USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1236 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 86 ASN : amide:sc= -4.27! C(o=-4.3!,f=-13!) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 49 HIS : no HE2:sc= 0.229 K(o=1.1,f=-15!) USER MOD Set 2.2: A 94 LYS NZ :NH3+ 151:sc= 0.885 (180deg=-0.495) USER MOD Set 3.1: A 42 HIS : no HD1:sc= 0.284 K(o=0.21,f=-2.2!) USER MOD Set 3.2: A 44 THR OG1 : rot 160:sc= -0.0697 USER MOD Single : A 1 GLY N :NH3+ -175:sc= -13.5! (180deg=-14.1!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl -161:sc= -0.417 (180deg=-0.751) USER MOD Single : A 11 CYS SG : rot 31:sc= -4.22! USER MOD Single : A 19 CYS SG : rot -115:sc= -5.12! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -7.28! C(o=-7.3!,f=-18!) USER MOD Single : A 27 ASN : amide:sc= -0.0812 K(o=-0.081,f=-1.5) USER MOD Single : A 35 GLN : amide:sc= -0.44 K(o=-0.44,f=-3.3!) USER MOD Single : A 37 SER OG : rot -141:sc= 1.26 USER MOD Single : A 41 HIS : no HD1:sc= -0.309 X(o=-0.31,f=-0.31) USER MOD Single : A 47 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.205) USER MOD Single : A 59 THR OG1 : rot 85:sc= -1.99! USER MOD Single : A 64 THR OG1 : rot 67:sc= -5.35! USER MOD Single : A 65 GLN : amide:sc= -0.0106 X(o=-0.011,f=-0.41) USER MOD Single : A 74 GLN : amide:sc= -1.62! C(o=-1.6!,f=-6.7!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -99:sc= -0.0653 (180deg=-0.797) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.374 K(o=-0.37,f=-2.2!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 174:sc= -0.845 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.222 USER MOD Single : A 113 SER OG : rot 180:sc= -0.131 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 116 HIS : no HD1:sc= -0.284 K(o=-0.28,f=-1.8) USER MOD Single : A 117 GLN : amide:sc= -0.802 K(o=-0.8,f=-5.4!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -2.06 USER MOD Single : A 129 GLN : amide:sc= -6.9! C(o=-6.9!,f=-10!) USER MOD Single : A 132 GLN :FLIP amide:sc= -3.97! C(o=-5.3!,f=-4!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -153:sc= -0.464 (180deg=-2.64) USER MOD Single : A 137 LYS NZ :NH3+ 175:sc= -5.02! (180deg=-5.29!) USER MOD Single : A 141 GLN :FLIP amide:sc= -1 F(o=-3.9!,f=-1) USER MOD Single : A 144 HIS : no HE2:sc= -0.587 K(o=-0.59,f=-1.7) USER MOD Single : A 145 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.28) USER MOD Single : A 148 CYS SG : rot 19:sc= 0.963 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.907 -18.679 -3.308 1.00 0.00 N ATOM 2 CA GLY A 1 10.570 -18.881 -4.581 1.00 0.00 C ATOM 3 C GLY A 1 11.390 -17.653 -4.949 1.00 0.00 C ATOM 4 O GLY A 1 12.028 -17.621 -5.999 1.00 0.00 O ATOM 0 H1 GLY A 1 9.420 -19.554 -3.028 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.612 -18.428 -2.585 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.213 -17.910 -3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.217 -19.756 -4.527 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.830 -19.079 -5.357 1.00 0.00 H new ATOM 8 N PRO A 2 11.371 -16.639 -4.080 1.00 0.00 N ATOM 9 CA PRO A 2 12.089 -15.396 -4.262 1.00 0.00 C ATOM 10 C PRO A 2 13.579 -15.633 -4.061 1.00 0.00 C ATOM 11 O PRO A 2 13.972 -16.523 -3.310 1.00 0.00 O ATOM 12 CB PRO A 2 11.533 -14.463 -3.188 1.00 0.00 C ATOM 13 CG PRO A 2 11.146 -15.428 -2.068 1.00 0.00 C ATOM 14 CD PRO A 2 10.631 -16.643 -2.837 1.00 0.00 C ATOM 0 HA PRO A 2 11.966 -14.976 -5.260 1.00 0.00 H new ATOM 0 HB2 PRO A 2 12.277 -13.738 -2.858 1.00 0.00 H new ATOM 0 HB3 PRO A 2 10.674 -13.897 -3.549 1.00 0.00 H new ATOM 0 HG2 PRO A 2 11.999 -15.679 -1.437 1.00 0.00 H new ATOM 0 HG3 PRO A 2 10.381 -15.007 -1.416 1.00 0.00 H new ATOM 0 HD2 PRO A 2 10.801 -17.564 -2.279 1.00 0.00 H new ATOM 0 HD3 PRO A 2 9.558 -16.572 -3.016 1.00 0.00 H new ATOM 22 N LEU A 3 14.424 -14.880 -4.695 1.00 0.00 N ATOM 23 CA LEU A 3 15.891 -15.081 -4.531 1.00 0.00 C ATOM 24 C LEU A 3 16.288 -14.822 -3.077 1.00 0.00 C ATOM 25 O LEU A 3 17.188 -15.447 -2.550 1.00 0.00 O ATOM 26 CB LEU A 3 16.642 -14.113 -5.448 1.00 0.00 C ATOM 27 CG LEU A 3 16.224 -14.357 -6.898 1.00 0.00 C ATOM 28 CD1 LEU A 3 17.030 -13.444 -7.821 1.00 0.00 C ATOM 29 CD2 LEU A 3 16.492 -15.815 -7.271 1.00 0.00 C ATOM 0 H LEU A 3 14.162 -14.124 -5.328 1.00 0.00 H new ATOM 0 HA LEU A 3 16.148 -16.107 -4.795 1.00 0.00 H new ATOM 0 HB2 LEU A 3 16.425 -13.083 -5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 3 17.718 -14.253 -5.340 1.00 0.00 H new ATOM 0 HG LEU A 3 15.161 -14.143 -7.007 1.00 0.00 H new ATOM 0 HD11 LEU A 3 16.732 -13.618 -8.855 1.00 0.00 H new ATOM 0 HD12 LEU A 3 16.841 -12.403 -7.559 1.00 0.00 H new ATOM 0 HD13 LEU A 3 18.093 -13.659 -7.708 1.00 0.00 H new ATOM 0 HD21 LEU A 3 16.193 -15.987 -8.305 1.00 0.00 H new ATOM 0 HD22 LEU A 3 17.555 -16.030 -7.160 1.00 0.00 H new ATOM 0 HD23 LEU A 3 15.919 -16.470 -6.614 1.00 0.00 H new ATOM 41 N GLY A 4 15.630 -13.907 -2.421 1.00 0.00 N ATOM 42 CA GLY A 4 15.981 -13.616 -1.001 1.00 0.00 C ATOM 43 C GLY A 4 14.782 -12.980 -0.293 1.00 0.00 C ATOM 44 O GLY A 4 13.780 -12.670 -0.905 1.00 0.00 O ATOM 0 H GLY A 4 14.867 -13.349 -2.804 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.270 -14.535 -0.492 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.839 -12.945 -0.959 1.00 0.00 H new ATOM 48 N SER A 5 14.881 -12.786 0.994 1.00 0.00 N ATOM 49 CA SER A 5 13.750 -12.170 1.742 1.00 0.00 C ATOM 50 C SER A 5 13.860 -10.644 1.671 1.00 0.00 C ATOM 51 O SER A 5 14.929 -10.098 1.482 1.00 0.00 O ATOM 52 CB SER A 5 13.802 -12.616 3.203 1.00 0.00 C ATOM 53 OG SER A 5 14.902 -11.988 3.847 1.00 0.00 O ATOM 0 H SER A 5 15.695 -13.027 1.559 1.00 0.00 H new ATOM 0 HA SER A 5 12.806 -12.487 1.298 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.872 -12.354 3.708 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.902 -13.700 3.261 1.00 0.00 H new ATOM 0 HG SER A 5 14.937 -12.271 4.785 1.00 0.00 H new ATOM 59 N MET A 6 12.765 -9.952 1.828 1.00 0.00 N ATOM 60 CA MET A 6 12.809 -8.464 1.771 1.00 0.00 C ATOM 61 C MET A 6 11.582 -7.888 2.482 1.00 0.00 C ATOM 62 O MET A 6 10.750 -7.243 1.877 1.00 0.00 O ATOM 63 CB MET A 6 12.812 -8.008 0.311 1.00 0.00 C ATOM 64 CG MET A 6 12.063 -9.031 -0.546 1.00 0.00 C ATOM 65 SD MET A 6 10.520 -9.494 0.281 1.00 0.00 S ATOM 66 CE MET A 6 9.461 -8.252 -0.496 1.00 0.00 C ATOM 0 H MET A 6 11.842 -10.353 1.993 1.00 0.00 H new ATOM 0 HA MET A 6 13.714 -8.110 2.264 1.00 0.00 H new ATOM 0 HB2 MET A 6 12.340 -7.030 0.224 1.00 0.00 H new ATOM 0 HB3 MET A 6 13.837 -7.900 -0.045 1.00 0.00 H new ATOM 0 HG2 MET A 6 11.850 -8.612 -1.529 1.00 0.00 H new ATOM 0 HG3 MET A 6 12.683 -9.914 -0.703 1.00 0.00 H new ATOM 0 HE1 MET A 6 8.555 -8.124 0.096 1.00 0.00 H new ATOM 0 HE2 MET A 6 9.994 -7.303 -0.553 1.00 0.00 H new ATOM 0 HE3 MET A 6 9.194 -8.579 -1.501 1.00 0.00 H new ATOM 76 N ALA A 7 11.467 -8.108 3.764 1.00 0.00 N ATOM 77 CA ALA A 7 10.297 -7.567 4.513 1.00 0.00 C ATOM 78 C ALA A 7 8.997 -7.995 3.829 1.00 0.00 C ATOM 79 O ALA A 7 8.992 -8.449 2.702 1.00 0.00 O ATOM 80 CB ALA A 7 10.380 -6.037 4.538 1.00 0.00 C ATOM 0 H ALA A 7 12.133 -8.639 4.325 1.00 0.00 H new ATOM 0 HA ALA A 7 10.309 -7.955 5.531 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.527 -5.635 5.085 1.00 0.00 H new ATOM 0 HB2 ALA A 7 11.303 -5.731 5.030 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.369 -5.655 3.517 1.00 0.00 H new ATOM 86 N LEU A 8 7.895 -7.851 4.509 1.00 0.00 N ATOM 87 CA LEU A 8 6.586 -8.246 3.911 1.00 0.00 C ATOM 88 C LEU A 8 5.855 -6.992 3.430 1.00 0.00 C ATOM 89 O LEU A 8 5.841 -5.979 4.101 1.00 0.00 O ATOM 90 CB LEU A 8 5.712 -8.945 4.958 1.00 0.00 C ATOM 91 CG LEU A 8 6.579 -9.710 5.962 1.00 0.00 C ATOM 92 CD1 LEU A 8 7.378 -8.720 6.812 1.00 0.00 C ATOM 93 CD2 LEU A 8 5.672 -10.528 6.878 1.00 0.00 C ATOM 0 H LEU A 8 7.842 -7.476 5.456 1.00 0.00 H new ATOM 0 HA LEU A 8 6.771 -8.926 3.079 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.104 -8.208 5.482 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.025 -9.633 4.465 1.00 0.00 H new ATOM 0 HG LEU A 8 7.264 -10.366 5.425 1.00 0.00 H new ATOM 0 HD11 LEU A 8 7.994 -9.267 7.525 1.00 0.00 H new ATOM 0 HD12 LEU A 8 8.018 -8.119 6.166 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.692 -8.067 7.351 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.280 -11.077 7.597 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.995 -9.860 7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.092 -11.232 6.281 1.00 0.00 H new ATOM 105 N ARG A 9 5.235 -7.050 2.288 1.00 0.00 N ATOM 106 CA ARG A 9 4.494 -5.860 1.792 1.00 0.00 C ATOM 107 C ARG A 9 3.056 -5.920 2.308 1.00 0.00 C ATOM 108 O ARG A 9 2.408 -6.946 2.251 1.00 0.00 O ATOM 109 CB ARG A 9 4.491 -5.850 0.263 1.00 0.00 C ATOM 110 CG ARG A 9 3.994 -4.491 -0.232 1.00 0.00 C ATOM 111 CD ARG A 9 3.892 -4.510 -1.758 1.00 0.00 C ATOM 112 NE ARG A 9 5.244 -4.740 -2.340 1.00 0.00 N ATOM 113 CZ ARG A 9 5.492 -4.396 -3.575 1.00 0.00 C ATOM 114 NH1 ARG A 9 4.553 -3.860 -4.305 1.00 0.00 N ATOM 115 NH2 ARG A 9 6.679 -4.593 -4.080 1.00 0.00 N ATOM 0 H ARG A 9 5.209 -7.867 1.678 1.00 0.00 H new ATOM 0 HA ARG A 9 4.978 -4.952 2.151 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.495 -6.043 -0.115 1.00 0.00 H new ATOM 0 HB3 ARG A 9 3.849 -6.645 -0.116 1.00 0.00 H new ATOM 0 HG2 ARG A 9 3.021 -4.266 0.205 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.677 -3.704 0.088 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.207 -5.295 -2.078 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.484 -3.565 -2.118 1.00 0.00 H new ATOM 0 HE ARG A 9 5.977 -5.167 -1.773 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.624 -3.709 -3.911 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.748 -3.592 -5.270 1.00 0.00 H new ATOM 0 HH21 ARG A 9 7.412 -5.015 -3.510 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.874 -4.325 -5.045 1.00 0.00 H new ATOM 129 N ALA A 10 2.548 -4.832 2.818 1.00 0.00 N ATOM 130 CA ALA A 10 1.151 -4.839 3.339 1.00 0.00 C ATOM 131 C ALA A 10 0.447 -3.553 2.921 1.00 0.00 C ATOM 132 O ALA A 10 1.075 -2.548 2.651 1.00 0.00 O ATOM 133 CB ALA A 10 1.173 -4.921 4.863 1.00 0.00 C ATOM 0 H ALA A 10 3.038 -3.941 2.897 1.00 0.00 H new ATOM 0 HA ALA A 10 0.620 -5.700 2.933 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.151 -4.926 5.242 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.679 -5.836 5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.705 -4.059 5.266 1.00 0.00 H new ATOM 139 N CYS A 11 -0.854 -3.569 2.867 1.00 0.00 N ATOM 140 CA CYS A 11 -1.582 -2.342 2.469 1.00 0.00 C ATOM 141 C CYS A 11 -2.906 -2.252 3.228 1.00 0.00 C ATOM 142 O CYS A 11 -3.734 -3.138 3.167 1.00 0.00 O ATOM 143 CB CYS A 11 -1.861 -2.389 0.968 1.00 0.00 C ATOM 144 SG CYS A 11 -0.613 -1.414 0.094 1.00 0.00 S ATOM 0 H CYS A 11 -1.440 -4.376 3.081 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.974 -1.469 2.706 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -1.845 -3.420 0.616 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -2.856 -1.997 0.760 1.00 0.00 H new ATOM 0 HG CYS A 11 0.508 -1.456 0.751 1.00 0.00 H new ATOM 150 N GLY A 12 -3.114 -1.171 3.923 1.00 0.00 N ATOM 151 CA GLY A 12 -4.387 -0.990 4.673 1.00 0.00 C ATOM 152 C GLY A 12 -5.044 0.296 4.173 1.00 0.00 C ATOM 153 O GLY A 12 -4.492 0.987 3.340 1.00 0.00 O ATOM 0 H GLY A 12 -2.452 -0.399 4.005 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -5.048 -1.843 4.516 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.194 -0.929 5.744 1.00 0.00 H new ATOM 157 N LEU A 13 -6.212 0.632 4.652 1.00 0.00 N ATOM 158 CA LEU A 13 -6.860 1.879 4.155 1.00 0.00 C ATOM 159 C LEU A 13 -7.197 2.818 5.310 1.00 0.00 C ATOM 160 O LEU A 13 -8.021 2.512 6.148 1.00 0.00 O ATOM 161 CB LEU A 13 -8.168 1.523 3.429 1.00 0.00 C ATOM 162 CG LEU A 13 -8.078 1.901 1.949 1.00 0.00 C ATOM 163 CD1 LEU A 13 -9.455 1.775 1.296 1.00 0.00 C ATOM 164 CD2 LEU A 13 -7.590 3.344 1.809 1.00 0.00 C ATOM 0 H LEU A 13 -6.737 0.108 5.352 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.163 2.374 3.479 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.366 0.456 3.527 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.003 2.046 3.894 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.376 1.228 1.457 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.384 2.045 0.242 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.807 0.747 1.384 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.157 2.443 1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -7.528 3.606 0.753 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.289 4.015 2.309 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.605 3.441 2.265 1.00 0.00 H new ATOM 176 N ILE A 14 -6.620 3.991 5.326 1.00 0.00 N ATOM 177 CA ILE A 14 -6.984 4.960 6.388 1.00 0.00 C ATOM 178 C ILE A 14 -8.240 5.662 5.899 1.00 0.00 C ATOM 179 O ILE A 14 -8.195 6.554 5.075 1.00 0.00 O ATOM 180 CB ILE A 14 -5.856 5.968 6.622 1.00 0.00 C ATOM 181 CG1 ILE A 14 -4.678 5.250 7.278 1.00 0.00 C ATOM 182 CG2 ILE A 14 -6.348 7.086 7.542 1.00 0.00 C ATOM 183 CD1 ILE A 14 -3.502 6.217 7.436 1.00 0.00 C ATOM 0 H ILE A 14 -5.921 4.313 4.656 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.152 4.457 7.341 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.544 6.399 5.670 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -4.974 4.862 8.252 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.378 4.395 6.672 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.543 7.802 7.707 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.195 7.592 7.079 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.657 6.662 8.497 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.665 5.699 7.904 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.199 6.584 6.456 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.804 7.058 8.061 1.00 0.00 H new ATOM 195 N ILE A 15 -9.362 5.220 6.368 1.00 0.00 N ATOM 196 CA ILE A 15 -10.653 5.787 5.913 1.00 0.00 C ATOM 197 C ILE A 15 -11.034 6.988 6.764 1.00 0.00 C ATOM 198 O ILE A 15 -10.949 6.959 7.973 1.00 0.00 O ATOM 199 CB ILE A 15 -11.698 4.685 6.059 1.00 0.00 C ATOM 200 CG1 ILE A 15 -11.321 3.533 5.132 1.00 0.00 C ATOM 201 CG2 ILE A 15 -13.094 5.196 5.706 1.00 0.00 C ATOM 202 CD1 ILE A 15 -12.066 2.267 5.551 1.00 0.00 C ATOM 0 H ILE A 15 -9.443 4.476 7.061 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.584 6.125 4.879 1.00 0.00 H new ATOM 0 HB ILE A 15 -11.718 4.350 7.096 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -11.569 3.787 4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -10.245 3.362 5.168 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.817 4.388 5.820 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.360 6.017 6.372 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -13.103 5.548 4.674 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.793 1.447 4.886 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.797 2.008 6.575 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -13.140 2.441 5.491 1.00 0.00 H new ATOM 214 N PHE A 16 -11.467 8.045 6.133 1.00 0.00 N ATOM 215 CA PHE A 16 -11.874 9.248 6.896 1.00 0.00 C ATOM 216 C PHE A 16 -13.275 9.664 6.454 1.00 0.00 C ATOM 217 O PHE A 16 -13.517 9.944 5.297 1.00 0.00 O ATOM 218 CB PHE A 16 -10.884 10.386 6.634 1.00 0.00 C ATOM 219 CG PHE A 16 -10.982 10.844 5.199 1.00 0.00 C ATOM 220 CD1 PHE A 16 -11.876 11.863 4.850 1.00 0.00 C ATOM 221 CD2 PHE A 16 -10.170 10.259 4.221 1.00 0.00 C ATOM 222 CE1 PHE A 16 -11.958 12.294 3.520 1.00 0.00 C ATOM 223 CE2 PHE A 16 -10.249 10.691 2.892 1.00 0.00 C ATOM 224 CZ PHE A 16 -11.146 11.710 2.542 1.00 0.00 C ATOM 0 H PHE A 16 -11.555 8.123 5.120 1.00 0.00 H new ATOM 0 HA PHE A 16 -11.878 9.025 7.963 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.092 11.220 7.304 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.869 10.051 6.848 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -12.501 12.316 5.605 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -9.481 9.473 4.492 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -12.649 13.078 3.249 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -9.621 10.240 2.138 1.00 0.00 H new ATOM 0 HZ PHE A 16 -11.210 12.044 1.517 1.00 0.00 H new ATOM 234 N ARG A 17 -14.202 9.703 7.370 1.00 0.00 N ATOM 235 CA ARG A 17 -15.591 10.095 7.012 1.00 0.00 C ATOM 236 C ARG A 17 -15.756 11.600 7.217 1.00 0.00 C ATOM 237 O ARG A 17 -15.692 12.099 8.323 1.00 0.00 O ATOM 238 CB ARG A 17 -16.562 9.336 7.921 1.00 0.00 C ATOM 239 CG ARG A 17 -18.004 9.626 7.512 1.00 0.00 C ATOM 240 CD ARG A 17 -18.945 8.823 8.409 1.00 0.00 C ATOM 241 NE ARG A 17 -18.895 9.367 9.795 1.00 0.00 N ATOM 242 CZ ARG A 17 -19.772 8.985 10.682 1.00 0.00 C ATOM 243 NH1 ARG A 17 -20.701 8.128 10.357 1.00 0.00 N ATOM 244 NH2 ARG A 17 -19.721 9.461 11.896 1.00 0.00 N ATOM 0 H ARG A 17 -14.056 9.479 8.354 1.00 0.00 H new ATOM 0 HA ARG A 17 -15.798 9.852 5.970 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -16.367 8.265 7.860 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -16.405 9.630 8.959 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -18.214 10.692 7.603 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -18.160 9.359 6.467 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -19.963 8.874 8.024 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -18.656 7.772 8.409 1.00 0.00 H new ATOM 0 HE ARG A 17 -18.173 10.040 10.051 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -20.742 7.756 9.408 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -21.386 7.830 11.052 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -18.996 10.131 12.151 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -20.406 9.163 12.590 1.00 0.00 H new ATOM 258 N ARG A 18 -15.965 12.328 6.154 1.00 0.00 N ATOM 259 CA ARG A 18 -16.127 13.803 6.278 1.00 0.00 C ATOM 260 C ARG A 18 -17.599 14.154 6.503 1.00 0.00 C ATOM 261 O ARG A 18 -18.484 13.602 5.875 1.00 0.00 O ATOM 262 CB ARG A 18 -15.618 14.477 5.000 1.00 0.00 C ATOM 263 CG ARG A 18 -15.752 15.995 5.133 1.00 0.00 C ATOM 264 CD ARG A 18 -15.030 16.675 3.969 1.00 0.00 C ATOM 265 NE ARG A 18 -15.667 16.268 2.683 1.00 0.00 N ATOM 266 CZ ARG A 18 -15.854 17.142 1.731 1.00 0.00 C ATOM 267 NH1 ARG A 18 -15.493 18.386 1.898 1.00 0.00 N ATOM 268 NH2 ARG A 18 -16.408 16.772 0.609 1.00 0.00 N ATOM 0 H ARG A 18 -16.031 11.963 5.204 1.00 0.00 H new ATOM 0 HA ARG A 18 -15.550 14.159 7.131 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.576 14.208 4.825 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.187 14.125 4.140 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -16.804 16.279 5.138 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -15.328 16.326 6.081 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -15.074 17.758 4.082 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -13.976 16.398 3.969 1.00 0.00 H new ATOM 0 HE ARG A 18 -15.959 15.300 2.546 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.063 18.679 2.775 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -15.641 19.065 