USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1053 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 110 TYR OH : rot 0:sc= 0.121 USER MOD Set 1.2: A 129 TYR OH : rot 82:sc= 0.862 USER MOD Single : A 10 MET CE :methyl -121:sc= -0.391 (180deg=-2.11!) USER MOD Single : A 19 CYS SG : rot 180:sc= -1.12 USER MOD Single : A 20 TYR OH : rot 130:sc= -0.554 USER MOD Single : A 21 CYS SG : rot 149:sc= -1.14 USER MOD Single : A 23 SER OG : rot 161:sc= 0.201 USER MOD Single : A 26 GLN : amide:sc= -0.0205 K(o=-0.02,f=-1.4!) USER MOD Single : A 29 GLN : amide:sc= -0.765 K(o=-0.76,f=1.1) USER MOD Single : A 31 MET CE :methyl 152:sc= -0.566 (180deg=-1.44!) USER MOD Single : A 34 GLN : amide:sc= -0.517 K(o=-0.52,f=0) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 CYS SG : rot 137:sc= -2.72 USER MOD Single : A 47 SER OG : rot -140:sc= -1.01 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -16:sc= 0.1 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 130:sc= -0.58 USER MOD Single : A 72 MET CE :methyl 165:sc= -3.44! (180deg=-4.84!) USER MOD Single : A 77 SER OG : rot 122:sc= -0.308 USER MOD Single : A 80 TYR OH : rot -84:sc= -1.64 USER MOD Single : A 82 GLN : amide:sc= -0.644 X(o=-0.64,f=-0.24) USER MOD Single : A 83 SER OG : rot 180:sc= -0.0834 USER MOD Single : A 84 LYS NZ :NH3+ 164:sc= -1.84 (180deg=-2.19) USER MOD Single : A 86 CYS SG : rot -100:sc= -1.32 USER MOD Single : A 89 GLN : amide:sc= -4.38 K(o=-4.4,f=-5.2!) USER MOD Single : A 90 THR OG1 : rot 94:sc= 1.23 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -16:sc= 0.982 USER MOD Single : A 97 SER OG : rot 180:sc= -0.967 USER MOD Single : A 101 HIS : no HD1:sc= -0.89 K(o=-0.89,f=-0.19) USER MOD Single : A 102 GLN : amide:sc= -0.527 K(o=-0.53,f=-3.9!) USER MOD Single : A 103 LYS NZ :NH3+ -166:sc= -0.0228 (180deg=-0.192) USER MOD Single : A 109 LYS NZ :NH3+ -148:sc= -1.03 (180deg=-1.84!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 146:sc= -3.19 (180deg=-8.06!) USER MOD Single : A 114 LYS NZ :NH3+ 178:sc= 0.532 (180deg=0.529) USER MOD Single : A 115 LYS NZ :NH3+ 154:sc= -1.95 (180deg=-3.37!) USER MOD Single : A 119 SER OG : rot 51:sc= 0.46 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.326 USER MOD Single : A 131 ASN : amide:sc= -0.0222 X(o=-0.022,f=-0.18) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 85:sc= 0.0174 USER MOD ----------------------------------------------------------------- ATOM 19 N MET A 10 -6.493 -12.210 -12.616 1.00 0.00 N ATOM 20 CA MET A 10 -6.266 -12.240 -11.175 1.00 0.00 C ATOM 21 C MET A 10 -5.486 -13.490 -10.773 1.00 0.00 C ATOM 22 O MET A 10 -6.045 -14.424 -10.202 1.00 0.00 O ATOM 23 CB MET A 10 -7.601 -12.195 -10.428 1.00 0.00 C ATOM 24 CG MET A 10 -7.454 -12.210 -8.915 1.00 0.00 C ATOM 25 SD MET A 10 -8.943 -12.787 -8.078 1.00 0.00 S ATOM 26 CE MET A 10 -9.862 -11.257 -7.927 1.00 0.00 C ATOM 0 HA MET A 10 -5.676 -11.364 -10.906 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.142 -11.296 -10.723 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.208 -13.047 -10.734 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.616 -12.852 -8.642 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.213 -11.206 -8.567 1.00 0.00 H new ATOM 0 HE1 MET A 10 -10.061 -11.055 -6.875 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.279 -10.439 -8.350 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.806 -11.345 -8.465 1.00 0.00 H new ATOM 36 N PRO A 11 -4.174 -13.520 -11.069 1.00 0.00 N ATOM 37 CA PRO A 11 -3.317 -14.663 -10.737 1.00 0.00 C ATOM 38 C PRO A 11 -3.438 -15.073 -9.272 1.00 0.00 C ATOM 39 O PRO A 11 -4.136 -14.427 -8.492 1.00 0.00 O ATOM 40 CB PRO A 11 -1.907 -14.149 -11.033 1.00 0.00 C ATOM 41 CG PRO A 11 -2.099 -13.087 -12.058 1.00 0.00 C ATOM 42 CD PRO A 11 -3.425 -12.447 -11.749 1.00 0.00 C ATOM 0 HA PRO A 11 -3.588 -15.553 -11.305 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.434 -13.752 -10.135 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.265 -14.947 -11.405 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -1.293 -12.354 -12.016 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -2.094 -13.509 -13.063 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -3.309 -11.571 -11.110 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.932 -12.116 -12.655 1.00 0.00 H new ATOM 50 N GLU A 12 -2.750 -16.149 -8.908 1.00 0.00 N ATOM 51 CA GLU A 12 -2.777 -16.646 -7.538 1.00 0.00 C ATOM 52 C GLU A 12 -1.695 -15.979 -6.698 1.00 0.00 C ATOM 53 O GLU A 12 -1.869 -15.764 -5.497 1.00 0.00 O ATOM 54 CB GLU A 12 -2.589 -18.165 -7.519 1.00 0.00 C ATOM 55 CG GLU A 12 -3.660 -18.920 -8.287 1.00 0.00 C ATOM 56 CD GLU A 12 -4.143 -20.156 -7.551 1.00 0.00 C ATOM 57 OE1 GLU A 12 -4.847 -20.002 -6.531 1.00 0.00 O ATOM 58 OE2 GLU A 12 -3.815 -21.276 -7.995 1.00 0.00 O ATOM 0 H GLU A 12 -2.167 -16.694 -9.543 1.00 0.00 H new ATOM 0 HA GLU A 12 -3.749 -16.402 -7.109 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.613 -18.407 -7.940 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.585 -18.509 -6.485 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.506 -18.257 -8.471 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.266 -19.212 -9.261 1.00 0.00 H new ATOM 65 N ARG A 13 -0.577 -15.649 -7.336 1.00 0.00 N ATOM 66 CA ARG A 13 0.533 -15.002 -6.646 1.00 0.00 C ATOM 67 C ARG A 13 0.585 -13.515 -6.978 1.00 0.00 C ATOM 68 O ARG A 13 0.666 -13.132 -8.145 1.00 0.00 O ATOM 69 CB ARG A 13 1.858 -15.668 -7.028 1.00 0.00 C ATOM 70 CG ARG A 13 1.792 -17.187 -7.049 1.00 0.00 C ATOM 71 CD ARG A 13 1.665 -17.761 -5.646 1.00 0.00 C ATOM 72 NE ARG A 13 2.682 -18.775 -5.376 1.00 0.00 N ATOM 73 CZ ARG A 13 2.589 -19.678 -4.401 1.00 0.00 C ATOM 74 NH1 ARG A 13 1.531 -19.694 -3.601 1.00 0.00 N ATOM 75 NH2 ARG A 13 3.558 -20.565 -4.225 1.00 0.00 N ATOM 0 H ARG A 13 -0.416 -15.819 -8.329 1.00 0.00 H new ATOM 0 HA ARG A 13 0.375 -15.112 -5.573 1.00 0.00 H new ATOM 0 HB2 ARG A 13 2.163 -15.312 -8.012 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.628 -15.356 -6.323 1.00 0.00 H new ATOM 0 HG2 ARG A 13 0.942 -17.507 -7.652 1.00 0.00 H new ATOM 0 HG3 ARG A 13 2.688 -17.584 -7.526 1.00 0.00 H new ATOM 0 HD2 ARG A 13 1.752 -16.956 -4.916 1.00 0.00 H new ATOM 0 HD3 ARG A 13 0.674 -18.199 -5.521 1.00 0.00 H new ATOM 0 HE ARG A 13 3.512 -18.792 -5.969 1.00 0.00 H new ATOM 0 HH11 ARG A 13 0.783 -19.013 -3.731 1.00 0.00 H new ATOM 0 HH12 ARG A 13 1.465 -20.388 -2.856 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.375 -20.556 -4.836 1.00 0.00 H new ATOM 0 HH22 ARG A 13 3.487 -21.256 -3.479 1.00 0.00 H new ATOM 89 N PHE A 14 0.536 -12.680 -5.945 1.00 0.00 N ATOM 90 CA PHE A 14 0.579 -11.235 -6.129 1.00 0.00 C ATOM 91 C PHE A 14 1.774 -10.632 -5.400 1.00 0.00 C ATOM 92 O PHE A 14 2.432 -11.305 -4.607 1.00 0.00 O ATOM 93 CB PHE A 14 -0.718 -10.599 -5.629 1.00 0.00 C ATOM 94 CG PHE A 14 -1.911 -10.929 -6.480 1.00 0.00 C ATOM 95 CD1 PHE A 14 -2.142 -10.248 -7.664 1.00 0.00 C ATOM 96 CD2 PHE A 14 -2.799 -11.921 -6.097 1.00 0.00 C ATOM 97 CE1 PHE A 14 -3.237 -10.552 -8.452 1.00 0.00 C ATOM 98 CE2 PHE A 14 -3.895 -12.228 -6.880 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.114 -11.543 -8.059 1.00 0.00 C ATOM 0 H PHE A 14 0.467 -12.980 -4.973 1.00 0.00 H new ATOM 0 HA PHE A 14 0.686 -11.029 -7.194 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -0.906 -10.931 -4.608 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.594 -9.517 -5.595 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.459 -9.471 -7.975 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.633 -12.460 -5.176 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -3.406 -10.015 -9.374 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -4.580 -13.003 -6.570 1.00 0.00 H new ATOM 0 HZ PHE A 14 -4.970 -11.782 -8.673 1.00 0.00 H new ATOM 109 N ASP A 15 2.056 -9.364 -5.679 1.00 0.00 N ATOM 110 CA ASP A 15 3.177 -8.680 -5.051 1.00 0.00 C ATOM 111 C ASP A 15 2.739 -7.941 -3.792 1.00 0.00 C ATOM 112 O ASP A 15 3.166 -8.276 -2.687 1.00 0.00 O ATOM 113 CB ASP A 15 3.822 -7.701 -6.030 1.00 0.00 C ATOM 114 CG ASP A 15 4.874 -8.362 -6.899 1.00 0.00 C ATOM 115 OD1 ASP A 15 5.614 -9.225 -6.382 1.00 0.00 O ATOM 116 OD2 ASP A 15 4.960 -8.016 -8.097 1.00 0.00 O ATOM 0 H ASP A 15 1.524 -8.791 -6.335 1.00 0.00 H new ATOM 0 HA ASP A 15 3.909 -9.436 -4.767 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.051 -7.266 -6.665 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.277 -6.881 -5.474 1.00 0.00 H new ATOM 121 N ALA A 16 1.890 -6.929 -3.960 1.00 0.00 N ATOM 122 CA ALA A 16 1.416 -6.148 -2.823 1.00 0.00 C ATOM 123 C ALA A 16 -0.029 -5.700 -2.997 1.00 0.00 C ATOM 124 O ALA A 16 -0.657 -5.950 -4.026 1.00 0.00 O ATOM 125 CB ALA A 16 2.311 -4.935 -2.607 1.00 0.00 C ATOM 0 H ALA A 16 1.520 -6.634 -4.864 1.00 0.00 H new ATOM 0 HA ALA A 16 1.458 -6.795 -1.947 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.946 -4.361 -1.755 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.331 -5.266 -2.411 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.297 -4.309 -3.499 1.00 0.00 H new ATOM 131 N PHE A 17 -0.540 -5.021 -1.976 1.00 0.00 N ATOM 132 CA PHE A 17 -1.905 -4.508 -1.991 1.00 0.00 C ATOM 133 C PHE A 17 -1.906 -3.012 -1.686 1.00 0.00 C ATOM 134 O PHE A 17 -0.996 -2.504 -1.032 1.00 0.00 O ATOM 135 CB PHE A 17 -2.766 -5.258 -0.970 1.00 0.00 C ATOM 136 CG PHE A 17 -4.160 -4.712 -0.844 1.00 0.00 C ATOM 137 CD1 PHE A 17 -4.442 -3.706 0.065 1.00 0.00 C ATOM 138 CD2 PHE A 17 -5.186 -5.204 -1.635 1.00 0.00 C ATOM 139 CE1 PHE A 17 -5.722 -3.200 0.186 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.469 -4.701 -1.520 1.00 0.00 C ATOM 141 CZ PHE A 17 -6.736 -3.698 -0.608 1.00 0.00 C ATOM 0 H PHE A 17 -0.025 -4.812 -1.121 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.328 -4.665 -2.983 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -2.820 -6.309 -1.255 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.279 -5.217 0.004 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -3.652 -3.312 0.687 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.981 -5.988 -2.349 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -5.929 -2.417 0.900 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.261 -5.091 -2.142 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.737 -3.304 -0.516 1.00 0.00 H new ATOM 151 N ILE A 18 -2.924 -2.310 -2.172 1.00 0.00 N ATOM 152 CA ILE A 18 -3.025 -0.872 -1.956 1.00 0.00 C ATOM 153 C ILE A 18 -4.167 -0.524 -1.004 1.00 0.00 C ATOM 154 O ILE A 18 -5.325 -0.848 -1.263 1.00 0.00 O ATOM 155 CB ILE A 18 -3.232 -0.117 -3.285 1.00 0.00 C ATOM 156 CG1 ILE A 18 -2.069 -0.388 -4.238 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.379 1.379 -3.038 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.755 0.196 -3.768 1.00 0.00 C ATOM 0 H ILE A 18 -3.688 -2.712 -2.716 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.082 -0.560 -1.508 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.151 -0.480 -3.745 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.955 -1.465 -4.362 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.310 0.023 -5.219 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.524 1.892 -3.989 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.240 1.559 -2.394 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.479 1.758 -2.555 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.026 -0.035 -4.493 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.852 1.277 -3.671 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.491 -0.233 -2.801 1.00 0.00 H new ATOM 170 N CYS A 19 -3.827 0.157 0.082 1.00 0.00 N ATOM 171 CA CYS A 19 -4.818 0.577 1.065 1.00 0.00 C ATOM 172 C CYS A 19 -5.003 2.091 1.005 1.00 0.00 C ATOM 173 O CYS A 19 -4.227 2.842 1.597 1.00 0.00 O ATOM 174 CB CYS A 19 -4.388 0.155 2.472 1.00 0.00 C ATOM 175 SG CYS A 19 -5.405 -1.153 3.194 1.00 0.00 S ATOM 0 H CYS A 19 -2.870 0.431 0.305 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.767 0.093 0.833 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -3.352 -0.182 2.438 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.418 1.026 3.126 1.00 0.00 H new ATOM 0 HG CYS A 19 -4.962 -1.442 4.382 1.00 0.00 H new ATOM 181 N TYR A 20 -6.023 2.534 0.275 1.00 0.00 N ATOM 182 CA TYR A 20 -6.289 3.961 0.130 1.00 0.00 C ATOM 183 C TYR A 20 -7.736 4.303 0.467 1.00 0.00 C ATOM 184 O TYR A 20 -8.557 3.417 0.707 1.00 0.00 O ATOM 185 CB TYR A 20 -5.964 4.418 -1.297 1.00 0.00 C ATOM 186 CG TYR A 20 -6.550 3.535 -2.382 1.00 0.00 C ATOM 187 CD1 TYR A 20 -7.882 3.133 -2.350 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.764 3.109 -3.445 1.00 0.00 C ATOM 189 CE1 TYR A 20 -8.408 2.330 -3.346 1.00 0.00 C ATOM 190 CE2 TYR A 20 -6.285 2.308 -4.443 1.00 0.00 C ATOM 191 CZ TYR A 20 -7.606 1.921 -4.388 1.00 0.00 C ATOM 192 OH TYR A 20 -8.127 1.122 -5.382 1.00 0.00 O ATOM 0 H TYR A 20 -6.676 1.928 -0.223 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.647 4.488 0.836 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.332 5.435 -1.433 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.881 4.452 -1.418 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -8.515 3.453 -1.535 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -4.728 3.409 -3.492 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -9.443 2.025 -3.307 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.659 1.987 -5.263 1.00 0.00 H new ATOM 0 HH TYR A 20 -7.907 1.504 -6.257 1.00 0.00 H new ATOM 202 N CYS A 21 -8.040 5.597 0.475 1.00 0.00 N ATOM 203 CA CYS A 21 -9.385 6.073 0.772 1.00 0.00 C ATOM 204 C CYS A 21 -10.078 6.553 -0.502 1.00 0.00 C ATOM 205 O CYS A 21 -9.422 6.977 -1.452 1.00 0.00 O ATOM 206 CB CYS A 21 -9.335 7.203 1.802 1.00 0.00 C ATOM 207 SG CYS A 21 -10.111 6.794 3.383 1.00 0.00 S ATOM 0 H CYS A 21 -7.368 6.338 0.278 1.00 0.00 H new ATOM 0 HA CYS A 21 -9.958 5.244 1.188 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -8.294 7.473 1.979 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -9.826 8.082 1.385 1.00 0.00 H new ATOM 0 HG CYS A 21 -9.507 7.432 4.341 1.00 0.00 H new ATOM 213 N PRO A 22 -11.420 6.488 -0.540 1.00 0.00 N ATOM 214 CA PRO A 22 -12.203 6.913 -1.706 1.00 0.00 C ATOM 215 C PRO A 22 -12.281 8.434 -1.858 1.00 0.00 C ATOM 216 O PRO A 22 -12.949 8.937 -2.759 1.00 0.00 O ATOM 217 CB PRO A 22 -13.590 6.337 -1.421 1.00 0.00 C ATOM 218 CG PRO A 22 -13.675 6.283 0.065 1.00 0.00 C ATOM 219 CD PRO A 22 -12.282 5.989 0.552 1.00 0.00 C ATOM 0 HA PRO A 22 -11.754 6.567 -2.637 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -14.375 6.966 -1.841 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.706 5.347 -1.861 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.038 7.228 0.469 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.372 5.510 0.388 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.071 6.496 1.493 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -12.134 4.923 0.724 1.00 0.00 H new ATOM 227 N SER A 23 -11.599 9.163 -0.976 1.00 0.00 N ATOM 228 CA SER A 23 -11.604 10.619 -1.029 1.00 0.00 C ATOM 229 C SER A 23 -10.641 11.125 -2.098 1.00 0.00 C ATOM 230 O SER A 23 -10.986 11.996 -2.897 1.00 0.00 O ATOM 231 CB SER A 23 -11.224 11.200 0.334 1.00 0.00 C ATOM 232 OG SER A 23 -12.037 10.664 1.363 1.00 0.00 O ATOM 0 H SER A 23 -11.039 8.769 -0.220 1.00 0.00 H new ATOM 0 HA SER A 23 -12.611 10.947 -1.287 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.176 10.985 0.545 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.328 12.285 0.312 1.00 0.00 H new ATOM 0 HG SER A 23 -11.603 10.805 2.230 1.00 0.00 H new ATOM 238 N ASP A 24 -9.434 10.570 -2.108 1.00 0.00 N ATOM 239 CA ASP A 24 -8.423 10.962 -3.081 1.00 0.00 C ATOM 240 C ASP A 24 -7.722 9.736 -3.659 1.00 0.00 C ATOM 241 O ASP A 24 -6.501 9.722 -3.817 1.00 0.00 O ATOM 242 CB ASP A 24 -7.398 11.897 -2.437 1.00 0.00 C ATOM 243 CG ASP A 24 -6.860 12.925 -3.414 1.00 0.00 C ATOM 244 OD1 ASP A 24 -7.672 13.541 -4.133 1.00 0.00 O ATOM 245 OD2 ASP A 24 -5.626 13.111 -3.459 1.00 0.00 O ATOM 0 H ASP A 24 -9.133 9.848 -1.454 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.922 11.490 -3.894 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.858 12.409 -1.592 