USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 101 SER OG : rot -94:sc= 1.05 USER MOD Set 1.2: A 103 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 28 THR OG1 : rot -15:sc= 0.603 USER MOD Set 2.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 42 SER OG : rot -153:sc= 0.103 USER MOD Set 3.2: A 57 ASN : amide:sc= -2.11! C(o=-2!,f=-3.1!) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 160:sc= 1.34 (180deg=0.538) USER MOD Single : A 1 ASN : amide:sc= -8.32! C(o=-8.3!,f=-8.6!) USER MOD Single : A 7 THR OG1 : rot -57:sc= 0.377 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 38:sc= 0.245 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 154:sc= -2.38 (180deg=-3.73!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.0402 USER MOD Single : A 27 THR OG1 : rot 170:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -165:sc= 0.306 (180deg=-0.0349) USER MOD Single : A 31 TYR OH : rot 130:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.706 USER MOD Single : A 37 TYR OH : rot -147:sc= 0.597 USER MOD Single : A 40 SER OG : rot -39:sc= 0.818 USER MOD Single : A 41 HIS : no HD1:sc= -0.0378 X(o=-0.038,f=-0.038) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.818 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -12.8! C(o=-13!,f=-8.5!) USER MOD Single : A 50 SER OG : rot -61:sc= 0.207 USER MOD Single : A 56 TYR OH : rot 3:sc= 0.0376 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 164:sc= -0.363 (180deg=-0.373) USER MOD Single : A 67 HIS : no HD1:sc= -0.0251 X(o=-0.025,f=-0.082) USER MOD Single : A 73 ASN : amide:sc=-0.00587 X(o=-0.0059,f=-0.41) USER MOD Single : A 75 GLN : amide:sc= -0.0177 K(o=-0.018,f=-2.7!) USER MOD Single : A 79 LYS NZ :NH3+ -108:sc= -0.0469 (180deg=-2.29!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 72:sc= 0.636 USER MOD Single : A 86 SER OG : rot -99:sc= 1.23 USER MOD Single : A 87 GLN : amide:sc= -5.43! K(o=-5.4!,f=-2.1) USER MOD Single : A 91 SER OG : rot -8:sc= 1.06 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -113:sc= -0.608 USER MOD Single : A 109 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 116 SER OG : rot 100:sc= 0.704 USER MOD Single : A 117 HIS : no HE2:sc= -0.5 K(o=-0.5,f=-1.3) USER MOD Single : A 121 GLN : amide:sc= -0.289 X(o=-0.29,f=0) USER MOD Single : A 127 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.12) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 129 HIS : no HD1:sc= -0.0497 X(o=-0.05,f=-0.13) USER MOD Single : A 130 HIS : no HD1:sc= -0.0539 X(o=-0.054,f=0) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 34.995 -3.083 0.921 1.00 0.00 N ATOM 2 CA MET A 0 33.700 -3.546 0.357 1.00 0.00 C ATOM 3 C MET A 0 32.770 -2.367 0.093 1.00 0.00 C ATOM 4 O MET A 0 32.540 -1.536 0.971 1.00 0.00 O ATOM 5 CB MET A 0 33.026 -4.534 1.315 1.00 0.00 C ATOM 6 CG MET A 0 33.795 -5.835 1.498 1.00 0.00 C ATOM 7 SD MET A 0 35.276 -5.639 2.509 1.00 0.00 S ATOM 8 CE MET A 0 35.898 -7.318 2.529 1.00 0.00 C ATOM 0 H1 MET A 0 35.468 -3.876 1.400 1.00 0.00 H new ATOM 0 H2 MET A 0 35.602 -2.730 0.153 1.00 0.00 H new ATOM 0 H3 MET A 0 34.822 -2.319 1.605 1.00 0.00 H new ATOM 0 HA MET A 0 33.903 -4.047 -0.590 1.00 0.00 H new ATOM 0 HB2 MET A 0 32.902 -4.056 2.287 1.00 0.00 H new ATOM 0 HB3 MET A 0 32.027 -4.763 0.943 1.00 0.00 H new ATOM 0 HG2 MET A 0 33.142 -6.575 1.959 1.00 0.00 H new ATOM 0 HG3 MET A 0 34.078 -6.225 0.520 1.00 0.00 H new ATOM 0 HE1 MET A 0 36.815 -7.359 3.117 1.00 0.00 H new ATOM 0 HE2 MET A 0 35.152 -7.977 2.973 1.00 0.00 H new ATOM 0 HE3 MET A 0 36.107 -7.641 1.509 1.00 0.00 H new ATOM 20 N ASN A 1 32.238 -2.300 -1.125 1.00 0.00 N ATOM 21 CA ASN A 1 31.333 -1.221 -1.509 1.00 0.00 C ATOM 22 C ASN A 1 30.298 -1.701 -2.520 1.00 0.00 C ATOM 23 O ASN A 1 30.590 -2.540 -3.373 1.00 0.00 O ATOM 24 CB ASN A 1 32.123 -0.046 -2.089 1.00 0.00 C ATOM 25 CG ASN A 1 32.385 1.037 -1.061 1.00 0.00 C ATOM 26 OD1 ASN A 1 33.421 1.699 -1.087 1.00 0.00 O ATOM 27 ND2 ASN A 1 31.435 1.224 -0.153 1.00 0.00 N ATOM 0 H ASN A 1 32.418 -2.981 -1.863 1.00 0.00 H new ATOM 0 HA ASN A 1 30.807 -0.892 -0.613 1.00 0.00 H new ATOM 0 HB2 ASN A 1 33.073 -0.409 -2.481 1.00 0.00 H new ATOM 0 HB3 ASN A 1 31.573 0.379 -2.929 1.00 0.00 H new ATOM 0 HD21 ASN A 1 31.548 1.942 0.563 1.00 0.00 H new ATOM 0 HD22 ASN A 1 30.592 0.650 -0.171 1.00 0.00 H new ATOM 34 N CYS A 2 29.088 -1.162 -2.414 1.00 0.00 N ATOM 35 CA CYS A 2 28.005 -1.529 -3.314 1.00 0.00 C ATOM 36 C CYS A 2 27.794 -0.464 -4.385 1.00 0.00 C ATOM 37 O CYS A 2 28.343 0.634 -4.295 1.00 0.00 O ATOM 38 CB CYS A 2 26.709 -1.733 -2.528 1.00 0.00 C ATOM 39 SG CYS A 2 26.704 -3.219 -1.477 1.00 0.00 S ATOM 0 H CYS A 2 28.834 -0.468 -1.711 1.00 0.00 H new ATOM 0 HA CYS A 2 28.281 -2.462 -3.805 1.00 0.00 H new ATOM 0 HB2 CYS A 2 26.535 -0.858 -1.902 1.00 0.00 H new ATOM 0 HB3 CYS A 2 25.877 -1.794 -3.229 1.00 0.00 H new ATOM 44 N GLY A 3 26.998 -0.796 -5.393 1.00 0.00 N ATOM 45 CA GLY A 3 26.701 0.162 -6.439 1.00 0.00 C ATOM 46 C GLY A 3 25.702 1.196 -5.957 1.00 0.00 C ATOM 47 O GLY A 3 24.780 0.852 -5.223 1.00 0.00 O ATOM 0 H GLY A 3 26.554 -1.708 -5.505 1.00 0.00 H new ATOM 0 HA2 GLY A 3 27.619 0.657 -6.756 1.00 0.00 H new ATOM 0 HA3 GLY A 3 26.302 -0.357 -7.310 1.00 0.00 H new ATOM 51 N PRO A 4 25.856 2.475 -6.349 1.00 0.00 N ATOM 52 CA PRO A 4 24.953 3.549 -5.927 1.00 0.00 C ATOM 53 C PRO A 4 23.499 3.096 -5.814 1.00 0.00 C ATOM 54 O PRO A 4 22.971 2.446 -6.717 1.00 0.00 O ATOM 55 CB PRO A 4 25.126 4.572 -7.043 1.00 0.00 C ATOM 56 CG PRO A 4 26.557 4.434 -7.439 1.00 0.00 C ATOM 57 CD PRO A 4 26.914 2.978 -7.248 1.00 0.00 C ATOM 0 HA PRO A 4 25.187 3.926 -4.931 1.00 0.00 H new ATOM 0 HB2 PRO A 4 24.459 4.367 -7.880 1.00 0.00 H new ATOM 0 HB3 PRO A 4 24.903 5.581 -6.698 1.00 0.00 H new ATOM 0 HG2 PRO A 4 26.704 4.737 -8.476 1.00 0.00 H new ATOM 0 HG3 PRO A 4 27.193 5.073 -6.827 1.00 0.00 H new ATOM 0 HD2 PRO A 4 26.924 2.440 -8.196 1.00 0.00 H new ATOM 0 HD3 PRO A 4 27.904 2.863 -6.806 1.00 0.00 H new ATOM 65 N PRO A 5 22.833 3.436 -4.692 1.00 0.00 N ATOM 66 CA PRO A 5 21.438 3.056 -4.451 1.00 0.00 C ATOM 67 C PRO A 5 20.522 3.423 -5.611 1.00 0.00 C ATOM 68 O PRO A 5 20.590 4.532 -6.143 1.00 0.00 O ATOM 69 CB PRO A 5 21.063 3.851 -3.199 1.00 0.00 C ATOM 70 CG PRO A 5 22.355 4.058 -2.491 1.00 0.00 C ATOM 71 CD PRO A 5 23.388 4.219 -3.571 1.00 0.00 C ATOM 0 HA PRO A 5 21.327 1.978 -4.337 1.00 0.00 H new ATOM 0 HB2 PRO A 5 20.595 4.801 -3.457 1.00 0.00 H new ATOM 0 HB3 PRO A 5 20.353 3.304 -2.579 1.00 0.00 H new ATOM 0 HG2 PRO A 5 22.315 4.941 -1.853 1.00 0.00 H new ATOM 0 HG3 PRO A 5 22.590 3.210 -1.848 1.00 0.00 H new ATOM 0 HD2 PRO A 5 23.527 5.266 -3.842 1.00 0.00 H new ATOM 0 HD3 PRO A 5 24.360 3.839 -3.257 1.00 0.00 H new ATOM 79 N PRO A 6 19.651 2.487 -6.019 1.00 0.00 N ATOM 80 CA PRO A 6 18.710 2.697 -7.118 1.00 0.00 C ATOM 81 C PRO A 6 17.515 3.540 -6.694 1.00 0.00 C ATOM 82 O PRO A 6 17.474 4.126 -5.612 1.00 0.00 O ATOM 83 CB PRO A 6 18.245 1.275 -7.479 1.00 0.00 C ATOM 84 CG PRO A 6 19.040 0.342 -6.620 1.00 0.00 C ATOM 85 CD PRO A 6 19.506 1.147 -5.444 1.00 0.00 C ATOM 0 HA PRO A 6 19.172 3.233 -7.947 1.00 0.00 H new ATOM 0 HB2 PRO A 6 17.177 1.157 -7.296 1.00 0.00 H new ATOM 0 HB3 PRO A 6 18.412 1.068 -8.536 1.00 0.00 H new ATOM 0 HG2 PRO A 6 18.431 -0.503 -6.297 1.00 0.00 H new ATOM 0 HG3 PRO A 6 19.887 -0.068 -7.171 1.00 0.00 H new ATOM 0 HD2 PRO A 6 18.783 1.131 -4.628 1.00 0.00 H new ATOM 0 HD3 PRO A 6 20.448 0.773 -5.043 1.00 0.00 H new ATOM 93 N THR A 7 16.546 3.568 -7.600 1.00 0.00 N ATOM 94 CA THR A 7 15.301 4.285 -7.406 1.00 0.00 C ATOM 95 C THR A 7 14.227 3.287 -6.991 1.00 0.00 C ATOM 96 O THR A 7 13.223 3.134 -7.687 1.00 0.00 O ATOM 97 CB THR A 7 14.879 4.998 -8.705 1.00 0.00 C ATOM 98 OG1 THR A 7 13.633 5.679 -8.514 1.00 0.00 O ATOM 99 CG2 THR A 7 14.757 4.013 -9.860 1.00 0.00 C ATOM 0 H THR A 7 16.607 3.088 -8.498 1.00 0.00 H new ATOM 0 HA THR A 7 15.433 5.040 -6.631 1.00 0.00 H new ATOM 0 HB THR A 7 15.653 5.724 -8.955 1.00 0.00 H new ATOM 0 HG1 THR A 7 12.952 5.039 -8.219 1.00 0.00 H new ATOM 0 HG21 THR A 7 14.458 4.546 -10.763 1.00 0.00 H new ATOM 0 HG22 THR A 7 15.718 3.527 -10.027 1.00 0.00 H new ATOM 0 HG23 THR A 7 14.007 3.260 -9.618 1.00 0.00 H new ATOM 107 N LEU A 8 14.428 2.602 -5.863 1.00 0.00 N ATOM 108 CA LEU A 8 13.472 1.582 -5.443 1.00 0.00 C ATOM 109 C LEU A 8 12.050 2.085 -5.639 1.00 0.00 C ATOM 110 O LEU A 8 11.654 3.080 -5.049 1.00 0.00 O ATOM 111 CB LEU A 8 13.683 1.218 -3.971 1.00 0.00 C ATOM 112 CG LEU A 8 14.998 0.504 -3.649 1.00 0.00 C ATOM 113 CD1 LEU A 8 16.174 1.462 -3.758 1.00 0.00 C ATOM 114 CD2 LEU A 8 14.936 -0.103 -2.256 1.00 0.00 C ATOM 0 H LEU A 8 15.224 2.732 -5.239 1.00 0.00 H new ATOM 0 HA LEU A 8 13.631 0.694 -6.054 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.632 2.131 -3.378 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.857 0.583 -3.650 1.00 0.00 H new ATOM 0 HG LEU A 8 15.143 -0.295 -4.376 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.098 0.932 -3.525 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.229 1.857 -4.772 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.040 2.284 -3.055 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.877 -0.608 -2.037 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.769 0.686 -1.523 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.118 -0.822 -2.208 1.00 0.00 H new ATOM 126 N SER A 9 11.291 1.405 -6.479 1.00 0.00 N ATOM 127 CA SER A 9 9.921 1.815 -6.747 1.00 0.00 C ATOM 128 C SER A 9 9.069 1.755 -5.483 1.00 0.00 C ATOM 129 O SER A 9 8.211 2.608 -5.264 1.00 0.00 O ATOM 130 CB SER A 9 9.305 0.934 -7.836 1.00 0.00 C ATOM 131 OG SER A 9 10.029 1.041 -9.048 1.00 0.00 O ATOM 0 H SER A 9 11.595 0.573 -6.985 1.00 0.00 H new ATOM 0 HA SER A 9 9.943 2.848 -7.094 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.295 -0.105 -7.505 1.00 0.00 H new ATOM 0 HB3 SER A 9 8.268 1.226 -8.001 1.00 0.00 H new ATOM 0 HG SER A 9 9.617 0.467 -9.727 1.00 0.00 H new ATOM 137 N PHE A 10 9.328 0.758 -4.643 1.00 0.00 N ATOM 138 CA PHE A 10 8.564 0.575 -3.409 1.00 0.00 C ATOM 139 C PHE A 10 8.941 1.588 -2.327 1.00 0.00 C ATOM 140 O PHE A 10 8.389 1.555 -1.227 1.00 0.00 O ATOM 141 CB PHE A 10 8.737 -0.849 -2.868 1.00 0.00 C ATOM 142 CG PHE A 10 9.917 -1.586 -3.436 1.00 0.00 C ATOM 143 CD1 PHE A 10 11.208 -1.255 -3.057 1.00 0.00 C ATOM 144 CD2 PHE A 10 9.734 -2.614 -4.347 1.00 0.00 C ATOM 145 CE1 PHE A 10 12.294 -1.934 -3.575 1.00 0.00 C ATOM 146 CE2 PHE A 10 10.817 -3.297 -4.870 1.00 0.00 C ATOM 147 CZ PHE A 10 12.098 -2.957 -4.483 1.00 0.00 C ATOM 0 H PHE A 10 10.060 0.064 -4.792 1.00 0.00 H new ATOM 0 HA PHE A 10 7.518 0.743 -3.666 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.839 -0.804 -1.784 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.832 -1.418 -3.079 1.00 0.00 H new ATOM 0 HD1 PHE A 10 11.367 -0.456 -2.348 1.00 0.00 H new ATOM 0 HD2 PHE A 10 8.734 -2.885 -4.652 1.00 0.00 H new ATOM 0 HE1 PHE A 10 13.295 -1.666 -3.271 1.00 0.00 H new ATOM 0 HE2 PHE A 10 10.661 -4.095 -5.580 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.945 -3.490 -4.889 1.00 0.00 H new ATOM 157 N ALA A 11 9.874 2.482 -2.631 1.00 0.00 N ATOM 158 CA ALA A 11 10.301 3.486 -1.658 1.00 0.00 C ATOM 159 C ALA A 11 10.925 4.699 -2.332 1.00 0.00 C ATOM 160 O ALA A 11 11.309 4.675 -3.495 1.00 0.00 O ATOM 161 CB ALA A 11 11.314 2.865 -0.709 1.00 0.00 C ATOM 0 H ALA A 11 10.347 2.535 -3.533 1.00 0.00 H new ATOM 0 HA ALA A 11 9.419 3.821 -1.113 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.635 3.610 0.019 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.857 2.023 -0.189 1.00 0.00 H new ATOM 0 HB3 ALA A 11 12.177 2.516 -1.276 1.00 0.00 H new ATOM 167 N ALA A 12 11.002 5.771 -1.555 1.00 0.00 N ATOM 168 CA ALA A 12 11.646 6.989 -2.015 1.00 0.00 C ATOM 169 C ALA A 12 12.624 7.492 -0.957 1.00 0.00 C ATOM 170 O ALA A 12 12.328 7.439 0.235 1.00 0.00 O ATOM 171 CB ALA A 12 10.611 8.054 -2.342 1.00 0.00 C ATOM 0 H ALA A 12 10.628 5.820 -0.607 1.00 0.00 H new ATOM 0 HA ALA A 12 12.200 6.769 -2.927 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.115 8.958 -2.685 1.00 0.00 H new ATOM 0 HB2 ALA A 12 9.948 7.689 -3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 12 10.027 8.280 -1.450 1.00 0.00 H new ATOM 177 N PRO A 13 13.803 7.986 -1.373 1.00 0.00 N ATOM 178 CA PRO A 13 14.820 8.483 -0.442 1.00 0.00 C ATOM 179 C PRO A 13 14.219 9.350 0.659 1.00 0.00 C ATOM 180 O PRO A 13 13.219 10.037 0.451 1.00 0.00 O ATOM 181 CB PRO A 13 15.737 9.308 -1.343 1.00 0.00 C ATOM 182 CG PRO A 13 15.635 8.649 -2.677 1.00 0.00 C ATOM 183 CD PRO A 13 14.227 8.121 -2.779 1.00 0.00 C ATOM 0 HA PRO A 13 15.331 7.677 0.085 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.418 10.349 -1.388 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.763 9.305 -0.975 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.844 9.358 -3.478 1.00 0.00 H new ATOM 0 HG3 PRO A 13 16.361 7.841 -2.769 1.00 0.00 H new ATOM 0 HD2 PRO A 13 13.581 8.806 -3.328 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.195 7.165 -3.301 1.00 0.00 H new ATOM 191 N MET A 14 14.846 9.309 1.833 1.00 0.00 N ATOM 192 CA MET A 14 14.364 10.084 2.970 1.00 0.00 C ATOM 193 C MET A 14 15.473 10.931 3.583 1.00 0.00 C ATOM 194 O MET A 14 15.210 11.891 4.307 1.00 0.00 O ATOM 195 CB MET A 14 13.774 9.153 4.031 1.00 0.00 C ATOM 196 CG MET A 14 12.992 9.883 5.112 1.00 0.00 C ATOM 197 SD MET A 14 12.453 8.789 6.441 1.00 0.00 S ATOM 198 CE MET A 14 11.684 9.964 7.553 1.00 0.00 C ATOM 0 H MET A 14 15.680 8.753 2.019 1.00 0.00 H new ATOM 0 HA MET A 14 13.588 10.758 2.606 1.00 0.00 H new ATOM 0 HB2 MET A 14 13.119 8.430 3.545 1.00 0.00 H new ATOM 0 HB3 MET A 14 14.581 8.588 4.497 1.00 0.00 H new ATOM 0 HG2 MET A 14 13.611 10.677 5.529 1.00 0.00 H new ATOM 0 HG3 MET A 14 12.121 10.361 4.664 1.00 0.00 H new ATOM 0 HE1 MET A 14 11.300 9.439 8.428 1.00 0.00 H new ATOM 0 HE2 MET A 14 12.421 10.703 7.868 1.00 0.00 H new ATOM 0 HE3 MET A 14 10.863 10.466 7.041 1.00 0.00 H new ATOM 208 N ASP A 15 16.715 10.566 3.286 1.00 0.00 N ATOM 209 CA ASP A 15 17.870 11.288 3.802 1.00 0.00 C ATOM 210 C ASP A 15 19.109 10.998 2.961 1.00 0.00 C ATOM 211 O ASP A 15 19.274 11.559 1.879 1.00 0.00 O ATOM 212 CB ASP A 15 18.119 10.915 5.263 1.00 0.00 C ATOM 213 CG ASP A 15 19.188 11.776 5.906 1.00 0.00 C ATOM 214 OD1 ASP A 15 18.862 12.899 6.341 1.00 0.00 O ATOM 215 OD2 ASP A 15 20.351 11.325 5.976 1.00 0.00 O ATOM 0 H ASP A 15 16.947 9.772 2.689 1.00 0.00 H new ATOM 0 HA ASP A 15 17.661 12.356 3.744 1.00 0.00 H new ATOM 0 HB2 ASP A 15 17.190 11.015 5.824 1.00 0.00 H new ATOM 0 HB3 ASP A 15 18.416 9.868 5.322 1.00 0.00 H new ATOM 220 N ILE A 16 19.970 10.116 3.473 1.00 0.00 N ATOM 221 CA ILE A 16 21.200 9.722 2.799 1.00 0.00 C ATOM 222 C ILE A 16 21.878 10.887 2.107 1.00 0.00 C ATOM 223 O ILE A 16 21.534 11.248 0.983 1.00 0.00 O ATOM 224 CB ILE A 16 20.983 8.586 1.773 1.00 0.00 C ATOM 225 CG1 ILE A 16 22.233 8.401 0.917 1.00 0.00 C ATOM 226 CG2 ILE A 16 19.775 8.852 0.893 1.00 0.00 C ATOM 227 CD1 ILE A 16 23.482 8.120 1.718 1.00 0.00 C ATOM 0 H ILE A 16 19.829 9.655 4.372 1.00 0.00 H new ATOM 0 HA ILE A 16 21.849 9.354 3.594 1.00 0.00 H new ATOM 0 HB ILE A 16 20.793 7.668 2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 16 22.067 7.580 0.220 1.00 0.00 H new ATOM 0 HG13 ILE A 16 22.390 9.299 0.320 1.00 0.00 H new ATOM 0 HG21 ILE A 16 