1.151 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.694 15.802 0.477 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -16.555 17.453 -0.136 1.00 0.00 H new ATOM 282 N CYS A 19 -17.869 15.069 7.397 1.00 0.00 N ATOM 283 CA CYS A 19 -19.280 15.463 7.668 1.00 0.00 C ATOM 284 C CYS A 19 -19.654 16.655 6.788 1.00 0.00 C ATOM 285 O CYS A 19 -18.827 17.488 6.470 1.00 0.00 O ATOM 286 CB CYS A 19 -19.432 15.849 9.140 1.00 0.00 C ATOM 287 SG CYS A 19 -21.139 16.362 9.456 1.00 0.00 S ATOM 0 H CYS A 19 -17.169 15.561 7.952 1.00 0.00 H new ATOM 0 HA CYS A 19 -19.939 14.624 7.444 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.171 15.004 9.777 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -18.746 16.659 9.387 1.00 0.00 H new ATOM 0 HG CYS A 19 -21.161 17.622 9.776 1.00 0.00 H new ATOM 293 N LEU A 20 -20.893 16.744 6.384 1.00 0.00 N ATOM 294 CA LEU A 20 -21.316 17.879 5.516 1.00 0.00 C ATOM 295 C LEU A 20 -21.044 19.207 6.227 1.00 0.00 C ATOM 296 O LEU A 20 -20.612 20.167 5.622 1.00 0.00 O ATOM 297 CB LEU A 20 -22.814 17.763 5.235 1.00 0.00 C ATOM 298 CG LEU A 20 -23.133 16.352 4.749 1.00 0.00 C ATOM 299 CD1 LEU A 20 -24.598 16.280 4.313 1.00 0.00 C ATOM 300 CD2 LEU A 20 -22.231 16.000 3.563 1.00 0.00 C ATOM 0 H LEU A 20 -21.630 16.079 6.618 1.00 0.00 H new ATOM 0 HA LEU A 20 -20.755 17.847 4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -23.382 17.985 6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -23.111 18.494 4.483 1.00 0.00 H new ATOM 0 HG LEU A 20 -22.959 15.644 5.559 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -24.825 15.272 3.966 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -25.241 16.527 5.157 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -24.772 16.990 3.504 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -22.461 14.992 3.218 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -22.402 16.709 2.753 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -21.187 16.048 3.873 1.00 0.00 H new ATOM 312 N ILE A 21 -21.298 19.268 7.505 1.00 0.00 N ATOM 313 CA ILE A 21 -21.055 20.541 8.246 1.00 0.00 C ATOM 314 C ILE A 21 -20.828 20.242 9.735 1.00 0.00 C ATOM 315 O ILE A 21 -21.203 19.195 10.223 1.00 0.00 O ATOM 316 CB ILE A 21 -22.271 21.462 8.087 1.00 0.00 C ATOM 317 CG1 ILE A 21 -23.557 20.676 8.372 1.00 0.00 C ATOM 318 CG2 ILE A 21 -22.318 22.003 6.655 1.00 0.00 C ATOM 319 CD1 ILE A 21 -24.147 21.126 9.709 1.00 0.00 C ATOM 0 H ILE A 21 -21.661 18.498 8.067 1.00 0.00 H new ATOM 0 HA ILE A 21 -20.170 21.031 7.841 1.00 0.00 H new ATOM 0 HB ILE A 21 -22.188 22.290 8.791 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.279 20.838 7.572 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.344 19.607 8.398 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -23.182 22.658 6.542 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -21.407 22.565 6.448 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -22.398 21.172 5.954 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -25.061 20.567 9.910 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -23.426 20.942 10.505 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.376 22.191 9.666 1.00 0.00 H new ATOM 331 N PRO A 22 -20.226 21.163 10.455 1.00 0.00 N ATOM 332 CA PRO A 22 -19.952 21.000 11.911 1.00 0.00 C ATOM 333 C PRO A 22 -21.166 21.342 12.777 1.00 0.00 C ATOM 334 O PRO A 22 -22.287 21.336 12.316 1.00 0.00 O ATOM 335 CB PRO A 22 -18.807 21.985 12.193 1.00 0.00 C ATOM 336 CG PRO A 22 -18.619 22.814 10.953 1.00 0.00 C ATOM 337 CD PRO A 22 -19.738 22.456 9.972 1.00 0.00 C ATOM 0 HA PRO A 22 -19.706 19.966 12.152 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -19.046 22.619 13.047 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -17.891 21.449 12.440 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -18.650 23.876 11.196 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -17.644 22.618 10.507 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -20.527 23.208 9.974 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -19.367 22.387 8.950 1.00 0.00 H new ATOM 345 N LYS A 23 -20.935 21.633 14.032 1.00 0.00 N ATOM 346 CA LYS A 23 -22.048 21.979 14.973 1.00 0.00 C ATOM 347 C LYS A 23 -22.564 20.699 15.632 1.00 0.00 C ATOM 348 O LYS A 23 -21.979 20.198 16.573 1.00 0.00 O ATOM 349 CB LYS A 23 -23.201 22.667 14.233 1.00 0.00 C ATOM 350 CG LYS A 23 -22.694 23.946 13.562 1.00 0.00 C ATOM 351 CD LYS A 23 -23.869 24.682 12.913 1.00 0.00 C ATOM 352 CE LYS A 23 -23.344 25.875 12.112 1.00 0.00 C ATOM 353 NZ LYS A 23 -23.030 25.439 10.721 1.00 0.00 N ATOM 0 H LYS A 23 -20.006 21.646 14.453 1.00 0.00 H new ATOM 0 HA LYS A 23 -21.664 22.666 15.727 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -23.619 21.993 13.485 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -24.003 22.905 14.931 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -22.210 24.588 14.298 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.944 23.702 12.810 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -24.419 24.005 12.259 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -24.566 25.023 13.679 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -24.088 26.672 12.096 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -22.451 26.282 12.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -22.673 26.249 10.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -22.306 24.693 10.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -23.892 25.071 10.270 1.00 0.00 H new ATOM 367 N VAL A 24 -23.647 20.159 15.147 1.00 0.00 N ATOM 368 CA VAL A 24 -24.183 18.906 15.750 1.00 0.00 C ATOM 369 C VAL A 24 -23.234 17.760 15.413 1.00 0.00 C ATOM 370 O VAL A 24 -22.995 16.877 16.213 1.00 0.00 O ATOM 371 CB VAL A 24 -25.575 18.611 15.187 1.00 0.00 C ATOM 372 CG1 VAL A 24 -26.545 19.716 15.614 1.00 0.00 C ATOM 373 CG2 VAL A 24 -25.510 18.559 13.657 1.00 0.00 C ATOM 0 H VAL A 24 -24.183 20.529 14.362 1.00 0.00 H new ATOM 0 HA VAL A 24 -24.261 19.018 16.831 1.00 0.00 H new ATOM 0 HB VAL A 24 -25.922 17.651 15.570 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -27.536 19.505 15.213 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -26.595 19.756 16.702 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -26.195 20.675 15.232 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -26.502 18.349 13.258 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -25.161 19.518 13.275 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -24.821 17.773 13.349 1.00 0.00 H new ATOM 383 N ASP A 25 -22.672 17.788 14.240 1.00 0.00 N ATOM 384 CA ASP A 25 -21.711 16.726 13.840 1.00 0.00 C ATOM 385 C ASP A 25 -20.302 17.200 14.191 1.00 0.00 C ATOM 386 O ASP A 25 -19.334 16.495 13.994 1.00 0.00 O ATOM 387 CB ASP A 25 -21.811 16.484 12.334 1.00 0.00 C ATOM 388 CG ASP A 25 -23.192 15.917 12.003 1.00 0.00 C ATOM 389 OD1 ASP A 25 -23.855 15.455 12.915 1.00 0.00 O ATOM 390 OD2 ASP A 25 -23.563 15.955 10.840 1.00 0.00 O ATOM 0 H ASP A 25 -22.838 18.507 13.535 1.00 0.00 H new ATOM 0 HA ASP A 25 -21.937 15.796 14.362 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -21.649 17.416 11.793 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -21.034 15.790 12.013 1.00 0.00 H new ATOM 396 N ASN A 26 -20.200 18.402 14.706 1.00 0.00 N ATOM 397 CA ASN A 26 -18.875 18.980 15.087 1.00 0.00 C ATOM 398 C ASN A 26 -17.728 18.210 14.424 1.00 0.00 C ATOM 399 O ASN A 26 -17.185 18.637 13.423 1.00 0.00 O ATOM 400 CB ASN A 26 -18.728 18.941 16.610 1.00 0.00 C ATOM 401 CG ASN A 26 -18.777 17.496 17.104 1.00 0.00 C ATOM 402 OD1 ASN A 26 -19.437 16.661 16.516 1.00 0.00 O ATOM 403 ND2 ASN A 26 -18.096 17.160 18.164 1.00 0.00 N ATOM 0 H ASN A 26 -20.995 19.017 14.881 1.00 0.00 H new ATOM 0 HA ASN A 26 -18.828 20.012 14.740 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -17.785 19.403 16.904 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -19.526 19.520 17.075 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -18.117 16.197 18.500 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -17.542 17.860 18.658 1.00 0.00 H new ATOM 410 N ASN A 27 -17.350 17.090 14.969 1.00 0.00 N ATOM 411 CA ASN A 27 -16.235 16.304 14.364 1.00 0.00 C ATOM 412 C ASN A 27 -16.342 16.364 12.839 1.00 0.00 C ATOM 413 O ASN A 27 -17.078 15.615 12.229 1.00 0.00 O ATOM 414 CB ASN A 27 -16.329 14.850 14.829 1.00 0.00 C ATOM 415 CG ASN A 27 -16.192 14.795 16.351 1.00 0.00 C ATOM 416 OD1 ASN A 27 -15.649 15.698 16.957 1.00 0.00 O ATOM 417 ND2 ASN A 27 -16.668 13.768 17.002 1.00 0.00 N ATOM 0 H ASN A 27 -17.763 16.682 15.808 1.00 0.00 H new ATOM 0 HA ASN A 27 -15.279 16.723 14.677 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -17.282 14.419 14.523 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -15.545 14.255 14.360 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -16.584 13.724 18.018 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -17.124 13.009 16.495 1.00 0.00 H new ATOM 424 N ALA A 28 -15.621 17.261 12.225 1.00 0.00 N ATOM 425 CA ALA A 28 -15.685 17.384 10.741 1.00 0.00 C ATOM 426 C ALA A 28 -15.178 16.098 10.084 1.00 0.00 C ATOM 427 O ALA A 28 -15.775 15.596 9.153 1.00 0.00 O ATOM 428 CB ALA A 28 -14.815 18.560 10.293 1.00 0.00 C ATOM 0 H ALA A 28 -14.989 17.915 12.687 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.719 17.553 10.441 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -14.859 18.653 9.208 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -15.181 19.479 10.751 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -13.784 18.387 10.600 1.00 0.00 H new ATOM 434 N ILE A 29 -14.082 15.566 10.552 1.00 0.00 N ATOM 435 CA ILE A 29 -13.543 14.318 9.939 1.00 0.00 C ATOM 436 C ILE A 29 -13.421 13.208 10.978 1.00 0.00 C ATOM 437 O ILE A 29 -12.954 13.410 12.080 1.00 0.00 O ATOM 438 CB ILE A 29 -12.169 14.596 9.335 1.00 0.00 C ATOM 439 CG1 ILE A 29 -12.337 15.496 8.109 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.517 13.277 8.920 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.062 16.312 7.889 1.00 0.00 C ATOM 0 H ILE A 29 -13.538 15.940 11.330 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.234 13.993 9.161 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.535 15.092 10.070 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.549 14.890 7.228 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.187 16.163 8.250 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.536 13.476 8.489 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.406 12.635 9.794 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.144 12.778 8.181 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.186 16.952 7.015 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.869 16.930 8.766 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -10.221 15.637 7.729 1.00 0.00 H new ATOM 453 N GLU A 30 -13.819 12.024 10.609 1.00 0.00 N ATOM 454 CA GLU A 30 -13.717 10.863 11.535 1.00 0.00 C ATOM 455 C GLU A 30 -13.038 9.718 10.783 1.00 0.00 C ATOM 456 O GLU A 30 -13.123 9.636 9.577 1.00 0.00 O ATOM 457 CB GLU A 30 -15.116 10.433 11.980 1.00 0.00 C ATOM 458 CG GLU A 30 -15.798 11.591 12.706 1.00 0.00 C ATOM 459 CD GLU A 30 -17.164 11.136 13.221 1.00 0.00 C ATOM 460 OE1 GLU A 30 -17.582 10.050 12.854 1.00 0.00 O ATOM 461 OE2 GLU A 30 -17.771 11.881 13.973 1.00 0.00 O ATOM 0 H GLU A 30 -14.215 11.809 9.694 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.138 11.131 12.419 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -15.708 10.133 11.115 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -15.050 9.566 12.637 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -15.178 11.929 13.537 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -15.916 12.439 12.031 1.00 0.00 H new ATOM 469 N PHE A 31 -12.356 8.842 11.472 1.00 0.00 N ATOM 470 CA PHE A 31 -11.668 7.726 10.757 1.00 0.00 C ATOM 471 C PHE A 31 -12.283 6.381 11.149 1.00 0.00 C ATOM 472 O PHE A 31 -12.752 6.196 12.256 1.00 0.00 O ATOM 473 CB PHE A 31 -10.178 7.730 11.113 1.00 0.00 C ATOM 474 CG PHE A 31 -9.559 9.050 10.709 1.00 0.00 C ATOM 475 CD1 PHE A 31 -9.119 9.246 9.394 1.00 0.00 C ATOM 476 CD2 PHE A 31 -9.420 10.076 11.653 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.543 10.469 9.024 1.00 0.00 C ATOM 478 CE2 PHE A 31 -8.847 11.299 11.279 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.408 11.494 9.967 1.00 0.00 C ATOM 0 H PHE A 31 -12.246 8.849 12.486 1.00 0.00 H new ATOM 0 HA PHE A 31 -11.790 7.869 9.683 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.050 7.570 12.184 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.671 6.909 10.605 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -9.223 8.455 8.666 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -9.754 9.924 12.669 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -8.203 10.620 8.010 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -8.745 12.091 12.006 1.00 0.00 H new ATOM 0 HZ PHE A 31 -7.964 12.436 9.681 1.00 0.00 H new ATOM 489 N LEU A 32 -12.270 5.432 10.248 1.00 0.00 N ATOM 490 CA LEU A 32 -12.841 4.093 10.568 1.00 0.00 C ATOM 491 C LEU A 32 -11.791 3.272 11.313 1.00 0.00 C ATOM 492 O LEU A 32 -10.676 3.111 10.860 1.00 0.00 O ATOM 493 CB LEU A 32 -13.235 3.365 9.274 1.00 0.00 C ATOM 494 CG LEU A 32 -13.653 1.929 9.600 1.00 0.00 C ATOM 495 CD1 LEU A 32 -14.810 1.945 10.595 1.00 0.00 C ATOM 496 CD2 LEU A 32 -14.107 1.226 8.321 1.00 0.00 C ATOM 0 H LEU A 32 -11.889 5.528 9.307 1.00 0.00 H new ATOM 0 HA LEU A 32 -13.729 4.216 11.188 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -14.055 3.891 8.784 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.397 3.361 8.577 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.804 1.399 10.032 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.106 0.922 10.826 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.496 2.447 11.510 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.656 2.478 10.161 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.404 0.204 8.554 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.954 1.762 7.892 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.287 1.211 7.603 1.00 0.00 H new ATOM 508 N LEU A 33 -12.142 2.753 12.453 1.00 0.00 N ATOM 509 CA LEU A 33 -11.169 1.940 13.232 1.00 0.00 C ATOM 510 C LEU A 33 -11.790 0.586 13.568 1.00 0.00 C ATOM 511 O LEU A 33 -12.916 0.501 14.012 1.00 0.00 O ATOM 512 CB LEU A 33 -10.808 2.677 14.525 1.00 0.00 C ATOM 513 CG LEU A 33 -9.704 3.695 14.237 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.655 4.735 15.358 1.00 0.00 C ATOM 515 CD2 LEU A 33 -8.359 2.972 14.163 1.00 0.00 C ATOM 0 H LEU A 33 -13.062 2.856 12.881 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.267 1.786 12.640 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.687 3.181 14.927 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -10.474 1.966 15.281 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.910 4.193 13.290 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.867 5.458 15.149 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.614 5.250 15.419 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.449 4.238 16.306 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.569 3.694 13.958 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.160 2.476 15.113 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.388 2.230 13.365 1.00 0.00 H new ATOM 527 N LEU A 34 -11.061 -0.472 13.354 1.00 0.00 N ATOM 528 CA LEU A 34 -11.600 -1.823 13.654 1.00 0.00 C ATOM 529 C LEU A 34 -10.960 -2.345 14.942 1.00 0.00 C ATOM 530 O LEU A 34 -9.782 -2.156 15.181 1.00 0.00 O ATOM 531 CB LEU A 34 -11.268 -2.757 12.491 1.00 0.00 C ATOM 532 CG LEU A 34 -11.756 -2.127 11.185 1.00 0.00 C ATOM 533 CD1 LEU A 34 -11.489 -3.080 10.021 1.00 0.00 C ATOM 534 CD2 LEU A 34 -13.257 -1.857 11.286 1.00 0.00 C ATOM 0 H LEU A 34 -10.111 -0.457 12.983 1.00 0.00 H new ATOM 0 HA LEU A 34 -12.681 -1.777 13.785 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.193 -2.932 12.445 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -11.743 -3.727 12.641 1.00 0.00 H new ATOM 0 HG LEU A 34 -11.224 -1.191 11.013 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.838 -2.627 9.093 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -10.419 -3.276 9.949 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.019 -4.017 10.189 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.609 -1.408 10.357 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -13.785 -2.795 11.458 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.449 -1.175 12.114 1.00 0.00 H new ATOM 546 N GLN A 35 -11.723 -2.995 15.776 1.00 0.00 N ATOM 547 CA GLN A 35 -11.152 -3.522 17.048 1.00 0.00 C ATOM 548 C GLN A 35 -10.731 -4.978 16.852 1.00 0.00 C ATOM 549 O GLN A 35 -11.520 -5.815 16.468 1.00 0.00 O ATOM 550 CB GLN A 35 -12.207 -3.447 18.154 1.00 0.00 C ATOM 551 CG GLN A 35 -11.561 -3.793 19.496 1.00 0.00 C ATOM 552 CD GLN A 35 -12.612 -3.713 20.602 1.00 0.00 C ATOM 553 OE1 GLN A 35 -13.715 -3.258 20.374 1.00 0.00 O ATOM 554 NE2 GLN A 35 -12.317 -4.139 21.798 1.00 0.00 N ATOM 0 H GLN A 35 -12.715 -3.184 15.633 1.00 0.00 H new ATOM 0 HA GLN A 35 -10.285 -2.924 17.330 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.639 -2.447 18.193 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -13.023 -4.138 17.941 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -11.133 -4.795 19.458 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -10.743 -3.104 19.706 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.391 -4.521 21.989 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -13.012 -4.090 22.543 1.00 0.00 H new ATOM 563 N ALA A 36 -9.494 -5.288 17.117 1.00 0.00 N ATOM 564 CA ALA A 36 -9.029 -6.694 16.946 1.00 0.00 C ATOM 565 C ALA A 36 -9.879 -7.618 17.820 1.00 0.00 C ATOM 566 O ALA A 36 -10.255 -7.272 18.923 1.00 0.00 O ATOM 567 CB ALA A 36 -7.562 -6.796 17.368 1.00 0.00 C ATOM 0 H ALA A 36 -8.785 -4.631 17.444 1.00 0.00 H new ATOM 0 HA ALA A 36 -9.128 -6.990 15.902 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.218 -7.823 17.244 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -6.958 -6.134 16.747 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.463 -6.504 18.413 1.00 0.00 H new ATOM 573 N SER A 37 -10.183 -8.792 17.339 1.00 0.00 N ATOM 574 CA SER A 37 -11.006 -9.732 18.147 1.00 0.00 C ATOM 575 C SER A 37 -10.109 -10.438 19.163 1.00 0.00 C ATOM 576 O SER A 37 -10.563 -11.226 19.970 1.00 0.00 O ATOM 577 CB SER A 37 -11.654 -10.768 17.226 1.00 0.00 C ATOM 578 OG SER A 37 -10.666 -11.697 16.797 1.00 0.00 O ATOM 0 H SER A 37 -9.897 -9.139 16.424 1.00 0.00 H new ATOM 0 HA SER A 37 -11.787 -9.179 18.670 1.00 0.00 H new ATOM 0 HB2 SER A 37 -12.455 -11.288 17.751 1.00 0.00 H new ATOM 0 HB3 SER A 37 -12.105 -10.275 16.365 1.00 0.00 H new ATOM 0 HG SER A 37 -10.824 -11.932 15.859 1.00 0.00 H new ATOM 584 N ASP A 38 -8.836 -10.156 19.129 1.00 0.00 N ATOM 585 CA ASP A 38 -7.900 -10.800 20.091 1.00 0.00 C ATOM 586 C ASP A 38 -6.626 -9.966 20.188 1.00 0.00 C ATOM 587 O ASP A 38 -6.543 -8.873 19.662 1.00 