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.571 11.308 -2.041 1.00 0.00 H new ATOM 250 N ILE A 25 -8.504 8.709 -3.969 1.00 0.00 N ATOM 251 CA ILE A 25 -7.966 7.474 -4.528 1.00 0.00 C ATOM 252 C ILE A 25 -7.338 7.719 -5.898 1.00 0.00 C ATOM 253 O ILE A 25 -6.305 7.138 -6.230 1.00 0.00 O ATOM 254 CB ILE A 25 -9.066 6.394 -4.648 1.00 0.00 C ATOM 255 CG1 ILE A 25 -8.444 5.016 -4.891 1.00 0.00 C ATOM 256 CG2 ILE A 25 -10.055 6.750 -5.751 1.00 0.00 C ATOM 257 CD1 ILE A 25 -7.819 4.849 -6.259 1.00 0.00 C ATOM 0 H ILE A 25 -9.516 8.707 -3.842 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.194 7.118 -3.846 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.614 6.356 -3.706 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.683 4.834 -4.132 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -9.213 4.255 -4.760 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.820 5.976 -5.817 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.525 7.707 -5.523 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.528 6.822 -6.703 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -7.402 3.846 -6.349 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.579 4.996 -7.027 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.025 5.585 -6.389 1.00 0.00 H new ATOM 269 N GLN A 26 -7.972 8.581 -6.687 1.00 0.00 N ATOM 270 CA GLN A 26 -7.482 8.904 -8.025 1.00 0.00 C ATOM 271 C GLN A 26 -5.987 9.215 -8.009 1.00 0.00 C ATOM 272 O GLN A 26 -5.254 8.847 -8.928 1.00 0.00 O ATOM 273 CB GLN A 26 -8.254 10.094 -8.598 1.00 0.00 C ATOM 274 CG GLN A 26 -9.757 9.875 -8.653 1.00 0.00 C ATOM 275 CD GLN A 26 -10.473 10.942 -9.457 1.00 0.00 C ATOM 276 OE1 GLN A 26 -9.865 11.632 -10.274 1.00 0.00 O ATOM 277 NE2 GLN A 26 -11.774 11.081 -9.227 1.00 0.00 N ATOM 0 H GLN A 26 -8.828 9.070 -6.423 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.642 8.031 -8.658 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -8.046 10.977 -7.993 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.889 10.303 -9.603 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.962 8.898 -9.090 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.156 9.861 -7.639 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -12.237 10.486 -8.540 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -12.310 11.783 -9.738 1.00 0.00 H new ATOM 286 N PHE A 27 -5.543 9.889 -6.956 1.00 0.00 N ATOM 287 CA PHE A 27 -4.137 10.244 -6.817 1.00 0.00 C ATOM 288 C PHE A 27 -3.297 9.003 -6.532 1.00 0.00 C ATOM 289 O PHE A 27 -2.230 8.814 -7.116 1.00 0.00 O ATOM 290 CB PHE A 27 -3.963 11.267 -5.695 1.00 0.00 C ATOM 291 CG PHE A 27 -2.886 12.278 -5.965 1.00 0.00 C ATOM 292 CD1 PHE A 27 -1.553 11.900 -5.998 1.00 0.00 C ATOM 293 CD2 PHE A 27 -3.208 13.607 -6.189 1.00 0.00 C ATOM 294 CE1 PHE A 27 -0.561 12.830 -6.248 1.00 0.00 C ATOM 295 CE2 PHE A 27 -2.220 14.541 -6.439 1.00 0.00 C ATOM 296 CZ PHE A 27 -0.895 14.152 -6.469 1.00 0.00 C ATOM 0 H PHE A 27 -6.136 10.200 -6.186 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.796 10.684 -7.754 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.908 11.788 -5.540 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.733 10.742 -4.768 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -1.286 10.868 -5.827 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -4.242 13.917 -6.168 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.474 12.523 -6.270 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -2.484 15.574 -6.611 1.00 0.00 H new ATOM 0 HZ PHE A 27 -0.122 14.880 -6.665 1.00 0.00 H new ATOM 306 N VAL A 28 -3.792 8.157 -5.634 1.00 0.00 N ATOM 307 CA VAL A 28 -3.091 6.931 -5.276 1.00 0.00 C ATOM 308 C VAL A 28 -2.989 5.992 -6.471 1.00 0.00 C ATOM 309 O VAL A 28 -1.891 5.624 -6.888 1.00 0.00 O ATOM 310 CB VAL A 28 -3.792 6.194 -4.120 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.904 5.084 -3.580 1.00 0.00 C ATOM 312 CG2 VAL A 28 -4.171 7.169 -3.014 1.00 0.00 C ATOM 0 H VAL A 28 -4.674 8.298 -5.142 1.00 0.00 H new ATOM 0 HA VAL A 28 -2.091 7.223 -4.955 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.707 5.743 -4.503 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -3.415 4.574 -2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.689 4.371 -4.376 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.971 5.511 -3.213 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -4.665 6.629 -2.206 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -3.272 7.652 -2.631 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.848 7.925 -3.412 1.00 0.00 H new ATOM 322 N GLN A 29 -4.139 5.613 -7.027 1.00 0.00 N ATOM 323 CA GLN A 29 -4.177 4.722 -8.177 1.00 0.00 C ATOM 324 C GLN A 29 -3.221 5.200 -9.265 1.00 0.00 C ATOM 325 O GLN A 29 -2.546 4.396 -9.908 1.00 0.00 O ATOM 326 CB GLN A 29 -5.600 4.632 -8.724 1.00 0.00 C ATOM 327 CG GLN A 29 -6.234 5.983 -9.000 1.00 0.00 C ATOM 328 CD GLN A 29 -6.315 6.298 -10.481 1.00 0.00 C ATOM 329 OE1 GLN A 29 -5.870 7.354 -10.929 1.00 0.00 O ATOM 330 NE2 GLN A 29 -6.887 5.378 -11.249 1.00 0.00 N ATOM 0 H GLN A 29 -5.056 5.912 -6.696 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.858 3.731 -7.855 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.589 4.050 -9.646 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.220 4.088 -8.011 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -7.237 6.004 -8.573 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.657 6.760 -8.498 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.242 4.516 -10.834 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.971 5.533 -12.254 1.00 0.00 H new ATOM 339 N GLU A 30 -3.158 6.515 -9.456 1.00 0.00 N ATOM 340 CA GLU A 30 -2.270 7.094 -10.457 1.00 0.00 C ATOM 341 C GLU A 30 -0.824 6.714 -10.154 1.00 0.00 C ATOM 342 O GLU A 30 -0.066 6.332 -11.047 1.00 0.00 O ATOM 343 CB GLU A 30 -2.421 8.618 -10.488 1.00 0.00 C ATOM 344 CG GLU A 30 -2.822 9.161 -11.851 1.00 0.00 C ATOM 345 CD GLU A 30 -3.588 10.465 -11.756 1.00 0.00 C ATOM 346 OE1 GLU A 30 -3.194 11.327 -10.943 1.00 0.00 O ATOM 347 OE2 GLU A 30 -4.583 10.626 -12.496 1.00 0.00 O ATOM 0 H GLU A 30 -3.709 7.196 -8.933 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.542 6.699 -11.436 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -3.169 8.916 -9.753 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.478 9.075 -10.187 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.928 9.312 -12.455 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.434 8.421 -12.367 1.00 0.00 H new ATOM 354 N MET A 31 -0.456 6.810 -8.881 1.00 0.00 N ATOM 355 CA MET A 31 0.891 6.466 -8.447 1.00 0.00 C ATOM 356 C MET A 31 1.117 4.961 -8.565 1.00 0.00 C ATOM 357 O MET A 31 2.107 4.514 -9.142 1.00 0.00 O ATOM 358 CB MET A 31 1.113 6.922 -7.001 1.00 0.00 C ATOM 359 CG MET A 31 2.389 6.386 -6.372 1.00 0.00 C ATOM 360 SD MET A 31 2.560 6.857 -4.640 1.00 0.00 S ATOM 361 CE MET A 31 0.966 6.356 -3.993 1.00 0.00 C ATOM 0 H MET A 31 -1.073 7.124 -8.132 1.00 0.00 H new ATOM 0 HA MET A 31 1.606 6.978 -9.090 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.137 8.011 -6.974 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.262 6.607 -6.397 1.00 0.00 H new ATOM 0 HG2 MET A 31 2.400 5.299 -6.452 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.248 6.755 -6.932 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.064 6.108 -2.936 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.253 7.172 -4.110 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.610 5.483 -4.539 1.00 0.00 H new ATOM 371 N ILE A 32 0.188 4.186 -8.015 1.00 0.00 N ATOM 372 CA ILE A 32 0.279 2.732 -8.054 1.00 0.00 C ATOM 373 C ILE A 32 0.414 2.222 -9.486 1.00 0.00 C ATOM 374 O ILE A 32 1.393 1.560 -9.828 1.00 0.00 O ATOM 375 CB ILE A 32 -0.952 2.070 -7.398 1.00 0.00 C ATOM 376 CG1 ILE A 32 -1.192 2.639 -5.994 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.777 0.559 -7.340 1.00 0.00 C ATOM 378 CD1 ILE A 32 0.074 2.848 -5.190 1.00 0.00 C ATOM 0 H ILE A 32 -0.639 4.543 -7.536 1.00 0.00 H new ATOM 0 HA ILE A 32 1.172 2.460 -7.491 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.826 2.293 -8.009 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.715 3.591 -6.083 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.850 1.964 -5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.654 0.109 -6.875 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.661 0.167 -8.350 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.109 0.318 -6.753 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.180 3.252 -4.210 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.588 1.895 -5.067 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.726 3.547 -5.713 1.00 0.00 H new ATOM 390 N ARG A 33 -0.576 2.530 -10.319 1.00 0.00 N ATOM 391 CA ARG A 33 -0.565 2.101 -11.709 1.00 0.00 C ATOM 392 C ARG A 33 0.735 2.511 -12.399 1.00 0.00 C ATOM 393 O ARG A 33 1.250 1.787 -13.252 1.00 0.00 O ATOM 394 CB ARG A 33 -1.770 2.685 -12.448 1.00 0.00 C ATOM 395 CG ARG A 33 -1.682 4.186 -12.676 1.00 0.00 C ATOM 396 CD ARG A 33 -1.076 4.508 -14.033 1.00 0.00 C ATOM 397 NE ARG A 33 -1.815 5.562 -14.726 1.00 0.00 N ATOM 398 CZ ARG A 33 -1.631 6.863 -14.513 1.00 0.00 C ATOM 399 NH1 ARG A 33 -0.740 7.278 -13.621 1.00 0.00 N ATOM 400 NH2 ARG A 33 -2.344 7.753 -15.191 1.00 0.00 N ATOM 0 H ARG A 33 -1.396 3.076 -10.053 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.629 1.013 -11.733 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.870 2.186 -13.412 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.674 2.466 -11.880 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.677 4.625 -12.607 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -1.079 4.640 -11.890 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.039 4.818 -13.903 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.065 3.608 -14.648 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.514 5.284 -15.415 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -0.191 6.599 -13.094 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -0.604 8.276 -13.463 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.033 7.440 -15.875 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.203 8.750 -15.028 1.00 0.00 H new ATOM 414 N GLN A 34 1.267 3.668 -12.014 1.00 0.00 N ATOM 415 CA GLN A 34 2.513 4.157 -12.587 1.00 0.00 C ATOM 416 C GLN A 34 3.699 3.407 -11.996 1.00 0.00 C ATOM 417 O GLN A 34 4.760 3.313 -12.613 1.00 0.00 O ATOM 418 CB GLN A 34 2.662 5.659 -12.337 1.00 0.00 C ATOM 419 CG GLN A 34 3.575 6.355 -13.335 1.00 0.00 C ATOM 420 CD GLN A 34 2.805 7.076 -14.422 1.00 0.00 C ATOM 421 OE1 GLN A 34 3.063 8.245 -14.712 1.00 0.00 O ATOM 422 NE2 GLN A 34 1.851 6.380 -15.033 1.00 0.00 N ATOM 0 H GLN A 34 0.855 4.281 -11.310 1.00 0.00 H new ATOM 0 HA GLN A 34 2.490 3.982 -13.663 1.00 0.00 H new ATOM 0 HB2 GLN A 34 1.677 6.124 -12.373 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.052 5.814 -11.331 1.00 0.00 H new ATOM 0 HG2 GLN A 34 4.207 7.069 -12.807 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.237 5.619 -13.791 1.00 0.00 H new ATOM 0 HE21 GLN A 34 1.671 5.414 -14.761 1.00 0.00 H new ATOM 0 HE22 GLN A 34 1.299 6.812 -15.774 1.00 0.00 H new ATOM 431 N LEU A 35 3.508 2.870 -10.794 1.00 0.00 N ATOM 432 CA LEU A 35 4.552 2.123 -10.114 1.00 0.00 C ATOM 433 C LEU A 35 4.652 0.701 -10.662 1.00 0.00 C ATOM 434 O LEU A 35 5.700 0.062 -10.566 1.00 0.00 O ATOM 435 CB LEU A 35 4.275 2.082 -8.611 1.00 0.00 C ATOM 436 CG LEU A 35 4.663 3.347 -7.843 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.449 3.151 -6.351 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.109 3.720 -8.132 1.00 0.00 C ATOM 0 H LEU A 35 2.634 2.941 -10.272 1.00 0.00 H new ATOM 0 HA LEU A 35 5.502 2.628 -10.292 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.212 1.895 -8.459 1.00 0.00 H new ATOM 0 HB3 LEU A 35 4.812 1.236 -8.182 1.00 0.00 H new ATOM 0 HG LEU A 35 4.023 4.164 -8.176 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.730 4.061 -5.821 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.399 2.929 -6.160 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.064 2.322 -6.001 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.370 4.622 -7.578 1.00 0.00 H new ATOM 0 HD22 LEU A 35 6.763 2.904 -7.825 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.231 3.902 -9.200 1.00 0.00 H new ATOM 450 N GLU A 36 3.556 0.212 -11.233 1.00 0.00 N ATOM 451 CA GLU A 36 3.521 -1.134 -11.792 1.00 0.00 C ATOM 452 C GLU A 36 4.101 -1.155 -13.202 1.00 0.00 C ATOM 453 O GLU A 36 4.830 -2.076 -13.571 1.00 0.00 O ATOM 454 CB GLU A 36 2.086 -1.665 -11.812 1.00 0.00 C ATOM 455 CG GLU A 36 1.390 -1.587 -10.463 1.00 0.00 C ATOM 456 CD GLU A 36 0.271 -2.600 -10.326 1.00 0.00 C ATOM 457 OE1 GLU A 36 0.427 -3.729 -10.834 1.00 0.00 O ATOM 458 OE2 GLU A 36 -0.763 -2.263 -9.711 1.00 0.00 O ATOM 0 H GLU A 36 2.680 0.728 -11.321 1.00 0.00 H new ATOM 0 HA GLU A 36 4.131 -1.777 -11.158 1.00 0.00 H new ATOM 0 HB2 GLU A 36 1.508 -1.099 -12.543 1.00 0.00 H new ATOM 0 HB3 GLU A 36 2.096 -2.702 -12.147 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.121 -1.749 -9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 36 0.986 -0.584 -10.324 1.00 0.00 H new ATOM 465 N GLN A 37 3.768 -0.138 -13.987 1.00 0.00 N ATOM 466 CA GLN A 37 4.248 -0.041 -15.356 1.00 0.00 C ATOM 467 C GLN A 37 5.722 0.355 -15.402 1.00 0.00 C ATOM 468 O GLN A 37 6.440 -0.001 -16.337 1.00 0.00 O ATOM 469 CB GLN A 37 3.411 0.975 -16.131 1.00 0.00 C ATOM 470 CG GLN A 37 3.243 2.303 -15.409 1.00 0.00 C ATOM 471 CD GLN A 37 3.691 3.484 -16.247 1.00 0.00 C ATOM 472 OE1 GLN A 37 2.877 4.160 -16.877 1.00 0.00 O ATOM 473 NE2 GLN A 37 4.995 3.739 -16.260 1.00 0.00 N ATOM 0 H GLN A 37 3.166 0.632 -13.696 1.00 0.00 H new ATOM 0 HA GLN A 37 4.148 -1.023 -15.819 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.878 1.154 -17.100 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.426 0.549 -16.325 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.196 2.433 -15.135 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.815 2.283 -14.481 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.635 3.153 -15.723 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.356 4.521 -16.807 1.00 0.00 H new ATOM 555 N LEU A 42 5.878 -5.815 -11.069 1.00 0.00 N ATOM 556 CA LEU A 42 5.159 -5.402 -9.870 1.00 0.00 C ATOM 557 C LEU A 42 3.659 -5.632 -10.035 1.00 0.00 C ATOM 558 O LEU A 42 3.033 -5.080 -10.940 1.00 0.00 O ATOM 559 CB LEU A 42 5.431 -3.929 -9.564 1.00 0.00 C ATOM 560 CG LEU A 42 5.015 -3.470 -8.164 1.00 0.00 C ATOM 561 CD1 LEU A 42 6.203 -3.512 -7.215 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.417 -2.072 -8.215 1.00 0.00 C ATOM 0 HA LEU A 42 5.515 -6.007 -9.036 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.497 -3.738 -9.690 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.908 -3.318 -10.300 1.00 0.00 H new ATOM 0 HG LEU A 42 4.253 -4.153 -7.790 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.889 -3.183 -6.224 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.584 -4.531 -7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.988 -2.852 -7.585 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.127 -1.763 -7.211 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.156 -1.375 -8.610 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.539 -2.075 -8.861 1.00 0.00 H new ATOM 574 N LYS A 43 3.091 -6.453 -9.158 1.00 0.00 N ATOM 575 CA LYS A 43 1.668 -6.761 -9.208 1.00 0.00 C ATOM 576 C LYS A 43 0.958 -6.309 -7.935 1.00 0.00 C ATOM 577 O LYS A 43 0.894 -7.046 -6.950 1.00 0.00 O ATOM 578 CB LYS A 43 1.460 -8.262 -9.415 1.00 0.00 C ATOM 579 CG LYS A 43 2.126 -8.800 -10.670 1.00 0.00 C ATOM 580 CD LYS A 43 1.581 -8.129 -11.924 1.00 0.00 C ATOM 581 CE LYS A 43 2.687 -7.469 -12.733 1.00 0.00 C ATOM 582 NZ LYS A 43 3.343 -8.429 -13.663 1.00 0.00 N ATOM 0 H LYS A 43 3.596 -6.917 -8.403 1.00 0.00 H new ATOM 0 HA LYS A 43 1.237 -6.218 -10.049 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.849 -8.797 -8.549 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.391 -8.469 -9.464 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.202 -8.639 -10.609 1.00 0.00 H new ATOM 0 HG3 LYS A 43 1.967 -9.876 -10.734 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.071 -8.869 -12.541 1.00 0.00 H new ATOM 0 HD3 LYS A 43 0.839 -7.381 -11.644 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.273 -6.637 -13.303 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.433 -7.052 -12.