USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 839 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 143 ASN : amide:sc= 0.794 K(o=1.7,f=-0.45) USER MOD Set 1.2: A 144 GLN : amide:sc= 0.905 K(o=1.7,f=0) USER MOD Set 2.1: A 132 ASN : amide:sc= 0.769 K(o=2.9,f=1.3) USER MOD Set 2.2: A 133 HIS : no HE2:sc= 0.268 K(o=2.9,f=0.72) USER MOD Set 2.3: B 149 C O2' : rot 72:sc= 1.86 USER MOD Set 3.1: A 65 LYS NZ :NH3+ -158:sc= 0.95 (180deg=-0.0047) USER MOD Set 3.2: A 124 GLN : amide:sc= 0.998 K(o=1.9,f=-3.5) USER MOD Set 4.1: A 87 ASN : amide:sc= 0.574 K(o=1.1,f=-0.52) USER MOD Set 4.2: A 138 THR OG1 : rot 160:sc= 0.545 USER MOD Set 5.1: A 62 HIS : no HE2:sc= -2.52 K(o=-3.2,f=-6.6!) USER MOD Set 5.2: A 96 GLN : amide:sc= -0.64 K(o=-3.2,f=-3.9) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0.286 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl 174:sc= 0 (180deg=-0.0446) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 165:sc= 1.26 (180deg=1.12) USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 101 MET CE :methyl 165:sc= -4.21! (180deg=-4.78!) USER MOD Single : A 102 ASN : amide:sc= -0.429 X(o=-0.43,f=-0.063) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.808 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 173:sc= -0.707 (180deg=-0.875) USER MOD Single : A 112 ASN : amide:sc= 0.0835 X(o=0.083,f=-0.0021) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc=-0.00211 USER MOD Single : A 115 THR OG1 : rot 77:sc= 0.889 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.0737 K(o=0.074,f=-0.87) USER MOD Single : A 131 SER OG : rot 37:sc= 1.64 USER MOD Single : A 134 LYS NZ :NH3+ -166:sc= 1.43 (180deg=1.22) USER MOD Single : A 137 LYS NZ :NH3+ 175:sc= 1.12 (180deg=1.1) USER MOD Single : A 140 SER OG : rot 123:sc= 0.507 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : B 147 C O2' : rot 28:sc= 0.0765 USER MOD Single : B 147 C O5' : rot 9:sc= 0.482 USER MOD Single : B 148 U O2' : rot -24:sc= 1.17 USER MOD Single : B 150 U O2' : rot -26:sc= 0.0657 USER MOD Single : B 151 C O2' : rot 24:sc= 0.0596 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 132:sc= 0.0165 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -20.769 6.584 2.483 1.00 0.00 N ATOM 2 CA GLY A 49 -20.160 6.317 1.159 1.00 0.00 C ATOM 3 C GLY A 49 -18.708 5.873 1.281 1.00 0.00 C ATOM 4 O GLY A 49 -18.095 5.989 2.343 1.00 0.00 O ATOM 0 HA2 GLY A 49 -20.733 5.546 0.644 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -20.214 7.217 0.546 1.00 0.00 H new ATOM 8 N ASP A 50 -18.131 5.375 0.188 1.00 0.00 N ATOM 9 CA ASP A 50 -16.798 4.744 0.120 1.00 0.00 C ATOM 10 C ASP A 50 -15.607 5.631 0.547 1.00 0.00 C ATOM 11 O ASP A 50 -14.547 5.104 0.887 1.00 0.00 O ATOM 12 CB ASP A 50 -16.578 4.174 -1.288 1.00 0.00 C ATOM 13 CG ASP A 50 -16.501 5.266 -2.371 1.00 0.00 C ATOM 14 OD1 ASP A 50 -17.568 5.682 -2.883 1.00 0.00 O ATOM 15 OD2 ASP A 50 -15.381 5.711 -2.715 1.00 0.00 O ATOM 0 H ASP A 50 -18.595 5.398 -0.720 1.00 0.00 H new ATOM 0 HA ASP A 50 -16.812 3.952 0.868 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.656 3.593 -1.299 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -17.390 3.488 -1.528 1.00 0.00 H new ATOM 20 N SER A 51 -15.774 6.955 0.615 1.00 0.00 N ATOM 21 CA SER A 51 -14.773 7.868 1.200 1.00 0.00 C ATOM 22 C SER A 51 -14.480 7.569 2.679 1.00 0.00 C ATOM 23 O SER A 51 -13.351 7.762 3.133 1.00 0.00 O ATOM 24 CB SER A 51 -15.222 9.327 1.055 1.00 0.00 C ATOM 25 OG SER A 51 -15.184 9.734 -0.304 1.00 0.00 O ATOM 0 H SER A 51 -16.607 7.430 0.267 1.00 0.00 H new ATOM 0 HA