19.654 8.033 0.184 1.00 0.00 H new ATOM 0 HG22 ILE A 16 18.883 8.930 1.514 1.00 0.00 H new ATOM 0 HG23 ILE A 16 19.920 9.785 0.348 1.00 0.00 H new ATOM 0 HD11 ILE A 16 24.329 8.000 1.042 1.00 0.00 H new ATOM 0 HD12 ILE A 16 23.674 8.951 2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 16 23.346 7.205 2.295 1.00 0.00 H new ATOM 239 N THR A 17 22.838 11.477 2.791 1.00 0.00 N ATOM 240 CA THR A 17 23.591 12.576 2.212 1.00 0.00 C ATOM 241 C THR A 17 24.211 12.119 0.903 1.00 0.00 C ATOM 242 O THR A 17 25.054 11.223 0.887 1.00 0.00 O ATOM 243 CB THR A 17 24.705 13.073 3.149 1.00 0.00 C ATOM 244 OG1 THR A 17 25.451 11.962 3.660 1.00 0.00 O ATOM 245 CG2 THR A 17 24.128 13.881 4.302 1.00 0.00 C ATOM 0 H THR A 17 23.114 11.219 3.738 1.00 0.00 H new ATOM 0 HA THR A 17 22.900 13.403 2.048 1.00 0.00 H new ATOM 0 HB THR A 17 25.368 13.719 2.574 1.00 0.00 H new ATOM 0 HG1 THR A 17 25.555 11.287 2.957 1.00 0.00 H new ATOM 0 HG21 THR A 17 24.937 14.220 4.949 1.00 0.00 H new ATOM 0 HG22 THR A 17 23.592 14.744 3.909 1.00 0.00 H new ATOM 0 HG23 THR A 17 23.442 13.258 4.875 1.00 0.00 H new ATOM 253 N LEU A 18 23.786 12.729 -0.193 1.00 0.00 N ATOM 254 CA LEU A 18 24.285 12.362 -1.503 1.00 0.00 C ATOM 255 C LEU A 18 25.675 12.939 -1.746 1.00 0.00 C ATOM 256 O LEU A 18 26.005 13.348 -2.860 1.00 0.00 O ATOM 257 CB LEU A 18 23.322 12.850 -2.583 1.00 0.00 C ATOM 258 CG LEU A 18 22.243 11.847 -3.001 1.00 0.00 C ATOM 259 CD1 LEU A 18 22.875 10.536 -3.445 1.00 0.00 C ATOM 260 CD2 LEU A 18 21.266 11.611 -1.862 1.00 0.00 C ATOM 0 H LEU A 18 23.096 13.480 -0.198 1.00 0.00 H new ATOM 0 HA LEU A 18 24.357 11.275 -1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 18 22.833 13.757 -2.227 1.00 0.00 H new ATOM 0 HB3 LEU A 18 23.901 13.125 -3.465 1.00 0.00 H new ATOM 0 HG LEU A 18 21.693 12.265 -3.844 1.00 0.00 H new ATOM 0 HD11 LEU A 18 22.093 9.836 -3.738 1.00 0.00 H new ATOM 0 HD12 LEU A 18 23.535 10.719 -4.293 1.00 0.00 H new ATOM 0 HD13 LEU A 18 23.451 10.113 -2.622 1.00 0.00 H new ATOM 0 HD21 LEU A 18 20.506 10.896 -2.177 1.00 0.00 H new ATOM 0 HD22 LEU A 18 21.802 11.215 -0.999 1.00 0.00 H new ATOM 0 HD23 LEU A 18 20.788 12.553 -1.592 1.00 0.00 H new ATOM 272 N THR A 19 26.487 12.957 -0.701 1.00 0.00 N ATOM 273 CA THR A 19 27.840 13.487 -0.787 1.00 0.00 C ATOM 274 C THR A 19 28.828 12.401 -1.194 1.00 0.00 C ATOM 275 O THR A 19 30.034 12.637 -1.259 1.00 0.00 O ATOM 276 CB THR A 19 28.280 14.093 0.556 1.00 0.00 C ATOM 277 OG1 THR A 19 28.459 13.056 1.528 1.00 0.00 O ATOM 278 CG2 THR A 19 27.244 15.089 1.057 1.00 0.00 C ATOM 0 H THR A 19 26.231 12.608 0.223 1.00 0.00 H new ATOM 0 HA THR A 19 27.834 14.268 -1.548 1.00 0.00 H new ATOM 0 HB THR A 19 29.226 14.614 0.405 1.00 0.00 H new ATOM 0 HG1 THR A 19 28.741 13.451 2.380 1.00 0.00 H new ATOM 0 HG21 THR A 19 27.572 15.508 2.008 1.00 0.00 H new ATOM 0 HG22 THR A 19 27.128 15.891 0.328 1.00 0.00 H new ATOM 0 HG23 THR A 19 26.289 14.582 1.194 1.00 0.00 H new ATOM 286 N GLU A 20 28.305 11.211 -1.471 1.00 0.00 N ATOM 287 CA GLU A 20 29.134 10.082 -1.872 1.00 0.00 C ATOM 288 C GLU A 20 28.419 9.226 -2.913 1.00 0.00 C ATOM 289 O GLU A 20 27.198 9.291 -3.054 1.00 0.00 O ATOM 290 CB GLU A 20 29.491 9.228 -0.653 1.00 0.00 C ATOM 291 CG GLU A 20 30.501 9.881 0.277 1.00 0.00 C ATOM 292 CD GLU A 20 31.853 10.086 -0.380 1.00 0.00 C ATOM 293 OE1 GLU A 20 32.593 9.092 -0.537 1.00 0.00 O ATOM 294 OE2 GLU A 20 32.171 11.239 -0.737 1.00 0.00 O ATOM 0 H GLU A 20 27.307 11.004 -1.425 1.00 0.00 H new ATOM 0 HA GLU A 20 30.050 10.474 -2.315 1.00 0.00 H new ATOM 0 HB2 GLU A 20 28.581 9.012 -0.093 1.00 0.00 H new ATOM 0 HB3 GLU A 20 29.889 8.272 -0.994 1.00 0.00 H new ATOM 0 HG2 GLU A 20 30.113 10.844 0.610 1.00 0.00 H new ATOM 0 HG3 GLU A 20 30.623 9.262 1.166 1.00 0.00 H new ATOM 301 N THR A 21 29.190 8.425 -3.642 1.00 0.00 N ATOM 302 CA THR A 21 28.633 7.554 -4.670 1.00 0.00 C ATOM 303 C THR A 21 28.754 6.089 -4.260 1.00 0.00 C ATOM 304 O THR A 21 28.149 5.208 -4.870 1.00 0.00 O ATOM 305 CB THR A 21 29.340 7.759 -6.023 1.00 0.00 C ATOM 306 OG1 THR A 21 29.563 9.156 -6.252 1.00 0.00 O ATOM 307 CG2 THR A 21 28.510 7.187 -7.162 1.00 0.00 C ATOM 0 H THR A 21 30.203 8.361 -3.539 1.00 0.00 H new ATOM 0 HA THR A 21 27.581 7.816 -4.779 1.00 0.00 H new ATOM 0 HB THR A 21 30.295 7.235 -5.989 1.00 0.00 H new ATOM 0 HG1 THR A 21 30.014 9.278 -7.113 1.00 0.00 H new ATOM 0 HG21 THR A 21 29.031 7.344 -8.106 1.00 0.00 H new ATOM 0 HG22 THR A 21 28.361 6.119 -7.003 1.00 0.00 H new ATOM 0 HG23 THR A 21 27.542 7.687 -7.194 1.00 0.00 H new ATOM 315 N ARG A 22 29.541 5.840 -3.216 1.00 0.00 N ATOM 316 CA ARG A 22 29.747 4.488 -2.710 1.00 0.00 C ATOM 317 C ARG A 22 29.335 4.414 -1.244 1.00 0.00 C ATOM 318 O ARG A 22 29.300 5.436 -0.557 1.00 0.00 O ATOM 319 CB ARG A 22 31.207 4.076 -2.860 1.00 0.00 C ATOM 320 CG ARG A 22 31.692 4.058 -4.301 1.00 0.00 C ATOM 321 CD ARG A 22 33.189 3.806 -4.385 1.00 0.00 C ATOM 322 NE ARG A 22 33.554 2.482 -3.891 1.00 0.00 N ATOM 323 CZ ARG A 22 34.811 2.076 -3.731 1.00 0.00 C ATOM 324 NH1 ARG A 22 35.816 2.892 -4.018 1.00 0.00 N ATOM 325 NH2 ARG A 22 35.064 0.854 -3.282 1.00 0.00 N ATOM 0 H ARG A 22 30.048 6.561 -2.703 1.00 0.00 H new ATOM 0 HA ARG A 22 29.131 3.802 -3.292 1.00 0.00 H new ATOM 0 HB2 ARG A 22 31.830 4.761 -2.285 1.00 0.00 H new ATOM 0 HB3 ARG A 22 31.342 3.084 -2.428 1.00 0.00 H new ATOM 0 HG2 ARG A 22 31.161 3.284 -4.855 1.00 0.00 H new ATOM 0 HG3 ARG A 22 31.455 5.010 -4.777 1.00 0.00 H new ATOM 0 HD2 ARG A 22 33.515 3.908 -5.420 1.00 0.00 H new ATOM 0 HD3 ARG A 22 33.716 4.565 -3.808 1.00 0.00 H new ATOM 0 HE ARG A 22 32.804 1.832 -3.655 1.00 0.00 H new ATOM 0 HH11 ARG A 22 35.626 3.833 -4.362 1.00 0.00 H new ATOM 0 HH12 ARG A 22 36.779 2.578 -3.894 1.00 0.00 H new ATOM 0 HH21 ARG A 22 34.294 0.223 -3.059 1.00 0.00 H new ATOM 0 HH22 ARG A 22 36.028 0.545 -3.160 1.00 0.00 H new ATOM 339 N PHE A 23 29.029 3.212 -0.760 1.00 0.00 N ATOM 340 CA PHE A 23 28.598 3.015 0.623 1.00 0.00 C ATOM 341 C PHE A 23 29.028 1.635 1.112 1.00 0.00 C ATOM 342 O PHE A 23 28.525 0.615 0.638 1.00 0.00 O ATOM 343 CB PHE A 23 27.076 3.169 0.721 1.00 0.00 C ATOM 344 CG PHE A 23 26.556 4.385 0.011 1.00 0.00 C ATOM 345 CD1 PHE A 23 26.379 4.374 -1.363 1.00 0.00 C ATOM 346 CD2 PHE A 23 26.276 5.549 0.707 1.00 0.00 C ATOM 347 CE1 PHE A 23 25.934 5.496 -2.029 1.00 0.00 C ATOM 348 CE2 PHE A 23 25.825 6.674 0.046 1.00 0.00 C ATOM 349 CZ PHE A 23 25.656 6.648 -1.324 1.00 0.00 C ATOM 0 H PHE A 23 29.072 2.354 -1.310 1.00 0.00 H new ATOM 0 HA PHE A 23 29.067 3.769 1.256 1.00 0.00 H new ATOM 0 HB2 PHE A 23 26.600 2.282 0.303 1.00 0.00 H new ATOM 0 HB3 PHE A 23 26.790 3.220 1.771 1.00 0.00 H new ATOM 0 HD1 PHE A 23 26.593 3.474 -1.920 1.00 0.00 H new ATOM 0 HD2 PHE A 23 26.412 5.577 1.778 1.00 0.00 H new ATOM 0 HE1 PHE A 23 25.803 5.473 -3.101 1.00 0.00 H new ATOM 0 HE2 PHE A 23 25.604 7.574 0.600 1.00 0.00 H new ATOM 0 HZ PHE A 23 25.307 7.529 -1.843 1.00 0.00 H new ATOM 359 N LYS A 24 29.966 1.612 2.055 1.00 0.00 N ATOM 360 CA LYS A 24 30.495 0.360 2.593 1.00 0.00 C ATOM 361 C LYS A 24 29.395 -0.600 3.028 1.00 0.00 C ATOM 362 O LYS A 24 28.235 -0.216 3.170 1.00 0.00 O ATOM 363 CB LYS A 24 31.439 0.630 3.763 1.00 0.00 C ATOM 364 CG LYS A 24 31.037 1.824 4.615 1.00 0.00 C ATOM 365 CD LYS A 24 29.993 1.447 5.655 1.00 0.00 C ATOM 366 CE LYS A 24 29.747 2.586 6.631 1.00 0.00 C ATOM 367 NZ LYS A 24 28.773 2.210 7.693 1.00 0.00 N ATOM 0 H LYS A 24 30.378 2.450 2.465 1.00 0.00 H new ATOM 0 HA LYS A 24 31.047 -0.117 1.783 1.00 0.00 H new ATOM 0 HB2 LYS A 24 31.482 -0.257 4.395 1.00 0.00 H new ATOM 0 HB3 LYS A 24 32.445 0.794 3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 24 31.918 2.228 5.114 1.00 0.00 H new ATOM 0 HG3 LYS A 24 30.644 2.613 3.974 1.00 0.00 H new ATOM 0 HD2 LYS A 24 29.060 1.184 5.157 1.00 0.00 H new ATOM 0 HD3 LYS A 24 30.323 0.563 6.201 1.00 0.00 H new ATOM 0 HE2 LYS A 24 30.690 2.879 7.092 1.00 0.00 H new ATOM 0 HE3 LYS A 24 29.374 3.455 6.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 28.948 2.783 8.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 27.805 2.381 7.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 28.885 1.203 7.926 1.00 0.00 H new ATOM 381 N THR A 25 29.780 -1.854 3.242 1.00 0.00 N ATOM 382 CA THR A 25 28.843 -2.890 3.636 1.00 0.00 C ATOM 383 C THR A 25 28.260 -2.659 5.023 1.00 0.00 C ATOM 384 O THR A 25 27.454 -3.456 5.504 1.00 0.00 O ATOM 385 CB THR A 25 29.498 -4.272 3.611 1.00 0.00 C ATOM 386 OG1 THR A 25 30.856 -4.182 4.058 1.00 0.00 O ATOM 387 CG2 THR A 25 29.446 -4.890 2.215 1.00 0.00 C ATOM 0 H THR A 25 30.743 -2.175 3.147 1.00 0.00 H new ATOM 0 HA THR A 25 28.034 -2.846 2.906 1.00 0.00 H new ATOM 0 HB THR A 25 28.938 -4.920 4.286 1.00 0.00 H new ATOM 0 HG1 THR A 25 31.266 -5.072 4.040 1.00 0.00 H new ATOM 0 HG21 THR A 25 29.920 -5.871 2.234 1.00 0.00 H new ATOM 0 HG22 THR A 25 28.407 -4.995 1.902 1.00 0.00 H new ATOM 0 HG23 THR A 25 29.974 -4.245 1.512 1.00 0.00 H new ATOM 395 N GLY A 26 28.665 -1.577 5.664 1.00 0.00 N ATOM 396 CA GLY A 26 28.162 -1.279 6.991 1.00 0.00 C ATOM 397 C GLY A 26 27.139 -0.167 6.968 1.00 0.00 C ATOM 398 O GLY A 26 26.463 0.089 7.965 1.00 0.00 O ATOM 0 H GLY A 26 29.331 -0.899 5.293 1.00 0.00 H new ATOM 0 HA2 GLY A 26 27.714 -2.176 7.420 1.00 0.00 H new ATOM 0 HA3 GLY A 26 28.992 -0.996 7.639 1.00 0.00 H new ATOM 402 N THR A 27 27.031 0.495 5.824 1.00 0.00 N ATOM 403 CA THR A 27 26.094 1.602 5.649 1.00 0.00 C ATOM 404 C THR A 27 24.651 1.113 5.679 1.00 0.00 C ATOM 405 O THR A 27 24.395 -0.089 5.634 1.00 0.00 O ATOM 406 CB THR A 27 26.340 2.335 4.318 1.00 0.00 C ATOM 407 OG1 THR A 27 25.773 3.649 4.371 1.00 0.00 O ATOM 408 CG2 THR A 27 25.726 1.564 3.161 1.00 0.00 C ATOM 0 H THR A 27 27.586 0.283 4.995 1.00 0.00 H new ATOM 0 HA THR A 27 26.260 2.290 6.478 1.00 0.00 H new ATOM 0 HB THR A 27 27.416 2.409 4.161 1.00 0.00 H new ATOM 0 HG1 THR A 27 26.069 4.165 3.592 1.00 0.00 H new ATOM 0 HG21 THR A 27 25.911 2.098 2.229 1.00 0.00 H new ATOM 0 HG22 THR A 27 26.175 0.572 3.106 1.00 0.00 H new ATOM 0 HG23 THR A 27 24.652 1.468 3.317 1.00 0.00 H new ATOM 416 N THR A 28 23.710 2.052 5.746 1.00 0.00 N ATOM 417 CA THR A 28 22.291 1.710 5.773 1.00 0.00 C ATOM 418 C THR A 28 21.421 2.922 5.453 1.00 0.00 C ATOM 419 O THR A 28 21.550 3.973 6.081 1.00 0.00 O ATOM 420 CB THR A 28 21.870 1.144 7.144 1.00 0.00 C ATOM 421 OG1 THR A 28 22.653 -0.011 7.467 1.00 0.00 O ATOM 422 CG2 THR A 28 20.394 0.776 7.149 1.00 0.00 C ATOM 0 H THR A 28 23.904 3.053 5.782 1.00 0.00 H new ATOM 0 HA THR A 28 22.142 0.946 5.010 1.00 0.00 H new ATOM 0 HB THR A 28 22.041 1.917 7.893 1.00 0.00 H new ATOM 0 HG1 THR A 28 23.113 -0.330 6.662 1.00 0.00 H new ATOM 0 HG21 THR A 28 20.121 0.379 8.127 1.00 0.00 H new ATOM 0 HG22 THR A 28 19.797 1.663 6.938 1.00 0.00 H new ATOM 0 HG23 THR A 28 20.205 0.021 6.386 1.00 0.00 H new ATOM 430 N LEU A 29 20.536 2.769 4.472 1.00 0.00 N ATOM 431 CA LEU A 29 19.655 3.858 4.058 1.00 0.00 C ATOM 432 C LEU A 29 18.387 3.899 4.907 1.00 0.00 C ATOM 433 O LEU A 29 18.340 3.344 6.006 1.00 0.00 O ATOM 434 CB LEU A 29 19.269 3.713 2.581 1.00 0.00 C ATOM 435 CG LEU A 29 20.411 3.866 1.570 1.00 0.00 C ATOM 436 CD1 LEU A 29 21.236 5.110 1.866 1.00 0.00 C ATOM 437 CD2 LEU A 29 21.287 2.626 1.563 1.00 0.00 C ATOM 0 H LEU A 29 20.410 1.902 3.949 1.00 0.00 H new ATOM 0 HA LEU A 29 20.204 4.789 4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 29 18.814 2.733 2.439 1.00 0.00 H new ATOM 0 HB3 LEU A 29 18.505 4.455 2.351 1.00 0.00 H new ATOM 0 HG LEU A 29 19.974 3.982 0.578 1.00 0.00 H new ATOM 0 HD11 LEU A 29 22.040 5.196 1.135 1.00 0.00 H new ATOM 0 HD12 LEU A 29 20.598 5.992 1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 29 21.662 5.034 2.866 1.00 0.00 H new ATOM 0 HD21 LEU A 29 22.092 2.753 0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 29 21.712 2.475 2.555 1.00 0.00 H new ATOM 0 HD23 LEU A 29 20.687 1.758 1.289 1.00 0.00 H new ATOM 449 N LYS A 30 17.362 4.566 4.382 1.00 0.00 N ATOM 450 CA LYS A 30 16.081 4.688 5.066 1.00 0.00 C ATOM 451 C LYS A 30 14.934 4.425 4.094 1.00 0.00 C ATOM 452 O LYS A 30 14.302 3.370 4.139 1.00 0.00 O ATOM 453 CB LYS A 30 15.936 6.079 5.688 1.00 0.00 C ATOM 454 CG LYS A 30 14.716 6.223 6.585 1.00 0.00 C ATOM 455 CD LYS A 30 14.802 5.306 7.797 1.00 0.00 C ATOM 456 CE LYS A 30 13.605 5.485 8.717 1.00 0.00 C ATOM 457 NZ LYS A 30 13.492 6.883 9.218 1.00 0.00 N ATOM 0 H LYS A 30 17.397 5.034 3.476 1.00 0.00 H new ATOM 0 HA LYS A 30 16.044 3.945 5.863 1.00 0.00 H new ATOM 0 HB2 LYS A 30 16.831 6.303 6.268 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.879 6.820 4.891 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.627 7.258 6.916 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.816 5.992 6.016 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.856 4.269 7.467 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.720 5.514 8.347 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.694 5.216 8.183 1.00 0.00 H new ATOM 0 HE3 LYS A 30 13.692 4.803 9.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 12.835 6.911 10.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 14.428 7.220 9.