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.091 -7.940 -14.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.760 -9.210 -13.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.637 -8.808 -14.326 1.00 0.00 H new ATOM 596 N LEU A 44 0.419 -5.095 -7.967 1.00 0.00 N ATOM 597 CA LEU A 44 -0.295 -4.550 -6.820 1.00 0.00 C ATOM 598 C LEU A 44 -1.791 -4.813 -6.952 1.00 0.00 C ATOM 599 O LEU A 44 -2.285 -5.082 -8.047 1.00 0.00 O ATOM 600 CB LEU A 44 -0.027 -3.050 -6.690 1.00 0.00 C ATOM 601 CG LEU A 44 1.192 -2.688 -5.842 1.00 0.00 C ATOM 602 CD1 LEU A 44 1.791 -1.367 -6.294 1.00 0.00 C ATOM 603 CD2 LEU A 44 0.816 -2.626 -4.371 1.00 0.00 C ATOM 0 H LEU A 44 0.463 -4.472 -8.773 1.00 0.00 H new ATOM 0 HA LEU A 44 0.066 -5.046 -5.919 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.104 -2.631 -7.688 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.907 -2.574 -6.258 1.00 0.00 H new ATOM 0 HG LEU A 44 1.944 -3.466 -5.976 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.657 -1.130 -5.676 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.099 -1.445 -7.337 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.047 -0.577 -6.194 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.695 -2.367 -3.781 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.045 -1.870 -4.224 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.438 -3.597 -4.051 1.00 0.00 H new ATOM 615 N CYS A 45 -2.508 -4.748 -5.835 1.00 0.00 N ATOM 616 CA CYS A 45 -3.945 -4.998 -5.846 1.00 0.00 C ATOM 617 C CYS A 45 -4.697 -3.970 -5.007 1.00 0.00 C ATOM 618 O CYS A 45 -4.101 -3.233 -4.225 1.00 0.00 O ATOM 619 CB CYS A 45 -4.234 -6.405 -5.325 1.00 0.00 C ATOM 620 SG CYS A 45 -3.624 -7.736 -6.406 1.00 0.00 S ATOM 0 H CYS A 45 -2.122 -4.526 -4.917 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.292 -4.912 -6.876 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.782 -6.516 -4.339 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.310 -6.520 -5.197 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.074 -8.665 -5.682 1.00 0.00 H new ATOM 625 N VAL A 46 -6.017 -3.933 -5.176 1.00 0.00 N ATOM 626 CA VAL A 46 -6.861 -3.004 -4.432 1.00 0.00 C ATOM 627 C VAL A 46 -8.155 -3.679 -3.988 1.00 0.00 C ATOM 628 O VAL A 46 -8.475 -4.782 -4.433 1.00 0.00 O ATOM 629 CB VAL A 46 -7.198 -1.751 -5.269 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.926 -1.049 -5.718 1.00 0.00 C ATOM 631 CG2 VAL A 46 -8.065 -2.114 -6.468 1.00 0.00 C ATOM 0 H VAL A 46 -6.525 -4.537 -5.823 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.297 -2.695 -3.552 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.764 -1.065 -4.639 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.185 -0.169 -6.306 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.350 -0.745 -4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.330 -1.730 -6.326 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.288 -1.214 -7.041 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.532 -2.824 -7.100 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.995 -2.564 -6.121 1.00 0.00 H new ATOM 641 N SER A 47 -8.898 -3.012 -3.112 1.00 0.00 N ATOM 642 CA SER A 47 -10.158 -3.552 -2.612 1.00 0.00 C ATOM 643 C SER A 47 -11.256 -2.495 -2.649 1.00 0.00 C ATOM 644 O SER A 47 -11.221 -1.523 -1.896 1.00 0.00 O ATOM 645 CB SER A 47 -9.988 -4.078 -1.186 1.00 0.00 C ATOM 646 OG SER A 47 -11.181 -4.679 -0.717 1.00 0.00 O ATOM 0 H SER A 47 -8.651 -2.098 -2.733 1.00 0.00 H new ATOM 0 HA SER A 47 -10.450 -4.378 -3.261 1.00 0.00 H new ATOM 0 HB2 SER A 47 -9.176 -4.805 -1.158 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.706 -3.259 -0.525 1.00 0.00 H new ATOM 0 HG SER A 47 -11.320 -4.440 0.223 1.00 0.00 H new ATOM 781 N VAL A 57 -8.320 -1.454 -14.356 1.00 0.00 N ATOM 782 CA VAL A 57 -7.367 -1.332 -13.258 1.00 0.00 C ATOM 783 C VAL A 57 -7.073 -2.688 -12.624 1.00 0.00 C ATOM 784 O VAL A 57 -7.736 -3.682 -12.921 1.00 0.00 O ATOM 785 CB VAL A 57 -7.884 -0.373 -12.170 1.00 0.00 C ATOM 786 CG1 VAL A 57 -7.939 1.053 -12.695 1.00 0.00 C ATOM 787 CG2 VAL A 57 -9.250 -0.817 -11.670 1.00 0.00 C ATOM 0 HA VAL A 57 -6.449 -0.929 -13.684 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.189 -0.400 -11.331 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.307 1.715 -11.911 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.940 1.368 -12.997 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.609 1.099 -13.553 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.598 -0.127 -10.902 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.957 -0.823 -12.500 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.175 -1.820 -11.250 1.00 0.00 H new ATOM 797 N TRP A 58 -6.076 -2.716 -11.747 1.00 0.00 N ATOM 798 CA TRP A 58 -5.684 -3.938 -11.065 1.00 0.00 C ATOM 799 C TRP A 58 -6.354 -4.023 -9.696 1.00 0.00 C ATOM 800 O TRP A 58 -6.110 -3.188 -8.825 1.00 0.00 O ATOM 801 CB TRP A 58 -4.164 -3.974 -10.910 1.00 0.00 C ATOM 802 CG TRP A 58 -3.582 -5.334 -11.112 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.921 -6.467 -10.441 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.561 -5.706 -12.047 1.00 0.00 C ATOM 805 NE1 TRP A 58 -3.172 -7.526 -10.894 1.00 0.00 N ATOM 806 CE2 TRP A 58 -2.331 -7.084 -11.882 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.822 -5.007 -13.004 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -1.391 -7.777 -12.641 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.888 -5.697 -13.757 1.00 0.00 C ATOM 810 CH2 TRP A 58 -0.681 -7.069 -13.572 1.00 0.00 C ATOM 0 H TRP A 58 -5.522 -1.898 -11.492 1.00 0.00 H new ATOM 0 HA TRP A 58 -6.005 -4.794 -11.659 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.716 -3.285 -11.626 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -3.899 -3.617 -9.915 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.670 -6.526 -9.665 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -3.232 -8.485 -10.551 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -1.976 -3.949 -13.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -1.228 -8.835 -12.500 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -0.309 -5.168 -14.500 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.054 -7.579 -14.177 1.00 0.00 H new ATOM 821 N SER A 59 -7.206 -5.028 -9.514 1.00 0.00 N ATOM 822 CA SER A 59 -7.914 -5.206 -8.250 1.00 0.00 C ATOM 823 C SER A 59 -7.924 -6.669 -7.814 1.00 0.00 C ATOM 824 O SER A 59 -7.608 -7.565 -8.596 1.00 0.00 O ATOM 825 CB SER A 59 -9.350 -4.691 -8.372 1.00 0.00 C ATOM 826 OG SER A 59 -9.386 -3.431 -9.019 1.00 0.00 O ATOM 0 H SER A 59 -7.422 -5.729 -10.223 1.00 0.00 H new ATOM 0 HA SER A 59 -7.385 -4.631 -7.490 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.951 -5.408 -8.932 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.795 -4.607 -7.381 1.00 0.00 H new ATOM 0 HG SER A 59 -10.314 -3.124 -9.086 1.00 0.00 H new ATOM 832 N ILE A 60 -8.294 -6.898 -6.556 1.00 0.00 N ATOM 833 CA ILE A 60 -8.352 -8.246 -6.003 1.00 0.00 C ATOM 834 C ILE A 60 -9.263 -8.296 -4.779 1.00 0.00 C ATOM 835 O ILE A 60 -9.425 -7.298 -4.076 1.00 0.00 O ATOM 836 CB ILE A 60 -6.946 -8.754 -5.607 1.00 0.00 C ATOM 837 CG1 ILE A 60 -6.876 -10.280 -5.736 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.590 -8.317 -4.188 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.751 -10.912 -4.941 1.00 0.00 C ATOM 0 H ILE A 60 -8.559 -6.164 -5.900 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.756 -8.892 -6.782 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.217 -8.314 -6.288 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.824 -10.707 -5.408 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.756 -10.541 -6.787 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.597 -8.686 -3.932 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.599 -7.229 -4.129 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.320 -8.724 -3.488 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.767 -11.993 -5.083 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.796 -10.515 -5.284 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -5.880 -10.683 -3.883 1.00 0.00 H new ATOM 851 N ALA A 61 -9.838 -9.463 -4.515 1.00 0.00 N ATOM 852 CA ALA A 61 -10.708 -9.630 -3.359 1.00 0.00 C ATOM 853 C ALA A 61 -9.911 -9.443 -2.073 1.00 0.00 C ATOM 854 O ALA A 61 -8.803 -9.963 -1.937 1.00 0.00 O ATOM 855 CB ALA A 61 -11.371 -11.000 -3.386 1.00 0.00 C ATOM 0 H ALA A 61 -9.718 -10.302 -5.082 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.491 -8.872 -3.396 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.018 -11.108 -2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.966 -11.099 -4.294 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.605 -11.775 -3.368 1.00 0.00 H new ATOM 861 N SER A 62 -10.470 -8.684 -1.138 1.00 0.00 N ATOM 862 CA SER A 62 -9.800 -8.416 0.130 1.00 0.00 C ATOM 863 C SER A 62 -9.508 -9.701 0.904 1.00 0.00 C ATOM 864 O SER A 62 -8.705 -9.698 1.839 1.00 0.00 O ATOM 865 CB SER A 62 -10.648 -7.475 0.987 1.00 0.00 C ATOM 866 OG SER A 62 -10.025 -7.223 2.236 1.00 0.00 O ATOM 0 H SER A 62 -11.385 -8.243 -1.233 1.00 0.00 H new ATOM 0 HA SER A 62 -8.846 -7.941 -0.099 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.802 -6.535 0.457 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.632 -7.914 1.150 1.00 0.00 H new ATOM 0 HG SER A 62 -9.329 -7.894 2.396 1.00 0.00 H new ATOM 872 N GLU A 63 -10.154 -10.796 0.520 1.00 0.00 N ATOM 873 CA GLU A 63 -9.948 -12.075 1.190 1.00 0.00 C ATOM 874 C GLU A 63 -8.727 -12.800 0.631 1.00 0.00 C ATOM 875 O GLU A 63 -8.210 -13.728 1.253 1.00 0.00 O ATOM 876 CB GLU A 63 -11.191 -12.957 1.051 1.00 0.00 C ATOM 877 CG GLU A 63 -11.749 -13.006 -0.364 1.00 0.00 C ATOM 878 CD GLU A 63 -12.373 -14.347 -0.697 1.00 0.00 C ATOM 879 OE1 GLU A 63 -11.626 -15.270 -1.082 1.00 0.00 O ATOM 880 OE2 GLU A 63 -13.609 -14.473 -0.570 1.00 0.00 O ATOM 0 H GLU A 63 -10.823 -10.824 -0.249 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.771 -11.874 2.247 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.945 -13.970 1.371 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.965 -12.589 1.725 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.496 -12.222 -0.484 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.949 -12.795 -1.074 1.00 0.00 H new ATOM 887 N LEU A 64 -8.274 -12.382 -0.548 1.00 0.00 N ATOM 888 CA LEU A 64 -7.124 -12.999 -1.184 1.00 0.00 C ATOM 889 C LEU A 64 -5.836 -12.240 -0.873 1.00 0.00 C ATOM 890 O LEU A 64 -4.751 -12.659 -1.276 1.00 0.00 O ATOM 891 CB LEU A 64 -7.330 -13.061 -2.698 1.00 0.00 C ATOM 892 CG LEU A 64 -8.786 -13.047 -3.162 1.00 0.00 C ATOM 893 CD1 LEU A 64 -8.866 -13.098 -4.681 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.546 -14.211 -2.547 1.00 0.00 C ATOM 0 H LEU A 64 -8.690 -11.617 -1.079 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.029 -14.009 -0.785 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.813 -12.216 -3.153 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.855 -13.966 -3.076 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.246 -12.117 -2.829 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.911 -13.087 -4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.354 -12.233 -5.102 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.391 -14.011 -5.040 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.582 -14.189 -2.886 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.084 -15.150 -2.853 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.518 -14.130 -1.460 1.00 0.00 H new ATOM 906 N ILE A 65 -5.953 -11.120 -0.164 1.00 0.00 N ATOM 907 CA ILE A 65 -4.787 -10.317 0.180 1.00 0.00 C ATOM 908 C ILE A 65 -3.863 -11.062 1.138 1.00 0.00 C ATOM 909 O ILE A 65 -2.727 -11.390 0.792 1.00 0.00 O ATOM 910 CB ILE A 65 -5.191 -8.974 0.818 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.248 -8.272 -0.036 1.00 0.00 C ATOM 912 CG2 ILE A 65 -3.968 -8.084 0.993 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.678 -6.930 0.516 1.00 0.00 C ATOM 0 H ILE A 65 -6.839 -10.751 0.181 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.258 -10.123 -0.753 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.620 -9.171 1.801 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.855 -8.132 -1.043 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.122 -8.918 -0.121 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.268 -7.138 1.445 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.245 -8.582 1.639 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.514 -7.894 0.020 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.429 -6.490 -0.141 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.101 -7.065 1.512 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.815 -6.267 0.575 1.00 0.00 H new ATOM 925 N GLU A 66 -4.353 -11.320 2.343 1.00 0.00 N ATOM 926 CA GLU A 66 -3.574 -12.018 3.357 1.00 0.00 C ATOM 927 C GLU A 66 -3.272 -13.459 2.944 1.00 0.00 C ATOM 928 O GLU A 66 -2.423 -14.116 3.546 1.00 0.00 O ATOM 929 CB GLU A 66 -4.325 -12.006 4.689 1.00 0.00 C ATOM 930 CG GLU A 66 -5.795 -12.374 4.564 1.00 0.00 C ATOM 931 CD GLU A 66 -6.383 -12.872 5.870 1.00 0.00 C ATOM 932 OE1 GLU A 66 -5.661 -13.560 6.622 1.00 0.00 O ATOM 933 OE2 GLU A 66 -7.565 -12.575 6.141 1.00 0.00 O ATOM 0 H GLU A 66 -5.291 -11.055 2.643 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.624 -11.496 3.466 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.842 -12.702 5.375 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.244 -11.014 5.133 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.356 -11.503 4.225 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.910 -13.144 3.801 1.00 0.00 H new ATOM 940 N LYS A 67 -3.971 -13.948 1.924 1.00 0.00 N ATOM 941 CA LYS A 67 -3.770 -15.316 1.452 1.00 0.00 C ATOM 942 C LYS A 67 -2.884 -15.358 0.208 1.00 0.00 C ATOM 943 O LYS A 67 -2.208 -16.355 -0.046 1.00 0.00 O ATOM 944 CB LYS A 67 -5.118 -15.971 1.150 1.00 0.00 C ATOM 945 CG LYS A 67 -6.132 -15.824 2.273 1.00 0.00 C ATOM 946 CD LYS A 67 -6.244 -17.098 3.096 1.00 0.00 C ATOM 947 CE LYS A 67 -7.465 -17.911 2.699 1.00 0.00 C ATOM 948 NZ LYS A 67 -7.412 -19.295 3.245 1.00 0.00 N ATOM 0 H LYS A 67 -4.678 -13.422 1.410 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.265 -15.869 2.244 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.530 -15.533 0.241 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.961 -17.031 0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.842 -14.996 2.920 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.107 -15.574 1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.345 -17.700 2.961 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.302 -16.845 4.155 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.365 -17.413 3.059 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.536 -17.952 1.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.263 -19.817 2.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.566 -19.779 2.