USER MOD reduce.3.24.130724 H: found=0, std=0, add=1026, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1027 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 129 SER OG : rot -64:sc= 1.28 USER MOD Set 1.2: A 142 HIS : no HD1:sc= -3.35! C(o=-2.1!,f=-9!) USER MOD Set 2.1: A 42 HIS : no HE2:sc= -0.133 K(o=0.55,f=-3.9) USER MOD Set 2.2: A 94 SER OG : rot -121:sc= 0.682 USER MOD Set 3.1: A 61 SER OG : rot 106:sc= 0.697 USER MOD Set 3.2: A 84 HIS : no HD1:sc= -2.06 K(o=-1.4,f=-0.32) USER MOD Set 4.1: A 58 THR OG1 : rot 131:sc= 0.623 USER MOD Set 4.2: A 60 LYS NZ :NH3+ 179:sc= 1.99 (180deg=1.22) USER MOD Single : A 37 TYR OH : rot -100:sc= -2.05! USER MOD Single : A 38 CYS SG : rot -130:sc= -4.31! USER MOD Single : A 40 GLN : amide:sc= -3.74! C(o=-3.7!,f=-6.5!) USER MOD Single : A 41 LYS NZ :NH3+ -160:sc= -0.0053 (180deg=-0.11) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= 0.483 K(o=0.48,f=-2.7!) USER MOD Single : A 49 TYR OH : rot 6:sc= 0.822 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 158:sc= -1.25 USER MOD Single : A 75 LYS NZ :NH3+ -169:sc= -0.0153 (180deg=-0.149) USER MOD Single : A 80 GLN : amide:sc= -2.33! C(o=-2.3!,f=-2!) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0.676 K(o=0.68,f=-0.032) USER MOD Single : A 99 HIS : no HD1:sc= -0.0416 X(o=-0.042,f=0) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -157:sc= -0.231 (180deg=-0.922) USER MOD Single : A 127 HIS : no HD1:sc= 0.944 K(o=0.94,f=-6.1!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot 109:sc= -2.39! USER MOD Single : A 147 ASN : amide:sc= 0.152 X(o=0.15,f=-0.014) USER MOD Single : A 151 LYS NZ :NH3+ -169:sc= -0.017 (180deg=-0.174) USER MOD Single : A 152 GLN : amide:sc=-0.000858 K(o=-0.00086,f=-0.88) USER MOD Single : A 153 SER OG : rot 180:sc= -0.01 USER MOD Single : A 154 GLN : amide:sc= -6.4! K(o=-6.4!,f=-1.5) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -143:sc= 1.26 (180deg=0.968) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 33 9.891 -13.643 2.903 1.00 0.00 N ATOM 2 CA GLY A 33 8.832 -13.688 3.889 1.00 0.00 C ATOM 3 C GLY A 33 9.205 -12.929 5.135 1.00 0.00 C ATOM 4 O GLY A 33 9.069 -13.417 6.255 1.00 0.00 O ATOM 0 HA2 GLY A 33 7.920 -13.267 3.465 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.615 -14.725 4.145 1.00 0.00 H new ATOM 8 N LEU A 34 9.717 -11.737 4.910 1.00 0.00 N ATOM 9 CA LEU A 34 10.100 -10.832 5.973 1.00 0.00 C ATOM 10 C LEU A 34 8.867 -10.060 6.420 1.00 0.00 C ATOM 11 O LEU A 34 7.806 -10.652 6.628 1.00 0.00 O ATOM 12 CB LEU A 34 11.189 -9.882 5.469 1.00 0.00 C ATOM 13 CG LEU A 34 12.024 -10.440 4.313 1.00 0.00 C ATOM 14 CD1 LEU A 34 11.514 -9.923 2.983 1.00 0.00 C ATOM 15 CD2 LEU A 34 13.498 -10.123 4.501 1.00 0.00 C ATOM 0 H LEU A 34 9.881 -11.366 3.974 1.00 0.00 H new ATOM 0 HA LEU A 34 10.500 -11.386 6.822 1.00 0.00 H new ATOM 0 HB2 LEU A 34 10.723 -8.950 5.149 1.00 0.00 H new ATOM 0 HB3 LEU A 34 11.854 -9.637 6.297 1.00 0.00 H new ATOM 0 HG LEU A 34 11.919 -11.525 4.312 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.122 -10.332 2.176 1.00 0.00 H new ATOM 0 HD12 LEU A 34 10.477 -10.229 2.847 1.00 0.00 H new ATOM 0 HD13 LEU A 34 11.576 -8.835 2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 34 14.067 -10.531 3.666 1.00 0.00 H new ATOM 0 HD22 LEU A 34 13.636 -9.042 4.541 1.00 0.00 H new ATOM 0 HD23 LEU A 34 13.850 -10.568 5.432 1.00 0.00 H new ATOM 27 N LEU A 35 9.028 -8.757 6.615 1.00 0.00 N ATOM 28 CA LEU A 35 7.898 -7.858 6.847 1.00 0.00 C ATOM 29 C LEU A 35 6.782 -8.178 5.849 1.00 0.00 C ATOM 30 O LEU A 35 7.055 -8.441 4.673 1.00 0.00 O ATOM 31 CB LEU A 35 8.342 -6.395 6.682 1.00 0.00 C ATOM 32 CG LEU A 35 9.245 -5.807 7.788 1.00 0.00 C ATOM 33 CD1 LEU A 35 10.459 -6.679 8.061 1.00 0.00 C ATOM 34 CD2 LEU A 35 9.711 -4.417 7.392 1.00 0.00 C ATOM 0 H LEU A 35 9.937 -8.294 6.617 1.00 0.00 H new ATOM 0 HA LEU A 35 7.530 -7.999 7.863 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.869 -6.306 5.732 1.00 0.00 H new ATOM 0 HB3 LEU A 35 7.448 -5.776 6.610 1.00 0.00 H new ATOM 0 HG LEU A 35 8.649 -5.762 8.700 1.00 0.00 H new ATOM 0 HD11 LEU A 35 11.064 -6.225 8.846 1.00 0.00 H new ATOM 0 HD12 LEU A 35 10.132 -7.668 8.381 1.00 0.00 H new ATOM 0 HD13 LEU A 35 11.053 -6.770 7.152 1.00 0.00 H new ATOM 0 HD21 LEU A 35 10.347 -4.009 8.177 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.275 -4.474 6.461 1.00 0.00 H new ATOM 0 HD23 LEU A 35 8.846 -3.769 7.253 1.00 0.00 H new ATOM 46 N ARG A 36 5.541 -8.182 6.311 1.00 0.00 N ATOM 47 CA ARG A 36 4.427 -8.586 5.461 1.00 0.00 C ATOM 48 C ARG A 36 3.737 -7.380 4.853 1.00 0.00 C ATOM 49 O ARG A 36 3.631 -6.326 5.479 1.00 0.00 O ATOM 50 CB ARG A 36 3.382 -9.402 6.231 1.00 0.00 C ATOM 51 CG ARG A 36 3.929 -10.621 6.957 1.00 0.00 C ATOM 52 CD ARG A 36 4.354 -10.280 8.376 1.00 0.00 C ATOM 53 NE ARG A 36 5.804 -10.299 8.552 1.00 0.00 N ATOM 54 CZ ARG A 36 6.439 -9.668 9.537 1.00 0.00 C ATOM 55 NH1 ARG A 36 5.782 -8.837 10.337 1.00 0.00 N ATOM 56 NH2 ARG A 36 7.743 -9.835 9.697 1.00 0.00 N ATOM 0 H ARG A 36 5.279 -7.913 7.260 1.00 0.00 H new ATOM 0 HA ARG A 36 4.855 -9.207 4.674 1.00 0.00 H new ATOM 0 HB2 ARG A 36 2.898 -8.751 6.959 1.00 0.00 H new ATOM 0 HB3 ARG A 36 2.611 -9.729 5.533 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.169 -11.402 6.981 1.00 0.00 H new ATOM 0 HG3 ARG A 36 4.781 -11.021 6.407 1.00 0.00 H new ATOM 0 HD2 ARG A 36 3.974 -9.292 8.637 1.00 0.00 H new ATOM 0 HD3 ARG A 36 3.899 -10.990 9.067 1.00 0.00 H new ATOM 0 HE ARG A 36 6.362 -10.827 7.881 1.00 0.00 H new ATOM 0 HH11 ARG A 36 4.784 -8.679 10.199 1.00 0.00 H new ATOM 0 HH12 ARG A 36 6.275 -8.357 11.090 1.00 0.00 H new ATOM 0 HH21 ARG A 36 8.260 -10.447 9.066 1.00 0.00 H new ATOM 0 HH22 ARG A 36 8.230 -9.352 10.452 1.00 0.00 H new ATOM 70 N TYR A 37 3.279 -7.534 3.627 1.00 0.00 N ATOM 71 CA TYR A 37 2.446 -6.532 3.002 1.00 0.00 C ATOM 72 C TYR A 37 1.264 -7.228 2.360 1.00 0.00 C ATOM 73 O TYR A 37 1.312 -8.433 2.095 1.00 0.00 O ATOM 74 CB TYR A 37 3.221 -5.707 1.961 1.00 0.00 C ATOM 75 CG TYR A 37 3.207 -6.282 0.563 1.00 0.00 C ATOM 76 CD1 TYR A 37 3.797 -7.507 0.279 1.00 0.00 C ATOM 77 CD2 TYR A 37 2.590 -5.596 -0.476 1.00 0.00 C ATOM 78 CE1 TYR A 37 3.775 -8.027 -0.999 1.00 0.00 C ATOM 79 CE2 TYR A 37 2.565 -6.111 -1.753 1.00 0.00 C ATOM 80 CZ TYR A 37 3.158 -7.323 -2.008 1.00 0.00 C ATOM 81 OH TYR A 37 3.128 -7.836 -3.279 1.00 0.00 O ATOM 0 H TYR A 37 3.472 -8.348 3.043 1.00 0.00 H new ATOM 0 HA TYR A 37 2.105 -5.830 3.763 1.00 0.00 H new ATOM 0 HB2 TYR A 37 2.803 -4.701 1.930 1.00 0.00 H new ATOM 0 HB3 TYR A 37 4.256 -5.612 2.290 1.00 0.00 H new ATOM 0 HD1 TYR A 37 4.280 -8.061 1.070 1.00 0.00 H new ATOM 0 HD2 TYR A 37 2.122 -4.643 -0.279 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.239 -8.980 -1.206 1.00 0.00 H new ATOM 0 HE2 TYR A 37 2.082 -5.565 -2.549 1.00 0.00 H new ATOM 0 HH TYR A 37 3.825 -7.409 -3.820 1.00 0.00 H new ATOM 91 N CYS A 38 0.211 -6.483 2.120 1.00 0.00 N ATOM 92 CA CYS A 38 -0.995 -7.048 1.556 1.00 0.00 C ATOM 93 C CYS A 38 -1.828 -5.953 0.925 1.00 0.00 C ATOM 94 O CYS A 38 -1.958 -4.875 1.488 1.00 0.00 O ATOM 95 CB CYS A 38 -1.785 -7.753 2.657 1.00 0.00 C ATOM 96 SG CYS A 38 -2.230 -6.665 4.027 1.00 0.00 S ATOM 0 H CYS A 38 0.164 -5.481 2.307 1.00 0.00 H new ATOM 0 HA CYS A 38 -0.735 -7.773 0.785 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -2.694 -8.176 2.228 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -1.196 -8.586 3.041 1.00 0.00 H new ATOM 0 HG CYS A 38 -1.896 -7.225 5.152 1.00 0.00 H new ATOM 102 N VAL A 39 -2.377 -6.211 -0.241 1.00 0.00 N ATOM 103 CA VAL A 39 -3.210 -5.226 -0.902 1.00 0.00 C ATOM 104 C VAL A 39 -4.597 -5.807 -1.162 1.00 0.00 C ATOM 105 O VAL A 39 -4.748 -6.976 -1.535 1.00 0.00 O ATOM 106 CB VAL A 39 -2.560 -4.689 -2.205 1.00 0.00 C ATOM 107 CG1 VAL A 39 -2.322 -5.799 -3.199 1.00 0.00 C ATOM 108 CG2 VAL A 39 -3.412 -3.599 -2.832 1.00 0.00 C ATOM 0 H VAL A 39 -2.264 -7.088 -0.750 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.312 -4.368 -0.237 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.595 -4.262 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.866 -5.389 -4.100 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.656 -6.543 -2.761 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.272 -6.268 -3.455 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.932 -3.241 -3.743 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -4.396 -4.000 -3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -3.519 -2.772 -2.130 1.00 0.00 H new ATOM 118 N GLN A 40 -5.602 -4.983 -0.939 1.00 0.00 N ATOM 119 CA GLN A 40 -6.984 -5.428 -0.952 1.00 0.00 C ATOM 120 C GLN A 40 -7.805 -4.603 -1.933 1.00 0.00 C ATOM 121 O GLN A 40 -7.537 -3.416 -2.134 1.00 0.00 O ATOM 122 CB GLN A 40 -7.562 -5.347 0.468 1.00 0.00 C ATOM 123 CG GLN A 40 -7.110 -6.500 1.356 1.00 0.00 C ATOM 124 CD GLN A 40 -7.369 -6.285 2.832 1.00 0.00 C ATOM 125 OE1 GLN A 40 -6.518 -5.776 3.555 1.00 0.00 O ATOM 126 NE2 GLN A 40 -8.543 -6.684 3.293 1.00 0.00 N ATOM 0 H GLN A 40 -5.485 -3.989 -0.744 1.00 0.00 H new ATOM 0 HA GLN A 40 -7.025 -6.465 -1.285 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -7.262 -4.404 0.924 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -8.651 -5.342 0.413 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -7.619 -7.410 1.038 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -6.043 -6.663 1.206 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -9.224 -7.103 2.660 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -8.767 -6.573 4.282 1.00 0.00 H new ATOM 135 N LYS A 41 -8.798 -5.231 -2.553 1.00 0.00 N ATOM 136 CA LYS A 41 -9.586 -4.563 -3.581 1.00 0.00 C ATOM 137 C LYS A 41 -11.070 -4.547 -3.234 1.00 0.00 C ATOM 138 O LYS A 41 -11.591 -5.487 -2.628 1.00 0.00 O ATOM 139 CB LYS A 41 -9.351 -5.223 -4.956 1.00 0.00 C ATOM 140 CG LYS A 41 -9.799 -6.680 -5.069 1.00 0.00 C ATOM 141 CD LYS A 41 -11.283 -6.798 -5.403 1.00 0.00 C ATOM 142 CE LYS A 41 -11.719 -8.247 -5.553 1.00 0.00 C ATOM 143 NZ LYS A 41 -11.087 -8.899 -6.727 1.00 0.00 N ATOM 0 H LYS A 41 -9.075 -6.194 -2.363 1.00 0.00 H new ATOM 0 HA LYS A 41 -9.254 -3.526 -3.631 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.874 -4.640 -5.714 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.288 -5.168 -5.189 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -9.213 -7.181 -5.840 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -9.597 -7.195 -4.130 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -11.870 -6.322 -4.618 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.491 -6.259 -6.328 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.461 -8.799 -4.649 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.803 -8.291 -5.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.639 -9.738 -6.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.060 -8.230 -7.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -10.118 -9.187 -6.484 1.00 0.00 H new ATOM 157 N HIS A 42 -11.728 -3.455 -3.611 1.00 0.00 N ATOM 158 CA HIS A 42 -13.170 -3.311 -3.478 1.00 0.00 C ATOM 159 C HIS A 42 -13.775 -3.077 -4.863 1.00 0.00 C ATOM 160 O HIS A 42 -13.922 -1.931 -5.300 1.00 0.00 O ATOM 161 CB HIS A 42 -13.496 -2.136 -2.544 1.00 0.00 C ATOM 162 CG HIS A 42 -14.948 -2.006 -2.177 1.00 0.00 C ATOM 163 ND1 HIS A 42 -15.419 -1.031 -1.327 1.00 0.00 N ATOM 164 CD2 HIS A 42 -16.032 -2.728 -2.548 1.00 0.00 C ATOM 165 CE1 HIS A 42 -16.724 -1.155 -1.194 1.00 0.00 C ATOM 166 NE2 HIS A 42 -17.124 -2.179 -1.924 1.00 0.00 N ATOM 0 H HIS A 42 -11.270 -2.640 -4.020 1.00 0.00 H new ATOM 0 HA HIS A 42 -13.594 -4.218 -3.047 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -12.913 -2.245 -1.629 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -13.172 -1.211 -3.021 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -14.846 -0.322 -0.870 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -16.036 -3.579 -3.213 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -17.359 -0.525 -0.589 1.00 0.00 H new ATOM 175 N ASP A 43 -14.125 -4.161 -5.544 1.00 0.00 N ATOM 176 CA ASP A 43 -14.591 -4.088 -6.931 1.00 0.00 C ATOM 177 C ASP A 43 -16.099 -3.844 -6.981 1.00 0.00 C ATOM 178 O ASP A 43 -16.861 -4.686 -7.446 1.00 0.00 O ATOM 179 CB ASP A 43 -14.244 -5.389 -7.668 1.00 0.00 C ATOM 180 CG ASP A 43 -14.252 -5.247 -9.182 1.00 0.00 C ATOM 181 OD1 ASP A 43 -15.341 -5.149 -9.783 1.00 0.00 O ATOM 182 OD2 ASP A 43 -13.155 -5.265 -9.785 1.00 0.00 O ATOM 0 H ASP A 43 -14.096 -5.106 -5.161 1.00 0.00 H new ATOM 0 HA ASP A 43 -14.090 -3.253 -7.422 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -13.259 -5.727 -7.348 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.956 -6.162 -7.379 1.00 0.00 H new ATOM 187 N ALA A 44 -16.523 -2.687 -6.496 1.00 0.00 N ATOM 188 CA ALA A 44 -17.944 -2.342 -6.447 1.00 0.00 C ATOM 189 C ALA A 44 -18.266 -1.257 -7.466 1.00 0.00 C ATOM 190 O ALA A 44 -17.549 -1.102 -8.459 1.00 0.00 O ATOM 191 CB ALA A 44 -18.311 -1.875 -5.046 1.00 0.00 C ATOM 0 H ALA A 44 -15.904 -1.965 -6.128 1.00 0.00 H new ATOM 0 HA ALA A 44 -18.530 -3.227 -6.693 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -19.370 -1.619 -5.014 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -18.109 -2.673 -4.332 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -17.718 -0.998 -4.788 1.00 0.00 H new ATOM 197 N SER A 45 -19.350 -0.523 -7.227 1.00 0.00 N ATOM 198 CA SER A 45 -19.702 0.624 -8.052 1.00 0.00 C ATOM 199 C SER A 45 -18.545 1.619 -8.076 1.00 0.00 C ATOM 200 O SER A 45 -18.238 2.222 -9.106 1.00 0.00 O ATOM 201 CB SER A 45 -20.970 1.279 -7.506 1.00 0.00 C ATOM 202 OG SER A 45 -22.013 0.326 -7.389 1.00 0.00 O ATOM 0 H SER A 45 -20.001 -0.706 -6.464 1.00 0.00 H new ATOM 0 HA SER A 45 -19.893 0.295 -9.073 1.00 0.00 H new ATOM 0 HB2 SER A 45 -20.766 1.724 -6.532 1.00 0.00 H new ATOM 0 HB3 SER A 45 -21.282 2.088 -8.167 1.00 0.00 H new ATOM 0 HG SER A 45 -22.817 0.762 -7.036 1.00 0.00 H new ATOM 208 N ARG A 46 -17.909 1.785 -6.928 1.00 0.00 N ATOM 209 CA ARG A 46 -16.653 2.499 -6.851 1.00 0.00 C ATOM 210 C ARG A 46 -15.527 1.490 -6.718 1.00 0.00 C ATOM 211 O ARG A 46 -15.459 0.749 -5.735 1.00 0.00 O ATOM 212 CB ARG A 46 -16.640 3.463 -5.665 1.00 0.00 C ATOM 213 CG ARG A 46 -15.310 4.177 -5.478 1.00 0.00 C ATOM 214 CD ARG A 46 -15.335 5.097 -4.270 1.00 0.00 C ATOM 215 NE ARG A 46 -16.298 6.184 -4.428 1.00 0.00 N ATOM 216 CZ ARG A 46 -16.587 7.066 -3.474 1.00 0.00 C ATOM 217 NH1 ARG A 46 -16.009 6.977 -2.280 1.00 0.00 N ATOM 218 NH2 ARG A 46 -17.464 8.034 -3.710 1.00 0.00 N ATOM 0 H ARG A 46 -18.248 1.431 -6.033 1.00 0.00 H new ATOM 0 HA ARG A 46 -16.521 3.089 -7.758 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -17.426 4.206 -5.802 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -16.878 2.911 -4.756 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -14.515 3.441 -5.359 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -15.078 4.756 -6.372 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -15.584 4.519 -3.380 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -14.341 5.514 -4.112 1.00 0.00 H new ATOM 0 HE ARG A 46 -16.778 6.272 -5.324 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -15.340 6.230 -2.091 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -16.234 7.656 -1.553 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -17.916 8.102 -4.622 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.686 8.710 -2.979 1.00 0.00 H new ATOM 232 N LEU A 47 -14.663 1.438 -7.718 1.00 0.00 N ATOM 233 CA LEU A 