USER MOD reduce.3.24.130724 H: found=0, std=0, add=1177, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1177 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 130 THR OG1 : rot -79:sc= 0.0629 USER MOD Set 1.2: A 131 ASN : amide:sc= -0.702 K(o=-0.64,f=-2.7!) USER MOD Set 2.1: A 127 CYS SG : rot 180:sc= -0.12 USER MOD Set 2.2: A 135 LYS NZ :NH3+ -153:sc= 0.314 (180deg=0.0514) USER MOD Set 3.1: A 80 TYR OH : rot 60:sc= -2.27 USER MOD Set 3.2: A 89 GLN : amide:sc= -4.68! C(o=-7!,f=-4.1!) USER MOD Set 4.1: A 20 TYR OH : rot 105:sc= -0.512 USER MOD Set 4.2: A 77 SER OG : rot -148:sc= 1.66 USER MOD Set 4.3: A 110 TYR OH : rot -163:sc= 0.513 USER MOD Single : A 9 HIS : no HD1:sc= -0.623 X(o=-0.62,f=-0.26) USER MOD Single : A 10 MET CE :methyl -110:sc= -2.01 (180deg=-4.46!) USER MOD Single : A 19 CYS SG : rot 180:sc= -1.17 USER MOD Single : A 21 CYS SG : rot -140:sc= -1.81 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -2.24 K(o=-2.2,f=-4.8!) USER MOD Single : A 31 MET CE :methyl -129:sc= -6.1! (180deg=-11.2!) USER MOD Single : A 34 GLN : amide:sc= -0.697 K(o=-0.7,f=-0.1) USER MOD Single : A 37 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.022) USER MOD Single : A 38 THR OG1 : rot -85:sc= 0.0643 USER MOD Single : A 39 ASN : amide:sc= -3.34 K(o=-3.3,f=-5.2!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 141:sc= -0.612 (180deg=-2.51!) USER MOD Single : A 45 CYS SG : rot 115:sc= -1.76 USER MOD Single : A 47 SER OG : rot -26:sc= 0.681 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.317 USER MOD Single : A 56 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= -0.328 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot -110:sc= -1.48 USER MOD Single : A 72 MET CE :methyl -120:sc= -1.36 (180deg=-6.23!) USER MOD Single : A 82 GLN : amide:sc= -1.55 X(o=-1.5,f=-1.3) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot 47:sc= -1.09 USER MOD Single : A 90 THR OG1 : rot 86:sc= 1 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= -2.01! USER MOD Single : A 97 SER OG : rot 180:sc= -0.0306 USER MOD Single : A 101 HIS : no HD1:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 102 GLN : amide:sc= -0.335 X(o=-0.34,f=-0.02) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ -166:sc= -0.616 (180deg=-0.797) USER MOD Single : A 111 LYS NZ :NH3+ -143:sc= -0.0138 (180deg=-1.25!) USER MOD Single : A 113 MET CE :methyl 148:sc= -3.73! (180deg=-6.38!) USER MOD Single : A 114 LYS NZ :NH3+ -154:sc= -0.48 (180deg=-1.5!) USER MOD Single : A 115 LYS NZ :NH3+ 156:sc= -1.79 (180deg=-2.98!) USER MOD Single : A 119 SER OG : rot -58:sc= 0.291 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -68:sc= 0.245 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot -70:sc= 0.5 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 9 -9.240 -9.903 -14.668 1.00 0.00 N ATOM 2 CA HIS A 9 -7.868 -10.303 -14.382 1.00 0.00 C ATOM 3 C HIS A 9 -7.642 -10.441 -12.879 1.00 0.00 C ATOM 4 O HIS A 9 -7.977 -9.544 -12.105 1.00 0.00 O ATOM 5 CB HIS A 9 -6.886 -9.286 -14.966 1.00 0.00 C ATOM 6 CG HIS A 9 -5.460 -9.742 -14.926 1.00 0.00 C ATOM 7 ND1 HIS A 9 -5.085 -11.056 -15.108 1.00 0.00 N ATOM 8 CD2 HIS A 9 -4.313 -9.049 -14.723 1.00 0.00 C ATOM 9 CE1 HIS A 9 -3.770 -11.154 -15.017 1.00 0.00 C ATOM 10 NE2 HIS A 9 -3.279 -9.951 -14.785 1.00 0.00 N ATOM 0 HA HIS A 9 -7.695 -11.274 -14.847 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -7.163 -9.077 -15.999 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -6.975 -8.349 -14.416 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -4.228 -7.987 -14.546 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -3.195 -12.063 -15.116 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -2.291 -9.727 -14.670 1.00 0.00 H new ATOM 19 N MET A 10 -7.069 -11.569 -12.476 1.00 0.00 N ATOM 20 CA MET A 10 -6.795 -11.829 -11.067 1.00 0.00 C ATOM 21 C MET A 10 -6.002 -13.122 -10.898 1.00 0.00 C ATOM 22 O MET A 10 -6.573 -14.179 -10.628 1.00 0.00 O ATOM 23 CB MET A 10 -8.102 -11.912 -10.277 1.00 0.00 C ATOM 24 CG MET A 10 -7.898 -12.037 -8.775 1.00 0.00 C ATOM 25 SD MET A 10 -9.386 -12.579 -7.915 1.00 0.00 S ATOM 26 CE MET A 10 -10.092 -11.005 -7.435 1.00 0.00 C ATOM 0 H MET A 10 -6.785 -12.319 -13.106 1.00 0.00 H new ATOM 0 HA MET A 10 -6.198 -11.003 -10.680 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.698 -11.022 -10.482 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.676 -12.768 -10.630 1.00 0.00 H new ATOM 0 HG2 MET A 10 -7.092 -12.744 -8.579 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.582 -11.074 -8.374 1.00 0.00 H new ATOM 0 HE1 MET A 10 -10.012 -10.885 -6.355 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.552 -10.198 -7.931 1.00 0.00 H new ATOM 0 HE3 MET A 10 -11.142 -10.973 -7.727 1.00 0.00 H new ATOM 36 N PRO A 11 -4.668 -13.056 -11.053 1.00 0.00 N ATOM 37 CA PRO A 11 -3.798 -14.229 -10.916 1.00 0.00 C ATOM 38 C PRO A 11 -3.895 -14.860 -9.531 1.00 0.00 C ATOM 39 O PRO A 11 -4.797 -14.547 -8.756 1.00 0.00 O ATOM 40 CB PRO A 11 -2.388 -13.673 -11.154 1.00 0.00 C ATOM 41 CG PRO A 11 -2.509 -12.201 -10.955 1.00 0.00 C ATOM 42 CD PRO A 11 -3.904 -11.841 -11.374 1.00 0.00 C ATOM 0 HA PRO A 11 -4.075 -15.020 -11.613 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.671 -14.107 -10.457 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -2.037 -13.907 -12.159 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.333 -11.932 -9.913 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.771 -11.665 -11.552 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -4.278 -10.973 -10.830 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.957 -11.599 -12.435 1.00 0.00 H new ATOM 50 N GLU A 12 -2.959 -15.754 -9.229 1.00 0.00 N ATOM 51 CA GLU A 12 -2.938 -16.434 -7.939 1.00 0.00 C ATOM 52 C GLU A 12 -1.993 -15.735 -6.968 1.00 0.00 C ATOM 53 O GLU A 12 -2.291 -15.601 -5.781 1.00 0.00 O ATOM 54 CB GLU A 12 -2.517 -17.894 -8.115 1.00 0.00 C ATOM 55 CG GLU A 12 -3.632 -18.789 -8.630 1.00 0.00 C ATOM 56 CD GLU A 12 -3.694 -20.118 -7.902 1.00 0.00 C ATOM 57 OE1 GLU A 12 -3.645 -20.115 -6.655 1.00 0.00 O ATOM 58 OE2 GLU A 12 -3.795 -21.162 -8.580 1.00 0.00 O ATOM 0 H GLU A 12 -2.205 -16.024 -9.860 1.00 0.00 H new ATOM 0 HA GLU A 12 -3.945 -16.400 -7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.676 -17.940 -8.807 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.165 -18.280 -7.158 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.586 -18.274 -8.521 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.487 -18.968 -9.695 1.00 0.00 H new ATOM 65 N ARG A 13 -0.851 -15.292 -7.482 1.00 0.00 N ATOM 66 CA ARG A 13 0.142 -14.606 -6.662 1.00 0.00 C ATOM 67 C ARG A 13 0.150 -13.109 -6.957 1.00 0.00 C ATOM 68 O ARG A 13 0.217 -12.696 -8.114 1.00 0.00 O ATOM 69 CB ARG A 13 1.533 -15.193 -6.912 1.00 0.00 C ATOM 70 CG ARG A 13 1.551 -16.712 -6.985 1.00 0.00 C ATOM 71 CD ARG A 13 1.514 -17.200 -8.425 1.00 0.00 C ATOM 72 NE ARG A 13 2.218 -18.471 -8.590 1.00 0.00 N ATOM 73 CZ ARG A 13 1.774 -19.631 -8.113 1.00 0.00 C ATOM 74 NH1 ARG A 13 0.629 -19.688 -7.443 1.00 0.00 N ATOM 75 NH2 ARG A 13 2.477 -20.739 -8.308 1.00 0.00 N ATOM 0 H ARG A 13 -0.589 -15.395 -8.462 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.124 -14.751 -5.615 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.926 -14.788 -7.845 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.203 -14.868 -6.116 1.00 0.00 H new ATOM 0 HG2 ARG A 13 2.448 -17.091 -6.494 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.696 -17.114 -6.441 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.478 -17.316 -8.742 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.964 -16.449 -9.074 1.00 0.00 H new ATOM 0 HE ARG A 13 3.101 -18.468 -9.101 1.00 0.00 H new ATOM 0 HH11 ARG A 13 0.084 -18.839 -7.291 1.00 0.00 H new ATOM 0 HH12 ARG A 13 0.294 -20.581 -7.080 1.00 0.00 H new ATOM 0 HH21 ARG A 13 3.357 -20.701 -8.823 1.00 0.00 H new ATOM 0 HH22 ARG A 13 2.138 -21.629 -7.943 1.00 0.00 H new ATOM 89 N PHE A 14 0.081 -12.302 -5.903 1.00 0.00 N ATOM 90 CA PHE A 14 0.078 -10.852 -6.051 1.00 0.00 C ATOM 91 C PHE A 14 1.244 -10.223 -5.298 1.00 0.00 C ATOM 92 O PHE A 14 1.810 -10.832 -4.390 1.00 0.00 O ATOM 93 CB PHE A 14 -1.245 -10.271 -5.550 1.00 0.00 C ATOM 94 CG PHE A 14 -2.391 -10.504 -6.490 1.00 0.00 C ATOM 95 CD1 PHE A 14 -2.405 -9.915 -7.743 1.00 0.00 C ATOM 96 CD2 PHE A 14 -3.452 -11.313 -6.121 1.00 0.00 C ATOM 97 CE1 PHE A 14 -3.458 -10.126 -8.611 1.00 0.00 C ATOM 98 CE2 PHE A 14 -4.510 -11.529 -6.985 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.511 -10.935 -8.232 1.00 0.00 C ATOM 0 H PHE A 14 0.026 -12.628 -4.938 1.00 0.00 H new ATOM 0 HA PHE A 14 0.190 -10.620 -7.110 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.483 -10.711 -4.582 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -1.126 -9.199 -5.392 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.583 -9.283 -8.045 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.454 -11.781 -5.148 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -3.458 -9.659 -9.585 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -5.333 -12.161 -6.685 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.335 -11.103 -8.910 1.00 0.00 H new ATOM 109 N ASP A 15 1.599 -9.002 -5.682 1.00 0.00 N ATOM 110 CA ASP A 15 2.700 -8.292 -5.044 1.00 0.00 C ATOM 111 C ASP A 15 2.244 -7.622 -3.752 1.00 0.00 C ATOM 112 O ASP A 15 2.631 -8.036 -2.659 1.00 0.00 O ATOM 113 CB ASP A 15 3.281 -7.246 -5.998 1.00 0.00 C ATOM 114 CG ASP A 15 4.794 -7.180 -5.932 1.00 0.00 C ATOM 115 OD1 ASP A 15 5.450 -8.148 -6.371 1.00 0.00 O ATOM 116 OD2 ASP A 15 5.323 -6.162 -5.439 1.00 0.00 O ATOM 0 H ASP A 15 1.140 -8.484 -6.431 1.00 0.00 H new ATOM 0 HA ASP A 15 3.473 -9.020 -4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.974 -7.478 -7.018 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.867 -6.267 -5.756 1.00 0.00 H new ATOM 121 N ALA A 16 1.422 -6.584 -3.881 1.00 0.00 N ATOM 122 CA ALA A 16 0.926 -5.863 -2.714 1.00 0.00 C ATOM 123 C ALA A 16 -0.519 -5.411 -2.901 1.00 0.00 C ATOM 124 O ALA A 16 -1.114 -5.604 -3.960 1.00 0.00 O ATOM 125 CB ALA A 16 1.816 -4.666 -2.418 1.00 0.00 C ATOM 0 H ALA A 16 1.088 -6.226 -4.776 1.00 0.00 H new ATOM 0 HA ALA A 16 0.951 -6.549 -1.867 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.435 -4.136 -1.545 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.832 -5.008 -2.220 1.00 0.00 H new ATOM 0 HB3 ALA A 16 1.820 -3.994 -3.277 1.00 0.00 H new ATOM 131 N PHE A 17 -1.076 -4.806 -1.856 1.00 0.00 N ATOM 132 CA PHE A 17 -2.451 -4.318 -1.892 1.00 0.00 C ATOM 133 C PHE A 17 -2.508 -2.830 -1.554 1.00 0.00 C ATOM 134 O PHE A 17 -1.789 -2.356 -0.676 1.00 0.00 O ATOM 135 CB PHE A 17 -3.315 -5.118 -0.912 1.00 0.00 C ATOM 136 CG PHE A 17 -4.705 -4.573 -0.739 1.00 0.00 C ATOM 137 CD1 PHE A 17 -5.728 -4.966 -1.586 1.00 0.00 C ATOM 138 CD2 PHE A 17 -4.986 -3.668 0.271 1.00 0.00 C ATOM 139 CE1 PHE A 17 -7.008 -4.467 -1.428 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.262 -3.164 0.434 1.00 0.00 C ATOM 141 CZ PHE A 17 -7.274 -3.564 -0.417 1.00 0.00 C ATOM 0 H PHE A 17 -0.595 -4.642 -0.972 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.839 -4.452 -2.902 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -3.380 -6.149 -1.259 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.820 -5.139 0.059 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.524 -5.670 -2.379 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.198 -3.353 0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.798 -4.783 -2.094 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.468 -2.459 1.225 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.272 -3.171 -0.292 1.00 0.00 H new ATOM 151 N ILE A 18 -3.369 -2.095 -2.257 1.00 0.00 N ATOM 152 CA ILE A 18 -3.514 -0.661 -2.029 1.00 0.00 C ATOM 153 C ILE A 18 -4.638 -0.369 -1.038 1.00 0.00 C ATOM 154 O ILE A 18 -5.798 -0.693 -1.290 1.00 0.00 O ATOM 155 CB ILE A 18 -3.807 0.096 -3.342 1.00 0.00 C ATOM 156 CG1 ILE A 18 -2.739 -0.215 -4.390 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.887 1.595 -3.090 1.00 0.00 C ATOM 158 CD1 ILE A 18 -1.369 0.321 -4.035 1.00 0.00 C ATOM 0 H ILE A 18 -3.975 -2.470 -2.987 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.565 -0.315 -1.618 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.771 -0.240 -3.723 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.675 -1.295 -4.522 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.048 0.205 -5.347 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.094 2.111 -4.028 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.686 1.802 -2.378 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.939 1.947 -2.684 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -0.662 0.063 -4.823 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -1.418 1.405 -3.932 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -1.039 -0.118 -3.094 1.00 0.00 H new ATOM 170 N CYS A 19 -4.291 0.252 0.087 1.00 0.00 N ATOM 171 CA CYS A 19 -5.284 0.589 1.104 1.00 0.00 C ATOM 172 C CYS A 19 -5.445 2.103 1.234 1.00 0.00 C ATOM 173 O CYS A 19 -4.686 2.760 1.946 1.00 0.00 O ATOM 174 CB CYS A 19 -4.885 -0.013 2.453 1.00 0.00 C ATOM 175 SG CYS A 19 -6.243 -0.822 3.331 1.00 0.00 S ATOM 0 H CYS A 19 -3.337 0.530 0.317 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.241 0.169 0.794 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -4.087 -0.738 2.293 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.477 0.776 3.085 1.00 0.00 H new ATOM 0 HG CYS A 19 -5.807 -1.301 4.458 1.00 0.00 H new ATOM 181 N TYR A 20 -6.448 2.646 0.545 1.00 0.00 N ATOM 182 CA TYR A 20 -6.723 4.081 0.586 1.00 0.00 C ATOM 183 C TYR A 20 -8.221 4.350 0.464 1.00 0.00 C ATOM 184 O TYR A 20 -8.996 3.453 0.133 1.00 0.00 O ATOM 185 CB TYR A 20 -5.967 4.799 -0.537 1.00 0.00 C ATOM 186 CG TYR A 20 -5.900 6.303 -0.366 1.00 0.00 C ATOM 187 CD1 TYR A 20 -5.662 6.874 0.879 1.00 0.00 C ATOM 188 CD2 TYR A 20 -6.072 7.150 -1.453 1.00 0.00 C ATOM 189 CE1 TYR A 20 -5.596 8.245 1.033 1.00 0.00 C ATOM 190 CE2 TYR A 20 -6.008 8.523 -1.305 1.00 0.00 C ATOM 191 CZ TYR A 20 -5.770 9.065 -0.061 1.00 0.00 C ATOM 192 OH TYR A 20 -5.706 10.431 0.089 1.00 0.00 O ATOM 0 H TYR A 20 -7.084 2.113 -0.049 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.381 4.466 1.547 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.953 4.403 -0.590 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -6.448 4.572 -1.489 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -5.527 6.235 1.739 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -6.259 6.729 -2.430 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -5.409 8.673 2.007 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -6.144 9.168 -2.161 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.853 10.759 -0.265 1.00 0.00 H new ATOM 202 N CYS A 21 -8.623 5.591 0.726 1.00 0.00 N ATOM 203 CA CYS A 21 -10.027 5.976 0.637 1.00 0.00 C ATOM 204 C CYS A 21 -10.416 6.263 -0.814 1.00 0.00 C ATOM 205 O CYS A 21 -9.575 6.649 -1.625 1.00 0.00 O ATOM 206 CB CYS A 21 -10.294 7.208 1.507 1.00 0.00 C ATOM 207 SG CYS A 21 -11.579 6.967 2.757 1.00 0.00 S ATOM 0 H CYS A 21 -7.996 6.347 1.002 1.00 0.00 H new ATOM 0 HA CYS A 21 -10.635 5.147 1.001 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -9.368 7.495 2.005 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -10.581 8.039 0.863 1.00 0.00 H new ATOM 0 HG CYS A 21 -12.311 8.038 2.839 1.00 0.00 H new ATOM 213 N PRO A 22 -11.702 6.072 -1.160 1.00 0.00 N ATOM 214 CA PRO A 22 -12.200 6.304 -2.520 1.00 0.00 C ATOM 215 C PRO A 22 -12.429 7.784 -2.829 1.00 0.00 C ATOM 216 O PRO A 22 -12.902 8.130 -3.911 1.00 0.00 O ATOM 217 CB PRO A 22 -13.526 5.548 -2.531 1.00 0.00 C ATOM 218 CG PRO A 22 -14.005 5.609 -1.123 1.00 0.00 C ATOM 219 CD PRO A 22 -12.771 5.605 -0.255 1.00 0.00 C ATOM 0 HA PRO A 22 -11.486 5.974 -3.275 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -14.240 6.010 -3.213 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.392 4.517 -2.860 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.597 6.508 -0.952 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.645 4.757 -0.893 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.884 6.266 0.604 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -12.559 4.609 0.134 1.00 0.00 H new ATOM 227 N SER A 23 -12.093 8.654 -1.880 1.00 0.00 N ATOM 228 CA SER A 23 -12.269 10.088 -2.065 1.00 0.00 C ATOM 229 C SER A 23 -11.176 10.646 -2.966 1.00 0.00 C ATOM 230 O SER A 23 -11.433 11.497 -3.818 1.00 0.00 O ATOM 231 CB SER A 23 -12.250 10.807 -0.714 1.00 0.00 C ATOM 232 OG SER A 23 -13.557 10.912 -0.176 1.00 0.00 O ATOM 0 H SER A 23 -11.698 8.390 -0.977 1.00 0.00 H new ATOM 0 HA SER A 23 -13.236 10.256 -2.540 1.00 0.00 H new ATOM 0 HB2 SER A 23 -11.609 10.265 -0.019 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.821 11.802 -0.834 1.00 0.00 H new ATOM 0 HG SER A 23 -13.519 11.373 0.688 1.00 0.00 H new ATOM 238 N ASP A 24 -9.956 10.159 -2.774 1.00 0.00 N ATOM 239 CA ASP A 24 -8.826 10.606 -3.574 1.00 0.00 C ATOM 240 C ASP A 24 -8.013 9.419 -4.082 1.00 0.00 C ATOM 241 O ASP A 24 -6.798 9.515 -4.257 1.00 0.00 O ATOM 242 CB ASP A 24 -7.932 11.543 -2.758 1.00 0.00 C ATOM 243 CG ASP A 24 -7.109 12.466 -3.635 1.00 0.00 C ATOM 244 OD1 ASP A 24 -7.688 13.415 -4.207 1.00 0.00 O ATOM 245 OD2 ASP A 24 -5.887 12.242 -3.749 1.00 0.00 O ATOM 0 H ASP A 24 -9.726 9.456 -2.072 1.00 0.00 H new ATOM 0 HA ASP A 24 -9.216 11.149 -4.435 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -8.551 12.139 -2.088 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -7.265 10.950 -2.132 1.00 0.00 H new ATOM 250 N ILE A 25 -8.693 8.303 -4.318 1.00 0.00 N ATOM 251 CA ILE A 25 -8.038 7.095 -4.804 1.00 0.00 C ATOM 252 C ILE A 25 -7.385 7.331 -6.166 1.00 0.00 C ATOM 253 O ILE A 25 -6.277 6.863 -6.423 1.00 0.00 O ATOM 254 CB ILE A 25 -9.036 5.920 -4.902 1.00 0.00 C ATOM 255 CG1 ILE A 25 -8.291 4.583 -4.899 1.00 0.00 C ATOM 256 CG2 ILE A 25 -9.912 6.047 -6.142 1.00 0.00 C ATOM 257 CD1 ILE A 25 -7.439 4.359 -6.130 1.00 0.00 C ATOM 0 H ILE A 25 -9.699 8.210 -4.180 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.262 