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.370 -19.257 4.283 1.00 0.00 H new ATOM 962 N ARG A 68 -2.894 -14.279 -0.569 1.00 0.00 N ATOM 963 CA ARG A 68 -2.094 -14.211 -1.787 1.00 0.00 C ATOM 964 C ARG A 68 -1.055 -13.094 -1.712 1.00 0.00 C ATOM 965 O ARG A 68 0.143 -13.342 -1.849 1.00 0.00 O ATOM 966 CB ARG A 68 -2.996 -14.001 -3.004 1.00 0.00 C ATOM 967 CG ARG A 68 -4.183 -14.950 -3.052 1.00 0.00 C ATOM 968 CD ARG A 68 -4.651 -15.185 -4.480 1.00 0.00 C ATOM 969 NE ARG A 68 -6.033 -15.657 -4.532 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.396 -16.915 -4.297 1.00 0.00 C ATOM 971 NH1 ARG A 68 -5.484 -17.828 -3.986 1.00 0.00 N ATOM 972 NH2 ARG A 68 -7.673 -17.262 -4.371 1.00 0.00 N ATOM 0 H ARG A 68 -3.445 -13.442 -0.378 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.566 -15.159 -1.889 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.362 -12.974 -3.002 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.404 -14.126 -3.911 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -3.908 -15.901 -2.597 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.003 -14.539 -2.462 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -4.563 -14.259 -5.048 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.000 -15.916 -4.959 1.00 0.00 H new ATOM 0 HE ARG A 68 -6.762 -14.982 -4.762 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.500 -17.566 -3.926 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -5.767 -18.791 -3.807 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -8.378 -16.564 -4.608 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -7.951 -18.227 -4.191 1.00 0.00 H new ATOM 986 N CYS A 69 -1.519 -11.867 -1.497 1.00 0.00 N ATOM 987 CA CYS A 69 -0.622 -10.717 -1.410 1.00 0.00 C ATOM 988 C CYS A 69 0.436 -10.929 -0.332 1.00 0.00 C ATOM 989 O CYS A 69 0.182 -11.578 0.682 1.00 0.00 O ATOM 990 CB CYS A 69 -1.418 -9.442 -1.121 1.00 0.00 C ATOM 991 SG CYS A 69 -1.908 -8.528 -2.601 1.00 0.00 S ATOM 0 H CYS A 69 -2.507 -11.643 -1.380 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.116 -10.610 -2.370 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.313 -9.705 -0.556 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -0.820 -8.789 -0.485 1.00 0.00 H new ATOM 0 HG CYS A 69 -3.179 -8.260 -2.545 1.00 0.00 H new ATOM 997 N ARG A 70 1.624 -10.378 -0.561 1.00 0.00 N ATOM 998 CA ARG A 70 2.725 -10.513 0.388 1.00 0.00 C ATOM 999 C ARG A 70 2.912 -9.231 1.196 1.00 0.00 C ATOM 1000 O ARG A 70 2.907 -9.257 2.426 1.00 0.00 O ATOM 1001 CB ARG A 70 4.019 -10.862 -0.349 1.00 0.00 C ATOM 1002 CG ARG A 70 4.415 -12.326 -0.223 1.00 0.00 C ATOM 1003 CD ARG A 70 5.692 -12.494 0.584 1.00 0.00 C ATOM 1004 NE ARG A 70 6.186 -13.869 0.548 1.00 0.00 N ATOM 1005 CZ ARG A 70 7.422 -14.221 0.894 1.00 0.00 C ATOM 1006 NH1 ARG A 70 8.292 -13.306 1.302 1.00 0.00 N ATOM 1007 NH2 ARG A 70 7.789 -15.494 0.835 1.00 0.00 N ATOM 0 H ARG A 70 1.849 -9.834 -1.394 1.00 0.00 H new ATOM 0 HA ARG A 70 2.479 -11.320 1.079 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.904 -10.615 -1.404 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.827 -10.241 0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.607 -12.882 0.253 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.553 -12.753 -1.216 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.458 -11.823 0.194 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.508 -12.202 1.618 1.00 0.00 H new ATOM 0 HE ARG A 70 5.546 -14.601 0.240 1.00 0.00 H new ATOM 0 HH11 ARG A 70 8.015 -12.326 1.352 1.00 0.00 H new ATOM 0 HH12 ARG A 70 9.238 -13.583 1.566 1.00 0.00 H new ATOM 0 HH21 ARG A 70 7.124 -16.203 0.525 1.00 0.00 H new ATOM 0 HH22 ARG A 70 8.736 -15.765 1.100 1.00 0.00 H new ATOM 1021 N ARG A 71 3.082 -8.112 0.497 1.00 0.00 N ATOM 1022 CA ARG A 71 3.275 -6.823 1.158 1.00 0.00 C ATOM 1023 C ARG A 71 2.058 -5.921 0.974 1.00 0.00 C ATOM 1024 O ARG A 71 1.197 -6.179 0.133 1.00 0.00 O ATOM 1025 CB ARG A 71 4.533 -6.120 0.634 1.00 0.00 C ATOM 1026 CG ARG A 71 4.886 -6.463 -0.805 1.00 0.00 C ATOM 1027 CD ARG A 71 5.883 -7.610 -0.876 1.00 0.00 C ATOM 1028 NE ARG A 71 7.202 -7.219 -0.384 1.00 0.00 N ATOM 1029 CZ ARG A 71 8.139 -8.084 -0.005 1.00 0.00 C ATOM 1030 NH1 ARG A 71 7.907 -9.392 -0.061 1.00 0.00 N ATOM 1031 NH2 ARG A 71 9.312 -7.644 0.430 1.00 0.00 N ATOM 0 H ARG A 71 3.090 -8.071 -0.522 1.00 0.00 H new ATOM 0 HA ARG A 71 3.402 -7.018 2.223 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.393 -5.042 0.715 1.00 0.00 H new ATOM 0 HB3 ARG A 71 5.375 -6.381 1.275 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.980 -6.732 -1.349 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.304 -5.585 -1.297 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.512 -8.450 -0.289 1.00 0.00 H new ATOM 0 HD3 ARG A 71 5.968 -7.954 -1.907 1.00 0.00 H new ATOM 0 HE ARG A 71 7.417 -6.224 -0.328 1.00 0.00 H new ATOM 0 HH11 ARG A 71 7.007 -9.736 -0.396 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.629 -10.051 0.231 1.00 0.00 H new ATOM 0 HH21 ARG A 71 9.496 -6.642 0.474 1.00 0.00 H new ATOM 0 HH22 ARG A 71 10.030 -8.308 0.720 1.00 0.00 H new ATOM 1045 N MET A 72 1.990 -4.865 1.778 1.00 0.00 N ATOM 1046 CA MET A 72 0.882 -3.923 1.721 1.00 0.00 C ATOM 1047 C MET A 72 1.387 -2.489 1.579 1.00 0.00 C ATOM 1048 O MET A 72 2.486 -2.159 2.025 1.00 0.00 O ATOM 1049 CB MET A 72 0.030 -4.054 2.983 1.00 0.00 C ATOM 1050 CG MET A 72 -1.189 -4.945 2.807 1.00 0.00 C ATOM 1051 SD MET A 72 -0.760 -6.611 2.265 1.00 0.00 S ATOM 1052 CE MET A 72 -1.869 -7.591 3.274 1.00 0.00 C ATOM 0 H MET A 72 2.695 -4.641 2.480 1.00 0.00 H new ATOM 0 HA MET A 72 0.276 -4.157 0.846 1.00 0.00 H new ATOM 0 HB2 MET A 72 0.647 -4.453 3.788 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.298 -3.062 3.294 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.731 -5.003 3.751 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.863 -4.493 2.079 1.00 0.00 H new ATOM 0 HE1 MET A 72 -1.921 -8.605 2.878 1.00 0.00 H new ATOM 0 HE2 MET A 72 -1.498 -7.620 4.299 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.863 -7.145 3.261 1.00 0.00 H new ATOM 1062 N VAL A 73 0.572 -1.641 0.962 1.00 0.00 N ATOM 1063 CA VAL A 73 0.926 -0.244 0.768 1.00 0.00 C ATOM 1064 C VAL A 73 -0.204 0.655 1.254 1.00 0.00 C ATOM 1065 O VAL A 73 -1.188 0.872 0.548 1.00 0.00 O ATOM 1066 CB VAL A 73 1.230 0.058 -0.715 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.550 1.534 -0.915 1.00 0.00 C ATOM 1068 CG2 VAL A 73 2.375 -0.815 -1.211 1.00 0.00 C ATOM 0 H VAL A 73 -0.341 -1.900 0.587 1.00 0.00 H new ATOM 0 HA VAL A 73 1.826 -0.044 1.349 1.00 0.00 H new ATOM 0 HB VAL A 73 0.341 -0.174 -1.301 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.761 1.721 -1.968 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.697 2.137 -0.603 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.422 1.802 -0.318 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.577 -0.590 -2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 73 3.268 -0.616 -0.618 1.00 0.00 H new ATOM 0 HG23 VAL A 73 2.101 -1.865 -1.112 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.063 1.161 2.475 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.083 2.017 3.068 1.00 0.00 C ATOM 1080 C VAL A 74 -0.812 3.492 2.794 1.00 0.00 C ATOM 1081 O VAL A 74 0.337 3.932 2.769 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.183 1.798 4.592 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.516 2.307 5.115 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -0.995 0.326 4.937 1.00 0.00 C ATOM 0 H VAL A 74 0.747 0.993 3.072 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.028 1.740 2.601 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.386 2.364 5.075 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.570 2.145 6.192 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.607 3.372 4.903 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.328 1.769 4.626 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.069 0.193 6.016 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.768 -0.265 4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.014 -0.005 4.597 1.00 0.00 H new ATOM 1094 N VAL A 75 -1.885 4.251 2.590 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.779 5.679 2.318 1.00 0.00 C ATOM 1096 C VAL A 75 -2.478 6.492 3.404 1.00 0.00 C ATOM 1097 O VAL A 75 -3.702 6.622 3.405 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.388 6.034 0.946 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.203 7.512 0.641 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.772 5.174 -0.148 1.00 0.00 C ATOM 0 H VAL A 75 -2.842 3.898 2.608 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.718 5.928 2.308 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.458 5.829 0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.640 7.740 -0.331 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.697 8.107 1.409 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.139 7.750 0.626 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.213 5.437 -1.109 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.696 5.345 -0.183 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.965 4.122 0.064 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.693 7.034 4.332 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.241 7.830 5.426 1.00 0.00 C ATOM 1112 C VAL A 76 -2.217 9.319 5.096 1.00 0.00 C ATOM 1113 O VAL A 76 -1.210 9.994 5.296 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.465 7.590 6.737 1.00 0.00 C ATOM 1115 CG1 VAL A 76 0.010 7.924 6.559 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -2.072 8.396 7.879 1.00 0.00 C ATOM 0 H VAL A 76 -0.678 6.937 4.348 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.275 7.512 5.560 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.544 6.533 6.991 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.539 7.748 7.496 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.434 7.293 5.778 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.114 8.971 6.275 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.509 8.212 8.794 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.032 9.458 7.636 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.110 8.096 8.025 1.00 0.00 H new ATOM 1126 N SER A 77 -3.338 9.828 4.595 1.00 0.00 N ATOM 1127 CA SER A 77 -3.445 11.240 4.243 1.00 0.00 C ATOM 1128 C SER A 77 -4.612 11.897 4.976 1.00 0.00 C ATOM 1129 O SER A 77 -5.584 11.235 5.335 1.00 0.00 O ATOM 1130 CB SER A 77 -3.620 11.400 2.732 1.00 0.00 C ATOM 1131 OG SER A 77 -3.219 10.228 2.043 1.00 0.00 O ATOM 0 H SER A 77 -4.184 9.285 4.424 1.00 0.00 H new ATOM 0 HA SER A 77 -2.523 11.735 4.548 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.663 11.619 2.505 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.033 12.249 2.383 1.00 0.00 H new ATOM 0 HG SER A 77 -3.969 9.888 1.512 1.00 0.00 H new ATOM 1137 N ASP A 78 -4.502 13.206 5.198 1.00 0.00 N ATOM 1138 CA ASP A 78 -5.544 13.968 5.891 1.00 0.00 C ATOM 1139 C ASP A 78 -6.945 13.568 5.428 1.00 0.00 C ATOM 1140 O ASP A 78 -7.785 13.166 6.231 1.00 0.00 O ATOM 1141 CB ASP A 78 -5.339 15.464 5.652 1.00 0.00 C ATOM 1142 CG ASP A 78 -5.096 16.224 6.937 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.324 15.726 7.782 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -5.679 17.316 7.101 1.00 0.00 O ATOM 0 H ASP A 78 -3.699 13.764 4.907 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.463 13.743 6.955 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.492 15.610 4.981 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.217 15.873 5.151 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.186 13.701 4.130 1.00 0.00 N ATOM 1150 CA ASP A 79 -8.482 13.376 3.545 1.00 0.00 C ATOM 1151 C ASP A 79 -8.830 11.895 3.699 1.00 0.00 C ATOM 1152 O ASP A 79 -9.966 11.492 3.452 1.00 0.00 O ATOM 1153 CB ASP A 79 -8.495 13.758 2.066 1.00 0.00 C ATOM 1154 CG ASP A 79 -8.693 15.246 1.857 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -7.746 16.015 2.126 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.795 15.643 1.422 1.00 0.00 O ATOM 0 H ASP A 79 -6.496 14.034 3.457 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.236 13.949 4.084 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -7.556 13.451 1.606 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.292 13.213 1.559 1.00 0.00 H new ATOM 1161 N TYR A 80 -7.856 11.085 4.102 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.080 9.658 4.278 1.00 0.00 C ATOM 1163 C TYR A 80 -8.485 9.363 5.713 1.00 0.00 C ATOM 1164 O TYR A 80 -9.266 8.449 5.977 1.00 0.00 O ATOM 1165 CB TYR A 80 -6.815 8.869 3.924 1.00 0.00 C ATOM 1166 CG TYR A 80 -6.406 8.958 2.467 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -6.536 10.142 1.747 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -5.885 7.849 1.809 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -6.159 10.217 0.420 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -5.506 7.919 0.482 1.00 0.00 C ATOM 1171 CZ TYR A 80 -5.646 9.104 -0.206 1.00 0.00 C ATOM 1172 OH TYR A 80 -5.270 9.177 -1.529 1.00 0.00 O ATOM 0 H TYR A 80 -6.907 11.393 4.312 1.00 0.00 H new ATOM 0 HA TYR A 80 -8.885 9.351 3.610 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -5.992 9.229 4.542 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.972 7.821 4.181 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -6.939 11.018 2.234 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.775 6.917 2.344 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -6.266 11.144 -0.123 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.102 7.049 -0.013 1.00 0.00 H new ATOM 0 HH TYR A 80 -6.056 9.047 -2.100 1.00 0.00 H new ATOM 1182 N LEU A 81 -7.941 10.145 6.638 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.228 9.981 8.051 1.00 0.00 C ATOM 1184 C LEU A 81 -9.554 10.630 8.423 1.00 0.00 C ATOM 1185 O LEU A 81 -10.274 10.136 9.291 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.098 10.590 8.874 1.00 0.00 C ATOM 1187 CG LEU A 81 -5.744 9.911 8.696 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -4.602 10.861 9.023 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.672 8.681 9.570 1.00 0.00 C ATOM 0 H LEU A 81 -7.293 10.905 6.428 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.305 8.915 8.266 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.999 11.642 8.608 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.373 10.552 9.928 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.641 9.618 7.651 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.651 10.347 8.886 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.646 11.725 8.360 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.690 11.193 10.058 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.703 8.199 9.440 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.797 8.969 10.614 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.464 7.987 9.287 1.00 0.00 H new ATOM 1201 N GLN A 82 -9.876 11.735 7.760 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.117 12.443 8.018 1.00 0.00 C ATOM 1203 C GLN A 82 -12.323 11.528 7.810 1.00 0.00 C ATOM 1204 O GLN A 82 -13.413 11.800 8.314 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.218 13.667 7.108 1.00 0.00 C ATOM 1206 CG GLN A 82 -11.402 13.325 5.637 1.00 0.00 C ATOM 1207 CD GLN A 82 -11.810 14.526 4.807 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -12.863 14.526 4.169 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -10.974 15.559 4.810 1.00 0.00 N ATOM 0 H GLN A 82 -9.291 12.158 7.039 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.116 12.770 9.058 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.055 14.284 7.436 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -10.316 14.268 7.222 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.472 12.915 5.244 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -12.159 12.547 5.540 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.112 15.516 5.353 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.194 16.395 4.269 1.00 0.00 H new ATOM 1218 N SER A 83 -12.121 10.444 7.065 1.00 0.00 N ATOM 1219 CA SER A 83 -13.192 9.494 6.795 1.00 0.00 C ATOM 1220 C SER A 83 -13.070 8.257 7.681 1.00 0.00 C ATOM 1221 O SER A 83 -12.001 7.970 8.217 1.00 0.00 O ATOM 1222 CB SER A 83 -13.176 9.083 5.321 1.00 0.00 C ATOM 1223 OG SER A 83 -14.154 8.093 5.056 1.00 0.00 O ATOM 0 H SER A 83 -11.226 10.204 6.639 1.00 0.00 H new ATOM 0 HA SER A 83 -14.139 9.984 7.022 1.00 0.00 H new ATOM 0 HB2 SER A 83 -13.359 9.956 4.695 1.00 0.00 H new ATOM 0 HB3 SER A 83 -12.189 8.703 5.057 1.00 0.00 H new ATOM 0 HG SER A 83 -14.124 7.849 4.107 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.174 7.528 7.827 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.197 6.323 8.644 1.00 0.00 C ATOM 1231 C LYS A 84 -13.472 5.178 7.947 1.00 0.00 C ATOM 1232 O LYS A 84 -12.991 4.248 8.595 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.642 5.922 8.937 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.273 6.693 10.084 1.00 0.00 C ATOM 1235 CD LYS A 84 -16.491 8.159 9.735 1.00 0.00 C ATOM 1236 CE LYS A 84 -15.690 9.076 10.644 1.00 0.00 C ATOM 1237 NZ LYS A 84 -14.347 9.384 10.081 1.00 0.00 N ATOM 0 H LYS A 84 -15.066 7.754 7.387 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.682 6.534 9.581 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.240 6.072 8.038 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.674 4.857 9.167 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -17.228 6.237 10.345 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -15.634 6.621 10.964 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -16.204 8.333 8.698 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -17.551 8.399 9.817 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.240 10.004 10.798 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -15.575 8.607 11.