0.00 H new ATOM 0 HH21 ARG A 138 21.946 -13.860 -10.959 1.00 0.00 H new ATOM 0 HH22 ARG A 138 23.329 -14.444 -10.028 1.00 0.00 H new ATOM 2165 N LYS A 139 23.455 -7.683 -8.669 1.00 0.00 N ATOM 2166 CA LYS A 139 24.699 -7.524 -7.924 1.00 0.00 C ATOM 2167 C LYS A 139 24.892 -6.075 -7.489 1.00 0.00 C ATOM 2168 O LYS A 139 25.662 -5.788 -6.573 1.00 0.00 O ATOM 2169 CB LYS A 139 25.888 -7.975 -8.776 1.00 0.00 C ATOM 2170 CG LYS A 139 27.059 -8.493 -7.959 1.00 0.00 C ATOM 2171 CD LYS A 139 28.132 -9.102 -8.846 1.00 0.00 C ATOM 2172 CE LYS A 139 28.762 -8.057 -9.755 1.00 0.00 C ATOM 2173 NZ LYS A 139 29.950 -8.593 -10.476 1.00 0.00 N ATOM 0 H LYS A 139 23.573 -8.052 -9.613 1.00 0.00 H new ATOM 0 HA LYS A 139 24.641 -8.147 -7.032 1.00 0.00 H new ATOM 0 HB2 LYS A 139 25.558 -8.757 -9.460 1.00 0.00 H new ATOM 0 HB3 LYS A 139 26.224 -7.138 -9.388 1.00 0.00 H new ATOM 0 HG2 LYS A 139 27.487 -7.677 -7.377 1.00 0.00 H new ATOM 0 HG3 LYS A 139 26.706 -9.240 -7.248 1.00 0.00 H new ATOM 0 HD2 LYS A 139 28.903 -9.558 -8.225 1.00 0.00 H new ATOM 0 HD3 LYS A 139 27.697 -9.898 -9.451 1.00 0.00 H new ATOM 0 HE2 LYS A 139 28.023 -7.712 -10.478 1.00 0.00 H new ATOM 0 HE3 LYS A 139 29.057 -7.191 -9.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 30.351 -7.851 -11.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 30.666 -8.899 -9.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 29.664 -9.404 -11.061 1.00 0.00 H new ATOM 2187 N LYS A 140 24.186 -5.165 -8.152 1.00 0.00 N ATOM 2188 CA LYS A 140 24.277 -3.745 -7.832 1.00 0.00 C ATOM 2189 C LYS A 140 23.399 -3.399 -6.634 1.00 0.00 C ATOM 2190 O LYS A 140 23.591 -2.369 -5.987 1.00 0.00 O ATOM 2191 CB LYS A 140 23.864 -2.902 -9.041 1.00 0.00 C ATOM 2192 CG LYS A 140 25.014 -2.579 -9.979 1.00 0.00 C ATOM 2193 CD LYS A 140 24.524 -2.317 -11.393 1.00 0.00 C ATOM 2194 CE LYS A 140 25.492 -1.432 -12.164 1.00 0.00 C ATOM 2195 NZ LYS A 140 26.529 -2.232 -12.873 1.00 0.00 N ATOM 0 H LYS A 140 23.545 -5.385 -8.914 1.00 0.00 H new ATOM 0 HA LYS A 140 25.313 -3.521 -7.577 1.00 0.00 H new ATOM 0 HB2 LYS A 140 23.091 -3.433 -9.597 1.00 0.00 H new ATOM 0 HB3 LYS A 140 23.420 -1.970 -8.689 1.00 0.00 H new ATOM 0 HG2 LYS A 140 25.550 -1.704 -9.611 1.00 0.00 H new ATOM 0 HG3 LYS A 140 25.722 -3.407 -9.986 1.00 0.00 H new ATOM 0 HD2 LYS A 140 24.399 -3.264 -11.917 1.00 0.00 H new ATOM 0 HD3 LYS A 140 23.544 -1.841 -11.357 1.00 0.00 H new ATOM 0 HE2 LYS A 140 24.939 -0.832 -12.887 1.00 0.00 H new ATOM 0 HE3 LYS A 140 25.976 -0.738 -11.