6.837 -4.083 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.687 5.954 -4.028 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.656 4.533 -4.014 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -9.016 3.773 -4.817 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.605 5.207 -6.186 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.475 6.979 -6.096 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.284 6.046 -7.033 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.942 3.392 -6.057 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.071 4.376 -7.018 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.690 5.148 -6.202 1.00 0.00 H new ATOM 269 N GLN A 26 -8.085 8.058 -7.034 1.00 0.00 N ATOM 270 CA GLN A 26 -7.583 8.359 -8.374 1.00 0.00 C ATOM 271 C GLN A 26 -6.124 8.805 -8.336 1.00 0.00 C ATOM 272 O GLN A 26 -5.308 8.384 -9.158 1.00 0.00 O ATOM 273 CB GLN A 26 -8.439 9.446 -9.027 1.00 0.00 C ATOM 274 CG GLN A 26 -9.871 9.012 -9.297 1.00 0.00 C ATOM 275 CD GLN A 26 -10.333 9.361 -10.699 1.00 0.00 C ATOM 276 OE1 GLN A 26 -10.096 8.615 -11.648 1.00 0.00 O ATOM 277 NE2 GLN A 26 -10.996 10.504 -10.835 1.00 0.00 N ATOM 0 H GLN A 26 -9.005 8.451 -6.833 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.644 7.445 -8.964 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -8.450 10.325 -8.382 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.976 9.746 -9.967 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.954 7.935 -9.149 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.533 9.486 -8.572 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.170 11.092 -10.020 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -11.331 10.793 -11.754 1.00 0.00 H new ATOM 286 N PHE A 27 -5.803 9.659 -7.372 1.00 0.00 N ATOM 287 CA PHE A 27 -4.445 10.169 -7.220 1.00 0.00 C ATOM 288 C PHE A 27 -3.460 9.031 -6.980 1.00 0.00 C ATOM 289 O PHE A 27 -2.494 8.864 -7.724 1.00 0.00 O ATOM 290 CB PHE A 27 -4.382 11.167 -6.064 1.00 0.00 C ATOM 291 CG PHE A 27 -3.334 12.228 -6.241 1.00 0.00 C ATOM 292 CD1 PHE A 27 -3.536 13.280 -7.120 1.00 0.00 C ATOM 293 CD2 PHE A 27 -2.146 12.172 -5.531 1.00 0.00 C ATOM 294 CE1 PHE A 27 -2.573 14.256 -7.287 1.00 0.00 C ATOM 295 CE2 PHE A 27 -1.178 13.146 -5.693 1.00 0.00 C ATOM 296 CZ PHE A 27 -1.394 14.190 -6.572 1.00 0.00 C ATOM 0 H PHE A 27 -6.465 10.014 -6.682 1.00 0.00 H new ATOM 0 HA PHE A 27 -4.167 10.675 -8.144 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.356 11.645 -5.954 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -4.186 10.626 -5.138 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -4.457 13.337 -7.681 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -1.974 11.358 -4.843 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -2.742 15.070 -7.976 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.256 13.091 -5.134 1.00 0.00 H new ATOM 0 HZ PHE A 27 -0.641 14.954 -6.700 1.00 0.00 H new ATOM 306 N VAL A 28 -3.712 8.252 -5.933 1.00 0.00 N ATOM 307 CA VAL A 28 -2.849 7.130 -5.592 1.00 0.00 C ATOM 308 C VAL A 28 -2.704 6.166 -6.765 1.00 0.00 C ATOM 309 O VAL A 28 -1.599 5.910 -7.236 1.00 0.00 O ATOM 310 CB VAL A 28 -3.386 6.361 -4.369 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.404 5.281 -3.939 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.672 7.318 -3.223 1.00 0.00 C ATOM 0 H VAL A 28 -4.507 8.378 -5.307 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.871 7.546 -5.350 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.320 5.875 -4.651 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.802 4.750 -3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.254 4.578 -4.759 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.451 5.740 -3.676 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -4.050 6.758 -2.368 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.754 7.834 -2.942 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.417 8.049 -3.537 1.00 0.00 H new ATOM 322 N GLN A 29 -3.826 5.636 -7.241 1.00 0.00 N ATOM 323 CA GLN A 29 -3.812 4.702 -8.359 1.00 0.00 C ATOM 324 C GLN A 29 -3.005 5.254 -9.534 1.00 0.00 C ATOM 325 O GLN A 29 -2.478 4.494 -10.345 1.00 0.00 O ATOM 326 CB GLN A 29 -5.240 4.395 -8.799 1.00 0.00 C ATOM 327 CG GLN A 29 -5.984 5.604 -9.338 1.00 0.00 C ATOM 328 CD GLN A 29 -7.067 5.230 -10.330 1.00 0.00 C ATOM 329 OE1 GLN A 29 -8.234 5.575 -10.152 1.00 0.00 O ATOM 330 NE2 GLN A 29 -6.683 4.518 -11.383 1.00 0.00 N ATOM 0 H GLN A 29 -4.755 5.837 -6.870 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.332 3.782 -8.026 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.216 3.622 -9.567 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.792 3.987 -7.952 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.431 6.150 -8.507 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.274 6.278 -9.818 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.704 4.254 -11.490 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.367 4.235 -12.085 1.00 0.00 H new ATOM 339 N GLU A 30 -2.913 6.577 -9.618 1.00 0.00 N ATOM 340 CA GLU A 30 -2.170 7.224 -10.694 1.00 0.00 C ATOM 341 C GLU A 30 -0.667 6.999 -10.536 1.00 0.00 C ATOM 342 O GLU A 30 -0.005 6.498 -11.446 1.00 0.00 O ATOM 343 CB GLU A 30 -2.473 8.723 -10.720 1.00 0.00 C ATOM 344 CG GLU A 30 -2.640 9.286 -12.123 1.00 0.00 C ATOM 345 CD GLU A 30 -1.313 9.644 -12.767 1.00 0.00 C ATOM 346 OE1 GLU A 30 -0.648 10.578 -12.274 1.00 0.00 O ATOM 347 OE2 GLU A 30 -0.945 8.992 -13.765 1.00 0.00 O ATOM 0 H GLU A 30 -3.343 7.222 -8.955 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.486 6.778 -11.637 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -3.384 8.911 -10.151 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.667 9.257 -10.217 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.157 8.555 -12.745 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.272 10.173 -12.082 1.00 0.00 H new ATOM 354 N MET A 31 -0.134 7.376 -9.378 1.00 0.00 N ATOM 355 CA MET A 31 1.293 7.215 -9.108 1.00 0.00 C ATOM 356 C MET A 31 1.651 5.746 -8.914 1.00 0.00 C ATOM 357 O MET A 31 2.746 5.312 -9.271 1.00 0.00 O ATOM 358 CB MET A 31 1.712 8.029 -7.880 1.00 0.00 C ATOM 359 CG MET A 31 0.682 8.042 -6.764 1.00 0.00 C ATOM 360 SD MET A 31 1.428 8.199 -5.132 1.00 0.00 S ATOM 361 CE MET A 31 0.954 6.634 -4.406 1.00 0.00 C ATOM 0 H MET A 31 -0.665 7.793 -8.614 1.00 0.00 H new ATOM 0 HA MET A 31 1.838 7.590 -9.974 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.647 7.626 -7.492 1.00 0.00 H new ATOM 0 HB3 MET A 31 1.911 9.055 -8.188 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.010 8.869 -6.924 1.00 0.00 H new ATOM 0 HG3 MET A 31 0.097 7.123 -6.805 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.489 6.809 -3.436 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.245 6.128 -5.062 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.838 6.010 -4.277 1.00 0.00 H new ATOM 371 N ILE A 32 0.720 4.983 -8.353 1.00 0.00 N ATOM 372 CA ILE A 32 0.941 3.560 -8.122 1.00 0.00 C ATOM 373 C ILE A 32 1.004 2.799 -9.443 1.00 0.00 C ATOM 374 O ILE A 32 1.976 2.097 -9.718 1.00 0.00 O ATOM 375 CB ILE A 32 -0.167 2.951 -7.232 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.180 3.615 -5.851 1.00 0.00 C ATOM 377 CG2 ILE A 32 0.024 1.446 -7.090 1.00 0.00 C ATOM 378 CD1 ILE A 32 1.191 3.756 -5.227 1.00 0.00 C ATOM 0 H ILE A 32 -0.192 5.324 -8.050 1.00 0.00 H new ATOM 0 HA ILE A 32 1.895 3.464 -7.604 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.127 3.136 -7.714 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.633 4.603 -5.938 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.814 3.031 -5.184 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.766 1.037 -6.460 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.018 0.979 -8.074 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.993 1.244 -6.634 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.099 4.234 -4.252 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.639 2.770 -5.107 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.823 4.366 -5.872 1.00 0.00 H new ATOM 390 N ARG A 33 -0.037 2.944 -10.259 1.00 0.00 N ATOM 391 CA ARG A 33 -0.091 2.271 -11.547 1.00 0.00 C ATOM 392 C ARG A 33 1.097 2.667 -12.417 1.00 0.00 C ATOM 393 O ARG A 33 1.589 1.871 -13.218 1.00 0.00 O ATOM 394 CB ARG A 33 -1.408 2.595 -12.257 1.00 0.00 C ATOM 395 CG ARG A 33 -1.466 3.996 -12.843 1.00 0.00 C ATOM 396 CD ARG A 33 -0.961 4.020 -14.278 1.00 0.00 C ATOM 397 NE ARG A 33 -2.053 3.933 -15.244 1.00 0.00 N ATOM 398 CZ ARG A 33 -1.933 4.254 -16.530 1.00 0.00 C ATOM 399 NH1 ARG A 33 -0.770 4.681 -17.008 1.00 0.00 N ATOM 400 NH2 ARG A 33 -2.977 4.146 -17.342 1.00 0.00 N ATOM 0 H ARG A 33 -0.851 3.521 -10.049 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.040 1.196 -11.376 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.565 1.871 -13.057 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.229 2.473 -11.551 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.492 4.363 -12.811 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.866 4.672 -12.233 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.398 4.938 -14.449 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.272 3.190 -14.434 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.961 3.607 -14.914 1.00 0.00 H new ATOM 0 HH11 ARG A 33 0.036 4.764 -16.389 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -0.683 4.926 -17.994 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.872 3.817 -16.981 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.884 4.392 -18.327 1.00 0.00 H new ATOM 414 N GLN A 34 1.563 3.900 -12.243 1.00 0.00 N ATOM 415 CA GLN A 34 2.703 4.398 -12.999 1.00 0.00 C ATOM 416 C GLN A 34 3.995 3.794 -12.463 1.00 0.00 C ATOM 417 O GLN A 34 4.986 3.680 -13.182 1.00 0.00 O ATOM 418 CB GLN A 34 2.766 5.924 -12.926 1.00 0.00 C ATOM 419 CG GLN A 34 3.773 6.539 -13.883 1.00 0.00 C ATOM 420 CD GLN A 34 3.301 6.511 -15.323 1.00 0.00 C ATOM 421 OE1 GLN A 34 2.808 7.511 -15.846 1.00 0.00 O ATOM 422 NE2 GLN A 34 3.449 5.363 -15.974 1.00 0.00 N ATOM 0 H GLN A 34 1.167 4.571 -11.585 1.00 0.00 H new ATOM 0 HA GLN A 34 2.583 4.104 -14.042 1.00 0.00 H new ATOM 0 HB2 GLN A 34 1.778 6.331 -13.141 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.018 6.220 -11.908 1.00 0.00 H new ATOM 0 HG2 GLN A 34 3.966 7.570 -13.588 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.718 6.002 -13.804 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.863 4.559 -15.502 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.149 5.285 -16.946 1.00 0.00 H new ATOM 431 N LEU A 35 3.971 3.407 -11.191 1.00 0.00 N ATOM 432 CA LEU A 35 5.132 2.812 -10.551 1.00 0.00 C ATOM 433 C LEU A 35 5.296 1.357 -10.975 1.00 0.00 C ATOM 434 O LEU A 35 6.413 0.846 -11.060 1.00 0.00 O ATOM 435 CB LEU A 35 4.998 2.902 -9.031 1.00 0.00 C ATOM 436 CG LEU A 35 5.369 4.256 -8.425 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.786 4.391 -7.027 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.880 4.430 -8.396 1.00 0.00 C ATOM 0 H LEU A 35 3.156 3.497 -10.584 1.00 0.00 H new ATOM 0 HA LEU A 35 6.018 3.365 -10.865 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.969 2.669 -8.758 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.628 2.135 -8.580 1.00 0.00 H new ATOM 0 HG LEU A 35 4.946 5.042 -9.050 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.060 5.360 -6.611 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.700 4.311 -7.076 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.180 3.599 -6.391 1.00 0.00 H new ATOM 0 HD21 LEU A 35 7.126 5.399 -7.962 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.326 3.638 -7.794 1.00 0.00 H new ATOM 0 HD23 LEU A 35 7.272 4.377 -9.412 1.00 0.00 H new ATOM 450 N GLU A 36 4.174 0.695 -11.239 1.00 0.00 N ATOM 451 CA GLU A 36 4.191 -0.704 -11.654 1.00 0.00 C ATOM 452 C GLU A 36 4.687 -0.838 -13.087 1.00 0.00 C ATOM 453 O GLU A 36 5.511 -1.700 -13.395 1.00 0.00 O ATOM 454 CB GLU A 36 2.793 -1.316 -11.530 1.00 0.00 C ATOM 455 CG GLU A 36 2.115 -1.025 -10.200 1.00 0.00 C ATOM 456 CD GLU A 36 0.602 -0.987 -10.313 1.00 0.00 C ATOM 457 OE1 GLU A 36 0.089 -1.029 -11.450 1.00 0.00 O ATOM 458 OE2 GLU A 36 -0.069 -0.914 -9.261 1.00 0.00 O ATOM 0 H GLU A 36 3.242 1.104 -11.173 1.00 0.00 H new ATOM 0 HA GLU A 36 4.874 -1.241 -10.997 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.167 -0.937 -12.338 1.00 0.00 H new ATOM 0 HB3 GLU A 36 2.865 -2.395 -11.663 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.403 -1.787 -9.475 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.471 -0.069 -9.816 1.00 0.00 H new ATOM 465 N GLN A 37 4.181 0.023 -13.961 1.00 0.00 N ATOM 466 CA GLN A 37 4.565 0.009 -15.364 1.00 0.00 C ATOM 467 C GLN A 37 6.071 0.198 -15.523 1.00 0.00 C ATOM 468 O GLN A 37 6.658 -0.240 -16.514 1.00 0.00 O ATOM 469 CB GLN A 37 3.817 1.106 -16.116 1.00 0.00 C ATOM 470 CG GLN A 37 2.304 0.996 -16.008 1.00 0.00 C ATOM 471 CD GLN A 37 1.621 0.979 -17.362 1.00 0.00 C ATOM 472 OE1 GLN A 37 1.892 0.115 -18.196 1.00 0.00 O ATOM 473 NE2 GLN A 37 0.730 1.938 -17.588 1.00 0.00 N ATOM 0 H GLN A 37 3.500 0.743 -13.720 1.00 0.00 H new ATOM 0 HA GLN A 37 4.300 -0.962 -15.783 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.131 2.077 -15.732 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.101 1.072 -17.168 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.048 0.086 -15.465 1.00 0.00 H new ATOM 0 HG3 GLN A 37 1.923 1.834 -15.424 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.536 2.634 -16.868 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.240 1.978 -18.481 1.00 0.00 H new ATOM 482 N THR A 38 6.692 0.850 -14.546 1.00 0.00 N ATOM 483 CA THR A 38 8.130 1.097 -14.583 1.00 0.00 C ATOM 484 C THR A 38 8.831 0.408 -13.416 1.00 0.00 C ATOM 485 O THR A 38 8.210 -0.337 -12.658 1.00 0.00 O ATOM 486 CB THR A 38 8.411 2.599 -14.544 1.00 0.00 C ATOM 487 OG1 THR A 38 8.178 3.120 -13.249 1.00 0.00 O ATOM 488 CG2 THR A 38 7.566 3.391 -15.518 1.00 0.00 C ATOM 0 H THR A 38 6.223 1.217 -13.718 1.00 0.00 H new ATOM 0 HA THR A 38 8.520 0.684 -15.513 1.00 0.00 H new ATOM 0 HB THR A 38 9.458 2.704 -14.828 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.227 3.336 -13.149 1.00 0.00 H new ATOM 0 HG21 THR A 38 7.815 4.449 -15.439 1.00 0.00 H new ATOM 0 HG22 THR A 38 7.762 3.047 -16.533 1.00 0.00 H new ATOM 0 HG23 THR A 38 6.511 3.248 -15.284 1.00 0.00 H new ATOM 496 N ASN A 39 10.129 0.664 -13.281 1.00 0.00 N ATOM 497 CA ASN A 39 10.925 0.074 -12.207 1.00 0.00 C ATOM 498 C ASN A 39 11.013 -1.443 -12.360 1.00 0.00 C ATOM 499 O ASN A 39 12.039 -1.973 -12.786 1.00 0.00 O ATOM 500 CB ASN A 39 10.332 0.434 -10.842 1.00 0.00 C ATOM 501 CG ASN A 39 11.152 -0.117 -9.691 1.00 0.00 C ATOM 502 OD1 ASN A 39 10.684 -0.966 -8.933 1.00 0.00 O ATOM 503 ND2 ASN A 39 12.382 0.363 -9.556 1.00 0.00 N ATOM 0 H ASN A 39 10.654 1.278 -13.904 1.00 0.00 H new ATOM 0 HA ASN A 39 11.933 0.483 -12.272 1.00 0.00 H new ATOM 0 HB2 ASN A 39 10.267 1.518 -10.752 1.00 0.00 H new ATOM 0 HB3 ASN A 39 9.315 0.047 -10.778 1.00 0.00 H new ATOM 0 HD21 ASN A 39 12.980 0.028 -8.800 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.729 1.067 -10.208 1.00 0.00 H new ATOM 510 N TYR A 40 9.934 -2.137 -12.010 1.00 0.00 N ATOM 511 CA TYR A 40 9.897 -3.592 -12.108 1.00 0.00 C ATOM 512 C TYR A 40 8.476 -4.084 -12.364 1.00 0.00 C ATOM 513 O TYR A 40 7.548 -3.287 -12.503 1.00 0.00 O ATOM 514 CB TYR A 40 10.443 -4.224 -10.827 1.00 0.00 C ATOM 515 CG TYR A 40 11.908 -3.938 -10.583 1.00 0.00 C ATOM 516 CD1 TYR A 40 12.868 -4.266 -11.532 1.00 0.00 C ATOM 517 CD2 TYR A 40 12.331 -3.338 -9.404 1.00 0.00 C ATOM 518 CE1 TYR A 40 14.207 -4.007 -11.313 1.00 0.00 C ATOM 519 CE2 TYR A 40 13.668 -3.072 -9.178 1.00 0.00 C ATOM 520 CZ TYR A 40 14.603 -3.410 -10.134 1.00 0.00 C ATOM 521 OH TYR A 40 15.935 -3.149 -9.913 1.00 0.00 O ATOM 0 H TYR A 40 9.075 -1.716 -11.656 1.00 0.00 H new ATOM 0 HA TYR A 40 10.523 -3.890 -12.949 1.00 0.00 H new ATOM 0 HB2 TYR A 40 9.865 -3.860 -9.978 1.00 0.00 H new ATOM 0 HB3 TYR A 40 10.296 -5.303 -10.874 1.00 0.00 H new ATOM 0 HD1 TYR A 40 12.562 -4.732 -12.457 1.00 0.00 H new ATOM 0 HD2 TYR A 40 11.603 -3.075 -8.651 1.00 0.00 H new ATOM 0 HE1 TYR A 40 14.940 -4.271 -12.061 1.00 0.00 H new ATOM 0 HE2 TYR A 40 13.979 -2.602 -8.257 1.00 0.00 H new ATOM 0 HH TYR A 40 16.044 -2.726 -9.036 1.00 0.00 H new ATOM 531 N ARG A 41 8.314 -5.401 -12.421 1.00 0.00 N ATOM 532 CA ARG A 41 7.005 -6.001 -12.658 1.00 0.00 C ATOM 533 C ARG A 41 6.167 -5.989 -11.384 1.00 0.00 C ATOM 534 O ARG A 41 5.941 -7.031 -10.768 1.00 0.00 O ATOM 535 CB ARG A 41 7.161 -7.433 -13.171 1.00 0.00 C ATOM 536 CG ARG A 41 7.521 -7.516 -14.646 1.00 0.00 C ATOM 537 CD ARG A 41 6.571 -8.430 -15.404 1.00 0.00 C ATOM 538 NE ARG A 41 6.726 -9.828 -15.010 1.00 0.00 N ATOM 539 CZ ARG A 41 5.811 -10.769 -15.235 1.00 0.00 C ATOM 540 NH1 ARG A 41 4.673 -10.464 -15.850 1.00 0.00 N ATOM 541 NH2 ARG A 41 6.033 -12.015 -14.844 1.00 0.00 N ATOM 0 H ARG A 41 9.072 -6.074 -12.306 1.00 0.00 H new ATOM 0 HA ARG A 41 6.491 -5.409 -13.415 1.00 0.00 H new ATOM 0 HB2 ARG A 41 7.933 -7.937 -12.589 1.00 0.00 H new ATOM 0 HB3 ARG A 41 6.230 -7.974 -13.002 1.00 0.00 H new ATOM 0 HG2 ARG A 41 7.494 -6.518 -15.084 1.00 0.00 H new ATOM 0 HG3 ARG A 41 8.542 -7.883 -14.752 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.543 -8.114 -15.224 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.751 -8.333 -16.475 1.00 0.00 H new ATOM 0 HE ARG A 41 7.586 -10.100 -14.534 1.00 0.00 H new ATOM 0 HH11 ARG A 41 4.497 -9.506 -16.152 1.00 0.00 H new ATOM 0 HH12 ARG A 41 3.975 -11.188 -16.020 1.00 0.00 H new ATOM 0 HH21 ARG A 41 6.905 -12.253 -14.371 1.00 0.00 H new ATOM 0 HH22 ARG A 41 5.332 -12.736 -15.016 1.00 0.00 H new ATOM 555 N LEU A 42 5.711 -4.805 -10.993 1.00 0.00 N ATOM 556 CA LEU A 42 4.902 -4.654 -9.792 1.00 0.00 C ATOM 557 C LEU A 42 3.476 -5.142 -10.027 1.00 0.00 C ATOM 558 O LEU A 42 2.899 -4.917 -11.091 1.00 0.00 O ATOM 559 CB LEU A 42 4.883 -3.191 -9.346 1.00 0.00 C ATOM 560 CG LEU A 42 4.624 -2.970 -7.856 1.00 0.00 C ATOM 561 CD1 LEU A 42 5.782 -3.505 -7.027 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.402 -1.492 -7.570 1.00 0.00 C ATOM 0 H LEU A 42 5.889 -3.934 -11.493 1.00 0.00 H new ATOM 0 HA LEU A 42 5.350 -5.263 -9.006 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.840 -2.736 -9.604 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.116 -2.664 -9.914 1.00 0.00 H new ATOM 0 HG LEU A 42 3.722 -3.516 -7.578 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.579 -3.339 -5.969 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.898 -4.573 -7.211 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.699 -2.987 -7.307 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.219 -1.351 -6.505 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.287 -0.928 -7.864 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.541 -1.137 -8.136 1.00 0.00 H new ATOM 574 N LYS A 43 2.913 -5.810 -9.025 1.00 0.00 N ATOM 575 CA LYS A 43 1.554 -6.330 -9.119 1.00 0.00 C ATOM 576 C LYS A 43 0.756 -5.988 -7.865 1.00 0.00 C ATOM 577 O LYS A 43 0.738 -6.752 -6.899 1.00 0.00 O ATOM 578 CB LYS A 43 1.580 -7.846 -9.326 1.00 0.00 C ATOM 579 CG LYS A 43 2.567 -8.295 -10.391 1.00 0.00 C ATOM 580 CD LYS A 43 2.030 -8.038 -11.792 1.00 0.00 C ATOM 581 CE LYS A 43 3.091 -7.436 -12.699 1.00 0.00 C ATOM 582 NZ LYS A 43 3.508 -8.379 -13.773 1.00 0.00 N ATOM 0 H LYS A 43 3.378 -6.004 -8.138 1.00 0.00 H new ATOM 0 HA LYS A 43 1.068 -5.863 -9.976 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.831 -8.329 -8.382 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.581 -8.184 -9.602 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.511 -7.767 -10.259 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.777 -9.358 -10.270 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.672 -8.974 -12.222 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.174 -7.365 -11.736 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.706 -6.521 -13.149 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.961 -7.157 -12.