USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 30 HIS HE2 : A 30 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD Set 1.1: B 155 THR OG1 : rot 116:sc= 0.00191 USER MOD Set 1.2: B 157 SER OG : rot -97:sc= 1.07 USER MOD Set 2.1: B 107 THR OG1 : rot 118:sc= 0.543 USER MOD Set 2.2: B 109 THR OG1 : rot 180:sc= 0.491 USER MOD Set 3.1: A 29 SER OG : rot 96:sc= 0.872 USER MOD Set 3.2: B 168 HIS :FLIP no HD1:sc= -0.53 F(o=-0.63,f=0.34) USER MOD Single : A 1 SER N :NH3+ -168:sc= -0.0306 (180deg=-0.297) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= -0.695 USER MOD Single : A 13 MET CE :methyl -172:sc= -2.03 (180deg=-2.5) USER MOD Single : A 15 GLN : amide:sc= -0.405 X(o=-0.4,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= -1.25 USER MOD Single : A 24 GLN : amide:sc= -1.1 K(o=-1.1,f=-2.7!) USER MOD Single : A 33 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.61) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 99 SER OG : rot 180:sc= 0 USER MOD Single : B 100 HIS :FLIP no HD1:sc= -1.24 F(o=-2,f=-1.2) USER MOD Single : B 101 MET CE :methyl 145:sc= -0.71 (180deg=-3.4!) USER MOD Single : B 102 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 106 LYS NZ :NH3+ 159:sc= -0.223 (180deg=-0.963) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= 0 USER MOD Single : B 114 THR OG1 : rot -97:sc= 1.04 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot -170:sc= -0.821 USER MOD Single : B 125 ASN : amide:sc= -0.0684 X(o=-0.068,f=0) USER MOD Single : B 127 LYS NZ :NH3+ -147:sc= -2.68 (180deg=-6.28!) USER MOD Single : B 129 LYS NZ :NH3+ 155:sc= -0.207 (180deg=-0.928) USER MOD Single : B 131 GLN : amide:sc= -0.564 X(o=-0.56,f=-0.08) USER MOD Single : B 133 LYS NZ :NH3+ -150:sc= -0.116 (180deg=-0.876) USER MOD Single : B 140 GLN : amide:sc= -0.032 X(o=-0.032,f=-0.032) USER MOD Single : B 141 GLN : amide:sc= -4.07! C(o=-4.1!,f=-6!) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 149 GLN : amide:sc= -0.515 X(o=-0.51,f=-0.72) USER MOD Single : B 159 TYR OH : rot 30:sc= -0.164 USER MOD Single : B 160 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.036) USER MOD Single : B 162 GLN :FLIP amide:sc= -0.0163 F(o=-0.65,f=-0.016) USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot 68:sc= 1.27 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -20.237 -14.856 4.153 1.00 0.00 N ATOM 2 CA SER A 1 -19.614 -15.826 3.261 1.00 0.00 C ATOM 3 C SER A 1 -19.975 -15.537 1.807 1.00 0.00 C ATOM 4 O SER A 1 -19.227 -15.877 0.889 1.00 0.00 O ATOM 5 CB SER A 1 -20.046 -17.245 3.633 1.00 0.00 C ATOM 6 OG SER A 1 -19.600 -17.590 4.934 1.00 0.00 O ATOM 0 H1 SER A 1 -19.823 -14.942 5.103 1.00 0.00 H new ATOM 0 H2 SER A 1 -20.074 -13.895 3.790 1.00 0.00 H new ATOM 0 H3 SER A 1 -21.260 -15.038 4.204 1.00 0.00 H new ATOM 0 HA SER A 1 -18.533 -15.743 3.373 1.00 0.00 H new ATOM 0 HB2 SER A 1 -21.132 -17.322 3.585 1.00 0.00 H new ATOM 0 HB3 SER A 1 -19.644 -17.953 2.908 1.00 0.00 H new ATOM 0 HG SER A 1 -19.890 -18.501 5.149 1.00 0.00 H new ATOM 12 N HIS A 2 -21.127 -14.907 1.604 1.00 0.00 N ATOM 13 CA HIS A 2 -21.590 -14.571 0.262 1.00 0.00 C ATOM 14 C HIS A 2 -21.044 -13.216 -0.177 1.00 0.00 C ATOM 15 O HIS A 2 -20.801 -12.987 -1.362 1.00 0.00 O ATOM 16 CB HIS A 2 -23.118 -14.559 0.214 1.00 0.00 C ATOM 17 CG HIS A 2 -23.675 -14.728 -1.166 1.00 0.00 C ATOM 18 ND1 HIS A 2 -24.443 -13.769 -1.791 1.00 0.00 N ATOM 19 CD2 HIS A 2 -23.569 -15.754 -2.044 1.00 0.00 C ATOM 20 CE1 HIS A 2 -24.787 -14.197 -2.992 1.00 0.00 C ATOM 21 NE2 HIS A 2 -24.270 -15.399 -3.170 1.00 0.00 N ATOM 0 H HIS A 2 -21.758 -14.618 2.352 1.00 0.00 H new ATOM 0 HA HIS A 2 -21.219 -15.332 -0.425 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -23.500 -15.357 0.851 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -23.479 -13.618 0.630 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -23.033 -16.679 -1.888 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -25.389 -13.656 -3.707 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -24.374 -15.971 -4.008 1.00 0.00 H new ATOM 29 N MET A 3 -20.855 -12.319 0.786 1.00 0.00 N ATOM 30 CA MET A 3 -20.338 -10.986 0.498 1.00 0.00 C ATOM 31 C MET A 3 -19.256 -10.595 1.499 1.00 0.00 C ATOM 32 O MET A 3 -19.243 -11.072 2.633 1.00 0.00 O ATOM 33 CB MET A 3 -21.471 -9.959 0.528 1.00 0.00 C ATOM 34 CG MET A 3 -22.270 -9.973 1.821 1.00 0.00 C ATOM 35 SD MET A 3 -23.790 -9.009 1.709 1.00 0.00 S ATOM 36 CE MET A 3 -23.343 -7.560 2.662 1.00 0.00 C ATOM 0 H MET A 3 -21.052 -12.491 1.772 1.00 0.00 H new ATOM 0 HA MET A 3 -19.898 -11.002 -0.499 1.00 0.00 H new ATOM 0 HB2 MET A 3 -21.052 -8.964 0.380 1.00 0.00 H new ATOM 0 HB3 MET A 3 -22.145 -10.149 -0.308 1.00 0.00 H new ATOM 0 HG2 MET A 3 -22.516 -11.003 2.080 1.00 0.00 H new ATOM 0 HG3 MET A 3 -21.653 -9.579 2.629 1.00 0.00 H new ATOM 0 HE1 MET A 3 -24.183 -6.866 2.685 1.00 0.00 H new ATOM 0 HE2 MET A 3 -23.090 -7.858 3.680 1.00 0.00 H new ATOM 0 HE3 MET A 3 -22.483 -7.073 2.202 1.00 0.00 H new ATOM 46 N GLY A 4 -18.347 -9.724 1.072 1.00 0.00 N ATOM 47 CA GLY A 4 -17.273 -9.284 1.943 1.00 0.00 C ATOM 48 C GLY A 4 -15.909 -9.413 1.292 1.00 0.00 C ATOM 49 O GLY A 4 -15.663 -8.836 0.234 1.00 0.00 O ATOM 0 H GLY A 4 -18.335 -9.315 0.138 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -17.441 -8.245 2.225 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.291 -9.870 2.862 1.00 0.00 H new ATOM 53 N ALA A 5 -15.021 -10.171 1.927 1.00 0.00 N ATOM 54 CA ALA A 5 -13.677 -10.374 1.404 1.00 0.00 C ATOM 55 C ALA A 5 -12.941 -9.047 1.254 1.00 0.00 C ATOM 56 O ALA A 5 -12.271 -8.807 0.249 1.00 0.00 O ATOM 57 CB ALA A 5 -13.734 -11.101 0.069 1.00 0.00 C ATOM 0 H ALA A 5 -15.209 -10.655 2.805 1.00 0.00 H new ATOM 0 HA ALA A 5 -13.126 -10.988 2.116 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -12.722 -11.246 -0.310 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -14.214 -12.071 0.203 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -14.307 -10.508 -0.644 1.00 0.00 H new ATOM 63 N ALA A 6 -13.068 -8.188 2.260 1.00 0.00 N ATOM 64 CA ALA A 6 -12.413 -6.886 2.240 1.00 0.00 C ATOM 65 C ALA A 6 -12.567 -6.174 3.580 1.00 0.00 C ATOM 66 O ALA A 6 -13.509 -6.434 4.328 1.00 0.00 O ATOM 67 CB ALA A 6 -12.977 -6.028 1.117 1.00 0.00 C ATOM 0 H ALA A 6 -13.619 -8.370 3.099 1.00 0.00 H new ATOM 0 HA ALA A 6 -11.349 -7.045 2.062 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.479 -5.059 1.114 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.810 -6.524 0.161 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.047 -5.885 1.270 1.00 0.00 H new ATOM 73 N ALA A 7 -11.635 -5.274 3.877 1.00 0.00 N ATOM 74 CA ALA A 7 -11.668 -4.523 5.126 1.00 0.00 C ATOM 75 C ALA A 7 -12.824 -3.529 5.139 1.00 0.00 C ATOM 76 O ALA A 7 -13.394 -3.237 6.190 1.00 0.00 O ATOM 77 CB ALA A 7 -10.346 -3.802 5.343 1.00 0.00 C ATOM 0 H ALA A 7 -10.848 -5.047 3.269 1.00 0.00 H new ATOM 0 HA ALA A 7 -11.822 -5.229 5.942 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.385 -3.245 6.279 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.537 -4.531 5.388 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.168 -3.112 4.518 1.00 0.00 H new ATOM 83 N LEU A 8 -13.166 -3.011 3.964 1.00 0.00 N ATOM 84 CA LEU A 8 -14.253 -2.048 3.840 1.00 0.00 C ATOM 85 C LEU A 8 -15.108 -2.346 2.611 1.00 0.00 C ATOM 86 O LEU A 8 -14.600 -2.801 1.586 1.00 0.00 O ATOM 87 CB LEU A 8 -13.696 -0.626 3.754 1.00 0.00 C ATOM 88 CG LEU A 8 -12.334 -0.479 3.074 1.00 0.00 C ATOM 89 CD1 LEU A 8 -12.257 0.834 2.312 1.00 0.00 C ATOM 90 CD2 LEU A 8 -11.214 -0.570 4.099 1.00 0.00 C ATOM 0 H LEU A 8 -12.705 -3.242 3.084 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.881 -2.132 4.727 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -14.416 -0.007 3.219 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -13.620 -0.225 4.765 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.215 -1.296 2.362 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.281 0.921 1.835 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.037 0.859 1.551 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -12.398 1.665 3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.252 -0.463 3.597 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.329 0.225 4.835 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.257 -1.537 4.600 1.00 0.00 H new ATOM 102 N ARG A 9 -16.406 -2.086 2.722 1.00 0.00 N ATOM 103 CA ARG A 9 -17.331 -2.326 1.620 1.00 0.00 C ATOM 104 C ARG A 9 -17.787 -1.009 0.997 1.00 0.00 C ATOM 105 O ARG A 9 -18.550 -1.000 0.031 1.00 0.00 O ATOM 106 CB ARG A 9 -18.544 -3.120 2.107 1.00 0.00 C ATOM 107 CG ARG A 9 -19.394 -2.370 3.120 1.00 0.00 C ATOM 108 CD ARG A 9 -20.879 -2.554 2.846 1.00 0.00 C ATOM 109 NE ARG A 9 -21.471 -3.579 3.701 1.00 0.00 N ATOM 110 CZ ARG A 9 -21.771 -3.384 4.981 1.00 0.00 C ATOM 111 NH1 ARG A 9 -21.538 -2.208 5.548 1.00 0.00 N ATOM 112 NH2 ARG A 9 -22.308 -4.364 5.695 1.00 0.00 N ATOM 0 H ARG A 9 -16.842 -1.709 3.564 1.00 0.00 H new ATOM 0 HA ARG A 9 -16.808 -2.906 0.860 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -19.163 -3.384 1.250 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -18.202 -4.054 2.553 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -19.162 -2.724 4.125 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -19.146 -1.309 3.090 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -21.396 -1.608 3.003 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -21.024 -2.826 1.801 1.00 0.00 H new ATOM 0 HE ARG A 9 -21.665 -4.494 3.294 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -21.128 -1.451 5.002 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -21.769 -2.061 6.531 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -22.491 -5.269 5.262 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -22.538 -4.213 6.677 1.00 0.00 H new ATOM 126 N SER A 10 -17.314 0.100 1.556 1.00 0.00 N ATOM 127 CA SER A 10 -17.676 1.421 1.059 1.00 0.00 C ATOM 128 C SER A 10 -16.594 2.443 1.393 1.00 0.00 C ATOM 129 O SER A 10 -16.239 2.631 2.557 1.00 0.00 O ATOM 130 CB SER A 10 -19.014 1.864 1.653 1.00 0.00 C ATOM 131 OG SER A 10 -19.751 0.753 2.136 1.00 0.00 O ATOM 0 H SER A 10 -16.679 0.109 2.354 1.00 0.00 H new ATOM 0 HA SER A 10 -17.771 1.360 -0.025 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.839 2.569 2.465 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.596 2.389 0.895 1.00 0.00 H new ATOM 0 HG SER A 10 -20.601 1.063 2.512 1.00 0.00 H new ATOM 137 N CYS A 11 -16.073 3.103 0.365 1.00 0.00 N ATOM 138 CA CYS A 11 -15.031 4.107 0.546 1.00 0.00 C ATOM 139 C CYS A 11 -15.437 5.127 1.606 1.00 0.00 C ATOM 140 O CYS A 11 -16.294 5.983 1.383 1.00 0.00 O ATOM 141 CB CYS A 11 -14.742 4.817 -0.777 1.00 0.00 C ATOM 142 SG CYS A 11 -13.277 5.900 -0.735 1.00 0.00 S ATOM 0 H CYS A 11 -16.356 2.960 -0.605 1.00 0.00 H new ATOM 0 HA CYS A 11 -14.127 3.600 0.883 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -14.605 4.068 -1.557 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -15.612 5.411 -1.056 1.00 0.00 H new ATOM 147 N PRO A 12 -14.809 5.035 2.788 1.00 0.00 N ATOM 148 CA PRO A 12 -15.087 5.942 3.905 1.00 0.00 C ATOM 149 C PRO A 12 -14.590 7.358 3.640 1.00 0.00 C ATOM 150 O PRO A 12 -14.806 8.262 4.446 1.00 0.00 O ATOM 151 CB PRO A 12 -14.318 5.314 5.070 1.00 0.00 C ATOM 152 CG PRO A 12 -13.221 4.540 4.427 1.00 0.00 C ATOM 153 CD PRO A 12 -13.776 4.039 3.123 1.00 0.00 C ATOM 0 HA PRO A 12 -16.156 6.047 4.089 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.923 6.077 5.741 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.962 4.667 5.666 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -12.345 5.168 4.263 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -12.905 3.711 5.061 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -13.006 3.984 2.353 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.199 3.039 3.224 1.00 0.00 H new ATOM 161 N MET A 13 -13.925 7.545 2.505 1.00 0.00 N ATOM 162 CA MET A 13 -13.399 8.853 2.133 1.00 0.00 C ATOM 163 C MET A 13 -14.435 9.652 1.348 1.00 0.00 C ATOM 164 O MET A 13 -14.773 10.777 1.715 1.00 0.00 O ATOM 165 CB MET A 13 -12.123 8.696 1.304 1.00 0.00 C ATOM 166 CG MET A 13 -11.139 7.695 1.886 1.00 0.00 C ATOM 167 SD MET A 13 -9.452 7.963 1.307 1.00 0.00 S ATOM 168 CE MET A 13 -9.073 6.356 0.614 1.00 0.00 C ATOM 0 H MET A 13 -13.737 6.807 1.827 1.00 0.00 H new ATOM 0 HA MET A 13 -13.164 9.397 3.048 1.00 0.00 H new ATOM 0 HB2 MET A 13 -12.391 8.384 0.295 1.00 0.00 H new ATOM 0 HB3 MET A 13 -11.634 9.666 1.218 1.00 0.00 H new ATOM 0 HG2 MET A 13 -11.160 7.761 2.974 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.454 6.686 1.621 1.00 0.00 H new ATOM 0 HE1 MET A 13 -8.018 6.316 0.343 1.00 0.00 H new ATOM 0 HE2 MET A 13 -9.288 5.582 1.351 1.00 0.00 H new ATOM 0 HE3 MET A 13 -9.682 6.190 -0.275 1.00 0.00 H new ATOM 178 N CYS A 14 -14.935 9.064 0.267 1.00 0.00 N ATOM 179 CA CYS A 14 -15.932 9.720 -0.570 1.00 0.00 C ATOM 180 C CYS A 14 -17.267 8.983 -0.508 1.00 0.00 C ATOM 181 O CYS A 14 -18.115 9.142 -1.384 1.00 0.00 O ATOM 182 CB CYS A 14 -15.445 9.792 -2.019 1.00 0.00 C ATOM 183 SG CYS A 14 -15.431 8.187 -2.880 1.00 0.00 S ATOM 0 H CYS A 14 -14.666 8.133 -0.050 1.00 0.00 H new ATOM 0 HA CYS A 14 -16.078 10.732 -0.191 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -16.082 10.483 -2.571 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -14.438 10.208 -2.032 1.00 0.00 H new ATOM 188 N GLN A 15 -17.442 8.176 0.534 1.00 0.00 N ATOM 189 CA GLN A 15 -18.673 7.414 0.711 1.00 0.00 C ATOM 190 C GLN A 15 -19.108 6.773 -0.602 1.00 0.00 C ATOM 191 O GLN A 15 -20.136 7.136 -1.172 1.00 0.00 O ATOM 192 CB GLN A 15 -19.785 8.319 1.243 1.00 0.00 C ATOM 193 CG GLN A 15 -19.848 8.377 2.761 1.00 0.00 C ATOM 194 CD GLN A 15 -20.779 7.333 3.347 1.00 0.00 C ATOM 195 OE1 GLN A 15 -21.878 7.650 3.802 1.00 0.00 O ATOM 196 NE2 GLN A 15 -20.341 6.079 3.339 1.00 0.00 N ATOM 0 H GLN A 15 -16.748 8.033 1.268 1.00 0.00 H new ATOM 0 HA GLN A 15 -18.481 6.622 1.435 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -19.639 9.327 0.855 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -20.743 7.966 0.861 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -18.847 8.235 3.168 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -20.180 9.368 3.069 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -19.423 5.862 2.951 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -20.923 5.333 3.720 1.00 0.00 H new ATOM 205 N LYS A 16 -18.319 5.815 -1.077 1.00 0.00 N ATOM 206 CA LYS A 16 -18.623 5.121 -2.323 1.00 0.00 C ATOM 207 C LYS A 16 -18.696 3.613 -2.100 1.00 0.00 C ATOM 208 O LYS A 16 -17.686 2.967 -1.824 1.00 0.00 O ATOM 209 CB LYS A 16 -17.563 5.440 -3.379 1.00 0.00 C ATOM 210 CG LYS A 16 -17.798 4.740 -4.707 1.00 0.00 C ATOM 211 CD LYS A 16 -18.015 5.737 -5.832 1.00 0.00 C ATOM 212 CE LYS A 16 -16.743 6.511 -6.145 1.00 0.00 C ATOM 213 NZ LYS A 16 -16.983 7.594 -7.138 1.00 0.00 N ATOM 0 H LYS A 16 -17.464 5.501 -0.618 1.00 0.00 H new ATOM 0 HA LYS A 16 -19.595 5.467 -2.676 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -17.540 6.517 -3.545 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -16.583 5.155 -2.996 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -16.943 4.106 -4.941 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -18.667 4.087 -4.626 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -18.351 5.211 -6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -18.807 6.433 -5.555 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -16.345 6.942 -5.226 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -15.987 5.827 -6.