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.134 7.496 8.458 1.00 0.00 H new ATOM 471 N TYR A 31 14.680 5.392 3.214 1.00 0.00 N ATOM 472 CA TYR A 31 13.620 5.275 2.212 1.00 0.00 C ATOM 473 C TYR A 31 12.236 5.185 2.855 1.00 0.00 C ATOM 474 O TYR A 31 12.063 4.574 3.909 1.00 0.00 O ATOM 475 CB TYR A 31 13.873 4.061 1.314 1.00 0.00 C ATOM 476 CG TYR A 31 15.004 4.263 0.330 1.00 0.00 C ATOM 477 CD1 TYR A 31 14.797 4.933 -0.869 1.00 0.00 C ATOM 478 CD2 TYR A 31 16.280 3.787 0.603 1.00 0.00 C ATOM 479 CE1 TYR A 31 15.828 5.122 -1.768 1.00 0.00 C ATOM 480 CE2 TYR A 31 17.317 3.973 -0.291 1.00 0.00 C ATOM 481 CZ TYR A 31 17.086 4.640 -1.475 1.00 0.00 C ATOM 482 OH TYR A 31 18.117 4.826 -2.367 1.00 0.00 O ATOM 0 H TYR A 31 15.197 6.270 3.174 1.00 0.00 H new ATOM 0 HA TYR A 31 13.638 6.179 1.604 1.00 0.00 H new ATOM 0 HB2 TYR A 31 14.096 3.197 1.939 1.00 0.00 H new ATOM 0 HB3 TYR A 31 12.961 3.829 0.764 1.00 0.00 H new ATOM 0 HD1 TYR A 31 13.813 5.313 -1.102 1.00 0.00 H new ATOM 0 HD2 TYR A 31 16.465 3.263 1.529 1.00 0.00 H new ATOM 0 HE1 TYR A 31 15.650 5.645 -2.696 1.00 0.00 H new ATOM 0 HE2 TYR A 31 18.304 3.598 -0.063 1.00 0.00 H new ATOM 0 HH TYR A 31 18.893 5.198 -1.898 1.00 0.00 H new ATOM 492 N THR A 32 11.254 5.808 2.206 1.00 0.00 N ATOM 493 CA THR A 32 9.879 5.822 2.697 1.00 0.00 C ATOM 494 C THR A 32 8.998 4.852 1.909 1.00 0.00 C ATOM 495 O THR A 32 9.489 3.879 1.338 1.00 0.00 O ATOM 496 CB THR A 32 9.282 7.240 2.598 1.00 0.00 C ATOM 497 OG1 THR A 32 8.609 7.407 1.344 1.00 0.00 O ATOM 498 CG2 THR A 32 10.373 8.291 2.723 1.00 0.00 C ATOM 0 H THR A 32 11.388 6.314 1.331 1.00 0.00 H new ATOM 0 HA THR A 32 9.904 5.508 3.740 1.00 0.00 H new ATOM 0 HB THR A 32 8.570 7.365 3.414 1.00 0.00 H new ATOM 0 HG1 THR A 32 8.232 8.310 1.293 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.931 9.285 2.651 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.872 8.185 3.686 1.00 0.00 H new ATOM 0 HG23 THR A 32 11.100 8.158 1.922 1.00 0.00 H new ATOM 506 N CYS A 33 7.693 5.119 1.888 1.00 0.00 N ATOM 507 CA CYS A 33 6.745 4.274 1.168 1.00 0.00 C ATOM 508 C CYS A 33 5.469 5.039 0.830 1.00 0.00 C ATOM 509 O CYS A 33 4.702 5.440 1.705 1.00 0.00 O ATOM 510 CB CYS A 33 6.394 3.038 1.998 1.00 0.00 C ATOM 511 SG CYS A 33 7.350 1.549 1.572 1.00 0.00 S ATOM 0 H CYS A 33 7.269 5.916 2.363 1.00 0.00 H new ATOM 0 HA CYS A 33 7.221 3.963 0.238 1.00 0.00 H new ATOM 0 HB2 CYS A 33 6.551 3.267 3.052 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.333 2.821 1.874 1.00 0.00 H new ATOM 516 N LEU A 34 5.284 5.229 -0.478 1.00 0.00 N ATOM 517 CA LEU A 34 4.142 5.959 -1.013 1.00 0.00 C ATOM 518 C LEU A 34 2.856 5.571 -0.280 1.00 0.00 C ATOM 519 O LEU A 34 2.667 4.415 0.095 1.00 0.00 O ATOM 520 CB LEU A 34 4.030 5.728 -2.522 1.00 0.00 C ATOM 521 CG LEU A 34 5.349 5.907 -3.288 1.00 0.00 C ATOM 522 CD1 LEU A 34 5.169 5.598 -4.766 1.00 0.00 C ATOM 523 CD2 LEU A 34 5.890 7.317 -3.102 1.00 0.00 C ATOM 0 H LEU A 34 5.923 4.880 -1.192 1.00 0.00 H new ATOM 0 HA LEU A 34 4.295 7.026 -0.848 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.656 4.719 -2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.290 6.417 -2.929 1.00 0.00 H new ATOM 0 HG LEU A 34 6.072 5.201 -2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.118 5.733 -5.284 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.834 4.567 -4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 34 4.425 6.272 -5.191 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.825 7.424 -3.652 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.164 8.038 -3.477 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.070 7.501 -2.043 1.00 0.00 H new ATOM 535 N PRO A 35 1.962 6.552 -0.069 1.00 0.00 N ATOM 536 CA PRO A 35 0.702 6.366 0.664 1.00 0.00 C ATOM 537 C PRO A 35 -0.111 5.142 0.248 1.00 0.00 C ATOM 538 O PRO A 35 -0.578 5.043 -0.886 1.00 0.00 O ATOM 539 CB PRO A 35 -0.092 7.650 0.364 1.00 0.00 C ATOM 540 CG PRO A 35 0.669 8.356 -0.710 1.00 0.00 C ATOM 541 CD PRO A 35 2.096 7.932 -0.550 1.00 0.00 C ATOM 0 HA PRO A 35 0.910 6.192 1.720 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -1.105 7.416 0.037 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.181 8.272 1.254 1.00 0.00 H new ATOM 0 HG2 PRO A 35 0.291 8.089 -1.697 1.00 0.00 H new ATOM 0 HG3 PRO A 35 0.570 9.437 -0.613 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.643 7.983 -1.491 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.629 8.561 0.163 1.00 0.00 H new ATOM 549 N GLY A 36 -0.269 4.211 1.190 1.00 0.00 N ATOM 550 CA GLY A 36 -1.067 3.020 0.953 1.00 0.00 C ATOM 551 C GLY A 36 -0.271 1.830 0.464 1.00 0.00 C ATOM 552 O GLY A 36 -0.818 0.740 0.338 1.00 0.00 O ATOM 0 H GLY A 36 0.146 4.264 2.120 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -1.577 2.748 1.877 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.839 3.253 0.220 1.00 0.00 H new ATOM 556 N TYR A 37 0.994 2.059 0.136 1.00 0.00 N ATOM 557 CA TYR A 37 1.882 1.014 -0.359 1.00 0.00 C ATOM 558 C TYR A 37 1.638 -0.363 0.235 1.00 0.00 C ATOM 559 O TYR A 37 2.173 -1.331 -0.283 1.00 0.00 O ATOM 560 CB TYR A 37 3.342 1.401 -0.158 1.00 0.00 C ATOM 561 CG TYR A 37 4.094 1.388 -1.456 1.00 0.00 C ATOM 562 CD1 TYR A 37 4.597 0.207 -1.981 1.00 0.00 C ATOM 563 CD2 TYR A 37 4.256 2.552 -2.181 1.00 0.00 C ATOM 564 CE1 TYR A 37 5.242 0.189 -3.199 1.00 0.00 C ATOM 565 CE2 TYR A 37 4.908 2.547 -3.398 1.00 0.00 C ATOM 566 CZ TYR A 37 5.397 1.363 -3.904 1.00 0.00 C ATOM 567 OH TYR A 37 6.029 1.349 -5.124 1.00 0.00 O ATOM 0 H TYR A 37 1.434 2.976 0.206 1.00 0.00 H new ATOM 0 HA TYR A 37 1.650 0.935 -1.421 1.00 0.00 H new ATOM 0 HB2 TYR A 37 3.399 2.394 0.288 1.00 0.00 H new ATOM 0 HB3 TYR A 37 3.810 0.710 0.543 1.00 0.00 H new ATOM 0 HD1 TYR A 37 4.482 -0.713 -1.427 1.00 0.00 H new ATOM 0 HD2 TYR A 37 3.867 3.480 -1.790 1.00 0.00 H new ATOM 0 HE1 TYR A 37 5.623 -0.739 -3.598 1.00 0.00 H new ATOM 0 HE2 TYR A 37 5.034 3.467 -3.950 1.00 0.00 H new ATOM 0 HH TYR A 37 6.517 2.190 -5.249 1.00 0.00 H new ATOM 577 N VAL A 38 0.906 -0.477 1.337 1.00 0.00 N ATOM 578 CA VAL A 38 0.627 -1.800 1.875 1.00 0.00 C ATOM 579 C VAL A 38 1.938 -2.460 2.299 1.00 0.00 C ATOM 580 O VAL A 38 3.010 -1.969 1.944 1.00 0.00 O ATOM 581 CB VAL A 38 -0.090 -2.673 0.813 1.00 0.00 C ATOM 582 CG1 VAL A 38 -0.369 -4.068 1.330 1.00 0.00 C ATOM 583 CG2 VAL A 38 -1.380 -2.014 0.356 1.00 0.00 C ATOM 0 H VAL A 38 0.507 0.303 1.860 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.028 -1.704 2.741 1.00 0.00 H new ATOM 0 HB VAL A 38 0.582 -2.762 -0.041 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.872 -4.649 0.557 1.00 0.00 H new ATOM 0 HG12 VAL A 38 0.571 -4.553 1.594 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.007 -4.008 2.212 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.866 -2.644 -0.389 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -2.044 -1.883 1.210 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.156 -1.041 -0.082 1.00 0.00 H new ATOM 593 N ARG A 39 1.887 -3.553 3.051 1.00 0.00 N ATOM 594 CA ARG A 39 3.127 -4.205 3.456 1.00 0.00 C ATOM 595 C ARG A 39 2.903 -5.472 4.264 1.00 0.00 C ATOM 596 O ARG A 39 1.793 -5.773 4.702 1.00 0.00 O ATOM 597 CB ARG A 39 3.993 -3.237 4.266 1.00 0.00 C ATOM 598 CG ARG A 39 3.301 -2.691 5.505 1.00 0.00 C ATOM 599 CD ARG A 39 4.164 -1.664 6.219 1.00 0.00 C ATOM 600 NE ARG A 39 4.516 -0.544 5.350 1.00 0.00 N ATOM 601 CZ ARG A 39 5.011 0.608 5.795 1.00 0.00 C ATOM 602 NH1 ARG A 39 5.209 0.792 7.094 1.00 0.00 N ATOM 603 NH2 ARG A 39 5.308 1.578 4.940 1.00 0.00 N ATOM 0 H ARG A 39 1.030 -3.995 3.384 1.00 0.00 H new ATOM 0 HA ARG A 39 3.635 -4.494 2.536 1.00 0.00 H new ATOM 0 HB2 ARG A 39 4.909 -3.746 4.566 1.00 0.00 H new ATOM 0 HB3 ARG A 39 4.287 -2.404 3.627 1.00 0.00 H new ATOM 0 HG2 ARG A 39 2.352 -2.236 5.222 1.00 0.00 H new ATOM 0 HG3 ARG A 39 3.071 -3.511 6.186 1.00 0.00 H new ATOM 0 HD2 ARG A 39 3.633 -1.290 7.094 1.00 0.00 H new ATOM 0 HD3 ARG A 39 5.074 -2.143 6.579 1.00 0.00 H new ATOM 0 HE ARG A 39 4.374 -0.651 4.346 1.00 0.00 H new ATOM 0 HH11 ARG A 39 4.982 0.049 7.755 1.00 0.00 H new ATOM 0 HH12 ARG A 39 5.589 1.676 7.432 1.00 0.00 H new ATOM 0 HH21 ARG A 39 5.157 1.441 3.941 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.687 2.461 5.282 1.00 0.00 H new ATOM 617 N SER A 40 3.996 -6.204 4.446 1.00 0.00 N ATOM 618 CA SER A 40 3.998 -7.442 5.206 1.00 0.00 C ATOM 619 C SER A 40 5.040 -7.354 6.320 1.00 0.00 C ATOM 620 O SER A 40 5.480 -8.369 6.861 1.00 0.00 O ATOM 621 CB SER A 40 4.307 -8.621 4.280 1.00 0.00 C ATOM 622 OG SER A 40 4.255 -9.852 4.981 1.00 0.00 O ATOM 0 H SER A 40 4.909 -5.951 4.067 1.00 0.00 H new ATOM 0 HA SER A 40 3.015 -7.597 5.651 1.00 0.00 H new ATOM 0 HB2 SER A 40 3.592 -8.638 3.457 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.296 -8.492 3.840 1.00 0.00 H new ATOM 0 HG SER A 40 4.650 -9.739 5.871 1.00 0.00 H new ATOM 628 N HIS A 41 5.424 -6.117 6.646 1.00 0.00 N ATOM 629 CA HIS A 41 6.414 -5.840 7.688 1.00 0.00 C ATOM 630 C HIS A 41 7.815 -6.258 7.248 1.00 0.00 C ATOM 631 O HIS A 41 8.417 -5.613 6.390 1.00 0.00 O ATOM 632 CB HIS A 41 6.045 -6.542 8.993 1.00 0.00 C ATOM 633 CG HIS A 41 4.631 -6.309 9.427 1.00 0.00 C ATOM 634 ND1 HIS A 41 4.136 -5.059 9.736 1.00 0.00 N ATOM 635 CD2 HIS A 41 3.601 -7.171 9.600 1.00 0.00 C ATOM 636 CE1 HIS A 41 2.865 -5.162 10.080 1.00 0.00 C ATOM 637 NE2 HIS A 41 2.515 -6.433 10.006 1.00 0.00 N ATOM 0 H HIS A 41 5.057 -5.280 6.194 1.00 0.00 H new ATOM 0 HA HIS A 41 6.414 -4.763 7.858 1.00 0.00 H new ATOM 0 HB2 HIS A 41 6.207 -7.614 8.877 1.00 0.00 H new ATOM 0 HB3 HIS A 41 6.717 -6.201 9.780 1.00 0.00 H new ATOM 0 HD2 HIS A 41 3.628 -8.240 9.447 1.00 0.00 H new ATOM 0 HE1 HIS A 41 2.221 -4.345 10.372 1.00 0.00 H new ATOM 0 HE2 HIS A 41 1.589 -6.806 10.216 1.00 0.00 H new ATOM 646 N SER A 42 8.325 -7.337 7.843 1.00 0.00 N ATOM 647 CA SER A 42 9.654 -7.848 7.518 1.00 0.00 C ATOM 648 C SER A 42 10.749 -6.877 7.948 1.00 0.00 C ATOM 649 O SER A 42 11.400 -7.069 8.975 1.00 0.00 O ATOM 650 CB SER A 42 9.767 -8.132 6.019 1.00 0.00 C ATOM 651 OG SER A 42 8.823 -9.106 5.612 1.00 0.00 O ATOM 0 H SER A 42 7.833 -7.875 8.556 1.00 0.00 H new ATOM 0 HA SER A 42 9.791 -8.778 8.070 1.00 0.00 H new ATOM 0 HB2 SER A 42 9.608 -7.211 5.458 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.774 -8.478 5.786 1.00 0.00 H new ATOM 0 HG SER A 42 9.161 -9.579 4.823 1.00 0.00 H new ATOM 657 N THR A 43 10.940 -5.835 7.153 1.00 0.00 N ATOM 658 CA THR A 43 11.966 -4.829 7.427 1.00 0.00 C ATOM 659 C THR A 43 11.730 -3.563 6.604 1.00 0.00 C ATOM 660 O THR A 43 10.631 -3.344 6.095 1.00 0.00 O ATOM 661 CB THR A 43 13.375 -5.363 7.104 1.00 0.00 C ATOM 662 OG1 THR A 43 13.390 -6.794 7.164 1.00 0.00 O ATOM 663 CG2 THR A 43 14.405 -4.804 8.074 1.00 0.00 C ATOM 0 H THR A 43 10.397 -5.660 6.308 1.00 0.00 H new ATOM 0 HA THR A 43 11.900 -4.595 8.490 1.00 0.00 H new ATOM 0 HB THR A 43 13.632 -5.040 6.095 1.00 0.00 H new ATOM 0 HG1 THR A 43 14.290 -7.121 6.955 1.00 0.00 H new ATOM 0 HG21 THR A 43 15.391 -5.196 7.824 1.00 0.00 H new ATOM 0 HG22 THR A 43 14.419 -3.716 8.003 1.00 0.00 H new ATOM 0 HG23 THR A 43 14.144 -5.098 9.091 1.00 0.00 H new ATOM 671 N GLN A 44 12.773 -2.736 6.479 1.00 0.00 N ATOM 672 CA GLN A 44 12.691 -1.491 5.714 1.00 0.00 C ATOM 673 C GLN A 44 14.018 -0.730 5.759 1.00 0.00 C ATOM 674 O GLN A 44 14.076 0.398 6.249 1.00 0.00 O ATOM 675 CB GLN A 44 11.565 -0.605 6.256 1.00 0.00 C ATOM 676 CG GLN A 44 11.654 -0.352 7.753 1.00 0.00 C ATOM 677 CD GLN A 44 10.570 0.581 8.254 1.00 0.00 C ATOM 678 OE1 GLN A 44 10.736 1.801 8.254 1.00 0.00 O ATOM 679 NE2 GLN A 44 9.453 0.012 8.691 1.00 0.00 N ATOM 0 H GLN A 44 13.686 -2.909 6.900 1.00 0.00 H new ATOM 0 HA GLN A 44 12.476 -1.749 4.677 1.00 0.00 H new ATOM 0 HB2 GLN A 44 11.583 0.351 5.733 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.606 -1.073 6.032 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.583 -1.302 8.283 1.00 0.00 H new ATOM 0 HG3 GLN A 44 12.630 0.072 7.988 1.00 0.00 H new ATOM 0 HE21 GLN A 44 9.357 -1.003 8.673 1.00 0.00 H new ATOM 0 HE22 GLN A 44 8.691 0.590 9.045 1.00 0.00 H new ATOM 688 N THR A 45 15.079 -1.342 5.228 1.00 0.00 N ATOM 689 CA THR A 45 16.402 -0.718 5.224 1.00 0.00 C ATOM 690 C THR A 45 17.295 -1.299 4.132 1.00 0.00 C ATOM 691 O THR A 45 17.221 -2.487 3.820 1.00 0.00 O ATOM 692 CB THR A 45 17.115 -0.887 6.579 1.00 0.00 C ATOM 693 OG1 THR A 45 16.964 -2.232 7.050 1.00 0.00 O ATOM 694 CG2 THR A 45 16.563 0.085 7.610 1.00 0.00 C ATOM 0 H THR A 45 15.047 -2.266 4.797 1.00 0.00 H new ATOM 0 HA THR A 45 16.236 0.342 5.031 1.00 0.00 H new ATOM 0 HB THR A 45 18.174 -0.671 6.435 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.422 -2.330 7.911 1.00 0.00 H new ATOM 0 HG21 THR A 45 17.083 -0.055 8.557 1.00 0.00 H new ATOM 0 HG22 THR A 45 16.711 1.107 7.262 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.498 -0.099 7.750 1.00 0.00 H new ATOM 702 N LEU A 46 18.139 -0.447 3.557 1.00 0.00 N ATOM 703 CA LEU A 46 19.056 -0.860 2.499 1.00 0.00 C ATOM 704 C LEU A 46 20.493 -0.872 3.020 1.00 0.00 C ATOM 705 O LEU A 46 21.077 0.178 3.281 1.00 0.00 O ATOM 706 CB LEU A 46 18.946 0.079 1.294 1.00 0.00 C ATOM 707 CG LEU A 46 17.938 -0.346 0.223 1.00 0.00 C ATOM 708 CD1 LEU A 46 16.547 -0.490 0.822 1.00 0.00 C ATOM 709 CD2 LEU A 46 17.925 0.654 -0.924 1.00 0.00 C ATOM 0 H LEU A 46 18.207 0.539 3.808 1.00 0.00 H new ATOM 0 HA LEU A 46 18.784 -1.867 2.183 1.00 0.00 H new ATOM 0 HB2 LEU A 46 18.674 1.072 1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 46 19.929 0.165 0.831 1.00 0.00 H new ATOM 0 HG LEU A 46 18.243 -1.316 -0.169 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.846 -0.793 0.044 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.566 -1.245 1.608 1.00 0.00 H new ATOM 0 HD13 LEU A 46 16.232 0.464 1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 46 17.203 0.336 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 46 17.646 1.638 -0.546 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.917 0.706 -1.373 1.00 0.00 H new ATOM 721 N THR A 47 21.057 -2.068 3.172 1.00 0.00 N ATOM 722 CA THR A 47 22.428 -2.215 3.654 1.00 0.00 C ATOM 723 C THR A 47 23.307 -2.820 2.571 1.00 0.00 C ATOM 724 O THR A 47 22.828 -3.596 1.744 1.00 0.00 O ATOM 725 CB THR A 47 22.499 -3.120 4.899 1.00 0.00 C ATOM 726 OG1 THR A 47 21.479 -2.752 5.834 1.00 0.00 O ATOM 727 CG2 THR A 47 23.863 -3.016 5.565 1.00 0.00 C ATOM 0 H THR A 47 20.586 -2.949 2.968 1.00 0.00 H new ATOM 0 HA THR A 47 22.782 -1.218 3.918 1.00 0.00 H new ATOM 0 HB THR A 47 22.343 -4.150 4.580 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.531 -3.334 6.621 1.00 0.00 H new ATOM 0 HG21 THR A 47 23.890 -3.663 6.442 1.00 0.00 H new ATOM 0 HG22 THR A 47 24.636 -3.325 4.861 1.00 0.00 H new ATOM 0 HG23 THR A 47 24.041 -1.985 5.870 1.00 0.00 H new ATOM 735 N CYS A 48 24.590 -2.471 2.566 1.00 0.00 N ATOM 736 CA CYS A 48 25.490 -3.019 1.568 1.00 0.00 C ATOM 737 C CYS A 48 25.933 -4.401 2.019 1.00 0.00 C ATOM 738 O CYS A 48 26.556 -4.560 3.068 1.00 0.00 O ATOM 739 CB CYS A 48 26.690 -2.096 1.342 1.00 0.00 C ATOM 740 SG CYS A 48 27.876 -2.703 0.098 1.00 0.00 S ATOM 0 H CYS A 48 25.019 -1.825 3.228 1.00 0.00 H new ATOM 0 HA CYS A 48 24.970 -3.100 0.613 1.00 0.00 H new ATOM 0 HB2 CYS A 48 26.327 -1.116 1.033 1.00 0.00 H new ATOM 0 HB3 CYS A 48 27.212 -1.959 2.289 1.00 0.00 H new ATOM 745 N ASN A 49 25.585 -5.399 1.226 1.00 0.00 N ATOM 746 CA ASN A 49 25.971 -6.770 1.511 1.00 0.00 C ATOM 747 C ASN A 49 27.178 -7.151 0.659 1.00 0.00 C ATOM 748 O ASN A 49 27.660 -6.343 -0.136 1.00 0.00 O ATOM 749 CB ASN A 49 24.802 -7.712 1.230 1.00 0.00 C ATOM 750 CG ASN A 49 24.176 -7.445 -0.120 1.00 0.00 C ATOM 751 OD1 ASN A 49 24.470 -8.123 -1.099 1.00 0.00 O ATOM 752 ND2 ASN A 49 23.315 -6.439 -0.177 1.00 0.00 N ATOM 0 H ASN A 49 25.033 -5.285 0.376 1.00 0.00 H new ATOM 0 HA ASN A 49 26.240 -6.857 2.564 1.00 0.00 H new ATOM 0 HB2 ASN A 49 25.149 -8.744 1.272 1.00 0.00 H new ATOM 0 HB3 ASN A 49 24.048 -7.598 2.009 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.866 -6.201 -1.062 1.00 0.00 H new ATOM 0 HD22 ASN A 49 23.101 -5.903 0.664 1.00 0.00 H new ATOM 759 N SER A 50 27.664 -8.374 0.819 1.00 0.00 N ATOM 760 CA SER A 50 28.811 -8.838 0.047 1.00 0.00 C ATOM 761 C SER A 50 28.332 -9.516 -1.237 1.00 0.00 C ATOM 762 O SER A 50 28.563 -10.705 -1.455 1.00 0.00 O ATOM 763 CB SER A 50 29.654 -9.810 0.876 1.00 0.00 C ATOM 764 OG SER A 50 30.789 -10.250 0.150 1.00 0.00 O ATOM 0 H SER A 50 27.286 -9.060 1.472 1.00 0.00 H new ATOM 0 HA SER A 50 29.431 -7.980 -0.214 1.00 0.00 H new ATOM 0 HB2 SER A 50 29.974 -9.324 1.797 1.00 0.00 H new ATOM 0 HB3 SER A 50 29.047 -10.669 1.163 1.00 0.00 H new ATOM 0 HG SER A 50 30.498 -10.728 -0.654 1.00 0.00 H new ATOM 770 N ASP A 51 27.659 -8.736 -2.077 1.00 0.00 N ATOM 771 CA ASP A 51 27.129 -9.211 -3.352 1.00 0.00 C ATOM 772 C ASP A 51 27.213 -8.106 -4.396 1.00 0.00 C ATOM 773 O ASP A 51 26.792 -8.276 -5.541 1.00 0.00 O ATOM 774 CB ASP A 51 25.668 -9.624 -3.193 1.00 0.00 C ATOM 775 CG ASP A 51 25.205 -10.553 -4.297 1.00 0.00 C ATOM 776 OD1 ASP A 51 24.796 -10.050 -5.365 1.00 0.00 O ATOM 777 OD2 ASP A 51 25.253 -11.785 -4.095 1.00 0.00 O ATOM 0 H ASP A 51 27.465 -7.752 -1.892 1.00 0.00 H new ATOM 0 HA ASP A 51 27.721 -10.068 -3.672 1.00 0.00 H new ATOM 0 HB2 ASP A 51 25.535 -10.116 -2.229 1.00 0.00 H new ATOM 0 HB3 ASP A 51 25.040 -8.733 -3.185 1.00 0.00 H new ATOM 782 N GLY A 52 27.765 -6.972 -3.985 1.00 0.00 N ATOM 783 CA GLY A 52 27.881 -5.839 -4.882 1.00 0.00 C ATOM 784 C GLY A 52 26.552 -5.160 -5.152 1.00 0.00 C ATOM 785 O GLY A 52 26.416 -4.355 -6.073 1.00 0.00 O ATOM 0 H GLY A 52 28.134 -6.816 -3.047 1.00 0.00 H new ATOM 0 HA2 GLY A 52 28.573 -5.114 -4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 52 28.311 -6.173 -5.826 1.00 0.00 H new ATOM 789 N GLU A 53 25.577 -5.509 -4.321 1.00 0.00 N ATOM 790 CA GLU A 53 24.242 -4.934 -4.443 1.00 0.00 C ATOM 791 C GLU A 53 23.625 -4.652 -3.082 1.00 0.00 C ATOM 792 O GLU A 53 24.222 -4.926 -2.043 1.00 0.00 O ATOM 793 CB GLU A 53 23.329 -5.878 -5.228 1.00 0.00 C ATOM 794 CG GLU A 53 22.776 -7.024 -4.392 1.00 0.00 C ATOM 795 CD GLU A 53 21.913 -7.972 -5.201 1.00 0.00 C ATOM 796 OE1 GLU A 53 22.469 -8.912 -5.808 1.00 0.00 O ATOM 797 OE2 GLU A 53 20.680 -7.777 -5.227 1.00 0.00 O ATOM 0 H GLU A 53 25.683 -6.181 -3.561 1.00 0.00 H new ATOM 0 HA GLU A 53 24.342 -3.989 -4.976 1.00 0.00 H new ATOM 0 HB2 GLU A 53 22.498 -5.306 -5.641 1.00 0.00 H new ATOM 0 HB3 GLU A 53 23.884 -6.289 -6.071 1.00 0.00 H new ATOM 0 HG2 GLU A 53 23.604 -7.579 -3.950 1.00 0.00 H new ATOM 0 HG3 GLU A 53 22.189 -6.618 -3.568 1.00 0.00 H new ATOM 804 N TRP A 54 22.422 -4.090 -3.109 1.00 0.00 N ATOM 805 CA TRP A 54 21.689 -3.779 -1.903 1.00 0.00 C ATOM 806 C TRP A 54 20.680 -4.877 -1.608 1.00 0.00 C ATOM 807 O TRP A 54 19.734 -5.099 -2.362 1.00 0.00 O ATOM 808 CB TRP A 54 20.984 -2.435 -2.065 1.00 0.00 C ATOM 809 CG TRP A 54 21.932 -1.295 -2.282 1.00 0.00 C ATOM 810 CD1 TRP A 54 22.186 -0.648 -3.457 1.00 0.00 C ATOM 811 CD2 TRP A 54 22.756 -0.672 -1.295 1.00 0.00 C ATOM 812 NE1 TRP A 54 23.119 0.340 -3.256 1.00 0.00 N ATOM 813 CE2 TRP A 54 23.486 0.345 -1.938 1.00 0.00 C ATOM 814 CE3 TRP A 54 22.947 -0.877 0.070 1.00 0.00 C ATOM 815 CZ2 TRP A 54 24.393 1.156 -1.259 1.00 0.00 C ATOM 816 CZ3 TRP A 54 23.845 -0.073 0.745 1.00 0.00 C ATOM 817 CH2 TRP A 54 24.558 0.932 0.079 1.00 0.00 C ATOM 0 H TRP A 54 21.934 -3.840 -3.969 1.00 0.00 H new ATOM 0 HA TRP A 54 22.383 -3.715 -1.065 1.00 0.00 H new ATOM 0 HB2 TRP A 54 20.295 -2.492 -2.908 1.00 0.00 H new ATOM 0 HB3 TRP A 54 20.384 -2.237 -1.177 1.00 0.00 H new ATOM 0 HD1 TRP A 54 21.722 -0.879 -4.405 1.00 0.00 H new ATOM 0 HE1 TRP A 54 23.480 0.969 -3.974 1.00 0.00 H new ATOM 0 HE3 TRP A 54 22.403 -1.651 0.