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.651 -7.854 -14.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.396 -8.845 -13.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.768 -9.097 -13.911 1.00 0.00 H new ATOM 596 N LEU A 44 0.099 -4.834 -7.886 1.00 0.00 N ATOM 597 CA LEU A 44 -0.700 -4.388 -6.752 1.00 0.00 C ATOM 598 C LEU A 44 -2.175 -4.712 -6.964 1.00 0.00 C ATOM 599 O LEU A 44 -2.590 -5.051 -8.074 1.00 0.00 O ATOM 600 CB LEU A 44 -0.517 -2.885 -6.532 1.00 0.00 C ATOM 601 CG LEU A 44 0.639 -2.508 -5.601 1.00 0.00 C ATOM 602 CD1 LEU A 44 1.380 -1.286 -6.128 1.00 0.00 C ATOM 603 CD2 LEU A 44 0.124 -2.257 -4.191 1.00 0.00 C ATOM 0 H LEU A 44 0.104 -4.190 -8.677 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.357 -4.920 -5.865 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -0.357 -2.407 -7.499 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -1.442 -2.477 -6.124 1.00 0.00 H new ATOM 0 HG LEU A 44 1.341 -3.342 -5.569 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.197 -1.036 -5.451 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.782 -1.503 -7.118 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.692 -0.443 -6.193 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.958 -1.990 -3.541 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.599 -1.441 -4.207 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.356 -3.160 -3.813 1.00 0.00 H new ATOM 615 N CYS A 45 -2.963 -4.612 -5.898 1.00 0.00 N ATOM 616 CA CYS A 45 -4.392 -4.903 -5.980 1.00 0.00 C ATOM 617 C CYS A 45 -5.197 -3.988 -5.064 1.00 0.00 C ATOM 618 O CYS A 45 -4.647 -3.349 -4.169 1.00 0.00 O ATOM 619 CB CYS A 45 -4.655 -6.364 -5.619 1.00 0.00 C ATOM 620 SG CYS A 45 -4.334 -7.533 -6.979 1.00 0.00 S ATOM 0 H CYS A 45 -2.640 -4.333 -4.972 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.712 -4.723 -7.006 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -4.032 -6.635 -4.766 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.693 -6.468 -5.302 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.341 -8.309 -6.659 1.00 0.00 H new ATOM 625 N VAL A 46 -6.507 -3.933 -5.296 1.00 0.00 N ATOM 626 CA VAL A 46 -7.391 -3.099 -4.491 1.00 0.00 C ATOM 627 C VAL A 46 -8.703 -3.817 -4.189 1.00 0.00 C ATOM 628 O VAL A 46 -9.037 -4.814 -4.829 1.00 0.00 O ATOM 629 CB VAL A 46 -7.700 -1.762 -5.194 1.00 0.00 C ATOM 630 CG1 VAL A 46 -6.425 -0.960 -5.412 1.00 0.00 C ATOM 631 CG2 VAL A 46 -8.419 -2.005 -6.514 1.00 0.00 C ATOM 0 H VAL A 46 -6.977 -4.456 -6.034 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.868 -2.897 -3.557 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.359 -1.180 -4.549 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.667 -0.021 -5.909 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.957 -0.751 -4.450 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.737 -1.533 -6.033 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.629 -1.050 -6.995 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.788 -2.609 -7.166 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -9.356 -2.530 -6.327 1.00 0.00 H new ATOM 641 N SER A 47 -9.443 -3.302 -3.213 1.00 0.00 N ATOM 642 CA SER A 47 -10.721 -3.893 -2.828 1.00 0.00 C ATOM 643 C SER A 47 -11.794 -2.818 -2.690 1.00 0.00 C ATOM 644 O SER A 47 -11.986 -2.251 -1.615 1.00 0.00 O ATOM 645 CB SER A 47 -10.579 -4.659 -1.512 1.00 0.00 C ATOM 646 OG SER A 47 -10.141 -5.987 -1.740 1.00 0.00 O ATOM 0 H SER A 47 -9.181 -2.477 -2.674 1.00 0.00 H new ATOM 0 HA SER A 47 -11.023 -4.587 -3.612 1.00 0.00 H new ATOM 0 HB2 SER A 47 -9.870 -4.145 -0.863 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.536 -4.673 -0.990 1.00 0.00 H new ATOM 0 HG SER A 47 -10.409 -6.270 -2.639 1.00 0.00 H new ATOM 652 N ASP A 48 -12.492 -2.542 -3.788 1.00 0.00 N ATOM 653 CA ASP A 48 -13.547 -1.535 -3.788 1.00 0.00 C ATOM 654 C ASP A 48 -14.250 -1.486 -5.141 1.00 0.00 C ATOM 655 O ASP A 48 -13.673 -1.847 -6.166 1.00 0.00 O ATOM 656 CB ASP A 48 -12.966 -0.160 -3.448 1.00 0.00 C ATOM 657 CG ASP A 48 -13.600 0.447 -2.211 1.00 0.00 C ATOM 658 OD1 ASP A 48 -13.701 -0.263 -1.188 1.00 0.00 O ATOM 659 OD2 ASP A 48 -13.995 1.629 -2.265 1.00 0.00 O ATOM 0 H ASP A 48 -12.346 -3.001 -4.687 1.00 0.00 H new ATOM 0 HA ASP A 48 -14.280 -1.809 -3.029 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -11.891 -0.251 -3.294 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -13.111 0.512 -4.294 1.00 0.00 H new ATOM 664 N ARG A 49 -15.501 -1.038 -5.135 1.00 0.00 N ATOM 665 CA ARG A 49 -16.285 -0.941 -6.361 1.00 0.00 C ATOM 666 C ARG A 49 -16.284 0.487 -6.896 1.00 0.00 C ATOM 667 O ARG A 49 -16.108 0.710 -8.095 1.00 0.00 O ATOM 668 CB ARG A 49 -17.721 -1.404 -6.110 1.00 0.00 C ATOM 669 CG ARG A 49 -17.902 -2.909 -6.208 1.00 0.00 C ATOM 670 CD ARG A 49 -19.353 -3.310 -5.991 1.00 0.00 C ATOM 671 NE ARG A 49 -19.468 -4.611 -5.336 1.00 0.00 N ATOM 672 CZ ARG A 49 -19.052 -4.855 -4.094 1.00 0.00 C ATOM 673 NH1 ARG A 49 -18.494 -3.891 -3.373 1.00 0.00 N ATOM 674 NH2 ARG A 49 -19.195 -6.066 -3.574 1.00 0.00 N ATOM 0 H ARG A 49 -15.994 -0.736 -4.295 1.00 0.00 H new ATOM 0 HA ARG A 49 -15.827 -1.589 -7.108 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -18.032 -1.073 -5.119 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -18.381 -0.920 -6.830 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -17.571 -3.254 -7.188 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -17.272 -3.402 -5.467 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -19.852 -2.553 -5.385 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -19.868 -3.340 -6.951 1.00 0.00 H new ATOM 0 HE ARG A 49 -19.891 -5.377 -5.860 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -18.382 -2.958 -3.769 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -18.177 -4.083 -2.423 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -19.623 -6.810 -4.125 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -18.877 -6.254 -2.623 1.00 0.00 H new ATOM 688 N ASP A 50 -16.481 1.449 -6.003 1.00 0.00 N ATOM 689 CA ASP A 50 -16.503 2.856 -6.385 1.00 0.00 C ATOM 690 C ASP A 50 -15.148 3.511 -6.133 1.00 0.00 C ATOM 691 O ASP A 50 -14.999 4.324 -5.221 1.00 0.00 O ATOM 692 CB ASP A 50 -17.595 3.599 -5.615 1.00 0.00 C ATOM 693 CG ASP A 50 -18.221 4.715 -6.428 1.00 0.00 C ATOM 694 OD1 ASP A 50 -17.560 5.208 -7.367 1.00 0.00 O ATOM 695 OD2 ASP A 50 -19.372 5.096 -6.128 1.00 0.00 O ATOM 0 H ASP A 50 -16.628 1.280 -5.008 1.00 0.00 H new ATOM 0 HA ASP A 50 -16.719 2.913 -7.452 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -18.370 2.893 -5.317 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -17.172 4.014 -4.700 1.00 0.00 H new ATOM 700 N VAL A 51 -14.162 3.151 -6.949 1.00 0.00 N ATOM 701 CA VAL A 51 -12.820 3.702 -6.813 1.00 0.00 C ATOM 702 C VAL A 51 -12.177 3.925 -8.179 1.00 0.00 C ATOM 703 O VAL A 51 -11.615 4.987 -8.446 1.00 0.00 O ATOM 704 CB VAL A 51 -11.913 2.780 -5.977 1.00 0.00 C ATOM 705 CG1 VAL A 51 -12.265 2.880 -4.500 1.00 0.00 C ATOM 706 CG2 VAL A 51 -12.022 1.343 -6.461 1.00 0.00 C ATOM 0 H VAL A 51 -14.268 2.481 -7.710 1.00 0.00 H new ATOM 0 HA VAL A 51 -12.923 4.658 -6.300 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.880 3.105 -6.104 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -11.614 2.222 -3.925 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -12.131 3.908 -4.163 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -13.303 2.582 -4.352 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -11.374 0.706 -5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -13.054 1.004 -6.366 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -11.716 1.287 -7.506 1.00 0.00 H new ATOM 716 N LEU A 52 -12.264 2.916 -9.040 1.00 0.00 N ATOM 717 CA LEU A 52 -11.693 3.002 -10.378 1.00 0.00 C ATOM 718 C LEU A 52 -12.745 2.694 -11.443 1.00 0.00 C ATOM 719 O LEU A 52 -12.540 1.836 -12.301 1.00 0.00 O ATOM 720 CB LEU A 52 -10.513 2.036 -10.512 1.00 0.00 C ATOM 721 CG LEU A 52 -9.174 2.575 -10.007 1.00 0.00 C ATOM 722 CD1 LEU A 52 -9.297 3.042 -8.565 1.00 0.00 C ATOM 723 CD2 LEU A 52 -8.091 1.515 -10.138 1.00 0.00 C ATOM 0 H LEU A 52 -12.725 2.030 -8.834 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.339 4.022 -10.531 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.748 1.122 -9.967 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.405 1.762 -11.562 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.892 3.431 -10.620 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.335 3.422 -8.222 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.044 3.834 -8.501 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -9.601 2.205 -7.936 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -7.145 1.915 -9.774 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -8.365 0.640 -9.549 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.986 1.230 -11.185 1.00 0.00 H new ATOM 735 N PRO A 53 -13.890 3.396 -11.401 1.00 0.00 N ATOM 736 CA PRO A 53 -14.975 3.194 -12.365 1.00 0.00 C ATOM 737 C PRO A 53 -14.656 3.794 -13.730 1.00 0.00 C ATOM 738 O PRO A 53 -14.169 4.922 -13.825 1.00 0.00 O ATOM 739 CB PRO A 53 -16.154 3.923 -11.722 1.00 0.00 C ATOM 740 CG PRO A 53 -15.528 4.999 -10.904 1.00 0.00 C ATOM 741 CD PRO A 53 -14.219 4.441 -10.411 1.00 0.00 C ATOM 0 HA PRO A 53 -15.162 2.137 -12.557 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -16.823 4.337 -12.476 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -16.748 3.249 -11.104 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -15.369 5.898 -11.499 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -16.171 5.279 -10.070 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -13.447 5.209 -10.368 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.313 4.027 -9.407 1.00 0.00 H new ATOM 749 N GLY A 54 -14.933 3.036 -14.786 1.00 0.00 N ATOM 750 CA GLY A 54 -14.669 3.513 -16.131 1.00 0.00 C ATOM 751 C GLY A 54 -14.076 2.439 -17.022 1.00 0.00 C ATOM 752 O GLY A 54 -14.704 2.009 -17.990 1.00 0.00 O ATOM 0 H GLY A 54 -15.335 2.100 -14.734 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -15.597 3.876 -16.573 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.985 4.361 -16.085 1.00 0.00 H new ATOM 756 N THR A 55 -12.863 2.005 -16.697 1.00 0.00 N ATOM 757 CA THR A 55 -12.184 0.976 -17.476 1.00 0.00 C ATOM 758 C THR A 55 -11.640 -0.124 -16.570 1.00 0.00 C ATOM 759 O THR A 55 -11.526 0.057 -15.357 1.00 0.00 O ATOM 760 CB THR A 55 -11.045 1.590 -18.291 1.00 0.00 C ATOM 761 OG1 THR A 55 -10.246 0.578 -18.878 1.00 0.00 O ATOM 762 CG2 THR A 55 -10.133 2.477 -17.471 1.00 0.00 C ATOM 0 H THR A 55 -12.330 2.350 -15.899 1.00 0.00 H new ATOM 0 HA THR A 55 -12.912 0.534 -18.157 1.00 0.00 H new ATOM 0 HB THR A 55 -11.531 2.201 -19.052 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.524 0.991 -19.396 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.347 2.880 -18.110 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.710 3.297 -17.044 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.684 1.893 -16.668 1.00 0.00 H new ATOM 770 N CYS A 56 -11.304 -1.263 -17.166 1.00 0.00 N ATOM 771 CA CYS A 56 -10.771 -2.392 -16.411 1.00 0.00 C ATOM 772 C CYS A 56 -9.466 -2.013 -15.717 1.00 0.00 C ATOM 773 O CYS A 56 -8.625 -1.322 -16.290 1.00 0.00 O ATOM 774 CB CYS A 56 -10.540 -3.587 -17.338 1.00 0.00 C ATOM 775 SG CYS A 56 -11.960 -4.697 -17.477 1.00 0.00 S ATOM 0 H CYS A 56 -11.391 -1.429 -18.169 1.00 0.00 H new ATOM 0 HA CYS A 56 -11.501 -2.667 -15.650 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -10.282 -3.219 -18.331 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -9.683 -4.154 -16.975 1.00 0.00 H new ATOM 0 HG CYS A 56 -11.669 -5.675 -18.283 1.00 0.00 H new ATOM 781 N VAL A 57 -9.308 -2.468 -14.479 1.00 0.00 N ATOM 782 CA VAL A 57 -8.107 -2.177 -13.706 1.00 0.00 C ATOM 783 C VAL A 57 -7.745 -3.342 -12.792 1.00 0.00 C ATOM 784 O VAL A 57 -8.422 -4.371 -12.782 1.00 0.00 O ATOM 785 CB VAL A 57 -8.285 -0.907 -12.853 1.00 0.00 C ATOM 786 CG1 VAL A 57 -8.367 0.326 -13.739 1.00 0.00 C ATOM 787 CG2 VAL A 57 -9.520 -1.023 -11.973 1.00 0.00 C ATOM 0 H VAL A 57 -9.997 -3.040 -13.990 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.301 -2.017 -14.422 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.414 -0.803 -12.206 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.493 1.213 -13.118 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.450 0.418 -14.321 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.217 0.233 -14.414 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.629 -0.116 -11.378 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.402 -1.154 -12.600 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.415 -1.882 -11.310 1.00 0.00 H new ATOM 797 N TRP A 58 -6.674 -3.174 -12.024 1.00 0.00 N ATOM 798 CA TRP A 58 -6.221 -4.210 -11.103 1.00 0.00 C ATOM 799 C TRP A 58 -7.027 -4.171 -9.808 1.00 0.00 C ATOM 800 O TRP A 58 -6.981 -3.190 -9.068 1.00 0.00 O ATOM 801 CB TRP A 58 -4.731 -4.028 -10.801 1.00 0.00 C ATOM 802 CG TRP A 58 -3.909 -5.238 -11.117 1.00 0.00 C ATOM 803 CD1 TRP A 58 -4.165 -6.522 -10.736 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.696 -5.277 -11.877 1.00 0.00 C ATOM 805 NE1 TRP A 58 -3.185 -7.360 -11.212 1.00 0.00 N ATOM 806 CE2 TRP A 58 -2.272 -6.619 -11.916 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.928 -4.309 -12.530 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -1.114 -7.014 -12.582 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.780 -4.703 -13.191 1.00 0.00 C ATOM 810 CH2 TRP A 58 -0.383 -6.046 -13.212 1.00 0.00 C ATOM 0 H TRP A 58 -6.103 -2.329 -12.021 1.00 0.00 H new ATOM 0 HA TRP A 58 -6.374 -5.181 -11.574 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -4.353 -3.181 -11.373 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -4.609 -3.780 -9.747 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -5.014 -6.835 -10.146 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -3.144 -8.369 -11.065 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -2.226 -3.271 -12.518 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.805 -8.049 -12.