0.00 O ATOM 588 CB ASP A 38 -7.548 -12.210 19.607 1.00 0.00 C ATOM 589 CG ASP A 38 -6.750 -12.936 20.691 1.00 0.00 C ATOM 590 OD1 ASP A 38 -6.245 -14.010 20.408 1.00 0.00 O ATOM 591 OD2 ASP A 38 -6.658 -12.408 21.786 1.00 0.00 O ATOM 0 H ASP A 38 -8.403 -9.505 18.474 1.00 0.00 H new ATOM 0 HA ASP A 38 -8.375 -10.864 21.070 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -8.458 -12.765 19.377 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -6.966 -12.156 18.687 1.00 0.00 H new ATOM 597 N GLY A 39 -5.629 -10.470 20.858 1.00 0.00 N ATOM 598 CA GLY A 39 -4.361 -9.700 20.987 1.00 0.00 C ATOM 599 C GLY A 39 -4.495 -8.682 22.120 1.00 0.00 C ATOM 600 O GLY A 39 -5.240 -8.879 23.061 1.00 0.00 O ATOM 0 H GLY A 39 -5.636 -11.379 21.321 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.531 -10.377 21.189 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.136 -9.190 20.050 1.00 0.00 H new ATOM 604 N ILE A 40 -3.775 -7.598 22.042 1.00 0.00 N ATOM 605 CA ILE A 40 -3.856 -6.567 23.115 1.00 0.00 C ATOM 606 C ILE A 40 -5.139 -5.751 22.951 1.00 0.00 C ATOM 607 O ILE A 40 -5.403 -4.836 23.704 1.00 0.00 O ATOM 608 CB ILE A 40 -2.638 -5.642 23.029 1.00 0.00 C ATOM 609 CG1 ILE A 40 -2.776 -4.715 21.816 1.00 0.00 C ATOM 610 CG2 ILE A 40 -1.369 -6.486 22.884 1.00 0.00 C ATOM 611 CD1 ILE A 40 -1.574 -3.769 21.761 1.00 0.00 C ATOM 0 H ILE A 40 -3.133 -7.381 21.280 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.868 -7.058 24.088 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.577 -5.040 23.936 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.833 -5.303 20.900 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -3.701 -4.142 21.885 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.501 -5.830 22.823 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.268 -7.142 23.749 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.434 -7.088 21.977 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -1.670 -3.109 20.899 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.538 -3.173 22.673 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -0.657 -4.351 21.672 1.00 0.00 H new ATOM 623 N HIS A 41 -5.938 -6.071 21.966 1.00 0.00 N ATOM 624 CA HIS A 41 -7.204 -5.313 21.750 1.00 0.00 C ATOM 625 C HIS A 41 -6.877 -3.885 21.310 1.00 0.00 C ATOM 626 O HIS A 41 -7.368 -2.926 21.872 1.00 0.00 O ATOM 627 CB HIS A 41 -8.018 -5.273 23.048 1.00 0.00 C ATOM 628 CG HIS A 41 -8.025 -6.634 23.682 1.00 0.00 C ATOM 629 ND1 HIS A 41 -8.543 -7.749 23.039 1.00 0.00 N ATOM 630 CD2 HIS A 41 -7.586 -7.077 24.906 1.00 0.00 C ATOM 631 CE1 HIS A 41 -8.406 -8.799 23.869 1.00 0.00 C ATOM 632 NE2 HIS A 41 -7.830 -8.442 25.018 1.00 0.00 N ATOM 0 H HIS A 41 -5.767 -6.826 21.302 1.00 0.00 H new ATOM 0 HA HIS A 41 -7.789 -5.809 20.976 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -7.590 -4.543 23.735 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.039 -4.953 22.839 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -7.123 -6.461 25.663 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -8.723 -9.805 23.634 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -7.614 -9.044 25.813 1.00 0.00 H new ATOM 641 N HIS A 42 -6.053 -3.733 20.309 1.00 0.00 N ATOM 642 CA HIS A 42 -5.702 -2.364 19.840 1.00 0.00 C ATOM 643 C HIS A 42 -6.597 -1.992 18.656 1.00 0.00 C ATOM 644 O HIS A 42 -7.263 -2.829 18.083 1.00 0.00 O ATOM 645 CB HIS A 42 -4.239 -2.331 19.396 1.00 0.00 C ATOM 646 CG HIS A 42 -4.050 -3.241 18.214 1.00 0.00 C ATOM 647 ND1 HIS A 42 -3.945 -4.619 18.352 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.949 -2.990 16.867 1.00 0.00 C ATOM 649 CE1 HIS A 42 -3.788 -5.140 17.121 1.00 0.00 C ATOM 650 NE2 HIS A 42 -3.785 -4.189 16.184 1.00 0.00 N ATOM 0 H HIS A 42 -5.609 -4.496 19.798 1.00 0.00 H new ATOM 0 HA HIS A 42 -5.850 -1.653 20.653 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -3.951 -1.313 19.134 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -3.592 -2.644 20.216 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -3.991 -2.012 16.410 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -3.678 -6.195 16.917 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -3.684 -4.316 15.177 1.00 0.00 H new ATOM 659 N TRP A 43 -6.618 -0.742 18.290 1.00 0.00 N ATOM 660 CA TRP A 43 -7.471 -0.317 17.145 1.00 0.00 C ATOM 661 C TRP A 43 -6.589 -0.017 15.934 1.00 0.00 C ATOM 662 O TRP A 43 -5.591 0.668 16.036 1.00 0.00 O ATOM 663 CB TRP A 43 -8.243 0.943 17.535 1.00 0.00 C ATOM 664 CG TRP A 43 -9.116 0.646 18.713 1.00 0.00 C ATOM 665 CD1 TRP A 43 -8.700 0.599 20.000 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.543 0.358 18.734 1.00 0.00 C ATOM 667 NE1 TRP A 43 -9.780 0.295 20.808 1.00 0.00 N ATOM 668 CE2 TRP A 43 -10.939 0.138 20.076 1.00 0.00 C ATOM 669 CE3 TRP A 43 -11.521 0.267 17.731 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.259 -0.163 20.408 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -12.852 -0.033 18.062 1.00 0.00 C ATOM 672 CH2 TRP A 43 -13.220 -0.249 19.399 1.00 0.00 C ATOM 0 H TRP A 43 -6.082 0.004 18.733 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.170 -1.115 16.894 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -7.549 1.748 17.777 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.849 1.286 16.696 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -7.690 0.771 20.340 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.726 0.199 21.822 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.248 0.429 16.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.536 -0.329 21.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -13.597 -0.098 17.283 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -14.245 -0.481 19.647 1.00 0.00 H new ATOM 683 N THR A 44 -6.953 -0.516 14.785 1.00 0.00 N ATOM 684 CA THR A 44 -6.140 -0.252 13.564 1.00 0.00 C ATOM 685 C THR A 44 -7.043 -0.333 12.331 1.00 0.00 C ATOM 686 O THR A 44 -8.038 -1.032 12.328 1.00 0.00 O ATOM 687 CB THR A 44 -5.031 -1.305 13.453 1.00 0.00 C ATOM 688 OG1 THR A 44 -5.367 -2.429 14.257 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.703 -0.714 13.935 1.00 0.00 C ATOM 0 H THR A 44 -7.779 -1.096 14.639 1.00 0.00 H new ATOM 0 HA THR A 44 -5.694 0.740 13.628 1.00 0.00 H new ATOM 0 HB THR A 44 -4.930 -1.613 12.412 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.857 -3.210 13.957 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.919 -1.467 13.854 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.444 0.148 13.320 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.800 -0.402 14.975 1.00 0.00 H new ATOM 697 N PRO A 45 -6.694 0.370 11.288 1.00 0.00 N ATOM 698 CA PRO A 45 -7.482 0.372 10.023 1.00 0.00 C ATOM 699 C PRO A 45 -7.413 -0.983 9.312 1.00 0.00 C ATOM 700 O PRO A 45 -6.565 -1.799 9.607 1.00 0.00 O ATOM 701 CB PRO A 45 -6.821 1.459 9.172 1.00 0.00 C ATOM 702 CG PRO A 45 -5.441 1.616 9.721 1.00 0.00 C ATOM 703 CD PRO A 45 -5.511 1.240 11.200 1.00 0.00 C ATOM 0 HA PRO A 45 -8.541 0.557 10.203 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.794 1.172 8.121 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.376 2.395 9.232 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.738 0.973 9.191 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -5.090 2.641 9.598 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.609 0.721 11.524 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.616 2.122 11.832 1.00 0.00 H new ATOM 711 N PRO A 46 -8.298 -1.227 8.384 1.00 0.00 N ATOM 712 CA PRO A 46 -8.327 -2.511 7.630 1.00 0.00 C ATOM 713 C PRO A 46 -6.955 -2.881 7.057 1.00 0.00 C ATOM 714 O PRO A 46 -6.622 -2.524 5.944 1.00 0.00 O ATOM 715 CB PRO A 46 -9.321 -2.251 6.497 1.00 0.00 C ATOM 716 CG PRO A 46 -10.196 -1.141 6.973 1.00 0.00 C ATOM 717 CD PRO A 46 -9.368 -0.311 7.955 1.00 0.00 C ATOM 0 HA PRO A 46 -8.607 -3.346 8.272 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -8.804 -1.975 5.578 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -9.906 -3.144 6.277 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -10.531 -0.528 6.136 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -11.089 -1.535 7.458 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -8.962 0.582 7.479 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -9.969 0.024 8.800 1.00 0.00 H new ATOM 725 N LYS A 47 -6.157 -3.601 7.799 1.00 0.00 N ATOM 726 CA LYS A 47 -4.815 -3.995 7.281 1.00 0.00 C ATOM 727 C LYS A 47 -4.916 -5.359 6.594 1.00 0.00 C ATOM 728 O LYS A 47 -5.580 -6.257 7.074 1.00 0.00 O ATOM 729 CB LYS A 47 -3.818 -4.088 8.437 1.00 0.00 C ATOM 730 CG LYS A 47 -3.574 -2.698 9.028 1.00 0.00 C ATOM 731 CD LYS A 47 -2.413 -2.765 10.023 1.00 0.00 C ATOM 732 CE LYS A 47 -2.816 -3.628 11.219 1.00 0.00 C ATOM 733 NZ LYS A 47 -2.195 -4.977 11.093 1.00 0.00 N ATOM 0 H LYS A 47 -6.375 -3.933 8.739 1.00 0.00 H new ATOM 0 HA LYS A 47 -4.473 -3.245 6.568 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.202 -4.758 9.207 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.878 -4.513 8.085 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -3.346 -1.988 8.233 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.475 -2.340 9.527 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.530 -3.183 9.540 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.148 -1.762 10.357 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.496 -3.154 12.147 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.901 -3.719 11.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.852 -5.697 11.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -1.987 -5.171 10.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -1.312 -5.005 11.642 1.00 0.00 H new ATOM 747 N GLY A 48 -4.262 -5.522 5.480 1.00 0.00 N ATOM 748 CA GLY A 48 -4.318 -6.829 4.768 1.00 0.00 C ATOM 749 C GLY A 48 -2.977 -7.094 4.085 1.00 0.00 C ATOM 750 O GLY A 48 -2.086 -6.266 4.107 1.00 0.00 O ATOM 0 H GLY A 48 -3.690 -4.807 5.031 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.544 -7.630 5.472 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -5.119 -6.819 4.029 1.00 0.00 H new ATOM 754 N HIS A 49 -2.826 -8.236 3.475 1.00 0.00 N ATOM 755 CA HIS A 49 -1.541 -8.550 2.788 1.00 0.00 C ATOM 756 C HIS A 49 -1.759 -8.488 1.275 1.00 0.00 C ATOM 757 O HIS A 49 -2.737 -8.990 0.759 1.00 0.00 O ATOM 758 CB HIS A 49 -1.079 -9.953 3.183 1.00 0.00 C ATOM 759 CG HIS A 49 -0.752 -9.983 4.652 1.00 0.00 C ATOM 760 ND1 HIS A 49 -1.699 -10.299 5.616 1.00 0.00 N ATOM 761 CD2 HIS A 49 0.415 -9.740 5.336 1.00 0.00 C ATOM 762 CE1 HIS A 49 -1.092 -10.238 6.817 1.00 0.00 C ATOM 763 NE2 HIS A 49 0.193 -9.902 6.700 1.00 0.00 N ATOM 0 H HIS A 49 -3.536 -8.966 3.422 1.00 0.00 H new ATOM 0 HA HIS A 49 -0.779 -7.827 3.081 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -1.860 -10.680 2.959 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -0.203 -10.236 2.599 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -2.677 -10.535 5.446 1.00 0.00 H new ATOM 0 HD2 HIS A 49 1.357 -9.466 4.885 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -1.585 -10.436 7.757 1.00 0.00 H new ATOM 772 N VAL A 50 -0.859 -7.871 0.558 1.00 0.00 N ATOM 773 CA VAL A 50 -1.029 -7.775 -0.918 1.00 0.00 C ATOM 774 C VAL A 50 -0.602 -9.088 -1.581 1.00 0.00 C ATOM 775 O VAL A 50 0.424 -9.657 -1.269 1.00 0.00 O ATOM 776 CB VAL A 50 -0.196 -6.605 -1.455 1.00 0.00 C ATOM 777 CG1 VAL A 50 0.597 -5.972 -0.313 1.00 0.00 C ATOM 778 CG2 VAL A 50 0.768 -7.093 -2.540 1.00 0.00 C ATOM 0 H VAL A 50 -0.017 -7.431 0.930 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.079 -7.597 -1.152 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.868 -5.864 -1.887 1.00 0.00 H new ATOM 0 HG11 VAL A 50 1.188 -5.141 -0.697 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.091 -5.606 0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.261 -6.717 0.126 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.353 -6.252 -2.912 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.438 -7.844 -2.121 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.200 -7.531 -3.361 1.00 0.00 H new ATOM 788 N GLU A 51 -1.400 -9.564 -2.493 1.00 0.00 N ATOM 789 CA GLU A 51 -1.082 -10.835 -3.201 1.00 0.00 C ATOM 790 C GLU A 51 0.077 -10.597 -4.173 1.00 0.00 C ATOM 791 O GLU A 51 0.618 -9.513 -4.243 1.00 0.00 O ATOM 792 CB GLU A 51 -2.328 -11.288 -3.971 1.00 0.00 C ATOM 793 CG GLU A 51 -2.828 -12.633 -3.429 1.00 0.00 C ATOM 794 CD GLU A 51 -3.614 -13.366 -4.518 1.00 0.00 C ATOM 795 OE1 GLU A 51 -4.274 -12.698 -5.296 1.00 0.00 O ATOM 796 OE2 GLU A 51 -3.542 -14.582 -4.554 1.00 0.00 O ATOM 0 H GLU A 51 -2.272 -9.121 -2.783 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.791 -11.605 -2.487 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.113 -10.537 -3.880 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -2.095 -11.379 -5.032 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -1.984 -13.242 -3.104 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.460 -12.472 -2.556 1.00 0.00 H new ATOM 804 N PRO A 52 0.465 -11.604 -4.913 1.00 0.00 N ATOM 805 CA PRO A 52 1.585 -11.504 -5.894 1.00 0.00 C ATOM 806 C PRO A 52 1.560 -10.190 -6.684 1.00 0.00 C ATOM 807 O PRO A 52 1.713 -9.119 -6.130 1.00 0.00 O ATOM 808 CB PRO A 52 1.348 -12.703 -6.811 1.00 0.00 C ATOM 809 CG PRO A 52 0.703 -13.725 -5.937 1.00 0.00 C ATOM 810 CD PRO A 52 -0.122 -12.956 -4.903 1.00 0.00 C ATOM 0 HA PRO A 52 2.561 -11.510 -5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 52 0.706 -12.438 -7.651 1.00 0.00 H new ATOM 0 HB3 PRO A 52 2.284 -13.073 -7.229 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.068 -14.391 -6.522 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.453 -14.347 -5.449 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -1.178 -12.935 -5.171 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -0.053 -13.414 -3.916 1.00 0.00 H new ATOM 818 N GLY A 53 1.374 -10.258 -7.973 1.00 0.00 N ATOM 819 CA GLY A 53 1.342 -9.010 -8.788 1.00 0.00 C ATOM 820 C GLY A 53 0.149 -8.149 -8.363 1.00 0.00 C ATOM 821 O GLY A 53 -0.194 -7.186 -9.018 1.00 0.00 O ATOM 0 H GLY A 53 1.243 -11.123 -8.498 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.270 -8.454 -8.656 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.266 -9.257 -9.847 1.00 0.00 H new ATOM 825 N GLU A 54 -0.485 -8.486 -7.272 1.00 0.00 N ATOM 826 CA GLU A 54 -1.655 -7.683 -6.817 1.00 0.00 C ATOM 827 C GLU A 54 -1.223 -6.230 -6.601 1.00 0.00 C ATOM 828 O GLU A 54 -0.091 -5.951 -6.262 1.00 0.00 O ATOM 829 CB GLU A 54 -2.198 -8.250 -5.505 1.00 0.00 C ATOM 830 CG GLU A 54 -3.502 -7.532 -5.155 1.00 0.00 C ATOM 831 CD GLU A 54 -4.015 -8.009 -3.795 1.00 0.00 C ATOM 832 OE1 GLU A 54 -3.198 -8.363 -2.966 1.00 0.00 O ATOM 833 OE2 GLU A 54 -5.221 -8.011 -3.609 1.00 0.00 O ATOM 0 H GLU A 54 -0.244 -9.280 -6.679 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.435 -7.726 -7.577 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.372 -9.322 -5.601 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.468 -8.116 -4.706 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.339 -6.455 -5.133 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.251 -7.726 -5.923 1.00 0.00 H new ATOM 841 N ASP A 55 -2.117 -5.302 -6.805 1.00 0.00 N ATOM 842 CA ASP A 55 -1.762 -3.866 -6.621 1.00 0.00 C ATOM 843 C ASP A 55 -1.630 -3.545 -5.139 1.00 0.00 C ATOM 844 O ASP A 55 -2.143 -4.242 -4.287 1.00 0.00 O ATOM 845 CB ASP A 55 -2.859 -2.981 -7.189 1.00 0.00 C ATOM 846 CG ASP A 55 -2.358 -1.539 -7.285 1.00 0.00 C ATOM 847 OD1 ASP A 55 -2.632 -0.776 -6.373 1.00 0.00 O ATOM 848 OD2 ASP A 55 -1.708 -1.222 -8.268 1.00 0.00 O ATOM 0 H ASP A 55 -3.080 -5.476 -7.092 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.819 -3.682 -7.136 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.156 -3.340 -8.175 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.743 -3.028 -6.553 1.00 0.00 H new ATOM 854 N ASP A 56 -0.959 -2.475 -4.837 1.00 0.00 N ATOM 855 CA ASP A 56 -0.797 -2.071 -3.412 1.00 0.00 C ATOM 856 C ASP A 56 -2.117 -1.491 -2.891 1.00 0.00 C ATOM 857 O ASP A 56 -2.587 -1.847 -1.828 1.00 0.00 O ATOM 858 CB ASP A 56 0.299 -1.007 -3.303 1.00 0.00 C ATOM 859 CG ASP A 56 1.640 -1.609 -3.720 1.00 0.00 C ATOM 860 OD1 ASP A 56 2.557 -0.842 -3.968 1.00 0.00 O ATOM 861 OD2 ASP A 56 1.729 -2.824 -3.782 1.00 0.00 O ATOM 0 H ASP A 56 -0.513 -1.858 -5.516 1.00 0.00 H new ATOM 0 HA ASP A 56 -0.521 -2.943 -2.819 1.00 0.00 H new ATOM 0 HB2 ASP A 56 0.058 -0.155 -3.939 1.00 0.00 H new ATOM 0 HB3 ASP A 56 0.358 -0.635 -2.280 1.00 0.00 H new ATOM 867 N LEU A 57 -2.714 -0.592 -3.633 1.00 0.00 N ATOM 868 CA LEU A 57 -3.998 0.023 -3.184 1.00 0.00 C ATOM 869 C LEU A 57 -5.135 -0.994 -3.261 1.00 0.00 C ATOM 870 O LEU A 57 -5.929 -1.113 -2.350 1.00 0.00 O ATOM 871 CB LEU A 57 -4.327 1.227 -4.070 1.00 0.00 C ATOM 872 CG LEU A 57 -5.683 1.810 -3.668 1.00 0.00 C ATOM 873 CD1 LEU A 57 -5.658 2.224 -2.197 1.00 0.00 C ATOM 874 CD2 LEU A 57 -5.984 3.037 -4.530 1.00 0.00 C ATOM 0 H LEU A 57 -2.366 -0.258 -4.532 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.888 0.347 -2.149 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.551 1.986 -3.971 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.346 0.925 -5.117 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.454 1.054 -3.817 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.627 2.638 -1.919 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.444 1.353 -1.577 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.885 2.977 -2.044 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.950 3.454 -4.245 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.207 3.786 -4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.010 2.746 -5.580 1.00 0.00 H new ATOM 886 N GLU A 58 -5.231 -1.731 -4.335 1.00 0.00 N ATOM 887 CA GLU A 58 -6.336 -2.727 -4.443 1.00 0.00 C ATOM 888 C GLU A 58 -6.293 -3.642 -3.221 1.00 0.00 C ATOM 889 O GLU A 58 -7.315 -4.010 -2.678 1.00 0.00 O ATOM 890 CB GLU A 58 -6.163 -3.557 -5.718 1.00 0.00 C ATOM 891 CG GLU A 58 -6.541 -2.715 -6.943 1.00 0.00 C ATOM 892 CD GLU A 58 -5.480 -1.644 -7.204 1.00 0.00 C ATOM 893 OE1 GLU A 58 -5.373 -0.732 -6.402 1.00 0.00 O ATOM 894 OE2 GLU A 58 -4.796 -1.748 -8.209 1.00 0.00 O ATOM 0 H GLU A 58 -4.599 -1.688 -5.135 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.296 -2.212 -4.486 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.131 -3.897 -5.804 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.789 -4.448 -5.671 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.640 -3.358 -7.817 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.511 -2.244 -6.783 1.00 0.00 H new ATOM 902 N THR A 59 -5.120 -3.988 -2.762 1.00 0.00 N ATOM 903 CA THR A 59 -5.040 -4.848 -1.554 1.00 0.00 C ATOM 904 C THR A 59 -5.741 -4.115 -0.416 1.00 0.00 C ATOM 905 O THR A 59 -6.510 -4.690 0.328 1.00 0.00 O ATOM 906 CB THR A 59 -3.575 -5.101 -1.192 1.00 0.00 C ATOM 907 OG1 THR A 59 -2.956 -5.820 -2.249 1.00 0.00 O ATOM 908 CG2 THR A 59 -3.491 -5.907 0.106 1.00 0.00 C ATOM 0 H THR A 59 -4.225 -3.714 -3.168 1.00 0.00 