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -13.944 10.206 10.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -13.721 8.563 10.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -14.436 9.599 9.067 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.391 5.252 6.621 1.00 0.00 N ATOM 1252 CA GLU A 85 -12.717 4.222 5.837 1.00 0.00 C ATOM 1253 C GLU A 85 -11.324 3.950 6.395 1.00 0.00 C ATOM 1254 O GLU A 85 -10.795 2.846 6.263 1.00 0.00 O ATOM 1255 CB GLU A 85 -12.623 4.646 4.371 1.00 0.00 C ATOM 1256 CG GLU A 85 -13.925 4.478 3.605 1.00 0.00 C ATOM 1257 CD GLU A 85 -13.885 3.318 2.630 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -12.876 3.183 1.907 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -14.864 2.543 2.589 1.00 0.00 O ATOM 0 H GLU A 85 -13.783 6.014 6.068 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.302 3.304 5.901 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.315 5.690 4.322 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.845 4.061 3.881 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.740 4.325 4.312 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.143 5.397 3.061 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.743 4.963 7.030 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.422 4.833 7.624 1.00 0.00 C ATOM 1268 C CYS A 86 -9.513 4.062 8.931 1.00 0.00 C ATOM 1269 O CYS A 86 -8.606 3.309 9.286 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.806 6.213 7.867 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.296 6.523 6.924 1.00 0.00 S ATOM 0 H CYS A 86 -11.169 5.883 7.145 1.00 0.00 H new ATOM 0 HA CYS A 86 -8.781 4.285 6.933 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -9.542 6.977 7.616 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -8.586 6.319 8.929 1.00 0.00 H new ATOM 0 HG CYS A 86 -6.261 6.341 7.689 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.622 4.248 9.643 1.00 0.00 N ATOM 1278 CA ASP A 87 -10.835 3.561 10.906 1.00 0.00 C ATOM 1279 C ASP A 87 -10.871 2.054 10.687 1.00 0.00 C ATOM 1280 O ASP A 87 -10.360 1.284 11.499 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.136 4.029 11.561 1.00 0.00 C ATOM 1282 CG ASP A 87 -11.988 5.378 12.237 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.551 5.412 13.406 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -12.311 6.401 11.597 1.00 0.00 O ATOM 0 H ASP A 87 -11.383 4.868 9.364 1.00 0.00 H new ATOM 0 HA ASP A 87 -10.006 3.801 11.572 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.920 4.088 10.806 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.456 3.290 12.296 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.465 1.644 9.571 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.553 0.230 9.233 1.00 0.00 C ATOM 1291 C PHE A 88 -10.182 -0.298 8.828 1.00 0.00 C ATOM 1292 O PHE A 88 -9.764 -1.376 9.254 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.553 0.017 8.095 1.00 0.00 C ATOM 1294 CG PHE A 88 -12.781 -1.429 7.758 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -13.005 -2.360 8.760 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.770 -1.856 6.440 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -13.214 -3.690 8.452 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -12.978 -3.186 6.127 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.201 -4.104 7.135 1.00 0.00 C ATOM 0 H PHE A 88 -11.891 2.270 8.888 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.899 -0.317 10.110 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.505 0.472 8.369 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.195 0.537 7.206 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -13.016 -2.042 9.792 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -12.597 -1.142 5.649 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.388 -4.406 9.241 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.966 -3.507 5.096 1.00 0.00 H new ATOM 0 HZ PHE A 88 -13.365 -5.144 6.893 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.479 0.485 8.014 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.147 0.115 7.559 1.00 0.00 C ATOM 1311 C GLN A 89 -7.200 0.002 8.745 1.00 0.00 C ATOM 1312 O GLN A 89 -6.333 -0.870 8.780 1.00 0.00 O ATOM 1313 CB GLN A 89 -7.622 1.152 6.562 1.00 0.00 C ATOM 1314 CG GLN A 89 -6.209 0.870 6.075 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.288 2.063 6.243 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -5.177 2.907 5.354 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -4.621 2.140 7.389 1.00 0.00 N ATOM 0 H GLN A 89 -9.812 1.380 7.657 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.203 -0.853 7.061 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.292 1.189 5.703 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.646 2.137 7.029 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.802 0.021 6.624 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.241 0.585 5.023 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -4.743 1.418 8.099 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -3.987 2.921 7.559 1.00 0.00 H new ATOM 1326 N THR A 90 -7.383 0.887 9.718 1.00 0.00 N ATOM 1327 CA THR A 90 -6.562 0.892 10.919 1.00 0.00 C ATOM 1328 C THR A 90 -6.766 -0.375 11.719 1.00 0.00 C ATOM 1329 O THR A 90 -5.851 -1.173 11.851 1.00 0.00 O ATOM 1330 CB THR A 90 -6.890 2.113 11.776 1.00 0.00 C ATOM 1331 OG1 THR A 90 -6.820 3.300 11.007 1.00 0.00 O ATOM 1332 CG2 THR A 90 -5.961 2.279 12.955 1.00 0.00 C ATOM 0 H THR A 90 -8.098 1.614 9.696 1.00 0.00 H new ATOM 0 HA THR A 90 -5.516 0.940 10.616 1.00 0.00 H new ATOM 0 HB THR A 90 -7.900 1.942 12.148 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.712 3.522 10.666 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.248 3.164 13.523 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.026 1.400 13.596 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.937 2.393 12.598 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.962 -0.557 12.254 1.00 0.00 N ATOM 1341 CA LYS A 91 -8.261 -1.740 13.055 1.00 0.00 C ATOM 1342 C LYS A 91 -7.786 -3.012 12.366 1.00 0.00 C ATOM 1343 O LYS A 91 -7.452 -3.996 13.025 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.760 -1.826 13.349 1.00 0.00 C ATOM 1345 CG LYS A 91 -10.165 -1.142 14.645 1.00 0.00 C ATOM 1346 CD LYS A 91 -10.422 0.342 14.434 1.00 0.00 C ATOM 1347 CE LYS A 91 -10.168 1.139 15.704 1.00 0.00 C ATOM 1348 NZ LYS A 91 -11.433 1.634 16.311 1.00 0.00 N ATOM 0 H LYS A 91 -8.741 0.094 12.151 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.722 -1.645 13.998 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.310 -1.376 12.523 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.054 -2.875 13.394 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.063 -1.615 15.042 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.379 -1.274 15.389 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.779 0.713 13.636 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.452 0.491 14.110 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -9.640 0.515 16.425 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.519 1.985 15.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.217 2.172 17.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.925 2.250 15.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.043 0.826 16.550 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.744 -2.985 11.044 1.00 0.00 N ATOM 1363 CA PHE A 92 -7.289 -4.139 10.286 1.00 0.00 C ATOM 1364 C PHE A 92 -5.791 -4.047 10.017 1.00 0.00 C ATOM 1365 O PHE A 92 -5.119 -5.059 9.825 1.00 0.00 O ATOM 1366 CB PHE A 92 -8.060 -4.251 8.969 1.00 0.00 C ATOM 1367 CG PHE A 92 -8.703 -5.593 8.763 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -7.931 -6.740 8.683 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -10.080 -5.705 8.647 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -8.521 -7.976 8.492 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -10.674 -6.938 8.458 1.00 0.00 C ATOM 1372 CZ PHE A 92 -9.894 -8.075 8.380 1.00 0.00 C ATOM 0 H PHE A 92 -8.017 -2.183 10.477 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.479 -5.035 10.877 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -8.830 -3.480 8.941 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.380 -4.052 8.141 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.857 -6.668 8.771 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -10.695 -4.819 8.705 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.908 -8.863 8.430 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -11.748 -7.013 8.371 1.00 0.00 H new ATOM 0 HZ PHE A 92 -10.357 -9.040 8.232 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.273 -2.820 10.004 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.855 -2.589 9.758 1.00 0.00 C ATOM 1384 C ALA A 93 -3.052 -2.549 11.057 1.00 0.00 C ATOM 1385 O ALA A 93 -1.854 -2.830 11.064 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.662 -1.296 8.986 1.00 0.00 C ATOM 0 H ALA A 93 -5.817 -1.971 10.161 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.483 -3.425 9.165 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.599 -1.134 8.808 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.184 -1.361 8.031 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.064 -0.464 9.564 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.714 -2.192 12.154 1.00 0.00 N ATOM 1393 CA LEU A 94 -3.056 -2.110 13.445 1.00 0.00 C ATOM 1394 C LEU A 94 -3.011 -3.473 14.100 1.00 0.00 C ATOM 1395 O LEU A 94 -1.975 -3.919 14.596 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.800 -1.121 14.337 1.00 0.00 C ATOM 1397 CG LEU A 94 -5.305 -1.352 14.512 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -5.577 -2.364 15.601 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -6.009 -0.038 14.824 1.00 0.00 C ATOM 0 H LEU A 94 -4.706 -1.956 12.170 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.033 -1.763 13.301 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.336 -1.136 15.323 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.654 -0.120 13.931 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.697 -1.749 13.576 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.653 -2.508 15.703 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.107 -3.313 15.342 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.168 -2.002 16.544 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -7.077 -0.217 14.946 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.604 0.382 15.745 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.850 0.663 14.005 1.00 0.00 H new ATOM 1411 N SER A 95 -4.152 -4.121 14.084 1.00 0.00 N ATOM 1412 CA SER A 95 -4.297 -5.452 14.663 1.00 0.00 C ATOM 1413 C SER A 95 -4.480 -6.496 13.567 1.00 0.00 C ATOM 1414 O SER A 95 -5.456 -7.246 13.562 1.00 0.00 O ATOM 1415 CB SER A 95 -5.479 -5.493 15.635 1.00 0.00 C ATOM 1416 OG SER A 95 -6.707 -5.318 14.953 1.00 0.00 O ATOM 0 H SER A 95 -5.008 -3.749 13.673 1.00 0.00 H new ATOM 0 HA SER A 95 -3.386 -5.683 15.215 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.486 -6.446 16.164 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.363 -4.712 16.387 1.00 0.00 H new ATOM 0 HG SER A 95 -6.535 -4.961 14.056 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.529 -6.535 12.641 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.580 -7.488 11.535 1.00 0.00 C ATOM 1424 C LEU A 96 -3.097 -8.862 11.990 1.00 0.00 C ATOM 1425 O LEU A 96 -3.897 -9.762 12.249 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.742 -7.013 10.337 1.00 0.00 C ATOM 1427 CG LEU A 96 -2.006 -5.682 10.513 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.716 -5.881 11.295 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.716 -5.060 9.159 1.00 0.00 C ATOM 0 H LEU A 96 -2.715 -5.920 12.632 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.620 -7.559 11.215 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.006 -7.784 10.106 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.399 -6.930 9.471 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.646 -5.005 11.078 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.208 -4.923 11.409 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.946 -6.289 12.279 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.068 -6.574 10.758 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.192 -4.114 9.298 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.094 -5.737 8.574 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.653 -4.882 8.632 1.00 0.00 H new ATOM 1441 N SER A 97 -1.781 -9.011 12.084 1.00 0.00 N ATOM 1442 CA SER A 97 -1.178 -10.267 12.509 1.00 0.00 C ATOM 1443 C SER A 97 -0.140 -10.026 13.602 1.00 0.00 C ATOM 1444 O SER A 97 0.276 -8.890 13.835 1.00 0.00 O ATOM 1445 CB SER A 97 -0.530 -10.974 11.315 1.00 0.00 C ATOM 1446 OG SER A 97 -1.046 -12.286 11.158 1.00 0.00 O ATOM 0 H SER A 97 -1.109 -8.274 11.870 1.00 0.00 H new ATOM 0 HA SER A 97 -1.964 -10.904 12.914 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.708 -10.398 10.407 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.550 -11.019 11.457 1.00 0.00 H new ATOM 0 HG SER A 97 -0.618 -12.716 10.388 1.00 0.00 H new ATOM 1452 N PRO A 98 0.292 -11.094 14.292 1.00 0.00 N ATOM 1453 CA PRO A 98 1.282 -10.993 15.367 1.00 0.00 C ATOM 1454 C PRO A 98 2.703 -10.811 14.840 1.00 0.00 C ATOM 1455 O PRO A 98 3.496 -11.753 14.827 1.00 0.00 O ATOM 1456 CB PRO A 98 1.147 -12.334 16.086 1.00 0.00 C ATOM 1457 CG PRO A 98 0.707 -13.282 15.026 1.00 0.00 C ATOM 1458 CD PRO A 98 -0.155 -12.485 14.081 1.00 0.00 C ATOM 0 HA PRO A 98 1.107 -10.126 16.004 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.094 -12.644 16.528 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.420 -12.279 16.896 1.00 0.00 H new ATOM 0 HG2 PRO A 98 1.564 -13.709 14.505 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.148 -14.114 15.455 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.013 -12.799 13.047 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -1.215 -12.604 14.308 1.00 0.00 H new ATOM 1466 N GLY A 99 3.021 -9.593 14.412 1.00 0.00 N ATOM 1467 CA GLY A 99 4.349 -9.313 13.897 1.00 0.00 C ATOM 1468 C GLY A 99 4.330 -8.786 12.475 1.00 0.00 C ATOM 1469 O GLY A 99 5.190 -9.133 11.667 1.00 0.00 O ATOM 0 H GLY A 99 2.384 -8.796 14.413 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.838 -8.584 14.543 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.947 -10.223 13.934 1.00 0.00 H new ATOM 1473 N ALA A 100 3.349 -7.945 12.167 1.00 0.00 N ATOM 1474 CA ALA A 100 3.229 -7.370 10.833 1.00 0.00 C ATOM 1475 C ALA A 100 2.691 -5.943 10.896 1.00 0.00 C ATOM 1476 O ALA A 100 1.842 -5.554 10.095 1.00 0.00 O ATOM 1477 CB ALA A 100 2.332 -8.238 9.965 1.00 0.00 C ATOM 0 H ALA A 100 2.626 -7.647 12.822 1.00 0.00 H new ATOM 0 HA ALA A 100 4.223 -7.335 10.387 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.251 -7.797 8.971 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.760 -9.237 9.885 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.342 -8.302 10.416 1.00 0.00 H new ATOM 1483 N HIS A 101 3.193 -5.166 11.851 1.00 0.00 N ATOM 1484 CA HIS A 101 2.765 -3.782 12.013 1.00 0.00 C ATOM 1485 C HIS A 101 3.426 -2.895 10.964 1.00 0.00 C ATOM 1486 O HIS A 101 2.794 -2.004 10.398 1.00 0.00 O ATOM 1487 CB HIS A 101 3.110 -3.276 13.415 1.00 0.00 C ATOM 1488 CG HIS A 101 2.216 -3.821 14.485 1.00 0.00 C ATOM 1489 ND1 HIS A 101 1.106 -3.150 14.953 1.00 0.00 N ATOM 1490 CD2 HIS A 101 2.274 -4.981 15.181 1.00 0.00 C ATOM 1491 CE1 HIS A 101 