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -0.179 -3.963 -13.700 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.519 -6.322 -13.737 1.00 0.00 H new ATOM 821 N SER A 59 -7.762 -5.246 -9.542 1.00 0.00 N ATOM 822 CA SER A 59 -8.578 -5.334 -8.336 1.00 0.00 C ATOM 823 C SER A 59 -8.478 -6.722 -7.713 1.00 0.00 C ATOM 824 O SER A 59 -8.000 -7.664 -8.345 1.00 0.00 O ATOM 825 CB SER A 59 -10.037 -5.006 -8.658 1.00 0.00 C ATOM 826 OG SER A 59 -10.512 -3.944 -7.849 1.00 0.00 O ATOM 0 H SER A 59 -7.809 -6.068 -10.145 1.00 0.00 H new ATOM 0 HA SER A 59 -8.202 -4.607 -7.617 1.00 0.00 H new ATOM 0 HB2 SER A 59 -10.128 -4.735 -9.710 1.00 0.00 H new ATOM 0 HB3 SER A 59 -10.655 -5.890 -8.502 1.00 0.00 H new ATOM 0 HG SER A 59 -11.446 -3.753 -8.076 1.00 0.00 H new ATOM 832 N ILE A 60 -8.930 -6.842 -6.469 1.00 0.00 N ATOM 833 CA ILE A 60 -8.888 -8.116 -5.762 1.00 0.00 C ATOM 834 C ILE A 60 -9.786 -8.095 -4.528 1.00 0.00 C ATOM 835 O ILE A 60 -10.092 -7.030 -3.990 1.00 0.00 O ATOM 836 CB ILE A 60 -7.444 -8.475 -5.336 1.00 0.00 C ATOM 837 CG1 ILE A 60 -7.229 -9.991 -5.401 1.00 0.00 C ATOM 838 CG2 ILE A 60 -7.140 -7.945 -3.936 1.00 0.00 C ATOM 839 CD1 ILE A 60 -6.046 -10.478 -4.590 1.00 0.00 C ATOM 0 H ILE A 60 -9.329 -6.073 -5.931 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.253 -8.874 -6.454 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.754 -7.998 -6.032 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -8.130 -10.491 -5.047 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -7.089 -10.284 -6.442 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.119 -8.210 -3.660 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -7.248 -6.860 -3.926 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.835 -8.385 -3.221 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.960 -11.560 -4.686 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -5.134 -10.007 -4.957 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.192 -10.218 -3.542 1.00 0.00 H new ATOM 851 N ALA A 61 -10.186 -9.275 -4.074 1.00 0.00 N ATOM 852 CA ALA A 61 -11.025 -9.392 -2.893 1.00 0.00 C ATOM 853 C ALA A 61 -10.200 -9.139 -1.636 1.00 0.00 C ATOM 854 O ALA A 61 -9.052 -9.574 -1.540 1.00 0.00 O ATOM 855 CB ALA A 61 -11.678 -10.767 -2.841 1.00 0.00 C ATOM 0 H ALA A 61 -9.942 -10.165 -4.508 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.814 -8.641 -2.946 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.303 -10.839 -1.951 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -12.293 -10.912 -3.729 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.906 -11.535 -2.805 1.00 0.00 H new ATOM 861 N SER A 62 -10.782 -8.428 -0.679 1.00 0.00 N ATOM 862 CA SER A 62 -10.088 -8.110 0.565 1.00 0.00 C ATOM 863 C SER A 62 -9.714 -9.371 1.342 1.00 0.00 C ATOM 864 O SER A 62 -8.891 -9.320 2.257 1.00 0.00 O ATOM 865 CB SER A 62 -10.955 -7.200 1.437 1.00 0.00 C ATOM 866 OG SER A 62 -10.160 -6.271 2.154 1.00 0.00 O ATOM 0 H SER A 62 -11.732 -8.060 -0.739 1.00 0.00 H new ATOM 0 HA SER A 62 -9.166 -7.591 0.303 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.670 -6.665 0.811 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.533 -7.804 2.136 1.00 0.00 H new ATOM 0 HG SER A 62 -10.738 -5.700 2.702 1.00 0.00 H new ATOM 872 N GLU A 63 -10.317 -10.500 0.982 1.00 0.00 N ATOM 873 CA GLU A 63 -10.035 -11.761 1.659 1.00 0.00 C ATOM 874 C GLU A 63 -8.818 -12.456 1.052 1.00 0.00 C ATOM 875 O GLU A 63 -8.243 -13.358 1.663 1.00 0.00 O ATOM 876 CB GLU A 63 -11.253 -12.686 1.592 1.00 0.00 C ATOM 877 CG GLU A 63 -11.900 -12.748 0.218 1.00 0.00 C ATOM 878 CD GLU A 63 -12.613 -14.063 -0.032 1.00 0.00 C ATOM 879 OE1 GLU A 63 -13.057 -14.694 0.951 1.00 0.00 O ATOM 880 OE2 GLU A 63 -12.728 -14.462 -1.208 1.00 0.00 O ATOM 0 H GLU A 63 -11.001 -10.568 0.229 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.814 -11.536 2.702 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.951 -13.691 1.887 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.994 -12.350 2.317 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.612 -11.928 0.118 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.136 -12.602 -0.546 1.00 0.00 H new ATOM 887 N LEU A 64 -8.430 -12.041 -0.152 1.00 0.00 N ATOM 888 CA LEU A 64 -7.290 -12.631 -0.829 1.00 0.00 C ATOM 889 C LEU A 64 -6.010 -11.840 -0.564 1.00 0.00 C ATOM 890 O LEU A 64 -4.941 -12.195 -1.059 1.00 0.00 O ATOM 891 CB LEU A 64 -7.552 -12.698 -2.332 1.00 0.00 C ATOM 892 CG LEU A 64 -9.022 -12.788 -2.734 1.00 0.00 C ATOM 893 CD1 LEU A 64 -9.159 -12.921 -4.244 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.694 -13.957 -2.033 1.00 0.00 C ATOM 0 H LEU A 64 -8.892 -11.297 -0.675 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.153 -13.638 -0.435 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.118 -11.814 -2.800 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.028 -13.563 -2.737 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.519 -11.868 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.214 -12.984 -4.509 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.714 -12.051 -4.728 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.647 -13.823 -4.578 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.741 -14.007 -2.331 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.193 -14.884 -2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.630 -13.820 -0.954 1.00 0.00 H new ATOM 906 N ILE A 65 -6.121 -10.765 0.210 1.00 0.00 N ATOM 907 CA ILE A 65 -4.970 -9.931 0.524 1.00 0.00 C ATOM 908 C ILE A 65 -4.001 -10.651 1.456 1.00 0.00 C ATOM 909 O ILE A 65 -2.857 -10.921 1.091 1.00 0.00 O ATOM 910 CB ILE A 65 -5.400 -8.602 1.176 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.501 -7.935 0.349 1.00 0.00 C ATOM 912 CG2 ILE A 65 -4.203 -7.673 1.325 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.964 -6.612 0.917 1.00 0.00 C ATOM 0 H ILE A 65 -6.996 -10.452 0.630 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.469 -9.720 -0.421 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.796 -8.813 2.169 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -6.137 -7.778 -0.666 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.354 -8.611 0.281 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.523 -6.739 1.787 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.449 -8.149 1.952 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.779 -7.465 0.343 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.745 -6.196 0.280 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.358 -6.765 1.922 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.123 -5.920 0.959 1.00 0.00 H new ATOM 925 N GLU A 66 -4.465 -10.953 2.662 1.00 0.00 N ATOM 926 CA GLU A 66 -3.644 -11.632 3.652 1.00 0.00 C ATOM 927 C GLU A 66 -3.174 -12.998 3.152 1.00 0.00 C ATOM 928 O GLU A 66 -2.213 -13.559 3.677 1.00 0.00 O ATOM 929 CB GLU A 66 -4.431 -11.796 4.952 1.00 0.00 C ATOM 930 CG GLU A 66 -5.631 -12.722 4.823 1.00 0.00 C ATOM 931 CD GLU A 66 -6.578 -12.614 6.002 1.00 0.00 C ATOM 932 OE1 GLU A 66 -7.056 -11.493 6.279 1.00 0.00 O ATOM 933 OE2 GLU A 66 -6.842 -13.649 6.649 1.00 0.00 O ATOM 0 H GLU A 66 -5.410 -10.736 2.978 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.760 -11.020 3.832 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.765 -12.182 5.724 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.772 -10.816 5.287 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.170 -12.487 3.905 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.283 -13.751 4.733 1.00 0.00 H new ATOM 940 N LYS A 67 -3.859 -13.533 2.145 1.00 0.00 N ATOM 941 CA LYS A 67 -3.506 -14.837 1.594 1.00 0.00 C ATOM 942 C LYS A 67 -2.625 -14.701 0.355 1.00 0.00 C ATOM 943 O LYS A 67 -1.525 -15.249 0.302 1.00 0.00 O ATOM 944 CB LYS A 67 -4.771 -15.624 1.250 1.00 0.00 C ATOM 945 CG LYS A 67 -5.677 -15.872 2.445 1.00 0.00 C ATOM 946 CD LYS A 67 -5.528 -17.289 2.974 1.00 0.00 C ATOM 947 CE LYS A 67 -6.065 -18.315 1.989 1.00 0.00 C ATOM 948 NZ LYS A 67 -5.014 -19.278 1.561 1.00 0.00 N ATOM 0 H LYS A 67 -4.658 -13.086 1.696 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.939 -15.376 2.353 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.330 -15.082 0.487 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.486 -16.582 0.816 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.440 -15.161 3.236 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.714 -15.697 2.159 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -4.477 -17.494 3.176 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.058 -17.382 3.922 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.891 -18.859 2.446 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.466 -17.803 1.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -5.421 -19.960 0.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -4.237 -18.762 1.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -4.649 -19.785 2.392 1.00 0.00 H new ATOM 962 N ARG A 68 -3.121 -13.979 -0.647 1.00 0.00 N ATOM 963 CA ARG A 68 -2.377 -13.786 -1.888 1.00 0.00 C ATOM 964 C ARG A 68 -1.360 -12.657 -1.760 1.00 0.00 C ATOM 965 O ARG A 68 -0.154 -12.882 -1.874 1.00 0.00 O ATOM 966 CB ARG A 68 -3.338 -13.495 -3.042 1.00 0.00 C ATOM 967 CG ARG A 68 -4.494 -14.478 -3.131 1.00 0.00 C ATOM 968 CD ARG A 68 -5.156 -14.441 -4.500 1.00 0.00 C ATOM 969 NE ARG A 68 -5.360 -15.782 -5.044 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.159 -16.693 -4.492 1.00 0.00 C ATOM 971 NH1 ARG A 68 -6.837 -16.411 -3.386 1.00 0.00 N ATOM 972 NH2 ARG A 68 -6.282 -17.890 -5.050 1.00 0.00 N ATOM 0 H ARG A 68 -4.031 -13.520 -0.624 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.833 -14.708 -2.095 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.737 -12.487 -2.927 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.783 -13.513 -3.980 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -4.132 -15.486 -2.928 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.231 -14.244 -2.363 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -6.116 -13.930 -4.425 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.539 -13.861 -5.186 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.861 -16.035 -5.897 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.748 -15.492 -2.954 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -7.447 -17.114 -2.969 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.765 -18.112 -5.901 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -6.894 -18.589 -4.628 1.00 0.00 H new ATOM 986 N CYS A 69 -1.847 -11.442 -1.527 1.00 0.00 N ATOM 987 CA CYS A 69 -0.971 -10.283 -1.390 1.00 0.00 C ATOM 988 C CYS A 69 0.064 -10.508 -0.292 1.00 0.00 C ATOM 989 O CYS A 69 -0.266 -10.965 0.803 1.00 0.00 O ATOM 990 CB CYS A 69 -1.791 -9.027 -1.088 1.00 0.00 C ATOM 991 SG CYS A 69 -3.006 -8.615 -2.363 1.00 0.00 S ATOM 0 H CYS A 69 -2.841 -11.235 -1.429 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.446 -10.144 -2.335 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.309 -9.163 -0.138 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -1.112 -8.184 -0.962 1.00 0.00 H new ATOM 0 HG CYS A 69 -2.632 -7.537 -2.986 1.00 0.00 H new ATOM 997 N ARG A 70 1.319 -10.193 -0.596 1.00 0.00 N ATOM 998 CA ARG A 70 2.405 -10.368 0.362 1.00 0.00 C ATOM 999 C ARG A 70 2.624 -9.101 1.186 1.00 0.00 C ATOM 1000 O ARG A 70 2.798 -9.165 2.403 1.00 0.00 O ATOM 1001 CB ARG A 70 3.695 -10.753 -0.366 1.00 0.00 C ATOM 1002 CG ARG A 70 4.118 -12.195 -0.131 1.00 0.00 C ATOM 1003 CD ARG A 70 5.567 -12.286 0.323 1.00 0.00 C ATOM 1004 NE ARG A 70 5.841 -13.535 1.029 1.00 0.00 N ATOM 1005 CZ ARG A 70 7.064 -14.027 1.220 1.00 0.00 C ATOM 1006 NH1 ARG A 70 8.126 -13.378 0.759 1.00 0.00 N ATOM 1007 NH2 ARG A 70 7.224 -15.169 1.874 1.00 0.00 N ATOM 0 H ARG A 70 1.609 -9.815 -1.498 1.00 0.00 H new ATOM 0 HA ARG A 70 2.127 -11.171 1.044 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.561 -10.592 -1.436 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.497 -10.090 -0.042 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.471 -12.647 0.621 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.987 -12.768 -1.049 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.224 -12.207 -0.543 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.796 -11.443 0.975 1.00 0.00 H new ATOM 0 HE ARG A 70 5.049 -14.062 1.398 1.00 0.00 H new ATOM 0 HH11 ARG A 70 8.008 -12.499 0.256 1.00 0.00 H new ATOM 0 HH12 ARG A 70 9.061 -13.759 0.908 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.411 -15.671 2.231 1.00 0.00 H new ATOM 0 HH22 ARG A 70 8.160 -15.546 2.020 1.00 0.00 H new ATOM 1021 N ARG A 71 2.619 -7.952 0.518 1.00 0.00 N ATOM 1022 CA ARG A 71 2.821 -6.675 1.198 1.00 0.00 C ATOM 1023 C ARG A 71 1.626 -5.748 0.996 1.00 0.00 C ATOM 1024 O ARG A 71 0.727 -6.033 0.202 1.00 0.00 O ATOM 1025 CB ARG A 71 4.105 -5.993 0.710 1.00 0.00 C ATOM 1026 CG ARG A 71 4.456 -6.296 -0.739 1.00 0.00 C ATOM 1027 CD ARG A 71 5.487 -7.408 -0.841 1.00 0.00 C ATOM 1028 NE ARG A 71 6.773 -7.017 -0.270 1.00 0.00 N ATOM 1029 CZ ARG A 71 7.779 -7.863 -0.061 1.00 0.00 C ATOM 1030 NH1 ARG A 71 7.653 -9.146 -0.376 1.00 0.00 N ATOM 1031 NH2 ARG A 71 8.915 -7.426 0.464 1.00 0.00 N ATOM 0 H ARG A 71 2.478 -7.877 -0.489 1.00 0.00 H new ATOM 0 HA ARG A 71 2.919 -6.882 2.264 1.00 0.00 H new ATOM 0 HB2 ARG A 71 3.999 -4.915 0.829 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.934 -6.304 1.346 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.555 -6.583 -1.280 1.00 0.00 H new ATOM 0 HG3 ARG A 71 4.842 -5.396 -1.217 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.116 -8.294 -0.326 1.00 0.00 H new ATOM 0 HD3 ARG A 71 5.623 -7.681 -1.887 1.00 0.00 H new ATOM 0 HE ARG A 71 6.908 -6.038 -0.017 1.00 0.00 H new ATOM 0 HH11 ARG A 71 6.782 -9.489 -0.781 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.428 -9.789 -0.213 1.00 0.00 H new ATOM 0 HH21 ARG A 71 9.018 -6.441 0.708 1.00 0.00 H new ATOM 0 HH22 ARG A 71 9.686 -8.075 0.624 1.00 0.00 H new ATOM 1045 N MET A 72 1.614 -4.639 1.728 1.00 0.00 N ATOM 1046 CA MET A 72 0.524 -3.678 1.638 1.00 0.00 C ATOM 1047 C MET A 72 1.053 -2.256 1.478 1.00 0.00 C ATOM 1048 O MET A 72 2.149 -1.929 1.938 1.00 0.00 O ATOM 1049 CB MET A 72 -0.358 -3.771 2.884 1.00 0.00 C ATOM 1050 CG MET A 72 -1.648 -4.540 2.657 1.00 0.00 C ATOM 1051 SD MET A 72 -2.372 -5.148 4.192 1.00 0.00 S ATOM 1052 CE MET A 72 -2.306 -6.917 3.920 1.00 0.00 C ATOM 0 H MET A 72 2.347 -4.385 2.390 1.00 0.00 H new ATOM 0 HA MET A 72 -0.069 -3.919 0.756 1.00 0.00 H new ATOM 0 HB2 MET A 72 0.206 -4.251 3.684 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.600 -2.764 3.224 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.367 -3.895 2.151 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.453 -5.382 1.993 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.315 -7.328 3.954 1.00 0.00 H new ATOM 0 HE2 MET A 72 -1.865 -7.119 2.944 1.00 0.00 H new ATOM 0 HE3 MET A 72 -1.698 -7.382 4.696 1.00 0.00 H new ATOM 1062 N VAL A 73 0.259 -1.410 0.832 1.00 0.00 N ATOM 1063 CA VAL A 73 0.631 -0.021 0.619 1.00 0.00 C ATOM 1064 C VAL A 73 -0.465 0.895 1.144 1.00 0.00 C ATOM 1065 O VAL A 73 -1.446 1.166 0.454 1.00 0.00 O ATOM 1066 CB VAL A 73 0.877 0.279 -0.873 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.380 1.700 -1.060 1.00 0.00 C ATOM 1068 CG2 VAL A 73 1.857 -0.723 -1.463 1.00 0.00 C ATOM 0 H VAL A 73 -0.650 -1.666 0.446 1.00 0.00 H new ATOM 0 HA VAL A 73 1.559 0.160 1.161 1.00 0.00 H new ATOM 0 HB VAL A 73 -0.071 0.184 -1.403 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.547 1.890 -2.120 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.639 2.402 -0.678 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.316 1.829 -0.516 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.019 -0.496 -2.517 1.00 0.00 H new ATOM 0 HG22 VAL A 73 2.805 -0.662 -0.929 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.450 -1.730 -1.367 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.297 1.356 2.377 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.280 2.227 3.001 1.00 0.00 C ATOM 1080 C VAL A 74 -0.987 3.690 2.699 1.00 0.00 C ATOM 1081 O VAL A 74 0.162 4.123 2.744 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.328 2.026 4.529 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.616 2.592 5.102 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -1.185 0.550 4.881 1.00 0.00 C ATOM 0 H VAL A 74 0.510 1.141 2.962 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.249 1.959 2.580 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.491 2.565 4.972 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.631 2.441 6.181 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.673 3.658 4.884 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.469 2.083 4.652 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.221 0.429 5.964 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.999 -0.013 4.425 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.232 0.177 4.506 1.00 0.00 H new ATOM 1094 N VAL A 75 -2.034 4.443 2.391 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.889 5.857 2.085 1.00 0.00 C ATOM 1096 C VAL A 75 -2.571 6.709 3.150 1.00 0.00 C ATOM 1097 O VAL A 75 -3.757 7.024 3.043 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.473 6.194 0.697 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.324 7.678 0.388 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.804 5.349 -0.377 1.00 0.00 C ATOM 0 H VAL A 75 -2.993 4.097 2.347 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.823 6.082 2.074 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.538 5.961 0.708 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.743 7.889 -0.596 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.854 8.261 1.141 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.268 7.947 0.397 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.226 5.597 -1.351 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.733 5.550 -0.384 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.973 4.293 -0.167 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.815 7.069 4.184 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.344 7.874 5.280 1.00 0.00 C ATOM 1112 C VAL A 76 -2.539 9.328 4.861 1.00 0.00 C ATOM 1113 O VAL A 76 -1.599 10.122 4.874 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.417 7.819 6.512 1.00 0.00 C ATOM 1115 CG1 VAL A 76 -0.030 8.339 6.167 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -2.017 8.600 7.672 1.00 0.00 C ATOM 0 H VAL A 76 -0.832 6.815 4.285 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.313 7.450 5.543 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.320 6.778 6.820 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.607 8.291 7.050 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.401 7.727 5.375 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.103 9.372 5.828 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.347 8.548 8.530 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.151 9.641 7.379 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.983 8.171 7.939 1.00 0.00 H new ATOM 1126 N SER A 77 -3.768 9.670 4.493 1.00 0.00 N ATOM 1127 CA SER A 77 -4.090 11.029 4.073 1.00 0.00 C ATOM 1128 C SER A 77 -5.310 11.557 4.821 1.00 0.00 C ATOM 1129 O SER A 77 -6.167 10.788 5.255 1.00 0.00 O ATOM 1130 CB SER A 77 -4.340 11.074 2.565 1.00 0.00 C ATOM 1131 OG SER A 77 -3.758 12.228 1.984 1.00 0.00 O ATOM 0 H SER A 77 -4.558 9.025 4.477 1.00 0.00 H new ATOM 0 HA SER A 77 -3.239 11.667 4.311 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.926 10.180 2.098 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.413 11.067 2.371 1.00 0.00 H new ATOM 0 HG SER A 77 -4.301 12.520 1.222 1.00 0.00 H new ATOM 1137 N ASP A 78 -5.379 12.879 4.963 1.00 0.00 N ATOM 1138 CA ASP A 78 -6.491 13.533 5.654 1.00 0.00 C ATOM 1139 C ASP A 78 -7.831 12.918 5.265 1.00 0.00 C ATOM 1140 O ASP A 78 -8.558 12.384 6.103 1.00 0.00 O ATOM 1141 CB ASP A 78 -6.507 15.024 5.311 1.00 0.00 C ATOM 1142 CG ASP A 78 -6.514 15.904 6.540 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -7.614 16.191 7.060 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -5.422 16.309 6.986 1.00 0.00 O ATOM 0 H ASP A 78 -4.673 13.523 4.606 