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 27.169 -1.593 -13.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 27.074 -2.785 -12.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 26.069 -2.877 -13.547 1.00 0.00 H new ATOM 2209 N HIS A 141 22.435 -4.267 -6.343 1.00 0.00 N ATOM 2210 CA HIS A 141 21.528 -4.054 -5.220 1.00 0.00 C ATOM 2211 C HIS A 141 22.142 -4.566 -3.921 1.00 0.00 C ATOM 2212 O HIS A 141 21.545 -4.447 -2.852 1.00 0.00 O ATOM 2213 CB HIS A 141 20.192 -4.753 -5.477 1.00 0.00 C ATOM 2214 CG HIS A 141 19.366 -4.938 -4.242 1.00 0.00 C ATOM 2215 ND1 HIS A 141 18.629 -3.922 -3.670 1.00 0.00 N ATOM 2216 CD2 HIS A 141 19.162 -6.030 -3.469 1.00 0.00 C ATOM 2217 CE1 HIS A 141 18.008 -4.381 -2.598 1.00 0.00 C ATOM 2218 NE2 HIS A 141 18.314 -5.658 -2.454 1.00 0.00 N ATOM 0 H HIS A 141 22.262 -5.124 -6.869 1.00 0.00 H new ATOM 0 HA HIS A 141 21.356 -2.982 -5.122 1.00 0.00 H new ATOM 0 HB2 HIS A 141 19.621 -4.173 -6.202 1.00 0.00 H new ATOM 0 HB3 HIS A 141 20.382 -5.728 -5.927 1.00 0.00 H new ATOM 0 HD1 HIS A 141 18.572 -2.966 -4.020 1.00 0.00 H new ATOM 0 HD2 HIS A 141 19.587 -7.011 -3.622 1.00 0.00 H new ATOM 0 HE1 HIS A 141 17.360 -3.809 -1.950 1.00 0.00 H new ATOM 2226 N MET A 142 23.338 -5.137 -4.022 1.00 0.00 N ATOM 2227 CA MET A 142 24.033 -5.667 -2.854 1.00 0.00 C ATOM 2228 C MET A 142 24.871 -4.584 -2.183 1.00 0.00 C ATOM 2229 O MET A 142 25.196 -4.681 -0.999 1.00 0.00 O ATOM 2230 CB MET A 142 24.925 -6.844 -3.255 1.00 0.00 C ATOM 2231 CG MET A 142 24.288 -7.767 -4.280 1.00 0.00 C ATOM 2232 SD MET A 142 23.351 -9.108 -3.521 1.00 0.00 S ATOM 2233 CE MET A 142 21.677 -8.504 -3.715 1.00 0.00 C ATOM 0 H MET A 142 23.846 -5.245 -4.900 1.00 0.00 H new ATOM 0 HA MET A 142 23.284 -6.015 -2.143 1.00 0.00 H new ATOM 0 HB2 MET A 142 25.862 -6.459 -3.658 1.00 0.00 H new ATOM 0 HB3 MET A 142 25.174 -7.421 -2.364 1.00 0.00 H new ATOM 0 HG2 MET A 142 23.627 -7.187 -4.924 1.00 0.00 H new ATOM 0 HG3 MET A 142 25.066 -8.188 -4.917 1.00 0.00 H new ATOM 0 HE1 MET A 142 21.167 -8.530 -2.752 1.00 0.00 H new ATOM 0 HE2 MET A 142 21.701 -7.479 -4.085 1.00 0.00 H new ATOM 0 HE3 MET A 142 21.143 -9.134 -4.426 1.00 0.00 H new ATOM 2243 N HIS A 143 25.219 -3.553 -2.946 1.00 0.00 N ATOM 2244 CA HIS A 143 26.020 -2.451 -2.424 1.00 0.00 C ATOM 2245 C HIS A 143 25.370 -1.847 -1.183 1.00 0.00 