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -16.092 8.098 -7.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -17.339 7.181 -8.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -17.686 8.261 -6.761 1.00 0.00 H new ATOM 227 N GLU A 17 -19.898 3.059 -2.225 1.00 0.00 N ATOM 228 CA GLU A 17 -20.102 1.628 -2.038 1.00 0.00 C ATOM 229 C GLU A 17 -19.365 0.829 -3.108 1.00 0.00 C ATOM 230 O GLU A 17 -19.613 0.994 -4.304 1.00 0.00 O ATOM 231 CB GLU A 17 -21.595 1.293 -2.074 1.00 0.00 C ATOM 232 CG GLU A 17 -22.331 1.655 -0.796 1.00 0.00 C ATOM 233 CD GLU A 17 -23.755 2.111 -1.052 1.00 0.00 C ATOM 234 OE1 GLU A 17 -23.939 3.267 -1.484 1.00 0.00 O ATOM 235 OE2 GLU A 17 -24.685 1.311 -0.818 1.00 0.00 O ATOM 0 H GLU A 17 -20.745 3.580 -2.455 1.00 0.00 H new ATOM 0 HA GLU A 17 -19.699 1.355 -1.063 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -22.056 1.818 -2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -21.715 0.226 -2.263 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -22.344 0.791 -0.131 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -21.787 2.446 -0.280 1.00 0.00 H new ATOM 242 N PHE A 18 -18.456 -0.037 -2.672 1.00 0.00 N ATOM 243 CA PHE A 18 -17.680 -0.861 -3.592 1.00 0.00 C ATOM 244 C PHE A 18 -18.526 -2.006 -4.142 1.00 0.00 C ATOM 245 O PHE A 18 -19.476 -2.454 -3.500 1.00 0.00 O ATOM 246 CB PHE A 18 -16.441 -1.419 -2.889 1.00 0.00 C ATOM 247 CG PHE A 18 -15.559 -0.358 -2.296 1.00 0.00 C ATOM 248 CD1 PHE A 18 -15.020 0.639 -3.094 1.00 0.00 C ATOM 249 CD2 PHE A 18 -15.271 -0.356 -0.942 1.00 0.00 C ATOM 250 CE1 PHE A 18 -14.207 1.616 -2.552 1.00 0.00 C ATOM 251 CE2 PHE A 18 -14.459 0.620 -0.393 1.00 0.00 C ATOM 252 CZ PHE A 18 -13.928 1.607 -1.199 1.00 0.00 C ATOM 0 H PHE A 18 -18.238 -0.186 -1.687 1.00 0.00 H new ATOM 0 HA PHE A 18 -17.364 -0.233 -4.425 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -16.757 -2.100 -2.099 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -15.861 -2.005 -3.602 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -15.238 0.652 -4.152 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -15.685 -1.125 -0.307 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -13.790 2.385 -3.185 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -14.241 0.610 0.665 1.00 0.00 H new ATOM 0 HZ PHE A 18 -13.295 2.371 -0.772 1.00 0.00 H new ATOM 262 N ALA A 19 -18.174 -2.474 -5.334 1.00 0.00 N ATOM 263 CA ALA A 19 -18.898 -3.567 -5.971 1.00 0.00 C ATOM 264 C ALA A 19 -18.892 -4.814 -5.093 1.00 0.00 C ATOM 265 O ALA A 19 -17.981 -5.036 -4.295 1.00 0.00 O ATOM 266 CB ALA A 19 -18.297 -3.876 -7.335 1.00 0.00 C ATOM 0 H ALA A 19 -17.391 -2.113 -5.879 1.00 0.00 H new ATOM 0 HA ALA A 19 -19.933 -3.254 -6.106 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -18.848 -4.694 -7.798 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -18.359 -2.991 -7.969 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -17.252 -4.164 -7.216 1.00 0.00 H new ATOM 272 N PRO A 20 -19.933 -5.647 -5.241 1.00 0.00 N ATOM 273 CA PRO A 20 -20.071 -6.886 -4.470 1.00 0.00 C ATOM 274 C PRO A 20 -19.044 -7.938 -4.875 1.00 0.00 C ATOM 275 O PRO A 20 -18.339 -7.781 -5.871 1.00 0.00 O ATOM 276 CB PRO A 20 -21.486 -7.361 -4.810 1.00 0.00 C ATOM 277 CG PRO A 20 -21.774 -6.765 -6.145 1.00 0.00 C ATOM 278 CD PRO A 20 -21.055 -5.445 -6.173 1.00 0.00 C ATOM 0 HA PRO A 20 -19.906 -6.723 -3.405 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -21.542 -8.449 -4.842 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -22.206 -7.027 -4.063 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -21.425 -7.416 -6.947 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -22.846 -6.629 -6.288 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -20.705 -5.199 -7.176 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -21.702 -4.628 -5.852 1.00 0.00 H new ATOM 286 N ARG A 21 -18.966 -9.013 -4.096 1.00 0.00 N ATOM 287 CA ARG A 21 -18.024 -10.091 -4.374 1.00 0.00 C ATOM 288 C ARG A 21 -16.686 -9.535 -4.851 1.00 0.00 C ATOM 289 O ARG A 21 -16.054 -10.093 -5.750 1.00 0.00 O ATOM 290 CB ARG A 21 -18.600 -11.040 -5.428 1.00 0.00 C ATOM 291 CG ARG A 21 -18.796 -10.392 -6.788 1.00 0.00 C ATOM 292 CD ARG A 21 -19.360 -11.379 -7.798 1.00 0.00 C ATOM 293 NE ARG A 21 -18.352 -11.811 -8.762 1.00 0.00 N ATOM 294 CZ ARG A 21 -17.548 -12.850 -8.571 1.00 0.00 C ATOM 295 NH1 ARG A 21 -17.633 -13.560 -7.454 1.00 0.00 N ATOM 296 NH2 ARG A 21 -16.656 -13.180 -9.495 1.00 0.00 N ATOM 0 H ARG A 21 -19.543 -9.160 -3.268 1.00 0.00 H new ATOM 0 HA ARG A 21 -17.858 -10.643 -3.449 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -17.935 -11.897 -5.536 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -19.558 -11.422 -5.076 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.471 -9.541 -6.693 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -17.843 -10.005 -7.149 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.756 -12.248 -7.273 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -20.194 -10.919 -8.327 1.00 0.00 H new ATOM 0 HE ARG A 21 -18.260 -11.285 -9.631 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.317 -13.308 -6.740 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -17.015 -14.358 -7.309 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -16.587 -12.635 -10.354 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -16.039 -13.979 -9.346 1.00 0.00 H new ATOM 310 N LEU A 22 -16.260 -8.432 -4.246 1.00 0.00 N ATOM 311 CA LEU A 22 -14.997 -7.798 -4.610 1.00 0.00 C ATOM 312 C LEU A 22 -13.827 -8.466 -3.893 1.00 0.00 C ATOM 313 O LEU A 22 -14.011 -9.420 -3.136 1.00 0.00 O ATOM 314 CB LEU A 22 -15.034 -6.308 -4.269 1.00 0.00 C ATOM 315 CG LEU A 22 -15.626 -5.944 -2.907 1.00 0.00 C ATOM 316 CD1 LEU A 22 -14.883 -6.665 -1.793 1.00 0.00 C ATOM 317 CD2 LEU A 22 -15.586 -4.439 -2.692 1.00 0.00 C ATOM 0 H LEU A 22 -16.770 -7.958 -3.501 1.00 0.00 H new ATOM 0 HA LEU A 22 -14.857 -7.915 -5.685 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.016 -5.920 -4.316 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -15.607 -5.794 -5.041 1.00 0.00 H new ATOM 0 HG LEU A 22 -16.668 -6.264 -2.888 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -15.318 -6.394 -0.831 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -14.966 -7.742 -1.938 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -13.832 -6.376 -1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -16.011 -4.199 -1.718 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -14.553 -4.093 -2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -16.165 -3.945 -3.472 1.00 0.00 H new ATOM 329 N THR A 23 -12.623 -7.958 -4.135 1.00 0.00 N ATOM 330 CA THR A 23 -11.424 -8.504 -3.513 1.00 0.00 C ATOM 331 C THR A 23 -10.638 -7.416 -2.788 1.00 0.00 C ATOM 332 O THR A 23 -10.856 -6.227 -3.011 1.00 0.00 O ATOM 333 CB THR A 23 -10.508 -9.176 -4.552 1.00 0.00 C ATOM 334 OG1 THR A 23 -10.669 -8.546 -5.828 1.00 0.00 O ATOM 335 CG2 THR A 23 -10.822 -10.660 -4.670 1.00 0.00 C ATOM 0 H THR A 23 -12.453 -7.169 -4.758 1.00 0.00 H new ATOM 0 HA THR A 23 -11.754 -9.253 -2.793 1.00 0.00 H new ATOM 0 HB THR A 23 -9.476 -9.064 -4.220 1.00 0.00 H new ATOM 0 HG1 THR A 23 -10.082 -8.979 -6.483 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.162 -11.114 -5.410 1.00 0.00 H new ATOM 0 HG22 THR A 23 -10.670 -11.142 -3.704 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.859 -10.789 -4.981 1.00 0.00 H new ATOM 343 N GLN A 24 -9.723 -7.835 -1.919 1.00 0.00 N ATOM 344 CA GLN A 24 -8.904 -6.896 -1.161 1.00 0.00 C ATOM 345 C GLN A 24 -8.248 -5.876 -2.086 1.00 0.00 C ATOM 346 O GLN A 24 -8.112 -4.703 -1.737 1.00 0.00 O ATOM 347 CB GLN A 24 -7.833 -7.645 -0.368 1.00 0.00 C ATOM 348 CG GLN A 24 -8.335 -8.204 0.954 1.00 0.00 C ATOM 349 CD GLN A 24 -8.088 -7.263 2.117 1.00 0.00 C ATOM 350 OE1 GLN A 24 -7.209 -7.500 2.946 1.00 0.00 O ATOM 351 NE2 GLN A 24 -8.866 -6.188 2.185 1.00 0.00 N ATOM 0 H GLN A 24 -9.530 -8.817 -1.723 1.00 0.00 H new ATOM 0 HA GLN A 24 -9.555 -6.364 -0.467 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -7.448 -8.463 -0.976 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -6.998 -6.971 -0.175 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -9.403 -8.407 0.876 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -7.843 -9.157 1.152 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -9.582 -6.031 1.476 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.747 -5.520 2.946 1.00 0.00 H new ATOM 360 N LEU A 25 -7.842 -6.331 -3.267 1.00 0.00 N ATOM 361 CA LEU A 25 -7.199 -5.458 -4.243 1.00 0.00 C ATOM 362 C LEU A 25 -8.206 -4.488 -4.853 1.00 0.00 C ATOM 363 O LEU A 25 -7.901 -3.315 -5.067 1.00 0.00 O ATOM 364 CB LEU A 25 -6.542 -6.290 -5.346 1.00 0.00 C ATOM 365 CG LEU A 25 -5.297 -5.684 -5.992 1.00 0.00 C ATOM 366 CD1 LEU A 25 -5.594 -4.292 -6.525 1.00 0.00 C ATOM 367 CD2 LEU A 25 -4.146 -5.642 -4.996 1.00 0.00 C ATOM 0 H LEU A 25 -7.947 -7.299 -3.571 1.00 0.00 H new ATOM 0 HA LEU A 25 -6.432 -4.880 -3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.275 -7.261 -4.930 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.281 -6.470 -6.127 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.003 -6.315 -6.831 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.695 -3.878 -6.981 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.386 -4.350 -7.272 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.914 -3.649 -5.705 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.268 -5.208 -5.473 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.430 -5.034 -4.137 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.915 -6.654 -4.664 1.00 0.00 H new ATOM 379 N ASP A 26 -9.407 -4.986 -5.128 1.00 0.00 N ATOM 380 CA ASP A 26 -10.461 -4.162 -5.710 1.00 0.00 C ATOM 381 C ASP A 26 -10.691 -2.905 -4.877 1.00 0.00 C ATOM 382 O ASP A 26 -10.785 -1.801 -5.414 1.00 0.00 O ATOM 383 CB ASP A 26 -11.760 -4.961 -5.820 1.00 0.00 C ATOM 384 CG ASP A 26 -11.647 -6.120 -6.791 1.00 0.00 C ATOM 385 OD1 ASP A 26 -10.654 -6.165 -7.547 1.00 0.00 O ATOM 386 OD2 ASP A 26 -12.552 -6.980 -6.795 1.00 0.00 O ATOM 0 H ASP A 26 -9.675 -5.955 -4.957 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.143 -3.861 -6.708 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -12.034 -5.341 -4.836 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -12.564 -4.299 -6.141 1.00 0.00 H new ATOM 391 N VAL A 27 -10.780 -3.080 -3.562 1.00 0.00 N ATOM 392 CA VAL A 27 -10.999 -1.960 -2.655 1.00 0.00 C ATOM 393 C VAL A 27 -9.757 -1.083 -2.556 1.00 0.00 C ATOM 394 O VAL A 27 -9.814 0.123 -2.803 1.00 0.00 O ATOM 395 CB VAL A 27 -11.384 -2.447 -1.245 1.00 0.00 C ATOM 396 CG1 VAL A 27 -11.886 -1.287 -0.399 1.00 0.00 C ATOM 397 CG2 VAL A 27 -12.430 -3.549 -1.330 1.00 0.00 C ATOM 0 H VAL A 27 -10.704 -3.987 -3.101 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.822 -1.375 -3.067 1.00 0.00 H new ATOM 0 HB VAL A 27 -10.496 -2.857 -0.765 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -12.153 -1.650 0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -11.102 -0.535 -0.312 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -12.763 -0.844 -0.872 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.691 -3.882 -0.325 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -13.321 -3.167 -1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -12.029 -4.389 -1.897 1.00 0.00 H new ATOM 407 N ASP A 28 -8.634 -1.693 -2.194 1.00 0.00 N ATOM 408 CA ASP A 28 -7.376 -0.968 -2.063 1.00 0.00 C ATOM 409 C ASP A 28 -7.086 -0.154 -3.320 1.00 0.00 C ATOM 410 O ASP A 28 -6.486 0.920 -3.252 1.00 0.00 O ATOM 411 CB ASP A 28 -6.227 -1.941 -1.795 1.00 0.00 C ATOM 412 CG ASP A 28 -6.431 -2.739 -0.521 1.00 0.00 C ATOM 413 OD1 ASP A 28 -7.426 -2.482 0.187 1.00 0.00 O ATOM 414 OD2 ASP A 28 -5.596 -3.622 -0.235 1.00 0.00 O ATOM 0 H ASP A 28 -8.569 -2.689 -1.986 1.00 0.00 H new ATOM 0 HA ASP A 28 -7.466 -0.283 -1.220 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.130 -2.625 -2.638 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.292 -1.385 -1.727 1.00 0.00 H new ATOM 419 N SER A 29 -7.513 -0.672 -4.467 1.00 0.00 N ATOM 420 CA SER A 29 -7.294 0.004 -5.740 1.00 0.00 C ATOM 421 C SER A 29 -7.834 1.431 -5.697 1.00 0.00 C ATOM 422 O SER A 29 -7.112 2.388 -5.977 1.00 0.00 O ATOM 423 CB SER A 29 -7.963 -0.772 -6.876 1.00 0.00 C ATOM 424 OG SER A 29 -7.248 -1.958 -7.175 1.00 0.00 O ATOM 0 H SER A 29 -8.013 -1.558 -4.541 1.00 0.00 H new ATOM 0 HA SER A 29 -6.220 0.045 -5.921 1.00 0.00 H new ATOM 0 HB2 SER A 29 -8.986 -1.022 -6.596 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.020 -0.144 -7.765 1.00 0.00 H new ATOM 0 HG