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.345 13.393 6.725 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.634 15.262 4.703 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.387 15.244 4.706 1.00 0.00 H new ATOM 1149 N ASP A 79 -8.149 13.019 3.982 1.00 0.00 N ATOM 1150 CA ASP A 79 -9.403 12.498 3.444 1.00 0.00 C ATOM 1151 C ASP A 79 -9.581 11.007 3.731 1.00 0.00 C ATOM 1152 O ASP A 79 -10.687 10.479 3.606 1.00 0.00 O ATOM 1153 CB ASP A 79 -9.464 12.746 1.937 1.00 0.00 C ATOM 1154 CG ASP A 79 -10.026 14.113 1.598 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -10.716 14.701 2.458 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.774 14.596 0.475 1.00 0.00 O ATOM 0 H ASP A 79 -7.550 13.462 3.285 1.00 0.00 H new ATOM 0 HA ASP A 79 -10.216 13.026 3.942 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -8.463 12.653 1.516 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -10.079 11.977 1.470 1.00 0.00 H new ATOM 1161 N TYR A 80 -8.503 10.327 4.111 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.574 8.902 4.405 1.00 0.00 C ATOM 1163 C TYR A 80 -8.851 8.671 5.885 1.00 0.00 C ATOM 1164 O TYR A 80 -9.484 7.688 6.263 1.00 0.00 O ATOM 1165 CB TYR A 80 -7.271 8.212 3.999 1.00 0.00 C ATOM 1166 CG TYR A 80 -7.220 6.738 4.339 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -8.362 5.949 4.279 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -6.026 6.137 4.719 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -8.316 4.603 4.587 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -5.972 4.791 5.030 1.00 0.00 C ATOM 1171 CZ TYR A 80 -7.119 4.029 4.963 1.00 0.00 C ATOM 1172 OH TYR A 80 -7.071 2.688 5.271 1.00 0.00 O ATOM 0 H TYR A 80 -7.576 10.738 4.222 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.395 8.474 3.829 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -7.129 8.331 2.925 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.438 8.716 4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.301 6.395 3.987 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.126 6.731 4.772 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -9.212 4.003 4.534 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.036 4.339 5.324 1.00 0.00 H new ATOM 0 HH TYR A 80 -7.354 2.163 4.493 1.00 0.00 H new ATOM 1182 N LEU A 81 -8.366 9.586 6.716 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.550 9.490 8.152 1.00 0.00 C ATOM 1184 C LEU A 81 -9.914 10.027 8.567 1.00 0.00 C ATOM 1185 O LEU A 81 -10.500 9.570 9.549 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.440 10.255 8.858 1.00 0.00 C ATOM 1187 CG LEU A 81 -6.042 9.683 8.642 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -4.971 10.742 8.849 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.814 8.521 9.577 1.00 0.00 C ATOM 0 H LEU A 81 -7.840 10.406 6.414 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.505 8.440 8.441 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.453 11.289 8.514 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.651 10.272 9.927 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.972 9.337 7.611 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.987 10.301 8.687 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.124 11.557 8.142 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.033 11.128 9.866 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.814 8.117 9.418 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.909 8.860 10.609 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.554 7.745 9.381 1.00 0.00 H new ATOM 1201 N GLN A 82 -10.417 10.997 7.813 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.712 11.594 8.097 1.00 0.00 C ATOM 1203 C GLN A 82 -12.848 10.609 7.822 1.00 0.00 C ATOM 1204 O GLN A 82 -13.999 10.866 8.175 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.892 12.854 7.251 1.00 0.00 C ATOM 1206 CG GLN A 82 -12.051 12.576 5.764 1.00 0.00 C ATOM 1207 CD GLN A 82 -12.333 13.831 4.962 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -13.240 13.861 4.132 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -11.553 14.880 5.207 1.00 0.00 N ATOM 0 H GLN A 82 -9.944 11.387 6.998 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.746 11.856 9.154 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.768 13.397 7.606 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -11.031 13.506 7.399 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -11.143 12.105 5.387 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -12.864 11.865 5.616 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.812 14.812 5.904 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.696 15.752 4.698 1.00 0.00 H new ATOM 1218 N SER A 83 -12.523 9.484 7.187 1.00 0.00 N ATOM 1219 CA SER A 83 -13.524 8.473 6.866 1.00 0.00 C ATOM 1220 C SER A 83 -13.382 7.250 7.766 1.00 0.00 C ATOM 1221 O SER A 83 -12.366 7.071 8.436 1.00 0.00 O ATOM 1222 CB SER A 83 -13.406 8.059 5.398 1.00 0.00 C ATOM 1223 OG SER A 83 -14.683 7.969 4.789 1.00 0.00 O ATOM 0 H SER A 83 -11.576 9.252 6.886 1.00 0.00 H new ATOM 0 HA SER A 83 -14.508 8.909 7.038 1.00 0.00 H new ATOM 0 HB2 SER A 83 -12.794 8.783 4.861 1.00 0.00 H new ATOM 0 HB3 SER A 83 -12.898 7.097 5.328 1.00 0.00 H new ATOM 0 HG SER A 83 -14.580 7.705 3.851 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.411 6.407 7.773 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.412 5.198 8.582 1.00 0.00 C ATOM 1231 C LYS A 84 -13.504 4.136 7.972 1.00 0.00 C ATOM 1232 O LYS A 84 -12.987 3.268 8.676 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.835 4.659 8.709 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.538 4.475 7.371 1.00 0.00 C ATOM 1235 CD LYS A 84 -17.864 5.222 7.322 1.00 0.00 C ATOM 1236 CE LYS A 84 -17.818 6.383 6.341 1.00 0.00 C ATOM 1237 NZ LYS A 84 -18.322 7.645 6.949 1.00 0.00 N ATOM 0 H LYS A 84 -15.259 6.543 7.223 1.00 0.00 H new ATOM 0 HA LYS A 84 -14.031 5.446 9.573 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -15.807 3.702 9.230 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -16.419 5.341 9.326 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -15.891 4.830 6.569 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -16.712 3.414 7.195 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -18.659 4.534 7.035 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -18.109 5.595 8.316 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.793 6.529 5.999 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -18.415 6.140 5.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -18.274 8.412 6.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -19.308 7.515 7.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -17.736 7.892 7.772 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.307 4.214 6.658 1.00 0.00 N ATOM 1252 CA GLU A 85 -12.454 3.264 5.952 1.00 0.00 C ATOM 1253 C GLU A 85 -11.104 3.135 6.650 1.00 0.00 C ATOM 1254 O GLU A 85 -10.452 2.093 6.576 1.00 0.00 O ATOM 1255 CB GLU A 85 -12.255 3.703 4.501 1.00 0.00 C ATOM 1256 CG GLU A 85 -13.554 3.861 3.728 1.00 0.00 C ATOM 1257 CD GLU A 85 -13.457 3.338 2.309 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -12.322 3.174 1.813 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -14.516 3.097 1.691 1.00 0.00 O ATOM 0 H GLU A 85 -13.727 4.926 6.061 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.945 2.291 5.961 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -11.717 4.651 4.488 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.626 2.972 3.992 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.350 3.333 4.252 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.832 4.915 3.704 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.699 4.198 7.336 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.438 4.204 8.059 1.00 0.00 C ATOM 1268 C CYS A 86 -9.582 3.437 9.365 1.00 0.00 C ATOM 1269 O CYS A 86 -8.654 2.762 9.806 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.990 5.641 8.341 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.419 6.089 7.569 1.00 0.00 S ATOM 0 H CYS A 86 -11.229 5.067 7.405 1.00 0.00 H new ATOM 0 HA CYS A 86 -8.681 3.718 7.443 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -9.763 6.326 7.992 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -8.905 5.779 9.419 1.00 0.00 H new ATOM 0 HG CYS A 86 -7.424 5.711 6.325 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.759 3.540 9.974 1.00 0.00 N ATOM 1278 CA ASP A 87 -11.028 2.852 11.228 1.00 0.00 C ATOM 1279 C ASP A 87 -10.935 1.345 11.034 1.00 0.00 C ATOM 1280 O ASP A 87 -10.273 0.648 11.803 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.411 3.230 11.761 1.00 0.00 C ATOM 1282 CG ASP A 87 -12.412 4.572 12.466 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.776 4.682 13.534 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -13.048 5.514 11.947 1.00 0.00 O ATOM 0 H ASP A 87 -11.539 4.093 9.619 1.00 0.00 H new ATOM 0 HA ASP A 87 -10.279 3.160 11.957 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -13.121 3.256 10.934 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.754 2.460 12.452 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.588 0.853 9.989 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.565 -0.569 9.681 1.00 0.00 C ATOM 1291 C PHE A 88 -10.146 -0.993 9.325 1.00 0.00 C ATOM 1292 O PHE A 88 -9.645 -2.009 9.812 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.516 -0.878 8.524 1.00 0.00 C ATOM 1294 CG PHE A 88 -12.768 -2.346 8.327 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -13.455 -3.077 9.284 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.316 -2.995 7.190 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -13.689 -4.426 9.109 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -12.548 -4.347 7.010 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.235 -5.064 7.970 1.00 0.00 C ATOM 0 H PHE A 88 -12.139 1.417 9.342 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.896 -1.128 10.557 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.467 -0.376 8.702 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.103 -0.462 7.605 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -13.811 -2.585 10.177 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.777 -2.440 6.436 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -14.227 -4.983 9.862 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.192 -4.842 6.119 1.00 0.00 H new ATOM 0 HZ PHE A 88 -13.417 -6.119 7.831 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.498 -0.193 8.485 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.129 -0.463 8.074 1.00 0.00 C ATOM 1311 C GLN A 89 -7.224 -0.534 9.297 1.00 0.00 C ATOM 1312 O GLN A 89 -6.381 -1.420 9.407 1.00 0.00 O ATOM 1313 CB GLN A 89 -7.640 0.622 7.114 1.00 0.00 C ATOM 1314 CG GLN A 89 -6.231 0.389 6.599 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.197 1.209 7.343 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -5.369 2.412 7.544 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -4.117 0.562 7.755 1.00 0.00 N ATOM 0 H GLN A 89 -9.902 0.649 8.076 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.098 -1.422 7.557 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.323 0.680 6.266 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.678 1.587 7.620 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.985 -0.669 6.690 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.190 0.635 5.538 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -4.017 -0.435 7.566 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -3.386 1.061 8.261 1.00 0.00 H new ATOM 1326 N THR A 90 -7.423 0.403 10.222 1.00 0.00 N ATOM 1327 CA THR A 90 -6.645 0.451 11.452 1.00 0.00 C ATOM 1328 C THR A 90 -6.722 -0.860 12.193 1.00 0.00 C ATOM 1329 O THR A 90 -5.714 -1.532 12.360 1.00 0.00 O ATOM 1330 CB THR A 90 -7.134 1.595 12.344 1.00 0.00 C ATOM 1331 OG1 THR A 90 -7.092 2.827 11.648 1.00 0.00 O ATOM 1332 CG2 THR A 90 -6.321 1.762 13.608 1.00 0.00 C ATOM 0 H THR A 90 -8.121 1.142 10.139 1.00 0.00 H new ATOM 0 HA THR A 90 -5.603 0.630 11.188 1.00 0.00 H new ATOM 0 HB THR A 90 -8.154 1.326 12.618 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.919 2.941 11.135 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.723 2.590 14.192 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.370 0.845 14.196 1.00 0.00 H new ATOM 0 HG23 THR A 90 -5.283 1.971 13.348 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.912 -1.226 12.633 1.00 0.00 N ATOM 1341 CA LYS A 91 -8.087 -2.468 13.365 1.00 0.00 C ATOM 1342 C LYS A 91 -7.445 -3.637 12.629 1.00 0.00 C ATOM 1343 O LYS A 91 -7.032 -4.619 13.248 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.572 -2.742 13.609 1.00 0.00 C ATOM 1345 CG LYS A 91 -10.084 -2.192 14.931 1.00 0.00 C ATOM 1346 CD LYS A 91 -10.617 -0.777 14.776 1.00 0.00 C ATOM 1347 CE LYS A 91 -10.304 0.075 15.996 1.00 0.00 C ATOM 1348 NZ LYS A 91 -9.792 1.421 15.617 1.00 0.00 N ATOM 0 H LYS A 91 -8.766 -0.686 12.498 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.588 -2.362 14.328 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.152 -2.306 12.795 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.743 -3.818 13.582 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.873 -2.839 15.315 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.279 -2.200 15.666 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.180 -0.318 13.889 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.695 -0.809 14.620 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.203 0.186 16.602 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.564 -0.434 16.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.591 1.971 16.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -8.920 1.317 15.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.508 1.917 15.049 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.349 -3.525 11.310 1.00 0.00 N ATOM 1363 CA PHE A 92 -6.741 -4.574 10.509 1.00 0.00 C ATOM 1364 C PHE A 92 -5.244 -4.325 10.335 1.00 0.00 C ATOM 1365 O PHE A 92 -4.478 -5.254 10.076 1.00 0.00 O ATOM 1366 CB PHE A 92 -7.424 -4.665 9.141 1.00 0.00 C ATOM 1367 CG PHE A 92 -7.696 -6.074 8.698 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -8.829 -6.744 9.132 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -6.818 -6.729 7.849 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -9.081 -8.040 8.724 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -7.066 -8.025 7.439 1.00 0.00 C ATOM 1372 CZ PHE A 92 -8.199 -8.682 7.878 1.00 0.00 C ATOM 0 H PHE A 92 -7.683 -2.722 10.777 1.00 0.00 H new ATOM 0 HA PHE A 92 -6.874 -5.521 11.032 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -8.365 -4.116 9.177 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.796 -4.174 8.397 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -9.522 -6.248 9.796 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.930 -6.221 7.504 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.968 -8.551 9.067 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.375 -8.524 6.776 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.394 -9.696 7.560 1.00 0.00 H new ATOM 1382 N ALA A 93 -4.835 -3.070 10.485 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.431 -2.702 10.349 1.00 0.00 C ATOM 1384 C ALA A 93 -2.715 -2.759 11.693 1.00 0.00 C ATOM 1385 O ALA A 93 -1.514 -3.014 11.760 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.304 -1.317 9.740 1.00 0.00 C ATOM 0 H ALA A 93 -5.456 -2.290 10.701 1.00 0.00 H new ATOM 0 HA ALA A 93 -2.956 -3.423 9.684 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.250 -1.057 9.645 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.770 -1.309 8.755 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.801 -0.590 10.383 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.463 -2.527 12.762 1.00 0.00 N ATOM 1393 CA LEU A 94 -2.911 -2.558 14.104 1.00 0.00 C ATOM 1394 C LEU A 94 -2.905 -3.978 14.626 1.00 0.00 C ATOM 1395 O LEU A 94 -1.915 -4.466 15.167 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.743 -1.670 15.021 1.00 0.00 C ATOM 1397 CG LEU A 94 -5.257 -1.913 15.006 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -5.645 -2.998 15.981 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -6.003 -0.625 15.325 1.00 0.00 C ATOM 0 H LEU A 94 -4.460 -2.314 12.723 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.887 -2.187 14.079 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.385 -1.801 16.042 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.560 -0.630 14.750 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.535 -2.244 14.005 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.724 -3.148 15.948 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.141 -3.926 15.712 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.350 -2.704 16.988 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -7.077 -0.813 15.311 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.710 -0.270 16.313 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.757 0.132 14.580 1.00 0.00 H new ATOM 1411 N SER A 95 -4.037 -4.621 14.441 1.00 0.00 N ATOM 1412 CA SER A 95 -4.225 -6.001 14.870 1.00 0.00 C ATOM 1413 C SER A 95 -4.221 -6.944 13.672 1.00 0.00 C ATOM 1414 O SER A 95 -5.149 -7.731 13.483 1.00 0.00 O ATOM 1415 CB SER A 95 -5.538 -6.144 15.645 1.00 0.00 C ATOM 1416 OG SER A 95 -5.437 -5.558 16.931 1.00 0.00 O ATOM 0 H SER A 95 -4.854 -4.209 13.991 1.00 0.00 H new ATOM 0 HA SER A 95 -3.396 -6.269 15.525 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.346 -5.670 15.088 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.794 -7.199 15.742 1.00 0.00 H new ATOM 0 HG SER A 95 -6.288 -5.661 17.405 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.169 -6.862 12.865 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.047 -7.713 11.684 1.00 0.00 C ATOM 1424 C LEU A 96 -2.509 -9.090 12.065 1.00 0.00 C ATOM 1425 O LEU A 96 -3.260 -10.057 12.178 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.142 -7.081 10.612 1.00 0.00 C ATOM 1427 CG LEU A 96 -1.498 -5.741 10.971 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.271 -5.950 11.846 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.128 -4.986 9.707 1.00 0.00 C ATOM 0 H LEU A 96 -2.390 -6.218 13.005 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.047 -7.820 11.263 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.348 -7.789 10.374 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -2.730 -6.945 9.705 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.219 -5.149 11.535 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.171 -4.984 12.089 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.562 -6.458 12.766 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.458 -6.558 11.311 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.670 -4.033 9.973 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.422 -5.577 9.123 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.025 -4.805 9.116 1.00 0.00 H new ATOM 1441 N SER A 97 -1.197 -9.164 12.259 1.00 0.00 N ATOM 1442 CA SER A 97 -0.540 -10.414 12.625 1.00 0.00 C ATOM 1443 C SER A 97 0.577 -10.161 13.636 1.00 0.00 C ATOM 1444 O SER A 97 0.926 -9.013 13.912 1.00 0.00 O ATOM 1445 CB SER A 97 0.022 -11.100 11.378 1.00 0.00 C ATOM 1446 OG SER A 97 -0.729 -12.255 11.048 1.00 0.00 O ATOM 0 H SER A 97 -0.564 -8.369 12.168 1.00 0.00 H new ATOM 0 HA SER A 97 -1.279 -11.069 13.086 1.00 0.00 H new ATOM 0 HB2 SER A 97 0.010 -10.403 10.540 1.00 0.00 H new ATOM 0 HB3 SER A 97 1.063 -11.376 11.549 1.00 0.00 H new ATOM 0 HG SER A 97 -0.350 -12.674 10.247 1.00 0.00 H new ATOM 1452 N PRO A 98 1.153 -11.234 14.207 1.00 0.00 N ATOM 1453 CA PRO A 98 2.232 -11.118 15.193 1.00 0.00 C ATOM 1454 C PRO A 98 3.563 -10.723 14.559 1.00 0.00 C ATOM 1455 O PRO A 98 4.438 -11.564 14.354 1.00 0.00 O ATOM 1456 CB PRO A 98 2.318 -12.526 15.782 1.00 0.00 C ATOM 1457 CG PRO A 98 1.851 -13.416 14.685 1.00 0.00 C ATOM 1458 CD PRO A 98 0.797 -12.641 13.941 1.00 0.00 C ATOM 0 HA PRO A 98 2.030 -10.340 15.930 1.00 0.00 H new ATOM 0 HB2 PRO A 98 3.337 -12.769 16.084 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.691 -12.625 16.668 1.00 0.00 H new ATOM 0 HG2 PRO A 98 2.675 -13.687 14.025 1.00 0.00 H new ATOM 0 HG3 PRO A 98 1.443 -14.345 15.083 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.813 -12.864 12.874 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.204 -12.877 14.301 1.00 0.00 H new ATOM 1466 N GLY A 99 3.710 -9.438 14.254 1.00 0.00 N ATOM 1467 CA GLY A 99 4.939 -8.956 13.651 1.00 0.00 C ATOM 1468 C GLY A 99 4.751 -8.509 12.214 1.00 0.00 C ATOM 1469 O GLY A 99 5.559 -8.836 11.345 1.00 0.00 O ATOM 0 H GLY A 99 3.001 -8.722 14.413 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.325 -8.123 14.239 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.690 -9.745 13.686 1.00 0.00 H new ATOM 1473 N ALA A 100 3.681 -7.763 11.963 1.00 0.00 N ATOM 1474 CA ALA A 100 3.391 -7.273 10.621 1.00 0.00 C ATOM 1475 C ALA A 100 2.745 -5.890 10.665 1.00 0.00 C ATOM 1476 O ALA A 100 1.807 -5.610 9.919 1.00 0.00 O ATOM 1477 CB ALA A 100 2.491 -8.254 9.886 1.00 0.00 C ATOM 0 H ALA A 100 3.001 -7.485 12.670 1.00 0.00 H new ATOM 0 HA ALA A 100 4.334 -7.186 10.082 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.282 -7.876 8.885 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.990 -9.220 9.812 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.555 -8.369 10.433 1.00 0.00 H new ATOM 1483 N HIS A 101 3.252 -5.029 11.541 1.00 0.00 N ATOM 1484 CA HIS A 101 2.722 -3.677 11.674 1.00 0.00 C ATOM 1485 C HIS A 101 3.375 -2.739 10.667 1.00 0.00 C ATOM 1486 O HIS A 101 2.711 -1.895 10.063 1.00 0.00 O ATOM 1487 CB HIS A 101 2.946 -3.155 13.095 1.00 0.00 C ATOM 1488 CG HIS A 101 2.339 -1.808 13.342 1.00 0.00 C ATOM 1489 ND1 HIS A 101 0.980 -1.602 13.437 1.00 0.00 N ATOM 1490 CD2 HIS A 101 2.916 -0.595 13.513 1.00 0.00 C ATOM 1491 CE1 HIS A 101 0.744 -0.321 13.657 1.00 0.00 C ATOM 1492 NE2 HIS A 101 1.903 0.313 13.708 1.00 0.00 N ATOM 0 H HIS A 101 4.028 -5.243 12.168 1.00 0.00 H new ATOM 0 HA HIS A 101 1.651 -3.711 11.473 1.00 0.00 H new ATOM 0 HB2 HIS A 101 2.528 -3.868 13.805 1.00 0.00 H new ATOM 0 HB3 HIS A 101 4.017 -3.103 13.289 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.975 -0.381 13.499 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.230 0.131 13.775 1.00 0.00 H new ATOM 0 HE2 HIS A 101 2.025 1.313 13.866 1.00 0.00 H new ATOM 1501 N GLN A 102 4.680 -2.897 10.488 1.00 0.00 N ATOM 1502 CA GLN A 102 5.433 -2.072 9.550 1.00 0.00 C ATOM 1503 C GLN A 102 6.436 -2.918 8.775 1.00 0.00 C ATOM 1504 O GLN A 102 7.488 -2.430 8.360 1.00 0.00 O ATOM 1505 CB GLN A 102 6.161 -0.952 10.295 1.00 0.00 C ATOM 1506 CG GLN A 102 7.020 -1.445 11.447 1.00 0.00 C ATOM 1507 CD GLN A 102 7.680 -0.313 12.210 1.00 0.00 C ATOM 1508 OE1 GLN A 102 8.618 0.315 11.721 1.00 0.00 O ATOM 1509 NE2 GLN A 102 7.192 -0.049 13.416 1.00 0.00 N ATOM 0 H GLN A 102 5.241 -3.591 10.981 1.00 0.00 H new ATOM 0 HA GLN A 102 4.730 -1.630 8.843 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.790 -0.408 9.591 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.426 -0.244 10.678 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.403 -2.028 12.131 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.789 -2.115 11.061 1.00 0.00 H new ATOM 0 HE21 GLN A 102 6.413 -0.596 13.782 1.00 0.00 H new ATOM 0 HE22 GLN A 102 7.596 0.701 13.977 1.00 0.00 H new ATOM 1518 N LYS A 103 6.105 -4.192 8.587 1.00 0.00 N ATOM 1519 CA LYS A 103 6.976 -5.111 7.867 1.00 0.00 C ATOM 1520 C LYS A 103 6.441 -5.389 6.467 1.00 0.00 C ATOM 1521 O LYS A 103 7.210 -5.583 5.525 1.00 0.00 O ATOM 1522 CB LYS A 103 7.109 -6.424 8.642 1.00 0.00 C ATOM 1523 CG LYS A 103 8.260 -6.433 9.633 1.00 0.00 C ATOM 1524 CD LYS A 103 7.853 -5.828 10.966 1.00 0.00 C ATOM 1525 CE LYS A 103 9.052 -5.261 11.709 1.00 0.00 C ATOM 1526 NZ LYS A 103 8.807 -5.172 13.175 1.00 0.00 N ATOM 0 H LYS A 103 5.238 -4.611 8.924 1.00 0.00 H new ATOM 0 HA LYS A 103 7.957 -4.645 7.773 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.179 -6.616 9.177 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.244 -7.242 7.934 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.601 -7.457 9.786 1.00 0.00 H new ATOM 0 HG3 LYS A 103 9.101 -5.875 9.221 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.120 -5.039 10.800 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.370 -6.588 11.579 1.00 0.00 H new ATOM 0 HE2 LYS A 103 9.923 -5.889 11.524 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.285 -4.270 11.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 9.648 -4.781 13.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 7.991 -4.552 13.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.610 -6.121 13.552 1.00 0.00 H new ATOM 1540 N ARG A 104 5.119 -5.412 6.337 1.00 0.00 N ATOM 1541 CA ARG A 104 4.482 -5.673 5.051 1.00 0.00 C ATOM 1542 C ARG A 104 3.751 -4.435 4.536 1.00 0.00 C ATOM 1543 O ARG A 104 3.799 -4.128 3.346 1.00 0.00 O ATOM 1544 CB ARG A 104 3.505 -6.846 5.162 1.00 0.00 C ATOM 1545 CG ARG A 104 2.841 -6.970 6.526 1.00 0.00 C ATOM 1546 CD ARG A 104 1.519 -7.716 6.439 1.00 0.00 C ATOM 1547 NE ARG A 104 1.612 -9.064 6.997 1.00 0.00 N ATOM 1548 CZ ARG A 104 2.109 -10.108 6.337 1.00 0.00 C ATOM 1549 NH1 ARG A 104 2.557 -9.967 5.095 1.00 0.00 N ATOM 1550 NH2 ARG A 104 2.157 -11.298 6.920 1.00 0.00 N ATOM 0 H ARG A 104 4.468 -5.253 7.106 1.00 0.00 H new ATOM 0 HA ARG A 104 5.267 -5.930 4.339 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.732 -6.735 4.401 1.00 0.00 H new ATOM 0 HB3 ARG A 104 4.038 -7.771 4.943 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.510 -7.492 7.211 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.672 -5.976 6.941 1.00 0.00 H new ATOM 0 HD2 ARG A 104 0.751 -7.155 6.972 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.205 -7.776 5.397 1.00 0.00 H new ATOM 0 HE ARG A 104 1.276 -9.214 7.948 1.00 0.00 H new ATOM 0 HH11 ARG A 104 2.522 -9.054 4.641 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.936 -10.771 4.595 1.00 0.00 H new ATOM 0 HH21 ARG A 104 1.813 -11.413 7.873 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.538 -12.098 6.415 1.00 0.00 H new ATOM 1564 N LEU A 105 3.073 -3.731 5.437 1.00 0.00 N ATOM 1565 CA LEU A 105 2.331 -2.534 5.064 1.00 0.00 C ATOM 1566 C LEU A 105 3.129 -1.274 5.379 1.00 0.00 C ATOM 1567 O LEU A 105 3.677 -1.130 6.472 1.00 0.00 O ATOM 1568 CB LEU A 105 0.983 -2.485 5.786 1.00 0.00 C ATOM 1569 CG LEU A 105 0.964 -3.100 7.187 1.00 0.00 C ATOM 1570 CD1 LEU A 105 -0.016 -2.360 8.081 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.611 -4.576 7.111 1.00 0.00 C ATOM 0 H LEU A 105 3.023 -3.969 6.428 1.00 0.00 H new ATOM 0 HA LEU A 105 2.156 -2.577 3.989 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.668 -1.444 5.861 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.243 -2.999 5.172 1.00 0.00 H new ATOM 0 HG LEU A 105 1.959 -3.005 7.621 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.016 -2.811 9.073 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.280 -1.314 8.158 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.017 -2.423 7.654 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.601 -5.000 8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.374 -4.692 6.659 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.352 -5.097 6.504 1.00 0.00 H new ATOM 1583 N ILE A 106 3.188 -0.361 4.413 1.00 0.00 N ATOM 1584 CA ILE A 106 3.916 0.888 4.590 1.00 0.00 C ATOM 1585 C ILE A 106 3.028 2.093 4.276 1.00 0.00 C ATOM 1586 O ILE A 106 2.419 2.162 3.210 1.00 0.00 O ATOM 1587 CB ILE A 106 5.172 0.948 3.698 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.846 0.474 2.275 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.298 0.123 4.307 1.00 0.00 C ATOM 1590 CD1 ILE A 106 4.907 -1.030 2.094 1.00 0.00 C ATOM 0 H ILE A 106 2.741 -0.464 3.502 1.00 0.00 H new ATOM 0 HA ILE A 106 4.223 0.924 5.635 1.00 0.00 H new ATOM 0 HB ILE A 106 5.507 1.984 3.638 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.848 0.821 2.008 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.543 0.941 1.579 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.177 0.176 3.664 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.545 0.516 5.293 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.979 -0.915 4.400 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.664 -1.282 1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 106 5.911 -1.384 2.327 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.190 -1.506 2.762 1.00 0.00 H new ATOM 1602 N PRO A 107 2.941 3.062 5.208 1.00 0.00 N ATOM 1603 CA PRO A 107 2.122 4.267 5.026 1.00 0.00 C ATOM 1604 C PRO A 107 2.733 5.246 4.028 1.00 0.00 C ATOM 1605 O PRO A 107 3.953 5.359 3.920 1.00 0.00 O ATOM 1606 CB PRO A 107 2.099 4.885 6.424 1.00 0.00 C ATOM 1607 CG PRO A 107 3.382 4.446 7.036 1.00 0.00 C ATOM 1608 CD PRO A 107 3.623 3.056 6.517 1.00 0.00 C ATOM 0 HA PRO A 107 1.136 4.032 4.624 1.00 0.00 H new ATOM 0 HB2 PRO A 107 2.030 5.972 6.378 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.242 4.536 7.000 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.197 5.115 6.759 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.320 4.453 8.124 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.687 2.843 6.416 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.208 2.300 7.184 1.00 0.00 H new ATOM 1616 N ILE A 108 1.871 5.951 3.305 1.00 0.00 N ATOM 1617 CA ILE A 108 2.308 6.924 2.313 1.00 0.00 C ATOM 1618 C ILE A 108 1.282 8.052 2.180 1.00 0.00 C ATOM 1619 O ILE A 108 0.129 7.901 2.584 1.00 0.00 O ATOM 1620 CB ILE A 108 2.530 6.248 0.939 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.735 5.309 1.001 1.00 0.00 C ATOM 1622 CG2 ILE A 108 2.726 7.280 -0.165 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.372 3.878 1.329 1.00 0.00 C ATOM 0 H ILE A 108 0.858 5.865 3.389 1.00 0.00 H new ATOM 0 HA ILE A 108 3.255 7.345 2.650 1.00 0.00 H new ATOM 0 HB ILE A 108 1.636 5.670 0.703 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.253 5.333 0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.435 5.678 1.751 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.879 6.770 -1.116 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.842 7.914 -0.231 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.597 7.895 0.062 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.276 3.270 1.356 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.881 3.841 2.301 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.697 3.490 0.566 1.00 0.00 H new ATOM 1635 N LYS A 109 1.704 9.177 1.612 1.00 0.00 N ATOM 1636 CA LYS A 109 0.811 10.315 1.428 1.00 0.00 C ATOM 1637 C LYS A 109 1.494 11.429 0.641 1.00 0.00 C ATOM 1638 O LYS A 109 2.701 11.639 0.758 1.00 0.00 O ATOM 1639 CB LYS A 109 0.323 10.839 2.784 1.00 0.00 C ATOM 1640 CG LYS A 109 1.350 11.670 3.541 1.00 0.00 C ATOM 1641 CD LYS A 109 2.369 10.793 4.252 1.00 0.00 C ATOM 1642 CE LYS A 109 2.182 10.827 5.761 1.00 0.00 C ATOM 1643 NZ LYS A 109 3.220 11.658 6.431 1.00 0.00 N ATOM 0 H LYS A 109 2.654 9.325 1.273 1.00 0.00 H new ATOM 0 HA LYS A 109 -0.051 9.976 0.853 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.571 11.443 2.627 1.00 0.00 H new ATOM 0 HB3 LYS A 109 0.030 9.992 3.404 1.00 0.00 H new ATOM 0 HG2 LYS A 109 1.864 12.335 2.846 1.00 0.00 H new ATOM 0 HG3 LYS A 109 0.842 12.301 4.270 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.277 9.767 3.897 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.376 11.128 4.002 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.194 11.222 5.995 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.221 9.811 6.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 3.208 11.470 7.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 4.157 11.421 6.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.021 12.665 6.262 1.00 0.00 H new ATOM 1657 N TYR A 110 0.711 12.142 -0.161 1.00 0.00 N ATOM 1658 CA TYR A 110 1.237 13.241 -0.966 1.00 0.00 C ATOM 1659 C TYR A 110 1.681 14.404 -0.079 1.00 0.00 C ATOM 1660 O TYR A 110 2.431 15.277 -0.517 1.00 0.00 O ATOM 1661 CB TYR A 110 0.197 13.723 -1.983 1.00 0.00 C ATOM 1662 CG TYR A 110 -1.230 13.681 -1.479 1.00 0.00 C ATOM 1663 CD1 TYR A 110 -1.719 14.670 -0.634 1.00 0.00 C ATOM 1664 CD2 TYR A 110 -2.086 12.651 -1.847 1.00 0.00 C ATOM 1665 CE1 TYR A 110 -3.020 14.634 -0.170 1.00 0.00 C ATOM 1666 CE2 TYR A 110 -3.390 12.608 -1.388 1.00 0.00 C ATOM 1667 CZ TYR A 110 -3.850 13.602 -0.551 1.00 0.00 C ATOM 1668 OH TYR A 110 -5.148 13.561 -0.091 1.00 0.00 O ATOM 0 H TYR A 110 -0.290 11.980 -0.272 1.00 0.00 H new ATOM 0 HA TYR A 110 2.105 12.867 -1.509 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.437 14.745 -2.275 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.272 13.109 -2.881 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -1.071 15.481 -0.335 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -1.728 11.871 -2.502 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -3.384 15.410 0.487 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -4.044 11.801 -1.683 1.00 0.00 H new ATOM 0 HH TYR A 110 -5.512 12.660 -0.217 1.00 0.00 H new ATOM 1678 N LYS A 111 1.217 14.409 1.167 1.00 0.00 N ATOM 1679 CA LYS A 111 1.569 15.462 2.112 1.00 0.00 C ATOM 1680 C LYS A 111 1.009 15.155 3.497 1.00 0.00 C ATOM 1681 O LYS A 111 0.145 14.291 3.650 1.00 0.00 O ATOM 1682 CB LYS A 111 1.047 16.814 1.623 1.00 0.00 C ATOM 1683 CG LYS A 111 -0.471 16.903 1.590 1.00 0.00 C ATOM 1684 CD LYS A 111 -0.995 17.895 2.614 1.00 0.00 C ATOM 1685 CE LYS A 111 -1.364 19.222 1.970 1.00 0.00 C ATOM 1686 NZ LYS A 111 -0.776 20.380 2.700 1.00 0.00 N ATOM 0 H LYS A 111 0.596 13.694 1.546 1.00 0.00 H new ATOM 0 HA LYS A 111 2.656 15.507 2.180 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.435 17.600 2.271 1.00 0.00 H new ATOM 0 HB3 LYS A 111 1.436 17.004 0.623 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -0.797 17.201 0.594 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.898 15.919 1.784 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.869 17.476 3.113 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -0.239 18.060 3.381 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.018 19.232 0.936 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -2.449 19.323 1.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -1.451 21.171 2.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.571 20.104 3.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.105 20.674 2.232 1.00 0.00 H new ATOM 1700 N ALA A 112 1.508 15.865 4.503 1.00 0.00 N ATOM 1701 CA ALA A 112 1.060 15.663 5.877 1.00 0.00 C ATOM 1702 C ALA A 112 -0.399 16.072 6.054 1.00 0.00 C ATOM 1703 O ALA A 112 -0.876 17.007 5.411 1.00 0.00 O ATOM 1704 CB ALA A 112 1.947 16.440 6.838 1.00 0.00 C ATOM 0 H ALA A 112 2.222 16.585 4.394 1.00 0.00 H new ATOM 0 HA ALA A 112 1.137 14.599 6.102 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.603 16.281 7.860 1.00 0.00 H new ATOM 0 HB2 ALA A 112 2.976 16.094 6.744 1.00 0.00 H new ATOM 0 HB3 ALA A 112 1.898 17.503 6.600 1.00 0.00 H new ATOM 1710 N MET A 113 -1.101 15.362 6.933 1.00 0.00 N ATOM 1711 CA MET A 113 -2.505 15.642 7.207 1.00 0.00 C ATOM 1712 C MET A 113 -2.653 16.741 8.247 1.00 0.00 C ATOM 1713 O MET A 113 -1.970 16.741 9.272 1.00 0.00 O ATOM 1714 CB MET A 113 -3.212 14.378 7.691 1.00 0.00 C ATOM 1715 CG MET A 113 -3.122 13.218 6.710 1.00 0.00 C ATOM 1716 SD MET A 113 -1.651 12.202 6.953 1.00 0.00 S ATOM 1717 CE MET A 113 -1.711 11.926 8.722 1.00 0.00 C ATOM 0 H MET A 113 -0.717 14.584 7.470 1.00 0.00 H new ATOM 0 HA MET A 113 -2.965 15.981 6.279 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.780 14.072 8.644 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.262 14.607 7.876 1.00 0.00 H new ATOM 0 HG2 MET A 113 -4.009 12.593 6.812 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.123 13.609 5.693 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.291 10.947 8.952 1.00 0.00 H new ATOM 0 HE2 MET A 113 -1.133 12.698 9.230 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.746 11.965 9.061 1.00 0.00 H new ATOM 1727 N LYS A 114 -3.562 17.669 7.979 1.00 0.00 N ATOM 1728 CA LYS A 114 -3.821 18.772 8.891 1.00 0.00 C ATOM 1729 C LYS A 114 -4.480 18.269 10.172 1.00 0.00 C ATOM 1730 O LYS A 114 -4.614 19.016 11.143 1.00 0.00 O ATOM 1731 CB LYS A 114 -4.714 19.817 8.221 1.00 0.00 C ATOM 1732 CG LYS A 114 -3.939 20.886 7.467 1.00 0.00 C ATOM 1733 CD LYS A 114 -4.105 20.740 5.963 1.00 0.00 C ATOM 1734 CE LYS A 114 -3.179 19.676 5.399 1.00 0.00 C ATOM 1735 NZ LYS A 114 -3.853 18.843 4.364 1.00 0.00 N ATOM 0 H LYS A 114 -4.133 17.678 7.134 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.867 19.233 9.148 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.391 19.315 7.530 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.332 20.296 8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.282 21.873 7.778 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.882 20.821 7.725 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.139 20.482 5.734 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.900 21.695 5.479 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.300 20.153 4.965 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.827 19.035 6.