H new ATOM 0 HA THR A 59 -5.517 -5.811 -1.737 1.00 0.00 H new ATOM 0 HB THR A 59 -3.063 -4.150 -1.047 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.643 -5.192 -2.933 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.445 -6.083 0.358 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.969 -5.350 0.912 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.999 -6.863 -0.026 1.00 0.00 H new ATOM 916 N ALA A 60 -5.505 -2.838 -0.299 1.00 0.00 N ATOM 917 CA ALA A 60 -6.187 -2.058 0.764 1.00 0.00 C ATOM 918 C ALA A 60 -7.680 -2.038 0.451 1.00 0.00 C ATOM 919 O ALA A 60 -8.509 -2.256 1.308 1.00 0.00 O ATOM 920 CB ALA A 60 -5.643 -0.628 0.781 1.00 0.00 C ATOM 0 H ALA A 60 -4.871 -2.304 -0.893 1.00 0.00 H new ATOM 0 HA ALA A 60 -6.012 -2.511 1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.145 -0.057 1.562 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.571 -0.649 0.979 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.825 -0.158 -0.186 1.00 0.00 H new ATOM 926 N LEU A 61 -8.023 -1.802 -0.788 1.00 0.00 N ATOM 927 CA LEU A 61 -9.461 -1.789 -1.176 1.00 0.00 C ATOM 928 C LEU A 61 -10.067 -3.144 -0.826 1.00 0.00 C ATOM 929 O LEU A 61 -11.083 -3.237 -0.167 1.00 0.00 O ATOM 930 CB LEU A 61 -9.570 -1.586 -2.686 1.00 0.00 C ATOM 931 CG LEU A 61 -8.882 -0.286 -3.090 1.00 0.00 C ATOM 932 CD1 LEU A 61 -8.937 -0.151 -4.610 1.00 0.00 C ATOM 933 CD2 LEU A 61 -9.604 0.900 -2.445 1.00 0.00 C ATOM 0 H LEU A 61 -7.368 -1.618 -1.548 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.982 -0.987 -0.653 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -9.112 -2.426 -3.208 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -10.619 -1.559 -2.983 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.845 -0.298 -2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.448 0.775 -4.911 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -8.426 -0.997 -5.069 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.977 -0.135 -4.936 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -9.111 1.828 -2.735 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.641 0.920 -2.780 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -9.575 0.797 -1.360 1.00 0.00 H new ATOM 945 N ARG A 62 -9.437 -4.195 -1.268 1.00 0.00 N ATOM 946 CA ARG A 62 -9.948 -5.562 -0.972 1.00 0.00 C ATOM 947 C ARG A 62 -9.948 -5.787 0.539 1.00 0.00 C ATOM 948 O ARG A 62 -10.890 -6.306 1.099 1.00 0.00 O ATOM 949 CB ARG A 62 -9.034 -6.590 -1.646 1.00 0.00 C ATOM 950 CG ARG A 62 -9.646 -7.989 -1.530 1.00 0.00 C ATOM 951 CD ARG A 62 -8.718 -9.004 -2.199 1.00 0.00 C ATOM 952 NE ARG A 62 -9.396 -10.328 -2.283 1.00 0.00 N ATOM 953 CZ ARG A 62 -8.730 -11.383 -2.665 1.00 0.00 C ATOM 954 NH1 ARG A 62 -7.465 -11.281 -2.968 1.00 0.00 N ATOM 955 NH2 ARG A 62 -9.328 -12.538 -2.750 1.00 0.00 N ATOM 0 H ARG A 62 -8.584 -4.166 -1.826 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.964 -5.670 -1.351 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.893 -6.331 -2.695 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.049 -6.575 -1.179 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.792 -8.249 -0.482 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.628 -8.009 -2.003 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.447 -8.660 -3.197 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.792 -9.094 -1.630 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.384 -10.410 -2.041 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -6.997 -10.377 -2.906 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -6.944 -12.105 -3.267 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.318 -12.618 -2.518 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -8.806 -13.362 -3.049 1.00 0.00 H new ATOM 969 N ALA A 63 -8.899 -5.389 1.205 1.00 0.00 N ATOM 970 CA ALA A 63 -8.840 -5.575 2.682 1.00 0.00 C ATOM 971 C ALA A 63 -9.861 -4.655 3.350 1.00 0.00 C ATOM 972 O ALA A 63 -10.453 -4.991 4.355 1.00 0.00 O ATOM 973 CB ALA A 63 -7.436 -5.230 3.185 1.00 0.00 C ATOM 0 H ALA A 63 -8.081 -4.943 0.790 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.068 -6.612 2.928 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.393 -5.366 4.266 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.707 -5.885 2.707 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.207 -4.193 2.941 1.00 0.00 H new ATOM 979 N THR A 64 -10.067 -3.491 2.800 1.00 0.00 N ATOM 980 CA THR A 64 -11.042 -2.542 3.406 1.00 0.00 C ATOM 981 C THR A 64 -12.422 -3.190 3.481 1.00 0.00 C ATOM 982 O THR A 64 -13.100 -3.117 4.487 1.00 0.00 O ATOM 983 CB THR A 64 -11.121 -1.285 2.542 1.00 0.00 C ATOM 984 OG1 THR A 64 -9.813 -0.786 2.321 1.00 0.00 O ATOM 985 CG2 THR A 64 -11.954 -0.223 3.252 1.00 0.00 C ATOM 0 H THR A 64 -9.602 -3.156 1.956 1.00 0.00 H new ATOM 0 HA THR A 64 -10.714 -2.282 4.412 1.00 0.00 H new ATOM 0 HB THR A 64 -11.588 -1.531 1.588 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.312 -1.417 1.763 1.00 0.00 H new ATOM 0 HG21 THR A 64 -12.008 0.672 2.632 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.960 -0.605 3.425 1.00 0.00 H new ATOM 0 HG23 THR A 64 -11.491 0.025 4.207 1.00 0.00 H new ATOM 993 N GLN A 65 -12.850 -3.818 2.423 1.00 0.00 N ATOM 994 CA GLN A 65 -14.191 -4.462 2.431 1.00 0.00 C ATOM 995 C GLN A 65 -14.147 -5.783 3.206 1.00 0.00 C ATOM 996 O GLN A 65 -15.069 -6.120 3.918 1.00 0.00 O ATOM 997 CB GLN A 65 -14.649 -4.706 0.987 1.00 0.00 C ATOM 998 CG GLN A 65 -15.252 -6.105 0.854 1.00 0.00 C ATOM 999 CD GLN A 65 -15.895 -6.254 -0.526 1.00 0.00 C ATOM 1000 OE1 GLN A 65 -15.295 -5.921 -1.528 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -17.100 -6.748 -0.622 1.00 0.00 N ATOM 0 H GLN A 65 -12.328 -3.913 1.552 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.901 -3.800 2.927 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.386 -3.956 0.700 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -13.804 -4.600 0.307 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -14.478 -6.861 0.990 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.997 -6.267 1.633 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -17.605 -7.028 0.219 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -17.536 -6.854 -1.538 1.00 0.00 H new ATOM 1010 N GLU A 66 -13.091 -6.537 3.068 1.00 0.00 N ATOM 1011 CA GLU A 66 -13.011 -7.839 3.795 1.00 0.00 C ATOM 1012 C GLU A 66 -13.020 -7.609 5.311 1.00 0.00 C ATOM 1013 O GLU A 66 -13.611 -8.366 6.053 1.00 0.00 O ATOM 1014 CB GLU A 66 -11.722 -8.558 3.398 1.00 0.00 C ATOM 1015 CG GLU A 66 -11.829 -9.048 1.950 1.00 0.00 C ATOM 1016 CD GLU A 66 -10.537 -9.770 1.560 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -10.517 -10.373 0.500 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -9.590 -9.704 2.327 1.00 0.00 O ATOM 0 H GLU A 66 -12.284 -6.311 2.487 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.875 -8.447 3.528 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -10.872 -7.884 3.502 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -11.544 -9.401 4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -12.680 -9.720 1.844 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -12.003 -8.205 1.281 1.00 0.00 H new ATOM 1026 N GLU A 67 -12.366 -6.581 5.780 1.00 0.00 N ATOM 1027 CA GLU A 67 -12.343 -6.330 7.251 1.00 0.00 C ATOM 1028 C GLU A 67 -13.312 -5.204 7.622 1.00 0.00 C ATOM 1029 O GLU A 67 -13.459 -4.865 8.779 1.00 0.00 O ATOM 1030 CB GLU A 67 -10.929 -5.938 7.682 1.00 0.00 C ATOM 1031 CG GLU A 67 -9.966 -7.089 7.392 1.00 0.00 C ATOM 1032 CD GLU A 67 -8.573 -6.726 7.906 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -7.718 -7.595 7.909 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -8.385 -5.583 8.288 1.00 0.00 O ATOM 0 H GLU A 67 -11.850 -5.908 5.214 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.649 -7.243 7.762 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.611 -5.042 7.149 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.915 -5.698 8.745 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.317 -8.002 7.873 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.930 -7.287 6.321 1.00 0.00 H new ATOM 1042 N ALA A 68 -13.968 -4.613 6.662 1.00 0.00 N ATOM 1043 CA ALA A 68 -14.914 -3.506 6.994 1.00 0.00 C ATOM 1044 C ALA A 68 -16.159 -3.597 6.116 1.00 0.00 C ATOM 1045 O ALA A 68 -17.203 -3.080 6.455 1.00 0.00 O ATOM 1046 CB ALA A 68 -14.228 -2.161 6.755 1.00 0.00 C ATOM 0 H ALA A 68 -13.893 -4.844 5.671 1.00 0.00 H new ATOM 0 HA ALA A 68 -15.206 -3.593 8.041 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.918 -1.353 6.997 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.344 -2.086 7.388 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -13.932 -2.084 5.709 1.00 0.00 H new ATOM 1052 N GLY A 69 -16.061 -4.238 4.990 1.00 0.00 N ATOM 1053 CA GLY A 69 -17.248 -4.349 4.098 1.00 0.00 C ATOM 1054 C GLY A 69 -17.305 -3.128 3.182 1.00 0.00 C ATOM 1055 O GLY A 69 -18.198 -2.991 2.370 1.00 0.00 O ATOM 0 H GLY A 69 -15.213 -4.690 4.647 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.187 -5.261 3.504 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.159 -4.415 4.692 1.00 0.00 H new ATOM 1059 N ILE A 70 -16.359 -2.237 3.308 1.00 0.00 N ATOM 1060 CA ILE A 70 -16.365 -1.026 2.446 1.00 0.00 C ATOM 1061 C ILE A 70 -15.248 -1.148 1.402 1.00 0.00 C ATOM 1062 O ILE A 70 -14.107 -1.403 1.727 1.00 0.00 O ATOM 1063 CB ILE A 70 -16.133 0.219 3.304 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -16.968 0.131 4.589 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -16.583 1.445 2.510 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -16.381 1.052 5.662 1.00 0.00 C ATOM 0 H ILE A 70 -15.585 -2.297 3.970 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.329 -0.938 1.944 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.077 0.293 3.563 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -18.000 0.413 4.381 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -16.985 -0.897 4.951 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -16.425 2.343 3.107 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.004 1.515 1.589 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.642 1.353 2.267 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.981 0.982 6.569 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -15.357 0.750 5.880 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.387 2.081 5.302 1.00 0.00 H new ATOM 1078 N GLU A 71 -15.573 -0.973 0.149 1.00 0.00 N ATOM 1079 CA GLU A 71 -14.538 -1.085 -0.922 1.00 0.00 C ATOM 1080 C GLU A 71 -14.443 0.228 -1.696 1.00 0.00 C ATOM 1081 O GLU A 71 -15.262 1.112 -1.547 1.00 0.00 O ATOM 1082 CB GLU A 71 -14.902 -2.234 -1.871 1.00 0.00 C ATOM 1083 CG GLU A 71 -14.121 -2.118 -3.184 1.00 0.00 C ATOM 1084 CD GLU A 71 -14.461 -3.308 -4.080 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -15.236 -4.146 -3.650 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -13.946 -3.361 -5.185 1.00 0.00 O ATOM 0 H GLU A 71 -16.514 -0.757 -0.181 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.570 -1.292 -0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -14.683 -3.190 -1.395 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -15.972 -2.218 -2.076 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -14.372 -1.185 -3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.050 -2.094 -2.983 1.00 0.00 H new ATOM 1094 N ALA A 72 -13.441 0.357 -2.518 1.00 0.00 N ATOM 1095 CA ALA A 72 -13.273 1.611 -3.310 1.00 0.00 C ATOM 1096 C ALA A 72 -14.608 1.985 -3.951 1.00 0.00 C ATOM 1097 O ALA A 72 -14.949 3.146 -4.067 1.00 0.00 O ATOM 1098 CB ALA A 72 -12.222 1.390 -4.392 1.00 0.00 C ATOM 0 H ALA A 72 -12.727 -0.354 -2.678 1.00 0.00 H new ATOM 0 HA ALA A 72 -12.948 2.420 -2.656 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.098 2.305 -4.971 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.273 1.123 -3.928 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -12.543 0.584 -5.052 1.00 0.00 H new ATOM 1104 N GLY A 73 -15.376 1.013 -4.346 1.00 0.00 N ATOM 1105 CA GLY A 73 -16.695 1.317 -4.952 1.00 0.00 C ATOM 1106 C GLY A 73 -17.605 1.863 -3.857 1.00 0.00 C ATOM 1107 O GLY A 73 -18.743 2.216 -4.095 1.00 0.00 O ATOM 0 H GLY A 73 -15.147 0.022 -4.275 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -16.586 2.046 -5.755 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -17.127 0.419 -5.393 1.00 0.00 H new ATOM 1111 N GLN A 74 -17.106 1.926 -2.651 1.00 0.00 N ATOM 1112 CA GLN A 74 -17.932 2.439 -1.526 1.00 0.00 C ATOM 1113 C GLN A 74 -17.217 3.605 -0.824 1.00 0.00 C ATOM 1114 O GLN A 74 -17.816 4.312 -0.039 1.00 0.00 O ATOM 1115 CB GLN A 74 -18.204 1.300 -0.540 1.00 0.00 C ATOM 1116 CG GLN A 74 -19.075 0.245 -1.233 1.00 0.00 C ATOM 1117 CD GLN A 74 -19.362 -0.911 -0.274 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -18.455 -1.548 0.217 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -20.601 -1.214 0.011 1.00 0.00 N ATOM 0 H GLN A 74 -16.159 1.643 -2.399 1.00 0.00 H new ATOM 0 HA GLN A 74 -18.881 2.811 -1.913 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -17.266 0.856 -0.208 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -18.708 1.682 0.348 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -20.011 0.695 -1.563 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -18.569 -0.128 -2.123 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -21.365 -0.679 -0.402 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -20.804 -1.986 0.646 1.00 0.00 H new ATOM 1128 N LEU A 75 -15.956 3.838 -1.114 1.00 0.00 N ATOM 1129 CA LEU A 75 -15.257 4.994 -0.468 1.00 0.00 C ATOM 1130 C LEU A 75 -14.564 5.831 -1.538 1.00 0.00 C ATOM 1131 O LEU A 75 -14.664 5.567 -2.719 1.00 0.00 O ATOM 1132 CB LEU A 75 -14.195 4.562 0.568 1.00 0.00 C ATOM 1133 CG LEU A 75 -13.984 3.051 0.572 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -12.713 2.724 -0.208 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -13.811 2.563 2.011 1.00 0.00 C ATOM 0 H LEU A 75 -15.390 3.287 -1.759 1.00 0.00 H new ATOM 0 HA LEU A 75 -16.023 5.565 0.057 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.250 5.060 0.348 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.504 4.888 1.561 1.00 0.00 H new ATOM 0 HG LEU A 75 -14.845 2.563 0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.555 1.646 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.815 3.078 -1.234 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.861 3.215 0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -13.660 1.483 2.013 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.946 3.051 2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -14.704 2.806 2.587 1.00 0.00 H new ATOM 1147 N THR A 76 -13.859 6.844 -1.121 1.00 0.00 N ATOM 1148 CA THR A 76 -13.147 7.719 -2.089 1.00 0.00 C ATOM 1149 C THR A 76 -11.676 7.801 -1.689 1.00 0.00 C ATOM 1150 O THR A 76 -11.332 8.379 -0.680 1.00 0.00 O ATOM 1151 CB THR A 76 -13.774 9.117 -2.043 1.00 0.00 C ATOM 1152 OG1 THR A 76 -15.139 9.035 -2.430 1.00 0.00 O ATOM 1153 CG2 THR A 76 -13.027 10.058 -2.985 1.00 0.00 C ATOM 0 H THR A 76 -13.745 7.105 -0.141 1.00 0.00 H new ATOM 0 HA THR A 76 -13.228 7.315 -3.098 1.00 0.00 H new ATOM 0 HB THR A 76 -13.705 9.507 -1.028 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.542 9.928 -2.399 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.480 11.048 -2.945 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.983 10.124 -2.680 1.00 0.00 H new ATOM 0 HG23 THR A 76 -13.084 9.674 -4.004 1.00 0.00 H new ATOM 1161 N ILE A 77 -10.802 7.231 -2.474 1.00 0.00 N ATOM 1162 CA ILE A 77 -9.355 7.283 -2.130 1.00 0.00 C ATOM 1163 C ILE A 77 -8.798 8.647 -2.549 1.00 0.00 C ATOM 1164 O ILE A 77 -9.042 9.112 -3.644 1.00 0.00 O ATOM 1165 CB ILE A 77 -8.609 6.174 -2.879 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -9.422 4.868 -2.829 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -7.241 5.949 -2.229 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -9.454 4.310 -1.401 1.00 0.00 C ATOM 0 H ILE A 77 -11.028 6.734 -3.335 1.00 0.00 H new ATOM 0 HA ILE A 77 -9.224 7.141 -1.057 1.00 0.00 H new ATOM 0 HB ILE A 77 -8.475 6.473 -3.919 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -10.439 5.052 -3.177 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.982 4.133 -3.503 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.710 5.160 -2.762 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.661 6.871 -2.274 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.377 5.656 -1.188 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -10.033 3.387 -1.384 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -8.437 4.107 -1.067 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -9.915 5.040 -0.735 1.00 0.00 H new ATOM 1180 N ILE A 78 -8.065 9.297 -1.689 1.00 0.00 N ATOM 1181 CA ILE A 78 -7.513 10.635 -2.051 1.00 0.00 C ATOM 1182 C ILE A 78 -6.134 10.471 -2.682 1.00 0.00 C ATOM 1183 O ILE A 78 -5.324 9.674 -2.249 1.00 0.00 O ATOM 1184 CB ILE A 78 -7.427 11.513 -0.798 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -8.478 12.619 -0.887 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -6.036 12.142 -0.683 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -9.876 12.004 -0.826 1.00 0.00 C ATOM 0 H ILE A 78 -7.824 8.963 -0.756 1.00 0.00 H new ATOM 0 HA ILE A 78 -8.172 11.117 -2.773 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.608 10.896 0.082 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.345 13.327 -0.069 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -8.355 13.177 -1.815 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.990 12.763 0.212 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.285 11.355 -0.617 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.841 12.757 -1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -10.624 12.794 -0.890 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -10.006 11.313 -1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -9.996 11.466 0.114 1.00 0.00 H new ATOM 1199 N GLU A 79 -5.876 11.213 -3.719 1.00 0.00 N ATOM 1200 CA GLU A 79 -4.563 11.112 -4.417 1.00 0.00 C ATOM 1201 C GLU A 79 -3.648 12.262 -3.994 1.00 0.00 C ATOM 1202 O GLU A 79 -4.097 13.332 -3.640 1.00 0.00 O ATOM 1203 CB GLU A 79 -4.790 11.178 -5.926 1.00 0.00 C ATOM 1204 CG GLU A 79 -5.689 10.016 -6.355 1.00 0.00 C ATOM 1205 CD GLU A 79 -5.887 10.055 -7.874 1.00 0.00 C ATOM 1206 OE1 GLU A 79 -5.506 11.044 -8.476 1.00 0.00 O ATOM 1207 OE2 GLU A 79 -6.419 9.093 -8.406 1.00 0.00 O ATOM 0 H GLU A 79 -6.524 11.892 -4.118 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.091 10.167 -4.151 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.252 12.128 -6.194 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.836 11.128 -6.451 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.240 9.067 -6.061 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.653 10.083 -5.850 1.00 0.00 H new ATOM 1215 N GLY A 80 -2.362 12.044 -4.036 1.00 0.00 N ATOM 1216 CA GLY A 80 -1.405 13.118 -3.648 1.00 0.00 C ATOM 1217 C GLY A 80 -0.812 12.808 -2.274 1.00 0.00 C ATOM 1218 O GLY A 80 0.282 13.227 -1.954 1.00 0.00 O ATOM 0 H GLY A 80 -1.932 11.165 -4.323 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -0.609 13.195 -4.389 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.914 14.082 -3.626 1.00 0.00 H new ATOM 1222 N PHE A 81 -1.520 12.072 -1.460 1.00 0.00 N ATOM 1223 CA PHE A 81 -0.984 11.735 -0.110 1.00 0.00 C ATOM 1224 C PHE A 81 -0.679 10.243 -0.015 1.00 0.00 C ATOM 1225 O PHE A 81 -1.531 9.409 -0.253 1.00 0.00 O ATOM 1226 CB PHE A 81 -2.013 12.085 0.960 1.00 0.00 C ATOM 1227 CG PHE A 81 -1.549 11.511 2.273 1.00 0.00 C ATOM 1228 CD1 PHE A 81 -1.844 10.180 2.594 1.00 0.00 C ATOM 1229 CD2 PHE A 81 -0.819 12.299 3.167 1.00 0.00 C ATOM 1230 CE1 PHE A 81 -1.406 9.637 3.808 1.00 0.00 C ATOM 1231 CE2 PHE A 81 -0.383 11.759 4.382 1.00 0.00 C ATOM 1232 CZ PHE A 81 -0.675 10.427 4.701 1.00 0.00 C ATOM 0 H PHE A 81 -2.443 11.691 -1.670 1.00 0.00 H new ATOM 0 HA PHE A 81 -0.070 12.308 0.045 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -2.126 13.166 1.038 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -2.990 11.681 0.693 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.410 9.572 1.904 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -0.591 13.325 2.920 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.632 8.610 4.054 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.179 12.369 5.074 1.00 0.00 H new ATOM 0 HZ PHE A 81 -0.335 10.010 5.637 1.00 0.00 H new ATOM 1242 N LYS A 82 0.518 9.899 0.370 1.00 0.00 N ATOM 1243 CA LYS A 82 0.857 8.458 0.520 1.00 0.00 C ATOM 1244 C LYS A 82 1.971 8.306 1.548 1.00 0.00 C ATOM 1245 O LYS A 82 2.947 9.032 1.543 1.00 0.00 O ATOM 1246 CB LYS A 82 1.326 7.863 -0.800 1.00 0.00 C ATOM 1247 CG LYS A 82 1.295 6.336 -0.686 1.00 0.00 C ATOM 1248 CD LYS A 82 1.749 5.706 -2.002 1.00 0.00 C ATOM 1249 CE LYS A 82 3.256 5.902 -2.179 1.00 0.00 C ATOM 1250 NZ LYS A 82 3.502 7.047 -3.097 1.00 0.00 N ATOM 0 H LYS A 82 1.273 10.550 0.586 1.00 0.00 H new ATOM 0 HA LYS A 82 -0.040 7.930 0.844 1.00 0.00 H new ATOM 0 HB2 LYS A 82 0.682 8.195 -1.614 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.335 8.205 -1.032 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.945 6.010 0.126 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.287 6.001 -0.441 1.00 0.00 H new ATOM 0 HD2 LYS A 82 1.508 4.643 -2.009 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.214 6.159 -2.836 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.725 6.089 -1.213 1.00 0.00 H new ATOM 0 HE3 LYS A 82 3.707 4.995 -2.