47 -13.552 0.503 -7.717 1.00 0.00 C ATOM 234 C LEU A 47 -12.450 0.987 -6.785 1.00 0.00 C ATOM 235 O LEU A 47 -11.423 1.505 -7.229 1.00 0.00 O ATOM 236 CB LEU A 47 -13.010 0.323 -9.137 1.00 0.00 C ATOM 237 CG LEU A 47 -14.012 -0.239 -10.148 1.00 0.00 C ATOM 238 CD1 LEU A 47 -13.399 -0.276 -11.536 1.00 0.00 C ATOM 239 CD2 LEU A 47 -14.464 -1.631 -9.735 1.00 0.00 C ATOM 0 H LEU A 47 -14.711 2.035 -8.544 1.00 0.00 H new ATOM 0 HA LEU A 47 -13.909 -0.461 -7.356 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -12.655 1.288 -9.499 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -12.146 -0.340 -9.098 1.00 0.00 H new ATOM 0 HG LEU A 47 -14.883 0.416 -10.168 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -14.124 -0.678 -12.243 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -13.119 0.734 -11.837 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -12.512 -0.910 -11.525 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -15.176 -2.014 -10.466 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -13.601 -2.295 -9.687 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -14.940 -1.583 -8.755 1.00 0.00 H new ATOM 251 N HIS A 48 -12.676 0.824 -5.492 1.00 0.00 N ATOM 252 CA HIS A 48 -11.711 1.242 -4.491 1.00 0.00 C ATOM 253 C HIS A 48 -10.606 0.203 -4.379 1.00 0.00 C ATOM 254 O HIS A 48 -10.853 -0.996 -4.484 1.00 0.00 O ATOM 255 CB HIS A 48 -12.401 1.472 -3.135 1.00 0.00 C ATOM 256 CG HIS A 48 -11.460 1.571 -1.963 1.00 0.00 C ATOM 257 ND1 HIS A 48 -10.707 2.687 -1.683 1.00 0.00 N ATOM 258 CD2 HIS A 48 -11.145 0.662 -1.011 1.00 0.00 C ATOM 259 CE1 HIS A 48 -9.968 2.459 -0.613 1.00 0.00 C ATOM 260 NE2 HIS A 48 -10.212 1.236 -0.185 1.00 0.00 N ATOM 0 H HIS A 48 -13.523 0.403 -5.111 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.266 2.189 -4.797 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -12.988 2.389 -3.191 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -13.101 0.656 -2.955 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -11.554 -0.333 -0.918 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.278 3.158 -0.163 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -9.780 0.791 0.625 1.00 0.00 H new ATOM 269 N TYR A 49 -9.396 0.675 -4.183 1.00 0.00 N ATOM 270 CA TYR A 49 -8.236 -0.186 -4.102 1.00 0.00 C ATOM 271 C TYR A 49 -7.258 0.430 -3.114 1.00 0.00 C ATOM 272 O TYR A 49 -7.044 1.646 -3.135 1.00 0.00 O ATOM 273 CB TYR A 49 -7.619 -0.308 -5.501 1.00 0.00 C ATOM 274 CG TYR A 49 -6.559 -1.377 -5.654 1.00 0.00 C ATOM 275 CD1 TYR A 49 -6.898 -2.722 -5.672 1.00 0.00 C ATOM 276 CD2 TYR A 49 -5.225 -1.035 -5.823 1.00 0.00 C ATOM 277 CE1 TYR A 49 -5.935 -3.697 -5.850 1.00 0.00 C ATOM 278 CE2 TYR A 49 -4.258 -2.001 -5.995 1.00 0.00 C ATOM 279 CZ TYR A 49 -4.616 -3.329 -6.012 1.00 0.00 C ATOM 280 OH TYR A 49 -3.653 -4.292 -6.196 1.00 0.00 O ATOM 0 H TYR A 49 -9.187 1.668 -4.075 1.00 0.00 H new ATOM 0 HA TYR A 49 -8.501 -1.185 -3.756 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -8.418 -0.508 -6.215 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -7.183 0.653 -5.772 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -7.931 -3.012 -5.545 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.940 0.007 -5.820 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -6.214 -4.740 -5.862 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -3.223 -1.717 -6.116 1.00 0.00 H new ATOM 0 HH TYR A 49 -4.081 -5.169 -6.286 1.00 0.00 H new ATOM 290 N ASP A 50 -6.693 -0.371 -2.228 1.00 0.00 N ATOM 291 CA ASP A 50 -5.791 0.175 -1.231 1.00 0.00 C ATOM 292 C ASP A 50 -4.794 -0.877 -0.769 1.00 0.00 C ATOM 293 O ASP A 50 -5.138 -2.042 -0.551 1.00 0.00 O ATOM 294 CB ASP A 50 -6.567 0.804 -0.050 1.00 0.00 C ATOM 295 CG ASP A 50 -7.170 -0.199 0.918 1.00 0.00 C ATOM 296 OD1 ASP A 50 -6.458 -0.651 1.836 1.00 0.00 O ATOM 297 OD2 ASP A 50 -8.377 -0.502 0.792 1.00 0.00 O ATOM 0 H ASP A 50 -6.838 -1.379 -2.178 1.00 0.00 H new ATOM 0 HA ASP A 50 -5.221 0.980 -1.694 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.894 1.461 0.501 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -7.366 1.429 -0.449 1.00 0.00 H new ATOM 302 N PHE A 51 -3.548 -0.453 -0.678 1.00 0.00 N ATOM 303 CA PHE A 51 -2.447 -1.326 -0.315 1.00 0.00 C ATOM 304 C PHE A 51 -2.078 -1.117 1.145 1.00 0.00 C ATOM 305 O PHE A 51 -1.993 0.008 1.621 1.00 0.00 O ATOM 306 CB PHE A 51 -1.265 -1.063 -1.262 1.00 0.00 C ATOM 307 CG PHE A 51 0.068 -0.826 -0.599 1.00 0.00 C ATOM 308 CD1 PHE A 51 0.399 0.432 -0.121 1.00 0.00 C ATOM 309 CD2 PHE A 51 0.992 -1.852 -0.477 1.00 0.00 C ATOM 310 CE1 PHE A 51 1.621 0.662 0.472 1.00 0.00 C ATOM 311 CE2 PHE A 51 2.222 -1.623 0.112 1.00 0.00 C ATOM 312 CZ PHE A 51 2.534 -0.364 0.586 1.00 0.00 C ATOM 0 H PHE A 51 -3.269 0.512 -0.855 1.00 0.00 H new ATOM 0 HA PHE A 51 -2.737 -2.371 -0.423 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -1.168 -1.914 -1.936 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -1.503 -0.195 -1.877 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -0.310 1.242 -0.215 1.00 0.00 H new ATOM 0 HD2 PHE A 51 0.749 -2.838 -0.845 1.00 0.00 H new ATOM 0 HE1 PHE A 51 1.863 1.645 0.847 1.00 0.00 H new ATOM 0 HE2 PHE A 51 2.937 -2.427 0.201 1.00 0.00 H new ATOM 0 HZ PHE A 51 3.494 -0.183 1.046 1.00 0.00 H new ATOM 322 N ARG A 52 -1.871 -2.205 1.854 1.00 0.00 N ATOM 323 CA ARG A 52 -1.637 -2.144 3.280 1.00 0.00 C ATOM 324 C ARG A 52 -0.259 -2.683 3.625 1.00 0.00 C ATOM 325 O ARG A 52 0.035 -3.874 3.479 1.00 0.00 O ATOM 326 CB ARG A 52 -2.762 -2.882 4.000 1.00 0.00 C ATOM 327 CG ARG A 52 -4.108 -2.259 3.680 1.00 0.00 C ATOM 328 CD ARG A 52 -5.284 -3.104 4.120 1.00 0.00 C ATOM 329 NE ARG A 52 -6.532 -2.519 3.640 1.00 0.00 N ATOM 330 CZ ARG A 52 -7.741 -2.808 4.107 1.00 0.00 C ATOM 331 NH1 ARG A 52 -7.902 -3.745 5.038 1.00 0.00 N ATOM 332 NH2 ARG A 52 -8.796 -2.176 3.608 1.00 0.00 N ATOM 0 H ARG A 52 -1.860 -3.147 1.464 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.646 -1.108 3.618 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -2.762 -3.931 3.704 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -2.590 -2.855 5.076 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.172 -1.283 4.162 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.175 -2.089 2.605 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.177 -4.118 3.735 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.302 -3.177 5.207 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.471 -1.834 2.886 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.092 -4.249 5.400 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -8.835 -3.959 5.390 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.672 -1.478 2.875 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.730 -2.389 3.958 1.00 0.00 H new ATOM 346 N LEU A 53 0.577 -1.765 4.068 1.00 0.00 N ATOM 347 CA LEU A 53 1.982 -2.012 4.336 1.00 0.00 C ATOM 348 C LEU A 53 2.188 -2.281 5.828 1.00 0.00 C ATOM 349 O LEU A 53 2.097 -1.366 6.645 1.00 0.00 O ATOM 350 CB LEU A 53 2.747 -0.762 3.888 1.00 0.00 C ATOM 351 CG LEU A 53 4.269 -0.805 3.943 1.00 0.00 C ATOM 352 CD1 LEU A 53 4.814 -1.816 2.953 1.00 0.00 C ATOM 353 CD2 LEU A 53 4.827 0.577 3.637 1.00 0.00 C ATOM 0 H LEU A 53 0.293 -0.804 4.256 1.00 0.00 H new ATOM 0 HA LEU A 53 2.343 -2.888 3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.455 -0.540 2.862 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.413 0.074 4.503 1.00 0.00 H new ATOM 0 HG LEU A 53 4.576 -1.108 4.944 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.902 -1.830 3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.425 -2.806 3.193 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.506 -1.540 1.944 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.916 0.547 3.676 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.508 0.886 2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.457 1.290 4.374 1.00 0.00 H new ATOM 365 N GLU A 54 2.452 -3.532 6.190 1.00 0.00 N ATOM 366 CA GLU A 54 2.569 -3.891 7.596 1.00 0.00 C ATOM 367 C GLU A 54 4.001 -3.715 8.073 1.00 0.00 C ATOM 368 O GLU A 54 4.906 -4.447 7.669 1.00 0.00 O ATOM 369 CB GLU A 54 2.095 -5.328 7.835 1.00 0.00 C ATOM 370 CG GLU A 54 2.350 -5.829 9.250 1.00 0.00 C ATOM 371 CD GLU A 54 2.397 -7.342 9.344 1.00 0.00 C ATOM 372 OE1 GLU A 54 1.527 -8.014 8.753 1.00 0.00 O ATOM 373 OE2 GLU A 54 3.313 -7.869 10.008 1.00 0.00 O ATOM 0 H GLU A 54 2.587 -4.305 5.538 1.00 0.00 H new ATOM 0 HA GLU A 54 1.928 -3.223 8.171 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.027 -5.389 7.624 1.00 0.00 H new ATOM 0 HB3 GLU A 54 2.597 -5.989 7.129 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.293 -5.419 9.610 1.00 0.00 H new ATOM 0 HG3 GLU A 54 1.567 -5.454 9.909 1.00 0.00 H new ATOM 380 N LEU A 55 4.195 -2.732 8.933 1.00 0.00 N ATOM 381 CA LEU A 55 5.504 -2.445 9.476 1.00 0.00 C ATOM 382 C LEU A 55 5.684 -3.176 10.793 1.00 0.00 C ATOM 383 O LEU A 55 4.893 -3.007 11.705 1.00 0.00 O ATOM 384 CB LEU A 55 5.675 -0.951 9.705 1.00 0.00 C ATOM 385 CG LEU A 55 7.043 -0.399 9.325 1.00 0.00 C ATOM 386 CD1 LEU A 55 8.174 -1.230 9.903 1.00 0.00 C ATOM 387 CD2 LEU A 55 7.165 -0.292 7.822 1.00 0.00 C ATOM 0 H LEU A 55 3.455 -2.117 9.271 1.00 0.00 H new ATOM 0 HA LEU A 55 6.254 -2.781 8.760 1.00 0.00 H new ATOM 0 HB2 LEU A 55 4.913 -0.421 9.134 1.00 0.00 H new ATOM 0 HB3 LEU A 55 5.491 -0.736 10.758 1.00 0.00 H new ATOM 0 HG LEU A 55 7.129 0.598 9.757 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.130 -0.799 9.606 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.101 -1.237 10.991 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.104 -2.251 9.528 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.147 0.104 7.564 1.00 0.00 H new ATOM 0 HD22 LEU A 55 7.043 -1.279 7.376 1.00 0.00 H new ATOM 0 HD23 LEU A 55 6.393 0.376 7.441 1.00 0.00 H new ATOM 399 N ASP A 56 6.729 -3.979 10.865 1.00 0.00 N ATOM 400 CA ASP A 56 7.081 -4.755 12.069 1.00 0.00 C ATOM 401 C ASP A 56 5.880 -5.283 12.872 1.00 0.00 C ATOM 402 O ASP A 56 5.905 -5.267 14.104 1.00 0.00 O ATOM 403 CB ASP A 56 7.968 -3.921 12.993 1.00 0.00 C ATOM 404 CG ASP A 56 9.429 -3.960 12.595 1.00 0.00 C ATOM 405 OD1 ASP A 56 10.156 -4.849 13.088 1.00 0.00 O ATOM 406 OD2 ASP A 56 9.865 -3.101 11.799 1.00 0.00 O ATOM 0 H ASP A 56 7.373 -4.122 10.087 1.00 0.00 H new ATOM 0 HA ASP A 56 7.610 -5.632 11.695 1.00 0.00 H new ATOM 0 HB2 ASP A 56 7.622 -2.888 12.986 1.00 0.00 H new ATOM 0 HB3 ASP A 56 7.865 -4.285 14.015 1.00 0.00 H new ATOM 411 N GLY A 57 4.834 -5.746 12.197 1.00 0.00 N ATOM 412 CA GLY A 57 3.742 -6.395 12.899 1.00 0.00 C ATOM 413 C GLY A 57 2.574 -5.473 13.182 1.00 0.00 C ATOM 414 O GLY A 57 1.648 -5.844 13.897 1.00 0.00 O ATOM 0 H GLY A 57 4.722 -5.685 11.185 1.00 0.00 H new ATOM 0 HA2 GLY A 57 3.392 -7.241 12.308 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.114 -6.797 13.841 1.00 0.00 H new ATOM 418 N THR A 58 2.617 -4.268 12.644 1.00 0.00 N ATOM 419 CA THR A 58 1.464 -3.387 12.671 1.00 0.00 C ATOM 420 C THR A 58 1.051 -3.060 11.241 1.00 0.00 C ATOM 421 O THR A 58 1.832 -2.509 10.460 1.00 0.00 O ATOM 422 CB THR A 58 1.720 -2.097 13.492 1.00 0.00 C ATOM 423 OG1 THR A 58 0.604 -1.200 13.383 1.00 0.00 O ATOM 424 CG2 THR A 58 2.989 -1.392 13.050 1.00 0.00 C ATOM 0 H THR A 58 3.438 -3.877 12.183 1.00 0.00 H new ATOM 0 HA THR A 58 0.650 -3.907 13.176 1.00 0.00 H new ATOM 0 HB THR A 58 1.843 -2.396 14.533 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.339 -0.898 14.277 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.133 -0.493 13.649 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.841 -2.058 13.184 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.905 -1.118 11.998 1.00 0.00 H new ATOM 432 N LEU A 59 -0.172 -3.424 10.895 1.00 0.00 N ATOM 433 CA LEU A 59 -0.623 -3.367 9.518 1.00 0.00 C ATOM 434 C LEU A 59 -1.133 -1.978 9.174 1.00 0.00 C ATOM 435 O LEU A 59 -2.291 -1.641 9.431 1.00 0.00 O ATOM 436 CB LEU A 59 -1.709 -4.419 9.284 1.00 0.00 C ATOM 437 CG LEU A 59 -2.245 -4.517 7.854 1.00 0.00 C ATOM 438 CD1 LEU A 59 -1.197 -5.088 6.917 1.00 0.00 C ATOM 439 CD2 LEU A 59 -3.515 -5.348 7.817 1.00 0.00 C ATOM 0 H LEU A 59 -0.873 -3.764 11.554 1.00 0.00 H new ATOM 0 HA LEU A 59 0.221 -3.582 8.863 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.312 -5.393 9.571 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.544 -4.206 9.951 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.484 -3.510 7.511 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.605 -5.147 5.908 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.319 -4.442 6.917 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.914 -6.086 7.252 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.882 -5.407 6.792 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.304 -6.352 8.185 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.273 -4.883 8.447 1.00 0.00 H new ATOM 451 N LYS A 60 -0.256 -1.176 8.597 1.00 0.00 N ATOM 452 CA LYS A 60 -0.608 0.171 8.194 1.00 0.00 C ATOM 453 C LYS A 60 -1.332 0.119 6.854 1.00 0.00 C ATOM 454 O LYS A 60 -1.157 -0.830 6.092 1.00 0.00 O ATOM 455 CB LYS A 60 0.645 1.046 8.095 1.00 0.00 C ATOM 456 CG LYS A 60 1.529 1.031 9.337 1.00 0.00 C ATOM 457 CD LYS A 60 0.699 1.121 10.609 1.00 0.00 C ATOM 458 CE LYS A 60 1.534 1.539 11.803 1.00 0.00 C ATOM 459 NZ LYS A 60 0.712 1.631 13.036 1.00 0.00 N ATOM 0 H LYS A 60 0.709 -1.437 8.397 1.00 0.00 H new ATOM 0 HA LYS A 60 -1.267 0.612 8.942 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.236 0.716 7.240 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.340 2.073 7.894 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.123 0.117 9.352 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.229 1.866 9.298 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -0.110 1.837 10.464 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.237 0.154 10.810 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.340 0.821 11.954 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.000 2.504 11.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.317 1.903 13.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -0.031 2.347 12.