SER A 29 -7.657 -2.714 -6.705 1.00 0.00 H new ATOM 430 N HIS A 30 -9.108 1.564 -5.345 1.00 0.00 N ATOM 431 CA HIS A 30 -9.745 2.874 -5.263 1.00 0.00 C ATOM 432 C HIS A 30 -9.203 3.670 -4.081 1.00 0.00 C ATOM 433 O HIS A 30 -9.065 4.892 -4.154 1.00 0.00 O ATOM 434 CB HIS A 30 -11.261 2.719 -5.137 1.00 0.00 C ATOM 435 CG HIS A 30 -11.992 4.024 -5.045 1.00 0.00 C ATOM 436 ND1 HIS A 30 -12.859 4.471 -6.018 1.00 0.00 N ATOM 437 CD2 HIS A 30 -11.979 4.979 -4.086 1.00 0.00 C ATOM 438 CE1 HIS A 30 -13.348 5.646 -5.663 1.00 0.00 C ATOM 439 NE2 HIS A 30 -12.830 5.976 -4.494 1.00 0.00 N ATOM 0 H HIS A 30 -9.720 0.782 -5.112 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.517 3.419 -6.179 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -11.634 2.163 -5.997 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -11.485 2.124 -4.252 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -13.088 3.973 -6.878 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -11.406 4.960 -3.171 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -14.051 6.236 -6.232 1.00 0.00 H new ATOM 447 N LEU A 31 -8.898 2.971 -2.993 1.00 0.00 N ATOM 448 CA LEU A 31 -8.370 3.613 -1.794 1.00 0.00 C ATOM 449 C LEU A 31 -7.141 4.453 -2.123 1.00 0.00 C ATOM 450 O LEU A 31 -7.007 5.584 -1.657 1.00 0.00 O ATOM 451 CB LEU A 31 -8.018 2.561 -0.741 1.00 0.00 C ATOM 452 CG LEU A 31 -9.152 2.137 0.191 1.00 0.00 C ATOM 453 CD1 LEU A 31 -10.497 2.286 -0.503 1.00 0.00 C ATOM 454 CD2 LEU A 31 -8.949 0.704 0.662 1.00 0.00 C ATOM 0 H LEU A 31 -9.007 1.960 -2.916 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.141 4.272 -1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.645 1.674 -1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.199 2.945 -0.133 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.142 2.790 1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -11.293 1.979 0.176 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.645 3.327 -0.789 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.518 1.658 -1.394 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -9.766 0.420 1.325 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.932 0.037 -0.200 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.003 0.628 1.199 1.00 0.00 H new ATOM 466 N ALA A 32 -6.246 3.893 -2.929 1.00 0.00 N ATOM 467 CA ALA A 32 -5.028 4.592 -3.323 1.00 0.00 C ATOM 468 C ALA A 32 -5.351 5.829 -4.155 1.00 0.00 C ATOM 469 O ALA A 32 -4.651 6.838 -4.081 1.00 0.00 O ATOM 470 CB ALA A 32 -4.111 3.658 -4.096 1.00 0.00 C ATOM 0 H ALA A 32 -6.341 2.957 -3.323 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.516 4.918 -2.418 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.206 4.193 -4.384 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -3.846 2.807 -3.469 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.623 3.304 -4.991 1.00 0.00 H new ATOM 476 N GLN A 33 -6.414 5.742 -4.949 1.00 0.00 N ATOM 477 CA GLN A 33 -6.828 6.854 -5.796 1.00 0.00 C ATOM 478 C GLN A 33 -7.472 7.960 -4.967 1.00 0.00 C ATOM 479 O GLN A 33 -7.049 9.111 -5.067 1.00 0.00 O ATOM 480 CB GLN A 33 -7.805 6.370 -6.868 1.00 0.00 C ATOM 481 CG GLN A 33 -7.182 5.414 -7.872 1.00 0.00 C ATOM 482 CD GLN A 33 -8.219 4.679 -8.699 1.00 0.00 C ATOM 483 OE1 GLN A 33 -8.560 3.532 -8.411 1.00 0.00 O ATOM 484 NE2 GLN A 33 -8.725 5.337 -9.735 1.00 0.00 N ATOM 0 H GLN A 33 -7.004 4.913 -5.023 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.939 7.259 -6.280 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.648 5.877 -6.384 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -8.204 7.233 -7.400 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -6.521 5.971 -8.536 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -6.564 4.689 -7.342 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -8.413 6.287 -9.937 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -9.425 4.893 -10.329 1.00 0.00 H new ATOM 493 N CYS A 34 -8.468 7.593 -4.175 1.00 0.00 N ATOM 494 CA CYS A 34 -9.156 8.563 -3.340 1.00 0.00 C ATOM 495 C CYS A 34 -8.111 9.307 -2.506 1.00 0.00 C ATOM 496 O CYS A 34 -7.999 10.533 -2.541 1.00 0.00 O ATOM 497 CB CYS A 34 -10.219 7.899 -2.462 1.00 0.00 C ATOM 498 SG CYS A 34 -11.731 8.930 -2.422 1.00 0.00 S ATOM 0 H CYS A 34 -8.815 6.637 -4.094 1.00 0.00 H new ATOM 0 HA CYS A 34 -9.690 9.275 -3.970 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -10.455 6.908 -2.849 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -9.835 7.763 -1.451 1.00 0.00 H new ATOM 503 N LEU A 35 -7.341 8.532 -1.749 1.00 0.00 N ATOM 504 CA LEU A 35 -6.296 9.090 -0.897 1.00 0.00 C ATOM 505 C LEU A 35 -5.375 10.007 -1.695 1.00 0.00 C ATOM 506 O LEU A 35 -5.089 11.130 -1.281 1.00 0.00 O ATOM 507 CB LEU A 35 -5.484 7.967 -0.251 1.00 0.00 C ATOM 508 CG LEU A 35 -4.289 8.405 0.597 1.00 0.00 C ATOM 509 CD1 LEU A 35 -4.713 9.451 1.617 1.00 0.00 C ATOM 510 CD2 LEU A 35 -3.658 7.205 1.290 1.00 0.00 C ATOM 0 H LEU A 35 -7.421 7.516 -1.708 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.775 9.679 -0.115 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -6.152 7.377 0.376 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.122 7.307 -1.040 1.00 0.00 H new ATOM 0 HG LEU A 35 -3.544 8.851 -0.062 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -3.850 9.751 2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.117 10.321 1.099 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.477 9.032 2.272 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.809 7.535 1.889 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.395 6.729 1.937 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.317 6.490 0.541 1.00 0.00 H new ATOM 522 N ALA A 36 -4.913 9.519 -2.842 1.00 0.00 N ATOM 523 CA ALA A 36 -4.027 10.296 -3.700 1.00 0.00 C ATOM 524 C ALA A 36 -4.713 11.565 -4.192 1.00 0.00 C ATOM 525 O ALA A 36 -4.051 12.530 -4.574 1.00 0.00 O ATOM 526 CB ALA A 36 -3.563 9.453 -4.880 1.00 0.00 C ATOM 0 H ALA A 36 -5.138 8.590 -3.198 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.157 10.589 -3.112 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.902 10.045 -5.513 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.026 8.578 -4.513 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.428 9.131 -5.460 1.00 0.00 H new ATOM 532 N GLU A 37 -6.042 11.557 -4.180 1.00 0.00 N ATOM 533 CA GLU A 37 -6.816 12.709 -4.627 1.00 0.00 C ATOM 534 C GLU A 37 -7.293 13.538 -3.439 1.00 0.00 C ATOM 535 O GLU A 37 -7.927 14.580 -3.609 1.00 0.00 O ATOM 536 CB GLU A 37 -8.016 12.254 -5.460 1.00 0.00 C ATOM 537 CG GLU A 37 -7.647 11.794 -6.861 1.00 0.00 C ATOM 538 CD GLU A 37 -8.761 12.024 -7.864 1.00 0.00 C ATOM 539 OE1 GLU A 37 -9.031 13.199 -8.189 1.00 0.00 O ATOM 540 OE2 GLU A 37 -9.362 11.030 -8.321 1.00 0.00 O ATOM 0 H GLU A 37 -6.605 10.766 -3.866 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.169 13.331 -5.246 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.520 11.439 -4.940 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -8.729 13.075 -5.533 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.753 12.324 -7.189 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.398 10.733 -6.837 1.00 0.00 H new ATOM 547 N SER A 38 -6.985 13.067 -2.235 1.00 0.00 N ATOM 548 CA SER A 38 -7.386 13.762 -1.017 1.00 0.00 C ATOM 549 C SER A 38 -6.170 14.328 -0.289 1.00 0.00 C ATOM 550 O SER A 38 -5.047 13.856 -0.469 1.00 0.00 O ATOM 551 CB SER A 38 -8.151 12.813 -0.091 1.00 0.00 C ATOM 552 OG SER A 38 -9.101 13.518 0.689 1.00 0.00 O ATOM 0 H SER A 38 -6.459 12.207 -2.077 1.00 0.00 H new ATOM 0 HA SER A 38 -8.038 14.589 -1.298 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.656 12.050 -0.684 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.450 12.295 0.564 1.00 0.00 H new ATOM 0 HG SER A 38 -9.578 12.890 1.271 1.00 0.00 H new ATOM 558 N THR A 39 -6.403 15.346 0.534 1.00 0.00 N ATOM 559 CA THR A 39 -5.328 15.979 1.288 1.00 0.00 C ATOM 560 C THR A 39 -5.411 15.624 2.768 1.00 0.00 C ATOM 561 O THR A 39 -4.634 16.125 3.580 1.00 0.00 O ATOM 562 CB THR A 39 -5.364 17.512 1.137 1.00 0.00 C ATOM 563 OG1 THR A 39 -6.544 18.037 1.753 1.00 0.00 O ATOM 564 CG2 THR A 39 -5.329 17.913 -0.330 1.00 0.00 C ATOM 0 H THR A 39 -7.326 15.749 0.695 1.00 0.00 H new ATOM 0 HA THR A 39 -4.391 15.602 0.879 1.00 0.00 H new ATOM 0 HB THR A 39 -4.484 17.924 1.630 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.559 19.012 1.654 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.355 19.000 -0.411 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.414 17.537 -0.788 1.00 0.00 H new ATOM 0 HG23 THR A 39 -6.192 17.490 -0.844 1.00 0.00 H new ATOM 572 N GLU A 40 -6.358 14.756 3.111 1.00 0.00 N ATOM 573 CA GLU A 40 -6.541 14.334 4.495 1.00 0.00 C ATOM 574 C GLU A 40 -6.133 12.875 4.678 1.00 0.00 C ATOM 575 O GLU A 40 -6.861 11.962 4.289 1.00 0.00 O ATOM 576 CB GLU A 40 -7.998 14.524 4.920 1.00 0.00 C ATOM 577 CG GLU A 40 -8.404 15.980 5.071 1.00 0.00 C ATOM 578 CD GLU A 40 -9.897 16.190 4.917 1.00 0.00 C ATOM 579 OE1 GLU A 40 -10.659 15.234 5.176 1.00 0.00 O ATOM 580 OE2 GLU A 40 -10.305 17.307 4.538 1.00 0.00 O ATOM 0 H GLU A 40 -7.009 14.332 2.451 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.902 14.953 5.124 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.647 14.049 4.184 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.161 14.010 5.867 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.090 16.341 6.050 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.878 16.579 4.327 1.00 0.00 H new ATOM 587 N ASP A 41 -4.964 12.664 5.271 1.00 0.00 N ATOM 588 CA ASP A 41 -4.457 11.316 5.506 1.00 0.00 C ATOM 589 C ASP A 41 -5.110 10.699 6.738 1.00 0.00 C ATOM 590 O ASP A 41 -4.436 10.392 7.722 1.00 0.00 O ATOM 591 CB ASP A 41 -2.937 11.343 5.677 1.00 0.00 C ATOM 592 CG ASP A 41 -2.210 11.569 4.367 1.00 0.00 C ATOM 593 OD1 ASP A 41 -2.271 10.679 3.493 1.00 0.00 O ATOM 594 OD2 ASP A 41 -1.580 12.636 4.214 1.00 0.00 O ATOM 0 H ASP A 41 -4.349 13.409 5.598 1.00 0.00 H new ATOM 0 HA ASP A 41 -4.706 10.703 4.640 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.668 12.132 6.379 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.607 10.401 6.114 1.00 0.00 H new ATOM 599 N VAL A 42 -6.425 10.518 6.677 1.00 0.00 N ATOM 600 CA VAL A 42 -7.170 9.937 7.787 1.00 0.00 C ATOM 601 C VAL A 42 -6.999 8.422 7.830 1.00 0.00 C ATOM 602 O VAL A 42 -6.897 7.768 6.792 1.00 0.00 O ATOM 603 CB VAL A 42 -8.671 10.271 7.693 1.00 0.00 C ATOM 604 CG1 VAL A 42 -9.242 9.792 6.367 1.00 0.00 C ATOM 605 CG2 VAL A 42 -9.426 9.657 8.861 1.00 0.00 C ATOM 0 H VAL A 42 -6.997 10.766 5.870 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.766 10.372 8.701 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.789 11.353 7.742 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.303 10.036 6.318 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.718 10.283 5.547 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.114 8.713 6.284 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.485 9.903 8.779 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.302 8.574 8.845 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.033 10.053 9.797 1.00 0.00 H new ATOM 615 N THR A 43 -6.970 7.869 9.037 1.00 0.00 N ATOM 616 CA THR A 43 -6.811 6.431 9.217 1.00 0.00 C ATOM 617 C THR A 43 -8.152 5.759 9.484 1.00 0.00 C ATOM 618 O THR A 43 -8.754 5.952 10.540 1.00 0.00 O ATOM 619 CB THR A 43 -5.850 6.112 10.377 1.00 0.00 C ATOM 620 OG1 THR A 43 -4.609 6.801 10.189 1.00 0.00 O ATOM 621 CG2 THR A 43 -5.595 4.616 10.473 1.00 0.00 C ATOM 0 H THR A 43 -7.055 8.395 9.907 1.00 0.00 H new ATOM 0 HA THR A 43 -6.391 6.042 8.290 1.00 0.00 H new ATOM 0 HB THR A 43 -6.314 6.446 11.305 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.004 6.594 10.932 1.00 0.00 H new ATOM 0 HG21 THR A 43 -4.913 4.415 11.300 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.538 4.097 10.646 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.151 4.262 9.543 1.00 0.00 H new ATOM 629 N TRP A 44 -8.615 4.969 8.522 1.00 0.00 N ATOM 630 CA TRP A 44 -9.887 4.268 8.655 1.00 0.00 C ATOM 631 C TRP A 44 -9.665 2.776 8.878 1.00 0.00 C ATOM 632 O TRP A 44 -8.658 2.242 8.415 1.00 0.00 O ATOM 633 CB TRP A 44 -10.747 4.486 7.409 1.00 0.00 C ATOM 634 CG TRP A 44 -10.153 3.894 6.166 1.00 0.00 C ATOM 635 CD1 TRP A 44 -10.448 2.680 5.615 1.00 0.00 C ATOM 636 CD2 TRP A 44 -9.162 4.490 5.322 1.00 0.00 C ATOM 637 NE1 TRP A 44 -9.701 2.485 4.479 1.00 0.00 N ATOM 638 CE2 TRP A 44 -8.905 3.581 4.277 1.00 0.00 C ATOM 639 CE3 TRP A 44 -8.469 5.703 5.346 1.00 0.00 C ATOM 640 CZ2 TRP A 44 -7.982 3.848 3.269 1.00 0.00 C ATOM 641 CZ3 TRP A 44 -7.555 5.967 4.344 1.00 0.00 C ATOM 642 CH2 TRP A 44 -7.318 5.044 3.317 1.00 0.00 C ATOM 0 H TRP A 44 -8.129 4.798 7.642 1.00 0.00 H new ATOM 0 HA TRP A 44 -10.407 4.674 9.523 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -11.732 4.050 7.575 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -10.893 5.556 7.260 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -11.164 1.976 6.014 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -9.734 1.658 3.883 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -8.645 6.421 6.133 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -7.797 3.137 2.