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 3.700 6.689 -4.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 2.661 7.658 -3.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 4.317 7.596 -2.757 1.00 0.00 H new ATOM 1264 N ARG A 83 1.833 7.360 2.421 1.00 0.00 N ATOM 1265 CA ARG A 83 2.874 7.127 3.456 1.00 0.00 C ATOM 1266 C ARG A 83 2.813 5.662 3.884 1.00 0.00 C ATOM 1267 O ARG A 83 1.745 5.094 4.005 1.00 0.00 O ATOM 1268 CB ARG A 83 2.606 8.033 4.662 1.00 0.00 C ATOM 1269 CG ARG A 83 3.699 7.840 5.719 1.00 0.00 C ATOM 1270 CD ARG A 83 4.973 8.574 5.295 1.00 0.00 C ATOM 1271 NE ARG A 83 6.012 8.407 6.350 1.00 0.00 N ATOM 1272 CZ ARG A 83 7.043 9.210 6.385 1.00 0.00 C ATOM 1273 NH1 ARG A 83 7.161 10.157 5.493 1.00 0.00 N ATOM 1274 NH2 ARG A 83 7.950 9.066 7.309 1.00 0.00 N ATOM 0 H ARG A 83 1.034 6.728 2.466 1.00 0.00 H new ATOM 0 HA ARG A 83 3.862 7.355 3.056 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.577 9.075 4.344 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.630 7.803 5.090 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.356 8.217 6.682 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.907 6.778 5.849 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.335 8.179 4.346 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.762 9.632 5.140 1.00 0.00 H new ATOM 0 HE ARG A 83 5.919 7.666 7.045 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.449 10.269 4.771 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.965 10.785 5.519 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.856 8.327 8.005 1.00 0.00 H new ATOM 0 HH22 ARG A 83 8.754 9.693 7.336 1.00 0.00 H new ATOM 1288 N GLU A 84 3.934 5.040 4.117 1.00 0.00 N ATOM 1289 CA GLU A 84 3.898 3.613 4.537 1.00 0.00 C ATOM 1290 C GLU A 84 4.586 3.448 5.887 1.00 0.00 C ATOM 1291 O GLU A 84 5.654 3.979 6.122 1.00 0.00 O ATOM 1292 CB GLU A 84 4.596 2.738 3.494 1.00 0.00 C ATOM 1293 CG GLU A 84 6.110 2.901 3.605 1.00 0.00 C ATOM 1294 CD GLU A 84 6.466 4.388 3.660 1.00 0.00 C ATOM 1295 OE1 GLU A 84 7.148 4.780 4.593 1.00 0.00 O ATOM 1296 OE2 GLU A 84 6.048 5.110 2.769 1.00 0.00 O ATOM 0 H GLU A 84 4.863 5.452 4.036 1.00 0.00 H new ATOM 0 HA GLU A 84 2.857 3.302 4.624 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.323 1.693 3.642 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.264 3.016 2.494 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.475 2.396 4.500 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.600 2.431 2.752 1.00 0.00 H new ATOM 1304 N LEU A 85 3.990 2.705 6.777 1.00 0.00 N ATOM 1305 CA LEU A 85 4.626 2.501 8.103 1.00 0.00 C ATOM 1306 C LEU A 85 5.491 1.243 8.017 1.00 0.00 C ATOM 1307 O LEU A 85 5.046 0.208 7.563 1.00 0.00 O ATOM 1308 CB LEU A 85 3.543 2.329 9.175 1.00 0.00 C ATOM 1309 CG LEU A 85 2.474 3.417 9.005 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.633 3.531 10.281 1.00 0.00 C ATOM 1311 CD2 LEU A 85 3.140 4.761 8.714 1.00 0.00 C ATOM 0 H LEU A 85 3.095 2.234 6.643 1.00 0.00 H new ATOM 0 HA LEU A 85 5.239 3.361 8.373 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.088 1.342 9.092 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.987 2.393 10.168 1.00 0.00 H new ATOM 0 HG LEU A 85 1.827 3.145 8.171 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.877 4.306 10.151 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.144 2.577 10.481 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.278 3.791 11.120 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.375 5.528 8.595 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.796 5.029 9.542 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.725 4.686 7.797 1.00 0.00 H new ATOM 1323 N ASN A 86 6.731 1.325 8.421 1.00 0.00 N ATOM 1324 CA ASN A 86 7.618 0.130 8.327 1.00 0.00 C ATOM 1325 C ASN A 86 8.188 -0.213 9.700 1.00 0.00 C ATOM 1326 O ASN A 86 8.806 0.608 10.351 1.00 0.00 O ATOM 1327 CB ASN A 86 8.767 0.438 7.361 1.00 0.00 C ATOM 1328 CG ASN A 86 8.187 0.848 6.007 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.010 0.676 5.765 1.00 0.00 O ATOM 1330 ND2 ASN A 86 8.966 1.386 5.109 1.00 0.00 N ATOM 0 H ASN A 86 7.165 2.162 8.809 1.00 0.00 H new ATOM 0 HA ASN A 86 7.040 -0.720 7.964 1.00 0.00 H new ATOM 0 HB2 ASN A 86 9.390 1.238 7.761 1.00 0.00 H new ATOM 0 HB3 ASN A 86 9.407 -0.437 7.246 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.586 1.662 4.204 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.955 1.531 5.312 1.00 0.00 H new ATOM 1337 N TYR A 87 7.999 -1.425 10.145 1.00 0.00 N ATOM 1338 CA TYR A 87 8.540 -1.821 11.469 1.00 0.00 C ATOM 1339 C TYR A 87 8.481 -3.338 11.616 1.00 0.00 C ATOM 1340 O TYR A 87 7.604 -3.993 11.088 1.00 0.00 O ATOM 1341 CB TYR A 87 7.717 -1.173 12.580 1.00 0.00 C ATOM 1342 CG TYR A 87 6.247 -1.432 12.340 1.00 0.00 C ATOM 1343 CD1 TYR A 87 5.682 -2.655 12.719 1.00 0.00 C ATOM 1344 CD2 TYR A 87 5.450 -0.451 11.735 1.00 0.00 C ATOM 1345 CE1 TYR A 87 4.320 -2.898 12.495 1.00 0.00 C ATOM 1346 CE2 TYR A 87 4.088 -0.693 11.511 1.00 0.00 C ATOM 1347 CZ TYR A 87 3.525 -1.915 11.894 1.00 0.00 C ATOM 1348 OH TYR A 87 2.183 -2.155 11.675 1.00 0.00 O ATOM 0 H TYR A 87 7.492 -2.156 9.646 1.00 0.00 H new ATOM 0 HA TYR A 87 9.575 -1.488 11.544 1.00 0.00 H new ATOM 0 HB2 TYR A 87 8.014 -1.576 13.548 1.00 0.00 H new ATOM 0 HB3 TYR A 87 7.908 -0.100 12.609 1.00 0.00 H new ATOM 0 HD1 TYR A 87 6.296 -3.412 13.184 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.886 0.492 11.441 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.884 -3.843 12.786 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.474 0.063 11.043 1.00 0.00 H new ATOM 0 HH TYR A 87 1.775 -1.371 11.251 1.00 0.00 H new ATOM 1358 N VAL A 88 9.401 -3.895 12.345 1.00 0.00 N ATOM 1359 CA VAL A 88 9.398 -5.368 12.550 1.00 0.00 C ATOM 1360 C VAL A 88 8.920 -5.662 13.969 1.00 0.00 C ATOM 1361 O VAL A 88 9.629 -5.449 14.931 1.00 0.00 O ATOM 1362 CB VAL A 88 10.811 -5.922 12.357 1.00 0.00 C ATOM 1363 CG1 VAL A 88 11.737 -5.335 13.419 1.00 0.00 C ATOM 1364 CG2 VAL A 88 10.779 -7.442 12.502 1.00 0.00 C ATOM 0 H VAL A 88 10.158 -3.394 12.810 1.00 0.00 H new ATOM 0 HA VAL A 88 8.733 -5.841 11.827 1.00 0.00 H new ATOM 0 HB VAL A 88 11.176 -5.653 11.366 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.744 -5.729 13.282 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.757 -4.249 13.325 1.00 0.00 H new ATOM 0 HG13 VAL A 88 11.373 -5.607 14.410 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.784 -7.842 12.365 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.416 -7.705 13.495 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.114 -7.865 11.749 1.00 0.00 H new ATOM 1374 N ALA A 89 7.715 -6.132 14.108 1.00 0.00 N ATOM 1375 CA ALA A 89 7.185 -6.420 15.468 1.00 0.00 C ATOM 1376 C ALA A 89 7.768 -7.726 16.007 1.00 0.00 C ATOM 1377 O ALA A 89 8.785 -7.735 16.670 1.00 0.00 O ATOM 1378 CB ALA A 89 5.659 -6.530 15.406 1.00 0.00 C ATOM 0 H ALA A 89 7.074 -6.329 13.340 1.00 0.00 H new ATOM 0 HA ALA A 89 7.472 -5.608 16.135 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.269 -6.741 16.402 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.241 -5.591 15.044 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.380 -7.337 14.728 1.00 0.00 H new ATOM 1384 N ARG A 90 7.121 -8.830 15.749 1.00 0.00 N ATOM 1385 CA ARG A 90 7.629 -10.130 16.273 1.00 0.00 C ATOM 1386 C ARG A 90 9.045 -10.397 15.751 1.00 0.00 C ATOM 1387 O ARG A 90 9.946 -10.678 16.515 1.00 0.00 O ATOM 1388 CB ARG A 90 6.693 -11.258 15.826 1.00 0.00 C ATOM 1389 CG ARG A 90 6.791 -11.443 14.310 1.00 0.00 C ATOM 1390 CD ARG A 90 5.650 -12.342 13.829 1.00 0.00 C ATOM 1391 NE ARG A 90 5.837 -12.648 12.382 1.00 0.00 N ATOM 1392 CZ ARG A 90 5.242 -11.920 11.475 1.00 0.00 C ATOM 1393 NH1 ARG A 90 4.480 -10.922 11.828 1.00 0.00 N ATOM 1394 NH2 ARG A 90 5.411 -12.192 10.209 1.00 0.00 N ATOM 0 H ARG A 90 6.264 -8.888 15.199 1.00 0.00 H new ATOM 0 HA ARG A 90 7.660 -10.088 17.362 1.00 0.00 H new ATOM 0 HB2 ARG A 90 6.959 -12.186 16.333 1.00 0.00 H new ATOM 0 HB3 ARG A 90 5.666 -11.024 16.107 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.740 -10.475 13.811 1.00 0.00 H new ATOM 0 HG3 ARG A 90 7.752 -11.886 14.049 1.00 0.00 H new ATOM 0 HD2 ARG A 90 5.631 -13.265 14.408 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.692 -11.847 13.987 1.00 0.00 H new ATOM 0 HE ARG A 90 6.431 -13.428 12.099 1.00 0.00 H new ATOM 0 HH11 ARG A 90 4.346 -10.707 12.816 1.00 0.00 H new ATOM 0 HH12 ARG A 90 4.018 -10.357 11.116 1.00 0.00 H new ATOM 0 HH21 ARG A 90 6.007 -12.972 9.930 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.947 -11.625 9.499 1.00 0.00 H new ATOM 1408 N ASN A 91 9.253 -10.310 14.463 1.00 0.00 N ATOM 1409 CA ASN A 91 10.617 -10.567 13.910 1.00 0.00 C ATOM 1410 C ASN A 91 10.597 -10.409 12.388 1.00 0.00 C ATOM 1411 O ASN A 91 11.466 -10.899 11.694 1.00 0.00 O ATOM 1412 CB ASN A 91 11.052 -11.995 14.255 1.00 0.00 C ATOM 1413 CG ASN A 91 12.549 -12.155 13.984 1.00 0.00 C ATOM 1414 OD1 ASN A 91 13.284 -11.189 13.975 1.00 0.00 O ATOM 1415 ND2 ASN A 91 13.034 -13.346 13.759 1.00 0.00 N ATOM 0 H ASN A 91 8.541 -10.073 13.772 1.00 0.00 H new ATOM 0 HA ASN A 91 11.316 -9.852 14.345 1.00 0.00 H new ATOM 0 HB2 ASN A 91 10.837 -12.209 15.302 1.00 0.00 H new ATOM 0 HB3 ASN A 91 10.486 -12.712 13.661 1.00 0.00 H new ATOM 0 HD21 ASN A 91 14.030 -13.465 13.576 1.00 0.00 H new ATOM 0 HD22 ASN A 91 12.417 -14.158 13.767 1.00 0.00 H new ATOM 1422 N LYS A 92 9.616 -9.734 11.864 1.00 0.00 N ATOM 1423 CA LYS A 92 9.544 -9.548 10.388 1.00 0.00 C ATOM 1424 C LYS A 92 9.113 -8.105 10.086 1.00 0.00 C ATOM 1425 O LYS A 92 8.101 -7.640 10.577 1.00 0.00 O ATOM 1426 CB LYS A 92 8.519 -10.530 9.812 1.00 0.00 C ATOM 1427 CG LYS A 92 9.040 -11.130 8.500 1.00 0.00 C ATOM 1428 CD LYS A 92 10.073 -12.220 8.797 1.00 0.00 C ATOM 1429 CE LYS A 92 10.527 -12.867 7.488 1.00 0.00 C ATOM 1430 NZ LYS A 92 10.731 -14.328 7.701 1.00 0.00 N ATOM 0 H LYS A 92 8.859 -9.302 12.393 1.00 0.00 H new ATOM 0 HA LYS A 92 10.518 -9.736 9.936 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.322 -11.325 10.531 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.573 -10.018 9.636 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.212 -11.548 7.928 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.489 -10.349 7.886 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.929 -11.792 9.319 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.642 -12.973 9.457 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.781 -12.703 6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.453 -12.406 7.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.040 -14.769 6.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 11.458 -14.474 8.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.838 -14.762 8.010 1.00 0.00 H new ATOM 1444 N PRO A 93 9.876 -7.395 9.292 1.00 0.00 N ATOM 1445 CA PRO A 93 9.573 -5.981 8.927 1.00 0.00 C ATOM 1446 C PRO A 93 8.448 -5.896 7.911 1.00 0.00 C ATOM 1447 O PRO A 93 8.492 -6.525 6.878 1.00 0.00 O ATOM 1448 CB PRO A 93 10.867 -5.478 8.313 1.00 0.00 C ATOM 1449 CG PRO A 93 11.511 -6.695 7.748 1.00 0.00 C ATOM 1450 CD PRO A 93 11.110 -7.860 8.644 1.00 0.00 C ATOM 0 HA PRO A 93 9.246 -5.398 9.788 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.676 -4.735 7.539 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.503 -5.004 9.061 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.183 -6.865 6.722 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.595 -6.582 7.722 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.941 -8.769 8.067 1.00 0.00 H new ATOM 0 HD3 PRO A 93 11.885 -8.087 9.376 1.00 0.00 H new ATOM 1458 N LYS A 94 7.449 -5.124 8.191 1.00 0.00 N ATOM 1459 CA LYS A 94 6.315 -5.010 7.233 1.00 0.00 C ATOM 1460 C LYS A 94 6.176 -3.579 6.729 1.00 0.00 C ATOM 1461 O LYS A 94 6.121 -2.644 7.498 1.00 0.00 O ATOM 1462 CB LYS A 94 5.010 -5.393 7.935 1.00 0.00 C ATOM 1463 CG LYS A 94 5.043 -6.864 8.359 1.00 0.00 C ATOM 1464 CD LYS A 94 3.747 -7.207 9.094 1.00 0.00 C ATOM 1465 CE LYS A 94 2.595 -7.307 8.089 1.00 0.00 C ATOM 1466 NZ LYS A 94 2.356 -8.737 7.745 1.00 0.00 N ATOM 0 H LYS A 94 7.362 -4.564 9.039 1.00 0.00 H new ATOM 0 HA LYS A 94 6.513 -5.677 6.394 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.861 -4.759 8.809 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.166 -5.219 7.267 1.00 0.00 H new ATOM 0 HG2 LYS A 94 5.159 -7.504 7.484 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.901 -7.049 9.005 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.859 -8.150 9.628 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.527 -6.443 9.839 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.691 -6.868 8.511 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.834 -6.741 7.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.355 -8.872 7.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.952 -9.004 6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.594 -9.335 8.562 1.00 0.00 H new ATOM 1480 N THR A 95 6.058 -3.406 5.442 1.00 0.00 N ATOM 1481 CA THR A 95 5.858 -2.036 4.910 1.00 0.00 C ATOM 1482 C THR A 95 4.363 -1.860 4.697 1.00 0.00 C ATOM 1483 O THR A 95 3.758 -2.548 3.901 1.00 0.00 O ATOM 1484 CB THR A 95 6.589 -1.860 3.577 1.00 0.00 C ATOM 1485 OG1 THR A 95 7.980 -1.696 3.815 1.00 0.00 O ATOM 1486 CG2 THR A 95 6.040 -0.626 2.849 1.00 0.00 C ATOM 0 H THR A 95 6.091 -4.149 4.744 1.00 0.00 H new ATOM 0 HA THR A 95 6.254 -1.297 5.606 1.00 0.00 H new ATOM 0 HB THR A 95 6.431 -2.743 2.958 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.447 -1.585 2.961 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.561 -0.502 1.900 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.974 -0.758 2.663 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.194 0.259 3.466 1.00 0.00 H new ATOM 1494 N VAL A 96 3.758 -0.966 5.413 1.00 0.00 N ATOM 1495 CA VAL A 96 2.297 -0.777 5.261 1.00 0.00 C ATOM 1496 C VAL A 96 2.038 0.548 4.555 1.00 0.00 C ATOM 1497 O VAL A 96 2.448 1.588 5.013 1.00 0.00 O ATOM 1498 CB VAL A 96 1.659 -0.759 6.652 1.00 0.00 C ATOM 1499 CG1 VAL A 96 0.148 -0.577 6.525 1.00 0.00 C ATOM 1500 CG2 VAL A 96 1.952 -2.089 7.362 1.00 0.00 C ATOM 0 H VAL A 96 4.210 -0.358 6.096 1.00 0.00 H new ATOM 0 HA VAL A 96 1.867 -1.587 4.672 1.00 0.00 H new ATOM 0 HB VAL A 96 2.075 0.067 7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.302 -0.565 7.518 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.064 0.365 6.019 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.270 -1.401 5.947 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.499 -2.080 8.353 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.536 -2.911 6.780 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.030 -2.221 7.457 1.00 0.00 H new ATOM 1510 N ILE A 97 1.356 0.512 3.443 1.00 0.00 N ATOM 1511 CA ILE A 97 1.069 1.770 2.703 1.00 0.00 C ATOM 1512 C ILE A 97 -0.355 2.204 3.031 1.00 0.00 C ATOM 1513 O ILE A 97 -1.280 1.420 2.957 1.00 0.00 O ATOM 1514 CB ILE A 97 1.206 1.514 1.199 1.00 0.00 C ATOM 1515 CG1 ILE A 97 2.574 0.869 0.919 1.00 0.00 C ATOM 1516 CG2 ILE A 97 1.074 2.834 0.433 1.00 0.00 C ATOM 1517 CD1 ILE A 97 3.582 1.917 0.435 1.00 0.00 C ATOM 0 H ILE A 97 0.985 -0.337 3.016 1.00 0.00 H new ATOM 0 HA ILE A 97 1.770 2.553 2.992 1.00 0.00 H new ATOM 0 HB ILE A 97 0.416 0.840 0.867 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.947 0.390 1.824 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.465 0.088 0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.172 2.646 -0.636 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.098 3.276 0.635 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.857 3.521 0.754 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.542 1.437 0.243 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.216 2.377 -0.483 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.706 2.683 1.200 1.00 0.00 H new ATOM 1529 N TYR A 98 -0.539 3.433 3.422 1.00 0.00 N ATOM 1530 CA TYR A 98 -1.909 3.887 3.781 1.00 0.00 C ATOM 1531 C TYR A 98 -2.391 4.999 2.852 1.00 0.00 C ATOM 1532 O TYR A 98 -1.714 5.980 2.620 1.00 0.00 O ATOM 1533 CB TYR A 98 -1.901 4.423 5.211 1.00 0.00 C ATOM 1534 CG TYR A 98 -1.910 3.274 6.190 1.00 0.00 C ATOM 1535 CD1 TYR A 98 -3.001 2.399 6.235 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.829 3.088 7.056 1.00 0.00 C ATOM 1537 CE1 TYR A 98 -3.012 1.339 7.149 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.840 2.029 7.973 1.00 0.00 C ATOM 1539 CZ TYR A 98 -1.932 1.154 8.019 1.00 0.00 C ATOM 1540 OH TYR A 98 -1.945 0.111 8.923 1.00 0.00 O ATOM 0 H TYR A 98 0.194 4.137 3.508 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.582 3.035 3.686 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.018 5.042 5.372 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.771 5.059 5.375 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -3.835 2.542 5.564 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.015 3.761 7.018 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -3.854 0.664 7.183 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -0.006 1.888 8.645 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.081 0.067 9.384 1.00 0.00 H new ATOM 1550 N TRP A 99 -3.588 4.858 2.356 1.00 0.00 N ATOM 1551 CA TRP A 99 -4.178 5.902 1.480 1.00 0.00 C ATOM 1552 C TRP A 99 -5.395 6.479 2.205 1.00 0.00 C ATOM 1553 O TRP A 99 -6.121 5.762 2.863 1.00 0.00 O ATOM 1554 CB TRP A 99 -4.620 5.281 0.153 1.00 0.00 C ATOM 1555 CG TRP A 99 -3.468 5.223 -0.795 1.00 0.00 C ATOM 1556 CD1 TRP A 99 -3.012 6.265 -1.527 1.00 0.00 C ATOM 1557 CD2 TRP A 99 -2.626 4.085 -1.136 1.00 0.00 C ATOM 1558 NE1 TRP A 99 -1.943 5.840 -2.294 1.00 0.00 N ATOM 1559 CE2 TRP A 99 -1.666 4.503 -2.088 1.00 0.00 C ATOM 1560 CE3 TRP A 99 -2.601 2.744 -0.714 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 -0.718 3.621 -2.607 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 -1.648 1.852 -1.233 1.00 0.00 C ATOM 1563 CH2 TRP A 99 -0.708 2.290 -2.178 1.00 0.00 C ATOM 0 H TRP A 99 -4.189 4.051 2.524 1.00 0.00 H new ATOM 0 HA TRP A 99 -3.446 6.682 1.270 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -5.011 4.278 0.324 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -5.429 5.869 -0.281 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -3.417 7.266 -1.514 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -1.423 6.441 -2.934 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -3.319 2.397 0.014 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 0.003 3.963 -3.