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.400 17.908 4.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.857 18.730 4.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.773 19.309 3.438 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.887 16.998 10.181 1.00 0.00 N ATOM 1750 CA LYS A 115 -5.523 16.417 11.360 1.00 0.00 C ATOM 1751 C LYS A 115 -4.562 15.478 12.091 1.00 0.00 C ATOM 1752 O LYS A 115 -3.347 15.571 11.913 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.841 15.720 11.001 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.846 15.068 9.636 1.00 0.00 C ATOM 1755 CD LYS A 115 -6.146 13.729 9.672 1.00 0.00 C ATOM 1756 CE LYS A 115 -6.856 12.756 10.601 1.00 0.00 C ATOM 1757 NZ LYS A 115 -8.316 12.683 10.317 1.00 0.00 N ATOM 0 H LYS A 115 -4.788 16.359 9.392 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.771 17.230 12.043 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -7.055 14.962 11.754 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.649 16.450 11.045 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.873 14.936 9.296 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.353 15.721 8.916 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.106 13.311 8.666 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.116 13.864 10.002 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.415 11.765 10.494 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.702 13.064 11.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.689 11.771 10.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.805 13.457 10.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.475 12.770 9.293 1.00 0.00 H new ATOM 1771 N GLU A 116 -5.094 14.599 12.937 1.00 0.00 N ATOM 1772 CA GLU A 116 -4.263 13.687 13.707 1.00 0.00 C ATOM 1773 C GLU A 116 -3.916 12.429 12.924 1.00 0.00 C ATOM 1774 O GLU A 116 -4.632 12.029 12.007 1.00 0.00 O ATOM 1775 CB GLU A 116 -4.975 13.307 15.002 1.00 0.00 C ATOM 1776 CG GLU A 116 -5.676 14.473 15.681 1.00 0.00 C ATOM 1777 CD GLU A 116 -4.710 15.555 16.122 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -3.825 15.923 15.322 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -4.838 16.035 17.268 1.00 0.00 O ATOM 0 H GLU A 116 -6.096 14.502 13.104 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.330 14.204 13.932 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.708 12.529 14.788 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.249 12.879 15.693 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -6.408 14.901 14.996 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -6.226 14.107 16.548 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.807 11.805 13.309 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.349 10.586 12.671 1.00 0.00 C ATOM 1788 C PHE A 117 -2.826 9.369 13.456 1.00 0.00 C ATOM 1789 O PHE A 117 -2.879 9.397 14.685 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.820 10.569 12.573 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.172 11.921 12.716 1.00 0.00 C ATOM 1792 CD1 PHE A 117 0.123 12.437 13.968 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.143 12.673 11.596 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.720 13.676 14.100 1.00 0.00 C ATOM 1795 CE2 PHE A 117 0.739 13.913 11.720 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.028 14.416 12.974 1.00 0.00 C ATOM 0 H PHE A 117 -2.208 12.131 14.067 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.766 10.551 11.665 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.426 9.907 13.345 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.534 10.143 11.611 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.117 11.864 14.851 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.080 12.285 10.613 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.946 14.066 15.082 1.00 0.00 H new ATOM 0 HE2 PHE A 117 0.979 14.488 10.838 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.494 15.385 13.074 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.174 8.278 12.758 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.641 7.056 13.401 1.00 0.00 C ATOM 1808 C PRO A 118 -2.501 6.228 13.962 1.00 0.00 C ATOM 1809 O PRO A 118 -1.403 6.226 13.408 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.332 6.311 12.265 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.606 6.739 11.040 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.138 8.151 11.289 1.00 0.00 C ATOM 0 HA PRO A 118 -4.288 7.261 14.254 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.272 5.232 12.405 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.390 6.567 12.209 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -2.761 6.080 10.840 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.258 6.695 10.168 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.134 8.315 10.898 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.791 8.880 10.808 1.00 0.00 H new ATOM 1820 N SER A 119 -2.773 5.507 15.049 1.00 0.00 N ATOM 1821 CA SER A 119 -1.766 4.642 15.657 1.00 0.00 C ATOM 1822 C SER A 119 -1.442 3.553 14.653 1.00 0.00 C ATOM 1823 O SER A 119 -1.854 2.402 14.795 1.00 0.00 O ATOM 1824 CB SER A 119 -2.286 4.033 16.961 1.00 0.00 C ATOM 1825 OG SER A 119 -1.437 2.990 17.410 1.00 0.00 O ATOM 0 H SER A 119 -3.676 5.505 15.523 1.00 0.00 H new ATOM 0 HA SER A 119 -0.873 5.215 15.905 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.353 4.806 17.726 1.00 0.00 H new ATOM 0 HB3 SER A 119 -3.294 3.646 16.809 1.00 0.00 H new ATOM 0 HG SER A 119 -1.369 2.302 16.715 1.00 0.00 H new ATOM 1831 N ILE A 120 -0.762 3.962 13.597 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.438 3.083 12.499 1.00 0.00 C ATOM 1833 C ILE A 120 0.850 3.530 11.813 1.00 0.00 C ATOM 1834 O ILE A 120 1.731 2.720 11.525 1.00 0.00 O ATOM 1835 CB ILE A 120 -1.620 3.112 11.509 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -2.799 2.340 12.092 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.244 2.571 10.148 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -3.971 2.233 11.145 1.00 0.00 C ATOM 0 H ILE A 120 -0.420 4.916 13.481 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.276 2.069 12.863 1.00 0.00 H new ATOM 0 HB ILE A 120 -1.906 4.154 11.362 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.469 1.338 12.365 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.126 2.829 13.010 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.110 2.613 9.488 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.438 3.172 9.728 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -0.912 1.537 10.246 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.775 1.672 11.622 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.326 3.232 10.892 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -3.659 1.718 10.237 1.00 0.00 H new ATOM 1850 N LEU A 121 0.951 4.833 11.569 1.00 0.00 N ATOM 1851 CA LEU A 121 2.131 5.405 10.934 1.00 0.00 C ATOM 1852 C LEU A 121 2.775 6.446 11.847 1.00 0.00 C ATOM 1853 O LEU A 121 3.365 7.420 11.381 1.00 0.00 O ATOM 1854 CB LEU A 121 1.778 6.031 9.577 1.00 0.00 C ATOM 1855 CG LEU A 121 0.505 6.890 9.533 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.737 6.017 9.470 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.437 7.837 10.724 1.00 0.00 C ATOM 0 H LEU A 121 0.228 5.513 11.802 1.00 0.00 H new ATOM 0 HA LEU A 121 2.845 4.600 10.761 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.618 6.647 9.256 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.674 5.228 8.847 1.00 0.00 H new ATOM 0 HG LEU A 121 0.544 7.494 8.626 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.625 6.649 9.440 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.701 5.398 8.574 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.777 5.377 10.351 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.475 8.431 10.665 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.434 7.259 11.648 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.303 8.499 10.712 1.00 0.00 H new ATOM 1869 N ARG A 122 2.644 6.231 13.156 1.00 0.00 N ATOM 1870 CA ARG A 122 3.192 7.143 14.157 1.00 0.00 C ATOM 1871 C ARG A 122 4.604 7.602 13.805 1.00 0.00 C ATOM 1872 O ARG A 122 4.927 8.785 13.926 1.00 0.00 O ATOM 1873 CB ARG A 122 3.190 6.478 15.535 1.00 0.00 C ATOM 1874 CG ARG A 122 3.744 5.063 15.531 1.00 0.00 C ATOM 1875 CD ARG A 122 3.248 4.267 16.727 1.00 0.00 C ATOM 1876 NE ARG A 122 4.193 3.225 17.125 1.00 0.00 N ATOM 1877 CZ ARG A 122 4.002 2.408 18.158 1.00 0.00 C ATOM 1878 NH1 ARG A 122 2.906 2.508 18.900 1.00 0.00 N ATOM 1879 NH2 ARG A 122 4.910 1.487 18.449 1.00 0.00 N ATOM 0 H ARG A 122 2.158 5.425 13.549 1.00 0.00 H new ATOM 0 HA ARG A 122 2.553 8.026 14.175 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.777 7.087 16.223 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.170 6.458 15.918 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.451 4.559 14.610 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.833 5.098 15.542 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.079 4.942 17.566 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.288 3.812 16.486 1.00 0.00 H new ATOM 0 HE ARG A 122 5.048 3.118 16.579 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.204 3.214 18.680 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.766 1.879 19.690 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.754 1.405 17.881 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.765 0.860 19.240 1.00 0.00 H new ATOM 1893 N PHE A 123 5.445 6.671 13.373 1.00 0.00 N ATOM 1894 CA PHE A 123 6.820 7.003 13.013 1.00 0.00 C ATOM 1895 C PHE A 123 7.469 5.882 12.210 1.00 0.00 C ATOM 1896 O PHE A 123 8.690 5.720 12.231 1.00 0.00 O ATOM 1897 CB PHE A 123 7.643 7.283 14.273 1.00 0.00 C ATOM 1898 CG PHE A 123 9.005 7.850 13.987 1.00 0.00 C ATOM 1899 CD1 PHE A 123 9.149 8.980 13.198 1.00 0.00 C ATOM 1900 CD2 PHE A 123 10.142 7.251 14.508 1.00 0.00 C ATOM 1901 CE1 PHE A 123 10.401 9.503 12.933 1.00 0.00 C ATOM 1902 CE2 PHE A 123 11.395 7.770 14.247 1.00 0.00 C ATOM 1903 CZ PHE A 123 11.525 8.897 13.460 1.00 0.00 C ATOM 0 H PHE A 123 5.203 5.686 13.263 1.00 0.00 H new ATOM 0 HA PHE A 123 6.795 7.897 12.391 1.00 0.00 H new ATOM 0 HB2 PHE A 123 7.095 7.979 14.908 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.755 6.357 14.837 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.273 9.458 12.785 1.00 0.00 H new ATOM 0 HD2 PHE A 123 10.047 6.369 15.124 1.00 0.00 H new ATOM 0 HE1 PHE A 123 10.500 10.383 12.315 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.273 7.294 14.658 1.00 0.00 H new ATOM 0 HZ PHE A 123 12.504 9.304 13.257 1.00 0.00 H new ATOM 1913 N ILE A 124 6.651 5.112 11.503 1.00 0.00 N ATOM 1914 CA ILE A 124 7.144 4.017 10.699 1.00 0.00 C ATOM 1915 C ILE A 124 7.559 4.502 9.311 1.00 0.00 C ATOM 1916 O ILE A 124 7.450 5.690 9.005 1.00 0.00 O ATOM 1917 CB ILE A 124 6.072 2.919 10.571 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.935 3.371 9.649 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.532 2.549 11.946 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.790 2.382 9.565 1.00 0.00 C ATOM 0 H ILE A 124 5.639 5.232 11.475 1.00 0.00 H new ATOM 0 HA ILE A 124 8.020 3.603 11.197 1.00 0.00 H new ATOM 0 HB ILE A 124 6.534 2.037 10.128 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.552 4.328 10.002 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.334 3.537 8.648 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.775 1.772 11.842 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.347 2.181 12.570 1.00 0.00 H new ATOM 0 HG23 ILE A 124 5.088 3.429 12.411 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.023 2.770 8.895 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.159 1.430 9.183 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.364 2.234 10.557 1.00 0.00 H new ATOM 1932 N THR A 125 8.036 3.586 8.475 1.00 0.00 N ATOM 1933 CA THR A 125 8.464 3.936 7.124 1.00 0.00 C ATOM 1934 C THR A 125 7.346 4.646 6.366 1.00 0.00 C ATOM 1935 O THR A 125 6.432 4.007 5.848 1.00 0.00 O ATOM 1936 CB THR A 125 8.897 2.687 6.357 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.995 2.061 6.996 1.00 0.00 O ATOM 1938 CG2 THR A 125 9.302 2.979 4.927 1.00 0.00 C ATOM 0 H THR A 125 8.136 2.598 8.708 1.00 0.00 H new ATOM 0 HA THR A 125 9.314 4.613 7.208 1.00 0.00 H new ATOM 0 HB THR A 125 8.024 2.034 6.347 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.256 1.263 6.491 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.599 2.052 4.436 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.460 3.419 4.393 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.139 3.677 4.921 1.00 0.00 H new ATOM 1946 N VAL A 126 7.427 5.968 6.306 1.00 0.00 N ATOM 1947 CA VAL A 126 6.423 6.764 5.616 1.00 0.00 C ATOM 1948 C VAL A 126 7.010 7.469 4.398 1.00 0.00 C ATOM 1949 O VAL A 126 8.151 7.932 4.425 1.00 0.00 O ATOM 1950 CB VAL A 126 5.810 7.818 6.557 1.00 0.00 C ATOM 1951 CG1 VAL A 126 4.811 8.697 5.812 1.00 0.00 C ATOM 1952 CG2 VAL A 126 5.152 7.149 7.754 1.00 0.00 C ATOM 0 H VAL A 126 8.179 6.512 6.728 1.00 0.00 H new ATOM 0 HA VAL A 126 5.645 6.075 5.287 1.00 0.00 H new ATOM 0 HB VAL A 126 6.614 8.457 6.921 1.00 0.00 H new ATOM 0 HG11 VAL A 126 4.392 9.433 6.498 1.00 0.00 H new ATOM 0 HG12 VAL A 126 5.317 9.210 4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 126 4.009 8.077 5.411 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.725 7.910 8.407 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.362 6.482 7.409 1.00 0.00 H new ATOM 0 HG23 VAL A 126 5.897 6.575 8.305 1.00 0.00 H new ATOM 1962 N CYS A 127 6.216 7.557 3.336 1.00 0.00 N ATOM 1963 CA CYS A 127 6.646 8.218 2.112 1.00 0.00 C ATOM 1964 C CYS A 127 5.883 9.523 1.920 1.00 0.00 C ATOM 1965 O CYS A 127 4.810 9.544 1.315 1.00 0.00 O ATOM 1966 CB CYS A 127 6.429 7.301 0.906 1.00 0.00 C ATOM 1967 SG CYS A 127 7.640 7.524 -0.419 1.00 0.00 S ATOM 0 H CYS A 127 5.270 7.178 3.300 1.00 0.00 H new ATOM 0 HA CYS A 127 7.710 8.441 2.195 1.00 0.00 H new ATOM 0 HB2 CYS A 127 6.460 6.264 1.241 1.00 0.00 H new ATOM 0 HB3 CYS A 127 5.431 7.476 0.505 1.00 0.00 H new ATOM 0 HG CYS A 127 7.374 6.704 -1.392 1.00 0.00 H new ATOM 1973 N ASP A 128 6.441 10.611 2.442 1.00 0.00 N ATOM 1974 CA ASP A 128 5.809 11.921 2.333 1.00 0.00 C ATOM 1975 C ASP A 128 6.660 12.866 1.493 1.00 0.00 C ATOM 1976 O ASP A 128 7.872 12.688 1.379 1.00 0.00 O ATOM 1977 CB ASP A 128 5.588 12.519 3.724 1.00 0.00 C ATOM 1978 CG ASP A 128 4.584 13.655 3.713 1.00 0.00 C ATOM 1979 OD1 ASP A 128 3.679 13.639 2.852 1.00 0.00 O ATOM 1980 OD2 ASP A 128 4.703 14.560 4.565 1.00 0.00 O ATOM 0 H ASP A 128 7.329 10.611 2.944 1.00 0.00 H new ATOM 0 HA ASP A 128 4.845 11.793 1.841 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.241 11.738 4.401 1.00 0.00 H new ATOM 0 HB3 ASP A 128 6.538 12.882 4.116 1.00 0.00 H new ATOM 1985 N TYR A 129 6.020 13.875 0.908 1.00 0.00 N ATOM 1986 CA TYR A 129 6.730 14.845 0.084 1.00 0.00 C ATOM 1987 C TYR A 129 7.442 15.870 0.956 1.00 0.00 C ATOM 1988 O TYR A 129 6.946 16.979 1.161 1.00 0.00 O ATOM 1989 CB TYR A 129 5.768 15.552 -0.874 1.00 0.00 C ATOM 1990 CG TYR A 129 5.270 14.671 -1.998 1.00 0.00 C ATOM 1991 CD1 TYR A 129 4.678 13.441 -1.736 1.00 0.00 C ATOM 1992 CD2 TYR A 129 5.393 15.070 -3.324 1.00 0.00 C ATOM 1993 CE1 TYR A 129 4.223 12.635 -2.764 1.00 0.00 C ATOM 1994 CE2 TYR A 129 4.939 14.269 -4.355 1.00 0.00 C ATOM 1995 CZ TYR A 129 4.356 13.053 -4.069 1.00 0.00 C ATOM 1996 OH TYR A 129 3.903 12.253 -5.094 1.00 0.00 O ATOM 0 H TYR A 129 5.017 14.041 0.989 1.00 0.00 H new ATOM 0 HA TYR A 129 7.473 14.306 -0.504 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.913 15.922 -0.308 1.00 0.00 H new ATOM 0 HB3 TYR A 129 6.268 16.422 -1.300 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.572 13.109 -0.714 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.851 16.021 -3.552 1.00 0.00 H new ATOM 0 HE1 TYR A 129 3.765 11.682 -2.544 1.00 0.00 H new ATOM 0 HE2 TYR A 129 5.041 14.594 -5.380 1.00 0.00 H new ATOM 0 HH TYR A 129 4.072 12.694 -5.953 1.00 0.00 H new ATOM 2006 N THR A 130 8.612 15.497 1.456 1.00 0.00 N ATOM 2007 CA THR A 130 9.403 16.388 2.298 1.00 0.00 C ATOM 2008 C THR A 130 10.377 17.178 1.437 1.00 0.00 C ATOM 2009 O THR A 130 10.608 18.367 1.658 1.00 0.00 O ATOM 2010 CB THR A 130 10.165 15.589 3.358 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.854 16.456 4.241 1.00 0.00 O ATOM 2012 CG2 THR A 130 11.180 14.629 2.774 1.00 0.00 C ATOM 0 H THR A 130 9.036 14.583 1.294 1.00 0.00 H new ATOM 0 HA THR A 130 8.731 17.080 2.806 1.00 0.00 H new ATOM 0 HB THR A 130 9.404 15.011 3.883 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.677 16.772 3.813 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.683 14.096 3.581 1.00 0.00 H new ATOM 0 HG22 THR A 130 10.673 13.913 2.127 1.00 0.00 H new ATOM 0 HG23 THR A 130 11.915 15.186 2.193 1.00 0.00 H new ATOM 2020 N ASN A 131 10.923 16.501 0.437 1.00 0.00 N ATOM 2021 CA ASN A 131 11.856 17.111 -0.496 1.00 0.00 C ATOM 2022 C ASN A 131 11.750 16.427 -1.856 1.00 0.00 C ATOM 2023 O ASN A 131 12.754 16.002 -2.428 1.00 0.00 O ATOM 2024 CB ASN A 131 13.289 17.008 0.036 1.00 0.00 C ATOM 2025 CG ASN A 131 13.471 17.741 1.350 