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -7.014 6.901 4.353 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -6.597 5.281 2.548 1.00 0.00 H new TER 653 TRP A 44 ATOM 654 N SER B 99 16.628 -13.161 2.279 1.00 0.00 N ATOM 655 CA SER B 99 16.459 -14.145 3.342 1.00 0.00 C ATOM 656 C SER B 99 15.326 -13.742 4.281 1.00 0.00 C ATOM 657 O SER B 99 15.340 -14.072 5.467 1.00 0.00 O ATOM 658 CB SER B 99 17.760 -14.302 4.131 1.00 0.00 C ATOM 659 OG SER B 99 18.671 -15.147 3.450 1.00 0.00 O ATOM 0 HA SER B 99 16.203 -15.100 2.883 1.00 0.00 H new ATOM 0 HB2 SER B 99 18.214 -13.324 4.288 1.00 0.00 H new ATOM 0 HB3 SER B 99 17.544 -14.714 5.116 1.00 0.00 H new ATOM 0 HG SER B 99 19.495 -15.230 3.974 1.00 0.00 H new ATOM 665 N HIS B 100 14.345 -13.025 3.741 1.00 0.00 N ATOM 666 CA HIS B 100 13.203 -12.577 4.529 1.00 0.00 C ATOM 667 C HIS B 100 11.897 -12.818 3.780 1.00 0.00 C ATOM 668 O HIS B 100 11.199 -13.801 4.027 1.00 0.00 O ATOM 669 CB HIS B 100 13.343 -11.092 4.870 1.00 0.00 C ATOM 670 CG HIS B 100 14.334 -10.372 4.009 1.00 0.00 C ATOM 671 ND1 HIS B 100 14.170 -9.693 2.849 1.00 0.00 N flip ATOM 672 CD2 HIS B 100 15.677 -10.296 4.308 1.00 0.00 C flip ATOM 673 CE1 HIS B 100 15.404 -9.223 2.474 1.00 0.00 C flip ATOM 674 NE2 HIS B 100 16.297 -9.600 3.372 1.00 0.00 N flip ATOM 0 H HIS B 100 14.318 -12.742 2.761 1.00 0.00 H new ATOM 0 HA HIS B 100 13.182 -13.154 5.453 1.00 0.00 H new ATOM 0 HB2 HIS B 100 12.370 -10.611 4.770 1.00 0.00 H new ATOM 0 HB3 HIS B 100 13.641 -10.994 5.914 1.00 0.00 H new ATOM 0 HD2 HIS B 100 16.149 -10.737 5.173 1.00 0.00 H new ATOM 0 HE1 HIS B 100 15.611 -8.640 1.589 1.00 0.00 H new ATOM 0 HE2 HIS B 100 17.295 -9.390 3.347 1.00 0.00 H new ATOM 682 N MET B 101 11.572 -11.913 2.862 1.00 0.00 N ATOM 683 CA MET B 101 10.348 -12.028 2.075 1.00 0.00 C ATOM 684 C MET B 101 10.312 -10.977 0.971 1.00 0.00 C ATOM 685 O MET B 101 10.956 -9.933 1.074 1.00 0.00 O ATOM 686 CB MET B 101 9.121 -11.880 2.977 1.00 0.00 C ATOM 687 CG MET B 101 8.723 -10.434 3.229 1.00 0.00 C ATOM 688 SD MET B 101 8.181 -10.149 4.925 1.00 0.00 S ATOM 689 CE MET B 101 6.995 -8.830 4.685 1.00 0.00 C ATOM 0 H MET B 101 12.138 -11.093 2.645 1.00 0.00 H new ATOM 0 HA MET B 101 10.333 -13.015 1.613 1.00 0.00 H new ATOM 0 HB2 MET B 101 8.281 -12.406 2.523 1.00 0.00 H new ATOM 0 HB3 MET B 101 9.322 -12.365 3.932 1.00 0.00 H new ATOM 0 HG2 MET B 101 9.570 -9.784 3.008 1.00 0.00 H new ATOM 0 HG3 MET B 101 7.922 -10.157 2.544 1.00 0.00 H new ATOM 0 HE1 MET B 101 6.175 -8.944 5.394 1.00 0.00 H new ATOM 0 HE2 MET B 101 7.483 -7.869 4.846 1.00 0.00 H new ATOM 0 HE3 MET B 101 6.604 -8.873 3.668 1.00 0.00 H new ATOM 699 N GLN B 102 9.555 -11.261 -0.085 1.00 0.00 N ATOM 700 CA GLN B 102 9.436 -10.339 -1.208 1.00 0.00 C ATOM 701 C GLN B 102 8.051 -9.703 -1.248 1.00 0.00 C ATOM 702 O GLN B 102 7.060 -10.327 -0.866 1.00 0.00 O ATOM 703 CB GLN B 102 9.713 -11.068 -2.525 1.00 0.00 C ATOM 704 CG GLN B 102 10.305 -10.175 -3.603 1.00 0.00 C ATOM 705 CD GLN B 102 11.269 -10.914 -4.510 1.00 0.00 C ATOM 706 OE1 GLN B 102 12.341 -11.339 -4.079 1.00 0.00 O ATOM 707 NE2 GLN B 102 10.891 -11.073 -5.773 1.00 0.00 N ATOM 0 H GLN B 102 9.016 -12.121 -0.186 1.00 0.00 H new ATOM 0 HA GLN B 102 10.174 -9.548 -1.075 1.00 0.00 H new ATOM 0 HB2 GLN B 102 10.396 -11.896 -2.335 1.00 0.00 H new ATOM 0 HB3 GLN B 102 8.783 -11.500 -2.894 1.00 0.00 H new ATOM 0 HG2 GLN B 102 9.499 -9.753 -4.203 1.00 0.00 H new ATOM 0 HG3 GLN B 102 10.823 -9.339 -3.133 1.00 0.00 H new ATOM 0 HE21 GLN B 102 9.993 -10.704 -6.087 1.00 0.00 H new ATOM 0 HE22 GLN B 102 11.498 -11.564 -6.429 1.00 0.00 H new ATOM 716 N ILE B 103 7.989 -8.459 -1.710 1.00 0.00 N ATOM 717 CA ILE B 103 6.724 -7.740 -1.799 1.00 0.00 C ATOM 718 C ILE B 103 6.644 -6.927 -3.087 1.00 0.00 C ATOM 719 O ILE B 103 7.666 -6.552 -3.661 1.00 0.00 O ATOM 720 CB ILE B 103 6.527 -6.798 -0.597 1.00 0.00 C ATOM 721 CG1 ILE B 103 7.671 -5.784 -0.522 1.00 0.00 C ATOM 722 CG2 ILE B 103 6.436 -7.598 0.694 1.00 0.00 C ATOM 723 CD1 ILE B 103 7.434 -4.678 0.482 1.00 0.00 C ATOM 0 H ILE B 103 8.800 -7.928 -2.028 1.00 0.00 H new ATOM 0 HA ILE B 103 5.933 -8.490 -1.796 1.00 0.00 H new ATOM 0 HB ILE B 103 5.592 -6.254 -0.731 1.00 0.00 H new ATOM 0 HG12 ILE B 103 8.592 -6.306 -0.264 1.00 0.00 H new ATOM 0 HG13 ILE B 103 7.820 -5.343 -1.508 1.00 0.00 H new ATOM 0 HG21 ILE B 103 6.297 -6.918 1.534 1.00 0.00 H new ATOM 0 HG22 ILE B 103 5.591 -8.284 0.638 1.00 0.00 H new ATOM 0 HG23 ILE B 103 7.355 -8.166 0.835 1.00 0.00 H new ATOM 0 HD11 ILE B 103 8.285 -3.997 0.481 1.00 0.00 H new ATOM 0 HD12 ILE B 103 6.531 -4.130 0.213 1.00 0.00 H new ATOM 0 HD13 ILE B 103 7.315 -5.109 1.476 1.00 0.00 H new ATOM 735 N PHE B 104 5.421 -6.656 -3.533 1.00 0.00 N ATOM 736 CA PHE B 104 5.207 -5.886 -4.752 1.00 0.00 C ATOM 737 C PHE B 104 4.407 -4.619 -4.462 1.00 0.00 C ATOM 738 O PHE B 104 3.480 -4.629 -3.653 1.00 0.00 O ATOM 739 CB PHE B 104 4.478 -6.736 -5.796 1.00 0.00 C ATOM 740 CG PHE B 104 5.204 -8.001 -6.153 1.00 0.00 C ATOM 741 CD1 PHE B 104 5.088 -9.130 -5.357 1.00 0.00 C ATOM 742 CD2 PHE B 104 6.001 -8.062 -7.284 1.00 0.00 C ATOM 743 CE1 PHE B 104 5.756 -10.295 -5.684 1.00 0.00 C ATOM 744 CE2 PHE B 104 6.671 -9.224 -7.616 1.00 0.00 C ATOM 745 CZ PHE B 104 6.548 -10.343 -6.814 1.00 0.00 C ATOM 0 H PHE B 104 4.565 -6.958 -3.069 1.00 0.00 H new ATOM 0 HA PHE B 104 6.182 -5.597 -5.145 1.00 0.00 H new ATOM 0 HB2 PHE B 104 3.487 -6.989 -5.419 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.333 -6.143 -6.699 1.00 0.00 H new ATOM 0 HD1 PHE B 104 4.469 -9.099 -4.472 1.00 0.00 H new ATOM 0 HD2 PHE B 104 6.100 -7.191 -7.914 1.00 0.00 H new ATOM 0 HE1 PHE B 104 5.658 -11.168 -5.056 1.00 0.00 H new ATOM 0 HE2 PHE B 104 7.290 -9.258 -8.501 1.00 0.00 H new ATOM 0 HZ PHE B 104 7.070 -11.253 -7.071 1.00 0.00 H new ATOM 755 N VAL B 105 4.774 -3.530 -5.130 1.00 0.00 N ATOM 756 CA VAL B 105 4.092 -2.254 -4.944 1.00 0.00 C ATOM 757 C VAL B 105 3.677 -1.654 -6.283 1.00 0.00 C ATOM 758 O VAL B 105 4.500 -1.480 -7.181 1.00 0.00 O ATOM 759 CB VAL B 105 4.983 -1.245 -4.196 1.00 0.00 C ATOM 760 CG1 VAL B 105 4.210 0.031 -3.899 1.00 0.00 C ATOM 761 CG2 VAL B 105 5.526 -1.860 -2.915 1.00 0.00 C ATOM 0 H VAL B 105 5.539 -3.505 -5.804 1.00 0.00 H new ATOM 0 HA VAL B 105 3.203 -2.454 -4.347 1.00 0.00 H new ATOM 0 HB VAL B 105 5.828 -0.989 -4.835 1.00 0.00 H new ATOM 0 HG11 VAL B 105 4.855 0.733 -3.370 1.00 0.00 H new ATOM 0 HG12 VAL B 105 3.876 0.480 -4.834 1.00 0.00 H new ATOM 0 HG13 VAL B 105 3.344 -0.204 -3.279 1.00 0.00 H new ATOM 0 HG21 VAL B 105 6.153 -1.133 -2.400 1.00 0.00 H new ATOM 0 HG22 VAL B 105 4.696 -2.146 -2.269 1.00 0.00 H new ATOM 0 HG23 VAL B 105 6.118 -2.743 -3.158 1.00 0.00 H new ATOM 771 N LYS B 106 2.391 -1.340 -6.410 1.00 0.00 N ATOM 772 CA LYS B 106 1.865 -0.757 -7.638 1.00 0.00 C ATOM 773 C LYS B 106 1.725 0.757 -7.506 1.00 0.00 C ATOM 774 O LYS B 106 1.571 1.283 -6.403 1.00 0.00 O ATOM 775 CB LYS B 106 0.507 -1.377 -7.980 1.00 0.00 C ATOM 776 CG LYS B 106 0.236 -1.462 -9.471 1.00 0.00 C ATOM 777 CD LYS B 106 -1.239 -1.266 -9.782 1.00 0.00 C ATOM 778 CE LYS B 106 -1.989 -2.590 -9.778 1.00 0.00 C ATOM 779 NZ LYS B 106 -1.902 -3.273 -8.458 1.00 0.00 N ATOM 0 H LYS B 106 1.695 -1.480 -5.677 1.00 0.00 H new ATOM 0 HA LYS B 106 2.569 -0.970 -8.442 1.00 0.00 H new ATOM 0 HB2 LYS B 106 0.456 -2.378 -7.552 1.00 0.00 H new ATOM 0 HB3 LYS B 106 -0.281 -0.789 -7.509 1.00 0.00 H new ATOM 0 HG2 LYS B 106 0.822 -0.705 -9.992 1.00 0.00 H new ATOM 0 HG3 LYS B 106 0.562 -2.432 -9.846 1.00 0.00 H new ATOM 0 HD2 LYS B 106 -1.681 -0.594 -9.047 1.00 0.00 H new ATOM 0 HD3 LYS B 106 -1.347 -0.788 -10.756 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -3.035 -2.415 -10.028 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -1.581 -3.241 -10.551 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 -2.681 -3.956 -8.369 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 -0.993 -3.773 -8.385 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 -1.971 -2.568 -7.697 1.00 0.00 H new ATOM 793 N THR B 107 1.777 1.453 -8.638 1.00 0.00 N ATOM 794 CA THR B 107 1.657 2.905 -8.648 1.00 0.00 C ATOM 795 C THR B 107 0.350 3.343 -9.299 1.00 0.00 C ATOM 796 O THR B 107 -0.407 2.518 -9.813 1.00 0.00 O ATOM 797 CB THR B 107 2.833 3.561 -9.394 1.00 0.00 C ATOM 798 OG1 THR B 107 2.962 2.993 -10.703 1.00 0.00 O ATOM 799 CG2 THR B 107 4.132 3.375 -8.625 1.00 0.00 C ATOM 0 H THR B 107 1.901 1.034 -9.559 1.00 0.00 H new ATOM 0 HA THR B 107 1.670 3.230 -7.608 1.00 0.00 H new ATOM 0 HB THR B 107 2.629 4.628 -9.480 1.00 0.00 H new ATOM 0 HG1 THR B 107 2.823 3.690 -11.377 1.00 0.00 H new ATOM 0 HG21 THR B 107 4.949 3.847 -9.171 1.00 0.00 H new ATOM 0 HG22 THR B 107 4.041 3.834 -7.641 1.00 0.00 H new ATOM 0 HG23 THR B 107 4.338 2.311 -8.511 1.00 0.00 H new ATOM 807 N LEU B 108 0.089 4.646 -9.275 1.00 0.00 N ATOM 808 CA LEU B 108 -1.128 5.194 -9.864 1.00 0.00 C ATOM 809 C LEU B 108 -1.070 5.133 -11.387 1.00 0.00 C ATOM 810 O LEU B 108 -2.081 5.320 -12.066 1.00 0.00 O ATOM 811 CB LEU B 108 -1.332 6.639 -9.407 1.00 0.00 C ATOM 812 CG LEU B 108 -2.129 6.830 -8.117 1.00 0.00 C ATOM 813 CD1 LEU B 108 -2.203 8.303 -7.746 1.00 0.00 C ATOM 814 CD2 LEU B 108 -3.526 6.244 -8.262 1.00 0.00 C ATOM 0 H LEU B 108 0.704 5.342 -8.854 1.00 0.00 H new ATOM 0 HA LEU B 108 -1.971 4.590 -9.527 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -0.353 7.099 -9.276 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -1.836 7.183 -10.206 1.00 0.00 H new ATOM 0 HG LEU B 108 -1.615 6.301 -7.314 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -2.774 8.418 -6.825 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -1.196 8.692 -7.599 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -2.692 8.856 -8.548 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -4.079 6.389 -7.334 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -4.048 6.745 -9.078 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -3.453 5.178 -8.478 1.00 0.00 H new ATOM 826 N THR B 109 0.118 4.867 -11.920 1.00 0.00 N ATOM 827 CA THR B 109 0.307 4.780 -13.362 1.00 0.00 C ATOM 828 C THR B 109 0.098 3.355 -13.859 1.00 0.00 C ATOM 829 O THR B 109 -0.015 3.116 -15.061 1.00 0.00 O ATOM 830 CB THR B 109 1.715 5.254 -13.774 1.00 0.00 C ATOM 831 OG1 THR B 109 2.704 4.357 -13.255 1.00 0.00 O ATOM 832 CG2 THR B 109 1.982 6.662 -13.264 1.00 0.00 C ATOM 0 H THR B 109 0.965 4.708 -11.374 1.00 0.00 H new ATOM 0 HA THR B 109 -0.437 5.434 -13.818 1.00 0.00 H new ATOM 0 HB THR B 109 1.768 5.263 -14.863 1.00 0.00 H new ATOM 0 HG1 THR B 109 3.596 4.663 -13.522 1.00 0.00 H new ATOM 0 HG21 THR B 109 2.981 6.975 -13.567 1.00 0.00 H new ATOM 0 HG22 THR B 109 1.245 7.347 -13.683 1.00 0.00 H new ATOM 0 HG23 THR B 109 1.912 6.674 -12.176 1.00 0.00 H new ATOM 840 N GLY B 110 0.047 2.409 -12.926 1.00 0.00 N ATOM 841 CA GLY B 110 -0.150 1.018 -13.289 1.00 0.00 C ATOM 842 C GLY B 110 1.135 0.216 -13.232 1.00 0.00 C ATOM 843 O GLY B 110 1.109 -1.015 -13.238 1.00 0.00 O ATOM 0 H GLY B 110 0.139 2.581 -11.925 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -0.884 0.571 -12.618 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -0.564 0.964 -14.296 1.00 0.00 H new ATOM 847 N LYS B 111 2.264 0.914 -13.178 1.00 0.00 N ATOM 848 CA LYS B 111 3.566 0.261 -13.121 1.00 0.00 C ATOM 849 C LYS B 111 3.605 -0.776 -12.002 1.00 0.00 C ATOM 850 O LYS B 111 2.858 -0.683 -11.028 1.00 0.00 O ATOM 851 CB LYS B 111 4.671 1.298 -12.908 1.00 0.00 C ATOM 852 CG LYS B 111 6.015 0.882 -13.482 1.00 0.00 C ATOM 853 CD LYS B 111 7.129 1.803 -13.015 1.00 0.00 C ATOM 854 CE LYS B 111 6.926 3.224 -13.516 1.00 0.00 C ATOM 855 NZ LYS B 111 8.217 3.958 -13.639 1.00 0.00 N ATOM 0 H LYS B 111 2.303 1.933 -13.173 1.00 0.00 H new ATOM 0 HA LYS B 111 3.732 -0.247 -14.071 1.00 0.00 H new ATOM 0 HB2 LYS B 111 4.366 2.240 -13.364 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.783 1.483 -11.840 1.00 0.00 H new ATOM 0 HG2 LYS B 111 6.238 -0.142 -13.182 1.00 0.00 H new ATOM 0 HG3 LYS B 111 5.966 0.892 -14.571 1.00 0.00 H new ATOM 0 HD2 LYS B 111 7.170 1.803 -11.926 1.00 0.00 H new ATOM 0 HD3 LYS B 111 8.088 1.425 -13.370 1.00 0.00 H new ATOM 0 HE2 LYS B 111 6.428 3.200 -14.485 1.00 0.00 H new ATOM 0 HE3 LYS B 111 6.267 3.760 -12.832 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 8.036 4.923 -13.983 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 8.681 4.003 -12.709 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 8.836 3.461 -14.311 1.00 0.00 H new ATOM 869 N THR B 112 4.484 -1.764 -12.148 1.00 0.00 N ATOM 870 CA THR B 112 4.621 -2.818 -11.150 1.00 0.00 C ATOM 871 C THR B 112 6.024 -2.831 -10.555 1.00 0.00 C ATOM 872 O THR B 112 6.983 -3.236 -11.213 1.00 0.00 O ATOM 873 CB THR B 112 4.316 -4.202 -11.752 1.00 0.00 C ATOM 874 OG1 THR B 112 3.016 -4.202 -12.350 1.00 0.00 O ATOM 875 CG2 THR B 112 4.388 -5.284 -10.683 1.00 0.00 C ATOM 0 H THR B 112 5.111 -1.856 -12.947 1.00 0.00 H new ATOM 0 HA THR B 112 3.898 -2.606 -10.362 1.00 0.00 H new ATOM 0 HB THR B 112 5.065 -4.415 -12.515 1.00 0.00 H new ATOM 0 HG1 THR B 112 2.831 -5.086 -12.732 1.00 0.00 H new ATOM 0 HG21 THR B 112 4.169 -6.253 -11.131 1.00 0.00 H new ATOM 0 HG22 THR B 112 5.388 -5.302 -10.250 1.00 0.00 H new ATOM 0 HG23 THR B 112 3.658 -5.072 -9.901 1.00 0.00 H new ATOM 883 N ILE B 113 6.136 -2.389 -9.307 1.00 0.00 N ATOM 884 CA ILE B 113 7.423 -2.353 -8.624 1.00 0.00 C ATOM 885 C ILE B 113 7.611 -3.581 -7.740 1.00 0.00 C ATOM 886 O ILE B 113 6.667 -4.053 -7.104 1.00 0.00 O ATOM 887 CB ILE B 113 7.566 -1.086 -7.759 1.00 0.00 C ATOM 888 CG1 ILE B 113 7.351 0.166 -8.611 1.00 0.00 C ATOM 889 CG2 ILE B 113 8.931 -1.051 -7.091 1.00 0.00 C ATOM 890 CD1 ILE B 113 7.181 1.430 -7.796 1.00 0.00 C ATOM 0 H ILE B 113 5.352 -2.051 -8.749 1.00 0.00 H new ATOM 0 HA ILE B 113 8.190 -2.344 -9.398 1.00 0.00 H new ATOM 0 HB ILE B 113 6.804 -1.108 -6.980 1.00 0.00 H new ATOM 0 HG12 ILE B 113 8.200 0.288 -9.283 1.00 0.00 H new ATOM 0 HG13 ILE B 113 6.468 0.024 -9.235 1.00 0.00 H new ATOM 0 HG21 ILE B 113 9.016 -0.150 -6.484 1.00 0.00 H new ATOM 0 HG22 ILE B 113 9.048 -1.929 -6.456 1.00 0.00 H new ATOM 0 HG23 ILE B 113 9.709 -1.049 -7.854 1.00 0.00 H new ATOM 0 HD11 ILE B 113 7.033 2.277 -8.465 1.00 0.00 H new ATOM 0 HD12 ILE B 113 6.314 1.328 -7.143 1.00 0.00 H new ATOM 0 HD13 ILE B 113 8.073 1.596 -7.192 1.00 0.00 H new ATOM 902 N THR B 114 8.835 -4.095 -7.702 1.00 0.00 N ATOM 903 CA THR B 114 9.148 -5.268 -6.896 1.00 0.00 C ATOM 904 C THR B 114 10.368 -5.021 -6.015 1.00 0.00 C ATOM 905 O THR B 114 11.401 -4.547 -6.488 1.00 0.00 O ATOM 906 CB THR B 114 9.409 -6.503 -7.779 1.00 0.00 C ATOM 907 OG1 THR B 114 8.380 -6.623 -8.768 1.00 0.00 O ATOM 908 CG2 THR B 114 9.460 -7.769 -6.937 1.00 0.00 C ATOM 0 H THR B 114 9.628 -3.717 -8.221 1.00 0.00 H new ATOM 0 HA THR B 114 8.280 -5.458 -6.265 1.00 0.00 H new ATOM 0 HB THR B 114 10.373 -6.374 -8.271 1.00 0.00 H new ATOM 0 HG1 THR B 114 7.705 -7.264 -8.462 1.00 0.00 H new ATOM 0 HG21 THR B 114 9.645 -8.628 -7.582 1.00 0.00 H new