0.523 -3.872 15.893 1.00 0.00 C ATOM 1492 NE2 HIS A 101 1.211 -4.988 16.050 1.00 0.00 N ATOM 0 H HIS A 101 3.896 -5.472 12.524 1.00 0.00 H new ATOM 0 HA HIS A 101 1.684 -3.740 11.880 1.00 0.00 H new ATOM 0 HB2 HIS A 101 4.142 -3.542 13.645 1.00 0.00 H new ATOM 0 HB3 HIS A 101 3.052 -2.188 13.424 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.018 -5.756 15.073 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.366 -3.596 16.441 1.00 0.00 H new ATOM 0 HE2 HIS A 101 0.989 -5.734 16.709 1.00 0.00 H new ATOM 1501 N GLN A 102 4.700 -3.157 10.710 1.00 0.00 N ATOM 1502 CA GLN A 102 5.461 -2.398 9.728 1.00 0.00 C ATOM 1503 C GLN A 102 6.463 -3.302 9.017 1.00 0.00 C ATOM 1504 O GLN A 102 7.537 -2.859 8.610 1.00 0.00 O ATOM 1505 CB GLN A 102 6.191 -1.233 10.401 1.00 0.00 C ATOM 1506 CG GLN A 102 7.136 -1.668 11.508 1.00 0.00 C ATOM 1507 CD GLN A 102 8.160 -0.604 11.852 1.00 0.00 C ATOM 1508 OE1 GLN A 102 8.252 0.425 11.183 1.00 0.00 O ATOM 1509 NE2 GLN A 102 8.936 -0.847 12.902 1.00 0.00 N ATOM 0 H GLN A 102 5.231 -3.894 11.174 1.00 0.00 H new ATOM 0 HA GLN A 102 4.766 -1.997 8.991 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.755 -0.684 9.647 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.455 -0.543 10.813 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.558 -1.912 12.399 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.652 -2.579 11.203 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.825 -1.714 13.428 1.00 0.00 H new ATOM 0 HE22 GLN A 102 9.643 -0.167 13.182 1.00 0.00 H new ATOM 1518 N LYS A 103 6.103 -4.573 8.880 1.00 0.00 N ATOM 1519 CA LYS A 103 6.963 -5.550 8.227 1.00 0.00 C ATOM 1520 C LYS A 103 6.503 -5.815 6.797 1.00 0.00 C ATOM 1521 O LYS A 103 7.318 -6.024 5.899 1.00 0.00 O ATOM 1522 CB LYS A 103 6.969 -6.858 9.021 1.00 0.00 C ATOM 1523 CG LYS A 103 8.220 -7.055 9.859 1.00 0.00 C ATOM 1524 CD LYS A 103 8.133 -6.307 11.179 1.00 0.00 C ATOM 1525 CE LYS A 103 9.359 -6.554 12.042 1.00 0.00 C ATOM 1526 NZ LYS A 103 9.461 -7.979 12.466 1.00 0.00 N ATOM 0 H LYS A 103 5.217 -4.951 9.215 1.00 0.00 H new ATOM 0 HA LYS A 103 7.974 -5.143 8.193 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.097 -6.881 9.674 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.870 -7.694 8.329 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.366 -8.118 10.051 1.00 0.00 H new ATOM 0 HG3 LYS A 103 9.090 -6.710 9.301 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.031 -5.239 10.987 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.239 -6.620 11.718 1.00 0.00 H new ATOM 0 HE2 LYS A 103 10.255 -6.275 11.488 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.317 -5.915 12.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 10.159 -8.064 13.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 8.534 -8.308 12.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 9.762 -8.561 11.658 1.00 0.00 H new ATOM 1540 N ARG A 104 5.189 -5.815 6.596 1.00 0.00 N ATOM 1541 CA ARG A 104 4.619 -6.064 5.277 1.00 0.00 C ATOM 1542 C ARG A 104 3.965 -4.810 4.711 1.00 0.00 C ATOM 1543 O ARG A 104 4.079 -4.524 3.521 1.00 0.00 O ATOM 1544 CB ARG A 104 3.593 -7.195 5.351 1.00 0.00 C ATOM 1545 CG ARG A 104 2.568 -7.018 6.461 1.00 0.00 C ATOM 1546 CD ARG A 104 1.605 -8.192 6.521 1.00 0.00 C ATOM 1547 NE ARG A 104 1.113 -8.565 5.197 1.00 0.00 N ATOM 1548 CZ ARG A 104 0.577 -9.750 4.910 1.00 0.00 C ATOM 1549 NH1 ARG A 104 0.456 -10.677 5.852 1.00 0.00 N ATOM 1550 NH2 ARG A 104 0.159 -10.007 3.678 1.00 0.00 N ATOM 0 H ARG A 104 4.500 -5.646 7.329 1.00 0.00 H new ATOM 0 HA ARG A 104 5.432 -6.355 4.611 1.00 0.00 H new ATOM 0 HB2 ARG A 104 3.073 -7.265 4.396 1.00 0.00 H new ATOM 0 HB3 ARG A 104 4.116 -8.140 5.499 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.080 -6.917 7.418 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.010 -6.096 6.299 1.00 0.00 H new ATOM 0 HD2 ARG A 104 2.104 -9.047 6.976 1.00 0.00 H new ATOM 0 HD3 ARG A 104 0.762 -7.937 7.162 1.00 0.00 H new ATOM 0 HE ARG A 104 1.184 -7.877 4.448 1.00 0.00 H new ATOM 0 HH11 ARG A 104 0.774 -10.484 6.802 1.00 0.00 H new ATOM 0 HH12 ARG A 104 0.045 -11.583 5.626 1.00 0.00 H new ATOM 0 HH21 ARG A 104 0.248 -9.297 2.951 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -0.252 -10.914 3.458 1.00 0.00 H new ATOM 1564 N LEU A 105 3.267 -4.071 5.567 1.00 0.00 N ATOM 1565 CA LEU A 105 2.581 -2.862 5.149 1.00 0.00 C ATOM 1566 C LEU A 105 3.401 -1.620 5.470 1.00 0.00 C ATOM 1567 O LEU A 105 4.020 -1.527 6.528 1.00 0.00 O ATOM 1568 CB LEU A 105 1.231 -2.777 5.853 1.00 0.00 C ATOM 1569 CG LEU A 105 1.295 -2.848 7.380 1.00 0.00 C ATOM 1570 CD1 LEU A 105 0.354 -1.830 8.005 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.962 -4.251 7.864 1.00 0.00 C ATOM 0 H LEU A 105 3.164 -4.293 6.557 1.00 0.00 H new ATOM 0 HA LEU A 105 2.439 -2.905 4.069 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.747 -1.843 5.567 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.598 -3.588 5.492 1.00 0.00 H new ATOM 0 HG LEU A 105 2.312 -2.609 7.691 1.00 0.00 H new ATOM 0 HD11 LEU A 105 0.415 -1.897 9.091 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.639 -0.827 7.687 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.668 -2.035 7.686 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.013 -4.282 8.952 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.044 -4.519 7.540 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.678 -4.959 7.447 1.00 0.00 H new ATOM 1583 N ILE A 106 3.393 -0.663 4.547 1.00 0.00 N ATOM 1584 CA ILE A 106 4.130 0.579 4.732 1.00 0.00 C ATOM 1585 C ILE A 106 3.263 1.791 4.387 1.00 0.00 C ATOM 1586 O ILE A 106 2.735 1.889 3.278 1.00 0.00 O ATOM 1587 CB ILE A 106 5.410 0.616 3.873 1.00 0.00 C ATOM 1588 CG1 ILE A 106 5.100 0.205 2.426 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.484 -0.276 4.482 1.00 0.00 C ATOM 1590 CD1 ILE A 106 5.138 -1.290 2.184 1.00 0.00 C ATOM 0 H ILE A 106 2.884 -0.725 3.665 1.00 0.00 H new ATOM 0 HA ILE A 106 4.411 0.621 5.784 1.00 0.00 H new ATOM 0 HB ILE A 106 5.791 1.637 3.856 1.00 0.00 H new ATOM 0 HG12 ILE A 106 4.113 0.580 2.157 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.817 0.688 1.761 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.381 -0.239 3.864 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.721 0.074 5.487 1.00 0.00 H new ATOM 0 HG23 ILE A 106 6.120 -1.302 4.532 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.908 -1.495 1.138 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.132 -1.671 2.419 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.401 -1.780 2.820 1.00 0.00 H new ATOM 1602 N PRO A 107 3.097 2.731 5.337 1.00 0.00 N ATOM 1603 CA PRO A 107 2.288 3.937 5.125 1.00 0.00 C ATOM 1604 C PRO A 107 2.969 4.939 4.201 1.00 0.00 C ATOM 1605 O PRO A 107 4.197 5.013 4.140 1.00 0.00 O ATOM 1606 CB PRO A 107 2.158 4.519 6.531 1.00 0.00 C ATOM 1607 CG PRO A 107 3.387 4.063 7.233 1.00 0.00 C ATOM 1608 CD PRO A 107 3.676 2.690 6.693 1.00 0.00 C ATOM 0 HA PRO A 107 1.335 3.711 4.646 1.00 0.00 H new ATOM 0 HB2 PRO A 107 2.094 5.607 6.507 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.258 4.158 7.029 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.220 4.741 7.046 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.235 4.036 8.312 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.746 2.485 6.668 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.217 1.913 7.303 1.00 0.00 H new ATOM 1616 N ILE A 108 2.162 5.713 3.484 1.00 0.00 N ATOM 1617 CA ILE A 108 2.681 6.717 2.563 1.00 0.00 C ATOM 1618 C ILE A 108 1.716 7.895 2.449 1.00 0.00 C ATOM 1619 O ILE A 108 0.517 7.752 2.690 1.00 0.00 O ATOM 1620 CB ILE A 108 2.933 6.114 1.164 1.00 0.00 C ATOM 1621 CG1 ILE A 108 4.098 5.125 1.219 1.00 0.00 C ATOM 1622 CG2 ILE A 108 3.212 7.208 0.139 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.668 3.699 1.479 1.00 0.00 C ATOM 0 H ILE A 108 1.144 5.664 3.523 1.00 0.00 H new ATOM 0 HA ILE A 108 3.630 7.071 2.965 1.00 0.00 H new ATOM 0 HB ILE A 108 2.033 5.583 0.853 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.643 5.165 0.276 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.791 5.435 2.001 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.386 6.756 -0.837 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.355 7.879 0.081 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.095 7.772 0.440 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.546 3.053 1.505 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.149 3.644 2.436 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.999 3.370 0.684 1.00 0.00 H new ATOM 1635 N LYS A 109 2.245 9.056 2.077 1.00 0.00 N ATOM 1636 CA LYS A 109 1.426 10.253 1.930 1.00 0.00 C ATOM 1637 C LYS A 109 1.789 11.020 0.668 1.00 0.00 C ATOM 1638 O LYS A 109 2.748 10.684 -0.030 1.00 0.00 O ATOM 1639 CB LYS A 109 1.598 11.181 3.135 1.00 0.00 C ATOM 1640 CG LYS A 109 1.300 10.528 4.473 1.00 0.00 C ATOM 1641 CD LYS A 109 2.568 10.322 5.284 1.00 0.00 C ATOM 1642 CE LYS A 109 2.273 10.252 6.774 1.00 0.00 C ATOM 1643 NZ LYS A 109 3.110 11.206 7.551 1.00 0.00 N ATOM 0 H LYS A 109 3.235 9.193 1.872 1.00 0.00 H new ATOM 0 HA LYS A 109 0.389 9.924 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 109 2.621 11.556 3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 109 0.943 12.044 3.011 1.00 0.00 H new ATOM 0 HG2 LYS A 109 0.603 11.149 5.036 1.00 0.00 H new ATOM 0 HG3 LYS A 109 0.811 9.568 4.310 1.00 0.00 H new ATOM 0 HD2 LYS A 109 3.059 9.402 4.966 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.263 11.138 5.088 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.219 10.470 6.946 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.451 9.238 7.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 3.309 10.808 8.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 4.005 11.371 7.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.602 12.107 7.657 1.00 0.00 H new ATOM 1657 N TYR A 110 1.028 12.071 0.406 1.00 0.00 N ATOM 1658 CA TYR A 110 1.255 12.933 -0.744 1.00 0.00 C ATOM 1659 C TYR A 110 1.154 14.392 -0.309 1.00 0.00 C ATOM 1660 O TYR A 110 0.866 15.279 -1.114 1.00 0.00 O ATOM 1661 CB TYR A 110 0.239 12.636 -1.850 1.00 0.00 C ATOM 1662 CG TYR A 110 0.849 11.982 -3.070 1.00 0.00 C ATOM 1663 CD1 TYR A 110 1.911 12.576 -3.741 1.00 0.00 C ATOM 1664 CD2 TYR A 110 0.362 10.774 -3.552 1.00 0.00 C ATOM 1665 CE1 TYR A 110 2.470 11.982 -4.856 1.00 0.00 C ATOM 1666 CE2 TYR A 110 0.917 10.174 -4.667 1.00 0.00 C ATOM 1667 CZ TYR A 110 1.970 10.782 -5.315 1.00 0.00 C ATOM 1668 OH TYR A 110 2.526 10.188 -6.426 1.00 0.00 O ATOM 0 H TYR A 110 0.236 12.351 0.984 1.00 0.00 H new ATOM 0 HA TYR A 110 2.252 12.742 -1.141 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -0.541 11.987 -1.451 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -0.243 13.567 -2.149 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.305 13.516 -3.385 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.464 10.295 -3.047 1.00 0.00 H new ATOM 0 HE1 TYR A 110 3.296 12.456 -5.366 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.527 9.234 -5.028 1.00 0.00 H new ATOM 0 HH TYR A 110 3.258 10.746 -6.763 1.00 0.00 H new ATOM 1678 N LYS A 111 1.384 14.623 0.984 1.00 0.00 N ATOM 1679 CA LYS A 111 1.311 15.956 1.568 1.00 0.00 C ATOM 1680 C LYS A 111 1.396 15.860 3.089 1.00 0.00 C ATOM 1681 O LYS A 111 1.686 14.794 3.632 1.00 0.00 O ATOM 1682 CB LYS A 111 0.007 16.648 1.155 1.00 0.00 C ATOM 1683 CG LYS A 111 -1.197 15.718 1.158 1.00 0.00 C ATOM 1684 CD LYS A 111 -2.286 16.213 2.097 1.00 0.00 C ATOM 1685 CE LYS A 111 -3.317 17.052 1.358 1.00 0.00 C ATOM 1686 NZ LYS A 111 -4.468 17.412 2.232 1.00 0.00 N ATOM 0 H LYS A 111 1.625 13.891 1.652 1.00 0.00 H new ATOM 0 HA LYS A 111 2.149 16.548 1.201 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -0.184 17.480 1.832 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.128 17.070 0.157 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.597 15.637 0.147 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.884 14.718 1.458 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.777 15.361 2.568 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.839 16.804 2.896 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.846 17.961 0.985 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.679 16.501 0.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -5.149 17.984 1.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -4.934 16.545 2.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -4.127 17.959 3.048 1.00 0.00 H new ATOM 1700 N ALA A 112 1.140 16.968 3.776 1.00 0.00 N ATOM 1701 CA ALA A 112 1.190 16.982 5.234 1.00 0.00 C ATOM 1702 C ALA A 112 -0.207 16.857 5.836 1.00 0.00 C ATOM 1703 O ALA A 112 -1.142 17.529 5.403 1.00 0.00 O ATOM 1704 CB ALA A 112 1.867 18.252 5.724 1.00 0.00 C ATOM 0 H ALA A 112 0.897 17.863 3.351 1.00 0.00 H new ATOM 0 HA ALA A 112 1.773 16.121 5.561 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.898 18.251 6.814 1.00 0.00 H new ATOM 0 HB2 ALA A 112 2.883 18.297 5.332 1.00 0.00 H new ATOM 0 HB3 ALA A 112 1.306 19.120 5.378 1.00 0.00 H new ATOM 1710 N MET A 113 -0.338 15.995 6.841 1.00 0.00 N ATOM 1711 CA MET A 113 -1.618 15.783 7.506 1.00 0.00 C ATOM 1712 C MET A 113 -1.840 16.831 8.593 1.00 0.00 C ATOM 1713 O MET A 113 -1.159 16.830 9.620 1.00 0.00 O ATOM 1714 CB MET A 113 -1.675 14.382 8.117 1.00 0.00 C ATOM 1715 CG MET A 113 -1.788 13.273 7.085 1.00 0.00 C ATOM 1716 SD MET A 113 -1.014 11.739 7.630 1.00 0.00 S ATOM 1717 CE MET A 113 -1.589 11.651 9.324 1.00 0.00 C ATOM 0 H MET A 113 0.428 15.432 7.212 1.00 0.00 H new ATOM 0 HA MET A 113 -2.408 15.878 6.761 1.00 0.00 H new ATOM 0 HB2 MET A 113 -0.779 14.219 8.716 1.00 0.00 H new ATOM 0 HB3 MET A 113 -2.527 14.325 8.795 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.840 13.088 6.869 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.324 13.599 6.154 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.743 10.608 9.602 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.845 12.097 9.984 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.530 12.194 9.418 1.00 0.00 H new ATOM 1727 N LYS A 114 -2.787 17.732 8.354 1.00 0.00 N ATOM 1728 CA LYS A 114 -3.094 18.797 9.299 1.00 0.00 C ATOM 1729 C LYS A 114 -3.776 18.270 10.563 1.00 0.00 C ATOM 1730 O LYS A 114 -3.822 18.964 11.579 1.00 0.00 O ATOM 1731 CB LYS A 114 -3.978 19.852 8.631 1.00 0.00 C ATOM 1732 CG LYS A 114 -3.238 21.139 8.310 1.00 0.00 C ATOM 1733 CD LYS A 114 -2.285 20.958 7.139 1.00 0.00 C ATOM 1734 CE LYS A 114 -3.033 20.879 5.819 1.00 0.00 C ATOM 1735 NZ LYS A 114 -2.188 20.306 4.735 1.00 0.00 N ATOM 0 H LYS A 114 -3.358 17.745 7.509 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.148 19.246 9.601 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.392 19.440 7.711 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.820 20.078 9.286 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.957 21.925 8.077 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.680 21.467 9.187 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -1.581 21.789 7.110 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.700 20.049 7.282 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.927 20.268 5.944 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.367 21.876 5.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.745 20.238 3.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.365 20.921 4.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.862 19.358 5.013 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.303 17.048 10.508 1.00 0.00 N ATOM 1750 CA LYS A 115 -4.969 16.467 11.672 1.00 0.00 C ATOM 1751 C LYS A 115 -4.077 15.431 12.361 1.00 0.00 C ATOM 1752 O LYS A 115 -2.858 15.449 12.189 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.339 15.882 11.295 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.384 15.236 9.930 1.00 0.00 C ATOM 1755 CD LYS A 115 -5.715 13.880 9.953 1.00 0.00 C ATOM 1756 CE LYS A 115 -6.488 12.905 10.827 1.00 0.00 C ATOM 1757 NZ LYS A 115 -7.942 12.903 10.507 1.00 0.00 N ATOM 0 H LYS A 115 -4.283 16.449 9.683 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.147 17.268 12.390 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.624 15.143 12.044 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.084 16.677 11.333 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.420 15.130 9.607 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.888 15.879 9.203 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.645 13.488 8.938 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.696 13.980 10.327 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.086 11.901 10.694 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.348 13.168 11.