C ATOM 2246 O HIS A 143 26.034 -1.197 -0.375 1.00 0.00 O ATOM 2247 CB HIS A 143 26.203 -1.374 -3.493 1.00 0.00 C ATOM 2248 CG HIS A 143 24.973 -0.553 -3.733 1.00 0.00 C ATOM 2249 ND1 HIS A 143 24.227 0.000 -2.713 1.00 0.00 N ATOM 2250 CD2 HIS A 143 24.361 -0.190 -4.884 1.00 0.00 C ATOM 2251 CE1 HIS A 143 23.208 0.665 -3.227 1.00 0.00 C ATOM 2252 NE2 HIS A 143 23.267 0.566 -4.543 1.00 0.00 N ATOM 0 H HIS A 143 24.959 -3.457 -3.928 1.00 0.00 H new ATOM 0 HA HIS A 143 26.997 -2.845 -2.146 1.00 0.00 H new ATOM 0 HB2 HIS A 143 27.018 -0.714 -3.196 1.00 0.00 H new ATOM 0 HB3 HIS A 143 26.501 -1.849 -4.428 1.00 0.00 H new ATOM 0 HD2 HIS A 143 24.675 -0.447 -5.885 1.00 0.00 H new ATOM 0 HE1 HIS A 143 22.455 1.199 -2.667 1.00 0.00 H new ATOM 0 HE2 HIS A 143 22.607 0.983 -5.199 1.00 0.00 H new ATOM 2260 N VAL A 144 24.067 -2.067 -1.037 1.00 0.00 N ATOM 2261 CA VAL A 144 23.327 -1.545 0.106 1.00 0.00 C ATOM 2262 C VAL A 144 23.142 -2.614 1.176 1.00 0.00 C ATOM 2263 O VAL A 144 22.788 -2.313 2.316 1.00 0.00 O ATOM 2264 CB VAL A 144 21.945 -1.012 -0.316 1.00 0.00 C ATOM 2265 CG1 VAL A 144 21.470 -1.705 -1.584 1.00 0.00 C ATOM 2266 CG2 VAL A 144 20.938 -1.193 0.809 1.00 0.00 C ATOM 0 H VAL A 144 23.502 -2.603 -1.696 1.00 0.00 H new ATOM 0 HA VAL A 144 23.915 -0.724 0.515 1.00 0.00 H new ATOM 0 HB VAL A 144 22.034 0.054 -0.525 1.00 0.00 H new ATOM 0 HG11 VAL A 144 20.492 -1.316 -1.867 1.00 0.00 H new ATOM 0 HG12 VAL A 144 22.181 -1.519 -2.389 1.00 0.00 H new ATOM 0 HG13 VAL A 144 21.396 -2.778 -1.406 1.00 0.00 H new ATOM 0 HG21 VAL A 144 19.967 -0.811 0.493 1.00 0.00 H new ATOM 0 HG22 VAL A 144 20.850 -2.252 1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 144 21.274 -0.646 1.690 1.00 0.00 H new ATOM 2276 N HIS A 145 23.384 -3.867 0.801 1.00 0.00 N ATOM 2277 CA HIS A 145 23.245 -4.983 1.730 1.00 0.00 C ATOM 2278 C HIS A 145 24.465 -5.088 2.640 1.00 0.00 C ATOM 2279 O HIS A 145 24.376 -5.590 3.761 1.00 0.00 O ATOM 2280 CB HIS A 145 23.053 -6.291 0.962 1.00 0.00 C ATOM 2281 CG HIS A 145 21.618 -6.615 0.679 1.00 0.00 C ATOM 2282 ND1 HIS A 145 20.660 -6.712 1.666 1.00 0.00 N ATOM 2283 CD2 HIS A 145 20.980 -6.862 -0.488 1.00 0.00 C ATOM 2284 CE1 HIS A 145 19.495 -7.007 1.118 1.00 0.00 C ATOM 2285 NE2 HIS A 145 19.662 -7.103 -0.189 1.00 0.00 N ATOM 0 H HIS A 145 23.677 -4.134 -0.139 1.00 0.00 H new ATOM 0 HA HIS A 145 22.367 -4.801 2.349 1.00 0.00 H new ATOM 0 HB2 HIS A 145 23.596 -6.232 0.019 1.00 0.00 H new ATOM 0 HB3 HIS A 145 23.495 -7.107 1.534 1.00 0.00 H new ATOM 0 HD1 HIS A 145 20.825 -6.577 2.663 1.00 0.00 H new ATOM 0 HD2 HIS A 145 21.425 -6.868 -1.472 1.00 0.00 H new ATOM 0 HE1 HIS A 145 18.564 -7.146 1.648 1.00 0.00 H new ATOM 2293 N THR A 146 25.605 -4.611 2.150 1.00 0.00 N ATOM 2294 CA THR A 146 26.843 -4.652 2.918 1.00 0.00 C ATOM 2295 C THR A 146 26.849 -3.589 4.010 1.00 0.00 C ATOM 2296 O THR A 146 27.732 -2.731 4.050 1.00 0.00 O ATOM 2297 CB THR A 146 28.073 -4.449 2.013 1.00 0.00 C ATOM 2298 OG1 THR A 146 27.805 -4.956 0.701 1.00 0.00 O ATOM 2299 CG2 THR A 146 29.293 -5.149 2.592 1.00 0.00 C ATOM 0 H THR A 146 25.696 -4.192 1.225 1.00 0.00 H new ATOM 0 HA THR A 146 26.897 -5.640 3.376 1.00 0.00 H new ATOM 0 HB THR A 146 28.280 -3.380 1.954 1.00 0.00 H new ATOM 0 HG1 THR A 146 28.591 -4.822 0.131 1.00 0.00 H new ATOM 0 HG21 THR A 146 30.149 -4.991 1.935 1.00 0.00 H new ATOM 0 HG22 THR A 146 29.513 -4.741 3.579 1.00 0.00 H new ATOM 0 HG23 THR A 146 29.093 -6.217 2.677 1.00 0.00 H new ATOM 2307 N SER A 147 25.859 -3.650 4.895 1.00 0.00 N ATOM 2308 CA SER A 147 25.749 -2.689 5.986 1.00 0.00 C ATOM 2309 C SER A 147 26.192 -1.301 5.535 1.00 0.00 C ATOM 2310 O SER A 147 26.954 -0.625 6.227 1.00 0.00 O ATOM 2311 CB SER A 147 26.591 -3.143 7.180 1.00 0.00 C ATOM 2312 OG SER A 147 26.620 -4.556 7.276 1.00 0.00 O ATOM 0 H SER A 147 25.122 -4.355 4.878 1.00 0.00 H new ATOM 0 HA SER A 147 24.703 -2.637 6.287 1.00 0.00 H new ATOM 0 HB2 SER A 147 27.607 -2.761 7.078 1.00 0.00 H new ATOM 0 HB3 SER A 147 26.182 -2.721 8.098 1.00 0.00 H new ATOM 0 HG SER A 147 27.166 -4.820 8.046 1.00 0.00 H new ATOM 2318 N ASP A 148 25.710 -0.883 4.370 1.00 0.00 N ATOM 2319 CA ASP A 148 26.055 0.425 3.825 1.00 0.00 C ATOM 2320 C ASP A 148 24.816 1.132 3.284 1.00 0.00 C ATOM 2321 O ASP A 148 23.754 0.526 3.142 1.00 0.00 O ATOM 2322 CB ASP A 148 27.100 0.281 2.717 1.00 0.00 C ATOM 2323 CG ASP A 148 28.456 -0.134 3.252 1.00 0.00 C ATOM 2324 OD1 ASP A 148 28.915 0.473 4.242 1.00 0.00 O ATOM 2325 OD2 ASP A 148 29.060 -1.066 2.680 1.00 0.00 O ATOM 0 H ASP A 148 25.079 -1.431 3.785 1.00 0.00 H new ATOM 0 HA ASP A 148 26.473 1.028 4.631 1.00 0.00 H new ATOM 0 HB2 ASP A 148 26.757 -0.457 1.992 1.00 0.00 H new ATOM 0 HB3 ASP A 148 27.196 1.228 2.187 1.00 0.00 H new ATOM 2330 N LYS A 149 24.959 2.419 2.983 1.00 0.00 N ATOM 2331 CA LYS A 149 23.853 3.210 2.457 1.00 0.00 