ATOM 0 HG22 THR B 114 10.262 -7.686 -6.204 1.00 0.00 H new ATOM 0 HG23 THR B 114 8.509 -7.901 -6.421 1.00 0.00 H new ATOM 916 N LEU B 115 10.241 -5.347 -4.733 1.00 0.00 N ATOM 917 CA LEU B 115 11.334 -5.161 -3.785 1.00 0.00 C ATOM 918 C LEU B 115 11.269 -6.198 -2.669 1.00 0.00 C ATOM 919 O LEU B 115 10.288 -6.931 -2.547 1.00 0.00 O ATOM 920 CB LEU B 115 11.285 -3.752 -3.190 1.00 0.00 C ATOM 921 CG LEU B 115 11.961 -2.653 -4.012 1.00 0.00 C ATOM 922 CD1 LEU B 115 11.586 -1.280 -3.476 1.00 0.00 C ATOM 923 CD2 LEU B 115 13.471 -2.835 -4.005 1.00 0.00 C ATOM 0 H LEU B 115 9.393 -5.741 -4.327 1.00 0.00 H new ATOM 0 HA LEU B 115 12.274 -5.290 -4.322 1.00 0.00 H new ATOM 0 HB2 LEU B 115 10.240 -3.477 -3.043 1.00 0.00 H new ATOM 0 HB3 LEU B 115 11.750 -3.779 -2.204 1.00 0.00 H new ATOM 0 HG LEU B 115 11.611 -2.728 -5.041 1.00 0.00 H new ATOM 0 HD11 LEU B 115 12.076 -0.510 -4.073 1.00 0.00 H new ATOM 0 HD12 LEU B 115 10.505 -1.150 -3.533 1.00 0.00 H new ATOM 0 HD13 LEU B 115 11.908 -1.194 -2.438 1.00 0.00 H new ATOM 0 HD21 LEU B 115 13.935 -2.045 -4.595 1.00 0.00 H new ATOM 0 HD22 LEU B 115 13.839 -2.787 -2.980 1.00 0.00 H new ATOM 0 HD23 LEU B 115 13.723 -3.804 -4.436 1.00 0.00 H new ATOM 935 N GLU B 116 12.321 -6.253 -1.857 1.00 0.00 N ATOM 936 CA GLU B 116 12.382 -7.200 -0.751 1.00 0.00 C ATOM 937 C GLU B 116 12.265 -6.480 0.589 1.00 0.00 C ATOM 938 O GLU B 116 12.697 -5.335 0.732 1.00 0.00 O ATOM 939 CB GLU B 116 13.687 -7.996 -0.802 1.00 0.00 C ATOM 940 CG GLU B 116 13.680 -9.110 -1.834 1.00 0.00 C ATOM 941 CD GLU B 116 14.060 -8.626 -3.220 1.00 0.00 C ATOM 942 OE1 GLU B 116 13.217 -7.979 -3.875 1.00 0.00 O ATOM 943 OE2 GLU B 116 15.203 -8.894 -3.649 1.00 0.00 O ATOM 0 H GLU B 116 13.141 -5.653 -1.945 1.00 0.00 H new ATOM 0 HA GLU B 116 11.542 -7.888 -0.849 1.00 0.00 H new ATOM 0 HB2 GLU B 116 14.510 -7.315 -1.020 1.00 0.00 H new ATOM 0 HB3 GLU B 116 13.880 -8.424 0.181 1.00 0.00 H new ATOM 0 HG2 GLU B 116 14.374 -9.892 -1.524 1.00 0.00 H new ATOM 0 HG3 GLU B 116 12.688 -9.560 -1.870 1.00 0.00 H new ATOM 950 N VAL B 117 11.677 -7.158 1.570 1.00 0.00 N ATOM 951 CA VAL B 117 11.504 -6.584 2.899 1.00 0.00 C ATOM 952 C VAL B 117 11.553 -7.664 3.975 1.00 0.00 C ATOM 953 O VAL B 117 11.522 -8.856 3.672 1.00 0.00 O ATOM 954 CB VAL B 117 10.170 -5.823 3.013 1.00 0.00 C ATOM 955 CG1 VAL B 117 10.180 -4.591 2.119 1.00 0.00 C ATOM 956 CG2 VAL B 117 9.005 -6.736 2.662 1.00 0.00 C ATOM 0 H VAL B 117 11.313 -8.105 1.469 1.00 0.00 H new ATOM 0 HA VAL B 117 12.327 -5.885 3.051 1.00 0.00 H new ATOM 0 HB VAL B 117 10.046 -5.493 4.045 1.00 0.00 H new ATOM 0 HG11 VAL B 117 9.229 -4.066 2.213 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.992 -3.929 2.421 1.00 0.00 H new ATOM 0 HG13 VAL B 117 10.326 -4.895 1.082 1.00 0.00 H new ATOM 0 HG21 VAL B 117 8.070 -6.182 2.748 1.00 0.00 H new ATOM 0 HG22 VAL B 117 9.121 -7.097 1.640 1.00 0.00 H new ATOM 0 HG23 VAL B 117 8.988 -7.584 3.346 1.00 0.00 H new ATOM 966 N GLU B 118 11.629 -7.236 5.232 1.00 0.00 N ATOM 967 CA GLU B 118 11.683 -8.168 6.352 1.00 0.00 C ATOM 968 C GLU B 118 10.418 -8.071 7.200 1.00 0.00 C ATOM 969 O GLU B 118 9.711 -7.064 7.194 1.00 0.00 O ATOM 970 CB GLU B 118 12.913 -7.889 7.218 1.00 0.00 C ATOM 971 CG GLU B 118 14.214 -8.379 6.604 1.00 0.00 C ATOM 972 CD GLU B 118 15.416 -7.574 7.061 1.00 0.00 C ATOM 973 OE1 GLU B 118 15.333 -6.328 7.049 1.00 0.00 O ATOM 974 OE2 GLU B 118 16.436 -8.190 7.431 1.00 0.00 O ATOM 0 H GLU B 118 11.654 -6.252 5.499 1.00 0.00 H new ATOM 0 HA GLU B 118 11.754 -9.178 5.948 1.00 0.00 H new ATOM 0 HB2 GLU B 118 12.986 -6.816 7.395 1.00 0.00 H new ATOM 0 HB3 GLU B 118 12.778 -8.364 8.190 1.00 0.00 H new ATOM 0 HG2 GLU B 118 14.363 -9.427 6.866 1.00 0.00 H new ATOM 0 HG3 GLU B 118 14.140 -8.329 5.518 1.00 0.00 H new ATOM 981 N PRO B 119 10.126 -9.145 7.950 1.00 0.00 N ATOM 982 CA PRO B 119 8.947 -9.207 8.817 1.00 0.00 C ATOM 983 C PRO B 119 9.062 -8.278 10.020 1.00 0.00 C ATOM 984 O PRO B 119 8.091 -8.061 10.745 1.00 0.00 O ATOM 985 CB PRO B 119 8.917 -10.669 9.272 1.00 0.00 C ATOM 986 CG PRO B 119 10.331 -11.126 9.171 1.00 0.00 C ATOM 987 CD PRO B 119 10.925 -10.381 8.007 1.00 0.00 C ATOM 0 HA PRO B 119 8.043 -8.889 8.298 1.00 0.00 H new ATOM 0 HB2 PRO B 119 8.544 -10.759 10.292 1.00 0.00 H new ATOM 0 HB3 PRO B 119 8.261 -11.267 8.639 1.00 0.00 H new ATOM 0 HG2 PRO B 119 10.877 -10.913 10.090 1.00 0.00 H new ATOM 0 HG3 PRO B 119 10.383 -12.203 9.012 1.00 0.00 H new ATOM 0 HD2 PRO B 119 11.983 -10.169 8.163 1.00 0.00 H new ATOM 0 HD3 PRO B 119 10.848 -10.953 7.082 1.00 0.00 H new ATOM 995 N SER B 120 10.256 -7.730 10.227 1.00 0.00 N ATOM 996 CA SER B 120 10.499 -6.826 11.345 1.00 0.00 C ATOM 997 C SER B 120 10.643 -5.387 10.858 1.00 0.00 C ATOM 998 O SER B 120 10.615 -4.446 11.651 1.00 0.00 O ATOM 999 CB SER B 120 11.757 -7.248 12.106 1.00 0.00 C ATOM 1000 OG SER B 120 11.712 -8.624 12.441 1.00 0.00 O ATOM 0 H SER B 120 11.070 -7.897 9.635 1.00 0.00 H new ATOM 0 HA SER B 120 9.642 -6.880 12.017 1.00 0.00 H new ATOM 0 HB2 SER B 120 12.639 -7.047 11.497 1.00 0.00 H new ATOM 0 HB3 SER B 120 11.854 -6.652 13.014 1.00 0.00 H new ATOM 0 HG SER B 120 12.528 -8.870 12.925 1.00 0.00 H new ATOM 1006 N ASP B 121 10.798 -5.225 9.549 1.00 0.00 N ATOM 1007 CA ASP B 121 10.947 -3.902 8.954 1.00 0.00 C ATOM 1008 C ASP B 121 9.687 -3.068 9.161 1.00 0.00 C ATOM 1009 O ASP B 121 8.751 -3.496 9.839 1.00 0.00 O ATOM 1010 CB ASP B 121 11.254 -4.022 7.461 1.00 0.00 C ATOM 1011 CG ASP B 121 12.710 -4.350 7.194 1.00 0.00 C ATOM 1012 OD1 ASP B 121 13.542 -4.140 8.101 1.00 0.00 O ATOM 1013 OD2 ASP B 121 13.018 -4.817 6.076 1.00 0.00 O ATOM 0 H ASP B 121 10.824 -5.994 8.879 1.00 0.00 H new ATOM 0 HA ASP B 121 11.779 -3.400 9.449 1.00 0.00 H new ATOM 0 HB2 ASP B 121 10.624 -4.797 7.025 1.00 0.00 H new ATOM 0 HB3 ASP B 121 10.998 -3.086 6.964 1.00 0.00 H new ATOM 1018 N THR B 122 9.669 -1.876 8.575 1.00 0.00 N ATOM 1019 CA THR B 122 8.524 -0.981 8.697 1.00 0.00 C ATOM 1020 C THR B 122 8.110 -0.430 7.337 1.00 0.00 C ATOM 1021 O THR B 122 8.854 -0.536 6.361 1.00 0.00 O ATOM 1022 CB THR B 122 8.830 0.195 9.643 1.00 0.00 C ATOM 1023 OG1 THR B 122 10.081 0.795 9.292 1.00 0.00 O ATOM 1024 CG2 THR B 122 8.874 -0.272 11.090 1.00 0.00 C ATOM 0 H THR B 122 10.434 -1.507 8.011 1.00 0.00 H new ATOM 0 HA THR B 122 7.705 -1.569 9.112 1.00 0.00 H new ATOM 0 HB THR B 122 8.033 0.932 9.539 1.00 0.00 H new ATOM 0 HG1 THR B 122 10.344 1.434 9.987 1.00 0.00 H new ATOM 0 HG21 THR B 122 9.092 0.576 11.739 1.00 0.00 H new ATOM 0 HG22 THR B 122 7.910 -0.700 11.364 1.00 0.00 H new ATOM 0 HG23 THR B 122 9.652 -1.027 11.205 1.00 0.00 H new ATOM 1032 N ILE B 123 6.920 0.158 7.279 1.00 0.00 N ATOM 1033 CA ILE B 123 6.408 0.727 6.040 1.00 0.00 C ATOM 1034 C ILE B 123 7.360 1.781 5.485 1.00 0.00 C ATOM 1035 O ILE B 123 7.594 1.846 4.279 1.00 0.00 O ATOM 1036 CB ILE B 123 5.020 1.361 6.242 1.00 0.00 C ATOM 1037 CG1 ILE B 123 4.074 0.367 6.918 1.00 0.00 C ATOM 1038 CG2 ILE B 123 4.448 1.821 4.909 1.00 0.00 C ATOM 1039 CD1 ILE B 123 3.940 -0.943 6.172 1.00 0.00 C ATOM 0 H ILE B 123 6.292 0.253 8.077 1.00 0.00 H new ATOM 0 HA ILE B 123 6.323 -0.094 5.328 1.00 0.00 H new ATOM 0 HB ILE B 123 5.126 2.231 6.890 1.00 0.00 H new ATOM 0 HG12 ILE B 123 4.432 0.166 7.928 1.00 0.00 H new ATOM 0 HG13 ILE B 123 3.089 0.823 7.014 1.00 0.00 H new ATOM 0 HG21 ILE B 123 3.466 2.267 5.069 1.00 0.00 H new ATOM 0 HG22 ILE B 123 5.114 2.560 4.463 1.00 0.00 H new ATOM 0 HG23 ILE B 123 4.353 0.966 4.239 1.00 0.00 H new ATOM 0 HD11 ILE B 123 3.254 -1.599 6.709 1.00 0.00 H new ATOM 0 HD12 ILE B 123 3.552 -0.754 5.171 1.00 0.00 H new ATOM 0 HD13 ILE B 123 4.917 -1.421 6.098 1.00 0.00 H new ATOM 1051 N GLU B 124 7.908 2.604 6.374 1.00 0.00 N ATOM 1052 CA GLU B 124 8.835 3.655 5.972 1.00 0.00 C ATOM 1053 C GLU B 124 10.032 3.069 5.228 1.00 0.00 C ATOM 1054 O GLU B 124 10.579 3.695 4.321 1.00 0.00 O ATOM 1055 CB GLU B 124 9.316 4.437 7.197 1.00 0.00 C ATOM 1056 CG GLU B 124 10.050 3.582 8.216 1.00 0.00 C ATOM 1057 CD GLU B 124 10.652 4.401 9.340 1.00 0.00 C ATOM 1058 OE1 GLU B 124 11.156 5.509 9.061 1.00 0.00 O ATOM 1059 OE2 GLU B 124 10.620 3.935 10.498 1.00 0.00 O ATOM 0 H GLU B 124 7.726 2.563 7.377 1.00 0.00 H new ATOM 0 HA GLU B 124 8.307 4.333 5.301 1.00 0.00 H new ATOM 0 HB2 GLU B 124 9.974 5.241 6.868 1.00 0.00 H new ATOM 0 HB3 GLU B 124 8.457 4.905 7.679 1.00 0.00 H new ATOM 0 HG2 GLU B 124 9.360 2.850 8.635 1.00 0.00 H new ATOM 0 HG3 GLU B 124 10.841 3.024 7.714 1.00 0.00 H new ATOM 1066 N ASN B 125 10.431 1.862 5.618 1.00 0.00 N ATOM 1067 CA ASN B 125 11.563 1.192 4.990 1.00 0.00 C ATOM 1068 C ASN B 125 11.223 0.773 3.563 1.00 0.00 C ATOM 1069 O ASN B 125 12.034 0.926 2.649 1.00 0.00 O ATOM 1070 CB ASN B 125 11.976 -0.033 5.808 1.00 0.00 C ATOM 1071 CG ASN B 125 13.475 -0.267 5.783 1.00 0.00 C ATOM 1072 OD1 ASN B 125 14.145 -0.174 6.811 1.00 0.00 O ATOM 1073 ND2 ASN B 125 14.006 -0.572 4.605 1.00 0.00 N ATOM 0 H ASN B 125 9.987 1.329 6.366 1.00 0.00 H new ATOM 0 HA ASN B 125 12.396 1.895 4.956 1.00 0.00 H new ATOM 0 HB2 ASN B 125 11.648 0.095 6.840 1.00 0.00 H new ATOM 0 HB3 ASN B 125 11.467 -0.915 5.419 1.00 0.00 H new ATOM 0 HD21 ASN B 125 15.009 -0.740 4.526 1.00 0.00 H new ATOM 0 HD22 ASN B 125 13.411 -0.638 3.779 1.00 0.00 H new ATOM 1080 N VAL B 126 10.017 0.244 3.378 1.00 0.00 N ATOM 1081 CA VAL B 126 9.568 -0.195 2.063 1.00 0.00 C ATOM 1082 C VAL B 126 9.640 0.941 1.050 1.00 0.00 C ATOM 1083 O VAL B 126 9.945 0.724 -0.123 1.00 0.00 O ATOM 1084 CB VAL B 126 8.126 -0.732 2.113 1.00 0.00 C ATOM 1085 CG1 VAL B 126 7.724 -1.313 0.766 1.00 0.00 C ATOM 1086 CG2 VAL B 126 7.982 -1.772 3.214 1.00 0.00 C ATOM 0 H VAL B 126 9.334 0.109 4.123 1.00 0.00 H new ATOM 0 HA VAL B 126 10.237 -0.998 1.752 1.00 0.00 H new ATOM 0 HB VAL B 126 7.457 0.098 2.338 1.00 0.00 H new ATOM 0 HG11 VAL B 126 6.702 -1.687 0.822 1.00 0.00 H new ATOM 0 HG12 VAL B 126 7.785 -0.538 0.002 1.00 0.00 H new ATOM 0 HG13 VAL B 126 8.396 -2.131 0.507 1.00 0.00 H new ATOM 0 HG21 VAL B 126 6.956 -2.140 3.235 1.00 0.00 H new ATOM 0 HG22 VAL B 126 8.662 -2.602 3.022 1.00 0.00 H new ATOM 0 HG23 VAL B 126 8.224 -1.320 4.176 1.00 0.00 H new ATOM 1096 N LYS B 127 9.358 2.155 1.508 1.00 0.00 N ATOM 1097 CA LYS B 127 9.392 3.329 0.644 1.00 0.00 C ATOM 1098 C LYS B 127 10.826 3.798 0.419 1.00 0.00 C ATOM 1099 O LYS B 127 11.144 4.377 -0.618 1.00 0.00 O ATOM 1100 CB LYS B 127 8.564 4.462 1.254 1.00 0.00 C ATOM 1101 CG LYS B 127 7.138 4.061 1.590 1.00 0.00 C ATOM 1102 CD LYS B 127 6.445 5.118 2.433 1.00 0.00 C ATOM 1103 CE LYS B 127 5.337 4.514 3.283 1.00 0.00 C ATOM 1104 NZ LYS B 127 4.375 3.729 2.461 1.00 0.00 N ATOM 0 H LYS B 127 9.103 2.352 2.476 1.00 0.00 H new ATOM 0 HA LYS B 127 8.963 3.052 -0.319 1.00 0.00 H new ATOM 0 HB2 LYS B 127 9.057 4.813 2.161 1.00 0.00 H new ATOM 0 HB3 LYS B 127 8.542 5.300 0.558 1.00 0.00 H new ATOM 0 HG2 LYS B 127 6.577 3.904 0.669 1.00 0.00 H new ATOM 0 HG3 LYS B 127 7.143 3.112 2.126 1.00 0.00 H new ATOM 0 HD2 LYS B 127 7.175 5.607 3.078 1.00 0.00 H new ATOM 0 HD3 LYS B 127 6.028 5.888 1.783 1.00 0.00 H new ATOM 0 HE2 LYS B 127 5.774 3.869 4.045 1.00 0.00 H new ATOM 0 HE3 LYS B 127 4.805 5.309 3.805 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 3.423 3.807 2.872 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 4.364 4.101 1.490 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 4.665 2.730 2.446 1.00 0.00 H new ATOM 1118 N ALA B 128 11.689 3.539 1.397 1.00 0.00 N ATOM 1119 CA ALA B 128 13.090 3.932 1.304 1.00 0.00 C ATOM 1120 C ALA B 128 13.742 3.346 0.056 1.00 0.00 C ATOM 1121 O ALA B 128 14.358 4.065 -0.731 1.00 0.00 O ATOM 1122 CB ALA B 128 13.844 3.495 2.551 1.00 0.00 C ATOM 0 H ALA B 128 11.442 3.059 2.262 1.00 0.00 H new ATOM 0 HA ALA B 128 13.134 5.019 1.229 1.00 0.00 H new ATOM 0 HB1 ALA B 128 14.889 3.795 2.468 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.400 3.965 3.428 1.00 0.00 H new ATOM 0 HB3 ALA B 128 13.784 2.411 2.651 1.00 0.00 H new ATOM 1128 N LYS B 129 13.602 2.036 -0.118 1.00 0.00 N ATOM 1129 CA LYS B 129 14.177 1.353 -1.271 1.00 0.00 C ATOM 1130 C LYS B 129 13.418 1.703 -2.546 1.00 0.00 C ATOM 1131 O LYS B 129 14.019 1.896 -3.604 1.00 0.00 O ATOM 1132 CB LYS B 129 14.157 -0.163 -1.053 1.00 0.00 C ATOM 1133 CG LYS B 129 12.865 -0.672 -0.438 1.00 0.00 C ATOM 1134 CD LYS B 129 13.085 -1.190 0.973 1.00 0.00 C ATOM 1135 CE LYS B 129 13.644 -2.604 0.966 1.00 0.00 C ATOM 1136 NZ LYS B 129 15.134 -2.612 0.967 1.00 0.00 N ATOM 0 H LYS B 129 13.096 1.426 0.524 1.00 0.00 H new ATOM 0 HA LYS B 129 15.209 1.686 -1.381 1.00 0.00 H new ATOM 0 HB2 LYS B 129 14.315 -0.661 -2.009 1.00 0.00 H new ATOM 0 HB3 LYS B 129 14.991 -0.440 -0.408 1.00 0.00 H new ATOM 0 HG2 LYS B 129 12.128 0.131 -0.421 1.00 0.00 H new ATOM 0 HG3 LYS B 129 12.454 -1.468 -1.059 1.00 0.00 H new ATOM 0 HD2 LYS B 129 13.772 -0.529 1.502 1.00 0.00 H new ATOM 0 HD3 LYS B 129 12.142 -1.173 1.519 1.00 0.00 H new ATOM 0 HE2 LYS B 129 13.277 -3.144 1.839 1.00 0.00 H new ATOM 0 HE3 LYS B 129 13.279 -3.135 0.