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.353 11.983 10.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.417 13.657 11.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.074 13.068 9.489 1.00 0.00 H new ATOM 1771 N GLU A 116 -4.673 14.553 13.164 1.00 0.00 N ATOM 1772 CA GLU A 116 -3.912 13.551 13.897 1.00 0.00 C ATOM 1773 C GLU A 116 -3.598 12.330 13.045 1.00 0.00 C ATOM 1774 O GLU A 116 -4.116 12.173 11.939 1.00 0.00 O ATOM 1775 CB GLU A 116 -4.682 13.124 15.147 1.00 0.00 C ATOM 1776 CG GLU A 116 -6.150 12.819 14.888 1.00 0.00 C ATOM 1777 CD GLU A 116 -6.690 11.738 15.803 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -6.392 11.784 17.015 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -7.411 10.847 15.308 1.00 0.00 O ATOM 0 H GLU A 116 -5.680 14.517 13.322 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.963 14.006 14.181 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.206 12.240 15.572 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.611 13.914 15.894 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -6.735 13.729 15.021 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -6.275 12.508 13.851 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.745 11.462 13.580 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.351 10.241 12.890 1.00 0.00 C ATOM 1788 C PHE A 117 -2.954 9.023 13.585 1.00 0.00 C ATOM 1789 O PHE A 117 -3.113 9.006 14.804 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.825 10.111 12.841 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.112 10.816 13.961 1.00 0.00 C ATOM 1792 CD1 PHE A 117 0.184 12.167 13.871 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.261 10.127 15.104 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.839 12.817 14.899 1.00 0.00 C ATOM 1795 CE2 PHE A 117 0.917 10.773 16.137 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.206 12.120 16.034 1.00 0.00 C ATOM 0 H PHE A 117 -2.312 11.584 14.495 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.727 10.292 11.868 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.560 9.054 12.865 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.468 10.508 11.891 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.101 12.718 12.987 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.037 9.074 15.190 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.064 13.870 14.815 1.00 0.00 H new ATOM 0 HE2 PHE A 117 1.203 10.225 17.023 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.718 12.627 16.839 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.301 7.986 12.809 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.890 6.763 13.344 1.00 0.00 C ATOM 1808 C PRO A 118 -2.849 5.814 13.909 1.00 0.00 C ATOM 1809 O PRO A 118 -1.701 5.814 13.468 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.565 6.151 12.120 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.720 6.584 10.972 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.148 7.928 11.342 1.00 0.00 C ATOM 0 HA PRO A 118 -4.566 6.960 14.176 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.609 5.064 12.193 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.590 6.505 12.014 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -2.925 5.863 10.783 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.312 6.653 10.059 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.103 8.013 11.045 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.685 8.740 10.852 1.00 0.00 H new ATOM 1820 N SER A 119 -3.259 4.985 14.871 1.00 0.00 N ATOM 1821 CA SER A 119 -2.357 4.002 15.463 1.00 0.00 C ATOM 1822 C SER A 119 -2.019 2.990 14.387 1.00 0.00 C ATOM 1823 O SER A 119 -2.477 1.848 14.409 1.00 0.00 O ATOM 1824 CB SER A 119 -3.011 3.313 16.662 1.00 0.00 C ATOM 1825 OG SER A 119 -4.240 2.709 16.297 1.00 0.00 O ATOM 0 H SER A 119 -4.205 4.976 15.253 1.00 0.00 H new ATOM 0 HA SER A 119 -1.453 4.491 15.828 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.336 2.557 17.063 1.00 0.00 H new ATOM 0 HB3 SER A 119 -3.182 4.041 17.455 1.00 0.00 H new ATOM 0 HG SER A 119 -4.105 2.143 15.508 1.00 0.00 H new ATOM 1831 N ILE A 120 -1.265 3.460 13.408 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.902 2.667 12.257 1.00 0.00 C ATOM 1833 C ILE A 120 0.466 3.092 11.731 1.00 0.00 C ATOM 1834 O ILE A 120 1.322 2.259 11.432 1.00 0.00 O ATOM 1835 CB ILE A 120 -1.983 2.875 11.171 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -3.198 2.003 11.466 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.451 2.602 9.778 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -2.924 0.527 11.335 1.00 0.00 C ATOM 0 H ILE A 120 -0.888 4.408 13.394 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.843 1.614 12.531 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.282 3.923 11.198 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -3.548 2.211 12.477 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.005 2.276 10.787 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.245 2.761 9.048 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.623 3.278 9.566 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -1.103 1.571 9.717 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -3.832 -0.033 11.559 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -2.603 0.305 10.317 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -2.139 0.239 12.034 1.00 0.00 H new ATOM 1850 N LEU A 121 0.654 4.401 11.632 1.00 0.00 N ATOM 1851 CA LEU A 121 1.908 4.969 11.153 1.00 0.00 C ATOM 1852 C LEU A 121 2.498 5.923 12.189 1.00 0.00 C ATOM 1853 O LEU A 121 3.156 6.904 11.842 1.00 0.00 O ATOM 1854 CB LEU A 121 1.698 5.698 9.816 1.00 0.00 C ATOM 1855 CG LEU A 121 0.461 6.607 9.719 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.804 5.790 9.501 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.327 7.487 10.955 1.00 0.00 C ATOM 0 H LEU A 121 -0.052 5.095 11.879 1.00 0.00 H new ATOM 0 HA LEU A 121 2.612 4.152 10.995 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.582 6.302 9.614 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.635 4.950 9.025 1.00 0.00 H new ATOM 0 HG LEU A 121 0.597 7.257 8.855 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.662 6.459 9.436 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.715 5.222 8.575 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.942 5.103 10.336 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.556 8.119 10.858 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.228 6.859 11.840 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.213 8.115 11.053 1.00 0.00 H new ATOM 1869 N ARG A 122 2.248 5.626 13.464 1.00 0.00 N ATOM 1870 CA ARG A 122 2.735 6.452 14.572 1.00 0.00 C ATOM 1871 C ARG A 122 4.155 6.959 14.330 1.00 0.00 C ATOM 1872 O ARG A 122 4.445 8.137 14.535 1.00 0.00 O ATOM 1873 CB ARG A 122 2.682 5.664 15.884 1.00 0.00 C ATOM 1874 CG ARG A 122 3.220 4.246 15.771 1.00 0.00 C ATOM 1875 CD ARG A 122 2.781 3.390 16.947 1.00 0.00 C ATOM 1876 NE ARG A 122 3.434 2.083 16.950 1.00 0.00 N ATOM 1877 CZ ARG A 122 3.488 1.283 18.012 1.00 0.00 C ATOM 1878 NH1 ARG A 122 2.933 1.654 19.160 1.00 0.00 N ATOM 1879 NH2 ARG A 122 4.101 0.110 17.927 1.00 0.00 N ATOM 0 H ARG A 122 1.707 4.813 13.758 1.00 0.00 H new ATOM 0 HA ARG A 122 2.080 7.321 14.639 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.253 6.200 16.642 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.650 5.624 16.232 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.871 3.796 14.842 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.309 4.271 15.724 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.008 3.910 17.878 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.700 3.255 16.913 1.00 0.00 H new ATOM 0 HE ARG A 122 3.875 1.765 16.087 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.462 2.556 19.231 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.977 1.037 19.971 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.531 -0.178 17.048 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.143 -0.504 18.741 1.00 0.00 H new ATOM 1893 N PHE A 123 5.035 6.066 13.901 1.00 0.00 N ATOM 1894 CA PHE A 123 6.423 6.434 13.637 1.00 0.00 C ATOM 1895 C PHE A 123 7.128 5.369 12.808 1.00 0.00 C ATOM 1896 O PHE A 123 8.346 5.207 12.894 1.00 0.00 O ATOM 1897 CB PHE A 123 7.173 6.648 14.955 1.00 0.00 C ATOM 1898 CG PHE A 123 6.894 5.589 15.984 1.00 0.00 C ATOM 1899 CD1 PHE A 123 7.584 4.387 15.962 1.00 0.00 C ATOM 1900 CD2 PHE A 123 5.944 5.796 16.971 1.00 0.00 C ATOM 1901 CE1 PHE A 123 7.330 3.411 16.908 1.00 0.00 C ATOM 1902 CE2 PHE A 123 5.686 4.824 17.917 1.00 0.00 C ATOM 1903 CZ PHE A 123 6.379 3.629 17.886 1.00 0.00 C ATOM 0 H PHE A 123 4.816 5.085 13.728 1.00 0.00 H new ATOM 0 HA PHE A 123 6.421 7.364 13.068 1.00 0.00 H new ATOM 0 HB2 PHE A 123 8.244 6.674 14.754 1.00 0.00 H new ATOM 0 HB3 PHE A 123 6.901 7.621 15.364 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.327 4.211 15.198 1.00 0.00 H new ATOM 0 HD2 PHE A 123 5.399 6.728 17.001 1.00 0.00 H new ATOM 0 HE1 PHE A 123 7.875 2.479 16.882 1.00 0.00 H new ATOM 0 HE2 PHE A 123 4.943 4.998 18.681 1.00 0.00 H new ATOM 0 HZ PHE A 123 6.178 2.867 18.625 1.00 0.00 H new ATOM 1913 N ILE A 124 6.359 4.642 12.005 1.00 0.00 N ATOM 1914 CA ILE A 124 6.903 3.595 11.166 1.00 0.00 C ATOM 1915 C ILE A 124 7.385 4.159 9.829 1.00 0.00 C ATOM 1916 O ILE A 124 7.363 5.371 9.615 1.00 0.00 O ATOM 1917 CB ILE A 124 5.851 2.497 10.930 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.789 2.959 9.925 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.199 2.100 12.248 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.674 1.955 9.716 1.00 0.00 C ATOM 0 H ILE A 124 5.350 4.765 11.922 1.00 0.00 H new ATOM 0 HA ILE A 124 7.759 3.160 11.682 1.00 0.00 H new ATOM 0 HB ILE A 124 6.355 1.626 10.511 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.360 3.900 10.270 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.270 3.160 8.968 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.457 1.323 12.067 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.960 1.723 12.931 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.713 2.970 12.690 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.960 2.349 8.993 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.091 1.020 9.341 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.167 1.772 10.663 1.00 0.00 H new ATOM 1932 N THR A 125 7.818 3.276 8.935 1.00 0.00 N ATOM 1933 CA THR A 125 8.304 3.696 7.622 1.00 0.00 C ATOM 1934 C THR A 125 7.243 4.504 6.882 1.00 0.00 C ATOM 1935 O THR A 125 6.298 3.948 6.328 1.00 0.00 O ATOM 1936 CB THR A 125 8.706 2.478 6.787 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.775 1.780 7.400 1.00 0.00 O ATOM 1938 CG2 THR A 125 9.138 2.839 5.381 1.00 0.00 C ATOM 0 H THR A 125 7.843 2.269 9.093 1.00 0.00 H new ATOM 0 HA THR A 125 9.179 4.328 7.773 1.00 0.00 H new ATOM 0 HB THR A 125 7.813 1.856 6.729 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.016 1.004 6.852 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.410 1.933 4.840 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.317 3.337 4.865 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.998 3.508 5.425 1.00 0.00 H new ATOM 1946 N VAL A 126 7.408 5.821 6.881 1.00 0.00 N ATOM 1947 CA VAL A 126 6.465 6.706 6.214 1.00 0.00 C ATOM 1948 C VAL A 126 7.134 7.474 5.078 1.00 0.00 C ATOM 1949 O VAL A 126 8.233 8.006 5.236 1.00 0.00 O ATOM 1950 CB VAL A 126 5.850 7.709 7.208 1.00 0.00 C ATOM 1951 CG1 VAL A 126 4.863 8.634 6.511 1.00 0.00 C ATOM 1952 CG2 VAL A 126 5.177 6.974 8.358 1.00 0.00 C ATOM 0 H VAL A 126 8.187 6.299 7.335 1.00 0.00 H new ATOM 0 HA VAL A 126 5.675 6.078 5.801 1.00 0.00 H new ATOM 0 HB VAL A 126 6.655 8.322 7.613 1.00 0.00 H new ATOM 0 HG11 VAL A 126 4.444 9.332 7.236 1.00 0.00 H new ATOM 0 HG12 VAL A 126 5.377 9.190 5.727 1.00 0.00 H new ATOM 0 HG13 VAL A 126 4.060 8.043 6.070 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.748 7.698 9.051 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.387 6.333 7.967 1.00 0.00 H new ATOM 0 HG23 VAL A 126 5.914 6.364 8.881 1.00 0.00 H new ATOM 1962 N CYS A 127 6.456 7.537 3.937 1.00 0.00 N ATOM 1963 CA CYS A 127 6.975 8.248 2.776 1.00 0.00 C ATOM 1964 C CYS A 127 6.161 9.512 2.514 1.00 0.00 C ATOM 1965 O CYS A 127 5.163 9.480 1.793 1.00 0.00 O ATOM 1966 CB CYS A 127 6.951 7.345 1.542 1.00 0.00 C ATOM 1967 SG CYS A 127 8.117 5.965 1.614 1.00 0.00 S ATOM 0 H CYS A 127 5.544 7.103 3.792 1.00 0.00 H new ATOM 0 HA CYS A 127 8.006 8.533 2.983 1.00 0.00 H new ATOM 0 HB2 CYS A 127 5.944 6.949 1.414 1.00 0.00 H new ATOM 0 HB3 CYS A 127 7.171 7.947 0.660 1.00 0.00 H new ATOM 0 HG CYS A 127 8.021 5.258 0.527 1.00 0.00 H new ATOM 1973 N ASP A 128 6.590 10.621 3.105 1.00 0.00 N ATOM 1974 CA ASP A 128 5.899 11.894 2.939 1.00 0.00 C ATOM 1975 C ASP A 128 6.645 12.795 1.964 1.00 0.00 C ATOM 1976 O ASP A 128 7.871 12.888 2.005 1.00 0.00 O ATOM 1977 CB ASP A 128 5.748 12.596 4.289 1.00 0.00 C ATOM 1978 CG ASP A 128 4.661 13.653 4.273 1.00 0.00 C ATOM 1979 OD1 ASP A 128 4.951 14.797 3.863 1.00 0.00 O ATOM 1980 OD2 ASP A 128 3.521 13.337 4.671 1.00 0.00 O ATOM 0 H ASP A 128 7.414 10.664 3.704 1.00 0.00 H new ATOM 0 HA ASP A 128 4.909 11.691 2.531 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.520 11.856 5.057 1.00 0.00 H new ATOM 0 HB3 ASP A 128 6.696 13.058 4.563 1.00 0.00 H new ATOM 1985 N TYR A 129 5.899 13.460 1.086 1.00 0.00 N ATOM 1986 CA TYR A 129 6.503 14.352 0.107 1.00 0.00 C ATOM 1987 C TYR A 129 6.874 15.683 0.747 1.00 0.00 C ATOM 1988 O TYR A 129 6.121 16.655 0.673 1.00 0.00 O ATOM 1989 CB TYR A 129 5.559 14.583 -1.074 1.00 0.00 C ATOM 1990 CG TYR A 129 5.407 13.376 -1.972 1.00 0.00 C ATOM 1991 CD1 TYR A 129 4.635 12.290 -1.583 1.00 0.00 C ATOM 1992 CD2 TYR A 129 6.038 13.324 -3.209 1.00 0.00 C ATOM 1993 CE1 TYR A 129 4.495 11.185 -2.401 1.00 0.00 C ATOM 1994 CE2 TYR A 129 5.902 12.223 -4.034 1.00 0.00 C ATOM 1995 CZ TYR A 129 5.129 11.157 -3.625 1.00 0.00 C ATOM 1996 OH TYR A 129 4.992 10.058 -4.442 1.00 0.00 O ATOM 0 H TYR A 129 4.882 13.397 1.034 1.00 0.00 H new ATOM 0 HA TYR A 129 7.412 13.877 -0.263 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.578 14.869 -0.694 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.928 15.421 -1.665 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.136 12.309 -0.626 1.00 0.00 H new ATOM 0 HD2 TYR A 129 6.645 14.157 -3.531 1.00 0.00 H new ATOM 0 HE1 TYR A 129 3.892 10.347 -2.083 1.00 0.00 H new ATOM 0 HE2 TYR A 129 6.398 12.198 -4.993 1.00 0.00 H new ATOM 0 HH TYR A 129 4.150 10.122 -4.938 1.00 0.00 H new ATOM 2006 N THR A 130 8.048 15.722 1.359 1.00 0.00 N ATOM 2007 CA THR A 130 8.541 16.937 1.999 1.00 0.00 C ATOM 2008 C THR A 130 9.237 17.806 0.963 1.00 0.00 C ATOM 2009 O THR A 130 8.950 18.995 0.828 1.00 0.00 O ATOM 2010 CB THR A 130 9.507 16.593 3.134 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.716 16.063 2.620 1.00 0.00 O ATOM 2012 CG2 THR A 130 8.944 15.587 4.115 1.00 0.00 C ATOM 0 H THR A 130 8.680 14.925 1.427 1.00 0.00 H new ATOM 0 HA THR A 130 7.698 17.483 2.423 1.00 0.00 H new ATOM 0 HB THR A 130 9.680 17.531 3.661 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.321 15.851 3.361 1.00 0.00 H new ATOM 0 HG21 THR A 130 9.680 15.388 4.894 1.00 0.00 H new ATOM 0 HG22 THR A 130 8.037 15.988 4.567 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.710 14.660 3.591 1.00 0.00 H new ATOM 2020 N ASN A 131 10.135 17.180 0.215 1.00 0.00 N ATOM 2021 CA ASN A 131 10.867 17.853 -0.844 1.00 0.00 C ATOM 2022 C ASN A 131 10.580 17.152 -2.167 1.00 0.00 C ATOM 2023 O ASN A 131 11.489 16.650 -2.830 1.00 0.00 O ATOM 2024 CB ASN A 131 12.369 17.845 -0.549 1.00 0.00 C ATOM 2025 