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -1.639 0.824 -0.903 1.00 0.00 H new ATOM 0 HH2 TRP A 99 0.023 1.600 -2.574 1.00 0.00 H new ATOM 1574 N LEU A 100 -5.632 7.754 2.102 1.00 0.00 N ATOM 1575 CA LEU A 100 -6.815 8.325 2.806 1.00 0.00 C ATOM 1576 C LEU A 100 -8.067 7.949 2.022 1.00 0.00 C ATOM 1577 O LEU A 100 -8.081 7.987 0.808 1.00 0.00 O ATOM 1578 CB LEU A 100 -6.689 9.847 2.881 1.00 0.00 C ATOM 1579 CG LEU A 100 -5.214 10.243 2.813 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -5.072 11.744 3.068 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -4.425 9.474 3.872 1.00 0.00 C ATOM 0 H LEU A 100 -5.069 8.418 1.570 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.874 7.930 3.820 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.238 10.308 2.060 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.132 10.214 3.807 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.825 10.003 1.824 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.020 12.023 3.019 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.630 12.296 2.311 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.465 11.984 4.056 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.374 9.759 3.821 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.817 9.711 4.861 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.520 8.403 3.691 1.00 0.00 H new ATOM 1593 N ALA A 101 -9.120 7.571 2.694 1.00 0.00 N ATOM 1594 CA ALA A 101 -10.355 7.180 1.960 1.00 0.00 C ATOM 1595 C ALA A 101 -11.594 7.706 2.683 1.00 0.00 C ATOM 1596 O ALA A 101 -11.598 7.879 3.884 1.00 0.00 O ATOM 1597 CB ALA A 101 -10.429 5.655 1.878 1.00 0.00 C ATOM 0 H ALA A 101 -9.178 7.516 3.711 1.00 0.00 H new ATOM 0 HA ALA A 101 -10.322 7.609 0.958 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.332 5.363 1.341 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.554 5.276 1.350 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -10.454 5.237 2.884 1.00 0.00 H new ATOM 1603 N GLU A 102 -12.650 7.952 1.956 1.00 0.00 N ATOM 1604 CA GLU A 102 -13.899 8.457 2.591 1.00 0.00 C ATOM 1605 C GLU A 102 -15.065 7.559 2.178 1.00 0.00 C ATOM 1606 O GLU A 102 -15.345 7.400 1.009 1.00 0.00 O ATOM 1607 CB GLU A 102 -14.167 9.887 2.116 1.00 0.00 C ATOM 1608 CG GLU A 102 -15.401 10.443 2.825 1.00 0.00 C ATOM 1609 CD GLU A 102 -15.737 11.823 2.257 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -15.024 12.267 1.373 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -16.703 12.411 2.715 1.00 0.00 O ATOM 0 H GLU A 102 -12.701 7.824 0.945 1.00 0.00 H new ATOM 0 HA GLU A 102 -13.792 8.449 3.676 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.302 10.517 2.323 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -14.319 9.899 1.037 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -16.246 9.767 2.691 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -15.217 10.514 3.897 1.00 0.00 H new ATOM 1619 N VAL A 103 -15.746 6.971 3.124 1.00 0.00 N ATOM 1620 CA VAL A 103 -16.887 6.084 2.767 1.00 0.00 C ATOM 1621 C VAL A 103 -18.069 6.932 2.286 1.00 0.00 C ATOM 1622 O VAL A 103 -18.452 7.906 2.904 1.00 0.00 O ATOM 1623 CB VAL A 103 -17.269 5.231 3.976 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -16.008 4.580 4.523 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -17.892 6.094 5.069 1.00 0.00 C ATOM 0 H VAL A 103 -15.562 7.066 4.123 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.599 5.415 1.956 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.995 4.478 3.668 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.261 3.966 5.388 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -15.558 3.954 3.753 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -15.300 5.353 4.821 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -18.157 5.467 5.921 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -17.177 6.853 5.385 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.788 6.579 4.683 1.00 0.00 H new ATOM 1635 N LYS A 104 -18.614 6.575 1.155 1.00 0.00 N ATOM 1636 CA LYS A 104 -19.743 7.347 0.555 1.00 0.00 C ATOM 1637 C LYS A 104 -20.943 7.415 1.503 1.00 0.00 C ATOM 1638 O LYS A 104 -21.583 8.440 1.628 1.00 0.00 O ATOM 1639 CB LYS A 104 -20.186 6.637 -0.721 1.00 0.00 C ATOM 1640 CG LYS A 104 -19.028 6.571 -1.712 1.00 0.00 C ATOM 1641 CD LYS A 104 -19.463 5.744 -2.917 1.00 0.00 C ATOM 1642 CE LYS A 104 -18.247 5.418 -3.786 1.00 0.00 C ATOM 1643 NZ LYS A 104 -18.677 5.266 -5.205 1.00 0.00 N ATOM 0 H LYS A 104 -18.319 5.765 0.610 1.00 0.00 H new ATOM 0 HA LYS A 104 -19.399 8.362 0.355 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -20.531 5.630 -0.485 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -21.028 7.166 -1.168 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -18.742 7.575 -2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -18.153 6.122 -1.242 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -19.941 4.823 -2.584 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -20.202 6.294 -3.500 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -17.504 6.211 -3.703 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -17.773 4.500 -3.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -17.851 5.044 -5.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -19.371 4.495 -5.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -19.110 6.153 -5.533 1.00 0.00 H new ATOM 1657 N ASP A 105 -21.281 6.332 2.141 1.00 0.00 N ATOM 1658 CA ASP A 105 -22.474 6.354 3.037 1.00 0.00 C ATOM 1659 C ASP A 105 -22.082 6.717 4.465 1.00 0.00 C ATOM 1660 O ASP A 105 -21.169 6.161 5.038 1.00 0.00 O ATOM 1661 CB ASP A 105 -23.141 4.982 3.036 1.00 0.00 C ATOM 1662 CG ASP A 105 -24.495 5.063 2.325 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -24.820 4.133 1.607 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -25.183 6.053 2.515 1.00 0.00 O ATOM 0 H ASP A 105 -20.790 5.440 2.084 1.00 0.00 H new ATOM 0 HA ASP A 105 -23.166 7.109 2.662 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.500 4.256 2.535 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.278 4.633 4.060 1.00 0.00 H new ATOM 1670 N TYR A 106 -22.791 7.642 5.046 1.00 0.00 N ATOM 1671 CA TYR A 106 -22.496 8.046 6.449 1.00 0.00 C ATOM 1672 C TYR A 106 -22.730 6.833 7.349 1.00 0.00 C ATOM 1673 O TYR A 106 -21.973 6.558 8.258 1.00 0.00 O ATOM 1674 CB TYR A 106 -23.429 9.191 6.856 1.00 0.00 C ATOM 1675 CG TYR A 106 -22.954 9.800 8.157 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -21.774 10.551 8.181 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -23.690 9.615 9.334 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -21.329 11.119 9.380 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -23.245 10.185 10.533 1.00 0.00 C ATOM 1680 CZ TYR A 106 -22.066 10.937 10.557 1.00 0.00 C ATOM 1681 OH TYR A 106 -21.629 11.500 11.739 1.00 0.00 O ATOM 0 H TYR A 106 -23.567 8.139 4.608 1.00 0.00 H new ATOM 0 HA TYR A 106 -21.465 8.387 6.543 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -23.450 9.951 6.074 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -24.448 8.820 6.968 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -21.206 10.693 7.273 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -24.600 9.033 9.317 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -20.417 11.698 9.398 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -23.813 10.044 11.441 1.00 0.00 H new ATOM 0 HH TYR A 106 -22.256 11.278 12.459 1.00 0.00 H new ATOM 1691 N ASP A 107 -23.773 6.097 7.075 1.00 0.00 N ATOM 1692 CA ASP A 107 -24.079 4.878 7.874 1.00 0.00 C ATOM 1693 C ASP A 107 -23.630 3.656 7.073 1.00 0.00 C ATOM 1694 O ASP A 107 -24.133 2.564 7.243 1.00 0.00 O ATOM 1695 CB ASP A 107 -25.587 4.795 8.132 1.00 0.00 C ATOM 1696 CG ASP A 107 -25.876 3.646 9.101 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -27.038 3.425 9.401 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -24.929 3.006 9.527 1.00 0.00 O ATOM 0 H ASP A 107 -24.433 6.292 6.322 1.00 0.00 H new ATOM 0 HA ASP A 107 -23.559 4.916 8.831 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.948 5.736 8.548 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -26.119 4.637 7.194 1.00 0.00 H new ATOM 1704 N VAL A 108 -22.686 3.844 6.189 1.00 0.00 N ATOM 1705 CA VAL A 108 -22.192 2.714 5.356 1.00 0.00 C ATOM 1706 C VAL A 108 -22.074 1.460 6.220 1.00 0.00 C ATOM 1707 O VAL A 108 -21.747 1.523 7.389 1.00 0.00 O ATOM 1708 CB VAL A 108 -20.827 3.088 4.784 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -19.930 3.580 5.913 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -20.184 1.873 4.117 1.00 0.00 C ATOM 0 H VAL A 108 -22.234 4.740 6.009 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.887 2.515 4.540 1.00 0.00 H new ATOM 0 HB VAL A 108 -20.953 3.874 4.040 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.953 3.849 5.511 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -20.382 4.454 6.382 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.812 2.790 6.655 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.211 2.152 3.713 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -20.057 1.079 4.853 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -20.825 1.520 3.309 1.00 0.00 H new ATOM 1720 N GLU A 109 -22.353 0.322 5.653 1.00 0.00 N ATOM 1721 CA GLU A 109 -22.279 -0.939 6.430 1.00 0.00 C ATOM 1722 C GLU A 109 -20.839 -1.224 6.831 1.00 0.00 C ATOM 1723 O GLU A 109 -19.902 -0.917 6.122 1.00 0.00 O ATOM 1724 CB GLU A 109 -22.814 -2.099 5.590 1.00 0.00 C ATOM 1725 CG GLU A 109 -21.666 -3.034 5.204 1.00 0.00 C ATOM 1726 CD GLU A 109 -22.173 -4.082 4.216 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -21.354 -4.673 3.535 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -23.377 -4.281 4.158 1.00 0.00 O ATOM 0 H GLU A 109 -22.631 0.213 4.678 1.00 0.00 H new ATOM 0 HA GLU A 109 -22.886 -0.833 7.329 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -23.569 -2.649 6.152 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -23.300 -1.716 4.693 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -20.852 -2.463 4.758 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -21.265 -3.521 6.093 1.00 0.00 H new ATOM 1736 N ILE A 110 -20.675 -1.827 7.962 1.00 0.00 N ATOM 1737 CA ILE A 110 -19.315 -2.179 8.456 1.00 0.00 C ATOM 1738 C ILE A 110 -19.229 -3.692 8.656 1.00 0.00 C ATOM 1739 O ILE A 110 -19.845 -4.245 9.546 1.00 0.00 O ATOM 1740 CB ILE A 110 -19.048 -1.462 9.783 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -18.951 0.051 9.542 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -17.741 -1.972 10.390 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -17.789 0.352 8.589 1.00 0.00 C ATOM 0 H ILE A 110 -21.437 -2.099 8.583 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.567 -1.866 7.727 1.00 0.00 H new ATOM 0 HB ILE A 110 -19.867 -1.665 10.473 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.885 0.422 9.120 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -18.801 0.570 10.489 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -17.554 -1.460 11.334 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -17.817 -3.045 10.568 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -16.919 -1.776 9.702 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -17.725 1.427 8.422 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -16.857 -0.003 9.028 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -17.958 -0.154 7.638 1.00 0.00 H new ATOM 1755 N ARG A 111 -18.462 -4.366 7.843 1.00 0.00 N ATOM 1756 CA ARG A 111 -18.332 -5.842 7.998 1.00 0.00 C ATOM 1757 C ARG A 111 -16.979 -6.149 8.616 1.00 0.00 C ATOM 1758 O ARG A 111 -15.941 -5.877 8.042 1.00 0.00 O ATOM 1759 CB ARG A 111 -18.440 -6.523 6.634 1.00 0.00 C ATOM 1760 CG ARG A 111 -19.873 -6.395 6.128 1.00 0.00 C ATOM 1761 CD ARG A 111 -19.957 -6.868 4.675 1.00 0.00 C ATOM 1762 NE ARG A 111 -19.580 -8.310 4.594 1.00 0.00 N ATOM 1763 CZ ARG A 111 -20.159 -9.092 3.722 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -21.085 -8.621 2.927 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -19.816 -10.350 3.644 1.00 0.00 N ATOM 0 H ARG A 111 -17.921 -3.959 7.080 1.00 0.00 H new ATOM 0 HA ARG A 111 -19.130 -6.215 8.640 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -17.749 -6.063 5.928 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -18.161 -7.574 6.715 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -20.542 -6.988 6.752 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -20.203 -5.359 6.202 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -20.968 -6.724 4.293 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -19.292 -6.272 4.049 1.00 0.00 H new ATOM 0 HE ARG A 111 -18.869 -8.686 5.221 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -21.357 -7.640 2.986 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -21.534 -9.235 2.248 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -19.096 -10.722 4.264 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -20.268 -10.961 2.963 1.00 0.00 H new ATOM 1779 N LEU A 112 -16.981 -6.702 9.787 1.00 0.00 N ATOM 1780 CA LEU A 112 -15.695 -7.018 10.456 1.00 0.00 C ATOM 1781 C LEU A 112 -15.392 -8.506 10.305 1.00 0.00 C ATOM 1782 O LEU A 112 -16.258 -9.346 10.445 1.00 0.00 O ATOM 1783 CB LEU A 112 -15.796 -6.672 11.939 1.00 0.00 C ATOM 1784 CG LEU A 112 -16.414 -5.282 12.110 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -16.252 -4.835 13.566 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -15.721 -4.276 11.183 1.00 0.00 C ATOM 0 H LEU A 112 -17.819 -6.951 10.313 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.896 -6.436 9.997 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -16.404 -7.416 12.454 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -14.807 -6.698 12.395 1.00 0.00 H new ATOM 0 HG LEU A 112 -17.472 -5.326 11.852 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -16.690 -3.845 13.694 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -16.757 -5.543 14.222 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -15.193 -4.798 13.819 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.170 -3.291 11.314 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -14.660 -4.227 11.428 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.840 -4.594 10.147 1.00 0.00 H new ATOM 1798 N SER A 113 -14.163 -8.842 10.032 1.00 0.00 N ATOM 1799 CA SER A 113 -13.803 -10.277 9.887 1.00 0.00 C ATOM 1800 C SER A 113 -13.547 -10.863 11.275 1.00 0.00 C ATOM 1801 O SER A 113 -13.502 -10.151 12.258 1.00 0.00 O ATOM 1802 CB SER A 113 -12.539 -10.406 9.037 1.00 0.00 C ATOM 1803 OG SER A 113 -12.244 -11.784 8.844 1.00 0.00 O ATOM 0 H SER A 113 -13.394 -8.185 9.903 1.00 0.00 H new ATOM 0 HA SER A 113 -14.617 -10.815 9.401 1.00 0.00 H new ATOM 0 HB2 SER A 113 -12.682 -9.914 8.075 1.00 0.00 H new ATOM 0 HB3 SER A 113 -11.703 -9.908 9.529 1.00 0.00 H new ATOM 0 HG SER A 113 -11.435 -11.872 8.298 1.00 0.00 H new ATOM 1809 N HIS A 114 -13.378 -12.151 11.370 1.00 0.00 N ATOM 1810 CA HIS A 114 -13.126 -12.763 12.702 1.00 0.00 C ATOM 1811 C HIS A 114 -11.985 -12.012 13.390 1.00 0.00 C ATOM 1812 O HIS A 114 -11.949 -11.889 14.598 1.00 0.00 O ATOM 1813 CB HIS A 114 -12.738 -14.232 12.528 1.00 0.00 C ATOM 1814 CG HIS A 114 -12.615 -14.884 13.879 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -11.395 -15.012 14.528 1.00 0.00 N ATOM 1816 CD2 HIS A 114 -13.548 -15.443 14.718 1.00 0.00 C ATOM 1817 CE1 HIS A 114 -11.624 -15.626 15.704 1.00 0.00 C ATOM 1818 NE2 HIS A 114 -12.917 -15.910 15.866 1.00 0.00 N ATOM 0 H HIS A 114 -13.403 -12.804 10.587 1.00 0.00 H new ATOM 0 HA HIS A 114 -14.028 -12.700 13.310 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -13.489 -14.749 11.930 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -11.794 -14.308 11.989 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -14.607 -15.510 14.517 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -10.856 -15.860 16.427 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -13.352 -16.373 16.664 1.00 0.00 H new ATOM 1827 N GLU A 115 -11.048 -11.514 12.631 1.00 0.00 N ATOM 1828 CA GLU A 115 -9.906 -10.773 13.236 1.00 0.00 C ATOM 1829 C GLU A 115 -10.420 -9.539 13.983 1.00 0.00 C ATOM 1830 O GLU A 115 -9.879 -9.150 14.998 1.00 0.00 O ATOM 1831 CB GLU A 115 -8.951 -10.328 12.129 1.00 0.00 C ATOM 1832 CG GLU A 115 -8.336 -11.555 11.458 1.00 0.00 C ATOM 1833 CD GLU A 115 -7.505 -12.337 12.477 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -7.166 -11.764 13.501 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -7.223 -13.495 12.218 1.00 0.00 O ATOM 0 H GLU A 115 -11.024 -11.589 11.614 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.386 -11.426 13.936 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.486 -9.728 11.393 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.166 -9.696 12.545 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -9.122 -12.191 11.050 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.708 -11.248 