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 15.476 -3.505 1.377 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 15.482 -2.523 -0.009 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 15.485 -1.814 1.534 1.00 0.00 H new ATOM 1150 N ILE B 130 12.097 1.785 -2.439 1.00 0.00 N ATOM 1151 CA ILE B 130 11.256 2.116 -3.583 1.00 0.00 C ATOM 1152 C ILE B 130 11.714 3.411 -4.245 1.00 0.00 C ATOM 1153 O ILE B 130 11.552 3.593 -5.452 1.00 0.00 O ATOM 1154 CB ILE B 130 9.778 2.255 -3.176 1.00 0.00 C ATOM 1155 CG1 ILE B 130 9.168 0.878 -2.907 1.00 0.00 C ATOM 1156 CG2 ILE B 130 8.996 2.985 -4.258 1.00 0.00 C ATOM 1157 CD1 ILE B 130 7.874 0.931 -2.125 1.00 0.00 C ATOM 0 H ILE B 130 11.585 1.627 -1.571 1.00 0.00 H new ATOM 0 HA ILE B 130 11.352 1.294 -4.292 1.00 0.00 H new ATOM 0 HB ILE B 130 9.723 2.841 -2.258 1.00 0.00 H new ATOM 0 HG12 ILE B 130 8.988 0.378 -3.858 1.00 0.00 H new ATOM 0 HG13 ILE B 130 9.889 0.271 -2.359 1.00 0.00 H new ATOM 0 HG21 ILE B 130 7.953 3.075 -3.955 1.00 0.00 H new ATOM 0 HG22 ILE B 130 9.419 3.979 -4.404 1.00 0.00 H new ATOM 0 HG23 ILE B 130 9.056 2.424 -5.191 1.00 0.00 H new ATOM 0 HD11 ILE B 130 7.500 -0.081 -1.972 1.00 0.00 H new ATOM 0 HD12 ILE B 130 8.052 1.402 -1.158 1.00 0.00 H new ATOM 0 HD13 ILE B 130 7.137 1.510 -2.681 1.00 0.00 H new ATOM 1169 N GLN B 131 12.287 4.306 -3.447 1.00 0.00 N ATOM 1170 CA GLN B 131 12.769 5.585 -3.957 1.00 0.00 C ATOM 1171 C GLN B 131 13.849 5.378 -5.013 1.00 0.00 C ATOM 1172 O GLN B 131 13.870 6.063 -6.036 1.00 0.00 O ATOM 1173 CB GLN B 131 13.316 6.441 -2.812 1.00 0.00 C ATOM 1174 CG GLN B 131 14.145 7.624 -3.281 1.00 0.00 C ATOM 1175 CD GLN B 131 14.214 8.734 -2.250 1.00 0.00 C ATOM 1176 OE1 GLN B 131 14.713 8.537 -1.142 1.00 0.00 O ATOM 1177 NE2 GLN B 131 13.711 9.909 -2.611 1.00 0.00 N ATOM 0 H GLN B 131 12.429 4.170 -2.446 1.00 0.00 H new ATOM 0 HA GLN B 131 11.929 6.103 -4.420 1.00 0.00 H new ATOM 0 HB2 GLN B 131 12.482 6.807 -2.212 1.00 0.00 H new ATOM 0 HB3 GLN B 131 13.926 5.815 -2.161 1.00 0.00 H new ATOM 0 HG2 GLN B 131 15.155 7.286 -3.513 1.00 0.00 H new ATOM 0 HG3 GLN B 131 13.720 8.017 -4.205 1.00 0.00 H new ATOM 0 HE21 GLN B 131 13.307 10.027 -3.540 1.00 0.00 H new ATOM 0 HE22 GLN B 131 13.729 10.693 -1.959 1.00 0.00 H new ATOM 1186 N ASP B 132 14.744 4.430 -4.759 1.00 0.00 N ATOM 1187 CA ASP B 132 15.828 4.131 -5.687 1.00 0.00 C ATOM 1188 C ASP B 132 15.288 3.494 -6.965 1.00 0.00 C ATOM 1189 O ASP B 132 16.007 3.358 -7.955 1.00 0.00 O ATOM 1190 CB ASP B 132 16.849 3.202 -5.031 1.00 0.00 C ATOM 1191 CG ASP B 132 18.175 3.188 -5.768 1.00 0.00 C ATOM 1192 OD1 ASP B 132 18.251 2.553 -6.841 1.00 0.00 O ATOM 1193 OD2 ASP B 132 19.137 3.810 -5.270 1.00 0.00 O ATOM 0 H ASP B 132 14.740 3.855 -3.917 1.00 0.00 H new ATOM 0 HA ASP B 132 16.319 5.069 -5.948 1.00 0.00 H new ATOM 0 HB2 ASP B 132 17.013 3.516 -4.000 1.00 0.00 H new ATOM 0 HB3 ASP B 132 16.445 2.190 -4.995 1.00 0.00 H new ATOM 1198 N LYS B 133 14.018 3.105 -6.935 1.00 0.00 N ATOM 1199 CA LYS B 133 13.381 2.482 -8.089 1.00 0.00 C ATOM 1200 C LYS B 133 12.658 3.522 -8.939 1.00 0.00 C ATOM 1201 O LYS B 133 13.043 3.781 -10.077 1.00 0.00 O ATOM 1202 CB LYS B 133 12.394 1.404 -7.632 1.00 0.00 C ATOM 1203 CG LYS B 133 12.947 -0.006 -7.727 1.00 0.00 C ATOM 1204 CD LYS B 133 13.626 -0.427 -6.434 1.00 0.00 C ATOM 1205 CE LYS B 133 15.140 -0.466 -6.586 1.00 0.00 C ATOM 1206 NZ LYS B 133 15.565 -1.416 -7.651 1.00 0.00 N ATOM 0 H LYS B 133 13.409 3.210 -6.123 1.00 0.00 H new ATOM 0 HA LYS B 133 14.159 2.020 -8.697 1.00 0.00 H new ATOM 0 HB2 LYS B 133 12.104 1.603 -6.600 1.00 0.00 H new ATOM 0 HB3 LYS B 133 11.489 1.472 -8.236 1.00 0.00 H new ATOM 0 HG2 LYS B 133 12.139 -0.700 -7.957 1.00 0.00 H new ATOM 0 HG3 LYS B 133 13.660 -0.063 -8.549 1.00 0.00 H new ATOM 0 HD2 LYS B 133 13.357 0.267 -5.638 1.00 0.00 H new ATOM 0 HD3 LYS B 133 13.264 -1.411 -6.135 1.00 0.00 H new ATOM 0 HE2 LYS B 133 15.507 0.533 -6.822 1.00 0.00 H new ATOM 0 HE3 LYS B 133 15.593 -0.756 -5.638 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 16.501 -1.805 -7.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 14.875 -2.191 -7.720 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 15.616 -0.916 -8.562 1.00 0.00 H new ATOM 1220 N GLU B 134 11.610 4.115 -8.375 1.00 0.00 N ATOM 1221 CA GLU B 134 10.835 5.127 -9.082 1.00 0.00 C ATOM 1222 C GLU B 134 11.530 6.485 -9.021 1.00 0.00 C ATOM 1223 O GLU B 134 11.650 7.178 -10.031 1.00 0.00 O ATOM 1224 CB GLU B 134 9.429 5.233 -8.486 1.00 0.00 C ATOM 1225 CG GLU B 134 8.339 5.421 -9.528 1.00 0.00 C ATOM 1226 CD GLU B 134 8.180 6.869 -9.951 1.00 0.00 C ATOM 1227 OE1 GLU B 134 8.661 7.758 -9.218 1.00 0.00 O ATOM 1228 OE2 GLU B 134 7.573 7.112 -11.015 1.00 0.00 O ATOM 0 H GLU B 134 11.279 3.912 -7.432 1.00 0.00 H new ATOM 0 HA GLU B 134 10.757 4.825 -10.126 1.00 0.00 H new ATOM 0 HB2 GLU B 134 9.218 4.331 -7.911 1.00 0.00 H new ATOM 0 HB3 GLU B 134 9.401 6.070 -7.788 1.00 0.00 H new ATOM 0 HG2 GLU B 134 8.570 4.814 -10.403 1.00 0.00 H new ATOM 0 HG3 GLU B 134 7.393 5.057 -9.128 1.00 0.00 H new ATOM 1235 N GLY B 135 11.982 6.858 -7.828 1.00 0.00 N ATOM 1236 CA GLY B 135 12.658 8.131 -7.656 1.00 0.00 C ATOM 1237 C GLY B 135 11.834 9.122 -6.859 1.00 0.00 C ATOM 1238 O GLY B 135 11.873 10.325 -7.121 1.00 0.00 O ATOM 0 H GLY B 135 11.892 6.302 -6.978 1.00 0.00 H new ATOM 0 HA2 GLY B 135 13.611 7.968 -7.153 1.00 0.00 H new ATOM 0 HA3 GLY B 135 12.883 8.555 -8.635 1.00 0.00 H new ATOM 1242 N ILE B 136 11.086 8.617 -5.883 1.00 0.00 N ATOM 1243 CA ILE B 136 10.248 9.467 -5.046 1.00 0.00 C ATOM 1244 C ILE B 136 10.566 9.267 -3.568 1.00 0.00 C ATOM 1245 O ILE B 136 10.830 8.155 -3.110 1.00 0.00 O ATOM 1246 CB ILE B 136 8.752 9.190 -5.281 1.00 0.00 C ATOM 1247 CG1 ILE B 136 8.167 10.215 -6.256 1.00 0.00 C ATOM 1248 CG2 ILE B 136 7.995 9.214 -3.962 1.00 0.00 C ATOM 1249 CD1 ILE B 136 6.961 9.708 -7.015 1.00 0.00 C ATOM 0 H ILE B 136 11.043 7.624 -5.653 1.00 0.00 H new ATOM 0 HA ILE B 136 10.465 10.498 -5.325 1.00 0.00 H new ATOM 0 HB ILE B 136 8.647 8.198 -5.720 1.00 0.00 H new ATOM 0 HG12 ILE B 136 7.887 11.112 -5.703 1.00 0.00 H new ATOM 0 HG13 ILE B 136 8.938 10.507 -6.969 1.00 0.00 H new ATOM 0 HG21 ILE B 136 6.939 9.017 -4.145 1.00 0.00 H new ATOM 0 HG22 ILE B 136 8.397 8.449 -3.298 1.00 0.00 H new ATOM 0 HG23 ILE B 136 8.106 10.194 -3.497 1.00 0.00 H new ATOM 0 HD11 ILE B 136 6.600 10.487 -7.687 1.00 0.00 H new ATOM 0 HD12 ILE B 136 7.240 8.829 -7.596 1.00 0.00 H new ATOM 0 HD13 ILE B 136 6.173 9.442 -6.310 1.00 0.00 H new ATOM 1261 N PRO B 137 10.536 10.367 -2.802 1.00 0.00 N ATOM 1262 CA PRO B 137 10.816 10.336 -1.363 1.00 0.00 C ATOM 1263 C PRO B 137 9.714 9.638 -0.573 1.00 0.00 C ATOM 1264 O PRO B 137 8.529 9.732 -0.897 1.00 0.00 O ATOM 1265 CB PRO B 137 10.887 11.818 -0.985 1.00 0.00 C ATOM 1266 CG PRO B 137 10.058 12.511 -2.010 1.00 0.00 C ATOM 1267 CD PRO B 137 10.227 11.725 -3.280 1.00 0.00 C ATOM 0 HA PRO B 137 11.725 9.779 -1.136 1.00 0.00 H new ATOM 0 HB2 PRO B 137 10.499 11.989 0.019 1.00 0.00 H new ATOM 0 HB3 PRO B 137 11.915 12.181 -0.996 1.00 0.00 H new ATOM 0 HG2 PRO B 137 9.011 12.544 -1.708 1.00 0.00 H new ATOM 0 HG3 PRO B 137 10.384 13.543 -2.143 1.00 0.00 H new ATOM 0 HD2 PRO B 137 9.321 11.741 -3.886 1.00 0.00 H new ATOM 0 HD3 PRO B 137 11.031 12.126 -3.897 1.00 0.00 H new ATOM 1275 N PRO B 138 10.110 8.920 0.488 1.00 0.00 N ATOM 1276 CA PRO B 138 9.171 8.192 1.347 1.00 0.00 C ATOM 1277 C PRO B 138 8.304 9.127 2.181 1.00 0.00 C ATOM 1278 O PRO B 138 7.309 8.706 2.772 1.00 0.00 O ATOM 1279 CB PRO B 138 10.087 7.363 2.251 1.00 0.00 C ATOM 1280 CG PRO B 138 11.371 8.117 2.283 1.00 0.00 C ATOM 1281 CD PRO B 138 11.506 8.763 0.932 1.00 0.00 C ATOM 0 HA PRO B 138 8.467 7.595 0.767 1.00 0.00 H new ATOM 0 HB2 PRO B 138 9.666 7.256 3.251 1.00 0.00 H new ATOM 0 HB3 PRO B 138 10.228 6.357 1.856 1.00 0.00 H new ATOM 0 HG2 PRO B 138 11.364 8.866 3.075 1.00 0.00 H new ATOM 0 HG3 PRO B 138 12.210 7.450 2.482 1.00 0.00 H new ATOM 0 HD2 PRO B 138 12.018 9.723 0.995 1.00 0.00 H new ATOM 0 HD3 PRO B 138 12.079 8.141 0.244 1.00 0.00 H new ATOM 1289 N ASP B 139 8.686 10.399 2.225 1.00 0.00 N ATOM 1290 CA ASP B 139 7.941 11.395 2.986 1.00 0.00 C ATOM 1291 C ASP B 139 6.752 11.915 2.184 1.00 0.00 C ATOM 1292 O ASP B 139 5.981 12.744 2.666 1.00 0.00 O ATOM 1293 CB ASP B 139 8.856 12.558 3.376 1.00 0.00 C ATOM 1294 CG ASP B 139 8.403 13.250 4.647 1.00 0.00 C ATOM 1295 OD1 ASP B 139 8.485 12.624 5.724 1.00 0.00 O ATOM 1296 OD2 ASP B 139 7.964 14.417 4.564 1.00 0.00 O ATOM 0 H ASP B 139 9.507 10.764 1.743 1.00 0.00 H new ATOM 0 HA ASP B 139 7.565 10.918 3.891 1.00 0.00 H new ATOM 0 HB2 ASP B 139 9.872 12.188 3.510 1.00 0.00 H new ATOM 0 HB3 ASP B 139 8.885 13.282 2.562 1.00 0.00 H new ATOM 1301 N GLN B 140 6.610 11.420 0.959 1.00 0.00 N ATOM 1302 CA GLN B 140 5.515 11.836 0.090 1.00 0.00 C ATOM 1303 C GLN B 140 4.676 10.637 -0.340 1.00 0.00 C ATOM 1304 O GLN B 140 3.452 10.728 -0.436 1.00 0.00 O ATOM 1305 CB GLN B 140 6.061 12.559 -1.143 1.00 0.00 C ATOM 1306 CG GLN B 140 6.052 14.074 -1.012 1.00 0.00 C ATOM 1307 CD GLN B 140 7.235 14.726 -1.702 1.00 0.00 C ATOM 1308 OE1 GLN B 140 7.949 15.532 -1.107 1.00 0.00 O ATOM 1309 NE2 GLN B 140 7.448 14.378 -2.966 1.00 0.00 N ATOM 0 H GLN B 140 7.239 10.731 0.546 1.00 0.00 H new ATOM 0 HA GLN B 140 4.878 12.520 0.652 1.00 0.00 H new ATOM 0 HB2 GLN B 140 7.082 12.224 -1.328 1.00 0.00 H new ATOM 0 HB3 GLN B 140 5.469 12.274 -2.013 1.00 0.00 H new ATOM 0 HG2 GLN B 140 5.128 14.466 -1.436 1.00 0.00 H new ATOM 0 HG3 GLN B 140 6.058 14.344 0.044 1.00 0.00 H new ATOM 0 HE21 GLN B 140 6.831 13.705 -3.421 1.00 0.00 H new ATOM 0 HE22 GLN B 140 8.229 14.783 -3.482 1.00 0.00 H new ATOM 1318 N GLN B 141 5.342 9.517 -0.597 1.00 0.00 N ATOM 1319 CA GLN B 141 4.657 8.300 -1.017 1.00 0.00 C ATOM 1320 C GLN B 141 4.122 7.533 0.188 1.00 0.00 C ATOM 1321 O GLN B 141 4.653 7.644 1.293 1.00 0.00 O ATOM 1322 CB GLN B 141 5.603 7.409 -1.824 1.00 0.00 C ATOM 1323 CG GLN B 141 6.783 6.889 -1.021 1.00 0.00 C ATOM 1324 CD GLN B 141 7.433 5.676 -1.656 1.00 0.00 C ATOM 1325 OE1 GLN B 141 6.862 4.584 -1.664 1.00 0.00 O ATOM 1326 NE2 GLN B 141 8.632 5.860 -2.193 1.00 0.00 N ATOM 0 H GLN B 141 6.355 9.426 -0.522 1.00 0.00 H new ATOM 0 HA GLN B 141 3.814 8.587 -1.646 1.00 0.00 H new ATOM 0 HB2 GLN B 141 5.042 6.562 -2.219 1.00 0.00 H new ATOM 0 HB3 GLN B 141 5.976 7.971 -2.680 1.00 0.00 H new ATOM 0 HG2 GLN B 141 7.524 7.681 -0.918 1.00 0.00 H new ATOM 0 HG3 GLN B 141 6.449 6.633 -0.016 1.00 0.00 H new ATOM 0 HE21 GLN B 141 9.068 6.782 -2.164 1.00 0.00 H new ATOM 0 HE22 GLN B 141 9.118 5.080 -2.635 1.00 0.00 H new ATOM 1335 N ARG B 142 3.066 6.756 -0.034 1.00 0.00 N ATOM 1336 CA ARG B 142 2.459 5.971 1.035 1.00 0.00 C ATOM 1337 C ARG B 142 2.118 4.565 0.550 1.00 0.00 C ATOM 1338 O ARG B 142 2.351 4.223 -0.610 1.00 0.00 O ATOM 1339 CB ARG B 142 1.195 6.664 1.549 1.00 0.00 C ATOM 1340 CG ARG B 142 1.477 7.923 2.354 1.00 0.00 C ATOM 1341 CD ARG B 142 0.355 8.939 2.208 1.00 0.00 C ATOM 1342 NE ARG B 142 0.613 10.154 2.975 1.00 0.00 N ATOM 1343 CZ ARG B 142 0.575 10.208 4.302 1.00 0.00 C ATOM 1344 NH1 ARG B 142 0.289 9.119 5.004 1.00 0.00 N ATOM 1345 NH2 ARG B 142 0.822 11.350 4.930 1.00 0.00 N ATOM 0 H ARG B 142 2.614 6.653 -0.943 1.00 0.00 H new ATOM 0 HA ARG B 142 3.180 5.892 1.849 1.00 0.00 H new ATOM 0 HB2 ARG B 142 0.560 6.920 0.701 1.00 0.00 H new ATOM 0 HB3 ARG B 142 0.633 5.965 2.168 1.00 0.00 H new ATOM 0 HG2 ARG B 142 1.601 7.664 3.406 1.00 0.00 H new ATOM 0 HG3 ARG B 142 2.416 8.366 2.022 1.00 0.00 H new ATOM 0 HD2 ARG B 142 0.232 9.194 1.155 1.00 0.00 H new ATOM 0 HD3 ARG B 142 -0.583 8.493 2.540 1.00 0.00 H new ATOM 0 HE ARG B 142 0.835 11.009 2.464 1.00 0.00 H new ATOM 0 HH11 ARG B 142 0.098 8.239 4.525 1.00 0.00 H new ATOM 0 HH12 ARG B 142 0.260 9.162 6.023 1.00 0.00 H new ATOM 0 HH21 ARG B 142 1.042 12.190 4.394 1.00 0.00 H new ATOM 0 HH22 ARG B 142 0.792 11.389 5.949 1.00 0.00 H new ATOM 1359 N LEU B 143 1.566 3.754 1.445 1.00 0.00 N ATOM 1360 CA LEU B 143 1.195 2.383 1.110 1.00 0.00 C ATOM 1361 C LEU B 143 -0.255 2.103 1.495 1.00 0.00 C ATOM 1362 O LEU B 143 -0.792 2.715 2.420 1.00 0.00 O ATOM 1363 CB LEU B 143 2.122 1.394 1.819 1.00 0.00 C ATOM 1364 CG LEU B 143 3.390 1.004 1.060 1.00 0.00 C ATOM 1365 CD1 LEU B 143 4.289 0.138 1.930 1.00 0.00 C ATOM 1366 CD2 LEU B 143 3.038 0.280 -0.232 1.00 0.00 C ATOM 0 H LEU B 143 1.365 4.022 2.409 1.00 0.00 H new ATOM 0 HA LEU B 143 1.298 2.258 0.032 1.00 0.00 H new ATOM 0 HB2 LEU B 143 2.413 1.823 2.778 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.557 0.487 2.034 1.00 0.00 H new ATOM 0 HG LEU B 143 3.932 1.915 0.807 1.00 0.00 H new ATOM 0 HD11 LEU B 143 5.187 -0.130 1.372 1.00 0.00 H new ATOM 0 HD12 LEU B 143 4.570 0.691 2.826 1.00 0.00 H new ATOM 0 HD13 LEU B 143 3.755 -0.769 2.215 1.00 0.00 H new ATOM 0 HD21 LEU B 143 3.953 0.010 -0.759 1.00 0.00 H new ATOM 0 HD22 LEU B 143 2.473 -0.623 -0.001 1.00 0.00 H new ATOM 0 HD23 LEU B 143 2.436 0.934 -0.863 1.00 0.00 H new ATOM 1378 N ILE B 144 -0.882 1.174 0.782 1.00 0.00 N ATOM 1379 CA ILE B 144 -2.268 0.811 1.050 1.00 0.00 C ATOM 1380 C ILE B 144 -2.467 -0.699 0.962 1.00 0.00 C ATOM 1381 O ILE B 144 -2.389 -1.283 -0.119 1.00 0.00 O ATOM 1382 CB ILE B 144 -3.232 1.503 0.069 1.00 0.00 C ATOM 1383 CG1 ILE B 144 -2.954 3.007 0.023 1.00 0.00 C ATOM 1384 CG2 ILE B 144 -4.675 1.238 0.470 1.00 0.00 C ATOM 1385 CD1 ILE B 144 -3.281 3.722 1.315 1.00 0.00 C ATOM 0 H ILE B 144 -0.452 0.659 0.014 1.00 0.00 H new ATOM 0 HA ILE B 144 -2.492 1.147 2.063 1.00 0.00 H new ATOM 0 HB ILE B 144 -3.071 1.092 -0.928 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.902 3.167 -0.215 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -3.535 3.451 -0.786 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -5.345 1.734 -0.233 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -4.865 0.165 0.457 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -4.851 1.626 1.474 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -3.059 4.784 1.209 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -4.339 3.593 1.544 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -2.681 3.305 2.124 1.00 0.00 H new ATOM 1397 N PHE B 145 -2.726 -1.324 2.105 1.00 0.00 N ATOM 1398 CA PHE B 145 -2.938 -2.766 2.157 1.00 0.00 C ATOM 1399 C PHE B 145 -3.957 -3.127 3.235 1.00 0.00 C ATOM 1400 O PHE B 145 -4.022 -2.485 4.282 1.00 0.00 O ATOM 1401 CB PHE B 145 -1.617 -3.488 2.427 1.00 0.00 C ATOM 1402 CG PHE B 145 -1.601 -4.910 1.944 1.00 0.00 C ATOM 1403 CD1 PHE B 145 -1.965 -5.218 0.643 1.00 0.00 C ATOM 1404 CD2 PHE B 145 -1.220 -5.939 2.791 1.00 0.00 C ATOM 1405 CE1 PHE B 145 -1.953 -6.526 0.197 1.00 0.00 C ATOM 1406 CE2 PHE B 145 -1.206 -7.248 2.350 1.00 0.00 C ATOM 1407 CZ PHE B 145 -1.571 -7.542 1.050 1.00 0.00 C ATOM 0 H PHE B 145 -2.794 -0.855 3.008 1.00 0.00 H new ATOM 0 HA PHE B 145 -3.328 -3.086 1.191 1.00 0.00 H new ATOM 0 HB2 PHE B 145 -0.808 -2.940 1.945 1.00 0.00 H new ATOM 0 HB3 PHE B 145 -1.417 -3.474 3.498 1.00 0.00 H new ATOM 0 HD1 PHE B 145 -2.261 -4.427 -0.030 1.00 0.00 H new ATOM 0 HD2 PHE B 145 -0.931 -5.715 3.807 1.00 0.00 H new ATOM 0 HE1 PHE B 145 -2.242 -6.753 -0.818 1.00 0.00 H new ATOM 0 HE2 PHE B 145 -0.910 -8.041 3.021 1.00 0.00 H new ATOM 0 HZ PHE