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.274 0.708 13.231 1.00 0.00 H new ATOM 473 N SER A 61 -2.146 1.119 6.565 1.00 0.00 N ATOM 474 CA SER A 61 -2.957 1.092 5.364 1.00 0.00 C ATOM 475 C SER A 61 -2.680 2.310 4.492 1.00 0.00 C ATOM 476 O SER A 61 -2.373 3.386 5.002 1.00 0.00 O ATOM 477 CB SER A 61 -4.431 1.048 5.756 1.00 0.00 C ATOM 478 OG SER A 61 -4.630 0.213 6.881 1.00 0.00 O ATOM 0 H SER A 61 -2.262 1.953 7.141 1.00 0.00 H new ATOM 0 HA SER A 61 -2.704 0.203 4.786 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.782 2.055 5.979 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.024 0.682 4.917 1.00 0.00 H new ATOM 0 HG SER A 61 -4.800 0.765 7.673 1.00 0.00 H new ATOM 484 N TRP A 62 -2.768 2.129 3.183 1.00 0.00 N ATOM 485 CA TRP A 62 -2.625 3.222 2.235 1.00 0.00 C ATOM 486 C TRP A 62 -3.580 3.020 1.068 1.00 0.00 C ATOM 487 O TRP A 62 -3.936 1.896 0.754 1.00 0.00 O ATOM 488 CB TRP A 62 -1.184 3.316 1.727 1.00 0.00 C ATOM 489 CG TRP A 62 -0.281 4.126 2.606 1.00 0.00 C ATOM 490 CD1 TRP A 62 -0.098 5.474 2.551 1.00 0.00 C ATOM 491 CD2 TRP A 62 0.568 3.654 3.658 1.00 0.00 C ATOM 492 NE1 TRP A 62 0.797 5.872 3.506 1.00 0.00 N ATOM 493 CE2 TRP A 62 1.222 4.776 4.198 1.00 0.00 C ATOM 494 CE3 TRP A 62 0.837 2.396 4.200 1.00 0.00 C ATOM 495 CZ2 TRP A 62 2.124 4.681 5.250 1.00 0.00 C ATOM 496 CZ3 TRP A 62 1.735 2.304 5.244 1.00 0.00 C ATOM 497 CH2 TRP A 62 2.368 3.439 5.759 1.00 0.00 C ATOM 0 H TRP A 62 -2.940 1.222 2.749 1.00 0.00 H new ATOM 0 HA TRP A 62 -2.869 4.156 2.742 1.00 0.00 H new ATOM 0 HB2 TRP A 62 -0.776 2.310 1.633 1.00 0.00 H new ATOM 0 HB3 TRP A 62 -1.189 3.752 0.728 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -0.590 6.135 1.853 1.00 0.00 H new ATOM 0 HE1 TRP A 62 1.098 6.832 3.673 1.00 0.00 H new ATOM 0 HE3 TRP A 62 0.352 1.513 3.810 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 2.613 5.557 5.650 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 1.953 1.336 5.671 1.00 0.00 H new ATOM 0 HH2 TRP A 62 3.065 3.330 6.577 1.00 0.00 H new ATOM 508 N ALA A 63 -3.982 4.103 0.419 1.00 0.00 N ATOM 509 CA ALA A 63 -5.021 4.027 -0.603 1.00 0.00 C ATOM 510 C ALA A 63 -4.656 4.812 -1.866 1.00 0.00 C ATOM 511 O ALA A 63 -4.100 5.902 -1.779 1.00 0.00 O ATOM 512 CB ALA A 63 -6.327 4.554 -0.018 1.00 0.00 C ATOM 0 H ALA A 63 -3.609 5.039 0.578 1.00 0.00 H new ATOM 0 HA ALA A 63 -5.129 2.984 -0.900 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.111 4.502 -0.773 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.611 3.948 0.842 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.194 5.589 0.296 1.00 0.00 H new ATOM 518 N VAL A 64 -4.994 4.241 -3.032 1.00 0.00 N ATOM 519 CA VAL A 64 -4.888 4.937 -4.335 1.00 0.00 C ATOM 520 C VAL A 64 -5.953 6.061 -4.342 1.00 0.00 C ATOM 521 O VAL A 64 -6.611 6.233 -3.313 1.00 0.00 O ATOM 522 CB VAL A 64 -5.054 3.939 -5.518 1.00 0.00 C ATOM 523 CG1 VAL A 64 -3.960 4.151 -6.552 1.00 0.00 C ATOM 524 CG2 VAL A 64 -5.003 2.496 -5.046 1.00 0.00 C ATOM 0 H VAL A 64 -5.348 3.287 -3.104 1.00 0.00 H new ATOM 0 HA VAL A 64 -3.899 5.377 -4.467 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.031 4.131 -5.962 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -4.092 3.445 -7.372 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -4.016 5.169 -6.938 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.986 3.992 -6.089 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.122 1.829 -5.900 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.043 2.304 -4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.807 2.318 -4.332 1.00 0.00 H new ATOM 534 N PRO A 65 -6.245 6.837 -5.426 1.00 0.00 N ATOM 535 CA PRO A 65 -5.963 6.584 -6.857 1.00 0.00 C ATOM 536 C PRO A 65 -4.687 7.188 -7.433 1.00 0.00 C ATOM 537 O PRO A 65 -4.205 8.209 -6.959 1.00 0.00 O ATOM 538 CB PRO A 65 -7.107 7.321 -7.549 1.00 0.00 C ATOM 539 CG PRO A 65 -7.846 8.070 -6.483 1.00 0.00 C ATOM 540 CD PRO A 65 -6.929 8.114 -5.303 1.00 0.00 C ATOM 0 HA PRO A 65 -5.857 5.508 -6.996 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -6.724 8.004 -8.307 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -7.768 6.619 -8.057 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -8.101 9.076 -6.817 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -8.782 7.571 -6.232 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -6.239 8.956 -5.350 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.473 8.200 -4.362 1.00 0.00 H new ATOM 548 N LYS A 66 -4.223 6.582 -8.535 1.00 0.00 N ATOM 549 CA LYS A 66 -3.170 7.144 -9.383 1.00 0.00 C ATOM 550 C LYS A 66 -2.764 6.139 -10.466 1.00 0.00 C ATOM 551 O LYS A 66 -2.643 4.942 -10.198 1.00 0.00 O ATOM 552 CB LYS A 66 -1.957 7.557 -8.553 1.00 0.00 C ATOM 553 CG LYS A 66 -0.786 8.080 -9.377 1.00 0.00 C ATOM 554 CD LYS A 66 -1.188 9.272 -10.224 1.00 0.00 C ATOM 555 CE LYS A 66 -0.074 9.689 -11.167 1.00 0.00 C ATOM 556 NZ LYS A 66 -0.506 10.773 -12.088 1.00 0.00 N ATOM 0 H LYS A 66 -4.573 5.682 -8.863 1.00 0.00 H new ATOM 0 HA LYS A 66 -3.565 8.037 -9.866 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -2.261 8.327 -7.844 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -1.622 6.700 -7.969 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.030 8.364 -8.712 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -0.410 7.285 -10.021 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.080 9.025 -10.800 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.449 10.108 -9.576 1.00 0.00 H new ATOM 0 HE2 LYS A 66 0.786 10.026 -10.587 1.00 0.00 H new ATOM 0 HE3 LYS A 66 0.252 8.827 -11.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 0.282 11.030 -12.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.310 10.443 -12.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -0.793 11.605 -11.534 1.00 0.00 H new ATOM 570 N GLY A 67 -2.572 6.637 -11.688 1.00 0.00 N ATOM 571 CA GLY A 67 -2.232 5.776 -12.810 1.00 0.00 C ATOM 572 C GLY A 67 -0.764 5.853 -13.214 1.00 0.00 C ATOM 573 O GLY A 67 0.082 6.263 -12.417 1.00 0.00 O ATOM 0 H GLY A 67 -2.647 7.627 -11.921 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.476 4.745 -12.553 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -2.851 6.047 -13.666 1.00 0.00 H new ATOM 577 N PRO A 68 -0.445 5.482 -14.470 1.00 0.00 N ATOM 578 CA PRO A 68 0.938 5.336 -14.947 1.00 0.00 C ATOM 579 C PRO A 68 1.633 6.663 -15.278 1.00 0.00 C ATOM 580 O PRO A 68 0.986 7.648 -15.649 1.00 0.00 O ATOM 581 CB PRO A 68 0.775 4.495 -16.211 1.00 0.00 C ATOM 582 CG PRO A 68 -0.573 4.853 -16.732 1.00 0.00 C ATOM 583 CD PRO A 68 -1.424 5.168 -15.530 1.00 0.00 C ATOM 0 HA PRO A 68 1.573 4.894 -14.179 1.00 0.00 H new ATOM 0 HB2 PRO A 68 1.554 4.720 -16.940 1.00 0.00 H new ATOM 0 HB3 PRO A 68 0.844 3.430 -15.990 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -0.515 5.711 -17.402 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.999 4.029 -17.305 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -2.089 6.010 -15.721 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -2.053 4.322 -15.254 1.00 0.00 H new ATOM 591 N CYS A 69 2.963 6.659 -15.158 1.00 0.00 N ATOM 592 CA CYS A 69 3.797 7.827 -15.445 1.00 0.00 C ATOM 593 C CYS A 69 5.172 7.369 -15.938 1.00 0.00 C ATOM 594 O CYS A 69 5.321 6.240 -16.404 1.00 0.00 O ATOM 595 CB CYS A 69 3.986 8.700 -14.204 1.00 0.00 C ATOM 596 SG CYS A 69 2.465 9.132 -13.326 1.00 0.00 S ATOM 0 H CYS A 69 3.493 5.841 -14.858 1.00 0.00 H new ATOM 0 HA CYS A 69 3.292 8.415 -16.211 1.00 0.00 H new ATOM 0 HB2 CYS A 69 4.651 8.182 -13.513 1.00 0.00 H new ATOM 0 HB3 CYS A 69 4.489 9.620 -14.500 1.00 0.00 H new ATOM 0 HG CYS A 69 2.747 9.438 -12.094 1.00 0.00 H new ATOM 602 N LEU A 70 6.162 8.253 -15.840 1.00 0.00 N ATOM 603 CA LEU A 70 7.535 7.947 -16.250 1.00 0.00 C ATOM 604 C LEU A 70 8.235 7.004 -15.256 1.00 0.00 C ATOM 605 O LEU A 70 7.897 5.825 -15.185 1.00 0.00 O ATOM 606 CB LEU A 70 8.328 9.243 -16.379 1.00 0.00 C ATOM 607 CG LEU A 70 7.726 10.289 -17.316 1.00 0.00 C ATOM 608 CD1 LEU A 70 8.612 11.521 -17.372 1.00 0.00 C ATOM 609 CD2 LEU A 70 7.525 9.714 -18.711 1.00 0.00 C ATOM 0 H LEU A 70 6.039 9.198 -15.476 1.00 0.00 H new ATOM 0 HA LEU A 70 7.492 7.437 -17.212 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.433 9.685 -15.388 1.00 0.00 H new ATOM 0 HB3 LEU A 70 9.332 9.002 -16.728 1.00 0.00 H new ATOM 0 HG LEU A 70 6.751 10.578 -16.924 1.00 0.00 H new ATOM 0 HD11 LEU A 70 8.170 12.257 -18.044 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.703 11.949 -16.374 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.600 11.242 -17.739 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.095 10.477 -19.360 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.486 9.393 -19.114 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.850 8.860 -18.659 1.00 0.00 H new ATOM 621 N ASP A 71 9.202 7.541 -14.487 1.00 0.00 N ATOM 622 CA ASP A 71 9.988 6.749 -13.516 1.00 0.00 C ATOM 623 C ASP A 71 11.209 7.531 -13.000 1.00 0.00 C ATOM 624 O ASP A 71 12.055 7.960 -13.783 1.00 0.00 O ATOM 625 CB ASP A 71 10.477 5.410 -14.111 1.00 0.00 C ATOM 626 CG ASP A 71 11.494 5.567 -15.233 1.00 0.00 C ATOM 627 OD1 ASP A 71 11.081 5.697 -16.405 1.00 0.00 O ATOM 628 OD2 ASP A 71 12.712 5.544 -14.954 1.00 0.00 O ATOM 0 H ASP A 71 9.460 8.527 -14.519 1.00 0.00 H new ATOM 0 HA ASP A 71 9.310 6.542 -12.688 1.00 0.00 H new ATOM 0 HB2 ASP A 71 10.919 4.810 -13.315 1.00 0.00 H new ATOM 0 HB3 ASP A 71 9.617 4.856 -14.488 1.00 0.00 H new ATOM 633 N PRO A 72 11.286 7.798 -11.681 1.00 0.00 N ATOM 634 CA PRO A 72 10.166 7.650 -10.758 1.00 0.00 C ATOM 635 C PRO A 72 9.201 8.788 -10.935 1.00 0.00 C ATOM 636 O PRO A 72 9.613 9.947 -11.015 1.00 0.00 O ATOM 637 CB PRO A 72 10.778 7.778 -9.372 1.00 0.00 C ATOM 638 CG PRO A 72 12.258 7.759 -9.577 1.00 0.00 C ATOM 639 CD PRO A 72 12.493 8.246 -10.979 1.00 0.00 C ATOM 0 HA PRO A 72 9.639 6.709 -10.919 1.00 0.00 H new ATOM 0 HB2 PRO A 72 10.462 8.703 -8.889 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.462 6.958 -8.728 1.00 0.00 H new ATOM 0 HG2 PRO A 72 12.760 8.401 -8.853 1.00 0.00 H new ATOM 0 HG3 PRO A 72 12.657 6.754 -9.442 1.00 0.00 H new ATOM 0 HD2 PRO A 72 12.606 9.329 -11.018 1.00 0.00 H new ATOM 0 HD3 PRO A 72 13.396 7.816 -11.411 1.00 0.00 H new ATOM 647 N ALA A 73 7.931 8.464 -10.959 1.00 0.00 N ATOM 648 CA ALA A 73 6.898 9.437 -11.224 1.00 0.00 C ATOM 649 C ALA A 73 5.568 8.732 -11.314 1.00 0.00 C ATOM 650 O ALA A 73 4.513 9.331 -11.122 1.00 0.00 O ATOM 651 CB ALA A 73 7.229 10.190 -12.486 1.00 0.00 C ATOM 0 H ALA A 73 7.584 7.519 -10.796 1.00 0.00 H new ATOM 0 HA ALA A 73 6.838 10.165 -10.415 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.449 10.925 -12.686 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.185 10.699 -12.366 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.292 9.492 -13.320 1.00 0.00 H new ATOM 657 N VAL A 74 5.642 7.429 -11.581 1.00 0.00 N ATOM 658 CA VAL A 74 4.497 6.535 -11.457 1.00 0.00 C ATOM 659 C VAL A 74 4.180 6.326 -9.979 1.00 0.00 C ATOM 660 O VAL A 74 3.718 5.263 -9.570 1.00 0.00 O ATOM 661 CB VAL A 74 4.783 5.158 -12.098 1.00 0.00 C ATOM 662 CG1 VAL A 74 3.490 4.415 -12.392 1.00 0.00 C ATOM 663 CG2 VAL A 74 5.617 5.307 -13.355 1.00 0.00 C ATOM 0 H VAL A 74 6.497 6.966 -11.889 1.00 0.00 H new ATOM 0 HA VAL A 74 3.654 6.993 -11.975 1.00 0.00 H new ATOM 0 HB VAL A 74 5.355 4.568 -11.382 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.720 3.449 -12.843 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.940 4.261 -11.464 1.00 0.00 H new ATOM 0 HG13 VAL A 74 2.882 5.001 -13.081 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.804 4.324 -13.786 1.00 0.00 H new ATOM 0 HG22 VAL A 74 5.081 5.924 -14.076 1.00 0.00 H new ATOM 0 HG23 VAL A 74 6.567 5.781 -13.107 1.00 0.00 H new ATOM 673 N LYS A 75 4.460 7.342 -9.177 1.00 0.00 N ATOM 674 CA LYS A 75 4.233 7.272 -7.764 1.00 0.00 C ATOM 675 C LYS A 75 2.737 7.330 -7.491 1.00 0.00 C ATOM 676 O LYS A 75 2.131 8.398 -7.448 1.00 0.00 O ATOM 677 CB LYS A 75 5.020 8.388 -7.057 1.00 0.00 C ATOM 678 CG LYS A 75 5.105 9.714 -7.813 1.00 0.00 C ATOM 679 CD LYS A 75 3.878 10.591 -7.622 1.00 0.00 C ATOM 680 CE LYS A 75 4.004 11.903 -8.377 1.00 0.00 C ATOM 681 NZ LYS A 75 5.090 12.761 -7.832 1.00 0.00 N ATOM 0 H LYS A 75 4.849 8.229 -9.497 1.00 0.00 H new ATOM 0 HA LYS A 75 4.597 6.327 -7.361 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.562 8.572 -6.085 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.033 8.031 -6.869 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.989 10.259 -7.480 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.237 9.511 -8.876 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.992 10.057 -7.965 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.737 10.794 -6.560 1.00 0.00 H new ATOM 0 HE2 LYS A 75 4.199 11.698 -9.430 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.058 12.442 -8.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.022 13.712 -8.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.995 12.826 -6.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 6.013 12.345 -8.069 1.00 0.00 H new ATOM 695 N ARG A 76 2.132 6.168 -7.336 1.00 0.00 N ATOM 696 CA ARG A 76 0.699 6.104 -7.192 1.00 0.00 C ATOM 697 C ARG A 76 0.278 6.584 -5.821 1.00 0.00 C ATOM 698 O ARG A 76 0.845 6.173 -4.806 1.00 0.00 O ATOM 699 CB ARG A 76 0.156 4.705 -7.495 1.00 0.00 C ATOM 700 CG ARG A 76 0.679 3.589 -6.612 1.00 0.00 C ATOM 701 CD ARG A 76 0.022 2.282 -7.007 1.00 0.00 C ATOM 702 NE ARG A 76 0.475 1.140 -6.219 1.00 0.00 N ATOM 703 CZ ARG A 76 0.058 -0.104 -6.446 1.00 0.00 C ATOM 704 NH1 ARG A 76 -0.805 -0.340 -7.430 1.00 0.00 N ATOM 705 NH2 ARG A 76 0.498 -1.114 -5.701 1.00 0.00 N ATOM 0 H ARG A 76 2.609 5.267 -7.307 1.00 0.00 H new ATOM 0 HA ARG A 76 0.261 6.774 -7.931 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -0.930 4.731 -7.410 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.389 4.462 -8.532 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.761 3.509 -6.712 1.00 0.00 H new ATOM 0 HG3 ARG A 76 0.471 3.811 -5.565 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -1.058 2.381 -6.900 1.00 0.00 H new ATOM 0 HD3 ARG A 76 0.222 2.088 -8.061 1.00 0.00 H new ATOM 0 HE ARG A 76 1.139 1.302 -5.462 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -1.144 0.430 -8.007 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -1.128 -1.291 -7.608 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.162 -0.940 -4.946 1.00 0.00 H new ATOM 0 HH22 ARG A 76 0.172 -2.063 -5.884 1.00 0.00 H new ATOM 719 N LEU A 77 -0.692 7.497 -5.824 1.00 0.00 N ATOM 720 CA LEU A 77 -1.217 8.089 -4.614 1.00 0.00 C ATOM 721 C LEU A 77 -1.515 7.016 -3.590 1.00 0.00 C ATOM 722 O LEU A 77 -2.244 6.066 -3.852 1.00 0.00 O ATOM 723 CB LEU A 77 -2.461 8.959 -4.916 1.00 0.00 C ATOM 724 CG LEU A 77 -3.039 9.699 -3.705 1.00 0.00 C ATOM 725 CD1 LEU A 77 -3.962 8.801 -2.916 1.00 0.00 C ATOM 726 CD2 LEU A 77 -1.898 10.222 -2.835 1.00 0.00 C ATOM 0 H LEU A 77 -1.133 7.843 -6.676 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.460 8.750 -4.192 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.198 9.691 -5.679 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.238 8.322 -5.339 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.630 10.546 -4.053 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.360 9.349 -2.062 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.784 8.475 -3.553 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.409 7.930 -2.563 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.309 10.748 -1.974 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.289 9.386 -2.492 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.280 10.906 -3.417 1.00 0.00 H new ATOM 738 N ALA A 78 -0.886 7.171 -2.449 1.00 0.00 N ATOM 739 CA ALA A 78 -1.093 6.314 -1.317 1.00 0.00 C ATOM 740 C ALA A 78 -1.456 7.169 -0.114 1.00 0.00 C ATOM 741 O ALA A 78 -0.585 7.663 0.593 1.00 0.00 O ATOM 742 CB ALA A 78 0.164 5.496 -1.040 1.00 0.00 C ATOM 0 H ALA A 78 -0.204 7.912 -2.283 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.907 5.619 -1.522 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.005 4.849 -0.179 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.400 4.885 -1.911 1.00 0.00 H new ATOM 0 HB3 ALA A 78 0.997 6.168 -0.831 1.00 0.00 H new ATOM 748 N VAL A 79 -2.738 7.356 0.114 1.00 0.00 N ATOM 749 CA VAL A 79 -3.184 8.139 1.250 1.00 0.00 C ATOM 750 C VAL A 79 -2.930 7.340 2.504 1.00 0.00 C ATOM 751 O VAL A 79 -3.236 6.153 2.541 1.00 0.00 O ATOM 752 CB VAL A 79 -4.691 8.467 1.169 1.00 0.00 C ATOM 753 CG1 VAL A 79 -5.219 8.965 2.506 1.00 0.00 C ATOM 754 CG2 VAL A 79 -4.946 9.507 0.099 1.00 0.00 C ATOM 0 H VAL A 79 -3.487 6.980 -0.467 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.635 9.081 1.255 1.00 0.00 H new ATOM 0 HB VAL A 79 -5.218 7.548 0.912 