10.621 1.00 0.00 H new ATOM 1843 N HIS A 116 -11.458 -8.919 13.489 1.00 0.00 N ATOM 1844 CA HIS A 116 -11.999 -7.710 14.175 1.00 0.00 C ATOM 1845 C HIS A 116 -13.411 -8.006 14.685 1.00 0.00 C ATOM 1846 O HIS A 116 -14.202 -8.641 14.016 1.00 0.00 O ATOM 1847 CB HIS A 116 -12.034 -6.541 13.189 1.00 0.00 C ATOM 1848 CG HIS A 116 -10.626 -6.180 12.800 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -9.804 -5.417 13.619 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -9.876 -6.478 11.688 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -8.619 -5.285 12.994 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -8.611 -5.912 11.817 1.00 0.00 N ATOM 0 H HIS A 116 -11.954 -9.197 12.642 1.00 0.00 H new ATOM 0 HA HIS A 116 -11.361 -7.448 15.019 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -12.610 -6.813 12.305 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -12.531 -5.683 13.642 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -10.215 -7.061 10.845 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -7.779 -4.739 13.396 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -7.840 -5.966 11.151 1.00 0.00 H new ATOM 1861 N GLN A 117 -13.730 -7.565 15.873 1.00 0.00 N ATOM 1862 CA GLN A 117 -15.085 -7.839 16.430 1.00 0.00 C ATOM 1863 C GLN A 117 -15.905 -6.548 16.523 1.00 0.00 C ATOM 1864 O GLN A 117 -17.120 -6.580 16.490 1.00 0.00 O ATOM 1865 CB GLN A 117 -14.942 -8.449 17.826 1.00 0.00 C ATOM 1866 CG GLN A 117 -14.263 -7.442 18.757 1.00 0.00 C ATOM 1867 CD GLN A 117 -14.116 -8.053 20.153 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -13.194 -8.802 20.407 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -14.990 -7.762 21.076 1.00 0.00 N ATOM 0 H GLN A 117 -13.111 -7.028 16.480 1.00 0.00 H new ATOM 0 HA GLN A 117 -15.602 -8.533 15.767 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -15.922 -8.719 18.218 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -14.355 -9.366 17.775 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -13.284 -7.170 18.363 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -14.851 -6.526 18.810 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -15.765 -7.133 20.865 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -14.899 -8.163 22.009 1.00 0.00 H new ATOM 1878 N ALA A 118 -15.267 -5.416 16.654 1.00 0.00 N ATOM 1879 CA ALA A 118 -16.048 -4.149 16.761 1.00 0.00 C ATOM 1880 C ALA A 118 -15.277 -2.987 16.128 1.00 0.00 C ATOM 1881 O ALA A 118 -14.070 -3.020 15.995 1.00 0.00 O ATOM 1882 CB ALA A 118 -16.308 -3.839 18.237 1.00 0.00 C ATOM 0 H ALA A 118 -14.253 -5.313 16.691 1.00 0.00 H new ATOM 0 HA ALA A 118 -16.993 -4.273 16.232 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -16.878 -2.914 18.319 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -16.874 -4.655 18.686 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -15.357 -3.727 18.758 1.00 0.00 H new ATOM 1888 N TYR A 119 -15.981 -1.954 15.744 1.00 0.00 N ATOM 1889 CA TYR A 119 -15.324 -0.768 15.122 1.00 0.00 C ATOM 1890 C TYR A 119 -15.925 0.507 15.717 1.00 0.00 C ATOM 1891 O TYR A 119 -16.999 0.487 16.285 1.00 0.00 O ATOM 1892 CB TYR A 119 -15.567 -0.780 13.613 1.00 0.00 C ATOM 1893 CG TYR A 119 -17.023 -0.483 13.347 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -17.953 -1.529 13.324 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -17.445 0.833 13.131 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -19.303 -1.260 13.085 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -18.798 1.104 12.888 1.00 0.00 C ATOM 1898 CZ TYR A 119 -19.727 0.057 12.867 1.00 0.00 C ATOM 1899 OH TYR A 119 -21.061 0.324 12.631 1.00 0.00 O ATOM 0 H TYR A 119 -16.994 -1.882 15.836 1.00 0.00 H new ATOM 0 HA TYR A 119 -14.252 -0.801 15.318 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -14.936 -0.038 13.124 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -15.299 -1.751 13.196 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -17.627 -2.545 13.491 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -16.728 1.640 13.152 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -20.020 -2.068 13.068 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -19.124 2.119 12.717 1.00 0.00 H new ATOM 0 HH TYR A 119 -21.184 1.288 12.501 1.00 0.00 H new ATOM 1909 N ARG A 120 -15.251 1.617 15.589 1.00 0.00 N ATOM 1910 CA ARG A 120 -15.804 2.885 16.147 1.00 0.00 C ATOM 1911 C ARG A 120 -15.466 4.057 15.225 1.00 0.00 C ATOM 1912 O ARG A 120 -14.437 4.083 14.580 1.00 0.00 O ATOM 1913 CB ARG A 120 -15.194 3.158 17.523 1.00 0.00 C ATOM 1914 CG ARG A 120 -15.616 2.069 18.511 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.088 2.421 19.902 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.267 1.256 20.814 1.00 0.00 N ATOM 1917 CZ ARG A 120 -14.747 1.281 22.011 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -14.072 2.327 22.407 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -14.900 0.260 22.810 1.00 0.00 N ATOM 0 H ARG A 120 -14.347 1.702 15.125 1.00 0.00 H new ATOM 0 HA ARG A 120 -16.886 2.781 16.232 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.107 3.190 17.448 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.517 4.134 17.886 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -16.702 1.982 18.533 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -15.225 1.102 18.194 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.034 2.692 19.844 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.619 3.288 20.295 1.00 0.00 H new ATOM 0 HE ARG A 120 -15.795 0.440 20.503 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -13.952 3.123 21.781 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -13.665 2.347 23.342 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -15.426 -0.557 22.499 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -14.494 0.279 23.745 1.00 0.00 H new ATOM 1933 N TRP A 121 -16.318 5.045 15.190 1.00 0.00 N ATOM 1934 CA TRP A 121 -16.046 6.244 14.348 1.00 0.00 C ATOM 1935 C TRP A 121 -15.650 7.387 15.276 1.00 0.00 C ATOM 1936 O TRP A 121 -16.468 7.918 16.000 1.00 0.00 O ATOM 1937 CB TRP A 121 -17.305 6.628 13.569 1.00 0.00 C ATOM 1938 CG TRP A 121 -17.445 5.736 12.381 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -18.249 4.652 12.311 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -16.773 5.836 11.095 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -18.112 4.075 11.059 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -17.213 4.771 10.273 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -15.833 6.739 10.566 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -16.736 4.612 8.970 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -15.352 6.581 9.260 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -15.804 5.521 8.463 1.00 0.00 C ATOM 0 H TRP A 121 -17.195 5.073 15.711 1.00 0.00 H new ATOM 0 HA TRP A 121 -15.247 6.034 13.637 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -18.183 6.540 14.209 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -17.246 7.669 13.251 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -18.893 4.294 13.101 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -18.613 3.240 10.755 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -15.479 7.560 11.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -17.085 3.793 8.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.629 7.280 8.865 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -15.432 5.406 7.456 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.397 7.756 15.285 1.00 0.00 N ATOM 1958 CA LEU A 122 -13.959 8.846 16.200 1.00 0.00 C ATOM 1959 C LEU A 122 -13.165 9.895 15.424 1.00 0.00 C ATOM 1960 O LEU A 122 -12.844 9.722 14.265 1.00 0.00 O ATOM 1961 CB LEU A 122 -13.075 8.267 17.310 1.00 0.00 C ATOM 1962 CG LEU A 122 -13.410 6.787 17.542 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -12.282 5.909 16.998 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -13.582 6.530 19.043 1.00 0.00 C ATOM 0 H LEU A 122 -13.664 7.352 14.702 1.00 0.00 H new ATOM 0 HA LEU A 122 -14.842 9.311 16.638 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.024 8.371 17.039 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.223 8.829 18.232 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.337 6.543 17.023 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.525 4.860 17.165 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.164 6.088 15.929 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.352 6.152 17.511 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -13.820 5.479 19.207 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.657 6.778 19.563 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.392 7.150 19.428 1.00 0.00 H new ATOM 1976 N GLY A 123 -12.843 10.985 16.065 1.00 0.00 N ATOM 1977 CA GLY A 123 -12.069 12.056 15.381 1.00 0.00 C ATOM 1978 C GLY A 123 -10.577 11.740 15.478 1.00 0.00 C ATOM 1979 O GLY A 123 -10.180 10.709 15.984 1.00 0.00 O ATOM 0 H GLY A 123 -13.084 11.179 17.037 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -12.370 12.128 14.336 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -12.279 13.022 15.840 1.00 0.00 H new ATOM 1983 N LEU A 124 -9.748 12.618 14.993 1.00 0.00 N ATOM 1984 CA LEU A 124 -8.281 12.376 15.050 1.00 0.00 C ATOM 1985 C LEU A 124 -7.829 12.222 16.506 1.00 0.00 C ATOM 1986 O LEU A 124 -6.983 11.410 16.815 1.00 0.00 O ATOM 1987 CB LEU A 124 -7.552 13.558 14.405 1.00 0.00 C ATOM 1988 CG LEU A 124 -6.037 13.358 14.497 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -5.665 11.949 14.033 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -5.347 14.382 13.598 1.00 0.00 C ATOM 0 H LEU A 124 -10.024 13.498 14.557 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.045 11.459 14.510 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -7.851 13.653 13.361 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.835 14.485 14.904 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.717 13.489 15.531 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.585 11.816 14.102 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.162 11.214 14.666 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -5.982 11.811 12.999 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.267 14.248 13.656 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.675 14.241 12.568 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.606 15.388 13.927 1.00 0.00 H new ATOM 2002 N GLU A 125 -8.378 13.000 17.398 1.00 0.00 N ATOM 2003 CA GLU A 125 -7.964 12.902 18.832 1.00 0.00 C ATOM 2004 C GLU A 125 -8.204 11.486 19.355 1.00 0.00 C ATOM 2005 O GLU A 125 -7.310 10.848 19.870 1.00 0.00 O ATOM 2006 CB GLU A 125 -8.779 13.897 19.668 1.00 0.00 C ATOM 2007 CG GLU A 125 -10.246 13.453 19.731 1.00 0.00 C ATOM 2008 CD GLU A 125 -11.079 14.545 20.400 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -12.291 14.410 20.421 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -10.492 15.499 20.882 1.00 0.00 O ATOM 0 H GLU A 125 -9.094 13.699 17.199 1.00 0.00 H new ATOM 0 HA GLU A 125 -6.902 13.136 18.911 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -8.367 13.962 20.675 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -8.711 14.893 19.231 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.622 13.258 18.727 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.332 12.521 20.290 1.00 0.00 H new ATOM 2018 N GLU A 126 -9.402 10.992 19.232 1.00 0.00 N ATOM 2019 CA GLU A 126 -9.693 9.620 19.725 1.00 0.00 C ATOM 2020 C GLU A 126 -9.015 8.605 18.814 1.00 0.00 C ATOM 2021 O GLU A 126 -8.362 7.688 19.264 1.00 0.00 O ATOM 2022 CB GLU A 126 -11.198 9.392 19.701 1.00 0.00 C ATOM 2023 CG GLU A 126 -11.762 9.486 21.119 1.00 0.00 C ATOM 2024 CD GLU A 126 -11.201 10.720 21.830 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -11.809 11.771 21.715 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -10.177 10.592 22.478 1.00 0.00 O ATOM 0 H GLU A 126 -10.193 11.480 18.811 1.00 0.00 H new ATOM 0 HA GLU A 126 -9.319 9.505 20.742 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.676 10.133 19.060 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.419 8.413 19.277 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.850 9.541 21.083 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.507 8.587 21.680 1.00 0.00 H new ATOM 2034 N ALA A 127 -9.142 8.764 17.531 1.00 0.00 N ATOM 2035 CA ALA A 127 -8.477 7.805 16.623 1.00 0.00 C ATOM 2036 C ALA A 127 -7.007 7.746 17.028 1.00 0.00 C ATOM 2037 O ALA A 127 -6.377 6.709 16.992 1.00 0.00 O ATOM 2038 CB ALA A 127 -8.613 8.293 15.183 1.00 0.00 C ATOM 0 H ALA A 127 -9.672 9.509 17.078 1.00 0.00 H new ATOM 0 HA ALA A 127 -8.929 6.815 16.691 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.123 7.587 14.512 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.669 8.369 14.923 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.144 9.272 15.085 1.00 0.00 H new ATOM 2044 N CYS A 128 -6.471 8.858 17.452 1.00 0.00 N ATOM 2045 CA CYS A 128 -5.055 8.885 17.906 1.00 0.00 C ATOM 2046 C CYS A 128 -4.966 8.222 19.282 1.00 0.00 C ATOM 2047 O CYS A 128 -4.025 7.514 19.580 1.00 0.00 O ATOM 2048 CB CYS A 128 -4.585 10.338 18.005 1.00 0.00 C ATOM 2049 SG CYS A 128 -3.792 10.826 16.454 1.00 0.00 S ATOM 0 H CYS A 128 -6.958 9.753 17.503 1.00 0.00 H new ATOM 0 HA CYS A 128 -4.424 8.349 17.197 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.432 10.991 18.213 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.885 10.449 18.834 1.00 0.00 H new ATOM 0 HG CYS A 128 -3.395 12.061 16.539 1.00 0.00 H new ATOM 2055 N GLN A 129 -5.941 8.448 20.125 1.00 0.00 N ATOM 2056 CA GLN A 129 -5.907 7.829 21.482 1.00 0.00 C ATOM 2057 C GLN A 129 -6.014 6.308 21.354 1.00 0.00 C ATOM 2058 O GLN A 129 -5.258 5.572 21.956 1.00 0.00 O ATOM 2059 CB GLN A 129 -7.056 8.397 22.332 1.00 0.00 C ATOM 2060 CG GLN A 129 -8.307 7.518 22.248 1.00 0.00 C ATOM 2061 CD GLN A 129 -8.141 6.290 23.146 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -7.062 6.022 23.636 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -9.178 5.537 23.391 1.00 0.00 N ATOM 0 H GLN A 129 -6.755 9.032 19.933 1.00 0.00 H new ATOM 0 HA GLN A 129 -4.965 8.064 21.976 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.736 8.477 23.371 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.296 9.405 21.994 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.184 8.088 22.555 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.474 7.206 21.217 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.083 5.765 22.978 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.084 4.721 23.995 1.00 0.00 H new ATOM 2072 N LEU A 130 -6.931 5.834 20.561 1.00 0.00 N ATOM 2073 CA LEU A 130 -7.068 4.359 20.376 1.00 0.00 C ATOM 2074 C LEU A 130 -5.855 3.848 19.604 1.00 0.00 C ATOM 2075 O LEU A 130 -5.263 2.844 19.948 1.00 0.00 O ATOM 2076 CB LEU A 130 -8.330 4.057 19.572 1.00 0.00 C ATOM 2077 CG LEU A 130 -9.564 4.477 20.366 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -10.607 5.041 19.410 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -10.153 3.259 21.074 1.00 0.00 C ATOM 0 H LEU A 130 -7.593 6.401 20.032 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.132 3.872 21.349 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -8.301 4.588 18.620 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -8.379 2.993 19.342 1.00 0.00 H new ATOM 0 HG LEU A 130 -9.283 5.231 21.101 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -11.491 5.343 19.972 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -10.195 5.906 18.891 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -10.883 4.278 18.682 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -11.034 3.559 21.641 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -10.435 2.509 20.335 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.411 2.838 21.752 1.00 0.00 H new ATOM 2091 N ALA A 131 -5.470 4.547 18.570 1.00 0.00 N ATOM 2092 CA ALA A 131 -4.282 4.120 17.788 1.00 0.00 C ATOM 2093 C ALA A 131 -3.040 4.565 18.553 1.00 0.00 C ATOM 2094 O ALA A 131 -2.165 5.223 18.026 1.00 0.00 O ATOM 2095 CB ALA A 131 -4.308 4.769 16.404 1.00 0.00 C ATOM 0 H ALA A 131 -5.929 5.394 18.236 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.279 3.038 17.655 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.433 4.451 15.837 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.213 4.466 15.877 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.297 5.854 16.511 1.00 0.00 H new ATOM 2101 N GLN A 132 -2.986 4.213 19.805 1.00 0.00 N ATOM 2102 CA GLN A 132 -1.833 4.604 20.666 1.00 0.00 C ATOM 2103 C GLN A 132 -0.536 4.555 19.865 1.00 0.00 C ATOM 2104 O GLN A 132 0.355 5.358 20.065 1.00 0.00 O ATOM 2105 CB GLN A 132 -1.726 3.626 21.830 1.00 0.00 C ATOM 2106 CG GLN A 132 -1.979 2.209 21.317 1.00 0.00 C ATOM 2107 CD GLN A 132 -0.942 1.258 21.911 1.00 0.00 C ATOM 2108 OE1 GLN A 132 0.317 1.601 21.900 1.00 0.00 O flip ATOM 2109 NE2 GLN A 132 -1.278 0.193 22.392 1.00 0.00 N flip ATOM 0 H GLN A 132 -3.703 3.662 20.278 1.00 0.00 H new ATOM 0 HA GLN A 132 -1.993 5.618 21.033 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -0.738 3.690 22.286 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.451 3.881 22.603 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -2.983 1.886 21.591 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -1.924 2.190 20.229 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -2.262 -0.075 22.401 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -0.576 -0.432 22.787 1.00 0.00 H new ATOM 2118 N PHE A 133 -0.410 3.618 18.971 1.00 0.00 N ATOM 2119 CA PHE A 133 0.845 3.532 18.179 1.00 0.00 C ATOM 2120 C PHE A 133 1.104 4.876 17.499 1.00 0.00 C ATOM 2121 O PHE A 133 0.275 5.393 16.777 1.00 0.00 O ATOM 2122 CB PHE A 133 0.704 2.438 17.118 1.00 0.00 C ATOM 2123 CG PHE A 133 0.223 1.153 17.755 1.00 0.00 C ATOM 2124 CD1 PHE A 133 0.558 0.843 19.083 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -0.561 0.266 17.009 1.00 0.00 C ATOM 2126 CE1 PHE A 133 0.105 -0.352 19.656 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -1.011 -0.928 17.585 1.00 0.00 C ATOM 2128 CZ PHE A 133 -0.678 -1.235 18.908 1.00 0.00 C ATOM 0 H PHE A 133 -1.115 2.913 18.755 1.00 0.00 H new ATOM 0 HA PHE A 133 1.679 3.290 18.837 1.00 0.00 H new ATOM 0 HB2 PHE A 133 0.001 2.756 16.348 1.00 0.00 H new ATOM 0 HB3 PHE A 133 1.662 2.272 16.626 1.00 0.00 H new ATOM 0 HD1 PHE A 133 1.164 1.525 19.661 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -0.819 0.503 15.987 1.00 0.00 H new ATOM 0 HE1 PHE A 133 0.361 -0.591 20.677 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -1.615 -1.612 17.008 1.00 0.00 H new ATOM 0 HZ PHE A 133 -1.026 -2.156 19.352 1.00 0.00 H new ATOM 2138 N LYS A 134 2.255 5.446 17.731 1.00 0.00 N ATOM 2139 CA LYS A 134 2.585 6.759 17.112 1.00 0.00 C ATOM 2140 C LYS A 134 2.485 6.657 15.589 1.00 0.00 C ATOM 2141 O LYS A 134 2.083 7.589 14.920 1.00 0.00 O ATOM 2142 CB LYS A 134 4.011 7.155 17.500 1.00 0.00 C ATOM 2143 CG LYS A 134 4.348 8.512 16.882 1.00 0.00 C ATOM 2144 CD LYS A 134 5.790 8.887 17.230 1.00 0.00 C ATOM 2145 CE LYS A 134 6.077 10.322 16.776 1.00 0.00 C ATOM 2146 NZ LYS A 134 6.041 11.233 17.955 1.00 0.00 N ATOM 0 H LYS A 134 2.985 5.055 18.327 1.00 0.00 H new ATOM 0 HA LYS A 134 1.881 7.512 17.468 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.104 7.204 18.585 1.00 0.00 H new ATOM 0 HB3 LYS A 134 4.717 6.400 17.153 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.222 8.472 15.800 1.00 0.00 H new ATOM 0 HG3 LYS A 134 3.663 9.274 17.255 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.950 8.797 18.304 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.482 8.197 16.746 1.00 0.00 H new ATOM 0 HE2 LYS A 134 7.053 10.374 16.293 1.00 0.00 H new ATOM 0 HE3 LYS A 134 5.339 10.636 16.