B 145 -1.557 -8.564 0.702 1.00 0.00 H new ATOM 1417 N ALA B 146 -4.750 -4.159 2.968 1.00 0.00 N ATOM 1418 CA ALA B 146 -5.765 -4.608 3.913 1.00 0.00 C ATOM 1419 C ALA B 146 -6.826 -3.534 4.130 1.00 0.00 C ATOM 1420 O ALA B 146 -7.490 -3.504 5.164 1.00 0.00 O ATOM 1421 CB ALA B 146 -5.121 -4.990 5.237 1.00 0.00 C ATOM 0 H ALA B 146 -4.709 -4.700 2.104 1.00 0.00 H new ATOM 0 HA ALA B 146 -6.254 -5.486 3.492 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -5.891 -5.323 5.933 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -4.405 -5.796 5.074 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -4.605 -4.125 5.654 1.00 0.00 H new ATOM 1427 N GLY B 147 -6.979 -2.652 3.146 1.00 0.00 N ATOM 1428 CA GLY B 147 -7.961 -1.588 3.249 1.00 0.00 C ATOM 1429 C GLY B 147 -7.595 -0.562 4.303 1.00 0.00 C ATOM 1430 O GLY B 147 -8.469 0.074 4.891 1.00 0.00 O ATOM 0 H GLY B 147 -6.440 -2.656 2.280 1.00 0.00 H new ATOM 0 HA2 GLY B 147 -8.059 -1.093 2.283 1.00 0.00 H new ATOM 0 HA3 GLY B 147 -8.934 -2.018 3.487 1.00 0.00 H new ATOM 1434 N LYS B 148 -6.298 -0.402 4.546 1.00 0.00 N ATOM 1435 CA LYS B 148 -5.817 0.554 5.536 1.00 0.00 C ATOM 1436 C LYS B 148 -4.514 1.200 5.080 1.00 0.00 C ATOM 1437 O LYS B 148 -3.763 0.619 4.296 1.00 0.00 O ATOM 1438 CB LYS B 148 -5.610 -0.140 6.884 1.00 0.00 C ATOM 1439 CG LYS B 148 -6.613 -1.246 7.160 1.00 0.00 C ATOM 1440 CD LYS B 148 -6.616 -1.644 8.627 1.00 0.00 C ATOM 1441 CE LYS B 148 -6.227 -3.104 8.808 1.00 0.00 C ATOM 1442 NZ LYS B 148 -6.628 -3.622 10.144 1.00 0.00 N ATOM 0 H LYS B 148 -5.561 -0.923 4.070 1.00 0.00 H new ATOM 0 HA LYS B 148 -6.569 1.335 5.647 1.00 0.00 H new ATOM 0 HB2 LYS B 148 -4.604 -0.557 6.917 1.00 0.00 H new ATOM 0 HB3 LYS B 148 -5.673 0.603 7.679 1.00 0.00 H new ATOM 0 HG2 LYS B 148 -7.610 -0.915 6.870 1.00 0.00 H new ATOM 0 HG3 LYS B 148 -6.375 -2.115 6.547 1.00 0.00 H new ATOM 0 HD2 LYS B 148 -5.922 -1.010 9.179 1.00 0.00 H new ATOM 0 HD3 LYS B 148 -7.607 -1.475 9.049 1.00 0.00 H new ATOM 0 HE2 LYS B 148 -6.697 -3.705 8.029 1.00 0.00 H new ATOM 0 HE3 LYS B 148 -5.149 -3.211 8.685 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 -6.346 -4.619 10.229 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 -6.160 -3.065 10.887 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 -7.659 -3.544 10.251 1.00 0.00 H new ATOM 1456 N GLN B 149 -4.250 2.406 5.575 1.00 0.00 N ATOM 1457 CA GLN B 149 -3.036 3.130 5.217 1.00 0.00 C ATOM 1458 C GLN B 149 -1.867 2.698 6.096 1.00 0.00 C ATOM 1459 O GLN B 149 -1.826 3.004 7.289 1.00 0.00 O ATOM 1460 CB GLN B 149 -3.259 4.637 5.350 1.00 0.00 C ATOM 1461 CG GLN B 149 -2.048 5.468 4.956 1.00 0.00 C ATOM 1462 CD GLN B 149 -2.070 6.856 5.565 1.00 0.00 C ATOM 1463 OE1 GLN B 149 -1.245 7.185 6.418 1.00 0.00 O ATOM 1464 NE2 GLN B 149 -3.016 7.678 5.130 1.00 0.00 N ATOM 0 H GLN B 149 -4.861 2.902 6.225 1.00 0.00 H new ATOM 0 HA GLN B 149 -2.794 2.895 4.180 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -4.106 4.927 4.728 1.00 0.00 H new ATOM 0 HB3 GLN B 149 -3.527 4.867 6.381 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -1.140 4.952 5.270 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -2.008 5.552 3.870 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -3.679 7.363 4.422 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -3.080 8.625 5.504 1.00 0.00 H new ATOM 1473 N LEU B 150 -0.917 1.987 5.501 1.00 0.00 N ATOM 1474 CA LEU B 150 0.255 1.512 6.229 1.00 0.00 C ATOM 1475 C LEU B 150 1.302 2.614 6.354 1.00 0.00 C ATOM 1476 O LEU B 150 1.645 3.272 5.372 1.00 0.00 O ATOM 1477 CB LEU B 150 0.861 0.297 5.525 1.00 0.00 C ATOM 1478 CG LEU B 150 -0.133 -0.662 4.868 1.00 0.00 C ATOM 1479 CD1 LEU B 150 0.576 -1.920 4.390 1.00 0.00 C ATOM 1480 CD2 LEU B 150 -1.254 -1.014 5.836 1.00 0.00 C ATOM 0 H LEU B 150 -0.935 1.726 4.515 1.00 0.00 H new ATOM 0 HA LEU B 150 -0.064 1.223 7.230 1.00 0.00 H new ATOM 0 HB2 LEU B 150 1.552 0.652 4.761 1.00 0.00 H new ATOM 0 HB3 LEU B 150 1.450 -0.263 6.252 1.00 0.00 H new ATOM 0 HG LEU B 150 -0.571 -0.165 4.002 1.00 0.00 H new ATOM 0 HD11 LEU B 150 -0.147 -2.591 3.925 1.00 0.00 H new ATOM 0 HD12 LEU B 150 1.342 -1.652 3.663 1.00 0.00 H new ATOM 0 HD13 LEU B 150 1.041 -2.420 5.239 1.00 0.00 H new ATOM 0 HD21 LEU B 150 -1.952 -1.697 5.352 1.00 0.00 H new ATOM 0 HD22 LEU B 150 -0.834 -1.492 6.721 1.00 0.00 H new ATOM 0 HD23 LEU B 150 -1.780 -0.106 6.129 1.00 0.00 H new ATOM 1492 N GLU B 151 1.805 2.810 7.569 1.00 0.00 N ATOM 1493 CA GLU B 151 2.814 3.832 7.822 1.00 0.00 C ATOM 1494 C GLU B 151 3.900 3.307 8.757 1.00 0.00 C ATOM 1495 O GLU B 151 3.857 2.155 9.190 1.00 0.00 O ATOM 1496 CB GLU B 151 2.167 5.081 8.424 1.00 0.00 C ATOM 1497 CG GLU B 151 1.173 4.777 9.533 1.00 0.00 C ATOM 1498 CD GLU B 151 1.095 5.884 10.566 1.00 0.00 C ATOM 1499 OE1 GLU B 151 1.417 7.041 10.220 1.00 0.00 O ATOM 1500 OE2 GLU B 151 0.713 5.595 11.719 1.00 0.00 O ATOM 0 H GLU B 151 1.530 2.275 8.393 1.00 0.00 H new ATOM 0 HA GLU B 151 3.275 4.093 6.870 1.00 0.00 H new ATOM 0 HB2 GLU B 151 2.949 5.732 8.816 1.00 0.00 H new ATOM 0 HB3 GLU B 151 1.659 5.634 7.634 1.00 0.00 H new ATOM 0 HG2 GLU B 151 0.186 4.621 9.098 1.00 0.00 H new ATOM 0 HG3 GLU B 151 1.456 3.846 10.024 1.00 0.00 H new ATOM 1507 N ASP B 152 4.871 4.159 9.063 1.00 0.00 N ATOM 1508 CA ASP B 152 5.968 3.782 9.948 1.00 0.00 C ATOM 1509 C ASP B 152 5.450 3.455 11.345 1.00 0.00 C ATOM 1510 O ASP B 152 6.148 2.835 12.147 1.00 0.00 O ATOM 1511 CB ASP B 152 7.000 4.908 10.023 1.00 0.00 C ATOM 1512 CG ASP B 152 6.622 5.974 11.032 1.00 0.00 C ATOM 1513 OD1 ASP B 152 5.689 6.755 10.748 1.00 0.00 O ATOM 1514 OD2 ASP B 152 7.259 6.029 12.105 1.00 0.00 O ATOM 0 H ASP B 152 4.922 5.115 8.712 1.00 0.00 H new ATOM 0 HA ASP B 152 6.444 2.891 9.539 1.00 0.00 H new ATOM 0 HB2 ASP B 152 7.971 4.490 10.288 1.00 0.00 H new ATOM 0 HB3 ASP B 152 7.107 5.365 9.039 1.00 0.00 H new ATOM 1519 N GLY B 153 4.223 3.877 11.630 1.00 0.00 N ATOM 1520 CA GLY B 153 3.634 3.620 12.933 1.00 0.00 C ATOM 1521 C GLY B 153 3.552 2.141 13.251 1.00 0.00 C ATOM 1522 O GLY B 153 3.412 1.755 14.411 1.00 0.00 O ATOM 0 H GLY B 153 3.625 4.392 10.983 1.00 0.00 H new ATOM 0 HA2 GLY B 153 4.224 4.121 13.700 1.00 0.00 H new ATOM 0 HA3 GLY B 153 2.634 4.052 12.968 1.00 0.00 H new ATOM 1526 N ARG B 154 3.637 1.310 12.216 1.00 0.00 N ATOM 1527 CA ARG B 154 3.568 -0.136 12.391 1.00 0.00 C ATOM 1528 C ARG B 154 4.561 -0.843 11.473 1.00 0.00 C ATOM 1529 O ARG B 154 5.126 -0.233 10.564 1.00 0.00 O ATOM 1530 CB ARG B 154 2.150 -0.639 12.109 1.00 0.00 C ATOM 1531 CG ARG B 154 1.062 0.315 12.573 1.00 0.00 C ATOM 1532 CD ARG B 154 -0.223 -0.426 12.908 1.00 0.00 C ATOM 1533 NE ARG B 154 -0.072 -1.278 14.085 1.00 0.00 N ATOM 1534 CZ ARG B 154 -0.105 -0.822 15.332 1.00 0.00 C ATOM 1535 NH1 ARG B 154 -0.283 0.472 15.564 1.00 0.00 N ATOM 1536 NH2 ARG B 154 0.039 -1.659 16.351 1.00 0.00 N ATOM 0 H ARG B 154 3.754 1.613 11.249 1.00 0.00 H new ATOM 0 HA ARG B 154 3.828 -0.364 13.425 1.00 0.00 H new ATOM 0 HB2 ARG B 154 2.040 -0.809 11.038 1.00 0.00 H new ATOM 0 HB3 ARG B 154 2.011 -1.602 12.600 1.00 0.00 H new ATOM 0 HG2 ARG B 154 1.407 0.863 13.450 1.00 0.00 H new ATOM 0 HG3 ARG B 154 0.866 1.052 11.794 1.00 0.00 H new ATOM 0 HD2 ARG B 154 -1.022 0.294 13.082 1.00 0.00 H new ATOM 0 HD3 ARG B 154 -0.523 -1.035 12.055 1.00 0.00 H new ATOM 0 HE ARG B 154 0.066 -2.278 13.941 1.00 0.00 H new ATOM 0 HH11 ARG B 154 -0.395 1.119 14.784 1.00 0.00 H new ATOM 0 HH12 ARG B 154 -0.308 0.820 16.523 1.00 0.00 H new ATOM 0 HH21 ARG B 154 0.175 -2.655 16.178 1.00 0.00 H new ATOM 0 HH22 ARG B 154 0.013 -1.307 17.308 1.00 0.00 H new ATOM 1550 N THR B 155 4.771 -2.133 11.717 1.00 0.00 N ATOM 1551 CA THR B 155 5.696 -2.922 10.915 1.00 0.00 C ATOM 1552 C THR B 155 4.952 -3.776 9.896 1.00 0.00 C ATOM 1553 O THR B 155 3.722 -3.743 9.823 1.00 0.00 O ATOM 1554 CB THR B 155 6.566 -3.838 11.797 1.00 0.00 C ATOM 1555 OG1 THR B 155 5.732 -4.647 12.633 1.00 0.00 O ATOM 1556 CG2 THR B 155 7.513 -3.017 12.659 1.00 0.00 C ATOM 0 H THR B 155 4.312 -2.653 12.465 1.00 0.00 H new ATOM 0 HA THR B 155 6.340 -2.215 10.392 1.00 0.00 H new ATOM 0 HB THR B 155 7.158 -4.480 11.145 1.00 0.00 H new ATOM 0 HG1 THR B 155 5.852 -5.591 12.399 1.00 0.00 H new ATOM 0 HG21 THR B 155 8.117 -3.685 13.273 1.00 0.00 H new ATOM 0 HG22 THR B 155 8.165 -2.423 12.019 1.00 0.00 H new ATOM 0 HG23 THR B 155 6.936 -2.354 13.304 1.00 0.00 H new ATOM 1564 N LEU B 156 5.701 -4.541 9.110 1.00 0.00 N ATOM 1565 CA LEU B 156 5.111 -5.405 8.095 1.00 0.00 C ATOM 1566 C LEU B 156 4.246 -6.486 8.735 1.00 0.00 C ATOM 1567 O LEU B 156 3.111 -6.717 8.315 1.00 0.00 O ATOM 1568 CB LEU B 156 6.207 -6.051 7.246 1.00 0.00 C ATOM 1569 CG LEU B 156 6.897 -5.139 6.232 1.00 0.00 C ATOM 1570 CD1 LEU B 156 5.870 -4.475 5.327 1.00 0.00 C ATOM 1571 CD2 LEU B 156 7.740 -4.091 6.944 1.00 0.00 C ATOM 0 H LEU B 156 6.719 -4.580 9.156 1.00 0.00 H new ATOM 0 HA LEU B 156 4.478 -4.790 7.455 1.00 0.00 H new ATOM 0 HB2 LEU B 156 6.966 -6.456 7.916 1.00 0.00 H new ATOM 0 HB3 LEU B 156 5.773 -6.894 6.709 1.00 0.00 H new ATOM 0 HG LEU B 156 7.557 -5.748 5.614 1.00 0.00 H new ATOM 0 HD11 LEU B 156 6.379 -3.829 4.611 1.00 0.00 H new ATOM 0 HD12 LEU B 156 5.309 -5.240 4.790 1.00 0.00 H new ATOM 0 HD13 LEU B 156 5.185 -3.879 5.930 1.00 0.00 H new ATOM 0 HD21 LEU B 156 8.224 -3.451 6.206 1.00 0.00 H new ATOM 0 HD22 LEU B 156 7.101 -3.485 7.587 1.00 0.00 H new ATOM 0 HD23 LEU B 156 8.500 -4.585 7.549 1.00 0.00 H new ATOM 1583 N SER B 157 4.787 -7.142 9.756 1.00 0.00 N ATOM 1584 CA SER B 157 4.064 -8.200 10.454 1.00 0.00 C ATOM 1585 C SER B 157 2.843 -7.638 11.176 1.00 0.00 C ATOM 1586 O SER B 157 1.944 -8.382 11.568 1.00 0.00 O ATOM 1587 CB SER B 157 4.985 -8.899 11.456 1.00 0.00 C ATOM 1588 OG SER B 157 5.731 -7.958 12.208 1.00 0.00 O ATOM 0 H SER B 157 5.723 -6.960 10.119 1.00 0.00 H new ATOM 0 HA SER B 157 3.725 -8.925 9.714 1.00 0.00 H new ATOM 0 HB2 SER B 157 4.392 -9.518 12.129 1.00 0.00 H new ATOM 0 HB3 SER B 157 5.665 -9.566 10.926 1.00 0.00 H new ATOM 0 HG SER B 157 6.621 -7.853 11.811 1.00 0.00 H new ATOM 1594 N ASP B 158 2.819 -6.321 11.346 1.00 0.00 N ATOM 1595 CA ASP B 158 1.709 -5.658 12.020 1.00 0.00 C ATOM 1596 C ASP B 158 0.495 -5.562 11.100 1.00 0.00 C ATOM 1597 O ASP B 158 -0.648 -5.612 11.556 1.00 0.00 O ATOM 1598 CB ASP B 158 2.125 -4.261 12.482 1.00 0.00 C ATOM 1599 CG ASP B 158 2.324 -4.183 13.983 1.00 0.00 C ATOM 1600 OD1 ASP B 158 3.097 -5.002 14.523 1.00 0.00 O ATOM 1601 OD2 ASP B 158 1.708 -3.302 14.618 1.00 0.00 O ATOM 0 H ASP B 158 3.555 -5.692 11.027 1.00 0.00 H new ATOM 0 HA ASP B 158 1.437 -6.254 12.891 1.00 0.00 H new ATOM 0 HB2 ASP B 158 3.050 -3.976 11.981 1.00 0.00 H new ATOM 0 HB3 ASP B 158 1.364 -3.541 12.181 1.00 0.00 H new ATOM 1606 N TYR B 159 0.751 -5.423 9.804 1.00 0.00 N ATOM 1607 CA TYR B 159 -0.320 -5.316 8.821 1.00 0.00 C ATOM 1608 C TYR B 159 -0.542 -6.648 8.111 1.00 0.00 C ATOM 1609 O TYR B 159 -1.182 -6.706 7.062 1.00 0.00 O ATOM 1610 CB TYR B 159 0.006 -4.227 7.797 1.00 0.00 C ATOM 1611 CG TYR B 159 -0.145 -2.824 8.336 1.00 0.00 C ATOM 1612 CD1 TYR B 159 -1.351 -2.392 8.876 1.00 0.00 C ATOM 1613 CD2 TYR B 159 0.917 -1.929 8.307 1.00 0.00 C ATOM 1614 CE1 TYR B 159 -1.494 -1.109 9.370 1.00 0.00 C ATOM 1615 CE2 TYR B 159 0.783 -0.645 8.799 1.00 0.00 C ATOM 1616 CZ TYR B 159 -0.424 -0.240 9.329 1.00 0.00 C ATOM 1617 OH TYR B 159 -0.562 1.037 9.821 1.00 0.00 O ATOM 0 H TYR B 159 1.691 -5.382 9.410 1.00 0.00 H new ATOM 0 HA TYR B 159 -1.236 -5.048 9.347 1.00 0.00 H new ATOM 0 HB2 TYR B 159 1.029 -4.364 7.447 1.00 0.00 H new ATOM 0 HB3 TYR B 159 -0.646 -4.347 6.932 1.00 0.00 H new ATOM 0 HD1 TYR B 159 -2.191 -3.070 8.910 1.00 0.00 H new ATOM 0 HD2 TYR B 159 1.864 -2.242 7.893 1.00 0.00 H new ATOM 0 HE1 TYR B 159 -2.438 -0.789 9.786 1.00 0.00 H new ATOM 0 HE2 TYR B 159 1.619 0.038 8.769 1.00 0.00 H new ATOM 0 HH TYR B 159 -1.222 1.039 10.545 1.00 0.00 H new ATOM 1627 N ASN B 160 -0.009 -7.717 8.693 1.00 0.00 N ATOM 1628 CA ASN B 160 -0.149 -9.050 8.117 1.00 0.00 C ATOM 1629 C ASN B 160 0.441 -9.100 6.711 1.00 0.00 C ATOM 1630 O ASN B 160 -0.069 -9.800 5.837 1.00 0.00 O ATOM 1631 CB ASN B 160 -1.622 -9.460 8.079 1.00 0.00 C ATOM 1632 CG ASN B 160 -1.802 -10.965 8.017 1.00 0.00 C ATOM 1633 OD1 ASN B 160 -1.623 -11.664 9.014 1.00 0.00 O ATOM 1634 ND2 ASN B 160 -2.157 -11.470 6.841 1.00 0.00 N ATOM 0 H ASN B 160 0.524 -7.687 9.562 1.00 0.00 H new ATOM 0 HA ASN B 160 0.400 -9.750 8.747 1.00 0.00 H new ATOM 0 HB2 ASN B 160 -2.127 -9.073 8.964 1.00 0.00 H new ATOM 0 HB3 ASN B 160 -2.101 -9.004 7.213 1.00 0.00 H new ATOM 0 HD21 ASN B 160 -2.292 -12.476 6.738 1.00 0.00 H new ATOM 0 HD22 ASN B 160 -2.294 -10.852 6.041 1.00 0.00 H new ATOM 1641 N ILE B 161 1.519 -8.352 6.501 1.00 0.00 N ATOM 1642 CA ILE B 161 2.180 -8.312 5.202 1.00 0.00 C ATOM 1643 C ILE B 161 2.853 -9.643 4.886 1.00 0.00 C ATOM 1644 O ILE B 161 3.910 -9.959 5.431 1.00 0.00 O ATOM 1645 CB ILE B 161 3.232 -7.189 5.140 1.00 0.00 C ATOM 1646 CG1 ILE B 161 2.595 -5.844 5.491 1.00 0.00 C ATOM 1647 CG2 ILE B 161 3.869 -7.137 3.759 1.00 0.00 C ATOM 1648 CD1 ILE B 161 1.602 -5.358 4.459 1.00 0.00 C ATOM 0 H ILE B 161 1.953 -7.765 7.214 1.00 0.00 H new ATOM 0 HA ILE B 161 1.406 -8.115 4.460 1.00 0.00 H new ATOM 0 HB ILE B 161 4.013 -7.401 5.871 1.00 0.00 H new ATOM 0 HG12 ILE B 161 2.093 -5.930 6.455 1.00 0.00 H new ATOM 0 HG13 ILE B 161 3.381 -5.098 5.606 1.00 0.00 H new ATOM 0 HG21 ILE B 161 4.610 -6.339 3.730 1.00 0.00 H new ATOM 0 HG22 ILE B 161 4.353 -8.090 3.546 1.00 0.00 H new ATOM 0 HG23 ILE B 161 3.100 -6.945 3.011 1.00 0.00 H new ATOM 0 HD11 ILE B 161 1.190 -4.399 4.774 1.00 0.00 H new ATOM 0 HD12 ILE B 161 2.104 -5.240 3.499 1.00 0.00 H new ATOM 0 HD13 ILE B 161 0.795 -6.084 4.360 1.00 0.00 H new ATOM 1660 N GLN B 162 2.233 -10.419 4.002 1.00 0.00 N ATOM 1661 CA GLN B 162 2.774 -11.716 3.614 1.00 0.00 C ATOM 1662 C GLN B 162 3.577 -11.606 2.322 1.00 0.00 C ATOM 1663 O GLN B 162 3.635 -10.543 1.703 1.00 0.00 O ATOM 1664 CB GLN B 162 1.644 -12.732 3.442 1.00 0.00 C ATOM 1665 CG GLN B 162 0.718 -12.822 4.644 1.00 0.00 C ATOM 1666 CD GLN B 162 1.441 -13.246 5.907 1.00 0.00 C ATOM 1667 OE1 GLN B 