C ATOM 2332 C LYS A 149 24.304 4.053 1.269 1.00 0.00 C ATOM 2333 O LYS A 149 25.377 4.655 1.294 1.00 0.00 O ATOM 2334 CB LYS A 149 23.281 4.115 3.551 1.00 0.00 C ATOM 2335 CG LYS A 149 22.337 5.182 3.025 1.00 0.00 C ATOM 2336 CD LYS A 149 21.714 5.983 4.156 1.00 0.00 C ATOM 2337 CE LYS A 149 20.918 7.166 3.629 1.00 0.00 C ATOM 2338 NZ LYS A 149 19.912 6.750 2.613 1.00 0.00 N ATOM 0 H LYS A 149 25.831 2.936 3.095 1.00 0.00 H new ATOM 0 HA LYS A 149 23.077 2.524 2.119 1.00 0.00 H new ATOM 0 HB2 LYS A 149 22.752 3.501 4.279 1.00 0.00 H new ATOM 0 HB3 LYS A 149 24.104 4.598 4.079 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.880 5.853 2.359 1.00 0.00 H new ATOM 0 HG3 LYS A 149 21.550 4.713 2.434 1.00 0.00 H new ATOM 0 HD2 LYS A 149 21.062 5.337 4.744 1.00 0.00 H new ATOM 0 HD3 LYS A 149 22.497 6.339 4.825 1.00 0.00 H new ATOM 0 HE2 LYS A 149 20.413 7.662 4.458 1.00 0.00 H new ATOM 0 HE3 LYS A 149 21.599 7.894 3.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 19.280 7.549 2.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 20.399 6.456 1.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 19.354 5.954 2.983 1.00 0.00 H new ATOM 2352 N SER A 150 23.476 4.092 0.229 1.00 0.00 N ATOM 2353 CA SER A 150 23.791 4.860 -0.970 1.00 0.00 C ATOM 2354 C SER A 150 22.677 5.853 -1.287 1.00 0.00 C ATOM 2355 O SER A 150 21.609 5.821 -0.677 1.00 0.00 O ATOM 2356 CB SER A 150 24.009 3.923 -2.159 1.00 0.00 C ATOM 2357 OG SER A 150 23.844 4.610 -3.387 1.00 0.00 O ATOM 0 H SER A 150 22.583 3.601 0.193 1.00 0.00 H new ATOM 0 HA SER A 150 24.709 5.418 -0.784 1.00 0.00 H new ATOM 0 HB2 SER A 150 25.010 3.495 -2.110 1.00 0.00 H new ATOM 0 HB3 SER A 150 23.305 3.093 -2.106 1.00 0.00 H new ATOM 0 HG SER A 150 23.990 3.989 -4.131 1.00 0.00 H new ATOM 2363 N GLY A 151 22.935 6.735 -2.248 1.00 0.00 N ATOM 2364 CA GLY A 151 21.946 7.725 -2.631 1.00 0.00 C ATOM 2365 C GLY A 151 21.788 7.836 -4.134 1.00 0.00 C ATOM 2366 O GLY A 151 22.358 7.058 -4.899 1.00 0.00 O ATOM 0 H GLY A 151 23.811 6.781 -2.768 1.00 0.00 H new ATOM 0 HA2 GLY A 151 20.985 7.465 -2.186 1.00 0.00 H new ATOM 0 HA3 GLY A 151 22.233 8.696 -2.226 1.00 0.00 H new ATOM 2370 N PRO A 152 20.996 8.823 -4.579 1.00 0.00 N ATOM 2371 CA PRO A 152 20.746 9.056 -6.005 1.00 0.00 C ATOM 2372 C PRO A 152 21.978 9.585 -6.731 1.00 0.00 C ATOM 2373 O PRO A 152 22.976 9.940 -6.103 1.00 0.00 O ATOM 2374 CB PRO A 152 19.634 10.108 -6.003 