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.282 9.188 2.417 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.071 8.196 3.265 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -4.682 9.868 2.795 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.012 9.728 0.053 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.396 10.417 0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.613 9.125 -0.866 1.00 0.00 H new ATOM 764 N GLN A 80 -2.329 7.961 3.504 1.00 0.00 N ATOM 765 CA GLN A 80 -2.051 7.254 4.735 1.00 0.00 C ATOM 766 C GLN A 80 -3.356 6.964 5.457 1.00 0.00 C ATOM 767 O GLN A 80 -3.972 7.833 6.083 1.00 0.00 O ATOM 768 CB GLN A 80 -1.056 8.007 5.612 1.00 0.00 C ATOM 769 CG GLN A 80 -1.484 9.409 5.999 1.00 0.00 C ATOM 770 CD GLN A 80 -0.657 9.951 7.141 1.00 0.00 C ATOM 771 OE1 GLN A 80 -1.016 9.804 8.309 1.00 0.00 O ATOM 772 NE2 GLN A 80 0.467 10.560 6.813 1.00 0.00 N ATOM 0 H GLN A 80 -2.030 8.936 3.487 1.00 0.00 H new ATOM 0 HA GLN A 80 -1.573 6.304 4.496 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.885 7.430 6.521 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -0.102 8.065 5.088 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.390 10.069 5.137 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.536 9.403 6.283 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.725 10.660 5.831 1.00 0.00 H new ATOM 0 HE22 GLN A 80 1.077 10.931 7.541 1.00 0.00 H new ATOM 781 N VAL A 81 -3.775 5.729 5.318 1.00 0.00 N ATOM 782 CA VAL A 81 -5.074 5.284 5.751 1.00 0.00 C ATOM 783 C VAL A 81 -5.016 4.806 7.208 1.00 0.00 C ATOM 784 O VAL A 81 -3.931 4.654 7.771 1.00 0.00 O ATOM 785 CB VAL A 81 -5.561 4.180 4.784 1.00 0.00 C ATOM 786 CG1 VAL A 81 -6.829 3.496 5.255 1.00 0.00 C ATOM 787 CG2 VAL A 81 -5.784 4.783 3.410 1.00 0.00 C ATOM 0 H VAL A 81 -3.211 4.993 4.893 1.00 0.00 H new ATOM 0 HA VAL A 81 -5.790 6.105 5.724 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.786 3.415 4.749 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -7.120 2.732 4.534 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -6.653 3.031 6.225 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.628 4.232 5.345 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -6.128 4.009 2.724 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -6.536 5.569 3.475 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.849 5.205 3.042 1.00 0.00 H new ATOM 797 N GLU A 82 -6.182 4.604 7.804 1.00 0.00 N ATOM 798 CA GLU A 82 -6.324 4.248 9.211 1.00 0.00 C ATOM 799 C GLU A 82 -5.420 3.110 9.674 1.00 0.00 C ATOM 800 O GLU A 82 -5.033 2.220 8.908 1.00 0.00 O ATOM 801 CB GLU A 82 -7.767 3.869 9.480 1.00 0.00 C ATOM 802 CG GLU A 82 -8.721 4.987 9.155 1.00 0.00 C ATOM 803 CD GLU A 82 -10.152 4.656 9.502 1.00 0.00 C ATOM 804 OE1 GLU A 82 -10.443 4.432 10.692 1.00 0.00 O ATOM 805 OE2 GLU A 82 -10.997 4.620 8.584 1.00 0.00 O ATOM 0 H GLU A 82 -7.074 4.684 7.315 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.018 5.128 9.777 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -8.026 2.990 8.889 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.878 3.592 10.528 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.419 5.884 9.696 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.654 5.218 8.092 1.00 0.00 H new ATOM 812 N ASP A 83 -5.130 3.152 10.963 1.00 0.00 N ATOM 813 CA ASP A 83 -4.303 2.147 11.619 1.00 0.00 C ATOM 814 C ASP A 83 -5.184 1.078 12.242 1.00 0.00 C ATOM 815 O ASP A 83 -5.493 1.128 13.434 1.00 0.00 O ATOM 816 CB ASP A 83 -3.432 2.778 12.710 1.00 0.00 C ATOM 817 CG ASP A 83 -2.348 3.685 12.172 1.00 0.00 C ATOM 818 OD1 ASP A 83 -2.640 4.870 11.895 1.00 0.00 O ATOM 819 OD2 ASP A 83 -1.196 3.227 12.046 1.00 0.00 O ATOM 0 H ASP A 83 -5.462 3.886 11.589 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.654 1.701 10.865 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -4.069 3.348 13.386 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.971 1.985 13.299 1.00 0.00 H new ATOM 824 N HIS A 84 -5.601 0.119 11.439 1.00 0.00 N ATOM 825 CA HIS A 84 -6.464 -0.950 11.926 1.00 0.00 C ATOM 826 C HIS A 84 -5.638 -2.090 12.512 1.00 0.00 C ATOM 827 O HIS A 84 -4.466 -2.252 12.167 1.00 0.00 O ATOM 828 CB HIS A 84 -7.394 -1.464 10.815 1.00 0.00 C ATOM 829 CG HIS A 84 -6.713 -1.823 9.526 1.00 0.00 C ATOM 830 ND1 HIS A 84 -7.353 -1.768 8.312 1.00 0.00 N ATOM 831 CD2 HIS A 84 -5.451 -2.236 9.263 1.00 0.00 C ATOM 832 CE1 HIS A 84 -6.518 -2.125 7.361 1.00 0.00 C ATOM 833 NE2 HIS A 84 -5.350 -2.415 7.907 1.00 0.00 N ATOM 0 H HIS A 84 -5.360 0.054 10.450 1.00 0.00 H new ATOM 0 HA HIS A 84 -7.088 -0.539 12.719 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -7.924 -2.342 11.184 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -8.145 -0.701 10.610 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -4.667 -2.395 9.988 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -6.749 -2.173 6.307 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -4.516 -2.720 7.406 1.00 0.00 H new ATOM 842 N PRO A 85 -6.235 -2.875 13.425 1.00 0.00 N ATOM 843 CA PRO A 85 -5.568 -4.021 14.056 1.00 0.00 C ATOM 844 C PRO A 85 -4.986 -5.000 13.039 1.00 0.00 C ATOM 845 O PRO A 85 -5.523 -5.169 11.937 1.00 0.00 O ATOM 846 CB PRO A 85 -6.691 -4.691 14.852 1.00 0.00 C ATOM 847 CG PRO A 85 -7.663 -3.601 15.128 1.00 0.00 C ATOM 848 CD PRO A 85 -7.610 -2.693 13.933 1.00 0.00 C ATOM 0 HA PRO A 85 -4.719 -3.707 14.662 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.153 -5.498 14.283 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.314 -5.128 15.776 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -8.667 -4.000 15.272 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -7.400 -3.064 16.039 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -8.354 -2.969 13.186 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.803 -1.656 14.208 1.00 0.00 H new ATOM 856 N LEU A 86 -3.886 -5.639 13.414 1.00 0.00 N ATOM 857 CA LEU A 86 -3.231 -6.603 12.547 1.00 0.00 C ATOM 858 C LEU A 86 -4.049 -7.884 12.465 1.00 0.00 C ATOM 859 O LEU A 86 -4.004 -8.711 13.374 1.00 0.00 O ATOM 860 CB LEU A 86 -1.824 -6.920 13.071 1.00 0.00 C ATOM 861 CG LEU A 86 -1.062 -7.989 12.281 1.00 0.00 C ATOM 862 CD1 LEU A 86 -0.680 -7.466 10.908 1.00 0.00 C ATOM 863 CD2 LEU A 86 0.176 -8.438 13.039 1.00 0.00 C ATOM 0 H LEU A 86 -3.429 -5.505 14.316 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.150 -6.170 11.550 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.237 -6.002 13.069 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.904 -7.245 14.108 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.718 -8.850 12.154 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.140 -8.239 10.362 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.581 -7.196 10.358 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.044 -6.587 11.017 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.702 -9.197 12.460 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.834 -7.584 13.200 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.118 -8.856 14.002 1.00 0.00 H new ATOM 875 N ASP A 87 -4.789 -8.032 11.367 1.00 0.00 N ATOM 876 CA ASP A 87 -5.575 -9.240 11.097 1.00 0.00 C ATOM 877 C ASP A 87 -6.410 -9.061 9.848 1.00 0.00 C ATOM 878 O ASP A 87 -6.455 -9.943 8.994 1.00 0.00 O ATOM 879 CB ASP A 87 -6.510 -9.593 12.259 1.00 0.00 C ATOM 880 CG ASP A 87 -7.368 -10.806 11.951 1.00 0.00 C ATOM 881 OD1 ASP A 87 -6.863 -11.941 12.075 1.00 0.00 O ATOM 882 OD2 ASP A 87 -8.549 -10.632 11.576 1.00 0.00 O ATOM 0 H ASP A 87 -4.862 -7.321 10.640 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.861 -10.052 10.964 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.919 -9.785 13.154 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.153 -8.741 12.479 1.00 0.00 H new ATOM 887 N TYR A 88 -7.057 -7.905 9.735 1.00 0.00 N ATOM 888 CA TYR A 88 -7.967 -7.642 8.623 1.00 0.00 C ATOM 889 C TYR A 88 -7.222 -7.280 7.348 1.00 0.00 C ATOM 890 O TYR A 88 -7.588 -6.365 6.611 1.00 0.00 O ATOM 891 CB TYR A 88 -8.965 -6.565 8.992 1.00 0.00 C ATOM 892 CG TYR A 88 -10.004 -7.052 9.972 1.00 0.00 C ATOM 893 CD1 TYR A 88 -10.722 -8.218 9.720 1.00 0.00 C ATOM 894 CD2 TYR A 88 -10.268 -6.361 11.146 1.00 0.00 C ATOM 895 CE1 TYR A 88 -11.669 -8.678 10.610 1.00 0.00 C ATOM 896 CE2 TYR A 88 -11.216 -6.817 12.042 1.00 0.00 C ATOM 897 CZ TYR A 88 -11.912 -7.975 11.769 1.00 0.00 C ATOM 898 OH TYR A 88 -12.852 -8.434 12.663 1.00 0.00 O ATOM 0 H TYR A 88 -6.969 -7.136 10.399 1.00 0.00 H new ATOM 0 HA TYR A 88 -8.511 -8.565 8.423 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -8.435 -5.715 9.422 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -9.461 -6.208 8.089 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -10.534 -8.771 8.812 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -9.724 -5.453 11.363 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -12.217 -9.584 10.400 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -11.411 -6.269 12.952 1.00 0.00 H new ATOM 0 HH TYR A 88 -12.901 -7.824 13.428 1.00 0.00 H new ATOM 908 N ALA A 89 -6.166 -8.023 7.125 1.00 0.00 N ATOM 909 CA ALA A 89 -5.456 -8.049 5.866 1.00 0.00 C ATOM 910 C ALA A 89 -6.158 -9.017 4.927 1.00 0.00 C ATOM 911 O ALA A 89 -5.739 -9.231 3.787 1.00 0.00 O ATOM 912 CB ALA A 89 -4.033 -8.509 6.117 1.00 0.00 C ATOM 0 H ALA A 89 -5.765 -8.642 7.830 1.00 0.00 H new ATOM 0 HA ALA A 89 -5.440 -7.057 5.415 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.487 -8.533 5.174 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -3.543 -7.818 6.803 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -4.045 -9.507 6.555 1.00 0.00 H new ATOM 918 N ASP A 90 -7.216 -9.631 5.439 1.00 0.00 N ATOM 919 CA ASP A 90 -7.935 -10.658 4.710 1.00 0.00 C ATOM 920 C ASP A 90 -9.329 -10.200 4.290 1.00 0.00 C ATOM 921 O ASP A 90 -9.571 -9.911 3.119 1.00 0.00 O ATOM 922 CB ASP A 90 -8.045 -11.913 5.566 1.00 0.00 C ATOM 923 CG ASP A 90 -8.437 -13.124 4.752 1.00 0.00 C ATOM 924 OD1 ASP A 90 -7.529 -13.770 4.188 1.00 0.00 O ATOM 925 OD2 ASP A 90 -9.642 -13.437 4.672 1.00 0.00 O ATOM 0 H ASP A 90 -7.595 -9.431 6.365 1.00 0.00 H new ATOM 0 HA ASP A 90 -7.371 -10.870 3.801 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -7.090 -12.101 6.058 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -8.782 -11.751 6.352 1.00 0.00 H new ATOM 930 N PHE A 91 -10.236 -10.119 5.254 1.00 0.00 N ATOM 931 CA PHE A 91 -11.640 -9.854 4.968 1.00 0.00 C ATOM 932 C PHE A 91 -12.024 -8.443 5.397 1.00 0.00 C ATOM 933 O PHE A 91 -11.843 -8.063 6.554 1.00 0.00 O ATOM 934 CB PHE A 91 -12.509 -10.899 5.689 1.00 0.00 C ATOM 935 CG PHE A 91 -13.991 -10.828 5.393 1.00 0.00 C ATOM 936 CD1 PHE A 91 -14.485 -10.065 4.348 1.00 0.00 C ATOM 937 CD2 PHE A 91 -14.887 -11.543 6.170 1.00 0.00 C ATOM 938 CE1 PHE A 91 -15.839 -10.015 4.086 1.00 0.00 C ATOM 939 CE2 PHE A 91 -16.243 -11.497 5.913 1.00 0.00 C ATOM 940 CZ PHE A 91 -16.720 -10.731 4.870 1.00 0.00 C ATOM 0 H PHE A 91 -10.024 -10.234 6.245 1.00 0.00 H new ATOM 0 HA PHE A 91 -11.807 -9.928 3.893 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -12.150 -11.893 5.421 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -12.365 -10.787 6.764 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -13.802 -9.502 3.730 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -14.520 -12.145 6.988 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -16.209 -9.415 3.267 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -16.929 -12.060 6.528 1.00 0.00 H new ATOM 0 HZ PHE A 91 -17.780 -10.692 4.668 1.00 0.00 H new ATOM 950 N GLU A 92 -12.540 -7.669 4.453 1.00 0.00 N ATOM 951 CA GLU A 92 -13.029 -6.333 4.740 1.00 0.00 C ATOM 952 C GLU A 92 -14.548 -6.310 4.833 1.00 0.00 C ATOM 953 O GLU A 92 -15.111 -6.059 5.900 1.00 0.00 O ATOM 954 CB GLU A 92 -12.572 -5.351 3.670 1.00 0.00 C ATOM 955 CG GLU A 92 -11.138 -4.904 3.817 1.00 0.00 C ATOM 956 CD GLU A 92 -10.941 -3.978 4.996 1.00 0.00 C ATOM 957 OE1 GLU A 92 -11.190 -2.762 4.852 1.00 0.00 O ATOM 958 OE2 GLU A 92 -10.508 -4.451 6.063 1.00 0.00 O ATOM 0 H GLU A 92 -12.630 -7.948 3.476 1.00 0.00 H new ATOM 0 HA GLU A 92 -12.615 -6.034 5.703 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -12.699 -5.812 2.691 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -13.219 -4.474 3.696 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.498 -5.778 3.934 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -10.823 -4.398 2.904 1.00 0.00 H new ATOM 965 N GLY A 93 -15.207 -6.589 3.718 1.00 0.00 N ATOM 966 CA GLY A 93 -16.646 -6.433 3.667 1.00 0.00 C ATOM 967 C GLY A 93 -17.241 -6.709 2.304 1.00 0.00 C ATOM 968 O GLY A 93 -16.725 -7.526 1.541 1.00 0.00 O ATOM 0 H GLY A 93 -14.776 -6.918 2.854 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -17.101 -7.105 4.395 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -16.903 -5.417 3.967 1.00 0.00 H new ATOM 972 N SER A 94 -18.335 -6.002 2.024 1.00 0.00 N ATOM 973 CA SER A 94 -18.984 -6.008 0.721 1.00 0.00 C ATOM 974 C SER A 94 -19.612 -7.356 0.373 1.00 0.00 C ATOM 975 O SER A 94 -19.640 -8.282 1.188 1.00 0.00 O ATOM 976 CB SER A 94 -17.980 -5.587 -0.331 1.00 0.00 C ATOM 977 OG SER A 94 -17.552 -4.255 -0.112 1.00 0.00 O ATOM 0 H SER A 94 -18.799 -5.403 2.707 1.00 0.00 H new ATOM 0 HA SER A 94 -19.810 -5.297 0.754 1.00 0.00 H new ATOM 0 HB2 SER A 94 -17.121 -6.258 -0.310 1.00 0.00 H new ATOM 0 HB3 SER A 94 -18.427 -5.672 -1.322 1.00 0.00 H new ATOM 0 HG SER A 94 -17.757 -3.711 -0.901 1.00 0.00 H new ATOM 983 N ILE A 95 -20.134 -7.438 -0.848 1.00 0.00 N ATOM 984 CA ILE A 95 -20.884 -8.598 -1.307 1.00 0.00 C ATOM 985 C ILE A 95 -20.380 -9.017 -2.680 1.00 0.00 C ATOM 986 O ILE A 95 -20.354 -8.197 -3.596 1.00 0.00 O ATOM 987 CB ILE A 95 -22.393 -8.269 -1.424 1.00 0.00 C ATOM 988 CG1 ILE A 95 -22.936 -7.681 -0.116 1.00 0.00 C ATOM 989 CG2 ILE A 95 -23.185 -9.508 -1.823 1.00 0.00 C ATOM 990 CD1 ILE A 95 -22.841 -8.618 1.069 1.00 0.00 C ATOM 0 H ILE A 95 -20.047 -6.699 -1.546 1.00 0.00 H new ATOM 0 HA ILE A 95 -20.744 -9.400 -0.583 1.00 0.00 H new ATOM 0 HB ILE A 95 -22.510 -7.517 -2.204 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -22.389 -6.766 0.113 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -23.979 -7.401 -0.262 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -24.242 -9.255 -1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -22.829 -9.873 -2.786 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -23.051 -10.284 -1.069 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -23.246 -8.127 1.954 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -23.412 -9.524 0.863 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -21.797 -8.879 1.244 1.00 0.00 H new ATOM 1002 N PRO A 96 -19.967 -10.290 -2.838 1.00 0.00 N ATOM 1003 CA PRO A 96 -19.501 -10.825 -4.122 1.00 0.00 C ATOM 1004 C PRO A 96 -20.358 -10.346 -5.292 1.00 0.00 C ATOM 1005 O PRO A 96 -21.573 -10.549 -5.311 1.00 0.00 O ATOM 1006 CB PRO A 96 -19.640 -12.331 -3.926 1.00 0.00 C ATOM 1007 CG PRO A 96 -19.389 -12.539 -2.474 1.00 0.00 C ATOM 1008 CD PRO A 96 -19.914 -11.311 -1.772 1.00 0.00 C ATOM 0 HA PRO A 96 -18.490 -10.503 -4.370 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -20.633 -12.679 -4.212 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -18.922 -12.879 -4.536 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -19.894 -13.436 -2.117 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -18.325 -12.673 -2.279 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -20.898 -11.488 -1.339 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -19.258 -11.005 -0.957 1.00 0.00 H new ATOM 1016 N GLN A 97 -19.717 -9.711 -6.268 1.00 0.00 N ATOM 1017 CA GLN A 97 -20.427 -9.039 -7.342 1.00 0.00 C ATOM 1018 C GLN A 97 -21.153 -10.016 -8.252 1.00 0.00 C ATOM 1019 O GLN A 97 -21.998 -9.616 -9.054 1.00 0.00 O ATOM 1020 CB GLN A 97 -19.457 -8.178 -8.141 1.00 0.00 C ATOM 1021 CG GLN A 97 -18.377 -8.967 -8.861 1.00 0.00 C ATOM 1022 CD GLN A 97 -17.219 -8.099 -9.308 1.00 0.00 C ATOM 1023 OE1 GLN A 97 -16.080 -8.563 -9.397 1.00 0.00 O ATOM 1024 NE2 GLN A 97 -17.492 -6.835 -9.585 1.00 0.00 N ATOM 0 H GLN A 97 -18.701 -9.650 -6.334 1.00 0.00 H new ATOM 0 HA GLN A 97 -21.189 -8.404 -6.891 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -20.020 -7.600 -8.874 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -18.983 -7.464 -7.468 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -18.005 -9.751 -8.201 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -18.812 -9.461 -9.730 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -18.448 -6.489 -9.499 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -16.747 -6.206 -9.885 1.00 0.00 H new ATOM 1033 N GLY A 98 -20.842 -11.294 -8.110 1.00 0.00 N ATOM 1034 CA GLY A 98 -21.552 -12.316 -8.852 1.00 0.00 C ATOM 1035 C GLY A 98 -22.998 -12.420 -8.412 1.00 0.00 C ATOM 1036 O GLY A 98 -23.830 -13.002 -9.109 1.00 0.00 O ATOM 0 H GLY A 98 -20.109 -11.644 -7.493 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -21.510 -12.088 -9.917 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -21.058 -13.278 -8.712 1.00 0.00 H new ATOM 1040 N HIS A 99 -23.292 -11.849 -7.248 1.00 0.00 N ATOM 1041 CA HIS A 99 -24.645 -11.838 -6.711 1.00 0.00 C ATOM 1042 C HIS A 99 -25.559 -10.978 -7.577 1.00 0.00 C ATOM 1043 O HIS A 99 -26.571 -11.460 -8.085 1.00 0.00 O ATOM 1044 CB HIS A 99 -24.638 -11.317 -5.269 1.00 0.00 C ATOM 1045 CG HIS A 99 -25.936 -11.521 -4.542 1.00 0.00 C ATOM 1046 ND1 HIS A 99 -26.105 -12.476 -3.565 1.00 0.00 N ATOM 1047 CD2 HIS A 99 -27.127 -10.884 -4.650 1.00 0.00 C ATOM 1048 CE1 HIS A 99 -27.343 -12.419 -3.106 1.00 0.00 C ATOM 1049 NE2 HIS A 99 -27.982 -11.461 -3.748 1.00 0.00 N ATOM 0 H HIS A 99 -22.604 -11.385 -6.656 1.00 0.00 H new ATOM 0 HA HIS A 99 -25.026 -12.859 -6.715 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -23.841 -11.816 -4.717 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -24.402 -10.253 -5.279 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -27.359 -10.072 -5.323 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -27.761 -13.050 -2.336 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -28.955 -11.193 -3.598 1.00 0.00 H new ATOM 1058 N TYR A 100 -25.204 -9.706 -7.740 1.00 0.00 N ATOM 1059 CA TYR A 100 -26.012 -8.789 -8.538 1.00 0.00 C ATOM 1060 C TYR A 100 -25.244 -7.496 -8.824 1.00 0.00 C ATOM 1061 O TYR A 100 -25.761 -6.395 -8.636 1.00 0.00 O ATOM 1062 CB TYR A 100 -27.330 -8.484 -7.811 1.00 0.00 C ATOM 1063 CG TYR A 100 -28.393 -7.872 -8.694 1.00 0.00 C ATOM 1064 CD1 TYR A 100 -28.878 -8.559 -9.798 1.00 0.00 C ATOM 1065 CD2 TYR A 100 -28.919 -6.616 -8.418 1.00 0.00 C ATOM 1066 CE1 TYR A 100 -29.857 -8.012 -10.603 1.00 0.00 C ATOM 1067 CE2 TYR A 100 -29.897 -6.062 -9.220 1.00 0.00 C ATOM 1068 CZ TYR A 100 -30.362 -6.765 -10.310 1.00 0.00 C ATOM 1069 OH TYR A 100 -31.340 -6.219 -11.109 1.00 0.00 O ATOM 0 H TYR A 100 -24.367 -9.289 -7.333 1.00 0.00 H new ATOM 0 HA TYR A 100 -26.238 -9.264 -9.493 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -27.717 -9.407 -7.381 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -27.127 -7.806 -6.982 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -28.483 -9.537 -10.031 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -28.557 -6.064 -7.563 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -30.225 -8.559 -11.458 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -30.295 -5.084 -8.994 1.00 0.00 H new ATOM 0 HH TYR A 100 -31.588 -5.336 -10.765 1.00 0.00 H new ATOM 1079 N GLY A 101 -24.001 -7.639 -9.271 1.00 0.00 N ATOM 1080 CA GLY A 101 -23.189 -6.480 -9.612 1.00 0.00 C ATOM 1081 C GLY A 101 -22.889 -5.599 -8.412 1.00 0.00 C ATOM 1082 O GLY A 101 -22.972 -4.372 -8.492 1.00 0.00 O ATOM 0 H GLY A 101 -23.538 -8.538 -9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -22.251 -6.816 -10.054 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -23.705 -5.891 -10.370 1.00 0.00 H new ATOM 1086 N ALA A 102 -22.538 -6.226 -7.303 1.00 0.00 N ATOM 1087 CA ALA A 102 -22.267 -5.508 -6.065 1.00 0.00 C ATOM 1088 C ALA A 102 -20.796 -5.151 -5.953 1.00 0.00 C ATOM 1089 O ALA A 102 -20.410 -4.005 -6.165 1.00 0.00 O ATOM 1090 CB ALA A 102 -22.698 -6.348 -4.880 1.00 0.00 C ATOM 0 H ALA A 102 -22.433 -7.238 -7.232 1.00 0.00 H new ATOM 0 HA ALA A 102 -22.837 -4.579 -6.072 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -22.493 -5.807 -3.956 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -23.766 -6.555 -4.950 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -22.145 -7.288 -4.880 1.00 0.00 H new ATOM 1096 N GLY A 103 -19.980 -6.141 -5.654 1.00 0.00 N ATOM 1097 CA GLY A 103 -18.568 -5.907 -5.485 1.00 0.00 C ATOM 1098 C GLY A 103 -18.100 -6.281 -4.106 1.00 0.00 C ATOM 1099 O GLY A 103 -18.718 -5.905 -3.112 1.00 0.00 O ATOM 0 H GLY A 103 -20.272 -7.110 -5.524 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -18.013 -6.483 -6.226 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -18.349 -4.855 -5.670 1.00 0.00 H new ATOM 1103 N ASP A 104 -17.008 -7.015 -4.060 1.00 0.00 N ATOM 1104 CA ASP A 104 -16.500 -7.591 -2.830 1.00 0.00 C ATOM 1105 C ASP A 104 -15.215 -6.886 -2.434 1.00 0.00 C ATOM 1106 O ASP A 104 -14.473 -6.420 -3.304 1.00 0.00 O ATOM 1107 CB ASP A 104 -16.256 -9.090 -3.047 1.00 0.00 C ATOM 1108 CG ASP A 104 -15.718 -9.804 -1.826 1.00 0.00 C ATOM 1109 OD1 ASP A 104 -16.134 -9.466 -0.706 1.00 0.00 O ATOM 1110 OD2 ASP A 104 -14.882 -10.718 -1.995 1.00 0.00 O ATOM 0 H ASP A 104 -16.443 -7.231 -4.881 1.00 0.00 H new ATOM 0 HA ASP A 104 -17.224 -7.463 -2.025 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -17.191 -9.561 -3.349 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -15.554 -9.219 -3.871 1.00 0.00 H new ATOM 1115 N VAL A 105 -14.959 -6.778 -1.140 1.00 0.00 N ATOM 1116 CA VAL A 105 -13.745 -6.132 -0.683 1.00 0.00 C ATOM 1117 C VAL A 105 -12.960 -7.051 0.249 1.00 0.00 C ATOM 1118 O VAL A 105 -13.305 -7.242 1.418 1.00 0.00 O ATOM 1119 CB VAL A 105 -14.000 -4.745 -0.028 1.00 0.00 C ATOM 1120 CG1 VAL A 105 -14.831 -4.824 1.232 1.00 0.00 C ATOM 1121 CG2 VAL A 105 -12.677 -4.048 0.231 1.00 0.00 C ATOM 0 H VAL A 105 -15.568 -7.125 -0.399 1.00 0.00 H new ATOM 0 HA VAL A 105 -13.142 -5.939 -1.570 1.00 0.00 H new ATOM 0 HB VAL A 105 -14.588 -4.158 -0.734 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -14.972 -3.822 1.638 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -15.802 -5.261 1.001 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -14.319 -5.445 1.967 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -12.861 -3.077 0.690 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -12.070 -4.657 0.901 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -12.148 -3.909 -0.712 1.00 0.00 H new ATOM 1131 N ILE A 106 -11.913 -7.646 -0.300 1.00 0.00 N ATOM 1132 CA ILE A 106 -11.062 -8.565 0.447 1.00 0.00 C ATOM 1133 C ILE A 106 -9.643 -8.508 -0.078 1.00 0.00 C ATOM 1134 O ILE A 106 -9.280 -7.620 -0.853 1.00 0.00 O ATOM 1135 CB ILE A 106 -11.513 -10.061 0.395 1.00 0.00 C ATOM 1136 CG1 ILE A 106 -11.230 -10.704 -0.983 1.00 0.00 C ATOM 1137 CG2 ILE A 106 -12.980 -10.222 0.765 1.00 0.00 C ATOM 1138 CD1 ILE A 106 -11.816 -9.961 -2.158 1.00 0.00 C ATOM 0 H ILE A 106 -11.628 -7.508 -1.270 1.00 0.00 H new ATOM 0 HA ILE A 106 -11.138 -8.230 1.481 1.00 0.00 H new ATOM 0 HB ILE A 106 -10.916 -10.588 1.139 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -10.151 -10.779 -1.119 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -11.622 -11.721 -0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -13.254 -11.276 0.717 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -13.143 -9.851 1.777 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -13.596 -9.655 0.067 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -11.567 -10.485 -3.081 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -12.900 -9.909 -2.052 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.406 -8.952 -2.192 1.00 0.00 H new ATOM 1150 N VAL A 107 -8.873 -9.492 0.330 1.00 0.00 N ATOM 1151 CA VAL A 107 -7.509 -9.644 -0.083 1.00 0.00 C ATOM 1152 C VAL A 107 -7.435 -9.988 -1.566 1.00 0.00 C ATOM 1153 O VAL A 107 -8.248 -10.750 -2.095 1.00 0.00 O ATOM 1154 CB VAL A 107 -6.824 -10.725 0.773 1.00 0.00 C ATOM 1155 CG1 VAL A 107 -7.207 -12.130 0.329 1.00 0.00 C ATOM 1156 CG2 VAL A 107 -5.314 -10.543 0.778 1.00 0.00 C ATOM 0 H VAL A 107 -9.190 -10.220 0.971 1.00 0.00 H new ATOM 0 HA VAL A 107 -6.983 -8.701 0.065 1.00 0.00 H new ATOM 0 HB VAL A 107 -7.183 -10.603 1.795 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -6.701 -12.861 0.960 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -8.286 -12.258 0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -6.908 -12.278 -0.709 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.856 -11.320 1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -4.936 -10.614 -0.242 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -5.067 -9.564 1.189 1.00 0.00 H new ATOM 1166 N TRP A 108 -6.487 -9.384 -2.235 1.00 0.00 N ATOM 1167 CA TRP A 108 -6.280 -9.625 -3.643 1.00 0.00 C ATOM 1168 C TRP A 108 -4.874 -10.145 -3.827 1.00 0.00 C ATOM 1169 O TRP A 108 -4.619 -11.077 -4.594 1.00 0.00 O ATOM 1170 CB TRP A 108 -6.479 -8.331 -4.425 1.00 0.00 C ATOM 1171 CG TRP A 108 -6.298 -8.488 -5.903 1.00 0.00 C ATOM 1172 CD1 TRP A 108 -7.182 -9.042 -6.778 1.00 0.00 C ATOM 1173 CD2 TRP A 108 -5.165 -8.080 -6.683 1.00 0.00 C ATOM 1174 NE1 TRP A 108 -6.671 -9.011 -8.051 1.00 0.00 N ATOM 1175 CE2 TRP A 108 -5.436 -8.423 -8.019 1.00 0.00 C ATOM 1176 CE3 TRP A 108 -3.949 -7.459 -6.381 1.00 0.00 C ATOM 1177 CZ2 TRP A 108 -4.538 -8.167 -9.052 1.00 0.00 C ATOM 1178 CZ3 TRP A 108 -3.058 -7.206 -7.407 1.00 0.00 C ATOM 1179 CH2 TRP A 108 -3.357 -7.559 -8.728 1.00 0.00 C ATOM 0 H TRP A 108 -5.838 -8.714 -1.823 1.00 0.00 H new ATOM 0 HA TRP A 108 -6.997 -10.357 -4.015 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -7.481 -7.949 -4.229 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -5.775 -7.584 -4.059 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -8.146 -9.447 -6.509 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -7.136 -9.368 -8.886 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -3.710 -7.182 -5.365 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -4.766 -8.439 -10.072 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -2.115 -6.728 -7.186 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -2.640 -7.347 -9.507 1.00 0.00 H new ATOM 1190 N ASP A 109 -3.973 -9.527 -3.087 1.00 0.00 N ATOM 1191 CA ASP A 109 -2.589 -9.926 -3.051 1.00 0.00 C ATOM 1192 C ASP A 109 -2.047 -9.787 -1.640 1.00 0.00 C ATOM 1193 O ASP A 109 -2.414 -8.872 -0.907 1.00 0.00 O ATOM 1194 CB ASP A 109 -1.764 -9.085 -4.018 1.00 0.00 C ATOM 1195 CG ASP A 109 -0.288 -9.116 -3.688 1.00 0.00 C ATOM 1196 OD1 ASP A 109 0.410 -9.997 -4.208 1.00 0.00 O ATOM 1197 OD2 ASP A 109 0.174 -8.262 -2.911 1.00 0.00 O ATOM 0 H ASP A 109 -4.188 -8.728 -2.491 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.518 -10.970 -3.357 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -1.915 -9.450 -5.034 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.118 -8.054 -3.994 1.00 0.00 H new ATOM 1202 N ARG A 110 -1.204 -10.718 -1.258 1.00 0.00 N ATOM 1203 CA ARG A 110 -0.548 -10.685 0.032 1.00 0.00 C ATOM 1204 C ARG A 110 0.779 -11.423 -0.059 1.00 0.00 C ATOM 1205 O ARG A 110 0.884 -12.425 -0.773 1.00 0.00 O ATOM 1206 CB ARG A 110 -1.453 -11.327 1.084 1.00 0.00 C ATOM 1207 CG ARG A 110 -0.819 -11.452 2.463 1.00 0.00 C ATOM 1208 CD ARG A 110 -1.669 -12.309 3.387 1.00 0.00 C ATOM 1209 NE ARG A 110 -3.056 -11.848 3.452 1.00 0.00 N ATOM 1210 CZ ARG A 110 -4.095 -12.657 3.672 1.00 0.00 C ATOM 1211 NH1 ARG A 110 -3.900 -13.953 3.888 1.00 0.00 N ATOM 1212 NH2 ARG A 110 -5.326 -12.167 3.682 1.00 0.00 N ATOM 0 H ARG A 110 -0.952 -11.522 -1.833 1.00 0.00 H new ATOM 0 HA ARG A 110 -0.356 -9.653 0.325 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.366 -10.738 1.169 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -1.744 -12.319 0.739 1.00 0.00 H new ATOM 0 HG2 ARG A 110 0.175 -11.890 2.370 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.692 -10.461 2.898 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -1.648 -13.343 3.042 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -1.238 -12.298 4.388 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.239 -10.853 3.322 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -2.954 -14.334 3.886 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -4.697 -14.568 4.056 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -5.480 -11.172 3.522 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -6.120 -12.785 3.850 1.00 0.00 H new ATOM 1226 N GLY A 111 1.792 -10.926 0.636 1.00 0.00 N ATOM 1227 CA GLY A 111 3.085 -11.567 0.588 1.00 0.00 C ATOM 1228 C GLY A 111 4.115 -10.907 1.476 1.00 0.00 C ATOM 1229 O GLY A 111 3.839 -10.573 2.629 1.00 0.00 O ATOM 0 H GLY A 111 1.741 -10.097 1.227 1.00 0.00 H new ATOM 0 HA2 GLY A 111 2.976 -12.610 0.884 1.00 0.00 H new ATOM 0 HA3 GLY A 111 3.446 -11.563 -0.440 1.00 0.00 H new ATOM 1233 N ALA A 112 5.301 -10.701 0.925 1.00 0.00 N ATOM 1234 CA ALA A 112 6.435 -10.211 1.690 1.00 0.00 C ATOM 1235 C ALA A 112 6.984 -8.929 1.104 1.00 0.00 C ATOM 1236 O ALA A 112 6.751 -8.624 -0.064 1.00 0.00 O ATOM 1237 CB ALA A 112 7.535 -11.250 1.704 1.00 0.00 C ATOM 0 H ALA A 112 5.503 -10.868 -0.061 1.00 0.00 H new ATOM 0 HA ALA A 112 6.088 -10.013 2.704 1.00 0.00 H new ATOM 0 HB1 ALA A 112 8.382 -10.876 2.279 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.163 -12.167 2.161 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.853 -11.457 0.682 1.00 0.00 H new ATOM 1243 N TRP A 113 7.729 -8.195 1.911 1.00 0.00 N ATOM 1244 CA TRP A 113 8.435 -7.034 1.415 1.00 0.00 C ATOM 1245 C TRP A 113 9.720 -6.794 2.184 1.00 0.00 C ATOM 1246 O TRP A 113 9.783 -6.970 3.402 1.00 0.00 O ATOM 1247 CB TRP A 113 7.554 -5.781 1.427 1.00 0.00 C ATOM 1248 CG TRP A 113 7.144 -5.275 2.777 1.00 0.00 C ATOM 1249 CD1 TRP A 113 6.146 -5.752 3.565 1.00 0.00 C ATOM 1250 CD2 TRP A 113 7.693 -4.151 3.470 1.00 0.00 C ATOM 1251 NE1 TRP A 113 6.040 -4.995 4.707 1.00 0.00 N ATOM 1252 CE2 TRP A 113 6.980 -4.007 4.668 1.00 0.00 C ATOM 1253 CE3 TRP A 113 8.720 -3.258 3.189 1.00 0.00 C ATOM 1254 CZ2 TRP A 113 7.260 -2.997 5.581 1.00 0.00 C ATOM 1255 CZ3 TRP A 113 9.003 -2.253 4.090 1.00 0.00 C ATOM 1256 CH2 TRP A 113 8.273 -2.128 5.274 1.00 0.00 C ATOM 0 H TRP A 113 7.859 -8.383 2.905 1.00 0.00 H new ATOM 0 HA TRP A 113 8.696 -7.244 0.378 1.00 0.00 H new ATOM 0 HB2 TRP A 113 8.086 -4.983 0.909 1.00 0.00 H new ATOM 0 HB3 TRP A 113 6.653 -5.990 0.851 1.00 0.00 H new ATOM 0 HD1 TRP A 113 5.525 -6.603 3.328 1.00 0.00 H new ATOM 0 HE1 TRP A 113 5.369 -5.147 5.460 1.00 0.00 H new ATOM 0 HE3 TRP A 113 9.290 -3.350 2.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 6.699 -2.901 6.