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 24.944 1.931 -1.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 24.000 -0.222 1.803 1.00 0.00 H new ATOM 0 HH2 TRP A 54 25.253 1.543 0.635 1.00 0.00 H new ATOM 828 N VAL A 55 20.904 -5.557 -0.495 1.00 0.00 N ATOM 829 CA VAL A 55 20.055 -6.650 -0.050 1.00 0.00 C ATOM 830 C VAL A 55 19.061 -6.123 0.974 1.00 0.00 C ATOM 831 O VAL A 55 19.376 -5.184 1.706 1.00 0.00 O ATOM 832 CB VAL A 55 20.900 -7.788 0.564 1.00 0.00 C ATOM 833 CG1 VAL A 55 20.178 -8.450 1.723 1.00 0.00 C ATOM 834 CG2 VAL A 55 21.271 -8.814 -0.496 1.00 0.00 C ATOM 0 H VAL A 55 21.687 -5.364 0.130 1.00 0.00 H new ATOM 0 HA VAL A 55 19.519 -7.056 -0.908 1.00 0.00 H new ATOM 0 HB VAL A 55 21.818 -7.347 0.953 1.00 0.00 H new ATOM 0 HG11 VAL A 55 20.800 -9.246 2.132 1.00 0.00 H new ATOM 0 HG12 VAL A 55 19.979 -7.710 2.498 1.00 0.00 H new ATOM 0 HG13 VAL A 55 19.235 -8.870 1.372 1.00 0.00 H new ATOM 0 HG21 VAL A 55 21.866 -9.607 -0.043 1.00 0.00 H new ATOM 0 HG22 VAL A 55 20.363 -9.240 -0.923 1.00 0.00 H new ATOM 0 HG23 VAL A 55 21.850 -8.331 -1.283 1.00 0.00 H new ATOM 844 N TYR A 56 17.877 -6.733 1.045 1.00 0.00 N ATOM 845 CA TYR A 56 16.879 -6.303 2.022 1.00 0.00 C ATOM 846 C TYR A 56 15.528 -6.977 1.801 1.00 0.00 C ATOM 847 O TYR A 56 15.329 -7.668 0.801 1.00 0.00 O ATOM 848 CB TYR A 56 16.694 -4.783 1.964 1.00 0.00 C ATOM 849 CG TYR A 56 16.401 -4.271 0.567 1.00 0.00 C ATOM 850 CD1 TYR A 56 15.113 -4.302 0.049 1.00 0.00 C ATOM 851 CD2 TYR A 56 17.418 -3.769 -0.238 1.00 0.00 C ATOM 852 CE1 TYR A 56 14.845 -3.848 -1.228 1.00 0.00 C ATOM 853 CE2 TYR A 56 17.158 -3.311 -1.516 1.00 0.00 C ATOM 854 CZ TYR A 56 15.871 -3.354 -2.006 1.00 0.00 C ATOM 855 OH TYR A 56 15.608 -2.903 -3.280 1.00 0.00 O ATOM 0 H TYR A 56 17.590 -7.511 0.450 1.00 0.00 H new ATOM 0 HA TYR A 56 17.251 -6.598 3.003 1.00 0.00 H new ATOM 0 HB2 TYR A 56 15.878 -4.497 2.628 1.00 0.00 H new ATOM 0 HB3 TYR A 56 17.595 -4.299 2.340 1.00 0.00 H new ATOM 0 HD1 TYR A 56 14.307 -4.688 0.655 1.00 0.00 H new ATOM 0 HD2 TYR A 56 18.428 -3.736 0.142 1.00 0.00 H new ATOM 0 HE1 TYR A 56 13.837 -3.880 -1.615 1.00 0.00 H new ATOM 0 HE2 TYR A 56 17.959 -2.922 -2.127 1.00 0.00 H new ATOM 0 HH TYR A 56 14.646 -2.961 -3.455 1.00 0.00 H new ATOM 865 N ASN A 57 14.604 -6.777 2.730 1.00 0.00 N ATOM 866 CA ASN A 57 13.276 -7.367 2.613 1.00 0.00 C ATOM 867 C ASN A 57 12.316 -6.389 1.946 1.00 0.00 C ATOM 868 O ASN A 57 12.651 -5.223 1.734 1.00 0.00 O ATOM 869 CB ASN A 57 12.744 -7.770 3.987 1.00 0.00 C ATOM 870 CG ASN A 57 12.215 -9.192 4.003 1.00 0.00 C ATOM 871 OD1 ASN A 57 11.058 -9.441 3.664 1.00 0.00 O ATOM 872 ND2 ASN A 57 13.063 -10.134 4.398 1.00 0.00 N ATOM 0 H ASN A 57 14.747 -6.214 3.569 1.00 0.00 H new ATOM 0 HA ASN A 57 13.353 -8.261 1.994 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.540 -7.672 4.726 1.00 0.00 H new ATOM 0 HB3 ASN A 57 11.949 -7.085 4.282 1.00 0.00 H new ATOM 0 HD21 ASN A 57 12.764 -11.109 4.429 1.00 0.00 H new ATOM 0 HD22 ASN A 57 14.013 -9.883 4.670 1.00 0.00 H new ATOM 879 N THR A 58 11.122 -6.866 1.615 1.00 0.00 N ATOM 880 CA THR A 58 10.120 -6.028 0.972 1.00 0.00 C ATOM 881 C THR A 58 9.307 -5.268 2.014 1.00 0.00 C ATOM 882 O THR A 58 8.293 -5.760 2.508 1.00 0.00 O ATOM 883 CB THR A 58 9.170 -6.860 0.091 1.00 0.00 C ATOM 884 OG1 THR A 58 9.902 -7.896 -0.575 1.00 0.00 O ATOM 885 CG2 THR A 58 8.484 -5.980 -0.942 1.00 0.00 C ATOM 0 H THR A 58 10.825 -7.828 1.781 1.00 0.00 H new ATOM 0 HA THR A 58 10.651 -5.319 0.337 1.00 0.00 H new ATOM 0 HB THR A 58 8.410 -7.305 0.733 1.00 0.00 H new ATOM 0 HG1 THR A 58 9.291 -8.422 -1.132 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.818 -6.588 -1.553 1.00 0.00 H new ATOM 0 HG22 THR A 58 7.907 -5.207 -0.435 1.00 0.00 H new ATOM 0 HG23 THR A 58 9.235 -5.513 -1.579 1.00 0.00 H new ATOM 893 N PHE A 59 9.768 -4.067 2.348 1.00 0.00 N ATOM 894 CA PHE A 59 9.100 -3.237 3.344 1.00 0.00 C ATOM 895 C PHE A 59 7.675 -2.879 2.923 1.00 0.00 C ATOM 896 O PHE A 59 6.826 -2.606 3.771 1.00 0.00 O ATOM 897 CB PHE A 59 9.904 -1.961 3.605 1.00 0.00 C ATOM 898 CG PHE A 59 10.590 -1.415 2.387 1.00 0.00 C ATOM 899 CD1 PHE A 59 9.860 -0.825 1.370 1.00 0.00 C ATOM 900 CD2 PHE A 59 11.968 -1.491 2.264 1.00 0.00 C ATOM 901 CE1 PHE A 59 10.492 -0.322 0.249 1.00 0.00 C ATOM 902 CE2 PHE A 59 12.606 -0.989 1.146 1.00 0.00 C ATOM 903 CZ PHE A 59 11.867 -0.404 0.138 1.00 0.00 C ATOM 0 H PHE A 59 10.604 -3.646 1.942 1.00 0.00 H new ATOM 0 HA PHE A 59 9.041 -3.819 4.264 1.00 0.00 H new ATOM 0 HB2 PHE A 59 9.237 -1.198 4.007 1.00 0.00 H new ATOM 0 HB3 PHE A 59 10.652 -2.165 4.371 1.00 0.00 H new ATOM 0 HD1 PHE A 59 8.785 -0.757 1.453 1.00 0.00 H new ATOM 0 HD2 PHE A 59 12.550 -1.948 3.051 1.00 0.00 H new ATOM 0 HE1 PHE A 59 9.912 0.135 -0.539 1.00 0.00 H new ATOM 0 HE2 PHE A 59 13.681 -1.054 1.061 1.00 0.00 H new ATOM 0 HZ PHE A 59 12.363 -0.011 -0.737 1.00 0.00 H new ATOM 913 N CYS A 60 7.416 -2.876 1.618 1.00 0.00 N ATOM 914 CA CYS A 60 6.087 -2.547 1.106 1.00 0.00 C ATOM 915 C CYS A 60 5.753 -3.381 -0.131 1.00 0.00 C ATOM 916 O CYS A 60 6.629 -3.686 -0.939 1.00 0.00 O ATOM 917 CB CYS A 60 5.997 -1.052 0.787 1.00 0.00 C ATOM 918 SG CYS A 60 6.192 0.024 2.245 1.00 0.00 S ATOM 0 H CYS A 60 8.104 -3.096 0.898 1.00 0.00 H new ATOM 0 HA CYS A 60 5.356 -2.785 1.878 1.00 0.00 H new ATOM 0 HB2 CYS A 60 6.764 -0.799 0.055 1.00 0.00 H new ATOM 0 HB3 CYS A 60 5.033 -0.847 0.322 1.00 0.00 H new ATOM 923 N ILE A 61 4.478 -3.738 -0.274 1.00 0.00 N ATOM 924 CA ILE A 61 4.030 -4.558 -1.399 1.00 0.00 C ATOM 925 C ILE A 61 3.110 -3.787 -2.349 1.00 0.00 C ATOM 926 O ILE A 61 3.315 -3.793 -3.563 1.00 0.00 O ATOM 927 CB ILE A 61 3.324 -5.833 -0.893 1.00 0.00 C ATOM 928 CG1 ILE A 61 2.456 -5.508 0.328 1.00 0.00 C ATOM 929 CG2 ILE A 61 4.354 -6.901 -0.548 1.00 0.00 C ATOM 930 CD1 ILE A 61 1.894 -6.729 1.027 1.00 0.00 C ATOM 0 H ILE A 61 3.737 -3.473 0.375 1.00 0.00 H new ATOM 0 HA ILE A 61 4.920 -4.839 -1.963 1.00 0.00 H new ATOM 0 HB ILE A 61 2.679 -6.217 -1.683 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.049 -4.935 1.041 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.630 -4.869 0.014 1.00 0.00 H new ATOM 0 HG21 ILE A 61 3.844 -7.796 -0.192 1.00 0.00 H new ATOM 0 HG22 ILE A 61 4.937 -7.144 -1.436 1.00 0.00 H new ATOM 0 HG23 ILE A 61 5.018 -6.528 0.231 1.00 0.00 H new ATOM 0 HD11 ILE A 61 1.292 -6.415 1.880 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.272 -7.292 0.331 1.00 0.00 H new ATOM 0 HD13 ILE A 61 2.713 -7.359 1.374 1.00 0.00 H new ATOM 942 N TYR A 62 2.095 -3.138 -1.787 1.00 0.00 N ATOM 943 CA TYR A 62 1.139 -2.336 -2.566 1.00 0.00 C ATOM 944 C TYR A 62 0.194 -3.215 -3.375 1.00 0.00 C ATOM 945 O TYR A 62 0.595 -3.879 -4.332 1.00 0.00 O ATOM 946 CB TYR A 62 1.879 -1.349 -3.478 1.00 0.00 C ATOM 947 CG TYR A 62 1.133 -0.057 -3.742 1.00 0.00 C ATOM 948 CD1 TYR A 62 -0.234 -0.034 -3.994 1.00 0.00 C ATOM 949 CD2 TYR A 62 1.812 1.150 -3.718 1.00 0.00 C ATOM 950 CE1 TYR A 62 -0.895 1.161 -4.217 1.00 0.00 C ATOM 951 CE2 TYR A 62 1.166 2.347 -3.934 1.00 0.00 C ATOM 952 CZ TYR A 62 -0.190 2.349 -4.183 1.00 0.00 C ATOM 953 OH TYR A 62 -0.841 3.542 -4.400 1.00 0.00 O ATOM 0 H TYR A 62 1.907 -3.149 -0.785 1.00 0.00 H new ATOM 0 HA TYR A 62 0.533 -1.769 -1.860 1.00 0.00 H new ATOM 0 HB2 TYR A 62 2.843 -1.112 -3.029 1.00 0.00 H new ATOM 0 HB3 TYR A 62 2.083 -1.837 -4.431 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.787 -0.961 -4.016 1.00 0.00 H new ATOM 0 HD2 TYR A 62 2.875 1.153 -3.525 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.956 1.165 -4.417 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.717 3.276 -3.909 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.199 4.280 -4.340 1.00 0.00 H new ATOM 963 N LYS A 63 -1.071 -3.199 -2.967 1.00 0.00 N ATOM 964 CA LYS A 63 -2.112 -3.982 -3.619 1.00 0.00 C ATOM 965 C LYS A 63 -3.490 -3.498 -3.173 1.00 0.00 C ATOM 966 O LYS A 63 -3.925 -3.782 -2.058 1.00 0.00 O ATOM 967 CB LYS A 63 -1.938 -5.464 -3.286 1.00 0.00 C ATOM 968 CG LYS A 63 -1.951 -5.755 -1.794 1.00 0.00 C ATOM 969 CD LYS A 63 -1.507 -7.175 -1.497 1.00 0.00 C ATOM 970 CE LYS A 63 -0.005 -7.330 -1.631 1.00 0.00 C ATOM 971 NZ LYS A 63 0.428 -8.741 -1.440 1.00 0.00 N ATOM 0 H LYS A 63 -1.402 -2.644 -2.177 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.029 -3.853 -4.698 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.735 -6.032 -3.766 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.997 -5.815 -3.709 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -1.294 -5.053 -1.280 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.955 -5.598 -1.401 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -1.813 -7.449 -0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.007 -7.863 -2.179 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.309 -6.984 -2.616 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.492 -6.696 -0.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.397 -8.858 -1.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.403 -8.978 -0.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.213 -9.374 -1.960 1.00 0.00 H new ATOM 985 N ARG A 64 -4.175 -2.756 -4.038 1.00 0.00 N ATOM 986 CA ARG A 64 -5.497 -2.225 -3.723 1.00 0.00 C ATOM 987 C ARG A 64 -6.599 -3.151 -4.229 1.00 0.00 C ATOM 988 O ARG A 64 -6.331 -4.267 -4.669 1.00 0.00 O ATOM 989 CB ARG A 64 -5.666 -0.832 -4.336 1.00 0.00 C ATOM 990 CG ARG A 64 -5.284 -0.762 -5.804 1.00 0.00 C ATOM 991 CD ARG A 64 -3.890 -0.187 -5.989 1.00 0.00 C ATOM 992 NE ARG A 64 -3.852 1.252 -5.736 1.00 0.00 N ATOM 993 CZ ARG A 64 -3.656 2.162 -6.685 1.00 0.00 C ATOM 994 NH1 ARG A 64 -3.500 1.787 -7.948 1.00 0.00 N ATOM 995 NH2 ARG A 64 -3.619 3.451 -6.373 1.00 0.00 N ATOM 0 H ARG A 64 -3.834 -2.508 -4.967 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.581 -2.155 -2.638 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.704 -0.519 -4.224 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.057 -0.122 -3.777 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -5.328 -1.760 -6.241 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.007 -0.147 -6.340 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.198 -0.692 -5.315 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.548 -0.385 -7.005 1.00 0.00 H new ATOM 0 HE ARG A 64 -3.983 1.576 -4.778 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -3.530 0.797 -8.194 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -3.350 2.488 -8.673 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -3.741 3.745 -5.404 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -3.469 4.148 -7.102 1.00 0.00 H new ATOM 1009 N CYS A 65 -7.840 -2.674 -4.172 1.00 0.00 N ATOM 1010 CA CYS A 65 -8.985 -3.453 -4.621 1.00 0.00 C ATOM 1011 C CYS A 65 -9.728 -2.701 -5.711 1.00 0.00 C ATOM 1012 O CYS A 65 -9.567 -1.489 -5.852 1.00 0.00 O ATOM 1013 CB CYS A 65 -9.934 -3.730 -3.453 1.00 0.00 C ATOM 1014 SG CYS A 65 -9.119 -4.400 -1.971 1.00 0.00 S ATOM 0 H CYS A 65 -8.076 -1.747 -3.817 1.00 0.00 H new ATOM 0 HA CYS A 65 -8.624 -4.402 -5.017 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -10.443 -2.804 -3.186 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -10.700 -4.432 -3.781 1.00 0.00 H new ATOM 1019 N ARG A 66 -10.539 -3.410 -6.485 1.00 0.00 N ATOM 1020 CA ARG A 66 -11.289 -2.764 -7.547 1.00 0.00 C ATOM 1021 C ARG A 66 -12.375 -1.879 -6.948 1.00 0.00 C ATOM 1022 O ARG A 66 -13.034 -2.256 -5.982 1.00 0.00 O ATOM 1023 CB ARG A 66 -11.890 -3.796 -8.504 1.00 0.00 C ATOM 1024 CG ARG A 66 -12.656 -3.181 -9.667 1.00 0.00 C ATOM 1025 CD ARG A 66 -11.774 -2.262 -10.496 1.00 0.00 C ATOM 1026 NE ARG A 66 -12.463 -1.769 -11.686 1.00 0.00 N ATOM 1027 CZ ARG A 66 -11.883 -1.015 -12.616 1.00 0.00 C ATOM 1028 NH1 ARG A 66 -10.611 -0.661 -12.490 1.00 0.00 N ATOM 1029 NH2 ARG A 66 -12.577 -0.615 -13.674 1.00 0.00 N ATOM 0 H ARG A 66 -10.691 -4.415 -6.398 1.00 0.00 H new ATOM 0 HA ARG A 66 -10.607 -2.140 -8.125 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -11.089 -4.422 -8.899 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -12.560 -4.450 -7.945 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.054 -3.974 -10.301 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -13.509 -2.620 -9.285 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -11.456 -1.417 -9.885 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -10.873 -2.797 -10.795 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.444 -2.017 -11.811 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -10.074 -0.967 -11.678 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -10.169 -0.083 -13.205 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -13.555 -0.886 -13.774 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.132 -0.037 -14.387 1.00 0.00 H new ATOM 1043 N HIS A 67 -12.554 -0.707 -7.535 1.00 0.00 N ATOM 1044 CA HIS A 67 -13.544 0.241 -7.052 1.00 0.00 C ATOM 1045 C HIS A 67 -14.925 -0.403 -6.922 1.00 0.00 C ATOM 1046 O HIS A 67 -15.440 -0.975 -7.883 1.00 0.00 O ATOM 1047 CB HIS A 67 -13.618 1.434 -8.002 1.00 0.00 C ATOM 1048 CG HIS A 67 -12.335 2.195 -8.118 1.00 0.00 C ATOM 1049 ND1 HIS A 67 -11.456 2.032 -9.169 1.00 0.00 N ATOM 1050 CD2 HIS A 67 -11.784 3.134 -7.312 1.00 0.00 C ATOM 1051 CE1 HIS A 67 -10.421 2.836 -9.003 1.00 0.00 C ATOM 1052 NE2 HIS A 67 -10.597 3.516 -7.885 1.00 0.00 N ATOM 0 H HIS A 67 -12.026 -0.389 -8.348 1.00 0.00 H new ATOM 0 HA HIS A 67 -13.236 0.574 -6.061 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.911 1.081 -8.991 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -14.401 2.111 -7.660 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -12.201 3.512 -6.390 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -9.575 2.922 -9.669 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -9.954 4.213 -7.508 1.00 0.00 H new ATOM 1061 N PRO A 68 -15.541 -0.319 -5.724 1.00 0.00 N ATOM 1062 CA PRO A 68 -16.877 -0.867 -5.472 1.00 0.00 C ATOM 1063 C PRO A 68 -17.858 -0.461 -6.559 1.00 0.00 C ATOM 1064 O PRO A 68 -18.775 -1.209 -6.901 1.00 0.00 O ATOM 1065 CB PRO A 68 -17.291 -0.231 -4.136 1.00 0.00 C ATOM 1066 CG PRO A 68 -16.241 0.783 -3.821 1.00 0.00 C ATOM 1067 CD PRO A 68 -14.999 0.326 -4.525 1.00 0.00 C ATOM 0 HA PRO A 68 -16.873 -1.957 -5.454 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -18.273 0.235 -4.213 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -17.356 -0.983 -3.349 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -16.541 1.774 -4.163 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -16.076 0.853 -2.746 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -14.342 1.159 -4.773 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.418 -0.368 -3.917 1.00 0.00 H new ATOM 1075 N GLY A 69 -17.653 0.734 -7.097 1.00 0.00 N ATOM 1076 CA GLY A 69 -18.526 1.245 -8.127 1.00 0.00 C ATOM 1077 C GLY A 69 -19.464 2.302 -7.584 1.00 0.00 C ATOM 1078 O GLY A 69 -19.339 2.739 -6.439 1.00 0.00 O ATOM 0 H GLY A 69 -16.892 1.360 -6.834 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.929 1.667 -8.935 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -19.106 0.426 -8.553 1.00 0.00 H new ATOM 1082 N GLU A 70 -20.403 2.702 -8.426 1.00 0.00 N ATOM 1083 CA GLU A 70 -21.376 3.707 -8.042 1.00 0.00 C ATOM 1084 C GLU A 70 -22.478 3.076 -7.196 1.00 0.00 C ATOM 1085 O GLU A 70 -22.992 2.007 -7.521 1.00 0.00 O ATOM 1086 CB GLU A 70 -21.966 4.402 -9.270 1.00 0.00 C ATOM 1087 CG GLU A 70 -22.955 5.506 -8.930 1.00 0.00 C ATOM 1088 CD GLU A 70 -22.326 6.623 -8.120 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -21.798 7.575 -8.733 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -22.362 6.547 -6.874 1.00 0.00 O ATOM 0 H GLU A 70 -20.511 2.347 -9.376 1.00 0.00 H new ATOM 0 HA GLU A 70 -20.868 4.465 -7.446 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -21.154 4.823 -9.863 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -22.464 3.659 -9.893 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -23.366 5.918 -9.852 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -23.789 5.082 -8.371 1.00 0.00 H new ATOM 1097 N LEU A 71 -22.831 3.753 -6.107 1.00 0.00 N ATOM 1098 CA LEU A 71 -23.884 3.279 -5.218 1.00 0.00 C ATOM 1099 C LEU A 71 -25.200 3.932 -5.613 1.00 0.00 C ATOM 1100 O LEU A 71 -25.461 5.077 -5.246 1.00 0.00 O ATOM 1101 CB LEU A 71 -23.545 3.606 -3.756 1.00 0.00 C ATOM 1102 CG LEU A 71 -24.083 2.624 -2.703 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -23.781 3.132 -1.302 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -25.579 2.391 -2.873 1.00 0.00 C ATOM 0 H LEU A 71 -22.402 4.633 -5.820 1.00 0.00 H new ATOM 0 HA LEU A 71 -23.972 2.196 -5.310 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -22.461 3.655 -3.658 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -23.931 4.600 -3.528 1.00 0.00 H new ATOM 0 HG LEU A 71 -23.578 1.669 -2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -24.168 2.426 -0.568 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -22.703 3.232 -1.176 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -24.255 4.103 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -25.927 1.692 -2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -26.109 3.337 -2.766 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -25.773 1.977 -3.862 1.00 0.00 H new ATOM 1116 N ARG A 72 -26.027 3.213 -6.364 1.00 0.00 N ATOM 1117 CA ARG A 72 -27.322 3.753 -6.764 1.00 0.00 C ATOM 1118 C ARG A 72 -28.170 3.996 -5.525 1.00 0.00 C ATOM 1119 O ARG A 72 -28.438 3.085 -4.741 1.00 0.00 O ATOM 1120 CB ARG A 72 -28.039 2.835 -7.757 1.00 0.00 C ATOM 1121 CG ARG A 72 -29.475 3.247 -8.039 1.00 0.00 C ATOM 1122 CD ARG A 72 -30.149 2.294 -9.012 1.00 0.00 C ATOM 1123 NE ARG A 72 -29.485 2.276 -10.313 1.00 0.00 N ATOM 1124 CZ ARG A 72 -29.955 1.624 -11.372 1.00 0.00 C ATOM 1125 NH1 ARG A 72 -31.086 0.935 -11.282 1.00 0.00 N ATOM 1126 NH2 ARG A 72 -29.296 1.659 -12.521 1.00 0.00 N ATOM 0 H ARG A 72 -25.830 2.272 -6.703 1.00 0.00 H new ATOM 0 HA ARG A 72 -27.160 4.700 -7.279 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -27.483 2.822 -8.694 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -28.032 1.817 -7.368 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -30.037 3.272 -7.105 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -29.491 4.257 -8.448 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -30.150 1.288 -8.592 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -31.191 2.586 -9.141 1.00 0.00 H new ATOM 0 HE ARG A 72 -28.612 2.793 -10.415 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -31.596 0.905 -10.399 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -31.445 0.435 -12.096 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -28.426 2.187 -12.594 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -29.658 1.158 -13.332 1.00 0.00 H new ATOM 1140 N ASN A 73 -28.578 5.254 -5.372 1.00 0.00 N ATOM 1141 CA ASN A 73 -29.337 5.680 -4.210 1.00 0.00 C ATOM 1142 C ASN A 73 -28.455 5.466 -2.998 1.00 0.00 C ATOM 1143 O ASN A 73 -28.913 4.983 -1.965 1.00 0.00 O ATOM 1144 CB ASN A 73 -30.643 4.891 -4.087 1.00 0.00 C ATOM 1145 CG ASN A 73 -31.489 4.969 -5.343 1.00 0.00 C ATOM 1146 OD1 ASN A 73 -31.463 5.967 -6.063 1.00 0.00 O ATOM 1147 ND2 ASN A 73 -32.243 3.910 -5.613 1.00 0.00 N ATOM 0 H ASN A 73 -28.391 5.997 -6.046 1.00 0.00 H new ATOM 0 HA ASN A 73 -29.616 6.730 -4.299 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -30.414 3.847 -3.871 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -31.216 5.273 -3.242 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -32.832 3.902 -6.446 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -32.233 3.104 -4.988 1.00 0.00 H new ATOM 1154 N GLY A 74 -27.194 5.864 -3.115 1.00 0.00 N ATOM 1155 CA GLY A 74 -26.275 5.679 -2.017 1.00 0.00 C ATOM 1156 C GLY A 74 -24.934 6.346 -2.253 1.00 0.00 C ATOM 1157 O GLY A 74 -24.710 6.956 -3.297 1.00 0.00 O ATOM 0 H GLY A 74 -26.797 6.307 -3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -26.719 6.080 -1.106 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -26.121 4.612 -1.854 1.00 0.00 H new ATOM 1161 N GLN A 75 -24.042 6.227 -1.274 1.00 0.00 N ATOM 1162 CA GLN A 75 -22.717 6.821 -1.369 1.00 0.00 C ATOM 1163 C GLN A 75 -21.644 5.842 -0.903 1.00 0.00 C ATOM 1164 O GLN A 75 -21.791 5.184 0.123 1.00 0.00 O ATOM 1165 CB GLN A 75 -22.647 8.103 -0.537 1.00 0.00 C ATOM 1166 CG GLN A 75 -21.296 8.797 -0.598 1.00 0.00 C ATOM 1167 CD GLN A 75 -20.968 9.319 -1.984 1.00 0.00 C ATOM 1168 OE1 GLN A 75 -20.382 8.611 -2.803 1.00 0.00 O ATOM 1169 NE2 GLN A 75 -21.345 10.563 -2.251 1.00 0.00 N ATOM 0 H GLN A 75 -24.216 5.723 -0.405 1.00 0.00 H new ATOM 0 HA GLN A 75 -22.532 7.064 -2.415 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -23.416 8.793 -0.884 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -22.877 7.865 0.502 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -21.286 9.626 0.110 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -20.519 8.100 -0.284 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -21.828 11.113 -1.541 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -21.151 10.969 -3.166 1.00 0.00 H new ATOM 1178 N VAL A 76 -20.570 5.755 -1.675 1.00 0.00 N ATOM 1179 CA VAL A 76 -19.470 4.863 -1.334 1.00 0.00 C ATOM 1180 C VAL A 76 -18.267 5.669 -0.847 1.00 0.00 C ATOM 1181 O VAL A 76 -17.630 6.378 -1.627 1.00 0.00 O ATOM 1182 CB VAL A 76 -19.079 3.959 -2.517 1.00 0.00 C ATOM 1183 CG1 VAL A 76 -19.456 4.609 -3.828 1.00 0.00 C ATOM 1184 CG2 VAL A 76 -17.602 3.600 -2.477 1.00 0.00 C ATOM 0 H VAL A 76 -20.437 6.287 -2.535 1.00 0.00 H new ATOM 0 HA VAL A 76 -19.807 4.212 -0.528 1.00 0.00 H new ATOM 0 HB VAL A 76 -19.637 3.027 -2.430 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -19.172 3.956 -4.653 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -20.532 4.779 -3.854 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -18.936 5.562 -3.924 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -17.360 2.961 -3.326 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -17.005 4.511 -2.526 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -17.381 3.071 -1.550 1.00 0.00 H new ATOM 1194 N GLU A 77 -17.967 5.570 0.442 1.00 0.00 N ATOM 1195 CA GLU A 77 -16.841 6.302 1.012 1.00 0.00 C ATOM 1196 C GLU A 77 -15.512 5.813 0.438 1.00 0.00 C ATOM 1197 O GLU A 77 -15.019 4.748 0.809 1.00 0.00 O ATOM 1198 CB GLU A 77 -16.825 6.170 2.535 1.00 0.00 C ATOM 1199 CG GLU A 77 -15.755 7.020 3.200 1.00 0.00 C ATOM 1200 CD GLU A 77 -16.022 8.506 3.063 1.00 0.00 C ATOM 1201 OE1 GLU A 77 -15.700 9.071 1.997 1.00 0.00 O ATOM 1202 OE2 GLU A 77 -16.550 9.106 4.023 1.00 0.00 O ATOM 0 H GLU A 77 -18.482 4.995 1.109 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.966 7.352 0.746 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.801 6.454 2.928 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -16.666 5.125 2.801 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.696 6.761 4.257 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.785 6.787 2.760 1.00 0.00 H new ATOM 1209 N ILE A 78 -14.941 6.601 -0.468 1.00 0.00 N ATOM 1210 CA ILE A 78 -13.662 6.265 -1.086 1.00 0.00 C ATOM 1211 C ILE A 78 -12.698 7.441 -0.983 1.00 0.00 C ATOM 1212 O ILE A 78 -13.076 8.588 -1.227 1.00 0.00 O ATOM 1213 CB ILE A 78 -13.823 5.869 -2.569 1.00 0.00 C ATOM 1214 CG1 ILE A 78 -14.511 4.506 -2.688 1.00 0.00 C ATOM 1215 CG2 ILE A 78 -12.471 5.847 -3.272 1.00 0.00 C ATOM 1216 CD1 ILE A 78 -13.724 3.360 -2.084 1.00 0.00 C ATOM 0 H ILE A 78 -15.345 7.480 -0.792 1.00 0.00 H new ATOM 0 HA ILE A 78 -13.262 5.407 -0.545 1.00 0.00 H new ATOM 0 HB ILE A 78 -14.449 6.617 -3.056 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -15.485 4.559 -2.202 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -14.691 4.293 -3.742 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -12.608 5.565 -4.316 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.018 6.837 -3.220 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -11.819 5.123 -2.784 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -14.280 2.431 -2.210 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.760 3.277 -2.585 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.566 3.547 -1.022 1.00 0.00 H new ATOM 1228 N LYS A 79 -11.455 7.151 -0.623 1.00 0.00 N ATOM 1229 CA LYS A 79 -10.444 8.188 -0.480 1.00 0.00 C ATOM 1230 C LYS A 79 -9.046 7.592 -0.451 1.00 0.00 C ATOM 1231 O LYS A 79 -8.118 8.122 -1.061 1.00 0.00 O ATOM 1232 CB LYS A 79 -10.684 8.994 0.802 1.00 0.00 C ATOM 1233 CG LYS A 79 -10.590 8.173 2.084 1.00 0.00 C ATOM 1234 CD LYS A 79 -11.736 7.181 2.213 1.00 0.00 C ATOM 1235 CE LYS A 79 -11.715 6.475 3.559 1.00 0.00 C ATOM 1236 NZ LYS A 79 -12.757 5.417 3.650 1.00 0.00 N ATOM 0 H LYS A 79 -11.123 6.207 -0.425 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.522 8.848 -1.344 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -9.957 9.805 0.849 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -11.671 9.453 0.750 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.642 7.635 2.101 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -10.592 8.843 2.944 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.685 7.702 2.090 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -11.671 6.443 1.413 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -10.733 6.031 3.720 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.869 7.205 4.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.515 5.730 4.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.154 5.238 2.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.332 4.542 4.018 1.00 0.00 H new ATOM 1250 N THR A 80 -8.906 6.485 0.262 1.00 0.00 N ATOM 1251 CA THR A 80 -7.623 5.817 0.396 1.00 0.00 C ATOM 1252 C THR A 80 -7.293 4.973 -0.828 1.00 0.00 C ATOM 1253 O THR A 80 -6.407 4.119 -0.779 1.00 0.00 O ATOM 1254 CB THR A 80 -7.608 4.928 1.649 1.00 0.00 C ATOM 1255 OG1 THR A 80 -8.424 3.770 1.438 1.00 0.00 O ATOM 1256 CG2 THR A 80 -8.122 5.705 2.852 1.00 0.00 C ATOM 0 H THR A 80 -9.671 6.029 0.759 1.00 0.00 H new ATOM 0 HA THR A 80 -6.864 6.594 0.489 1.00 0.00 H new ATOM 0 HB THR A 80 -6.582 4.614 1.842 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.408 3.208 2.240 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.106 5.064 3.733 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.485 6.573 3.024 1.00 0.00 H new ATOM 0 HG23 THR A 80 -9.143 6.036 2.662 1.00 0.00 H new ATOM 1264 N ASP A 81 -8.011 5.213 -1.924 1.00 0.00 N ATOM 1265 CA ASP A 81 -7.780 4.477 -3.165 1.00 0.00 C ATOM 1266 C ASP A 81 -8.035 2.990 -2.992 1.00 0.00 C ATOM 1267 O ASP A 81 -7.756 2.194 -3.890 1.00 0.00 O ATOM 1268 CB ASP A 81 -6.345 4.659 -3.622 1.00 0.00 C ATOM 1269 CG ASP A 81 -6.054 6.069 -4.099 1.00 0.00 C ATOM 1270 OD1 ASP A 81 -6.351 6.372 -5.274 1.00 0.00 O ATOM 1271 OD2 ASP A 81 -5.529 6.870 -3.298 1.00 0.00 O ATOM 0 H ASP A 81 -8.755 5.909 -1.978 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.474 4.875 -3.906 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -5.673 4.412 -2.800 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -6.134 3.957 -4.428 1.00 0.00 H new ATOM 1276 N LEU A 82 -8.557 2.628 -1.832 1.00 0.00 N ATOM 1277 CA LEU A 82 -8.851 1.240 -1.521 1.00 0.00 C ATOM 1278 C LEU A 82 -7.565 0.442 -1.405 1.00 0.00 C ATOM 1279 O LEU A 82 -7.374 -0.552 -2.102 1.00 0.00 O ATOM 1280 CB LEU A 82 -9.736 0.652 -2.599 1.00 0.00 C ATOM 1281 CG LEU A 82 -11.073 1.355 -2.770 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -11.038 2.299 -3.963 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -12.165 0.329 -2.921 1.00 0.00 C ATOM 0 H LEU A 82 -8.787 3.283 -1.085 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.374 1.193 -0.566 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.200 0.682 -3.548 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -9.919 -0.398 -2.369 1.00 0.00 H new ATOM 0 HG LEU A 82 -11.277 1.956 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.005 2.791 -4.066 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -10.263 3.050 -3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -10.821 1.733 -4.869 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -13.124 0.833 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -11.965 -0.289 -3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -12.198 -0.301 -2.032 1.00 0.00 H new ATOM 1295 N SER A 83 -6.703 0.870 -0.506 1.00 0.00 N ATOM 1296 CA SER A 83 -5.439 0.184 -0.280 1.00 0.00 C ATOM 1297 C SER A 83 -5.636 -0.954 0.716 1.00 0.00 C ATOM 1298 O SER A 83 -6.189 -0.743 