162 1.641 -12.303 6.820 1.00 0.00 O flip ATOM 1668 NE2 GLN B 162 1.815 -14.409 6.061 1.00 0.00 N flip ATOM 0 H GLN B 162 1.357 -10.172 3.542 1.00 0.00 H new ATOM 0 HA GLN B 162 3.441 -12.056 4.406 1.00 0.00 H new ATOM 0 HB2 GLN B 162 1.058 -12.466 2.562 1.00 0.00 H new ATOM 0 HB3 GLN B 162 2.076 -13.715 3.252 1.00 0.00 H new ATOM 0 HG2 GLN B 162 0.246 -11.853 4.808 1.00 0.00 H new ATOM 0 HG3 GLN B 162 -0.080 -13.533 4.431 1.00 0.00 H new ATOM 0 HE21 GLN B 162 1.640 -15.102 5.333 1.00 0.00 H new ATOM 0 HE22 GLN B 162 2.300 -14.680 6.917 1.00 0.00 H new ATOM 1677 N LYS B 163 4.194 -12.711 1.919 1.00 0.00 N ATOM 1678 CA LYS B 163 4.993 -12.741 0.699 1.00 0.00 C ATOM 1679 C LYS B 163 4.140 -12.399 -0.518 1.00 0.00 C ATOM 1680 O LYS B 163 2.981 -12.802 -0.607 1.00 0.00 O ATOM 1681 CB LYS B 163 5.632 -14.119 0.517 1.00 0.00 C ATOM 1682 CG LYS B 163 6.858 -14.108 -0.378 1.00 0.00 C ATOM 1683 CD LYS B 163 7.514 -15.477 -0.446 1.00 0.00 C ATOM 1684 CE LYS B 163 8.970 -15.379 -0.873 1.00 0.00 C ATOM 1685 NZ LYS B 163 9.744 -16.591 -0.486 1.00 0.00 N ATOM 0 H LYS B 163 4.156 -13.599 2.420 1.00 0.00 H new ATOM 0 HA LYS B 163 5.780 -11.992 0.791 1.00 0.00 H new ATOM 0 HB2 LYS B 163 5.910 -14.513 1.495 1.00 0.00 H new ATOM 0 HB3 LYS B 163 4.892 -14.801 0.097 1.00 0.00 H new ATOM 0 HG2 LYS B 163 6.574 -13.790 -1.381 1.00 0.00 H new ATOM 0 HG3 LYS B 163 7.576 -13.378 -0.004 1.00 0.00 H new ATOM 0 HD2 LYS B 163 7.452 -15.960 0.529 1.00 0.00 H new ATOM 0 HD3 LYS B 163 6.970 -16.108 -1.149 1.00 0.00 H new ATOM 0 HE2 LYS B 163 9.023 -15.244 -1.953 1.00 0.00 H new ATOM 0 HE3 LYS B 163 9.423 -14.498 -0.419 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 10.732 -16.485 -0.795 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 9.715 -16.706 0.547 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 9.327 -17.429 -0.940 1.00 0.00 H new ATOM 1699 N GLU B 164 4.722 -11.654 -1.453 1.00 0.00 N ATOM 1700 CA GLU B 164 4.015 -11.259 -2.665 1.00 0.00 C ATOM 1701 C GLU B 164 2.829 -10.358 -2.333 1.00 0.00 C ATOM 1702 O GLU B 164 1.782 -10.430 -2.978 1.00 0.00 O ATOM 1703 CB GLU B 164 3.533 -12.496 -3.426 1.00 0.00 C ATOM 1704 CG GLU B 164 4.583 -13.589 -3.540 1.00 0.00 C ATOM 1705 CD GLU B 164 4.158 -14.712 -4.464 1.00 0.00 C ATOM 1706 OE1 GLU B 164 3.432 -14.434 -5.442 1.00 0.00 O ATOM 1707 OE2 GLU B 164 4.549 -15.870 -4.210 1.00 0.00 O ATOM 0 H GLU B 164 5.681 -11.312 -1.394 1.00 0.00 H new ATOM 0 HA GLU B 164 4.708 -10.701 -3.295 1.00 0.00 H new ATOM 0 HB2 GLU B 164 2.653 -12.900 -2.925 1.00 0.00 H new ATOM 0 HB3 GLU B 164 3.221 -12.198 -4.427 1.00 0.00 H new ATOM 0 HG2 GLU B 164 5.514 -13.156 -3.905 1.00 0.00 H new ATOM 0 HG3 GLU B 164 4.787 -13.996 -2.550 1.00 0.00 H new ATOM 1714 N SER B 165 3.000 -9.511 -1.323 1.00 0.00 N ATOM 1715 CA SER B 165 1.944 -8.599 -0.902 1.00 0.00 C ATOM 1716 C SER B 165 1.679 -7.545 -1.973 1.00 0.00 C ATOM 1717 O SER B 165 2.601 -6.885 -2.453 1.00 0.00 O ATOM 1718 CB SER B 165 2.321 -7.922 0.416 1.00 0.00 C ATOM 1719 OG SER B 165 1.846 -8.664 1.526 1.00 0.00 O ATOM 0 H SER B 165 3.861 -9.438 -0.781 1.00 0.00 H new ATOM 0 HA SER B 165 1.033 -9.179 -0.755 1.00 0.00 H new ATOM 0 HB2 SER B 165 3.404 -7.821 0.479 1.00 0.00 H new ATOM 0 HB3 SER B 165 1.905 -6.915 0.443 1.00 0.00 H new ATOM 0 HG SER B 165 2.328 -9.515 1.581 1.00 0.00 H new ATOM 1725 N THR B 166 0.411 -7.390 -2.341 1.00 0.00 N ATOM 1726 CA THR B 166 0.022 -6.417 -3.354 1.00 0.00 C ATOM 1727 C THR B 166 -0.375 -5.090 -2.718 1.00 0.00 C ATOM 1728 O THR B 166 -1.514 -4.915 -2.284 1.00 0.00 O ATOM 1729 CB THR B 166 -1.149 -6.935 -4.210 1.00 0.00 C ATOM 1730 OG1 THR B 166 -1.111 -8.364 -4.280 1.00 0.00 O ATOM 1731 CG2 THR B 166 -1.093 -6.351 -5.614 1.00 0.00 C ATOM 0 H THR B 166 -0.365 -7.926 -1.952 1.00 0.00 H new ATOM 0 HA THR B 166 0.890 -6.264 -3.995 1.00 0.00 H new ATOM 0 HB THR B 166 -2.081 -6.620 -3.740 1.00 0.00 H new ATOM 0 HG1 THR B 166 -1.860 -8.685 -4.825 1.00 0.00 H new ATOM 0 HG21 THR B 166 -1.930 -6.731 -6.200 1.00 0.00 H new ATOM 0 HG22 THR B 166 -1.153 -5.264 -5.559 1.00 0.00 H new ATOM 0 HG23 THR B 166 -0.156 -6.639 -6.091 1.00 0.00 H new ATOM 1739 N LEU B 167 0.570 -4.158 -2.666 1.00 0.00 N ATOM 1740 CA LEU B 167 0.318 -2.844 -2.084 1.00 0.00 C ATOM 1741 C LEU B 167 0.219 -1.777 -3.169 1.00 0.00 C ATOM 1742 O LEU B 167 0.582 -2.013 -4.322 1.00 0.00 O ATOM 1743 CB LEU B 167 1.428 -2.481 -1.097 1.00 0.00 C ATOM 1744 CG LEU B 167 1.646 -3.460 0.058 1.00 0.00 C ATOM 1745 CD1 LEU B 167 2.657 -4.528 -0.331 1.00 0.00 C ATOM 1746 CD2 LEU B 167 2.104 -2.719 1.306 1.00 0.00 C ATOM 0 H LEU B 167 1.518 -4.288 -3.020 1.00 0.00 H new ATOM 0 HA LEU B 167 -0.633 -2.886 -1.554 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.363 -2.389 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU B 167 1.207 -1.499 -0.678 1.00 0.00 H new ATOM 0 HG LEU B 167 0.697 -3.950 0.278 1.00 0.00 H new ATOM 0 HD11 LEU B 167 2.799 -5.215 0.503 1.00 0.00 H new ATOM 0 HD12 LEU B 167 2.289 -5.079 -1.197 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.608 -4.056 -0.578 1.00 0.00 H new ATOM 0 HD21 LEU B 167 2.254 -3.431 2.117 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.041 -2.202 1.099 1.00 0.00 H new ATOM 0 HD23 LEU B 167 1.345 -1.992 1.597 1.00 0.00 H new ATOM 1758 N HIS B 168 -0.274 -0.601 -2.793 1.00 0.00 N ATOM 1759 CA HIS B 168 -0.418 0.504 -3.733 1.00 0.00 C ATOM 1760 C HIS B 168 0.482 1.672 -3.343 1.00 0.00 C ATOM 1761 O HIS B 168 1.064 1.684 -2.257 1.00 0.00 O ATOM 1762 CB HIS B 168 -1.875 0.965 -3.791 1.00 0.00 C ATOM 1763 CG HIS B 168 -2.814 -0.078 -4.314 1.00 0.00 C ATOM 1764 ND1 HIS B 168 -3.522 -1.034 -3.670 1.00 0.00 N flip ATOM 1765 CD2 HIS B 168 -3.111 -0.220 -5.653 1.00 0.00 C flip ATOM 1766 CE1 HIS B 168 -4.228 -1.729 -4.621 1.00 0.00 C flip ATOM 1767 NE2 HIS B 168 -3.962 -1.217 -5.810 1.00 0.00 N flip ATOM 0 H HIS B 168 -0.580 -0.389 -1.843 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.116 0.150 -4.719 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -2.194 1.260 -2.791 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.942 1.851 -4.422 1.00 0.00 H new ATOM 0 HD2 HIS B 168 -2.710 0.389 -6.449 1.00 0.00 H new ATOM 0 HE1 HIS B 168 -4.892 -2.559 -4.429 1.00 0.00 H new ATOM 0 HE2 HIS B 168 -4.348 -1.538 -6.698 1.00 0.00 H new ATOM 1775 N LEU B 169 0.594 2.650 -4.233 1.00 0.00 N ATOM 1776 CA LEU B 169 1.425 3.823 -3.982 1.00 0.00 C ATOM 1777 C LEU B 169 0.606 5.105 -4.095 1.00 0.00 C ATOM 1778 O LEU B 169 -0.103 5.316 -5.079 1.00 0.00 O ATOM 1779 CB LEU B 169 2.595 3.863 -4.966 1.00 0.00 C ATOM 1780 CG LEU B 169 3.848 4.598 -4.489 1.00 0.00 C ATOM 1781 CD1 LEU B 169 3.548 6.071 -4.258 1.00 0.00 C ATOM 1782 CD2 LEU B 169 4.392 3.957 -3.221 1.00 0.00 C ATOM 0 H LEU B 169 0.120 2.655 -5.136 1.00 0.00 H new ATOM 0 HA LEU B 169 1.815 3.751 -2.967 1.00 0.00 H new ATOM 0 HB2 LEU B 169 2.871 2.838 -5.213 1.00 0.00 H new ATOM 0 HB3 LEU B 169 2.252 4.332 -5.888 1.00 0.00 H new ATOM 0 HG LEU B 169 4.609 4.521 -5.266 1.00 0.00 H new ATOM 0 HD11 LEU B 169 4.452 6.578 -3.919 1.00 0.00 H new ATOM 0 HD12 LEU B 169 3.206 6.523 -5.189 1.00 0.00 H new ATOM 0 HD13 LEU B 169 2.771 6.170 -3.500 1.00 0.00 H new ATOM 0 HD21 LEU B 169 5.284 4.493 -2.896 1.00 0.00 H new ATOM 0 HD22 LEU B 169 3.636 4.002 -2.437 1.00 0.00 H new ATOM 0 HD23 LEU B 169 4.647 2.916 -3.420 1.00 0.00 H new ATOM 1794 N VAL B 170 0.711 5.959 -3.082 1.00 0.00 N ATOM 1795 CA VAL B 170 -0.017 7.222 -3.068 1.00 0.00 C ATOM 1796 C VAL B 170 0.896 8.378 -2.675 1.00 0.00 C ATOM 1797 O VAL B 170 1.511 8.363 -1.607 1.00 0.00 O ATOM 1798 CB VAL B 170 -1.211 7.172 -2.097 1.00 0.00 C ATOM 1799 CG1 VAL B 170 -1.913 8.520 -2.043 1.00 0.00 C ATOM 1800 CG2 VAL B 170 -2.180 6.072 -2.502 1.00 0.00 C ATOM 0 H VAL B 170 1.293 5.799 -2.260 1.00 0.00 H new ATOM 0 HA VAL B 170 -0.389 7.384 -4.080 1.00 0.00 H new ATOM 0 HB VAL B 170 -0.836 6.945 -1.099 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -2.754 8.465 -1.352 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -1.212 9.282 -1.702 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -2.277 8.781 -3.037 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -3.018 6.051 -1.805 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -2.550 6.266 -3.509 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -1.667 5.110 -2.483 1.00 0.00 H new ATOM 1810 N LEU B 171 0.981 9.380 -3.544 1.00 0.00 N ATOM 1811 CA LEU B 171 1.819 10.547 -3.287 1.00 0.00 C ATOM 1812 C LEU B 171 0.967 11.763 -2.937 1.00 0.00 C ATOM 1813 O LEU B 171 0.157 12.217 -3.743 1.00 0.00 O ATOM 1814 CB LEU B 171 2.688 10.852 -4.508 1.00 0.00 C ATOM 1815 CG LEU B 171 4.138 10.369 -4.438 1.00 0.00 C ATOM 1816 CD1 LEU B 171 4.313 9.090 -5.241 1.00 0.00 C ATOM 1817 CD2 LEU B 171 5.084 11.451 -4.940 1.00 0.00 C ATOM 0 H LEU B 171 0.480 9.408 -4.432 1.00 0.00 H new ATOM 0 HA LEU B 171 2.463 10.322 -2.437 1.00 0.00 H new ATOM 0 HB2 LEU B 171 2.219 10.404 -5.384 1.00 0.00 H new ATOM 0 HB3 LEU B 171 2.693 11.931 -4.665 1.00 0.00 H new ATOM 0 HG LEU B 171 4.381 10.156 -3.397 1.00 0.00 H new ATOM 0 HD11 LEU B 171 5.350 8.761 -5.180 1.00 0.00 H new ATOM 0 HD12 LEU B 171 3.662 8.315 -4.837 1.00 0.00 H new ATOM 0 HD13 LEU B 171 4.052 9.276 -6.283 1.00 0.00 H new ATOM 0 HD21 LEU B 171 6.111 11.091 -4.883 1.00 0.00 H new ATOM 0 HD22 LEU B 171 4.841 11.695 -5.974 1.00 0.00 H new ATOM 0 HD23 LEU B 171 4.977 12.343 -4.322 1.00 0.00 H new ATOM 1829 N ARG B 172 1.159 12.285 -1.730 1.00 0.00 N ATOM 1830 CA ARG B 172 0.409 13.449 -1.274 1.00 0.00 C ATOM 1831 C ARG B 172 1.320 14.667 -1.148 1.00 0.00 C ATOM 1832 O ARG B 172 1.725 15.042 -0.046 1.00 0.00 O ATOM 1833 CB ARG B 172 -0.259 13.156 0.071 1.00 0.00 C ATOM 1834 CG ARG B 172 -1.537 13.947 0.300 1.00 0.00 C ATOM 1835 CD ARG B 172 -1.241 15.406 0.613 1.00 0.00 C ATOM 1836 NE ARG B 172 -0.328 15.549 1.743 1.00 0.00 N ATOM 1837 CZ ARG B 172 -0.713 15.480 3.013 1.00 0.00 C ATOM 1838 NH1 ARG B 172 -1.988 15.271 3.312 1.00 0.00 N ATOM 1839 NH2 ARG B 172 0.178 15.621 3.987 1.00 0.00 N ATOM 0 H ARG B 172 1.827 11.921 -1.051 1.00 0.00 H new ATOM 0 HA ARG B 172 -0.361 13.668 -2.014 1.00 0.00 H new ATOM 0 HB2 ARG B 172 -0.485 12.091 0.131 1.00 0.00 H new ATOM 0 HB3 ARG B 172 0.445 13.378 0.873 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -2.168 13.885 -0.586 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -2.098 13.504 1.123 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -0.808 15.885 -0.265 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -2.173 15.926 0.832 1.00 0.00 H new ATOM 0 HE ARG B 172 0.660 15.711 1.547 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -2.676 15.163 2.566 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -2.281 15.218 4.288 1.00 0.00 H new ATOM 0 HH21 ARG B 172 1.159 15.783 3.761 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -0.119 15.568 4.961 1.00 0.00 H new ATOM 1853 N LEU B 173 1.638 15.281 -2.282 1.00 0.00 N ATOM 1854 CA LEU B 173 2.502 16.456 -2.299 1.00 0.00 C ATOM 1855 C LEU B 173 2.006 17.510 -1.314 1.00 0.00 C ATOM 1856 O LEU B 173 0.836 17.890 -1.333 1.00 0.00 O ATOM 1857 CB LEU B 173 2.563 17.048 -3.709 1.00 0.00 C ATOM 1858 CG LEU B 173 3.613 16.447 -4.645 1.00 0.00 C ATOM 1859 CD1 LEU B 173 3.333 16.844 -6.085 1.00 0.00 C ATOM 1860 CD2 LEU B 173 5.010 16.884 -4.229 1.00 0.00 C ATOM 0 H LEU B 173 1.311 14.985 -3.202 1.00 0.00 H new ATOM 0 HA LEU B 173 3.503 16.146 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU B 173 1.583 16.932 -4.173 1.00 0.00 H new ATOM 0 HB3 LEU B 173 2.751 18.118 -3.624 1.00 0.00 H new ATOM 0 HG LEU B 173 3.558 15.361 -4.573 1.00 0.00 H new ATOM 0 HD11 LEU B 173 4.090 16.407 -6.737 1.00 0.00 H new ATOM 0 HD12 LEU B 173 2.348 16.480 -6.378 1.00 0.00 H new ATOM 0 HD13 LEU B 173 3.360 17.930 -6.175 1.00 0.00 H new ATOM 0 HD21 LEU B 173 5.744 16.447 -4.906 1.00 0.00 H new ATOM 0 HD22 LEU B 173 5.079 17.971 -4.271 1.00 0.00 H new ATOM 0 HD23 LEU B 173 5.209 16.547 -3.212 1.00 0.00 H new ATOM 1872 N ARG B 174 2.906 17.980 -0.456 1.00 0.00 N ATOM 1873 CA ARG B 174 2.560 18.991 0.536 1.00 0.00 C ATOM 1874 C ARG B 174 2.259 20.329 -0.133 1.00 0.00 C ATOM 1875 O ARG B 174 1.234 20.953 0.137 1.00 0.00 O ATOM 1876 CB ARG B 174 3.700 19.157 1.543 1.00 0.00 C ATOM 1877 CG ARG B 174 3.288 19.883 2.814 1.00 0.00 C ATOM 1878 CD ARG B 174 4.378 19.815 3.872 1.00 0.00 C ATOM 1879 NE ARG B 174 3.836 19.929 5.224 1.00 0.00 N ATOM 1880 CZ ARG B 174 4.574 20.222 6.289 1.00 0.00 C ATOM 1881 NH1 ARG B 174 5.877 20.431 6.160 1.00 0.00 N ATOM 1882 NH2 ARG B 174 4.007 20.308 7.486 1.00 0.00 N ATOM 0 H ARG B 174 3.880 17.677 -0.428 1.00 0.00 H new ATOM 0 HA ARG B 174 1.665 18.658 1.061 1.00 0.00 H new ATOM 0 HB2 ARG B 174 4.088 18.173 1.806 1.00 0.00 H new ATOM 0 HB3 ARG B 174 4.515 19.704 1.070 1.00 0.00 H new ATOM 0 HG2 ARG B 174 3.067 20.925 2.584 1.00 0.00 H new ATOM 0 HG3 ARG B 174 2.371 19.442 3.205 1.00 0.00 H new ATOM 0 HD2 ARG B 174 4.918 18.873 3.776 1.00 0.00 H new ATOM 0 HD3 ARG B 174 5.099 20.615 3.702 1.00 0.00 H new ATOM 0 HE ARG B 174 2.837 19.775 5.357 1.00 0.00 H new ATOM 0 HH11 ARG B 174 6.315 20.367 5.241 1.00 0.00 H new ATOM 0 HH12 ARG B 174 6.441 20.656 6.980 1.00 0.00 H new ATOM 0 HH21 ARG B 174 3.005 20.149 7.588 1.00 0.00 H new ATOM 0 HH22 ARG B 174 4.574 20.533 8.304 1.00 0.00 H new ATOM 1896 N GLY B 175 3.162 20.763 -1.009 1.00 0.00 N ATOM 1897 CA GLY B 175 2.975 22.025 -1.702 1.00 0.00 C ATOM 1898 C GLY B 175 4.198 22.915 -1.626 1.00 0.00 C ATOM 1899 O GLY B 175 4.175 23.959 -0.974 1.00 0.00 O ATOM 0 H GLY B 175 4.018 20.264 -1.250 1.00 0.00 H new ATOM 0 HA2 GLY B 175 2.736 21.830 -2.747 1.00 0.00 H new ATOM 0 HA3 GLY B 175 2.121 22.549 -1.272 1.00 0.00 H new ATOM 1903 N GLY B 176 5.272 22.503 -2.293 1.00 0.00 N ATOM 1904 CA GLY B 176 6.496 23.281 -2.283 1.00 0.00 C ATOM 1905 C GLY B 176 7.722 22.430 -2.021 1.00 0.00 C ATOM 1906 O GLY B 176 8.430 22.046 -2.952 1.00 0.00 O ATOM 0 H GLY B 176 5.316 21.643 -2.840 1.00 0.00 H new ATOM 0 HA2 GLY B 176 6.608 23.789 -3.241 1.00 0.00 H new ATOM 0 HA3 GLY B 176 6.425 24.055 -1.519 1.00 0.00 H new TER 1910 GLY B 176 HETATM 1911 ZN ZN A 101 -13.208 7.205 -2.803 1.00 0.00 ZN