CG ASN A 131 12.796 19.021 0.306 1.00 0.00 C ATOM 2026 OD1 ASN A 131 12.503 20.174 -0.011 1.00 0.00 O ATOM 2027 ND2 ASN A 131 13.496 18.734 1.399 1.00 0.00 N ATOM 0 H ASN A 131 10.375 16.195 0.326 1.00 0.00 H new ATOM 0 HA ASN A 131 10.543 18.892 -0.904 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.632 16.916 -0.042 1.00 0.00 H new ATOM 0 HB3 ASN A 131 12.921 17.863 -1.489 1.00 0.00 H new ATOM 0 HD21 ASN A 131 13.813 19.484 2.013 1.00 0.00 H new ATOM 0 HD22 ASN A 131 13.716 17.764 1.623 1.00 0.00 H new ATOM 2034 N PRO A 132 9.294 17.096 -2.559 1.00 0.00 N ATOM 2035 CA PRO A 132 8.861 16.440 -3.792 1.00 0.00 C ATOM 2036 C PRO A 132 9.721 16.822 -4.988 1.00 0.00 C ATOM 2037 O PRO A 132 9.864 16.053 -5.938 1.00 0.00 O ATOM 2038 CB PRO A 132 7.415 16.927 -3.986 1.00 0.00 C ATOM 2039 CG PRO A 132 7.183 17.958 -2.930 1.00 0.00 C ATOM 2040 CD PRO A 132 8.154 17.653 -1.827 1.00 0.00 C ATOM 0 HA PRO A 132 8.945 15.356 -3.719 1.00 0.00 H new ATOM 0 HB2 PRO A 132 7.276 17.349 -4.981 1.00 0.00 H new ATOM 0 HB3 PRO A 132 6.709 16.102 -3.888 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.344 18.962 -3.324 1.00 0.00 H new ATOM 0 HG3 PRO A 132 6.156 17.919 -2.567 1.00 0.00 H new ATOM 0 HD2 PRO A 132 8.428 18.548 -1.268 1.00 0.00 H new ATOM 0 HD3 PRO A 132 7.744 16.942 -1.110 1.00 0.00 H new ATOM 2048 N CYS A 133 10.295 18.017 -4.931 1.00 0.00 N ATOM 2049 CA CYS A 133 11.146 18.512 -6.007 1.00 0.00 C ATOM 2050 C CYS A 133 12.238 17.500 -6.347 1.00 0.00 C ATOM 2051 O CYS A 133 12.561 17.288 -7.516 1.00 0.00 O ATOM 2052 CB CYS A 133 11.778 19.850 -5.610 1.00 0.00 C ATOM 2053 SG CYS A 133 10.973 21.291 -6.346 1.00 0.00 S ATOM 0 H CYS A 133 10.187 18.663 -4.149 1.00 0.00 H new ATOM 0 HA CYS A 133 10.525 18.659 -6.891 1.00 0.00 H new ATOM 0 HB2 CYS A 133 11.749 19.946 -4.525 1.00 0.00 H new ATOM 0 HB3 CYS A 133 12.828 19.845 -5.902 1.00 0.00 H new ATOM 0 HG CYS A 133 11.575 22.373 -5.951 1.00 0.00 H new ATOM 2059 N THR A 134 12.797 16.879 -5.315 1.00 0.00 N ATOM 2060 CA THR A 134 13.852 15.886 -5.497 1.00 0.00 C ATOM 2061 C THR A 134 13.419 14.518 -4.973 1.00 0.00 C ATOM 2062 O THR A 134 13.927 13.488 -5.414 1.00 0.00 O ATOM 2063 CB THR A 134 15.130 16.337 -4.789 1.00 0.00 C ATOM 2064 OG1 THR A 134 14.920 16.442 -3.392 1.00 0.00 O ATOM 2065 CG2 THR A 134 15.646 17.673 -5.277 1.00 0.00 C ATOM 0 H THR A 134 12.538 17.045 -4.342 1.00 0.00 H new ATOM 0 HA THR A 134 14.047 15.795 -6.565 1.00 0.00 H new ATOM 0 HB THR A 134 15.872 15.573 -5.020 1.00 0.00 H new ATOM 0 HG1 THR A 134 15.750 16.730 -2.957 1.00 0.00 H new ATOM 0 HG21 THR A 134 16.554 17.933 -4.733 1.00 0.00 H new ATOM 0 HG22 THR A 134 15.866 17.611 -6.343 1.00 0.00 H new ATOM 0 HG23 THR A 134 14.890 18.439 -5.107 1.00 0.00 H new ATOM 2073 N LYS A 135 12.478 14.514 -4.033 1.00 0.00 N ATOM 2074 CA LYS A 135 11.979 13.272 -3.453 1.00 0.00 C ATOM 2075 C LYS A 135 11.017 12.561 -4.408 1.00 0.00 C ATOM 2076 O LYS A 135 10.562 11.452 -4.127 1.00 0.00 O ATOM 2077 CB LYS A 135 11.279 13.552 -2.123 1.00 0.00 C ATOM 2078 CG LYS A 135 12.111 14.395 -1.168 1.00 0.00 C ATOM 2079 CD LYS A 135 12.539 13.598 0.056 1.00 0.00 C ATOM 2080 CE LYS A 135 13.970 13.104 -0.075 1.00 0.00 C ATOM 2081 NZ LYS A 135 14.276 12.022 0.904 1.00 0.00 N ATOM 0 H LYS A 135 12.046 15.358 -3.657 1.00 0.00 H new ATOM 0 HA LYS A 135 12.833 12.618 -3.279 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.335 14.062 -2.318 1.00 0.00 H new ATOM 0 HB3 LYS A 135 11.036 12.604 -1.642 1.00 0.00 H new ATOM 0 HG2 LYS A 135 12.994 14.769 -1.687 1.00 0.00 H new ATOM 0 HG3 LYS A 135 11.534 15.265 -0.853 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.447 14.220 0.947 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.870 12.748 0.190 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.136 12.735 -1.087 1.00 0.00 H new ATOM 0 HE3 LYS A 135 14.657 13.936 0.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 15.261 11.712 0.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 14.143 12.381 1.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.638 11.217 0.742 1.00 0.00 H new ATOM 2095 N SER A 136 10.707 13.204 -5.532 1.00 0.00 N ATOM 2096 CA SER A 136 9.795 12.630 -6.520 1.00 0.00 C ATOM 2097 C SER A 136 10.207 11.209 -6.905 1.00 0.00 C ATOM 2098 O SER A 136 9.382 10.419 -7.364 1.00 0.00 O ATOM 2099 CB SER A 136 9.746 13.513 -7.769 1.00 0.00 C ATOM 2100 OG SER A 136 11.014 13.575 -8.400 1.00 0.00 O ATOM 0 H SER A 136 11.074 14.123 -5.782 1.00 0.00 H new ATOM 0 HA SER A 136 8.804 12.584 -6.069 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.008 13.120 -8.468 1.00 0.00 H new ATOM 0 HB3 SER A 136 9.423 14.517 -7.496 1.00 0.00 H new ATOM 0 HG SER A 136 10.956 14.144 -9.196 1.00 0.00 H new ATOM 2106 N TRP A 137 11.484 10.886 -6.715 1.00 0.00 N ATOM 2107 CA TRP A 137 11.995 9.559 -7.046 1.00 0.00 C ATOM 2108 C TRP A 137 11.483 8.499 -6.067 1.00 0.00 C ATOM 2109 O TRP A 137 11.729 7.308 -6.254 1.00 0.00 O ATOM 2110 CB TRP A 137 13.524 9.564 -7.049 1.00 0.00 C ATOM 2111 CG TRP A 137 14.112 10.364 -8.169 1.00 0.00 C ATOM 2112 CD1 TRP A 137 14.413 11.696 -8.155 1.00 0.00 C ATOM 2113 CD2 TRP A 137 14.470 9.885 -9.470 1.00 0.00 C ATOM 2114 NE1 TRP A 137 14.937 12.073 -9.368 1.00 0.00 N ATOM 2115 CE2 TRP A 137 14.981 10.979 -10.192 1.00 0.00 C ATOM 2116 CE3 TRP A 137 14.408 8.636 -10.095 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 15.428 10.862 -11.507 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 14.851 8.519 -11.398 1.00 0.00 C ATOM 2119 CH2 TRP A 137 15.355 9.627 -12.092 1.00 0.00 C ATOM 0 H TRP A 137 12.183 11.524 -6.334 1.00 0.00 H new ATOM 0 HA TRP A 137 11.631 9.306 -8.042 1.00 0.00 H new ATOM 0 HB2 TRP A 137 13.881 9.964 -6.100 1.00 0.00 H new ATOM 0 HB3 TRP A 137 13.883 8.537 -7.118 1.00 0.00 H new ATOM 0 HD1 TRP A 137 14.261 12.356 -7.314 1.00 0.00 H new ATOM 0 HE1 TRP A 137 15.243 13.014 -9.615 1.00 0.00 H new ATOM 0 HE3 TRP A 137 14.020 7.777 -9.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 15.817 11.714 -12.044 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 14.808 7.558 -11.890 1.00 0.00 H new ATOM 0 HH2 TRP A 137 15.693 9.504 -13.110 1.00 0.00 H new ATOM 2130 N PHE A 138 10.772 8.934 -5.025 1.00 0.00 N ATOM 2131 CA PHE A 138 10.233 8.016 -4.024 1.00 0.00 C ATOM 2132 C PHE A 138 9.561 6.810 -4.682 1.00 0.00 C ATOM 2133 O PHE A 138 9.533 5.718 -4.116 1.00 0.00 O ATOM 2134 CB PHE A 138 9.227 8.744 -3.127 1.00 0.00 C ATOM 2135 CG PHE A 138 9.760 9.055 -1.757 1.00 0.00 C ATOM 2136 CD1 PHE A 138 10.441 8.091 -1.030 1.00 0.00 C ATOM 2137 CD2 PHE A 138 9.578 10.308 -1.197 1.00 0.00 C ATOM 2138 CE1 PHE A 138 10.930 8.373 0.231 1.00 0.00 C ATOM 2139 CE2 PHE A 138 10.064 10.596 0.063 1.00 0.00 C ATOM 2140 CZ PHE A 138 10.741 9.629 0.778 1.00 0.00 C ATOM 0 H PHE A 138 10.557 9.916 -4.854 1.00 0.00 H new ATOM 0 HA PHE A 138 11.065 7.656 -3.418 1.00 0.00 H new ATOM 0 HB2 PHE A 138 8.927 9.673 -3.611 1.00 0.00 H new ATOM 0 HB3 PHE A 138 8.330 8.132 -3.029 1.00 0.00 H new ATOM 0 HD1 PHE A 138 10.591 7.109 -1.454 1.00 0.00 H new ATOM 0 HD2 PHE A 138 9.050 11.069 -1.752 1.00 0.00 H new ATOM 0 HE1 PHE A 138 11.459 7.614 0.788 1.00 0.00 H new ATOM 0 HE2 PHE A 138 9.914 11.577 0.489 1.00 0.00 H new ATOM 0 HZ PHE A 138 11.123 9.853 1.763 1.00 0.00 H new ATOM 2150 N TRP A 139 9.029 7.016 -5.884 1.00 0.00 N ATOM 2151 CA TRP A 139 8.361 5.948 -6.620 1.00 0.00 C ATOM 2152 C TRP A 139 9.263 4.722 -6.739 1.00 0.00 C ATOM 2153 O TRP A 139 8.798 3.584 -6.661 1.00 0.00 O ATOM 2154 CB TRP A 139 7.964 6.433 -8.016 1.00 0.00 C ATOM 2155 CG TRP A 139 6.813 7.390 -8.008 1.00 0.00 C ATOM 2156 CD1 TRP A 139 5.710 7.341 -7.203 1.00 0.00 C ATOM 2157 CD2 TRP A 139 6.646 8.539 -8.847 1.00 0.00 C ATOM 2158 NE1 TRP A 139 4.870 8.390 -7.490 1.00 0.00 N ATOM 2159 CE2 TRP A 139 5.423 9.139 -8.495 1.00 0.00 C ATOM 2160 CE3 TRP A 139 7.414 9.118 -9.861 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 4.951 10.290 -9.121 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 6.945 10.260 -10.482 1.00 0.00 C ATOM 2163 CH2 TRP A 139 5.723 10.836 -10.111 1.00 0.00 C ATOM 0 H TRP A 139 9.048 7.913 -6.369 1.00 0.00 H new ATOM 0 HA TRP A 139 7.464 5.668 -6.068 1.00 0.00 H new ATOM 0 HB2 TRP A 139 8.823 6.914 -8.483 1.00 0.00 H new ATOM 0 HB3 TRP A 139 7.706 5.572 -8.632 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.525 6.588 -6.451 1.00 0.00 H new ATOM 0 HE1 TRP A 139 3.980 8.580 -7.030 1.00 0.00 H new ATOM 0 HE3 TRP A 139 8.357 8.681 -10.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 4.010 10.736 -8.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 7.530 10.716 -11.267 1.00 0.00 H new ATOM 0 HH2 TRP A 139 5.383 11.728 -10.616 1.00 0.00 H new ATOM 2174 N THR A 140 10.556 4.966 -6.927 1.00 0.00 N ATOM 2175 CA THR A 140 11.526 3.888 -7.058 1.00 0.00 C ATOM 2176 C THR A 140 11.722 3.166 -5.727 1.00 0.00 C ATOM 2177 O THR A 140 11.861 1.944 -5.687 1.00 0.00 O ATOM 2178 CB THR A 140 12.865 4.441 -7.555 1.00 0.00 C ATOM 2179 OG1 THR A 140 12.707 5.080 -8.809 1.00 0.00 O ATOM 2180 CG2 THR A 140 13.933 3.380 -7.713 1.00 0.00 C ATOM 0 H THR A 140 10.955 5.902 -6.992 1.00 0.00 H new ATOM 0 HA THR A 140 11.142 3.171 -7.784 1.00 0.00 H new ATOM 0 HB THR A 140 13.188 5.145 -6.788 1.00 0.00 H new ATOM 0 HG1 THR A 140 13.572 5.428 -9.110 1.00 0.00 H new ATOM 0 HG21 THR A 140 14.855 3.841 -8.068 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.114 2.900 -6.751 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.600 2.633 -8.434 1.00 0.00 H new ATOM 2188 N ARG A 141 11.730 3.931 -4.641 1.00 0.00 N ATOM 2189 CA ARG A 141 11.909 3.366 -3.307 1.00 0.00 C ATOM 2190 C ARG A 141 10.832 2.327 -3.004 1.00 0.00 C ATOM 2191 O ARG A 141 11.131 1.223 -2.552 1.00 0.00 O ATOM 2192 CB ARG A 141 11.882 4.475 -2.254 1.00 0.00 C ATOM 2193 CG ARG A 141 13.257 4.820 -1.700 1.00 0.00 C ATOM 2194 CD ARG A 141 13.371 4.468 -0.224 1.00 0.00 C ATOM 2195 NE ARG A 141 14.760 4.289 0.190 1.00 0.00 N ATOM 2196 CZ ARG A 141 15.634 5.288 0.304 1.00 0.00 C ATOM 2197 NH1 ARG A 141 15.266 6.535 0.036 1.00 0.00 N ATOM 2198 NH2 ARG A 141 16.878 5.038 0.688 1.00 0.00 N ATOM 0 H ARG A 141 11.615 4.944 -4.657 1.00 0.00 H new ATOM 0 HA ARG A 141 12.879 2.871 -3.276 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.440 5.370 -2.692 1.00 0.00 H new ATOM 0 HB3 ARG A 141 11.234 4.169 -1.432 1.00 0.00 H new ATOM 0 HG2 ARG A 141 14.021 4.284 -2.262 1.00 0.00 H new ATOM 0 HG3 ARG A 141 13.448 5.884 -1.837 1.00 0.00 H new ATOM 0 HD2 ARG A 141 12.913 5.257 0.373 1.00 0.00 H new ATOM 0 HD3 ARG A 141 12.813 3.553 -0.025 1.00 0.00 H new ATOM 0 HE ARG A 141 15.080 3.344 0.404 1.00 0.00 H new ATOM 0 HH11 ARG A 141 14.310 6.732 -0.259 1.00 0.00 H new ATOM 0 HH12 ARG A 141 15.940 7.296 0.125 1.00 0.00 H new ATOM 0 HH21 ARG A 141 17.165 4.082 0.896 1.00 0.00 H new ATOM 0 HH22 ARG A 141 17.548 5.802 0.776 1.00 0.00 H new ATOM 2212 N LEU A 142 9.579 2.691 -3.254 1.00 0.00 N ATOM 2213 CA LEU A 142 8.458 1.791 -3.004 1.00 0.00 C ATOM 2214 C LEU A 142 8.364 0.722 -4.089 1.00 0.00 C ATOM 2215 O LEU A 142 7.934 -0.402 -3.832 1.00 0.00 O ATOM 2216 CB LEU A 142 7.149 2.579 -2.935 1.00 0.00 C ATOM 2217 CG LEU A 142 6.043 1.926 -2.102 1.00 0.00 C ATOM 2218 CD1 LEU A 142 6.509 1.714 -0.670 1.00 0.00 C ATOM 2219 CD2 LEU A 142 4.781 2.774 -2.133 1.00 0.00 C ATOM 0 H LEU A 142 9.314 3.602 -3.629 1.00 0.00 H new ATOM 0 HA LEU A 142 8.629 1.298 -2.047 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.358 3.566 -2.523 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.779 2.729 -3.949 1.00 0.00 H new ATOM 0 HG LEU A 142 5.814 0.953 -2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 142 5.710 1.249 -0.092 1.00 0.00 H new ATOM 0 HD12 LEU A 142 7.385 1.066 -0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.766 2.675 -0.225 1.00 0.00 H new ATOM 0 HD21 LEU A 142 4.006 2.294 -1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 142 4.996 3.761 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU A 142 4.436 2.875 -3.162 1.00 0.00 H new ATOM 2231 N ALA A 143 8.769 1.080 -5.303 1.00 0.00 N ATOM 2232 CA ALA A 143 8.729 0.153 -6.427 1.00 0.00 C ATOM 2233 C ALA A 143 9.688 -1.013 -6.212 1.00 0.00 C ATOM 2234 O ALA A 143 9.379 -2.155 -6.552 1.00 0.00 O ATOM 2235 CB ALA A 143 9.057 0.880 -7.723 1.00 0.00 C ATOM 0 H ALA A 143 9.129 2.006 -5.533 1.00 0.00 H new ATOM 0 HA ALA A 143 7.719 -0.251 -6.497 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.023 0.175 -8.554 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.328 1.673 -7.890 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.055 1.313 -7.655 1.00 0.00 H new ATOM 2241 N LYS A 144 10.854 -0.718 -5.644 1.00 0.00 N ATOM 2242 CA LYS A 144 11.858 -1.746 -5.384 1.00 0.00 C ATOM 2243 C LYS A 144 11.660 -2.371 -4.004 1.00 0.00 C ATOM 2244 O LYS A 144 12.115 -3.485 -3.747 1.00 0.00 O ATOM 2245 CB LYS A 144 13.265 -1.153 -5.491 1.00 0.00 C ATOM 2246 CG LYS A 144 13.578 -0.122 -4.418 1.00 0.00 C ATOM 2247 CD LYS A 144 14.905 -0.412 -3.735 1.00 0.00 C ATOM 2248 CE LYS A 144 14.851 -1.701 -2.933 1.00 0.00 C ATOM 2249 NZ LYS A 144 16.152 -2.000 -2.273 1.00 0.00 N ATOM 0 H LYS A 144 11.127 0.222 -5.356 1.00 0.00 H new ATOM 0 HA LYS A 144 11.741 -2.528 -6.135 1.00 0.00 H new ATOM 0 HB2 LYS A 144 13.995 -1.960 -5.431 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.381 -0.691 -6.471 1.00 0.00 H new ATOM 0 HG2 LYS A 144 13.607 0.872 -4.865 1.00 0.00 H new ATOM 0 HG3 LYS A 144 12.780 -0.114 -3.676 1.00 0.00 H new ATOM 0 HD2 LYS A 144 15.693 -0.482 -4.485 1.00 0.00 H new ATOM 0 HD3 LYS A 144 15.165 0.417 -3.076 1.00 0.00 H new ATOM 0 HE2 LYS A 144 14.069 -1.626 -2.177 1.00 0.00 H new ATOM 0 HE3 LYS A 144 14.580 -2.527 -3.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 16.073 -2.887 -1.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 16.894 -2.097 -2.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 16.399 -1.224 -1.626 1.00 0.00 H new ATOM 2263 N ALA A 145 10.976 -1.648 -3.122 1.00 0.00 N ATOM 2264 CA ALA A 145 10.717 -2.134 -1.772 1.00 0.00 C ATOM 2265 C ALA A 145 9.517 -3.078 -1.742 1.00 0.00 C ATOM 2266 O ALA A 145 9.321 -3.816 -0.778 1.00 0.00 O ATOM 2267 CB ALA A 145 10.490 -0.964 -0.826 1.00 0.00 C ATOM 0 H ALA A 145 10.592 -0.724 -3.319 1.00 0.00 H new ATOM 0 HA ALA A 145 11.593 -2.694 -1.443 1.00 0.00 H new ATOM 0 HB1 ALA A 145 10.298 -1.340 0.179 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.376 -0.330 -0.812 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.633 -0.382 -1.166 1.00 0.00 H new ATOM 2273 N LEU A 146 8.716 -3.044 -2.803 1.00 0.00 N ATOM 2274 CA LEU A 146 7.536 -3.888 -2.898 1.00 0.00 C ATOM 2275 C LEU A 146 7.863 -5.215 -3.577 1.00 0.00 C ATOM 2276 O LEU A 146 7.183 -6.217 -3.357 1.00 0.00 O ATOM 2277 CB LEU A 146 6.439 -3.163 -3.676 1.00 0.00 C ATOM 2278 CG LEU A 146 5.684 -2.090 -2.889 1.00 0.00 C ATOM 2279 CD1 LEU A 146 4.842 -1.237 -3.825 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.812 -2.730 -1.819 1.00 0.00 C ATOM 0 H LEU A 146 8.866 -2.438 -3.610 1.00 0.00 H new ATOM 0 HA LEU A 146 7.186 -4.099 -1.888 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.885 -2.699 -4.556 1.00 0.00 H new ATOM 0 HB3 LEU A 146 5.721 -3.901 -4.034 1.00 0.00 H new ATOM 0 HG LEU A 146 6.413 -1.445 -2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 146 4.312 -0.479 -3.248 1.00 0.00 H new ATOM 0 HD12 LEU A 146 5.489 -0.751 -4.555 1.00 0.00 H new ATOM 0 HD13 LEU A 146 4.121 -1.869 -4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 146 4.282 -1.953 -1.269 1.00 0.00 H new ATOM 0 HD22 LEU A 146 4.090 -3.398 -2.289 1.00 0.00 H new ATOM 0 HD23 LEU A 146 5.438 -3.299 -1.131 1.00 0.00 H new ATOM 2292 N SER A 147 8.902 -5.215 -4.405 1.00 0.00 N ATOM 2293 CA SER A 147 9.308 -6.420 -5.115 1.00 0.00 C ATOM 2294 C SER A 147 10.828 -6.561 -5.140 1.00 0.00 C ATOM 2295 O SER A 147 11.425 -6.785 -6.194 1.00 0.00 O ATOM 2296 CB SER A 147 8.761 -6.400 -6.544 1.00 0.00 C ATOM 2297 OG SER A 147 8.441 -7.708 -6.986 1.00 0.00 O ATOM 0 H SER A 147 9.477 -4.395 -4.600 1.00 0.00 H new ATOM 0 HA SER A 147 8.896 -7.278 -4.584 1.00 0.00 H new ATOM 0 HB2 SER A 147 7.872 -5.770 -6.588 1.00 0.00 H new ATOM 0 HB3 SER A 147 9.499 -5.957 -7.213 1.00 0.00 H new ATOM 0 HG SER A 147 7.540 -7.945 -6.681 1.00 0.00 H new