1.795 1.00 0.00 O ATOM 1299 CB SER A 83 -4.385 1.161 0.244 1.00 0.00 C ATOM 1300 OG SER A 83 -4.165 2.217 -0.674 1.00 0.00 O ATOM 0 H SER A 83 -6.851 1.690 0.083 1.00 0.00 H new ATOM 0 HA SER A 83 -5.091 -0.226 -1.228 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.708 1.569 1.202 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.450 0.630 0.423 1.00 0.00 H new ATOM 0 HG SER A 83 -4.939 2.819 -0.672 1.00 0.00 H new ATOM 1306 N PHE A 84 -5.196 -2.157 0.341 1.00 0.00 N ATOM 1307 CA PHE A 84 -5.321 -3.331 1.209 1.00 0.00 C ATOM 1308 C PHE A 84 -5.217 -2.925 2.674 1.00 0.00 C ATOM 1309 O PHE A 84 -4.335 -2.151 3.046 1.00 0.00 O ATOM 1310 CB PHE A 84 -4.234 -4.356 0.867 1.00 0.00 C ATOM 1311 CG PHE A 84 -4.085 -5.452 1.885 1.00 0.00 C ATOM 1312 CD1 PHE A 84 -4.906 -6.567 1.848 1.00 0.00 C ATOM 1313 CD2 PHE A 84 -3.118 -5.370 2.875 1.00 0.00 C ATOM 1314 CE1 PHE A 84 -4.768 -7.577 2.781 1.00 0.00 C ATOM 1315 CE2 PHE A 84 -2.975 -6.377 3.810 1.00 0.00 C ATOM 1316 CZ PHE A 84 -3.801 -7.482 3.763 1.00 0.00 C ATOM 0 H PHE A 84 -4.750 -2.344 -0.557 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.299 -3.783 1.044 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -4.461 -4.802 -0.101 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -3.280 -3.838 0.763 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -5.662 -6.648 1.081 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -2.468 -4.508 2.916 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.416 -8.440 2.742 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.218 -6.300 4.577 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.691 -8.271 4.493 1.00 0.00 H new ATOM 1326 N GLY A 85 -6.110 -3.450 3.508 1.00 0.00 N ATOM 1327 CA GLY A 85 -6.101 -3.111 4.914 1.00 0.00 C ATOM 1328 C GLY A 85 -6.890 -1.844 5.192 1.00 0.00 C ATOM 1329 O GLY A 85 -6.617 -1.138 6.163 1.00 0.00 O ATOM 0 H GLY A 85 -6.840 -4.106 3.231 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.522 -3.935 5.490 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.072 -2.980 5.250 1.00 0.00 H new ATOM 1333 N SER A 86 -7.875 -1.554 4.338 1.00 0.00 N ATOM 1334 CA SER A 86 -8.694 -0.355 4.504 1.00 0.00 C ATOM 1335 C SER A 86 -10.185 -0.664 4.501 1.00 0.00 C ATOM 1336 O SER A 86 -10.638 -1.663 3.944 1.00 0.00 O ATOM 1337 CB SER A 86 -8.389 0.669 3.410 1.00 0.00 C ATOM 1338 OG SER A 86 -8.621 0.126 2.122 1.00 0.00 O ATOM 0 H SER A 86 -8.122 -2.129 3.532 1.00 0.00 H new ATOM 0 HA SER A 86 -8.437 0.060 5.479 1.00 0.00 H new ATOM 0 HB2 SER A 86 -9.010 1.553 3.552 1.00 0.00 H new ATOM 0 HB3 SER A 86 -7.351 0.992 3.490 1.00 0.00 H new ATOM 0 HG SER A 86 -7.770 -0.161 1.730 1.00 0.00 H new ATOM 1344 N GLN A 87 -10.929 0.226 5.143 1.00 0.00 N ATOM 1345 CA GLN A 87 -12.375 0.095 5.243 1.00 0.00 C ATOM 1346 C GLN A 87 -13.066 1.241 4.504 1.00 0.00 C ATOM 1347 O GLN A 87 -12.643 2.394 4.596 1.00 0.00 O ATOM 1348 CB GLN A 87 -12.797 0.057 6.719 1.00 0.00 C ATOM 1349 CG GLN A 87 -14.167 0.657 7.005 1.00 0.00 C ATOM 1350 CD GLN A 87 -14.091 2.135 7.340 1.00 0.00 C ATOM 1351 OE1 GLN A 87 -13.886 2.511 8.493 1.00 0.00 O ATOM 1352 NE2 GLN A 87 -14.270 2.979 6.333 1.00 0.00 N ATOM 0 H GLN A 87 -10.551 1.053 5.606 1.00 0.00 H new ATOM 0 HA GLN A 87 -12.681 -0.840 4.774 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -12.791 -0.979 7.058 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -12.052 0.590 7.310 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -14.811 0.516 6.137 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -14.629 0.122 7.835 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -14.437 2.622 5.392 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -14.240 3.985 6.499 1.00 0.00 H new ATOM 1361 N ILE A 88 -14.106 0.910 3.741 1.00 0.00 N ATOM 1362 CA ILE A 88 -14.868 1.911 2.997 1.00 0.00 C ATOM 1363 C ILE A 88 -16.352 1.811 3.336 1.00 0.00 C ATOM 1364 O ILE A 88 -17.020 0.838 2.986 1.00 0.00 O ATOM 1365 CB ILE A 88 -14.674 1.774 1.472 1.00 0.00 C ATOM 1366 CG1 ILE A 88 -15.026 0.364 1.001 1.00 0.00 C ATOM 1367 CG2 ILE A 88 -13.242 2.120 1.092 1.00 0.00 C ATOM 1368 CD1 ILE A 88 -15.382 0.289 -0.469 1.00 0.00 C ATOM 0 H ILE A 88 -14.441 -0.046 3.622 1.00 0.00 H new ATOM 0 HA ILE A 88 -14.489 2.888 3.296 1.00 0.00 H new ATOM 0 HB ILE A 88 -15.348 2.473 0.977 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -14.182 -0.297 1.196 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -15.865 -0.008 1.589 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -13.117 2.020 0.014 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -13.025 3.146 1.389 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -12.557 1.442 1.601 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -15.621 -0.741 -0.733 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -16.246 0.924 -0.667 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -14.536 0.630 -1.066 1.00 0.00 H new ATOM 1380 N GLU A 89 -16.862 2.820 4.034 1.00 0.00 N ATOM 1381 CA GLU A 89 -18.263 2.837 4.435 1.00 0.00 C ATOM 1382 C GLU A 89 -19.159 3.248 3.277 1.00 0.00 C ATOM 1383 O GLU A 89 -18.685 3.501 2.171 1.00 0.00 O ATOM 1384 CB GLU A 89 -18.473 3.797 5.607 1.00 0.00 C ATOM 1385 CG GLU A 89 -17.280 3.885 6.540 1.00 0.00 C ATOM 1386 CD GLU A 89 -17.526 4.804 7.721 1.00 0.00 C ATOM 1387 OE1 GLU A 89 -17.399 6.034 7.552 1.00 0.00 O ATOM 1388 OE2 GLU A 89 -17.846 4.291 8.815 1.00 0.00 O ATOM 0 H GLU A 89 -16.327 3.635 4.333 1.00 0.00 H new ATOM 0 HA GLU A 89 -18.531 1.826 4.743 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -18.693 4.791 5.217 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -19.346 3.477 6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -17.036 2.888 6.906 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -16.414 4.241 5.982 1.00 0.00 H new ATOM 1395 N PHE A 90 -20.459 3.307 3.541 1.00 0.00 N ATOM 1396 CA PHE A 90 -21.423 3.702 2.527 1.00 0.00 C ATOM 1397 C PHE A 90 -22.510 4.586 3.130 1.00 0.00 C ATOM 1398 O PHE A 90 -22.468 4.915 4.315 1.00 0.00 O ATOM 1399 CB PHE A 90 -22.057 2.475 1.866 1.00 0.00 C ATOM 1400 CG PHE A 90 -21.079 1.606 1.128 1.00 0.00 C ATOM 1401 CD1 PHE A 90 -20.729 1.887 -0.189 1.00 0.00 C ATOM 1402 CD2 PHE A 90 -20.514 0.503 1.746 1.00 0.00 C ATOM 1403 CE1 PHE A 90 -19.837 1.082 -0.869 1.00 0.00 C ATOM 1404 CE2 PHE A 90 -19.619 -0.304 1.069 1.00 0.00 C ATOM 1405 CZ PHE A 90 -19.280 -0.015 -0.239 1.00 0.00 C ATOM 0 H PHE A 90 -20.867 3.086 4.449 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.889 4.270 1.766 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -22.553 1.878 2.631 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -22.829 2.807 1.171 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -21.160 2.744 -0.685 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -20.775 0.271 2.768 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -19.575 1.309 -1.892 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -19.185 -1.161 1.563 1.00 0.00 H new ATOM 0 HZ PHE A 90 -18.581 -0.645 -0.768 1.00 0.00 H new ATOM 1415 N SER A 91 -23.480 4.964 2.305 1.00 0.00 N ATOM 1416 CA SER A 91 -24.567 5.821 2.775 1.00 0.00 C ATOM 1417 C SER A 91 -25.779 5.755 1.858 1.00 0.00 C ATOM 1418 O SER A 91 -25.728 6.194 0.714 1.00 0.00 O ATOM 1419 CB SER A 91 -24.097 7.269 2.891 1.00 0.00 C ATOM 1420 OG SER A 91 -23.093 7.408 3.882 1.00 0.00 O ATOM 0 H SER A 91 -23.539 4.697 1.322 1.00 0.00 H new ATOM 0 HA SER A 91 -24.862 5.452 3.757 1.00 0.00 H new ATOM 0 HB2 SER A 91 -23.710 7.606 1.929 1.00 0.00 H new ATOM 0 HB3 SER A 91 -24.944 7.910 3.136 1.00 0.00 H new ATOM 0 HG SER A 91 -23.002 6.567 4.376 1.00 0.00 H new ATOM 1426 N CYS A 92 -26.877 5.224 2.381 1.00 0.00 N ATOM 1427 CA CYS A 92 -28.094 5.125 1.590 1.00 0.00 C ATOM 1428 C CYS A 92 -28.940 6.382 1.786 1.00 0.00 C ATOM 1429 O CYS A 92 -29.303 6.739 2.907 1.00 0.00 O ATOM 1430 CB CYS A 92 -28.878 3.860 1.932 1.00 0.00 C ATOM 1431 SG CYS A 92 -29.953 3.287 0.589 1.00 0.00 S ATOM 0 H CYS A 92 -26.949 4.862 3.332 1.00 0.00 H new ATOM 0 HA CYS A 92 -27.823 5.052 0.537 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -28.177 3.066 2.189 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -29.485 4.047 2.818 1.00 0.00 H new ATOM 1436 N SER A 93 -29.226 7.041 0.669 1.00 0.00 N ATOM 1437 CA SER A 93 -29.996 8.287 0.666 1.00 0.00 C ATOM 1438 C SER A 93 -31.193 8.275 1.619 1.00 0.00 C ATOM 1439 O SER A 93 -31.650 7.231 2.076 1.00 0.00 O ATOM 1440 CB SER A 93 -30.486 8.606 -0.745 1.00 0.00 C ATOM 1441 OG SER A 93 -29.425 9.068 -1.563 1.00 0.00 O ATOM 0 H SER A 93 -28.934 6.731 -0.258 1.00 0.00 H new ATOM 0 HA SER A 93 -29.311 9.057 1.021 1.00 0.00 H new ATOM 0 HB2 SER A 93 -30.930 7.715 -1.189 1.00 0.00 H new ATOM 0 HB3 SER A 93 -31.269 9.363 -0.699 1.00 0.00 H new ATOM 0 HG SER A 93 -29.765 9.263 -2.461 1.00 0.00 H new ATOM 1447 N GLU A 94 -31.683 9.481 1.885 1.00 0.00 N ATOM 1448 CA GLU A 94 -32.832 9.736 2.756 1.00 0.00 C ATOM 1449 C GLU A 94 -33.841 8.589 2.851 1.00 0.00 C ATOM 1450 O GLU A 94 -33.892 7.889 3.863 1.00 0.00 O ATOM 1451 CB GLU A 94 -33.544 11.001 2.273 1.00 0.00 C ATOM 1452 CG GLU A 94 -34.894 11.231 2.929 1.00 0.00 C ATOM 1453 CD GLU A 94 -35.535 12.537 2.505 1.00 0.00 C ATOM 1454 OE1 GLU A 94 -36.060 12.601 1.374 1.00 0.00 O ATOM 1455 OE2 GLU A 94 -35.510 13.497 3.304 1.00 0.00 O ATOM 0 H GLU A 94 -31.283 10.333 1.492 1.00 0.00 H new ATOM 0 HA GLU A 94 -32.429 9.851 3.762 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -32.905 11.863 2.466 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -33.680 10.940 1.193 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -35.560 10.406 2.678 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -34.773 11.225 4.012 1.00 0.00 H new ATOM 1462 N GLY A 95 -34.634 8.394 1.810 1.00 0.00 N ATOM 1463 CA GLY A 95 -35.690 7.391 1.852 1.00 0.00 C ATOM 1464 C GLY A 95 -35.225 5.947 1.870 1.00 0.00 C ATOM 1465 O GLY A 95 -35.987 5.066 2.267 1.00 0.00 O ATOM 0 H GLY A 95 -34.570 8.910 0.933 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -36.299 7.568 2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -36.337 7.534 0.986 1.00 0.00 H new ATOM 1469 N PHE A 96 -33.997 5.677 1.453 1.00 0.00 N ATOM 1470 CA PHE A 96 -33.523 4.294 1.415 1.00 0.00 C ATOM 1471 C PHE A 96 -32.434 4.063 2.457 1.00 0.00 C ATOM 1472 O PHE A 96 -31.579 4.917 2.676 1.00 0.00 O ATOM 1473 CB PHE A 96 -32.999 3.951 0.023 1.00 0.00 C ATOM 1474 CG PHE A 96 -33.400 4.945 -1.022 1.00 0.00 C ATOM 1475 CD1 PHE A 96 -34.658 4.898 -1.598 1.00 0.00 C ATOM 1476 CD2 PHE A 96 -32.518 5.932 -1.419 1.00 0.00 C ATOM 1477 CE1 PHE A 96 -35.030 5.820 -2.556 1.00 0.00 C ATOM 1478 CE2 PHE A 96 -32.883 6.859 -2.378 1.00 0.00 C ATOM 1479 CZ PHE A 96 -34.141 6.803 -2.947 1.00 0.00 C ATOM 0 H PHE A 96 -33.322 6.375 1.142 1.00 0.00 H new ATOM 0 HA PHE A 96 -34.364 3.641 1.647 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -31.911 3.889 0.057 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -33.366 2.965 -0.263 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -35.356 4.132 -1.295 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -31.534 5.980 -0.976 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -36.014 5.773 -2.999 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -32.186 7.626 -2.682 1.00 0.00 H new ATOM 0 HZ PHE A 96 -34.429 7.526 -3.696 1.00 0.00 H new ATOM 1489 N PHE A 97 -32.470 2.900 3.101 1.00 0.00 N ATOM 1490 CA PHE A 97 -31.485 2.574 4.124 1.00 0.00 C ATOM 1491 C PHE A 97 -30.431 1.610 3.592 1.00 0.00 C ATOM 1492 O PHE A 97 -30.590 0.990 2.540 1.00 0.00 O ATOM 1493 CB PHE A 97 -32.175 2.004 5.370 1.00 0.00 C ATOM 1494 CG PHE A 97 -32.745 0.622 5.201 1.00 0.00 C ATOM 1495 CD1 PHE A 97 -33.801 0.391 4.332 1.00 0.00 C ATOM 1496 CD2 PHE A 97 -32.238 -0.441 5.931 1.00 0.00 C ATOM 1497 CE1 PHE A 97 -34.336 -0.876 4.193 1.00 0.00 C ATOM 1498 CE2 PHE A 97 -32.772 -1.708 5.798 1.00 0.00 C ATOM 1499 CZ PHE A 97 -33.821 -1.926 4.927 1.00 0.00 C ATOM 0 H PHE A 97 -33.166 2.173 2.933 1.00 0.00 H new ATOM 0 HA PHE A 97 -30.973 3.494 4.406 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -31.457 1.987 6.190 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -32.979 2.679 5.664 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -34.210 1.210 3.758 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -31.416 -0.277 6.612 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -35.156 -1.044 3.511 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -32.369 -2.527 6.375 1.00 0.00 H new ATOM 0 HZ PHE A 97 -34.238 -2.916 4.820 1.00 0.00 H new ATOM 1509 N LEU A 98 -29.351 1.507 4.358 1.00 0.00 N ATOM 1510 CA LEU A 98 -28.228 0.646 4.009 1.00 0.00 C ATOM 1511 C LEU A 98 -28.498 -0.790 4.443 1.00 0.00 C ATOM 1512 O LEU A 98 -29.005 -1.033 5.539 1.00 0.00 O ATOM 1513 CB LEU A 98 -26.951 1.173 4.687 1.00 0.00 C ATOM 1514 CG LEU A 98 -25.616 0.610 4.174 1.00 0.00 C ATOM 1515 CD1 LEU A 98 -25.468 -0.865 4.516 1.00 0.00 C ATOM 1516 CD2 LEU A 98 -25.469 0.825 2.678 1.00 0.00 C ATOM 0 H LEU A 98 -29.230 2.015 5.234 1.00 0.00 H new ATOM 0 HA LEU A 98 -28.096 0.656 2.927 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -26.929 2.257 4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -27.021 0.964 5.754 1.00 0.00 H new ATOM 0 HG LEU A 98 -24.819 1.156 4.678 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -24.513 -1.232 4.139 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -25.504 -0.993 5.598 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -26.280 -1.428 4.056 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -24.515 0.417 2.344 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -26.282 0.321 2.156 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -25.504 1.892 2.459 1.00 0.00 H new ATOM 1528 N ILE A 99 -28.156 -1.738 3.575 1.00 0.00 N ATOM 1529 CA ILE A 99 -28.325 -3.161 3.841 1.00 0.00 C ATOM 1530 C ILE A 99 -27.364 -3.941 2.966 1.00 0.00 C ATOM 1531 O ILE A 99 -27.657 -4.282 1.822 1.00 0.00 O ATOM 1532 CB ILE A 99 -29.751 -3.642 3.519 1.00 0.00 C ATOM 1533 CG1 ILE A 99 -30.655 -2.450 3.238 1.00 0.00 C ATOM 1534 CG2 ILE A 99 -30.301 -4.481 4.661 1.00 0.00 C ATOM 1535 CD1 ILE A 99 -31.908 -2.799 2.466 1.00 0.00 C ATOM 0 H ILE A 99 -27.751 -1.537 2.661 1.00 0.00 H new ATOM 0 HA ILE A 99 -28.132 -3.324 4.901 1.00 0.00 H new ATOM 0 HB ILE A 99 -29.717 -4.267 2.627 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -30.940 -1.991 4.185 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -30.092 -1.703 2.679 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -31.310 -4.812 4.416 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -29.661 -5.350 4.815 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -30.327 -3.883 5.572 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -32.499 -1.898 2.305 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -31.634 -3.229 1.503 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -32.495 -3.522 3.033 1.00 0.00 H new ATOM 1547 N GLY A 100 -26.206 -4.207 3.543 1.00 0.00 N ATOM 1548 CA GLY A 100 -25.154 -4.923 2.857 1.00 0.00 C ATOM 1549 C GLY A 100 -23.805 -4.621 3.465 1.00 0.00 C ATOM 1550 O GLY A 100 -22.814 -4.453 2.754 1.00 0.00 O ATOM 0 H GLY A 100 -25.972 -3.932 4.497 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -25.347 -5.995 2.907 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -25.151 -4.648 1.802 