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 9.799 -1.554 3.877 1.00 0.00 H new ATOM 0 HH2 TRP A 113 8.512 -1.330 5.961 1.00 0.00 H new ATOM 1267 N THR A 114 10.747 -6.424 1.445 1.00 0.00 N ATOM 1268 CA THR A 114 12.031 -6.091 2.024 1.00 0.00 C ATOM 1269 C THR A 114 12.210 -4.579 2.065 1.00 0.00 C ATOM 1270 O THR A 114 11.941 -3.892 1.081 1.00 0.00 O ATOM 1271 CB THR A 114 13.187 -6.741 1.219 1.00 0.00 C ATOM 1272 OG1 THR A 114 13.755 -7.827 1.965 1.00 0.00 O ATOM 1273 CG2 THR A 114 14.279 -5.732 0.865 1.00 0.00 C ATOM 0 H THR A 114 10.714 -6.346 0.429 1.00 0.00 H new ATOM 0 HA THR A 114 12.059 -6.483 3.041 1.00 0.00 H new ATOM 0 HB THR A 114 12.765 -7.114 0.286 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.483 -8.233 1.449 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.067 -6.232 0.302 1.00 0.00 H new ATOM 0 HG22 THR A 114 13.853 -4.932 0.260 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.697 -5.312 1.780 1.00 0.00 H new ATOM 1281 N PRO A 115 12.627 -4.034 3.214 1.00 0.00 N ATOM 1282 CA PRO A 115 13.006 -2.631 3.303 1.00 0.00 C ATOM 1283 C PRO A 115 14.221 -2.338 2.420 1.00 0.00 C ATOM 1284 O PRO A 115 15.299 -2.905 2.615 1.00 0.00 O ATOM 1285 CB PRO A 115 13.362 -2.428 4.778 1.00 0.00 C ATOM 1286 CG PRO A 115 13.540 -3.794 5.352 1.00 0.00 C ATOM 1287 CD PRO A 115 12.733 -4.733 4.504 1.00 0.00 C ATOM 0 HA PRO A 115 12.210 -1.967 2.965 1.00 0.00 H new ATOM 0 HB2 PRO A 115 14.274 -1.840 4.882 1.00 0.00 H new ATOM 0 HB3 PRO A 115 12.572 -1.886 5.299 1.00 0.00 H new ATOM 0 HG2 PRO A 115 14.592 -4.079 5.350 1.00 0.00 H new ATOM 0 HG3 PRO A 115 13.204 -3.824 6.388 1.00 0.00 H new ATOM 0 HD2 PRO A 115 13.226 -5.699 4.397 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.752 -4.922 4.939 1.00 0.00 H new ATOM 1295 N LEU A 116 14.034 -1.452 1.452 1.00 0.00 N ATOM 1296 CA LEU A 116 15.113 -1.029 0.562 1.00 0.00 C ATOM 1297 C LEU A 116 15.964 0.005 1.277 1.00 0.00 C ATOM 1298 O LEU A 116 17.174 0.093 1.078 1.00 0.00 O ATOM 1299 CB LEU A 116 14.534 -0.440 -0.734 1.00 0.00 C ATOM 1300 CG LEU A 116 14.229 -1.418 -1.874 1.00 0.00 C ATOM 1301 CD1 LEU A 116 13.943 -2.819 -1.367 1.00 0.00 C ATOM 1302 CD2 LEU A 116 13.090 -0.908 -2.720 1.00 0.00 C ATOM 0 H LEU A 116 13.137 -1.007 1.260 1.00 0.00 H new ATOM 0 HA LEU A 116 15.729 -1.889 0.299 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.612 0.085 -0.484 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.235 0.307 -1.108 1.00 0.00 H new ATOM 0 HG LEU A 116 15.123 -1.481 -2.494 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.733 -3.476 -2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.810 -3.193 -0.823 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.080 -2.796 -0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.888 -1.616 -3.524 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.199 -0.797 -2.102 1.00 0.00 H new ATOM 0 HD23 LEU A 116 13.358 0.059 -3.147 1.00 0.00 H new ATOM 1314 N ASP A 117 15.300 0.785 2.109 1.00 0.00 N ATOM 1315 CA ASP A 117 15.956 1.744 2.979 1.00 0.00 C ATOM 1316 C ASP A 117 15.528 1.419 4.406 1.00 0.00 C ATOM 1317 O ASP A 117 15.338 0.244 4.732 1.00 0.00 O ATOM 1318 CB ASP A 117 15.557 3.174 2.577 1.00 0.00 C ATOM 1319 CG ASP A 117 16.473 4.239 3.153 1.00 0.00 C ATOM 1320 OD1 ASP A 117 17.521 4.530 2.534 1.00 0.00 O ATOM 1321 OD2 ASP A 117 16.139 4.802 4.218 1.00 0.00 O ATOM 0 H ASP A 117 14.284 0.771 2.201 1.00 0.00 H new ATOM 0 HA ASP A 117 17.041 1.683 2.897 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.560 3.252 1.490 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.536 3.365 2.908 1.00 0.00 H new ATOM 1326 N ASP A 118 15.360 2.415 5.254 1.00 0.00 N ATOM 1327 CA ASP A 118 14.797 2.180 6.569 1.00 0.00 C ATOM 1328 C ASP A 118 13.282 2.056 6.464 1.00 0.00 C ATOM 1329 O ASP A 118 12.618 2.980 6.018 1.00 0.00 O ATOM 1330 CB ASP A 118 15.154 3.320 7.516 1.00 0.00 C ATOM 1331 CG ASP A 118 16.480 3.119 8.221 1.00 0.00 C ATOM 1332 OD1 ASP A 118 16.490 2.514 9.316 1.00 0.00 O ATOM 1333 OD2 ASP A 118 17.514 3.578 7.692 1.00 0.00 O ATOM 0 H ASP A 118 15.603 3.386 5.059 1.00 0.00 H new ATOM 0 HA ASP A 118 15.213 1.254 6.966 1.00 0.00 H new ATOM 0 HB2 ASP A 118 15.187 4.253 6.954 1.00 0.00 H new ATOM 0 HB3 ASP A 118 14.366 3.424 8.262 1.00 0.00 H new ATOM 1338 N PRO A 119 12.726 0.904 6.868 1.00 0.00 N ATOM 1339 CA PRO A 119 11.276 0.630 6.793 1.00 0.00 C ATOM 1340 C PRO A 119 10.514 1.476 7.774 1.00 0.00 C ATOM 1341 O PRO A 119 9.458 2.026 7.481 1.00 0.00 O ATOM 1342 CB PRO A 119 11.180 -0.834 7.230 1.00 0.00 C ATOM 1343 CG PRO A 119 12.368 -1.018 8.114 1.00 0.00 C ATOM 1344 CD PRO A 119 13.459 -0.224 7.459 1.00 0.00 C ATOM 0 HA PRO A 119 10.865 0.838 5.805 1.00 0.00 H new ATOM 0 HB2 PRO A 119 10.250 -1.033 7.763 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.208 -1.510 6.375 1.00 0.00 H new ATOM 0 HG2 PRO A 119 12.169 -0.659 9.124 1.00 0.00 H new ATOM 0 HG3 PRO A 119 12.640 -2.070 8.197 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.205 0.111 8.180 1.00 0.00 H new ATOM 0 HD3 PRO A 119 13.985 -0.806 6.702 1.00 0.00 H new ATOM 1352 N ARG A 120 11.079 1.554 8.946 1.00 0.00 N ATOM 1353 CA ARG A 120 10.503 2.278 10.023 1.00 0.00 C ATOM 1354 C ARG A 120 10.830 3.743 9.834 1.00 0.00 C ATOM 1355 O ARG A 120 9.941 4.593 9.817 1.00 0.00 O ATOM 1356 CB ARG A 120 11.093 1.748 11.327 1.00 0.00 C ATOM 1357 CG ARG A 120 10.256 2.042 12.562 1.00 0.00 C ATOM 1358 CD ARG A 120 9.987 3.521 12.699 1.00 0.00 C ATOM 1359 NE ARG A 120 8.918 3.806 13.651 1.00 0.00 N ATOM 1360 CZ ARG A 120 8.998 4.715 14.618 1.00 0.00 C ATOM 1361 NH1 ARG A 120 10.092 5.454 14.760 1.00 0.00 N ATOM 1362 NH2 ARG A 120 7.972 4.897 15.436 1.00 0.00 N ATOM 0 H ARG A 120 11.967 1.106 9.174 1.00 0.00 H new ATOM 0 HA ARG A 120 9.420 2.159 10.054 1.00 0.00 H new ATOM 0 HB2 ARG A 120 11.224 0.669 11.240 1.00 0.00 H new ATOM 0 HB3 ARG A 120 12.085 2.179 11.464 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.311 1.502 12.501 1.00 0.00 H new ATOM 0 HG3 ARG A 120 10.774 1.680 13.450 1.00 0.00 H new ATOM 0 HD2 ARG A 120 10.899 4.025 13.019 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.721 3.931 11.725 1.00 0.00 H new ATOM 0 HE ARG A 120 8.052 3.273 13.569 1.00 0.00 H new ATOM 0 HH11 ARG A 120 10.880 5.327 14.124 1.00 0.00 H new ATOM 0 HH12 ARG A 120 10.145 6.149 15.505 1.00 0.00 H new ATOM 0 HH21 ARG A 120 7.125 4.341 15.323 1.00 0.00 H new ATOM 0 HH22 ARG A 120 8.029 5.593 16.179 1.00 0.00 H new ATOM 1376 N GLU A 121 12.112 4.027 9.653 1.00 0.00 N ATOM 1377 CA GLU A 121 12.558 5.407 9.586 1.00 0.00 C ATOM 1378 C GLU A 121 12.014 6.074 8.355 1.00 0.00 C ATOM 1379 O GLU A 121 11.422 7.118 8.449 1.00 0.00 O ATOM 1380 CB GLU A 121 14.069 5.519 9.566 1.00 0.00 C ATOM 1381 CG GLU A 121 14.564 6.943 9.617 1.00 0.00 C ATOM 1382 CD GLU A 121 14.151 7.676 10.874 1.00 0.00 C ATOM 1383 OE1 GLU A 121 13.005 8.161 10.936 1.00 0.00 O ATOM 1384 OE2 GLU A 121 14.966 7.769 11.810 1.00 0.00 O ATOM 0 H GLU A 121 12.850 3.330 9.551 1.00 0.00 H new ATOM 0 HA GLU A 121 12.184 5.900 10.483 1.00 0.00 H new ATOM 0 HB2 GLU A 121 14.478 4.969 10.414 1.00 0.00 H new ATOM 0 HB3 GLU A 121 14.450 5.042 8.663 1.00 0.00 H new ATOM 0 HG2 GLU A 121 15.652 6.945 9.544 1.00 0.00 H new ATOM 0 HG3 GLU A 121 14.186 7.483 8.749 1.00 0.00 H new ATOM 1391 N GLY A 122 12.228 5.459 7.206 1.00 0.00 N ATOM 1392 CA GLY A 122 11.729 6.000 5.956 1.00 0.00 C ATOM 1393 C GLY A 122 10.261 6.383 6.016 1.00 0.00 C ATOM 1394 O GLY A 122 9.831 7.344 5.387 1.00 0.00 O ATOM 0 H GLY A 122 12.744 4.584 7.113 1.00 0.00 H new ATOM 0 HA2 GLY A 122 12.317 6.878 5.687 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.874 5.264 5.165 1.00 0.00 H new ATOM 1398 N LEU A 123 9.507 5.648 6.804 1.00 0.00 N ATOM 1399 CA LEU A 123 8.077 5.846 6.916 1.00 0.00 C ATOM 1400 C LEU A 123 7.790 7.011 7.876 1.00 0.00 C ATOM 1401 O LEU A 123 6.742 7.649 7.819 1.00 0.00 O ATOM 1402 CB LEU A 123 7.457 4.527 7.402 1.00 0.00 C ATOM 1403 CG LEU A 123 5.948 4.341 7.227 1.00 0.00 C ATOM 1404 CD1 LEU A 123 5.210 4.661 8.516 1.00 0.00 C ATOM 1405 CD2 LEU A 123 5.435 5.206 6.104 1.00 0.00 C ATOM 0 H LEU A 123 9.869 4.894 7.387 1.00 0.00 H new ATOM 0 HA LEU A 123 7.635 6.110 5.955 1.00 0.00 H new ATOM 0 HB2 LEU A 123 7.958 3.710 6.882 1.00 0.00 H new ATOM 0 HB3 LEU A 123 7.687 4.419 8.462 1.00 0.00 H new ATOM 0 HG LEU A 123 5.764 3.296 6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 123 4.139 4.521 8.367 1.00 0.00 H new ATOM 0 HD12 LEU A 123 5.556 3.996 9.308 1.00 0.00 H new ATOM 0 HD13 LEU A 123 5.405 5.695 8.800 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.360 5.060 5.994 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.638 6.253 6.329 1.00 0.00 H new ATOM 0 HD23 LEU A 123 5.935 4.931 5.175 1.00 0.00 H new ATOM 1417 N GLU A 124 8.736 7.268 8.763 1.00 0.00 N ATOM 1418 CA GLU A 124 8.703 8.446 9.622 1.00 0.00 C ATOM 1419 C GLU A 124 9.315 9.646 8.915 1.00 0.00 C ATOM 1420 O GLU A 124 8.736 10.728 8.857 1.00 0.00 O ATOM 1421 CB GLU A 124 9.476 8.171 10.898 1.00 0.00 C ATOM 1422 CG GLU A 124 8.967 6.975 11.660 1.00 0.00 C ATOM 1423 CD GLU A 124 7.535 7.152 12.123 1.00 0.00 C ATOM 1424 OE1 GLU A 124 7.251 8.154 12.817 1.00 0.00 O ATOM 1425 OE2 GLU A 124 6.689 6.289 11.814 1.00 0.00 O ATOM 0 H GLU A 124 9.548 6.669 8.910 1.00 0.00 H new ATOM 0 HA GLU A 124 7.663 8.669 9.859 1.00 0.00 H new ATOM 0 HB2 GLU A 124 10.526 8.015 10.651 1.00 0.00 H new ATOM 0 HB3 GLU A 124 9.426 9.050 11.541 1.00 0.00 H new ATOM 0 HG2 GLU A 124 9.035 6.089 11.028 1.00 0.00 H new ATOM 0 HG3 GLU A 124 9.607 6.799 12.525 1.00 0.00 H new ATOM 1432 N LYS A 125 10.498 9.418 8.365 1.00 0.00 N ATOM 1433 CA LYS A 125 11.326 10.461 7.802 1.00 0.00 C ATOM 1434 C LYS A 125 10.772 10.943 6.462 1.00 0.00 C ATOM 1435 O LYS A 125 11.150 12.006 5.971 1.00 0.00 O ATOM 1436 CB LYS A 125 12.779 9.963 7.666 1.00 0.00 C ATOM 1437 CG LYS A 125 12.992 8.952 6.563 1.00 0.00 C ATOM 1438 CD LYS A 125 14.302 9.171 5.810 1.00 0.00 C ATOM 1439 CE LYS A 125 15.532 8.771 6.622 1.00 0.00 C ATOM 1440 NZ LYS A 125 15.883 9.763 7.673 1.00 0.00 N ATOM 0 H LYS A 125 10.911 8.488 8.299 1.00 0.00 H new ATOM 0 HA LYS A 125 11.318 11.316 8.478 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.429 10.820 7.487 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.089 9.520 8.613 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.985 7.949 6.989 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.160 9.006 5.861 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.283 8.597 4.884 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.383 10.222 5.532 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.353 7.803 7.090 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.380 8.648 5.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 16.889 9.667 7.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.704 10.724 7.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.302 9.593 8.519 1.00 0.00 H new ATOM 1454 N GLY A 126 9.877 10.158 5.871 1.00 0.00 N ATOM 1455 CA GLY A 126 9.192 10.602 4.667 1.00 0.00 C ATOM 1456 C GLY A 126 9.750 9.995 3.397 1.00 0.00 C ATOM 1457 O GLY A 126 9.284 10.307 2.300 1.00 0.00 O ATOM 0 H GLY A 126 9.614 9.229 6.200 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.134 10.351 4.746 1.00 0.00 H new ATOM 0 HA3 GLY A 126 9.257 11.688 4.601 1.00 0.00 H new ATOM 1461 N HIS A 127 10.738 9.125 3.535 1.00 0.00 N ATOM 1462 CA HIS A 127 11.343 8.475 2.382 1.00 0.00 C ATOM 1463 C HIS A 127 11.438 6.978 2.600 1.00 0.00 C ATOM 1464 O HIS A 127 12.385 6.483 3.208 1.00 0.00 O ATOM 1465 CB HIS A 127 12.728 9.071 2.101 1.00 0.00 C ATOM 1466 CG HIS A 127 13.432 8.453 0.933 1.00 0.00 C ATOM 1467 ND1 HIS A 127 14.390 7.472 1.068 1.00 0.00 N ATOM 1468 CD2 HIS A 127 13.318 8.682 -0.396 1.00 0.00 C ATOM 1469 CE1 HIS A 127 14.832 7.123 -0.123 1.00 0.00 C ATOM 1470 NE2 HIS A 127 14.198 7.842 -1.026 1.00 0.00 N ATOM 0 H HIS A 127 11.138 8.852 4.433 1.00 0.00 H new ATOM 0 HA HIS A 127 10.708 8.651 1.513 1.00 0.00 H new ATOM 0 HB2 HIS A 127 12.622 10.141 1.924 1.00 0.00 H new ATOM 0 HB3 HIS A 127 13.349 8.955 2.989 1.00 0.00 H new ATOM 0 HD2 HIS A 127 12.658 9.393 -0.870 1.00 0.00 H new ATOM 0 HE1 HIS A 127 15.585 6.375 -0.324 1.00 0.00 H new ATOM 0 HE2 HIS A 127 14.340 7.783 -2.034 1.00 0.00 H new ATOM 1479 N LEU A 128 10.471 6.266 2.058 1.00 0.00 N ATOM 1480 CA LEU A 128 10.374 4.838 2.264 1.00 0.00 C ATOM 1481 C LEU A 128 10.723 4.084 0.997 1.00 0.00 C ATOM 1482 O LEU A 128 10.411 4.527 -0.108 1.00 0.00 O ATOM 1483 CB LEU A 128 8.963 4.454 2.726 1.00 0.00 C ATOM 1484 CG LEU A 128 8.922 3.229 3.632 1.00 0.00 C ATOM 1485 CD1 LEU A 128 10.046 3.343 4.613 1.00 0.00 C ATOM 1486 CD2 LEU A 128 7.604 3.112 4.367 1.00 0.00 C ATOM 0 H LEU A 128 9.737 6.658 1.468 1.00 0.00 H new ATOM 0 HA LEU A 128 11.088 4.563 3.041 1.00 0.00 H new ATOM 0 HB2 LEU A 128 8.522 5.299 3.254 1.00 0.00 H new ATOM 0 HB3 LEU A 128 8.343 4.267 1.850 1.00 0.00 H new ATOM 0 HG LEU A 128 9.026 2.332 3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 128 10.040 2.477 5.275 1.00 0.00 H new ATOM 0 HD12 LEU A 128 10.994 3.383 4.077 1.00 0.00 H new ATOM 0 HD13 LEU A 128 9.924 4.252 5.203 1.00 0.00 H new ATOM 0 HD21 LEU A 128 7.618 2.225 5.001 1.00 0.00 H new ATOM 0 HD22 LEU A 128 7.452 3.997 4.985 1.00 0.00 H new ATOM 0 HD23 LEU A 128 6.791 3.029 3.646 1.00 0.00 H new ATOM 1498 N SER A 129 11.379 2.951 1.158 1.00 0.00 N ATOM 1499 CA SER A 129 11.712 2.103 0.036 1.00 0.00 C ATOM 1500 C SER A 129 11.563 0.647 0.432 1.00 0.00 C ATOM 1501 O SER A 129 11.873 0.274 1.566 1.00 0.00 O ATOM 1502 CB SER A 129 13.134 2.393 -0.448 1.00 0.00 C ATOM 1503 OG SER A 129 13.383 3.788 -0.509 1.00 0.00 O ATOM 0 H SER A 129 11.692 2.597 2.062 1.00 0.00 H new ATOM 0 HA SER A 129 11.027 2.313 -0.786 1.00 0.00 H new ATOM 0 HB2 SER A 129 13.852 1.922 0.223 1.00 0.00 H new ATOM 0 HB3 SER A 129 13.282 1.951 -1.434 1.00 0.00 H new ATOM 0 HG SER A 129 12.793 4.197 -1.177 1.00 0.00 H new ATOM 1509 N PHE A 130 11.103 -0.174 -0.504 1.00 0.00 N ATOM 1510 CA PHE A 130 10.783 -1.563 -0.221 1.00 0.00 C ATOM 1511 C PHE A 130 10.481 -2.355 -1.481 1.00 0.00 C ATOM 1512 O PHE A 130 9.896 -1.843 -2.424 1.00 0.00 O ATOM 1513 CB PHE A 130 9.610 -1.691 0.738 1.00 0.00 C ATOM 1514 CG PHE A 130 8.505 -0.690 0.574 1.00 0.00 C ATOM 1515 CD1 PHE A 130 7.541 -0.829 -0.413 1.00 0.00 C ATOM 1516 CD2 PHE A 130 8.412 0.372 1.448 1.00 0.00 C ATOM 1517 CE1 PHE A 130 6.507 0.078 -0.511 1.00 0.00 C ATOM 1518 CE2 PHE A 130 7.389 1.279 1.341 1.00 0.00 C ATOM 1519 CZ PHE A 130 6.438 1.126 0.363 1.00 0.00 C ATOM 0 H PHE A 130 10.943 0.103 -1.472 1.00 0.00 H new ATOM 0 HA PHE A 130 11.675 -1.979 0.247 1.00 0.00 H new ATOM 0 HB2 PHE A 130 9.186 -2.689 0.629 1.00 0.00 H new ATOM 0 HB3 PHE A 130 9.991 -1.616 1.756 1.00 0.00 H new ATOM 0 HD1 PHE A 130 7.600 -1.653 -1.109 1.00 0.00 H new ATOM 0 HD2 PHE A 130 9.153 0.491 2.225 1.00 0.00 H new ATOM 0 HE1 PHE A 130 5.754 -0.040 -1.276 1.00 0.00 H new ATOM 0 HE2 PHE A 130 7.332 2.113 2.025 1.00 0.00 H new ATOM 0 HZ PHE A 130 5.630 1.838 0.284 1.00 0.00 H new ATOM 1529 N ALA A 131 10.898 -3.602 -1.479 1.00 0.00 N ATOM 1530 CA ALA A 131 10.600 -4.511 -2.567 1.00 0.00 C ATOM 1531 C ALA A 131 9.407 -5.379 -2.203 1.00 0.00 C ATOM 1532 O ALA A 131 9.422 -6.055 -1.177 1.00 0.00 O ATOM 1533 CB ALA A 131 11.818 -5.363 -2.872 1.00 0.00 C ATOM 0 H ALA A 131 11.451 -4.014 -0.727 1.00 0.00 H new ATOM 0 HA ALA A 131 10.347 -3.939 -3.460 1.00 0.00 H new ATOM 0 HB1 ALA A 131 11.589 -6.045 -3.691 1.00 0.00 H new ATOM 0 HB2 ALA A 131 12.650 -4.719 -3.158 1.00 0.00 H new ATOM 0 HB3 ALA A 131 12.091 -5.938 -1.987 1.00 0.00 H new ATOM 1539 N LEU A 132 8.382 -5.355 -3.041 1.00 0.00 N ATOM 1540 CA LEU A 132 7.130 -6.034 -2.740 1.00 0.00 C ATOM 1541 C LEU A 132 7.010 -7.309 -3.554 1.00 0.00 C ATOM 1542 O LEU A 132 7.166 -7.281 -4.767 1.00 0.00 O ATOM 1543 CB LEU A 132 5.939 -5.119 -3.057 1.00 0.00 C ATOM 1544 CG LEU A 132 5.932 -3.766 -2.344 1.00 0.00 C ATOM 1545 CD1 LEU A 132 4.710 -2.956 -2.742 1.00 0.00 C ATOM 1546 CD2 LEU A 132 5.971 -3.955 -0.840 1.00 0.00 C ATOM 0 H LEU A 132 8.393 -4.871 -3.939 1.00 0.00 H new ATOM 0 HA LEU A 132 7.124 -6.282 -1.679 1.00 0.00 H new ATOM 0 HB2 LEU A 132 5.917 -4.942 -4.132 1.00 0.00 H new ATOM 0 HB3 LEU A 132 5.021 -5.648 -2.802 1.00 0.00 H new ATOM 0 HG LEU A 132 6.824 -3.218 -2.648 1.00 0.00 H new ATOM 0 HD11 LEU A 132 4.724 -1.997 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 132 4.721 -2.787 -3.819 1.00 0.00 H new ATOM 0 HD13 LEU A 132 3.807 -3.502 -2.470 1.00 0.00 H new ATOM 0 HD21 LEU A 132 5.965 -2.981 -0.351 1.00 0.00 H new ATOM 0 HD22 LEU A 132 5.098 -4.526 -0.522 1.00 0.00 H new ATOM 0 HD23 LEU A 132 6.877 -4.494 -0.564 1.00 0.00 H new ATOM 1558 N ASP A 133 6.748 -8.424 -2.890 1.00 0.00 N ATOM 1559 CA ASP A 133 6.551 -9.693 -3.585 1.00 0.00 C ATOM 1560 C ASP A 133 5.526 -10.558 -2.871 1.00 0.00 C ATOM 1561 O ASP A 133 5.814 -11.135 -1.817 1.00 0.00 O ATOM 1562 CB ASP A 133 7.864 -10.468 -3.700 1.00 0.00 C ATOM 1563 CG ASP A 133 8.781 -9.924 -4.786 1.00 0.00 C ATOM 1564 OD1 ASP A 133 8.457 -10.085 -5.981 1.00 0.00 O ATOM 1565 OD2 ASP A 133 9.833 -9.349 -4.451 1.00 0.00 O ATOM 0 H ASP A 133 6.666 -8.479 -1.875 1.00 0.00 H new ATOM 0 HA ASP A 133 6.185 -9.455 -4.584 1.00 0.00 H new ATOM 0 HB2 ASP A 133 8.384 -10.435 -2.743 1.00 0.00 H new ATOM 0 HB3 ASP A 133 7.645 -11.515 -3.908 1.00 0.00 H new ATOM 1570 N GLY A 134 4.330 -10.649 -3.435 1.00 0.00 N ATOM 1571 CA GLY A 134 3.324 -11.504 -2.864 1.00 0.00 C ATOM 1572 C GLY A 134 2.637 -12.368 -3.890 1.00 0.00 C ATOM 1573 O GLY A 134 3.274 -12.923 -4.789 1.00 0.00 O ATOM 0 H GLY A 134 4.044 -10.146 -4.275 1.00 0.00 H new ATOM 0 HA2 GLY A 134 3.783 -12.141 -2.108 1.00 0.00 H new ATOM 0 HA3 GLY A 134 2.580 -10.891 -2.355 1.00 0.00 H new ATOM 1577 N GLU A 135 1.330 -12.458 -3.749 1.00 0.00 N ATOM 1578 CA GLU A 135 0.495 -13.305 -4.567 1.00 0.00 C ATOM 1579 C GLU A 135 0.449 -12.828 -6.027 1.00 0.00 C ATOM 1580 O GLU A 135 0.852 -13.554 -6.937 1.00 0.00 O ATOM 1581 CB GLU A 135 -0.896 -13.313 -3.942 1.00 0.00 C ATOM 1582 CG GLU A 135 -1.951 -13.998 -4.777 1.00 0.00 C ATOM 1583 CD GLU A 135 -1.676 -15.471 -4.968 1.00 0.00 C ATOM 1584 OE1 GLU A 135 -1.956 -16.261 -4.045 1.00 0.00 O ATOM 1585 OE2 GLU A 135 -1.193 -15.854 -6.049 1.00 0.00 O ATOM 0 H GLU A 135 0.810 -11.932 -3.046 1.00 0.00 H new ATOM 0 HA GLU A 135 0.906 -14.314 -4.597 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.842 -13.806 -2.971 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -1.205 -12.284 -3.760 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -2.924 -13.873 -4.301 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -2.008 -13.514 -5.752 1.00 0.00 H new ATOM 1592 N LYS A 136 -0.027 -11.607 -6.245 1.00 0.00 N ATOM 1593 CA LYS A 136 -0.168 -11.062 -7.595 1.00 0.00 C ATOM 1594 C LYS A 136 0.720 -9.839 -7.780 1.00 0.00 C ATOM 1595 O LYS A 136 1.139 -9.518 -8.894 1.00 0.00 O ATOM 1596 CB LYS A 136 -1.620 -10.670 -7.893 1.00 0.00 C ATOM 1597 CG LYS A 136 -2.614 -11.820 -7.843 1.00 0.00 C ATOM 1598 CD LYS A 136 -2.201 -12.961 -8.758 1.00 0.00 C ATOM 1599 CE LYS A 136 -3.235 -14.075 -8.759 1.00 0.00 C ATOM 1600 NZ LYS A 136 -2.841 -15.197 -9.647 1.00 0.00 N ATOM 0 H LYS A 136 -0.323 -10.972 -5.503 1.00 0.00 H new ATOM 0 HA LYS A 136 0.137 -11.846 -8.288 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -1.930 -9.909 -7.177 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -1.663 -10.214 -8.882 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -2.696 -12.186 -6.820 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -3.601 -11.460 -8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -2.068 -12.585 -9.773 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -1.238 -13.357 -8.436 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -3.369 -14.446 -7.743 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -4.197 -13.677 -9.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -3.573 -15.935 -9.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -2.738 -14.849 -10.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -1.936 -15.594 -9.324 1.00 0.00 H new ATOM 1614 N LEU A 137 0.998 -9.160 -6.684 1.00 0.00 N ATOM 1615 CA LEU A 137 1.782 -7.941 -6.711 1.00 0.00 C ATOM 1616 C LEU A 137 3.245 -8.294 -6.485 1.00 0.00 C ATOM 1617 O LEU A 137 3.564 -9.193 -5.706 1.00 0.00 O ATOM 1618 CB LEU A 137 1.263 -6.976 -5.638 1.00 0.00 C ATOM 1619 CG LEU A 137 1.508 -5.488 -5.886 1.00 0.00 C ATOM 1620 CD1 LEU A 137 0.602 -4.658 -4.991 1.00 0.00 C ATOM 1621 CD2 LEU A 137 2.962 -5.121 -5.646 1.00 0.00 C ATOM 0 H LEU A 137 0.688 -9.437 -5.753 1.00 0.00 H new ATOM 0 HA LEU A 137 1.690 -7.446 -7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 137 0.190 -7.132 -5.529 1.00 0.00 H new ATOM 0 HB3 LEU A 137 1.722 -7.244 -4.687 1.00 0.00 H new ATOM 0 HG LEU A 137 1.277 -5.274 -6.930 1.00 0.00 H new ATOM 0 HD11 LEU A 137 0.782 -3.599 -5.173 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -0.440 -4.892 -5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 137 0.813 -4.888 -3.947 1.00 0.00 H new ATOM 0 HD21 LEU A 137 3.104 -4.056 -5.831 1.00 0.00 H new ATOM 0 HD22 LEU A 137 3.229 -5.349 -4.614 1.00 0.00 H new ATOM 0 HD23 LEU A 137 3.598 -5.694 -6.321 1.00 0.00 H new ATOM 1633 N SER A 138 4.123 -7.613 -7.198 1.00 0.00 N ATOM 1634 CA SER A 138 5.547 -7.866 -7.083 1.00 0.00 C ATOM 1635 C SER A 138 6.361 -6.749 -7.731 1.00 0.00 C ATOM 1636 O SER A 138 5.820 -5.913 -8.463 1.00 0.00 O ATOM 1637 CB SER A 138 5.901 -9.226 -7.697 1.00 0.00 C ATOM 1638 OG SER A 138 5.399 -9.348 -9.021 1.00 0.00 O ATOM 0 H SER A 138 3.875 -6.880 -7.863 1.00 0.00 H new ATOM 0 HA SER A 138 5.802 -7.889 -6.023 1.00 0.00 H new ATOM 0 HB2 SER A 138 6.984 -9.352 -7.705 1.00 0.00 H new ATOM 0 HB3 SER A 138 5.492 -10.024 -7.077 1.00 0.00 H new ATOM 0 HG SER A 138 5.643 -10.225 -9.384 1.00 0.00 H new ATOM 1644 N GLY A 139 7.650 -6.732 -7.433 1.00 0.00 N ATOM 1645 CA GLY A 139 8.545 -5.737 -7.973 1.00 0.00 C ATOM 1646 C GLY A 139 9.257 -4.977 -6.872 1.00 0.00 C ATOM 1647 O GLY A 139 9.564 -5.541 -5.824 1.00 0.00 O ATOM 0 H GLY A 139 8.098 -7.406 -6.813 1.00 0.00 H new ATOM 0 HA2 GLY A 139 9.280 -6.218 -8.618 1.00 0.00 H new ATOM 0 HA3 GLY A 139 7.983 -5.039 -8.594 1.00 0.00 H new ATOM 1651 N ARG A 140 9.496 -3.693 -7.088 1.00 0.00 N ATOM 1652 CA ARG A 140 10.168 -2.865 -6.095 1.00 0.00 C ATOM 1653 C ARG A 140 9.568 -1.469 -6.100 1.00 0.00 C ATOM 1654 O ARG A 140 9.347 -0.890 -7.163 1.00 0.00 O ATOM 1655 CB ARG A 140 11.668 -2.786 -6.369 1.00 0.00 C ATOM 1656 CG ARG A 140 12.367 -4.133 -6.417 1.00 0.00 C ATOM 1657 CD ARG A 140 13.864 -3.969 -6.580 1.00 0.00 C ATOM 1658 NE ARG A 140 14.202 -3.113 -7.716 1.00 0.00 N ATOM 1659 CZ ARG A 140 15.392 -3.101 -8.305 1.00 0.00 C ATOM 1660 NH1 ARG A 140 16.332 -3.956 -7.923 1.00 0.00 N ATOM 1661 NH2 ARG A 140 15.635 -2.252 -9.294 1.00 0.00 N ATOM 0 H ARG A 140 9.235 -3.200 -7.942 1.00 0.00 H new ATOM 0 HA ARG A 140 10.025 -3.321 -5.115 1.00 0.00 H new ATOM 0 HB2 ARG A 140 11.825 -2.274 -7.318 1.00 0.00 H new ATOM 0 HB3 ARG A 140 12.135 -2.175 -5.596 1.00 0.00 H new ATOM 0 HG2 ARG A 140 12.157 -4.687 -5.502 1.00 0.00 H new ATOM 0 HG3 ARG A 140 11.971 -4.722 -7.244 1.00 0.00 H new ATOM 0 HD2 ARG A 140 14.283 -3.543 -5.668 1.00 0.00 H new ATOM 0 HD3 ARG A 140 14.323 -4.948 -6.715 1.00 0.00 H new ATOM 0 HE ARG A 140 13.481 -2.488 -8.077 1.00 0.00 H new ATOM 0 HH11 ARG A 140 16.141 -4.624 -7.176 1.00 0.00 H new ATOM 0 HH12 ARG A 140 17.246 -3.946 -8.376 1.00 0.00 H new ATOM 0 HH21 ARG A 140 14.907 -1.607 -9.603 1.00 0.00 H new ATOM 0 HH22 ARG A 140 16.549 -2.244 -9.746 1.00 0.00 H new ATOM 1675 N TRP A 141 9.314 -0.930 -4.918 1.00 0.00 N ATOM 1676 CA TRP A 141 8.575 0.317 -4.789 1.00 0.00 C ATOM 1677 C TRP A 141 9.214 1.274 -3.776 1.00 0.00 C ATOM 1678 O TRP A 141 10.162 0.926 -3.064 1.00 0.00 O ATOM 1679 CB TRP A 141 7.134 0.022 -4.361 1.00 0.00 C ATOM 1680 CG TRP A 141 6.345 -0.793 -5.346 1.00 0.00 C ATOM 1681 CD1 TRP A 141 6.413 -2.144 -5.544 1.00 0.00 C ATOM 1682 CD2 TRP A 141 5.354 -0.307 -6.252 1.00 0.00 C ATOM 1683 NE1 TRP A 141 5.532 -2.523 -6.527 1.00 0.00 N ATOM 1684 CE2 TRP A 141 4.868 -1.411 -6.976 1.00 0.00 C ATOM 1685 CE3 TRP A 141 4.834 0.958 -6.521 1.00 0.00 C ATOM 1686 CZ2 TRP A 141 3.882 -1.284 -7.951 1.00 0.00 C ATOM 1687 CZ3 TRP A 141 3.856 1.084 -7.486 1.00 0.00 C ATOM 1688 CH2 TRP A 141 3.387 -0.032 -8.191 1.00 0.00 C ATOM 0 H TRP A 141 9.610 -1.338 -4.031 1.00 0.00 H new ATOM 0 HA TRP A 141 8.593 0.804 -5.764 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.153 -0.504 -3.406 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.617 0.967 -4.195 1.00 0.00 H new ATOM 0 HD1 TRP A 141 7.065 -2.816 -5.005 1.00 0.00 H new ATOM 0 HE1 TRP A 141 5.394 -3.475 -6.867 1.00 0.00 H new ATOM 0 HE3 TRP A 141 5.190 1.824 -5.983 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 3.521 -2.143 -8.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 3.445 2.059 -7.701 1.00 0.00 H new ATOM 0 HH2 TRP A 141 2.619 0.099 -8.939 1.00 0.00 H new ATOM 1699 N HIS A 142 8.689 2.495 -3.749 1.00 0.00 N ATOM 1700 CA HIS A 142 9.052 3.508 -2.764 1.00 0.00 C ATOM 1701 C HIS A 142 7.788 4.196 -2.272 1.00 0.00 C ATOM 1702 O HIS A 142 6.826 4.317 -3.025 1.00 0.00 O ATOM 1703 CB HIS A 142 9.946 4.601 -3.364 1.00 0.00 C ATOM 1704 CG HIS A 142 11.299 4.180 -3.845 1.00 0.00 C ATOM 1705 ND1 HIS A 142 12.423 4.218 -3.053 1.00 0.00 N ATOM 1706 CD2 HIS A 142 11.721 3.808 -5.071 1.00 0.00 C ATOM 1707 CE1 HIS A 142 13.477 3.896 -3.776 1.00 0.00 C ATOM 1708 NE2 HIS A 142 13.085 3.642 -5.008 1.00 0.00 N ATOM 0 H HIS A 142 7.990 2.813 -4.420 1.00 0.00 H new ATOM 0 HA HIS A 142 9.589 3.000 -1.962 1.00 0.00 H new ATOM 0 HB2 HIS A 142 9.414 5.053 -4.201 1.00 0.00 H new ATOM 0 HB3 HIS A 142 10.080 5.380 -2.613 1.00 0.00 H new ATOM 0 HD2 HIS A 142 11.101 3.666 -5.944 1.00 0.00 H new ATOM 0 HE1 HIS A 142 14.495 3.848 -3.417 1.00 0.00 H new ATOM 0 HE2 HIS A 142 13.690 3.369 -5.783 1.00 0.00 H new ATOM 1717 N LEU A 143 7.787 4.643 -1.029 1.00 0.00 N ATOM 1718 CA LEU A 143 6.736 5.531 -0.543 1.00 0.00 C ATOM 1719 C LEU A 143 7.309 6.865 -0.130 1.00 0.00 C ATOM 1720 O LEU A 143 8.311 6.926 0.570 1.00 0.00 O ATOM 1721 CB LEU A 143 5.976 4.937 0.630 1.00 0.00 C ATOM 1722 CG LEU A 143 4.837 4.046 0.259 1.00 0.00 C ATOM 1723 CD1 LEU A 143 4.217 3.416 1.486 1.00 0.00 C ATOM 1724 CD2 LEU A 143 3.799 4.806 -0.464 1.00 0.00 C ATOM 0 H LEU A 143 8.498 4.409 -0.336 1.00 0.00 H new ATOM 0 HA LEU A 143 6.040 5.666 -1.371 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.674 4.371 1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.595 5.751 1.246 1.00 0.00 H new ATOM 0 HG LEU A 143 5.233 3.261 -0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 143 3.390 2.772 1.186 1.00 0.00 H new ATOM 0 HD12 LEU A 143 4.967 2.823 2.009 1.00 0.00 H new ATOM 0 HD13 LEU A 143 3.846 4.198 2.149 1.00 0.00 H new ATOM 0 HD21 LEU A 143 2.977 4.140 -0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 143 3.427 5.609 0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 143 4.226 5.231 -1.373 1.00 0.00 H new ATOM 1736 N ILE A 144 6.666 7.932 -0.554 1.00 0.00 N ATOM 1737 CA ILE A 144 7.136 9.270 -0.227 1.00 0.00 C ATOM 1738 C ILE A 144 5.986 10.137 0.274 1.00 0.00 C ATOM 1739 O ILE A 144 4.931 10.187 -0.353 1.00 0.00 O ATOM 1740 CB ILE A 144 7.783 9.974 -1.442 1.00 0.00 C ATOM 1741 CG1 ILE A 144 8.715 9.031 -2.221 1.00 0.00 C ATOM 1742 CG2 ILE A 144 8.553 11.181 -0.954 1.00 0.00 C ATOM 1743 CD1 ILE A 144 9.964 8.631 -1.465 1.00 0.00 C ATOM 0 H ILE A 144 5.820 7.904 -1.123 1.00 0.00 H new ATOM 0 HA ILE A 144 7.889 9.151 0.552 1.00 0.00 H new ATOM 0 HB ILE A 144 6.992 10.281 -2.126 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.162 8.131 -2.489 1.00 0.00 H new ATOM 0 HG13 ILE A 144 9.007 9.515 -3.153 1.00 0.00 H new ATOM 0 HG21 ILE A 144 9.014 11.686 -1.803 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.873 11.867 -0.449 1.00 0.00 H new ATOM 0 HG23 ILE A 144 9.328 10.861 -0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 144 10.567 7.966 -2.084 1.00 0.00 H new ATOM 0 HD12 ILE A 144 10.542 9.522 -1.220 1.00 0.00 H new ATOM 0 HD13 ILE A 144 9.684 8.116 -0.546 1.00 0.00 H new ATOM 1755 N ARG A 145 6.192 10.813 1.399 1.00 0.00 N ATOM 1756 CA ARG A 145 5.150 11.649 1.987 1.00 0.00 C ATOM 1757 C ARG A 145 5.080 13.006 1.288 1.00 0.00 C ATOM 1758 O ARG A 145 6.099 13.656 1.064 1.00 0.00 O ATOM 1759 CB ARG A 145 5.396 11.829 3.484 1.00 0.00 C ATOM 1760 CG ARG A 145 4.283 12.571 4.207 1.00 0.00 C ATOM 1761 CD ARG A 145 4.498 12.542 5.712 1.00 0.00 C ATOM 1762 NE ARG A 145 5.854 12.947 6.082 1.00 0.00 N ATOM 1763 CZ ARG A 145 6.485 12.528 7.179 1.00 0.00 C ATOM 1764 NH1 ARG A 145 5.883 11.712 8.034 1.00 0.00 N ATOM 1765 NH2 ARG A 145 7.724 12.931 7.419 1.00 0.00 N ATOM 0 H ARG A 145 7.068 10.799 1.921 1.00 0.00 H new ATOM 0 HA ARG A 145 4.192 11.148 1.849 1.00 0.00 H new ATOM 0 HB2 ARG A 145 5.522 10.848 3.942 1.00 0.00 H new ATOM 0 HB3 ARG A 145 6.332 12.370 3.626 1.00 0.00 H new ATOM 0 HG2 ARG A 145 4.245 13.604 3.861 1.00 0.00 H new ATOM 0 HG3 ARG A 145 3.322 12.118 3.964 1.00 0.00 H new ATOM 0 HD2 ARG A 145 3.778 13.204 6.193 1.00 0.00 H new ATOM 0 HD3 ARG A 145 4.306 11.536 6.086 1.00 0.00 H new ATOM 0 HE ARG A 145 6.347 13.590 5.462 1.00 0.00 H new ATOM 0 HH11 ARG A 145 4.929 11.399 7.855 1.00 0.00 H new ATOM 0 HH12 ARG A 145 6.374 11.397 8.871 1.00 0.00 H new ATOM 0 HH21 ARG A 145 8.191 13.559 6.766 1.00 0.00 H new ATOM 0 HH22 ARG A 145 8.210 12.613 8.257 1.00 0.00 H new ATOM 1779 N THR A 146 3.866 13.436 0.973 1.00 0.00 N ATOM 1780 CA THR A 146 3.648 14.637 0.181 1.00 0.00 C ATOM 1781 C THR A 146 3.637 15.911 1.045 1.00 0.00 C ATOM 1782 O THR A 146 2.985 16.902 0.717 1.00 0.00 O ATOM 1783 CB THR A 146 2.337 14.516 -0.630 1.00 0.00 C ATOM 1784 OG1 THR A 146 2.260 15.532 -1.630 1.00 0.00 O ATOM 1785 CG2 THR A 146 1.129 14.607 0.270 1.00 0.00 C ATOM 0 H THR A 146 3.008 12.964 1.258 1.00 0.00 H new ATOM 0 HA THR A 146 4.486 14.727 -0.510 1.00 0.00 H new ATOM 0 HB THR A 146 2.345 13.539 -1.113 1.00 0.00 H new ATOM 0 HG1 THR A 146 2.382 15.130 -2.515 1.00 0.00 H new ATOM 0 HG21 THR A 146 0.222 14.519 -0.328 1.00 0.00 H new ATOM 0 HG22 THR A 146 1.160 13.801 1.003 1.00 0.00 H new ATOM 0 HG23 THR A 146 1.131 15.567 0.786 1.00 0.00 H new ATOM 1793 N ASN A 147 4.380 15.887 2.149 1.00 0.00 N ATOM 1794 CA ASN A 147 4.491 17.051 3.029 1.00 0.00 C ATOM 1795 C ASN A 147 5.272 18.166 2.342 1.00 0.00 C ATOM 1796 O ASN A 147 5.311 19.305 2.804 1.00 0.00 O ATOM 1797 CB ASN A 147 5.160 16.658 4.349 1.00 0.00 C ATOM 1798 CG ASN A 147 5.053 17.743 5.406 1.00 0.00 C ATOM 1799 OD1 ASN A 147 5.976 18.534 5.602 1.00 0.00 O ATOM 1800 ND2 ASN A 147 3.910 17.808 6.078 1.00 0.00 N ATOM 0 H ASN A 147 4.915 15.075 2.457 1.00 0.00 H new ATOM 0 HA ASN A 147 3.489 17.419 3.247 1.00 0.00 H new ATOM 0 HB2 ASN A 147 4.702 15.743 4.725 1.00 0.00 H new ATOM 0 HB3 ASN A 147 6.212 16.436 4.167 1.00 0.00 H new ATOM 0 HD21 ASN A 147 3.774 18.531 6.784 1.00 0.00 H new ATOM 0 HD22 ASN A 147 3.168 17.135 5.888 1.00 0.00 H new