1.00 0.00 C ATOM 2375 CG PRO A 152 19.787 10.818 -4.702 1.00 0.00 C ATOM 2376 CD PRO A 152 20.285 9.789 -3.725 1.00 0.00 C ATOM 0 HA PRO A 152 20.481 8.137 -6.528 1.00 0.00 H new ATOM 0 HB2 PRO A 152 19.737 10.795 -6.843 1.00 0.00 H new ATOM 0 HB3 PRO A 152 18.651 9.645 -6.088 1.00 0.00 H new ATOM 0 HG2 PRO A 152 20.491 11.646 -4.790 1.00 0.00 H new ATOM 0 HG3 PRO A 152 18.837 11.240 -4.374 1.00 0.00 H new ATOM 0 HD2 PRO A 152 20.947 10.230 -2.980 1.00 0.00 H new ATOM 0 HD3 PRO A 152 19.464 9.319 -3.184 1.00 0.00 H new ATOM 2384 N SER A 153 21.902 9.634 -8.057 1.00 0.00 N ATOM 2385 CA SER A 153 23.013 10.116 -8.869 1.00 0.00 C ATOM 2386 C SER A 153 22.529 11.119 -9.912 1.00 0.00 C ATOM 2387 O SER A 153 22.220 10.753 -11.046 1.00 0.00 O ATOM 2388 CB SER A 153 23.714 8.945 -9.559 1.00 0.00 C ATOM 2389 OG SER A 153 24.696 8.369 -8.715 1.00 0.00 O ATOM 0 H SER A 153 21.083 9.346 -8.592 1.00 0.00 H new ATOM 0 HA SER A 153 23.722 10.617 -8.209 1.00 0.00 H new ATOM 0 HB2 SER A 153 22.979 8.189 -9.835 1.00 0.00 H new ATOM 0 HB3 SER A 153 24.180 9.289 -10.482 1.00 0.00 H new ATOM 0 HG SER A 153 25.128 7.622 -9.179 1.00 0.00 H new ATOM 2395 N SER A 154 22.465 12.387 -9.519 1.00 0.00 N ATOM 2396 CA SER A 154 22.014 13.444 -10.417 1.00 0.00 C ATOM 2397 C SER A 154 23.200 14.236 -10.962 1.00 0.00 C ATOM 2398 O SER A 154 23.370 14.364 -12.174 1.00 0.00 O ATOM 2399 CB SER A 154 21.050 14.384 -9.690 1.00 0.00 C ATOM 2400 OG SER A 154 19.715 13.920 -9.789 1.00 0.00 O ATOM 0 H SER A 154 22.720 12.708 -8.585 1.00 0.00 H new ATOM 0 HA SER A 154 21.494 12.978 -11.254 1.00 0.00 H new ATOM 0 HB2 SER A 154 21.335 14.462 -8.641 1.00 0.00 H new ATOM 0 HB3 SER A 154 21.123 15.385 -10.115 1.00 0.00 H new ATOM 0 HG SER A 154 19.118 14.536 -9.315 1.00 0.00 H new ATOM 2406 N GLY A 155 24.017 14.765 -10.056 1.00 0.00 N ATOM 2407 CA GLY A 155 25.175 15.537 -10.464 1.00 0.00 C ATOM 2408 C GLY A 155 25.827 14.987 -11.717 1.00 0.00 C ATOM 2409 O GLY A 155 25.900 13.769 -11.869 1.00 0.00 O ATOM 0 H GLY A 155 23.897 14.672 -9.047 1.00 0.00 H new ATOM 0 HA2 GLY A 155 24.876 16.571 -10.638 1.00 0.00 H new ATOM 0 HA3 GLY A 155 25.904 15.548 -9.654 1.00 0.00 H new TER 2413 GLY A 155 HETATM 2414 ZN ZN A 201 -8.622 17.823 -20.675 1.00 0.00 ZN HETATM 2415 ZN ZN A 401 2.584 18.647 -19.154 1.00 0.00 ZN HETATM 2416 ZN ZN A 601 5.423 -7.479 -19.760 1.00 0.00 ZN HETATM 2417 ZN ZN A 801 18.100 -7.492 -1.531 1.00 0.00 ZN