1.00 0.00 H new ATOM 1554 N SER A 101 -23.782 -4.544 4.788 1.00 0.00 N ATOM 1555 CA SER A 101 -22.563 -4.237 5.526 1.00 0.00 C ATOM 1556 C SER A 101 -22.102 -2.820 5.203 1.00 0.00 C ATOM 1557 O SER A 101 -21.569 -2.562 4.124 1.00 0.00 O ATOM 1558 CB SER A 101 -21.455 -5.241 5.194 1.00 0.00 C ATOM 1559 OG SER A 101 -20.276 -4.959 5.927 1.00 0.00 O ATOM 0 H SER A 101 -24.601 -4.691 5.378 1.00 0.00 H new ATOM 0 HA SER A 101 -22.779 -4.309 6.592 1.00 0.00 H new ATOM 0 HB2 SER A 101 -21.795 -6.251 5.421 1.00 0.00 H new ATOM 0 HB3 SER A 101 -21.239 -5.210 4.126 1.00 0.00 H new ATOM 0 HG SER A 101 -19.684 -4.393 5.389 1.00 0.00 H new ATOM 1565 N THR A 102 -22.308 -1.903 6.145 1.00 0.00 N ATOM 1566 CA THR A 102 -21.919 -0.513 5.948 1.00 0.00 C ATOM 1567 C THR A 102 -20.413 -0.380 5.843 1.00 0.00 C ATOM 1568 O THR A 102 -19.896 0.705 5.589 1.00 0.00 O ATOM 1569 CB THR A 102 -22.419 0.390 7.093 1.00 0.00 C ATOM 1570 OG1 THR A 102 -21.827 -0.018 8.332 1.00 0.00 O ATOM 1571 CG2 THR A 102 -23.934 0.337 7.212 1.00 0.00 C ATOM 0 H THR A 102 -22.740 -2.098 7.048 1.00 0.00 H new ATOM 0 HA THR A 102 -22.383 -0.190 5.016 1.00 0.00 H new ATOM 0 HB THR A 102 -22.126 1.415 6.866 1.00 0.00 H new ATOM 0 HG1 THR A 102 -22.148 0.561 9.054 1.00 0.00 H new ATOM 0 HG21 THR A 102 -24.258 0.984 8.028 1.00 0.00 H new ATOM 0 HG22 THR A 102 -24.384 0.677 6.279 1.00 0.00 H new ATOM 0 HG23 THR A 102 -24.247 -0.687 7.415 1.00 0.00 H new ATOM 1579 N THR A 103 -19.710 -1.481 6.044 1.00 0.00 N ATOM 1580 CA THR A 103 -18.269 -1.471 5.954 1.00 0.00 C ATOM 1581 C THR A 103 -17.800 -2.405 4.854 1.00 0.00 C ATOM 1582 O THR A 103 -18.509 -3.334 4.470 1.00 0.00 O ATOM 1583 CB THR A 103 -17.632 -1.862 7.287 1.00 0.00 C ATOM 1584 OG1 THR A 103 -18.076 -3.164 7.689 1.00 0.00 O ATOM 1585 CG2 THR A 103 -17.987 -0.840 8.351 1.00 0.00 C ATOM 0 H THR A 103 -20.117 -2.389 6.270 1.00 0.00 H new ATOM 0 HA THR A 103 -17.954 -0.456 5.712 1.00 0.00 H new ATOM 0 HB THR A 103 -16.549 -1.886 7.164 1.00 0.00 H new ATOM 0 HG1 THR A 103 -17.659 -3.402 8.543 1.00 0.00 H new ATOM 0 HG21 THR A 103 -17.529 -1.126 9.298 1.00 0.00 H new ATOM 0 HG22 THR A 103 -17.618 0.141 8.051 1.00 0.00 H new ATOM 0 HG23 THR A 103 -19.070 -0.799 8.469 1.00 0.00 H new ATOM 1593 N SER A 104 -16.602 -2.153 4.348 1.00 0.00 N ATOM 1594 CA SER A 104 -16.008 -2.993 3.325 1.00 0.00 C ATOM 1595 C SER A 104 -14.493 -2.988 3.505 1.00 0.00 C ATOM 1596 O SER A 104 -13.840 -1.957 3.338 1.00 0.00 O ATOM 1597 CB SER A 104 -16.402 -2.507 1.928 1.00 0.00 C ATOM 1598 OG SER A 104 -17.786 -2.696 1.695 1.00 0.00 O ATOM 0 H SER A 104 -16.020 -1.366 4.634 1.00 0.00 H new ATOM 0 HA SER A 104 -16.378 -4.013 3.427 1.00 0.00 H new ATOM 0 HB2 SER A 104 -16.153 -1.451 1.823 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.826 -3.046 1.176 1.00 0.00 H new ATOM 0 HG SER A 104 -17.911 -3.373 0.998 1.00 0.00 H new ATOM 1604 N ARG A 105 -13.940 -4.147 3.846 1.00 0.00 N ATOM 1605 CA ARG A 105 -12.502 -4.285 4.091 1.00 0.00 C ATOM 1606 C ARG A 105 -11.776 -4.888 2.893 1.00 0.00 C ATOM 1607 O ARG A 105 -12.339 -5.684 2.145 1.00 0.00 O ATOM 1608 CB ARG A 105 -12.266 -5.149 5.330 1.00 0.00 C ATOM 1609 CG ARG A 105 -12.956 -4.623 6.578 1.00 0.00 C ATOM 1610 CD ARG A 105 -12.673 -5.503 7.786 1.00 0.00 C ATOM 1611 NE ARG A 105 -13.279 -4.972 9.004 1.00 0.00 N ATOM 1612 CZ ARG A 105 -13.306 -5.627 10.160 1.00 0.00 C ATOM 1613 NH1 ARG A 105 -12.765 -6.835 10.255 1.00 0.00 N ATOM 1614 NH2 ARG A 105 -13.873 -5.075 11.224 1.00 0.00 N ATOM 0 H ARG A 105 -14.467 -5.013 3.961 1.00 0.00 H new ATOM 0 HA ARG A 105 -12.097 -3.286 4.255 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -12.618 -6.161 5.130 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -11.194 -5.215 5.518 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -12.618 -3.607 6.780 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -14.031 -4.574 6.407 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -13.054 -6.507 7.600 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -11.596 -5.591 7.926 1.00 0.00 H new ATOM 0 HE ARG A 105 -13.706 -4.046 8.965 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -12.327 -7.263 9.439 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.787 -7.335 11.144 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -14.289 -4.146 11.156 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.893 -5.579 12.111 1.00 0.00 H new ATOM 1628 N CYS A 106 -10.507 -4.515 2.739 1.00 0.00 N ATOM 1629 CA CYS A 106 -9.691 -4.998 1.633 1.00 0.00 C ATOM 1630 C CYS A 106 -8.715 -6.076 2.090 1.00 0.00 C ATOM 1631 O CYS A 106 -7.873 -5.842 2.958 1.00 0.00 O ATOM 1632 CB CYS A 106 -8.919 -3.840 1.000 1.00 0.00 C ATOM 1633 SG CYS A 106 -9.707 -3.147 -0.486 1.00 0.00 S ATOM 0 H CYS A 106 -10.022 -3.877 3.370 1.00 0.00 H new ATOM 0 HA CYS A 106 -10.362 -5.436 0.894 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -8.803 -3.048 1.739 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -7.918 -4.184 0.741 1.00 0.00 H new ATOM 1638 N GLU A 107 -8.839 -7.258 1.499 1.00 0.00 N ATOM 1639 CA GLU A 107 -7.979 -8.382 1.835 1.00 0.00 C ATOM 1640 C GLU A 107 -7.363 -8.962 0.566 1.00 0.00 C ATOM 1641 O GLU A 107 -7.408 -8.331 -0.485 1.00 0.00 O ATOM 1642 CB GLU A 107 -8.792 -9.449 2.571 1.00 0.00 C ATOM 1643 CG GLU A 107 -7.966 -10.319 3.507 1.00 0.00 C ATOM 1644 CD GLU A 107 -7.502 -9.571 4.741 1.00 0.00 C ATOM 1645 OE1 GLU A 107 -8.343 -9.310 5.627 1.00 0.00 O ATOM 1646 OE2 GLU A 107 -6.299 -9.245 4.822 1.00 0.00 O ATOM 0 H GLU A 107 -9.533 -7.462 0.780 1.00 0.00 H new ATOM 0 HA GLU A 107 -7.175 -8.041 2.486 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.579 -8.960 3.146 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -9.283 -10.088 1.837 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -8.558 -11.182 3.811 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -7.098 -10.701 2.970 1.00 0.00 H new ATOM 1653 N VAL A 108 -6.752 -10.139 0.683 1.00 0.00 N ATOM 1654 CA VAL A 108 -6.144 -10.793 -0.473 1.00 0.00 C ATOM 1655 C VAL A 108 -6.501 -12.272 -0.571 1.00 0.00 C ATOM 1656 O VAL A 108 -6.433 -13.016 0.408 1.00 0.00 O ATOM 1657 CB VAL A 108 -4.618 -10.652 -0.484 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -4.038 -11.304 -1.737 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.221 -9.187 -0.402 1.00 0.00 C ATOM 0 H VAL A 108 -6.665 -10.655 1.558 1.00 0.00 H new ATOM 0 HA VAL A 108 -6.559 -10.276 -1.338 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.211 -11.163 0.388 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.953 -11.197 -1.734 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -4.299 -12.362 -1.750 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -4.448 -10.818 -2.623 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.134 -9.103 -0.411 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.633 -8.650 -1.256 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.611 -8.756 0.520 1.00 0.00 H new ATOM 1669 N GLN A 109 -6.875 -12.673 -1.783 1.00 0.00 N ATOM 1670 CA GLN A 109 -7.235 -14.060 -2.058 1.00 0.00 C ATOM 1671 C GLN A 109 -7.631 -14.250 -3.517 1.00 0.00 C ATOM 1672 O GLN A 109 -8.559 -14.999 -3.824 1.00 0.00 O ATOM 1673 CB GLN A 109 -8.397 -14.475 -1.164 1.00 0.00 C ATOM 1674 CG GLN A 109 -9.582 -13.534 -1.280 1.00 0.00 C ATOM 1675 CD GLN A 109 -10.764 -13.969 -0.435 1.00 0.00 C ATOM 1676 OE1 GLN A 109 -10.597 -14.599 0.608 1.00 0.00 O ATOM 1677 NE2 GLN A 109 -11.968 -13.632 -0.883 1.00 0.00 N ATOM 0 H GLN A 109 -6.937 -12.055 -2.592 1.00 0.00 H new ATOM 0 HA GLN A 109 -6.364 -14.682 -1.853 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -8.712 -15.485 -1.427 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -8.061 -14.506 -0.127 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -9.275 -12.532 -0.979 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -9.890 -13.473 -2.324 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -12.060 -13.109 -1.754 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -12.801 -13.896 -0.356 1.00 0.00 H new ATOM 1686 N ASP A 110 -6.922 -13.579 -4.412 1.00 0.00 N ATOM 1687 CA ASP A 110 -7.216 -13.681 -5.832 1.00 0.00 C ATOM 1688 C ASP A 110 -6.051 -13.177 -6.674 1.00 0.00 C ATOM 1689 O ASP A 110 -5.036 -13.858 -6.813 1.00 0.00 O ATOM 1690 CB ASP A 110 -8.498 -12.911 -6.167 1.00 0.00 C ATOM 1691 CG ASP A 110 -8.909 -13.069 -7.617 1.00 0.00 C ATOM 1692 OD1 ASP A 110 -9.466 -14.131 -7.964 1.00 0.00 O ATOM 1693 OD2 ASP A 110 -8.673 -12.130 -8.407 1.00 0.00 O ATOM 0 H ASP A 110 -6.143 -12.962 -4.182 1.00 0.00 H new ATOM 0 HA ASP A 110 -7.368 -14.733 -6.071 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -9.306 -13.260 -5.524 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -8.350 -11.853 -5.948 1.00 0.00 H new ATOM 1698 N ARG A 111 -6.200 -11.984 -7.236 1.00 0.00 N ATOM 1699 CA ARG A 111 -5.157 -11.405 -8.062 1.00 0.00 C ATOM 1700 C ARG A 111 -4.256 -10.499 -7.246 1.00 0.00 C ATOM 1701 O ARG A 111 -3.962 -9.369 -7.639 1.00 0.00 O ATOM 1702 CB ARG A 111 -5.766 -10.641 -9.242 1.00 0.00 C ATOM 1703 CG ARG A 111 -6.761 -9.571 -8.827 1.00 0.00 C ATOM 1704 CD ARG A 111 -7.432 -8.936 -10.035 1.00 0.00 C ATOM 1705 NE ARG A 111 -8.197 -9.909 -10.810 1.00 0.00 N ATOM 1706 CZ ARG A 111 -8.691 -9.664 -12.022 1.00 0.00 C ATOM 1707 NH1 ARG A 111 -8.495 -8.485 -12.595 1.00 0.00 N ATOM 1708 NH2 ARG A 111 -9.380 -10.601 -12.659 1.00 0.00 N ATOM 0 H ARG A 111 -7.032 -11.403 -7.133 1.00 0.00 H new ATOM 0 HA ARG A 111 -4.548 -12.219 -8.456 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -4.964 -10.176 -9.816 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.263 -11.349 -9.905 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -7.518 -10.009 -8.177 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -6.250 -8.802 -8.247 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -8.094 -8.136 -9.703 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -6.675 -8.480 -10.672 1.00 0.00 H new ATOM 0 HE ARG A 111 -8.362 -10.828 -10.400 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.965 -7.763 -12.107 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -8.874 -8.300 -13.524 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -9.532 -11.509 -12.221 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -9.758 -10.413 -13.587 1.00 0.00 H new ATOM 1722 N GLY A 112 -3.814 -11.010 -6.107 1.00 0.00 N ATOM 1723 CA GLY A 112 -2.947 -10.243 -5.247 1.00 0.00 C ATOM 1724 C GLY A 112 -3.737 -9.526 -4.188 1.00 0.00 C ATOM 1725 O GLY A 112 -3.171 -8.911 -3.286 1.00 0.00 O ATOM 0 H GLY A 112 -4.042 -11.944 -5.765 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -2.218 -10.903 -4.777 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -2.387 -9.520 -5.840 1.00 0.00 H new ATOM 1729 N VAL A 113 -5.061 -9.603 -4.306 1.00 0.00 N ATOM 1730 CA VAL A 113 -5.952 -8.966 -3.348 1.00 0.00 C ATOM 1731 C VAL A 113 -7.412 -9.330 -3.617 1.00 0.00 C ATOM 1732 O VAL A 113 -7.864 -9.359 -4.762 1.00 0.00 O ATOM 1733 CB VAL A 113 -5.771 -7.436 -3.345 1.00 0.00 C ATOM 1734 CG1 VAL A 113 -5.219 -6.972 -4.681 1.00 0.00 C ATOM 1735 CG2 VAL A 113 -7.069 -6.718 -3.014 1.00 0.00 C ATOM 0 H VAL A 113 -5.538 -10.102 -5.058 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.685 -9.342 -2.361 1.00 0.00 H new ATOM 0 HB VAL A 113 -5.055 -7.183 -2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -5.095 -5.889 -4.667 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.254 -7.445 -4.860 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -5.911 -7.248 -5.476 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.901 -5.641 -3.021 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -7.825 -6.973 -3.757 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -7.413 -7.025 -2.026 1.00 0.00 H new ATOM 1745 N GLY A 114 -8.130 -9.604 -2.539 1.00 0.00 N ATOM 1746 CA GLY A 114 -9.528 -9.968 -2.683 1.00 0.00 C ATOM 1747 C GLY A 114 -10.457 -8.979 -2.001 1.00 0.00 C ATOM 1748 O GLY A 114 -10.092 -8.384 -0.987 1.00 0.00 O ATOM 0 H GLY A 114 -7.780 -9.582 -1.581 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.778 -10.026 -3.742 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.687 -10.961 -2.263 1.00 0.00 H new ATOM 1752 N TRP A 115 -11.659 -8.797 -2.548 1.00 0.00 N ATOM 1753 CA TRP A 115 -12.633 -7.881 -1.967 1.00 0.00 C ATOM 1754 C TRP A 115 -13.565 -8.618 -1.009 1.00 0.00 C ATOM 1755 O TRP A 115 -14.207 -9.597 -1.386 1.00 0.00 O ATOM 1756 CB TRP A 115 -13.461 -7.200 -3.065 1.00 0.00 C ATOM 1757 CG TRP A 115 -13.414 -5.699 -3.022 1.00 0.00 C ATOM 1758 CD1 TRP A 115 -13.235 -4.856 -4.082 1.00 0.00 C ATOM 1759 CD2 TRP A 115 -13.549 -4.862 -1.866 1.00 0.00 C ATOM 1760 NE1 TRP A 115 -13.253 -3.549 -3.654 1.00 0.00 N ATOM 1761 CE2 TRP A 115 -13.441 -3.528 -2.301 1.00 0.00 C ATOM 1762 CE3 TRP A 115 -13.750 -5.108 -0.505 1.00 0.00 C ATOM 1763 CZ2 TRP A 115 -13.529 -2.448 -1.428 1.00 0.00 C ATOM 1764 CZ3 TRP A 115 -13.834 -4.034 0.359 1.00 0.00 C ATOM 1765 CH2 TRP A 115 -13.724 -2.719 -0.105 1.00 0.00 C ATOM 0 H TRP A 115 -11.979 -9.273 -3.392 1.00 0.00 H new ATOM 0 HA TRP A 115 -12.083 -7.120 -1.413 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -13.103 -7.537 -4.038 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -14.498 -7.524 -2.977 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -13.099 -5.170 -5.106 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -13.144 -2.729 -4.250 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -13.838 -6.119 -0.