ATOM 1807 N LEU A 148 5.879 17.819 1.223 1.00 0.00 N ATOM 1808 CA LEU A 148 6.585 18.772 0.396 1.00 0.00 C ATOM 1809 C LEU A 148 6.154 18.596 -1.056 1.00 0.00 C ATOM 1810 O LEU A 148 5.879 17.475 -1.485 1.00 0.00 O ATOM 1811 CB LEU A 148 8.109 18.611 0.541 1.00 0.00 C ATOM 1812 CG LEU A 148 8.674 17.204 0.291 1.00 0.00 C ATOM 1813 CD1 LEU A 148 10.169 17.281 0.032 1.00 0.00 C ATOM 1814 CD2 LEU A 148 8.408 16.285 1.479 1.00 0.00 C ATOM 0 H LEU A 148 5.895 16.865 0.863 1.00 0.00 H new ATOM 0 HA LEU A 148 6.334 19.781 0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 148 8.593 19.301 -0.150 1.00 0.00 H new ATOM 0 HB3 LEU A 148 8.391 18.918 1.548 1.00 0.00 H new ATOM 0 HG LEU A 148 8.172 16.791 -0.584 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.560 16.279 -0.144 1.00 0.00 H new ATOM 0 HD12 LEU A 148 10.355 17.902 -0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 148 10.666 17.717 0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 148 8.819 15.297 1.274 1.00 0.00 H new ATOM 0 HD22 LEU A 148 8.881 16.697 2.370 1.00 0.00 H new ATOM 0 HD23 LEU A 148 7.333 16.204 1.643 1.00 0.00 H new ATOM 1826 N ARG A 149 6.091 19.713 -1.787 1.00 0.00 N ATOM 1827 CA ARG A 149 5.630 19.762 -3.187 1.00 0.00 C ATOM 1828 C ARG A 149 4.376 18.908 -3.425 1.00 0.00 C ATOM 1829 O ARG A 149 4.291 18.157 -4.403 1.00 0.00 O ATOM 1830 CB ARG A 149 6.750 19.389 -4.187 1.00 0.00 C ATOM 1831 CG ARG A 149 7.244 17.948 -4.119 1.00 0.00 C ATOM 1832 CD ARG A 149 8.544 17.825 -3.341 1.00 0.00 C ATOM 1833 NE ARG A 149 9.671 18.446 -4.040 1.00 0.00 N ATOM 1834 CZ ARG A 149 10.927 18.003 -3.966 1.00 0.00 C ATOM 1835 NH1 ARG A 149 11.222 16.941 -3.227 1.00 0.00 N ATOM 1836 NH2 ARG A 149 11.895 18.623 -4.630 1.00 0.00 N ATOM 0 H ARG A 149 6.362 20.626 -1.421 1.00 0.00 H new ATOM 0 HA ARG A 149 5.355 20.800 -3.372 1.00 0.00 H new ATOM 0 HB2 ARG A 149 6.389 19.583 -5.197 1.00 0.00 H new ATOM 0 HB3 ARG A 149 7.598 20.053 -4.019 1.00 0.00 H new ATOM 0 HG2 ARG A 149 6.482 17.326 -3.651 1.00 0.00 H new ATOM 0 HG3 ARG A 149 7.390 17.567 -5.130 1.00 0.00 H new ATOM 0 HD2 ARG A 149 8.425 18.291 -2.363 1.00 0.00 H new ATOM 0 HD3 ARG A 149 8.763 16.771 -3.168 1.00 0.00 H new ATOM 0 HE ARG A 149 9.485 19.266 -4.618 1.00 0.00 H new ATOM 0 HH11 ARG A 149 10.486 16.458 -2.711 1.00 0.00 H new ATOM 0 HH12 ARG A 149 12.185 16.607 -3.175 1.00 0.00 H new ATOM 0 HH21 ARG A 149 11.680 19.441 -5.199 1.00 0.00 H new ATOM 0 HH22 ARG A 149 12.854 18.281 -4.571 1.00 0.00 H new ATOM 1850 N GLY A 150 3.391 19.051 -2.549 1.00 0.00 N ATOM 1851 CA GLY A 150 2.165 18.289 -2.692 1.00 0.00 C ATOM 1852 C GLY A 150 1.114 18.660 -1.664 1.00 0.00 C ATOM 1853 O GLY A 150 0.880 19.842 -1.405 1.00 0.00 O ATOM 0 H GLY A 150 3.418 19.678 -1.745 1.00 0.00 H new ATOM 0 HA2 GLY A 150 1.760 18.447 -3.691 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.392 17.226 -2.605 1.00 0.00 H new ATOM 1857 N LYS A 151 0.487 17.651 -1.072 1.00 0.00 N ATOM 1858 CA LYS A 151 -0.586 17.875 -0.112 1.00 0.00 C ATOM 1859 C LYS A 151 -0.013 18.089 1.293 1.00 0.00 C ATOM 1860 O LYS A 151 0.250 19.225 1.687 1.00 0.00 O ATOM 1861 CB LYS A 151 -1.595 16.709 -0.144 1.00 0.00 C ATOM 1862 CG LYS A 151 -2.941 17.008 0.506 1.00 0.00 C ATOM 1863 CD LYS A 151 -2.886 17.027 2.029 1.00 0.00 C ATOM 1864 CE LYS A 151 -4.262 17.266 2.633 1.00 0.00 C ATOM 1865 NZ LYS A 151 -4.839 18.575 2.224 1.00 0.00 N ATOM 0 H LYS A 151 0.704 16.669 -1.240 1.00 0.00 H new ATOM 0 HA LYS A 151 -1.123 18.782 -0.391 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -1.765 16.423 -1.182 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -1.150 15.848 0.355 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -3.301 17.973 0.151 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -3.665 16.259 0.185 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -2.488 16.079 2.392 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -2.201 17.808 2.360 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -4.934 16.464 2.328 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -4.191 17.227 3.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -5.682 18.778 2.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -4.133 19.325 2.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -5.106 18.538 1.219 1.00 0.00 H new ATOM 1879 N GLN A 152 0.207 17.005 2.041 1.00 0.00 N ATOM 1880 CA GLN A 152 0.660 17.120 3.415 1.00 0.00 C ATOM 1881 C GLN A 152 1.143 15.784 3.974 1.00 0.00 C ATOM 1882 O GLN A 152 2.228 15.702 4.546 1.00 0.00 O ATOM 1883 CB GLN A 152 -0.483 17.639 4.284 1.00 0.00 C ATOM 1884 CG GLN A 152 -0.033 18.207 5.605 1.00 0.00 C ATOM 1885 CD GLN A 152 -1.193 18.565 6.512 1.00 0.00 C ATOM 1886 OE1 GLN A 152 -2.249 17.934 6.470 1.00 0.00 O ATOM 1887 NE2 GLN A 152 -1.009 19.582 7.333 1.00 0.00 N ATOM 0 H GLN A 152 0.078 16.047 1.715 1.00 0.00 H new ATOM 0 HA GLN A 152 1.501 17.814 3.428 1.00 0.00 H new ATOM 0 HB2 GLN A 152 -1.025 18.408 3.734 1.00 0.00 H new ATOM 0 HB3 GLN A 152 -1.185 16.826 4.469 1.00 0.00 H new ATOM 0 HG2 GLN A 152 0.607 17.482 6.109 1.00 0.00 H new ATOM 0 HG3 GLN A 152 0.572 19.096 5.427 1.00 0.00 H new ATOM 0 HE21 GLN A 152 -0.118 20.079 7.337 1.00 0.00 H new ATOM 0 HE22 GLN A 152 -1.757 19.871 7.963 1.00 0.00 H new ATOM 1896 N SER A 153 0.343 14.736 3.816 1.00 0.00 N ATOM 1897 CA SER A 153 0.621 13.486 4.501 1.00 0.00 C ATOM 1898 C SER A 153 0.312 12.273 3.629 1.00 0.00 C ATOM 1899 O SER A 153 0.515 11.135 4.051 1.00 0.00 O ATOM 1900 CB SER A 153 -0.192 13.418 5.787 1.00 0.00 C ATOM 1901 OG SER A 153 -0.069 14.616 6.539 1.00 0.00 O ATOM 0 H SER A 153 -0.491 14.728 3.228 1.00 0.00 H new ATOM 0 HA SER A 153 1.687 13.462 4.729 1.00 0.00 H new ATOM 0 HB2 SER A 153 -1.241 13.242 5.548 1.00 0.00 H new ATOM 0 HB3 SER A 153 0.144 12.573 6.388 1.00 0.00 H new ATOM 0 HG SER A 153 -0.602 14.544 7.358 1.00 0.00 H new ATOM 1907 N GLN A 154 -0.181 12.511 2.423 1.00 0.00 N ATOM 1908 CA GLN A 154 -0.419 11.420 1.484 1.00 0.00 C ATOM 1909 C GLN A 154 0.933 10.934 0.981 1.00 0.00 C ATOM 1910 O GLN A 154 1.843 11.731 0.792 1.00 0.00 O ATOM 1911 CB GLN A 154 -1.288 11.866 0.295 1.00 0.00 C ATOM 1912 CG GLN A 154 -2.161 13.076 0.583 1.00 0.00 C ATOM 1913 CD GLN A 154 -3.597 12.890 0.218 1.00 0.00 C ATOM 1914 OE1 GLN A 154 -4.489 13.395 0.893 1.00 0.00 O ATOM 1915 NE2 GLN A 154 -3.830 12.232 -0.874 1.00 0.00 N ATOM 0 H GLN A 154 -0.422 13.438 2.072 1.00 0.00 H new ATOM 0 HA GLN A 154 -0.959 10.622 1.994 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -0.639 12.093 -0.551 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -1.926 11.035 -0.007 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -2.095 13.315 1.644 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -1.766 13.934 0.038 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -3.056 11.830 -1.402 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -4.788 12.117 -1.205 1.00 0.00 H new ATOM 1924 N TRP A 155 1.083 9.644 0.805 1.00 0.00 N ATOM 1925 CA TRP A 155 2.327 9.096 0.296 1.00 0.00 C ATOM 1926 C TRP A 155 2.131 8.706 -1.160 1.00 0.00 C ATOM 1927 O TRP A 155 1.015 8.761 -1.666 1.00 0.00 O ATOM 1928 CB TRP A 155 2.779 7.895 1.141 1.00 0.00 C ATOM 1929 CG TRP A 155 3.124 8.258 2.560 1.00 0.00 C ATOM 1930 CD1 TRP A 155 2.259 8.693 3.522 1.00 0.00 C ATOM 1931 CD2 TRP A 155 4.421 8.213 3.180 1.00 0.00 C ATOM 1932 NE1 TRP A 155 2.934 8.938 4.691 1.00 0.00 N ATOM 1933 CE2 TRP A 155 4.258 8.650 4.508 1.00 0.00 C ATOM 1934 CE3 TRP A 155 5.703 7.852 2.748 1.00 0.00 C ATOM 1935 CZ2 TRP A 155 5.324 8.740 5.397 1.00 0.00 C ATOM 1936 CZ3 TRP A 155 6.755 7.941 3.635 1.00 0.00 C ATOM 1937 CH2 TRP A 155 6.560 8.381 4.943 1.00 0.00 C ATOM 0 H TRP A 155 0.363 8.950 1.005 1.00 0.00 H new ATOM 0 HA TRP A 155 3.114 9.847 0.361 1.00 0.00 H new ATOM 0 HB2 TRP A 155 1.987 7.146 1.148 1.00 0.00 H new ATOM 0 HB3 TRP A 155 3.648 7.435 0.670 1.00 0.00 H new ATOM 0 HD1 TRP A 155 1.196 8.825 3.383 1.00 0.00 H new ATOM 0 HE1 TRP A 155 2.516 9.280 5.556 1.00 0.00 H new ATOM 0 HE3 TRP A 155 5.865 7.509 1.737 1.00 0.00 H new ATOM 0 HZ2 TRP A 155 5.179 9.082 6.411 1.00 0.00 H new ATOM 0 HZ3 TRP A 155 7.747 7.665 3.310 1.00 0.00 H new ATOM 0 HH2 TRP A 155 7.406 8.439 5.612 1.00 0.00 H new ATOM 1948 N PHE A 156 3.203 8.369 -1.852 1.00 0.00 N ATOM 1949 CA PHE A 156 3.095 7.910 -3.227 1.00 0.00 C ATOM 1950 C PHE A 156 4.008 6.715 -3.454 1.00 0.00 C ATOM 1951 O PHE A 156 5.156 6.713 -3.011 1.00 0.00 O ATOM 1952 CB PHE A 156 3.451 9.005 -4.240 1.00 0.00 C ATOM 1953 CG PHE A 156 2.842 10.351 -3.989 1.00 0.00 C ATOM 1954 CD1 PHE A 156 1.562 10.640 -4.429 1.00 0.00 C ATOM 1955 CD2 PHE A 156 3.564 11.338 -3.342 1.00 0.00 C ATOM 1956 CE1 PHE A 156 1.011 11.888 -4.226 1.00 0.00 C ATOM 1957 CE2 PHE A 156 3.019 12.587 -3.134 1.00 0.00 C ATOM 1958 CZ PHE A 156 1.740 12.863 -3.576 1.00 0.00 C ATOM 0 H PHE A 156 4.155 8.404 -1.488 1.00 0.00 H new ATOM 0 HA PHE A 156 2.053 7.630 -3.383 1.00 0.00 H new ATOM 0 HB2 PHE A 156 4.535 9.116 -4.260 1.00 0.00 H new ATOM 0 HB3 PHE A 156 3.147 8.669 -5.231 1.00 0.00 H new ATOM 0 HD1 PHE A 156 0.988 9.879 -4.937 1.00 0.00 H new ATOM 0 HD2 PHE A 156 4.565 11.128 -2.996 1.00 0.00 H new ATOM 0 HE1 PHE A 156 0.011 12.102 -4.575 1.00 0.00 H new ATOM 0 HE2 PHE A 156 3.592 13.349 -2.626 1.00 0.00 H new ATOM 0 HZ PHE A 156 1.311 13.841 -3.413 1.00 0.00 H new ATOM 1968 N LEU A 157 3.486 5.707 -4.135 1.00 0.00 N ATOM 1969 CA LEU A 157 4.230 4.486 -4.427 1.00 0.00 C ATOM 1970 C LEU A 157 4.855 4.505 -5.817 1.00 0.00 C ATOM 1971 O LEU A 157 4.162 4.355 -6.820 1.00 0.00 O ATOM 1972 CB LEU A 157 3.306 3.277 -4.282 1.00 0.00 C ATOM 1973 CG LEU A 157 3.344 2.627 -2.909 1.00 0.00 C ATOM 1974 CD1 LEU A 157 2.090 1.822 -2.636 1.00 0.00 C ATOM 1975 CD2 LEU A 157 4.565 1.746 -2.780 1.00 0.00 C ATOM 0 H LEU A 157 2.534 5.710 -4.502 1.00 0.00 H new ATOM 0 HA LEU A 157 5.048 4.418 -3.710 1.00 0.00 H new ATOM 0 HB2 LEU A 157 2.283 3.587 -4.497 1.00 0.00 H new ATOM 0 HB3 LEU A 157 3.578 2.534 -5.031 1.00 0.00 H new ATOM 0 HG LEU A 157 3.396 3.425 -2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 157 2.155 1.373 -1.645 1.00 0.00 H new ATOM 0 HD12 LEU A 157 1.220 2.477 -2.681 1.00 0.00 H new ATOM 0 HD13 LEU A 157 1.992 1.036 -3.385 1.00 0.00 H new ATOM 0 HD21 LEU A 157 4.580 1.287 -1.792 1.00 0.00 H new ATOM 0 HD22 LEU A 157 4.534 0.967 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 157 5.464 2.348 -2.914 1.00 0.00 H new ATOM 1987 N VAL A 158 6.171 4.679 -5.864 1.00 0.00 N ATOM 1988 CA VAL A 158 6.915 4.673 -7.124 1.00 0.00 C ATOM 1989 C VAL A 158 7.687 3.375 -7.274 1.00 0.00 C ATOM 1990 O VAL A 158 7.836 2.633 -6.318 1.00 0.00 O ATOM 1991 CB VAL A 158 7.914 5.846 -7.225 1.00 0.00 C ATOM 1992 CG1 VAL A 158 7.619 6.682 -8.450 1.00 0.00 C ATOM 1993 CG2 VAL A 158 7.905 6.695 -5.964 1.00 0.00 C ATOM 0 H VAL A 158 6.751 4.827 -5.038 1.00 0.00 H new ATOM 0 HA VAL A 158 6.177 4.777 -7.919 1.00 0.00 H new ATOM 0 HB VAL A 158 8.917 5.430 -7.325 1.00 0.00 H new ATOM 0 HG11 VAL A 158 8.331 7.505 -8.509 1.00 0.00 H new ATOM 0 HG12 VAL A 158 7.706 6.063 -9.343 1.00 0.00 H new ATOM 0 HG13 VAL A 158 6.607 7.081 -8.383 1.00 0.00 H new ATOM 0 HG21 VAL A 158 8.620 7.511 -6.070 1.00 0.00 H new ATOM 0 HG22 VAL A 158 6.907 7.104 -5.808 1.00 0.00 H new ATOM 0 HG23 VAL A 158 8.182 6.079 -5.109 1.00 0.00 H new ATOM 2003 N LYS A 159 8.164 3.099 -8.477 1.00 0.00 N ATOM 2004 CA LYS A 159 9.016 1.939 -8.709 1.00 0.00 C ATOM 2005 C LYS A 159 10.436 2.238 -8.238 1.00 0.00 C ATOM 2006 O LYS A 159 10.910 3.368 -8.367 1.00 0.00 O ATOM 2007 CB LYS A 159 9.017 1.564 -10.193 1.00 0.00 C ATOM 2008 CG LYS A 159 9.898 0.364 -10.517 1.00 0.00 C ATOM 2009 CD LYS A 159 9.846 0.006 -11.991 1.00 0.00 C ATOM 2010 CE LYS A 159 8.456 -0.446 -12.408 1.00 0.00 C ATOM 2011 NZ LYS A 159 8.408 -0.855 -13.833 1.00 0.00 N ATOM 0 H LYS A 159 7.977 3.660 -9.308 1.00 0.00 H new ATOM 0 HA LYS A 159 8.624 1.095 -8.142 1.00 0.00 H new ATOM 0 HB2 LYS A 159 7.995 1.349 -10.506 1.00 0.00 H new ATOM 0 HB3 LYS A 159 9.355 2.421 -10.776 1.00 0.00 H new ATOM 0 HG2 LYS A 159 10.927 0.582 -10.232 1.00 0.00 H new ATOM 0 HG3 LYS A 159 9.578 -0.492 -9.924 1.00 0.00 H new ATOM 0 HD2 LYS A 159 10.142 0.870 -12.586 1.00 0.00 H new ATOM 0 HD3 LYS A 159 10.565 -0.787 -12.199 1.00 0.00 H new ATOM 0 HE2 LYS A 159 8.143 -1.281 -11.781 1.00 0.00 H new ATOM 0 HE3 LYS A 159 7.746 0.364 -12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 7.442 -1.156 -14.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 8.682 -0.052 -14.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 9.066 -1.645 -13.990 1.00 0.00 H new ATOM 2025 N ALA A 160 11.105 1.232 -7.682 1.00 0.00 N ATOM 2026 CA ALA A 160 12.464 1.399 -7.175 1.00 0.00 C ATOM 2027 C ALA A 160 13.482 1.463 -8.313 1.00 0.00 C ATOM 2028 O ALA A 160 14.382 0.631 -8.417 1.00 0.00 O ATOM 2029 CB ALA A 160 12.812 0.292 -6.190 1.00 0.00 C ATOM 0 H ALA A 160 10.728 0.291 -7.571 1.00 0.00 H new ATOM 0 HA ALA A 160 12.507 2.351 -6.646 1.00 0.00 H new ATOM 0 HB1 ALA A 160 13.829 0.436 -5.825 1.00 0.00 H new ATOM 0 HB2 ALA A 160 12.118 0.321 -5.350 1.00 0.00 H new ATOM 0 HB3 ALA A 160 12.739 -0.675 -6.688 1.00 0.00 H new ATOM 2035 N LYS A 161 13.317 2.458 -9.165 1.00 0.00 N ATOM 2036 CA LYS A 161 14.255 2.729 -10.231 1.00 0.00 C ATOM 2037 C LYS A 161 14.857 4.105 -9.984 1.00 0.00 C ATOM 2038 O LYS A 161 14.481 5.085 -10.631 1.00 0.00 O ATOM 2039 CB LYS A 161 13.544 2.654 -11.587 1.00 0.00 C ATOM 2040 CG LYS A 161 14.471 2.768 -12.787 1.00 0.00 C ATOM 2041 CD LYS A 161 13.726 2.476 -14.081 1.00 0.00 C ATOM 2042 CE LYS A 161 14.600 2.711 -15.301 1.00 0.00 C ATOM 2043 NZ LYS A 161 14.945 4.146 -15.466 1.00 0.00 N ATOM 0 H LYS A 161 12.526 3.101 -9.134 1.00 0.00 H new ATOM 0 HA LYS A 161 15.053 1.986 -10.248 1.00 0.00 H new ATOM 0 HB2 LYS A 161 13.003 1.710 -11.649 1.00 0.00 H new ATOM 0 HB3 LYS A 161 12.802 3.450 -11.639 1.00 0.00 H new ATOM 0 HG2 LYS A 161 14.898 3.770 -12.827 1.00 0.00 H new ATOM 0 HG3 LYS A 161 15.302 2.071 -12.677 1.00 0.00 H new ATOM 0 HD2 LYS A 161 13.380 1.442 -14.076 1.00 0.00 H new ATOM 0 HD3 LYS A 161 12.840 3.109 -14.141 1.00 0.00 H new ATOM 0 HE2 LYS A 161 15.515 2.126 -15.210 1.00 0.00 H new ATOM 0 HE3 LYS A 161 14.082 2.357 -16.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 14.956 4.386 -16.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 14.237 4.732 -14.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 15.884 4.326 -15.058 1.00 0.00 H new ATOM 2057 N ASP A 162 15.771 4.148 -9.008 1.00 0.00 N ATOM 2058 CA ASP A 162 16.318 5.396 -8.463 1.00 0.00 C ATOM 2059 C ASP A 162 15.277 6.060 -7.556 1.00 0.00 C ATOM 2060 O ASP A 162 14.120 5.633 -7.511 1.00 0.00 O ATOM 2061 CB ASP A 162 16.786 6.352 -9.575 1.00 0.00 C ATOM 2062 CG ASP A 162 17.397 7.634 -9.037 1.00 0.00 C ATOM 2063 OD1 ASP A 162 18.183 7.569 -8.065 1.00 0.00 O ATOM 2064 OD2 ASP A 162 17.083 8.716 -9.571 1.00 0.00 O ATOM 0 H ASP A 162 16.155 3.311 -8.570 1.00 0.00 H new ATOM 0 HA ASP A 162 17.201 5.155 -7.871 1.00 0.00 H new ATOM 0 HB2 ASP A 162 17.518 5.842 -10.201 1.00 0.00 H new ATOM 0 HB3 ASP A 162 15.938 6.600 -10.214 1.00 0.00 H new ATOM 2069 N GLY A 163 15.697 7.061 -6.796 1.00 0.00 N ATOM 2070 CA GLY A 163 14.790 7.743 -5.900 1.00 0.00 C ATOM 2071 C GLY A 163 15.186 7.570 -4.449 1.00 0.00 C ATOM 2072 O GLY A 163 14.289 7.532 -3.588 1.00 0.00 O ATOM 0 H GLY A 163 16.654 7.413 -6.785 1.00 0.00 H new ATOM 0 HA2 GLY A 163 14.769 8.805 -6.145 1.00 0.00 H new ATOM 0 HA3 GLY A 163 13.780 7.361 -6.048 1.00 0.00 H new TER 2076 GLY A 163