1.00 0.00 C ATOM 2026 OD1 ASN A 131 13.414 17.140 2.424 1.00 0.00 O ATOM 2027 ND2 ASN A 131 13.694 19.047 1.273 1.00 0.00 N ATOM 0 H ASN A 131 10.732 15.517 0.251 1.00 0.00 H new ATOM 0 HA ASN A 131 11.603 18.166 -0.606 1.00 0.00 H new ATOM 0 HB2 ASN A 131 13.550 15.958 0.170 1.00 0.00 H new ATOM 0 HB3 ASN A 131 13.978 17.416 -0.703 1.00 0.00 H new ATOM 0 HD21 ASN A 131 13.826 19.593 2.124 1.00 0.00 H new ATOM 0 HD22 ASN A 131 13.733 19.505 0.362 1.00 0.00 H new ATOM 2034 N PRO A 132 10.519 16.303 -2.397 1.00 0.00 N ATOM 2035 CA PRO A 132 10.289 15.660 -3.691 1.00 0.00 C ATOM 2036 C PRO A 132 11.257 16.149 -4.756 1.00 0.00 C ATOM 2037 O PRO A 132 11.652 15.400 -5.650 1.00 0.00 O ATOM 2038 CB PRO A 132 8.863 16.074 -4.045 1.00 0.00 C ATOM 2039 CG PRO A 132 8.195 16.283 -2.733 1.00 0.00 C ATOM 2040 CD PRO A 132 9.259 16.776 -1.787 1.00 0.00 C ATOM 0 HA PRO A 132 10.435 14.581 -3.641 1.00 0.00 H new ATOM 0 HB2 PRO A 132 8.852 16.984 -4.645 1.00 0.00 H new ATOM 0 HB3 PRO A 132 8.359 15.302 -4.628 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.386 17.009 -2.820 1.00 0.00 H new ATOM 0 HG3 PRO A 132 7.753 15.355 -2.370 1.00 0.00 H new ATOM 0 HD2 PRO A 132 9.242 17.862 -1.696 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.123 16.370 -0.785 1.00 0.00 H new ATOM 2048 N CYS A 133 11.631 17.418 -4.646 1.00 0.00 N ATOM 2049 CA CYS A 133 12.558 18.040 -5.591 1.00 0.00 C ATOM 2050 C CYS A 133 13.723 17.107 -5.914 1.00 0.00 C ATOM 2051 O CYS A 133 14.021 16.847 -7.080 1.00 0.00 O ATOM 2052 CB CYS A 133 13.084 19.361 -5.024 1.00 0.00 C ATOM 2053 SG CYS A 133 12.589 20.820 -5.971 1.00 0.00 S ATOM 0 H CYS A 133 11.306 18.042 -3.908 1.00 0.00 H new ATOM 0 HA CYS A 133 12.015 18.239 -6.515 1.00 0.00 H new ATOM 0 HB2 CYS A 133 12.731 19.470 -3.998 1.00 0.00 H new ATOM 0 HB3 CYS A 133 14.172 19.319 -4.984 1.00 0.00 H new ATOM 0 HG CYS A 133 13.080 21.887 -5.413 1.00 0.00 H new ATOM 2059 N THR A 134 14.365 16.602 -4.870 1.00 0.00 N ATOM 2060 CA THR A 134 15.490 15.688 -5.030 1.00 0.00 C ATOM 2061 C THR A 134 15.104 14.280 -4.591 1.00 0.00 C ATOM 2062 O THR A 134 15.661 13.291 -5.072 1.00 0.00 O ATOM 2063 CB THR A 134 16.696 16.177 -4.225 1.00 0.00 C ATOM 2064 OG1 THR A 134 17.820 15.345 -4.451 1.00 0.00 O ATOM 2065 CG2 THR A 134 16.445 16.214 -2.733 1.00 0.00 C ATOM 0 H THR A 134 14.126 16.810 -3.900 1.00 0.00 H new ATOM 0 HA THR A 134 15.760 15.662 -6.086 1.00 0.00 H new ATOM 0 HB THR A 134 16.881 17.194 -4.571 1.00 0.00 H new ATOM 0 HG1 THR A 134 17.655 14.460 -4.064 1.00 0.00 H new ATOM 0 HG21 THR A 134 17.340 16.570 -2.222 1.00 0.00 H new ATOM 0 HG22 THR A 134 15.614 16.887 -2.520 1.00 0.00 H new ATOM 0 HG23 THR A 134 16.200 15.212 -2.380 1.00 0.00 H new ATOM 2073 N LYS A 135 14.140 14.196 -3.680 1.00 0.00 N ATOM 2074 CA LYS A 135 13.664 12.913 -3.177 1.00 0.00 C ATOM 2075 C LYS A 135 12.741 12.232 -4.187 1.00 0.00 C ATOM 2076 O LYS A 135 12.300 11.105 -3.968 1.00 0.00 O ATOM 2077 CB LYS A 135 12.933 13.102 -1.847 1.00 0.00 C ATOM 2078 CG LYS A 135 12.922 11.857 -0.976 1.00 0.00 C ATOM 2079 CD LYS A 135 11.859 11.940 0.109 1.00 0.00 C ATOM 2080 CE LYS A 135 10.726 10.959 -0.145 1.00 0.00 C ATOM 2081 NZ LYS A 135 10.080 10.516 1.122 1.00 0.00 N ATOM 0 H LYS A 135 13.671 15.006 -3.274 1.00 0.00 H new ATOM 0 HA LYS A 135 14.532 12.272 -3.021 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.403 13.916 -1.296 1.00 0.00 H new ATOM 0 HB3 LYS A 135 11.905 13.404 -2.047 1.00 0.00 H new ATOM 0 HG2 LYS A 135 12.741 10.980 -1.597 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.902 11.725 -0.517 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.311 11.732 1.079 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.461 12.954 0.153 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.980 11.425 -0.789 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.111 10.090 -0.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 9.667 9.571 0.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.791 10.480 1.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 9.330 11.188 1.383 1.00 0.00 H new ATOM 2095 N SER A 136 12.443 12.929 -5.290 1.00 0.00 N ATOM 2096 CA SER A 136 11.560 12.401 -6.333 1.00 0.00 C ATOM 2097 C SER A 136 11.818 10.919 -6.608 1.00 0.00 C ATOM 2098 O SER A 136 10.907 10.186 -6.997 1.00 0.00 O ATOM 2099 CB SER A 136 11.739 13.201 -7.624 1.00 0.00 C ATOM 2100 OG SER A 136 11.146 12.534 -8.725 1.00 0.00 O ATOM 0 H SER A 136 12.803 13.864 -5.482 1.00 0.00 H new ATOM 0 HA SER A 136 10.536 12.500 -5.973 1.00 0.00 H new ATOM 0 HB2 SER A 136 11.291 14.188 -7.509 1.00 0.00 H new ATOM 0 HB3 SER A 136 12.801 13.354 -7.816 1.00 0.00 H new ATOM 0 HG SER A 136 11.273 13.067 -9.537 1.00 0.00 H new ATOM 2106 N TRP A 137 13.055 10.480 -6.404 1.00 0.00 N ATOM 2107 CA TRP A 137 13.419 9.084 -6.631 1.00 0.00 C ATOM 2108 C TRP A 137 12.590 8.139 -5.760 1.00 0.00 C ATOM 2109 O TRP A 137 12.567 6.931 -5.998 1.00 0.00 O ATOM 2110 CB TRP A 137 14.910 8.868 -6.357 1.00 0.00 C ATOM 2111 CG TRP A 137 15.390 9.533 -5.103 1.00 0.00 C ATOM 2112 CD1 TRP A 137 14.848 9.420 -3.855 1.00 0.00 C ATOM 2113 CD2 TRP A 137 16.510 10.416 -4.977 1.00 0.00 C ATOM 2114 NE1 TRP A 137 15.562 10.179 -2.961 1.00 0.00 N ATOM 2115 CE2 TRP A 137 16.588 10.800 -3.625 1.00 0.00 C ATOM 2116 CE3 TRP A 137 17.456 10.918 -5.876 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 17.573 11.663 -3.153 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 18.433 11.773 -5.405 1.00 0.00 C ATOM 2119 CH2 TRP A 137 18.486 12.139 -4.053 1.00 0.00 C ATOM 0 H TRP A 137 13.823 11.069 -6.082 1.00 0.00 H new ATOM 0 HA TRP A 137 13.208 8.856 -7.676 1.00 0.00 H new ATOM 0 HB2 TRP A 137 15.108 7.798 -6.290 1.00 0.00 H new ATOM 0 HB3 TRP A 137 15.485 9.246 -7.202 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.984 8.821 -3.607 1.00 0.00 H new ATOM 0 HE1 TRP A 137 15.362 10.267 -1.965 1.00 0.00 H new ATOM 0 HE3 TRP A 137 17.423 10.642 -6.920 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 17.615 11.947 -2.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 19.169 12.166 -6.090 1.00 0.00 H new ATOM 0 HH2 TRP A 137 19.263 12.810 -3.716 1.00 0.00 H new ATOM 2130 N PHE A 138 11.912 8.690 -4.753 1.00 0.00 N ATOM 2131 CA PHE A 138 11.086 7.898 -3.849 1.00 0.00 C ATOM 2132 C PHE A 138 10.250 6.869 -4.609 1.00 0.00 C ATOM 2133 O PHE A 138 9.950 5.794 -4.091 1.00 0.00 O ATOM 2134 CB PHE A 138 10.177 8.820 -3.035 1.00 0.00 C ATOM 2135 CG PHE A 138 9.054 9.425 -3.832 1.00 0.00 C ATOM 2136 CD1 PHE A 138 7.868 8.733 -4.017 1.00 0.00 C ATOM 2137 CD2 PHE A 138 9.187 10.684 -4.397 1.00 0.00 C ATOM 2138 CE1 PHE A 138 6.835 9.286 -4.749 1.00 0.00 C ATOM 2139 CE2 PHE A 138 8.156 11.241 -5.130 1.00 0.00 C ATOM 2140 CZ PHE A 138 6.979 10.542 -5.308 1.00 0.00 C ATOM 0 H PHE A 138 11.921 9.688 -4.544 1.00 0.00 H new ATOM 0 HA PHE A 138 11.748 7.354 -3.175 1.00 0.00 H new ATOM 0 HB2 PHE A 138 9.756 8.257 -2.202 1.00 0.00 H new ATOM 0 HB3 PHE A 138 10.779 9.622 -2.606 1.00 0.00 H new ATOM 0 HD1 PHE A 138 7.750 7.751 -3.584 1.00 0.00 H new ATOM 0 HD2 PHE A 138 10.106 11.235 -4.263 1.00 0.00 H new ATOM 0 HE1 PHE A 138 5.915 8.737 -4.884 1.00 0.00 H new ATOM 0 HE2 PHE A 138 8.271 12.223 -5.564 1.00 0.00 H new ATOM 0 HZ PHE A 138 6.173 10.975 -5.882 1.00 0.00 H new ATOM 2150 N TRP A 139 9.882 7.204 -5.844 1.00 0.00 N ATOM 2151 CA TRP A 139 9.088 6.305 -6.675 1.00 0.00 C ATOM 2152 C TRP A 139 9.747 4.932 -6.760 1.00 0.00 C ATOM 2153 O TRP A 139 9.068 3.907 -6.832 1.00 0.00 O ATOM 2154 CB TRP A 139 8.918 6.889 -8.081 1.00 0.00 C ATOM 2155 CG TRP A 139 7.668 7.701 -8.255 1.00 0.00 C ATOM 2156 CD1 TRP A 139 6.641 7.837 -7.364 1.00 0.00 C ATOM 2157 CD2 TRP A 139 7.313 8.489 -9.398 1.00 0.00 C ATOM 2158 NE1 TRP A 139 5.672 8.662 -7.883 1.00 0.00 N ATOM 2159 CE2 TRP A 139 6.061 9.075 -9.129 1.00 0.00 C ATOM 2160 CE3 TRP A 139 7.935 8.756 -10.620 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 5.420 9.911 -10.040 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 7.297 9.586 -11.524 1.00 0.00 C ATOM 2163 CH2 TRP A 139 6.052 10.156 -11.230 1.00 0.00 C ATOM 0 H TRP A 139 10.121 8.090 -6.290 1.00 0.00 H new ATOM 0 HA TRP A 139 8.105 6.195 -6.216 1.00 0.00 H new ATOM 0 HB2 TRP A 139 9.781 7.514 -8.311 1.00 0.00 H new ATOM 0 HB3 TRP A 139 8.914 6.074 -8.804 1.00 0.00 H new ATOM 0 HD1 TRP A 139 6.597 7.365 -6.394 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.804 8.924 -7.416 1.00 0.00 H new ATOM 0 HE3 TRP A 139 8.896 8.322 -10.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 4.459 10.350 -9.816 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 7.767 9.798 -12.473 1.00 0.00 H new ATOM 0 HH2 TRP A 139 5.581 10.802 -11.956 1.00 0.00 H new ATOM 2174 N THR A 140 11.076 4.922 -6.744 1.00 0.00 N ATOM 2175 CA THR A 140 11.835 3.679 -6.814 1.00 0.00 C ATOM 2176 C THR A 140 11.930 3.031 -5.436 1.00 0.00 C ATOM 2177 O THR A 140 12.012 1.808 -5.320 1.00 0.00 O ATOM 2178 CB THR A 140 13.237 3.945 -7.364 1.00 0.00 C ATOM 2179 OG1 THR A 140 13.197 4.937 -8.376 1.00 0.00 O ATOM 2180 CG2 THR A 140 13.892 2.716 -7.952 1.00 0.00 C ATOM 0 H THR A 140 11.650 5.763 -6.683 1.00 0.00 H new ATOM 0 HA THR A 140 11.315 2.996 -7.485 1.00 0.00 H new ATOM 0 HB THR A 140 13.826 4.276 -6.508 1.00 0.00 H new ATOM 0 HG1 THR A 140 14.103 5.095 -8.715 1.00 0.00 H new ATOM 0 HG21 THR A 140 14.883 2.975 -8.324 1.00 0.00 H new ATOM 0 HG22 THR A 140 13.982 1.948 -7.183 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.284 2.337 -8.774 1.00 0.00 H new ATOM 2188 N ARG A 141 11.917 3.859 -4.395 1.00 0.00 N ATOM 2189 CA ARG A 141 11.997 3.364 -3.027 1.00 0.00 C ATOM 2190 C ARG A 141 10.829 2.434 -2.721 1.00 0.00 C ATOM 2191 O ARG A 141 11.007 1.367 -2.134 1.00 0.00 O ATOM 2192 CB ARG A 141 12.008 4.532 -2.038 1.00 0.00 C ATOM 2193 CG ARG A 141 13.159 5.501 -2.255 1.00 0.00 C ATOM 2194 CD ARG A 141 14.438 5.001 -1.601 1.00 0.00 C ATOM 2195 NE ARG A 141 15.430 6.063 -1.456 1.00 0.00 N ATOM 2196 CZ ARG A 141 16.467 6.000 -0.624 1.00 0.00 C ATOM 2197 NH1 ARG A 141 16.650 4.928 0.138 1.00 0.00 N ATOM 2198 NH2 ARG A 141 17.322 7.010 -0.553 1.00 0.00 N ATOM 0 H ARG A 141 11.852 4.874 -4.474 1.00 0.00 H new ATOM 0 HA ARG A 141 12.925 2.802 -2.922 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.066 5.075 -2.119 1.00 0.00 H new ATOM 0 HB3 ARG A 141 12.062 4.138 -1.023 1.00 0.00 H new ATOM 0 HG2 ARG A 141 13.325 5.638 -3.324 1.00 0.00 H new ATOM 0 HG3 ARG A 141 12.897 6.477 -1.846 1.00 0.00 H new ATOM 0 HD2 ARG A 141 14.205 4.586 -0.620 1.00 0.00 H new ATOM 0 HD3 ARG A 141 14.858 4.192 -2.198 1.00 0.00 H new ATOM 0 HE ARG A 141 15.322 6.902 -2.026 1.00 0.00 H new ATOM 0 HH11 ARG A 141 15.994 4.148 0.087 1.00 0.00 H new ATOM 0 HH12 ARG A 141 17.446 4.884 0.774 1.00 0.00 H new ATOM 0 HH21 ARG A 141 17.185 7.836 -1.136 1.00 0.00 H new ATOM 0 HH22 ARG A 141 18.117 6.962 0.085 1.00 0.00 H new ATOM 2212 N LEU A 142 9.631 2.847 -3.126 1.00 0.00 N ATOM 2213 CA LEU A 142 8.432 2.050 -2.900 1.00 0.00 C ATOM 2214 C LEU A 142 8.331 0.925 -3.925 1.00 0.00 C ATOM 2215 O LEU A 142 7.939 -0.194 -3.597 1.00 0.00 O ATOM 2216 CB LEU A 142 7.185 2.936 -2.968 1.00 0.00 C ATOM 2217 CG LEU A 142 6.147 2.675 -1.873 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.728 1.214 -1.873 1.00 0.00 C ATOM 2219 CD2 LEU A 142 6.698 3.075 -0.513 1.00 0.00 C ATOM 0 H LEU A 142 9.466 3.729 -3.612 1.00 0.00 H new ATOM 0 HA LEU A 142 8.498 1.608 -1.906 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.495 3.979 -2.913 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.710 2.796 -3.939 1.00 0.00 H new ATOM 0 HG LEU A 142 5.266 3.283 -2.079 1.00 0.00 H new ATOM 0 HD11 LEU A 142 4.990 1.047 -1.088 1.00 0.00 H new ATOM 0 HD12 LEU A 142 5.293 0.960 -2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.600 0.585 -1.691 1.00 0.00 H new ATOM 0 HD21 LEU A 142 5.948 2.883 0.254 1.00 0.00 H new ATOM 0 HD22 LEU A 142 7.594 2.493 -0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 142 6.947 4.136 -0.519 1.00 0.00 H new ATOM 2231 N ALA A 143 8.693 1.233 -5.165 1.00 0.00 N ATOM 2232 CA ALA A 143 8.650 0.253 -6.241 1.00 0.00 C ATOM 2233 C ALA A 143 9.694 -0.838 -6.025 1.00 0.00 C ATOM 2234 O ALA A 143 9.512 -1.979 -6.452 1.00 0.00 O ATOM 2235 CB ALA A 143 8.863 0.935 -7.585 1.00 0.00 C ATOM 0 H ALA A 143 9.020 2.156 -5.449 1.00 0.00 H new ATOM 0 HA ALA A 143 7.666 -0.215 -6.238 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.828 0.190 -8.380 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.079 1.675 -7.746 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.835 1.429 -7.592 1.00 0.00 H new ATOM 2241 N LYS A 144 10.786 -0.478 -5.359 1.00 0.00 N ATOM 2242 CA LYS A 144 11.862 -1.421 -5.082 1.00 0.00 C ATOM 2243 C LYS A 144 11.672 -2.079 -3.715 1.00 0.00 C ATOM 2244 O LYS A 144 12.142 -3.193 -3.482 1.00 0.00 O ATOM 2245 CB LYS A 144 13.213 -0.706 -5.136 1.00 0.00 C ATOM 2246 CG LYS A 144 14.397 -1.605 -4.814 1.00 0.00 C ATOM 2247 CD LYS A 144 15.271 -1.009 -3.722 1.00 0.00 C ATOM 2248 CE LYS A 144 14.897 -1.550 -2.351 1.00 0.00 C ATOM 2249 NZ LYS A 144 15.082 -0.532 -1.282 1.00 0.00 N ATOM 0 H LYS A 144 10.949 0.463 -5.000 1.00 0.00 H new ATOM 0 HA LYS A 144 11.838 -2.200 -5.844 1.00 0.00 H new ATOM 0 HB2 LYS A 144 13.350 -0.283 -6.131 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.200 0.128 -4.434 1.00 0.00 H new ATOM 0 HG2 LYS A 144 14.036 -2.584 -4.498 1.00 0.00 H new ATOM 0 HG3 LYS A 144 14.993 -1.760 -5.714 1.00 0.00 H new ATOM 0 HD2 LYS A 144 16.317 -1.233 -3.929 1.00 0.00 H new ATOM 0 HD3 LYS A 144 15.170 0.076 -3.726 1.00 0.00 H new ATOM 0 HE2 LYS A 144 13.858 -1.880 -2.362 1.00 0.00 H new ATOM 0 HE3 LYS A 144 15.507 -2.425 -2.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 14.816 -0.941 -0.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 16.078 -0.236 -1.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 14.481 0.293 -1.481 1.00 0.00 H new ATOM 2263 N ALA A 145 10.980 -1.385 -2.817 1.00 0.00 N ATOM 2264 CA ALA A 145 10.727 -1.902 -1.479 1.00 0.00 C ATOM 2265 C ALA A 145 9.554 -2.879 -1.474 1.00 0.00 C ATOM 2266 O ALA A 145 9.369 -3.635 -0.520 1.00 0.00 O ATOM 2267 CB ALA A 145 10.464 -0.759 -0.511 1.00 0.00 C ATOM 0 H ALA A 145 10.584 -0.462 -2.993 1.00 0.00 H new ATOM 0 HA ALA A 145 11.617 -2.443 -1.156 1.00 0.00 H new ATOM 0 HB1 ALA A 145 10.277 -1.161 0.485 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.333 -0.102 -0.479 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.594 -0.194 -0.844 1.00 0.00 H new ATOM 2273 N LEU A 146 8.764 -2.856 -2.542 1.00 0.00 N ATOM 2274 CA LEU A 146 7.610 -3.737 -2.656 1.00 0.00 C ATOM 2275 C LEU A 146 8.002 -5.082 -3.260 1.00 0.00 C ATOM 2276 O LEU A 146 7.294 -6.076 -3.095 1.00 0.00 O ATOM 2277 CB LEU A 146 6.527 -3.079 -3.513 1.00 0.00 C ATOM 2278 CG LEU A 146 5.616 -2.101 -2.768 1.00 0.00 C ATOM 2279 CD1 LEU A 146 4.777 -1.301 -3.751 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.725 -2.849 -1.788 1.00 0.00 C ATOM 0 H LEU A 146 8.903 -2.237 -3.340 1.00 0.00 H new ATOM 0 HA LEU A 146 7.220 -3.912 -1.653 1.00 0.00 H new ATOM 0 HB2 LEU A 146 7.008 -2.549 -4.335 1.00 0.00 H new ATOM 0 HB3 LEU A 146 5.910 -3.861 -3.955 1.00 0.00 H new ATOM 0 HG LEU A 146 6.239 -1.406 -2.205 1.00 0.00 H new ATOM 0 HD11 LEU A 146 4.135 -0.611 -3.204 1.00 0.00 H new ATOM 0 HD12 LEU A 146 5.433 -0.738 -4.415 1.00 0.00 H new ATOM 0 HD13 LEU A 146 4.161 -1.980 -4.340 1.00 0.00 H new ATOM 0 HD21 LEU A 146 4.083 -2.140 -1.266 1.00 0.00 H new ATOM 0 HD22 LEU A 146 4.108 -3.565 -2.331 1.00 0.00 H new ATOM 0 HD23 LEU A 146 5.345 -3.379 -1.064 1.00 0.00 H new ATOM 2292 N SER A 147 9.131 -5.110 -3.965 1.00 0.00 N ATOM 2293 CA SER A 147 9.605 -6.335 -4.591 1.00 0.00 C ATOM 2294 C SER A 147 11.119 -6.473 -4.462 1.00 0.00 C ATOM 2295 O SER A 147 11.806 -6.804 -5.427 1.00 0.00 O ATOM 2296 CB SER A 147 9.200 -6.364 -6.067 1.00 0.00 C ATOM 2297 OG SER A 147 8.061 -5.556 -6.300 1.00 0.00 O ATOM 0 H SER A 147 9.731 -4.299 -4.115 1.00 0.00 H new ATOM 0 HA SER A 147 9.143 -7.177 -4.075 1.00 0.00 H new ATOM 0 HB2 SER A 147 10.029 -6.014 -6.682 1.00 0.00 H new ATOM 0 HB3 SER A 147 8.990 -7.390 -6.369 1.00 0.00 H new ATOM 0 HG SER A 147 7.273 -5.977 -5.897 1.00 0.00 H new ATOM 2303 N LEU A 148 11.634 -6.229 -3.260 1.00 0.00 N ATOM 2304 CA LEU A 148 13.072 -6.342 -3.013 1.00 0.00 C ATOM 2305 C LEU A 148 13.550 -7.758 -3.322 1.00 0.00 C ATOM 2306 O LEU A 148 14.470 -7.953 -4.116 1.00 0.00 O ATOM 2307 CB LEU A 148 13.432 -5.983 -1.562 1.00 0.00 C ATOM 2308 CG LEU A 148 12.415 -5.117 -0.809 1.00 0.00 C ATOM 2309 CD1 LEU A 148 11.601 -5.961 0.161 1.00 0.00 C ATOM 2310 CD2 LEU A 148 13.122 -3.990 -0.068 1.00 0.00 C ATOM 0 H LEU A 148 11.084 -5.954 -2.446 1.00 0.00 H new ATOM 0 HA LEU A 148 13.573 -5.632 -3.671 1.00 0.00 H new ATOM 0 HB2 LEU A 148 13.574 -6.909 -1.005 1.00 0.00 H new ATOM 0 HB3 LEU A 148 14.390 -5.463 -1.565 1.00 0.00 H new ATOM 0 HG LEU A 148 11.732 -4.680 -1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.886 -5.326 0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 148 11.065 -6.734 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 148 12.268 -6.429 0.885 1.00 0.00 H new ATOM 0 HD21 LEU A 148 12.386 -3.385 0.461 1.00 0.00 H new ATOM 0 HD22 LEU A 148 13.828 -4.412 0.648 1.00 0.00 H new ATOM 0 HD23 LEU A 148 13.659 -3.366 -0.782 1.00 0.00 H new ATOM 2322 N PRO A 149 12.922 -8.770 -2.691 1.00 0.00 N ATOM 2323 CA PRO A 149 13.273 -10.176 -2.896 1.00 0.00 C ATOM 2324 C PRO A 149 13.587 -10.502 -4.354 1.00 0.00 C ATOM 2325 O PRO A 149 12.848 -10.020 -5.239 1.00 0.00 O ATOM 2326 CB PRO A 149 12.010 -10.908 -2.447 1.00 0.00 C ATOM 2327 CG PRO A 149 11.417 -10.035 -1.393 1.00 0.00 C ATOM 2328 CD PRO A 149 11.814 -8.617 -1.726 1.00 0.00 C ATOM 2329 OXT PRO A 149 14.568 -11.235 -4.598 1.00 0.00 O ATOM 0 HA PRO A 149 14.174 -10.456 -2.351 1.00 0.00 H new ATOM 0 HB2 PRO A 149 11.319 -11.050 -3.278 1.00 0.00 H new ATOM 0 HB3 PRO A 149 12.245 -11.898 -2.055 1.00 0.00 H new ATOM 0 HG2 PRO A 149 10.332 -10.138 -1.372 1.00 0.00 H new ATOM 0 HG3 PRO A 149 11.784 -10.317 -0.406 1.00 0.00 H new ATOM 0 HD2 PRO A 149 10.982 -8.061 -2.159 1.00 0.00 H new ATOM 0 HD3 PRO A 149 12.132 -8.073 -0.837 1.00 0.00 H new TER 2337 PRO A 149