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -13.446 -1.432 -1.785 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -13.988 -4.213 1.413 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.795 -1.902 0.598 1.00 0.00 H new ATOM 1776 N SER A 116 -13.633 -8.142 0.231 1.00 0.00 N ATOM 1777 CA SER A 116 -14.492 -8.758 1.237 1.00 0.00 C ATOM 1778 C SER A 116 -15.963 -8.611 0.854 1.00 0.00 C ATOM 1779 O SER A 116 -16.753 -9.540 1.018 1.00 0.00 O ATOM 1780 CB SER A 116 -14.242 -8.128 2.608 1.00 0.00 C ATOM 1781 OG SER A 116 -12.898 -8.310 3.017 1.00 0.00 O ATOM 0 H SER A 116 -13.105 -7.334 0.562 1.00 0.00 H new ATOM 0 HA SER A 116 -14.251 -9.820 1.287 1.00 0.00 H new ATOM 0 HB2 SER A 116 -14.472 -7.063 2.570 1.00 0.00 H new ATOM 0 HB3 SER A 116 -14.912 -8.573 3.343 1.00 0.00 H new ATOM 0 HG SER A 116 -12.390 -7.490 2.845 1.00 0.00 H new ATOM 1787 N HIS A 117 -16.319 -7.436 0.341 1.00 0.00 N ATOM 1788 CA HIS A 117 -17.692 -7.159 -0.070 1.00 0.00 C ATOM 1789 C HIS A 117 -17.775 -5.829 -0.813 1.00 0.00 C ATOM 1790 O HIS A 117 -17.159 -4.844 -0.402 1.00 0.00 O ATOM 1791 CB HIS A 117 -18.623 -7.130 1.143 1.00 0.00 C ATOM 1792 CG HIS A 117 -20.070 -6.990 0.781 1.00 0.00 C ATOM 1793 ND1 HIS A 117 -20.692 -5.769 0.628 1.00 0.00 N ATOM 1794 CD2 HIS A 117 -21.016 -7.926 0.528 1.00 0.00 C ATOM 1795 CE1 HIS A 117 -21.957 -5.960 0.299 1.00 0.00 C ATOM 1796 NE2 HIS A 117 -22.179 -7.260 0.231 1.00 0.00 N ATOM 0 H HIS A 117 -15.674 -6.659 0.200 1.00 0.00 H new ATOM 0 HA HIS A 117 -18.008 -7.958 -0.740 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -18.487 -8.046 1.718 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -18.337 -6.302 1.791 1.00 0.00 H new ATOM 0 HD1 HIS A 117 -20.245 -4.860 0.750 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -20.880 -8.997 0.555 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -22.686 -5.184 0.117 1.00 0.00 H new ATOM 1805 N PRO A 118 -18.538 -5.780 -1.918 1.00 0.00 N ATOM 1806 CA PRO A 118 -18.703 -4.577 -2.713 1.00 0.00 C ATOM 1807 C PRO A 118 -19.967 -3.809 -2.335 1.00 0.00 C ATOM 1808 O PRO A 118 -20.266 -3.626 -1.156 1.00 0.00 O ATOM 1809 CB PRO A 118 -18.817 -5.157 -4.119 1.00 0.00 C ATOM 1810 CG PRO A 118 -19.535 -6.457 -3.933 1.00 0.00 C ATOM 1811 CD PRO A 118 -19.304 -6.893 -2.501 1.00 0.00 C ATOM 0 HA PRO A 118 -17.896 -3.855 -2.584 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -19.370 -4.489 -4.780 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -17.835 -5.307 -4.567 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -20.600 -6.341 -4.133 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -19.160 -7.207 -4.629 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -20.245 -7.051 -1.974 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -18.749 -7.830 -2.452 1.00 0.00 H new ATOM 1819 N LEU A 119 -20.699 -3.363 -3.348 1.00 0.00 N ATOM 1820 CA LEU A 119 -21.927 -2.615 -3.150 1.00 0.00 C ATOM 1821 C LEU A 119 -22.947 -3.387 -2.315 1.00 0.00 C ATOM 1822 O LEU A 119 -23.068 -4.606 -2.437 1.00 0.00 O ATOM 1823 CB LEU A 119 -22.520 -2.284 -4.512 1.00 0.00 C ATOM 1824 CG LEU A 119 -22.066 -0.958 -5.123 1.00 0.00 C ATOM 1825 CD1 LEU A 119 -23.144 0.094 -4.947 1.00 0.00 C ATOM 1826 CD2 LEU A 119 -20.757 -0.489 -4.510 1.00 0.00 C ATOM 0 H LEU A 119 -20.456 -3.511 -4.327 1.00 0.00 H new ATOM 0 HA LEU A 119 -21.688 -1.705 -2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -22.268 -3.088 -5.204 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -23.606 -2.270 -4.422 1.00 0.00 H new ATOM 0 HG LEU A 119 -21.896 -1.115 -6.188 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -22.810 1.034 -5.386 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -24.057 -0.234 -5.444 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -23.341 0.239 -3.885 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -20.460 0.456 -4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -20.887 -0.350 -3.437 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -19.984 -1.236 -4.688 1.00 0.00 H new ATOM 1838 N PRO A 120 -23.696 -2.672 -1.454 1.00 0.00 N ATOM 1839 CA PRO A 120 -24.722 -3.268 -0.606 1.00 0.00 C ATOM 1840 C PRO A 120 -26.085 -3.297 -1.294 1.00 0.00 C ATOM 1841 O PRO A 120 -26.181 -3.580 -2.488 1.00 0.00 O ATOM 1842 CB PRO A 120 -24.740 -2.322 0.589 1.00 0.00 C ATOM 1843 CG PRO A 120 -24.419 -0.981 0.015 1.00 0.00 C ATOM 1844 CD PRO A 120 -23.588 -1.219 -1.225 1.00 0.00 C ATOM 0 HA PRO A 120 -24.515 -4.307 -0.351 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -25.714 -2.321 1.078 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -24.007 -2.618 1.339 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -25.332 -0.438 -0.231 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -23.871 -0.374 0.736 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -23.968 -0.652 -2.075 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -22.552 -0.914 -1.076 1.00 0.00 H new ATOM 1852 N GLN A 121 -27.138 -3.003 -0.536 1.00 0.00 N ATOM 1853 CA GLN A 121 -28.493 -2.992 -1.075 1.00 0.00 C ATOM 1854 C GLN A 121 -29.252 -1.761 -0.595 1.00 0.00 C ATOM 1855 O GLN A 121 -29.524 -1.619 0.596 1.00 0.00 O ATOM 1856 CB GLN A 121 -29.243 -4.255 -0.651 1.00 0.00 C ATOM 1857 CG GLN A 121 -30.521 -4.501 -1.439 1.00 0.00 C ATOM 1858 CD GLN A 121 -31.251 -5.753 -0.992 1.00 0.00 C ATOM 1859 OE1 GLN A 121 -30.998 -6.846 -1.498 1.00 0.00 O ATOM 1860 NE2 GLN A 121 -32.163 -5.598 -0.040 1.00 0.00 N ATOM 0 H GLN A 121 -27.078 -2.769 0.455 1.00 0.00 H new ATOM 0 HA GLN A 121 -28.426 -2.963 -2.163 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -28.583 -5.115 -0.768 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -29.488 -4.183 0.409 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -31.182 -3.641 -1.330 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -30.280 -4.585 -2.499 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -32.340 -4.673 0.351 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -32.687 -6.404 0.301 1.00 0.00 H new ATOM 1869 N CYS A 122 -29.590 -0.872 -1.522 1.00 0.00 N ATOM 1870 CA CYS A 122 -30.318 0.335 -1.170 1.00 0.00 C ATOM 1871 C CYS A 122 -31.795 0.211 -1.522 1.00 0.00 C ATOM 1872 O CYS A 122 -32.173 0.244 -2.693 1.00 0.00 O ATOM 1873 CB CYS A 122 -29.707 1.543 -1.871 1.00 0.00 C ATOM 1874 SG CYS A 122 -28.652 2.544 -0.782 1.00 0.00 S ATOM 0 H CYS A 122 -29.373 -0.965 -2.514 1.00 0.00 H new ATOM 0 HA CYS A 122 -30.240 0.473 -0.092 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -29.119 1.202 -2.723 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -30.507 2.169 -2.267 1.00 0.00 H new ATOM 1879 N GLU A 123 -32.622 0.070 -0.493 1.00 0.00 N ATOM 1880 CA GLU A 123 -34.062 -0.058 -0.679 1.00 0.00 C ATOM 1881 C GLU A 123 -34.788 0.994 0.146 1.00 0.00 C ATOM 1882 O GLU A 123 -34.375 1.333 1.255 1.00 0.00 O ATOM 1883 CB GLU A 123 -34.534 -1.454 -0.274 1.00 0.00 C ATOM 1884 CG GLU A 123 -33.860 -2.574 -1.047 1.00 0.00 C ATOM 1885 CD GLU A 123 -34.056 -2.454 -2.546 1.00 0.00 C ATOM 1886 OE1 GLU A 123 -35.206 -2.602 -3.008 1.00 0.00 O ATOM 1887 OE2 GLU A 123 -33.058 -2.211 -3.256 1.00 0.00 O ATOM 0 H GLU A 123 -32.319 0.041 0.481 1.00 0.00 H new ATOM 0 HA GLU A 123 -34.290 0.093 -1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -34.348 -1.596 0.791 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -35.612 -1.520 -0.421 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -32.793 -2.573 -0.823 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -34.255 -3.532 -0.709 1.00 0.00 H new ATOM 1894 N ILE A 124 -35.878 1.499 -0.416 1.00 0.00 N ATOM 1895 CA ILE A 124 -36.668 2.532 0.240 1.00 0.00 C ATOM 1896 C ILE A 124 -37.397 1.970 1.458 1.00 0.00 C ATOM 1897 O ILE A 124 -37.674 0.773 1.529 1.00 0.00 O ATOM 1898 CB ILE A 124 -37.696 3.145 -0.732 1.00 0.00 C ATOM 1899 CG1 ILE A 124 -38.391 4.349 -0.090 1.00 0.00 C ATOM 1900 CG2 ILE A 124 -38.713 2.094 -1.151 1.00 0.00 C ATOM 1901 CD1 ILE A 124 -39.348 5.065 -1.018 1.00 0.00 C ATOM 0 H ILE A 124 -36.236 1.209 -1.326 1.00 0.00 H new ATOM 0 HA ILE A 124 -35.978 3.311 0.564 1.00 0.00 H new ATOM 0 HB ILE A 124 -37.172 3.492 -1.622 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -38.936 4.014 0.792 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -37.634 5.055 0.252 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -39.434 2.538 -1.837 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -38.201 1.269 -1.647 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -39.234 1.720 -0.270 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -39.802 5.906 -0.494 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -38.805 5.431 -1.889 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -40.127 4.375 -1.340 1.00 0.00 H new ATOM 1913 N LEU A 125 -37.703 2.841 2.412 1.00 0.00 N ATOM 1914 CA LEU A 125 -38.396 2.434 3.628 1.00 0.00 C ATOM 1915 C LEU A 125 -39.900 2.324 3.388 1.00 0.00 C ATOM 1916 O LEU A 125 -40.675 2.156 4.329 1.00 0.00 O ATOM 1917 CB LEU A 125 -38.120 3.434 4.754 1.00 0.00 C ATOM 1918 CG LEU A 125 -36.642 3.646 5.094 1.00 0.00 C ATOM 1919 CD1 LEU A 125 -36.477 4.852 6.007 1.00 0.00 C ATOM 1920 CD2 LEU A 125 -36.053 2.402 5.743 1.00 0.00 C ATOM 0 H LEU A 125 -37.482 3.836 2.367 1.00 0.00 H new ATOM 0 HA LEU A 125 -38.021 1.453 3.920 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -38.554 4.395 4.478 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -38.638 3.097 5.652 1.00 0.00 H new ATOM 0 HG LEU A 125 -36.101 3.834 4.167 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -35.421 4.990 6.240 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -36.858 5.742 5.506 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -37.034 4.689 6.930 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -35.002 2.576 5.976 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -36.596 2.179 6.661 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -36.138 1.559 5.057 1.00 0.00 H new ATOM 1932 N GLU A 126 -40.308 2.418 2.123 1.00 0.00 N ATOM 1933 CA GLU A 126 -41.722 2.331 1.769 1.00 0.00 C ATOM 1934 C GLU A 126 -41.933 1.495 0.508 1.00 0.00 C ATOM 1935 O GLU A 126 -42.155 0.286 0.586 1.00 0.00 O ATOM 1936 CB GLU A 126 -42.306 3.732 1.570 1.00 0.00 C ATOM 1937 CG GLU A 126 -42.253 4.597 2.818 1.00 0.00 C ATOM 1938 CD GLU A 126 -42.814 5.986 2.590 1.00 0.00 C ATOM 1939 OE1 GLU A 126 -42.044 6.875 2.166 1.00 0.00 O ATOM 1940 OE2 GLU A 126 -44.022 6.186 2.835 1.00 0.00 O ATOM 0 H GLU A 126 -39.681 2.554 1.330 1.00 0.00 H new ATOM 0 HA GLU A 126 -42.240 1.838 2.592 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -41.763 4.232 0.768 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -43.342 3.642 1.245 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -42.812 4.110 3.617 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -41.220 4.678 3.156 1.00 0.00 H new ATOM 1947 N HIS A 127 -41.863 2.144 -0.652 1.00 0.00 N ATOM 1948 CA HIS A 127 -42.054 1.459 -1.928 1.00 0.00 C ATOM 1949 C HIS A 127 -41.305 2.176 -3.050 1.00 0.00 C ATOM 1950 O HIS A 127 -41.148 3.396 -3.022 1.00 0.00 O ATOM 1951 CB HIS A 127 -43.544 1.381 -2.267 1.00 0.00 C ATOM 1952 CG HIS A 127 -43.831 0.720 -3.580 1.00 0.00 C ATOM 1953 ND1 HIS A 127 -44.095 1.426 -4.736 1.00 0.00 N ATOM 1954 CD2 HIS A 127 -43.894 -0.590 -3.919 1.00 0.00 C ATOM 1955 CE1 HIS A 127 -44.309 0.580 -5.727 1.00 0.00 C ATOM 1956 NE2 HIS A 127 -44.193 -0.649 -5.257 1.00 0.00 N ATOM 0 H HIS A 127 -41.675 3.143 -0.735 1.00 0.00 H new ATOM 0 HA HIS A 127 -41.653 0.450 -1.834 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -44.059 0.836 -1.476 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -43.957 2.389 -2.280 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -43.738 -1.431 -3.259 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -44.540 0.847 -6.748 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -44.307 -1.504 -5.801 1.00 0.00 H new ATOM 1965 N HIS A 128 -40.843 1.408 -4.033 1.00 0.00 N ATOM 1966 CA HIS A 128 -40.110 1.971 -5.163 1.00 0.00 C ATOM 1967 C HIS A 128 -40.370 1.169 -6.436 1.00 0.00 C ATOM 1968 O HIS A 128 -40.399 -0.061 -6.412 1.00 0.00 O ATOM 1969 CB HIS A 128 -38.611 2.000 -4.857 1.00 0.00 C ATOM 1970 CG HIS A 128 -37.781 2.564 -5.968 1.00 0.00 C ATOM 1971 ND1 HIS A 128 -36.879 1.811 -6.690 1.00 0.00 N ATOM 1972 CD2 HIS A 128 -37.716 3.817 -6.478 1.00 0.00 C ATOM 1973 CE1 HIS A 128 -36.296 2.576 -7.596 1.00 0.00 C ATOM 1974 NE2 HIS A 128 -36.785 3.797 -7.487 1.00 0.00 N ATOM 0 H HIS A 128 -40.963 0.396 -4.070 1.00 0.00 H new ATOM 0 HA HIS A 128 -40.461 2.990 -5.323 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -38.445 2.590 -3.956 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -38.273 0.986 -4.642 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -38.289 4.672 -6.152 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -35.547 2.256 -8.305 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -36.515 4.597 -8.060 1.00 0.00 H new ATOM 1983 N HIS A 129 -40.557 1.878 -7.545 1.00 0.00 N ATOM 1984 CA HIS A 129 -40.816 1.240 -8.832 1.00 0.00 C ATOM 1985 C HIS A 129 -39.516 0.993 -9.591 1.00 0.00 C ATOM 1986 O HIS A 129 -38.612 1.829 -9.583 1.00 0.00 O ATOM 1987 CB HIS A 129 -41.757 2.111 -9.669 1.00 0.00 C ATOM 1988 CG HIS A 129 -42.142 1.496 -10.980 1.00 0.00 C ATOM 1989 ND1 HIS A 129 -41.574 1.866 -12.181 1.00 0.00 N ATOM 1990 CD2 HIS A 129 -43.050 0.535 -11.277 1.00 0.00 C ATOM 1991 CE1 HIS A 129 -42.114 1.160 -13.158 1.00 0.00 C ATOM 1992 NE2 HIS A 129 -43.012 0.346 -12.636 1.00 0.00 N ATOM 0 H HIS A 129 -40.534 2.897 -7.578 1.00 0.00 H new ATOM 0 HA HIS A 129 -41.290 0.276 -8.647 1.00 0.00 H new ATOM 0 HB2 HIS A 129 -42.660 2.312 -9.093 1.00 0.00 H new ATOM 0 HB3 HIS A 129 -41.278 3.072 -9.856 1.00 0.00 H new ATOM 0 HD2 HIS A 129 -43.685 0.015 -10.575 1.00 0.00 H new ATOM 0 HE1 HIS A 129 -41.863 1.236 -14.206 1.00 0.00 H new ATOM 0 HE2 HIS A 129 -43.585 -0.317 -13.158 1.00 0.00 H new ATOM 2001 N HIS A 130 -39.429 -0.162 -10.244 1.00 0.00 N ATOM 2002 CA HIS A 130 -38.239 -0.527 -11.007 1.00 0.00 C ATOM 2003 C HIS A 130 -38.221 0.181 -12.360 1.00 0.00 C ATOM 2004 O HIS A 130 -39.232 0.224 -13.061 1.00 0.00 O ATOM 2005 CB HIS A 130 -38.187 -2.043 -11.209 1.00 0.00 C ATOM 2006 CG HIS A 130 -36.909 -2.530 -11.820 1.00 0.00 C ATOM 2007 ND1 HIS A 130 -35.890 -3.090 -11.080 1.00 0.00 N ATOM 2008 CD2 HIS A 130 -36.491 -2.547 -13.108 1.00 0.00 C ATOM 2009 CE1 HIS A 130 -34.898 -3.430 -11.886 1.00 0.00 C ATOM 2010 NE2 HIS A 130 -35.239 -3.111 -13.121 1.00 0.00 N ATOM 0 H HIS A 130 -40.170 -0.863 -10.260 1.00 0.00 H new ATOM 0 HA HIS A 130 -37.362 -0.211 -10.442 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -38.328 -2.533 -10.246 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -39.020 -2.344 -11.844 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -37.040 -2.185 -13.965 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -33.968 -3.890 -11.585 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -34.665 -3.260 -13.951 1.00 0.00 H new ATOM 2019 N HIS A 131 -37.066 0.732 -12.722 1.00 0.00 N ATOM 2020 CA HIS A 131 -36.918 1.434 -13.992 1.00 0.00 C ATOM 2021 C HIS A 131 -36.154 0.580 -15.000 1.00 0.00 C ATOM 2022 O HIS A 131 -35.136 -0.027 -14.667 1.00 0.00 O ATOM 2023 CB HIS A 131 -36.194 2.765 -13.783 1.00 0.00 C ATOM 2024 CG HIS A 131 -36.940 3.722 -12.905 1.00 0.00 C ATOM 2025 ND1 HIS A 131 -36.701 3.847 -11.553 1.00 0.00 N ATOM 2026 CD2 HIS A 131 -37.924 4.606 -13.194 1.00 0.00 C ATOM 2027 CE1 HIS A 131 -37.506 4.765 -11.048 1.00 0.00 C ATOM 2028 NE2 HIS A 131 -38.257 5.240 -12.022 1.00 0.00 N ATOM 0 H HIS A 131 -36.219 0.706 -12.154 1.00 0.00 H new ATOM 0 HA HIS A 131 -37.915 1.629 -14.388 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -35.215 2.571 -13.345 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -36.023 3.232 -14.753 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -38.365 4.780 -14.165 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -37.543 5.074 -10.014 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -38.970 5.962 -11.921 1.00 0.00 H new ATOM 2037 N HIS A 132 -36.653 0.539 -16.231 1.00 0.00 N ATOM 2038 CA HIS A 132 -36.017 -0.239 -17.289 1.00 0.00 C ATOM 2039 C HIS A 132 -35.287 0.674 -18.271 1.00 0.00 C ATOM 2040 O HIS A 132 -34.073 0.895 -18.080 1.00 0.00 O ATOM 2041 CB HIS A 132 -37.061 -1.078 -18.031 1.00 0.00 C ATOM 2042 CG HIS A 132 -36.485 -1.933 -19.117 1.00 0.00 C ATOM 2043 ND1 HIS A 132 -36.724 -1.712 -20.457 1.00 0.00 N ATOM 2044 CD2 HIS A 132 -35.676 -3.019 -19.056 1.00 0.00 C ATOM 2045 CE1 HIS A 132 -36.090 -2.623 -21.173 1.00 0.00 C ATOM 2046 NE2 HIS A 132 -35.447 -3.427 -20.347 1.00 0.00 N ATOM 2047 OXT HIS A 132 -35.936 1.158 -19.222 1.00 0.00 O ATOM 0 H HIS A 132 -37.496 1.035 -16.521 1.00 0.00 H new ATOM 0 HA HIS A 132 -35.287 -0.905 -16.829 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -37.578 -1.716 -17.314 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -37.809 -0.413 -18.463 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -35.285 -3.477 -18.160 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -36.097 -2.697 -22.250 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -34.872 -4.223 -20.623 1.00 0.00 H new TER 2056 HIS A 132