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 6.236 12.207 17.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 5.101 11.191 18.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 6.761 10.937 18.644 1.00 0.00 H new ATOM 2160 N GLU A 135 2.861 5.540 15.040 1.00 0.00 N ATOM 2161 CA GLU A 135 2.809 5.377 13.559 1.00 0.00 C ATOM 2162 C GLU A 135 1.397 5.668 13.066 1.00 0.00 C ATOM 2163 O GLU A 135 1.198 6.352 12.082 1.00 0.00 O ATOM 2164 CB GLU A 135 3.145 3.931 13.204 1.00 0.00 C ATOM 2165 CG GLU A 135 4.256 3.434 14.123 1.00 0.00 C ATOM 2166 CD GLU A 135 4.593 1.983 13.779 1.00 0.00 C ATOM 2167 OE1 GLU A 135 4.039 1.480 12.816 1.00 0.00 O ATOM 2168 OE2 GLU A 135 5.394 1.397 14.489 1.00 0.00 O ATOM 0 H GLU A 135 3.204 4.728 15.553 1.00 0.00 H new ATOM 0 HA GLU A 135 3.520 6.062 13.096 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.261 3.303 13.310 1.00 0.00 H new ATOM 0 HB3 GLU A 135 3.460 3.863 12.163 1.00 0.00 H new ATOM 0 HG2 GLU A 135 5.141 4.060 14.012 1.00 0.00 H new ATOM 0 HG3 GLU A 135 3.942 3.508 15.164 1.00 0.00 H new ATOM 2176 N MET A 136 0.412 5.143 13.737 1.00 0.00 N ATOM 2177 CA MET A 136 -0.986 5.377 13.298 1.00 0.00 C ATOM 2178 C MET A 136 -1.419 6.777 13.713 1.00 0.00 C ATOM 2179 O MET A 136 -2.001 7.508 12.936 1.00 0.00 O ATOM 2180 CB MET A 136 -1.884 4.328 13.939 1.00 0.00 C ATOM 2181 CG MET A 136 -1.327 2.937 13.620 1.00 0.00 C ATOM 2182 SD MET A 136 -1.004 2.793 11.846 1.00 0.00 S ATOM 2183 CE MET A 136 -2.645 3.268 11.251 1.00 0.00 C ATOM 0 H MET A 136 0.516 4.563 14.569 1.00 0.00 H new ATOM 0 HA MET A 136 -1.061 5.298 12.213 1.00 0.00 H new ATOM 0 HB2 MET A 136 -1.929 4.478 15.018 1.00 0.00 H new ATOM 0 HB3 MET A 136 -2.902 4.422 13.562 1.00 0.00 H new ATOM 0 HG2 MET A 136 -0.408 2.767 14.181 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.037 2.171 13.932 1.00 0.00 H new ATOM 0 HE1 MET A 136 -2.826 2.809 10.279 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.401 2.929 11.959 1.00 0.00 H new ATOM 0 HE3 MET A 136 -2.698 4.353 11.156 1.00 0.00 H new ATOM 2193 N LYS A 137 -1.116 7.180 14.916 1.00 0.00 N ATOM 2194 CA LYS A 137 -1.495 8.554 15.323 1.00 0.00 C ATOM 2195 C LYS A 137 -0.868 9.500 14.316 1.00 0.00 C ATOM 2196 O LYS A 137 -1.443 10.498 13.943 1.00 0.00 O ATOM 2197 CB LYS A 137 -0.971 8.855 16.726 1.00 0.00 C ATOM 2198 CG LYS A 137 -1.853 8.140 17.751 1.00 0.00 C ATOM 2199 CD LYS A 137 -0.985 7.488 18.827 1.00 0.00 C ATOM 2200 CE LYS A 137 -0.372 8.550 19.742 1.00 0.00 C ATOM 2201 NZ LYS A 137 -0.508 9.897 19.117 1.00 0.00 N ATOM 0 H LYS A 137 -0.631 6.626 15.621 1.00 0.00 H new ATOM 0 HA LYS A 137 -2.579 8.668 15.344 1.00 0.00 H new ATOM 0 HB2 LYS A 137 0.063 8.522 16.821 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -0.978 9.930 16.908 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -2.541 8.851 18.209 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -2.460 7.383 17.255 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -1.586 6.796 19.416 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -0.193 6.903 18.358 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -0.869 8.538 20.712 1.00 0.00 H new ATOM 0 HE3 LYS A 137 0.680 8.326 19.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -0.167 10.623 19.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 0.055 9.933 18.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -1.507 10.076 18.892 1.00 0.00 H new ATOM 2215 N ALA A 138 0.307 9.160 13.848 1.00 0.00 N ATOM 2216 CA ALA A 138 0.983 10.000 12.830 1.00 0.00 C ATOM 2217 C ALA A 138 0.286 9.797 11.484 1.00 0.00 C ATOM 2218 O ALA A 138 -0.036 10.743 10.790 1.00 0.00 O ATOM 2219 CB ALA A 138 2.440 9.579 12.708 1.00 0.00 C ATOM 0 H ALA A 138 0.825 8.329 14.134 1.00 0.00 H new ATOM 0 HA ALA A 138 0.934 11.048 13.124 1.00 0.00 H new ATOM 0 HB1 ALA A 138 2.936 10.197 11.959 1.00 0.00 H new ATOM 0 HB2 ALA A 138 2.937 9.705 13.670 1.00 0.00 H new ATOM 0 HB3 ALA A 138 2.492 8.533 12.407 1.00 0.00 H new ATOM 2225 N ALA A 139 0.037 8.565 11.117 1.00 0.00 N ATOM 2226 CA ALA A 139 -0.656 8.305 9.824 1.00 0.00 C ATOM 2227 C ALA A 139 -2.011 8.993 9.870 1.00 0.00 C ATOM 2228 O ALA A 139 -2.393 9.712 8.966 1.00 0.00 O ATOM 2229 CB ALA A 139 -0.864 6.799 9.646 1.00 0.00 C ATOM 0 H ALA A 139 0.283 7.734 11.655 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.059 8.684 8.994 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.371 6.611 8.700 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.103 6.296 9.646 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -1.472 6.416 10.466 1.00 0.00 H new ATOM 2235 N LEU A 140 -2.729 8.800 10.937 1.00 0.00 N ATOM 2236 CA LEU A 140 -4.047 9.458 11.081 1.00 0.00 C ATOM 2237 C LEU A 140 -3.808 10.968 11.177 1.00 0.00 C ATOM 2238 O LEU A 140 -4.641 11.771 10.807 1.00 0.00 O ATOM 2239 CB LEU A 140 -4.726 8.954 12.359 1.00 0.00 C ATOM 2240 CG LEU A 140 -4.852 7.427 12.301 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -4.796 6.853 13.715 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -6.188 7.042 11.658 1.00 0.00 C ATOM 0 H LEU A 140 -2.454 8.209 11.721 1.00 0.00 H new ATOM 0 HA LEU A 140 -4.689 9.232 10.230 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -4.145 9.249 13.233 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.712 9.407 12.463 1.00 0.00 H new ATOM 0 HG LEU A 140 -4.031 7.025 11.708 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -4.886 5.768 13.671 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.846 7.120 14.179 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.616 7.261 14.306 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.273 5.956 11.619 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.008 7.449 12.250 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.235 7.446 10.647 1.00 0.00 H new ATOM 2254 N GLN A 141 -2.663 11.347 11.687 1.00 0.00 N ATOM 2255 CA GLN A 141 -2.331 12.794 11.838 1.00 0.00 C ATOM 2256 C GLN A 141 -1.966 13.412 10.490 1.00 0.00 C ATOM 2257 O GLN A 141 -2.503 14.428 10.097 1.00 0.00 O ATOM 2258 CB GLN A 141 -1.123 12.924 12.766 1.00 0.00 C ATOM 2259 CG GLN A 141 -1.567 13.463 14.124 1.00 0.00 C ATOM 2260 CD GLN A 141 -1.835 14.966 14.014 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -1.663 15.564 12.865 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -2.201 15.603 14.981 1.00 0.00 N flip ATOM 0 H GLN A 141 -1.937 10.707 12.008 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.200 13.311 12.244 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.642 11.954 12.890 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.384 13.592 12.324 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -2.467 12.946 14.456 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.797 13.274 14.872 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -2.335 15.136 15.878 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -2.374 16.605 14.896 1.00 0.00 H new ATOM 2271 N GLU A 142 -1.041 12.823 9.786 1.00 0.00 N ATOM 2272 CA GLU A 142 -0.630 13.401 8.478 1.00 0.00 C ATOM 2273 C GLU A 142 -1.788 13.306 7.488 1.00 0.00 C ATOM 2274 O GLU A 142 -2.030 14.215 6.718 1.00 0.00 O ATOM 2275 CB GLU A 142 0.581 12.636 7.941 1.00 0.00 C ATOM 2276 CG GLU A 142 1.756 12.799 8.905 1.00 0.00 C ATOM 2277 CD GLU A 142 2.989 12.105 8.325 1.00 0.00 C ATOM 2278 OE1 GLU A 142 2.840 11.407 7.336 1.00 0.00 O ATOM 2279 OE2 GLU A 142 4.063 12.284 8.877 1.00 0.00 O ATOM 0 H GLU A 142 -0.554 11.970 10.059 1.00 0.00 H new ATOM 0 HA GLU A 142 -0.362 14.449 8.611 1.00 0.00 H new ATOM 0 HB2 GLU A 142 0.336 11.580 7.825 1.00 0.00 H new ATOM 0 HB3 GLU A 142 0.852 13.010 6.954 1.00 0.00 H new ATOM 0 HG2 GLU A 142 1.963 13.857 9.068 1.00 0.00 H new ATOM 0 HG3 GLU A 142 1.507 12.370 9.876 1.00 0.00 H new ATOM 2287 N GLY A 143 -2.516 12.225 7.504 1.00 0.00 N ATOM 2288 CA GLY A 143 -3.663 12.101 6.565 1.00 0.00 C ATOM 2289 C GLY A 143 -4.617 13.266 6.815 1.00 0.00 C ATOM 2290 O GLY A 143 -5.072 13.922 5.901 1.00 0.00 O ATOM 0 H GLY A 143 -2.368 11.427 8.122 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.312 12.113 5.533 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.176 11.151 6.716 1.00 0.00 H new ATOM 2294 N HIS A 144 -4.905 13.539 8.058 1.00 0.00 N ATOM 2295 CA HIS A 144 -5.810 14.675 8.384 1.00 0.00 C ATOM 2296 C HIS A 144 -5.137 15.980 7.953 1.00 0.00 C ATOM 2297 O HIS A 144 -5.754 16.853 7.376 1.00 0.00 O ATOM 2298 CB HIS A 144 -6.053 14.709 9.895 1.00 0.00 C ATOM 2299 CG HIS A 144 -7.155 15.682 10.203 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -6.910 16.929 10.762 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -8.516 15.608 10.037 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -8.096 17.547 10.909 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -9.103 16.785 10.482 1.00 0.00 N ATOM 0 H HIS A 144 -4.551 13.022 8.863 1.00 0.00 H new ATOM 0 HA HIS A 144 -6.760 14.555 7.864 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -6.320 13.715 10.254 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -5.140 15.001 10.414 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -5.997 17.308 11.015 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -9.048 14.764 9.624 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -8.217 18.538 11.322 1.00 0.00 H new ATOM 2312 N GLN A 145 -3.873 16.111 8.243 1.00 0.00 N ATOM 2313 CA GLN A 145 -3.135 17.352 7.873 1.00 0.00 C ATOM 2314 C GLN A 145 -3.167 17.554 6.357 1.00 0.00 C ATOM 2315 O GLN A 145 -3.345 18.653 5.872 1.00 0.00 O ATOM 2316 CB GLN A 145 -1.679 17.223 8.328 1.00 0.00 C ATOM 2317 CG GLN A 145 -0.964 18.562 8.135 1.00 0.00 C ATOM 2318 CD GLN A 145 -1.474 19.567 9.169 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -1.416 19.318 10.358 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -1.976 20.702 8.765 1.00 0.00 N ATOM 0 H GLN A 145 -3.315 15.406 8.724 1.00 0.00 H new ATOM 0 HA GLN A 145 -3.608 18.206 8.358 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -1.639 16.925 9.376 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -1.176 16.444 7.756 1.00 0.00 H new ATOM 0 HG2 GLN A 145 0.113 18.430 8.241 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -1.141 18.939 7.128 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -2.025 20.912 7.768 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -2.319 21.379 9.446 1.00 0.00 H new ATOM 2329 N PHE A 146 -2.979 16.506 5.606 1.00 0.00 N ATOM 2330 CA PHE A 146 -2.977 16.642 4.120 1.00 0.00 C ATOM 2331 C PHE A 146 -4.376 16.981 3.601 1.00 0.00 C ATOM 2332 O PHE A 146 -4.548 17.895 2.818 1.00 0.00 O ATOM 2333 CB PHE A 146 -2.514 15.333 3.489 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.524 15.482 1.988 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.721 15.322 1.283 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.342 15.781 1.301 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.741 15.462 -0.106 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.360 15.921 -0.093 1.00 0.00 C ATOM 2339 CZ PHE A 146 -2.560 15.761 -0.797 1.00 0.00 C ATOM 0 H PHE A 146 -2.826 15.560 5.955 1.00 0.00 H new ATOM 0 HA PHE A 146 -2.297 17.450 3.850 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.512 15.081 3.836 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.170 14.517 3.791 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.632 15.090 1.814 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -0.417 15.904 1.845 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.667 15.340 -0.648 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.449 16.152 -0.624 1.00 0.00 H new ATOM 0 HZ PHE A 146 -2.575 15.868 -1.872 1.00 0.00 H new ATOM 2349 N LEU A 147 -5.377 16.249 4.010 1.00 0.00 N ATOM 2350 CA LEU A 147 -6.754 16.536 3.511 1.00 0.00 C ATOM 2351 C LEU A 147 -7.099 18.002 3.771 1.00 0.00 C ATOM 2352 O LEU A 147 -7.725 18.652 2.958 1.00 0.00 O ATOM 2353 CB LEU A 147 -7.765 15.626 4.215 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.490 14.170 3.832 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.514 13.261 4.509 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -7.611 14.005 2.315 1.00 0.00 C ATOM 0 H LEU A 147 -5.303 15.470 4.664 1.00 0.00 H new ATOM 0 HA LEU A 147 -6.795 16.344 2.439 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.692 15.750 5.295 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.780 15.903 3.931 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.484 13.901 4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.317 12.224 4.236 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.439 13.371 5.591 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.517 13.538 4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -7.415 12.967 2.045 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.618 14.278 1.998 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.887 14.652 1.820 1.00 0.00 H new ATOM 2368 N CYS A 148 -6.683 18.536 4.883 1.00 0.00 N ATOM 2369 CA CYS A 148 -6.976 19.967 5.169 1.00 0.00 C ATOM 2370 C CYS A 148 -6.118 20.833 4.245 1.00 0.00 C ATOM 2371 O CYS A 148 -6.306 22.028 4.140 1.00 0.00 O ATOM 2372 CB CYS A 148 -6.637 20.278 6.627 1.00 0.00 C ATOM 2373 SG CYS A 148 -5.825 21.894 6.727 1.00 0.00 S ATOM 0 H CYS A 148 -6.154 18.046 5.605 1.00 0.00 H new ATOM 0 HA CYS A 148 -8.033 20.174 4.999 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -7.545 20.277 7.231 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -5.984 19.505 7.032 1.00 0.00 H new ATOM 0 HG CYS A 148 -6.078 22.574 5.648 1.00 0.00 H new ATOM 2379 N SER A 149 -5.168 20.228 3.585 1.00 0.00 N ATOM 2380 CA SER A 149 -4.278 20.995 2.670 1.00 0.00 C ATOM 2381 C SER A 149 -4.871 21.030 1.258 1.00 0.00 C ATOM 2382 O SER A 149 -4.382 21.725 0.393 1.00 0.00 O ATOM 2383 CB SER A 149 -2.913 20.312 2.614 1.00 0.00 C ATOM 2384 OG SER A 149 -1.888 21.290 2.724 1.00 0.00 O ATOM 0 H SER A 149 -4.970 19.229 3.641 1.00 0.00 H new ATOM 0 HA SER A 149 -4.179 22.014 3.043 1.00 0.00 H new ATOM 0 HB2 SER A 149 -2.825 19.585 3.422 1.00 0.00 H new ATOM 0 HB3 SER A 149 -2.807 19.763 1.678 1.00 0.00 H new ATOM 0 HG SER A 149 -1.012 20.851 2.690 1.00 0.00 H new ATOM 2390 N ILE A 150 -5.908 20.276 1.008 1.00 0.00 N ATOM 2391 CA ILE A 150 -6.496 20.269 -0.358 1.00 0.00 C ATOM 2392 C ILE A 150 -7.453 21.450 -0.523 1.00 0.00 C ATOM 2393 O ILE A 150 -7.132 22.579 -0.209 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.265 18.965 -0.585 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.554 17.804 0.113 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.330 18.678 -2.083 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -7.425 16.551 0.019 1.00 0.00 C ATOM 0 H ILE A 150 -6.369 19.670 1.687 1.00 0.00 H new ATOM 0 HA ILE A 150 -5.690 20.351 -1.087 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.270 19.068 -0.176 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.585 17.623 -0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.365 18.053 1.157 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -7.877 17.750 -2.252 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.841 19.497 -2.589 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.319 18.581 -2.479 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -6.923 15.721 0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -8.383 16.737 0.504 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -7.591 16.301 -1.029 1.00 0.00 H new ATOM 2409 N GLU A 151 -8.627 21.185 -1.018 1.00 0.00 N ATOM 2410 CA GLU A 151 -9.630 22.271 -1.224 1.00 0.00 C ATOM 2411 C GLU A 151 -10.045 22.880 0.114 1.00 0.00 C ATOM 2412 O GLU A 151 -10.066 24.084 0.282 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.860 21.679 -1.913 1.00 0.00 C ATOM 2414 CG GLU A 151 -11.922 22.764 -2.085 1.00 0.00 C ATOM 2415 CD GLU A 151 -13.160 22.167 -2.757 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -14.107 22.903 -2.972 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -13.138 20.980 -3.047 1.00 0.00 O ATOM 0 H GLU A 151 -8.941 20.254 -1.292 1.00 0.00 H new ATOM 0 HA GLU A 151 -9.188 23.054 -1.840 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.583 21.269 -2.884 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -11.260 20.855 -1.322 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -12.189 23.183 -1.115 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -11.527 23.582 -2.688 1.00 0.00 H new ATOM 2425 N ALA A 152 -10.382 22.060 1.064 1.00 0.00 N ATOM 2426 CA ALA A 152 -10.807 22.587 2.393 1.00 0.00 C ATOM 2427 C ALA A 152 -11.816 23.719 2.189 1.00 0.00 C ATOM 2428 O ALA A 152 -12.439 23.826 1.152 1.00 0.00 O ATOM 2429 CB ALA A 152 -9.586 23.121 3.144 1.00 0.00 C ATOM 0 H ALA A 152 -10.383 21.043 0.981 1.00 0.00 H new ATOM 0 HA ALA A 152 -11.268 21.787 2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -9.896 23.506 4.115 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -8.865 22.316 3.286 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -9.125 23.922 2.566 1.00 0.00 H new ATOM 2435 N LEU A 153 -11.987 24.563 3.171 1.00 0.00 N ATOM 2436 CA LEU A 153 -12.957 25.686 3.027 1.00 0.00 C ATOM 2437 C LEU A 153 -12.224 26.935 2.536 1.00 0.00 C ATOM 2438 O LEU A 153 -11.016 26.905 2.312 1.00 0.00 O ATOM 2439 CB LEU A 153 -13.612 25.979 4.379 1.00 0.00 C ATOM 2440 CG LEU A 153 -14.262 24.706 4.920 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -14.951 25.012 6.251 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -15.303 24.202 3.917 1.00 0.00 C ATOM 0 H LEU A 153 -11.498 24.523 4.065 1.00 0.00 H new ATOM 0 HA LEU A 153 -13.725 25.407 2.306 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -12.866 26.346 5.084 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -14.361 26.764 4.269 1.00 0.00 H new ATOM 0 HG LEU A 153 -13.498 23.943 5.071 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -15.415 24.105 6.638 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -14.214 25.376 6.967 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -15.716 25.774 6.098 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -15.768 23.294 4.301 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -16.066 24.966 3.770 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -14.817 23.987 2.965 1.00 0.00 H new TER 2454 LEU A 153