SER A 51 -13.850 7.705 0.643 1.00 0.00 H new ATOM 0 HB2 SER A 51 -16.233 9.441 1.445 1.00 0.00 H new ATOM 0 HB3 SER A 51 -14.576 9.972 1.651 1.00 0.00 H new ATOM 0 HG SER A 51 -15.476 10.667 -0.374 1.00 0.00 H new ATOM 31 N ARG A 52 -15.456 7.048 3.439 1.00 0.00 N ATOM 32 CA ARG A 52 -15.281 6.622 4.842 1.00 0.00 C ATOM 33 C ARG A 52 -14.379 5.388 4.980 1.00 0.00 C ATOM 34 O ARG A 52 -13.675 5.258 5.980 1.00 0.00 O ATOM 35 CB ARG A 52 -16.654 6.357 5.493 1.00 0.00 C ATOM 36 CG ARG A 52 -17.598 7.574 5.530 1.00 0.00 C ATOM 37 CD ARG A 52 -17.051 8.733 6.380 1.00 0.00 C ATOM 38 NE ARG A 52 -18.031 9.833 6.482 1.00 0.00 N ATOM 39 CZ ARG A 52 -17.898 10.962 7.157 1.00 0.00 C ATOM 40 NH1 ARG A 52 -16.822 11.235 7.842 1.00 0.00 N ATOM 41 NH2 ARG A 52 -18.853 11.849 7.165 1.00 0.00 N ATOM 0 H ARG A 52 -16.405 6.907 3.093 1.00 0.00 H new ATOM 0 HA ARG A 52 -14.781 7.439 5.363 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -17.147 5.549 4.952 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -16.495 6.007 6.513 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.768 7.926 4.512 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.565 7.265 5.926 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -16.804 8.370 7.378 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -16.127 9.106 5.938 1.00 0.00 H new ATOM 0 HE ARG A 52 -18.908 9.708 5.976 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -16.051 10.568 7.868 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -16.752 12.116 8.352 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -19.714 11.676 6.647 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -18.739 12.716 7.689 1.00 0.00 H new ATOM 55 N SER A 53 -14.338 4.527 3.960 1.00 0.00 N ATOM 56 CA SER A 53 -13.476 3.334 3.876 1.00 0.00 C ATOM 57 C SER A 53 -11.992 3.645 3.595 1.00 0.00 C ATOM 58 O SER A 53 -11.161 2.735 3.624 1.00 0.00 O ATOM 59 CB SER A 53 -14.002 2.373 2.794 1.00 0.00 C ATOM 60 OG SER A 53 -15.377 2.078 3.000 1.00 0.00 O ATOM 0 H SER A 53 -14.926 4.642 3.135 1.00 0.00 H new ATOM 0 HA SER A 53 -13.519 2.873 4.863 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.866 2.819 1.809 1.00 0.00 H new ATOM 0 HB3 SER A 53 -13.422 1.450 2.809 1.00 0.00 H new ATOM 0 HG SER A 53 -15.689 1.468 2.300 1.00 0.00 H new ATOM 66 N ALA A 54 -11.650 4.915 3.339 1.00 0.00 N ATOM 67 CA ALA A 54 -10.292 5.397 3.055 1.00 0.00 C ATOM 68 C ALA A 54 -9.889 6.656 3.866 1.00 0.00 C ATOM 69 O ALA A 54 -8.712 7.025 3.884 1.00 0.00 O ATOM 70 CB ALA A 54 -10.216 5.627 1.542 1.00 0.00 C ATOM 0 H ALA A 54 -12.341 5.665 3.324 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.566 4.649 3.375 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.222 5.987 1.278 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.412 4.690 1.021 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.960 6.368 1.249 1.00 0.00 H new ATOM 76 N GLY A 55 -10.828 7.314 4.563 1.00 0.00 N ATOM 77 CA GLY A 55 -10.572 8.495 5.399 1.00 0.00 C ATOM 78 C GLY A 55 -10.582 9.822 4.629 1.00 0.00 C ATOM 79 O GLY A 55 -9.722 10.671 4.866 1.00 0.00 O ATOM 0 H GLY A 55 -11.808 7.033 4.560 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.324 8.539 6.187 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -9.605 8.378 5.888 1.00 0.00 H new ATOM 83 N VAL A 56 -11.537 9.995 3.702 1.00 0.00 N ATOM 84 CA VAL A 56 -11.660 11.098 2.725 1.00 0.00 C ATOM 85 C VAL A 56 -10.318 11.299 1.987 1.00 0.00 C ATOM 86 O VAL A 56 -9.524 12.187 2.317 1.00 0.00 O ATOM 87 CB VAL A 56 -12.238 12.358 3.385 1.00 0.00 C ATOM 88 CG1 VAL A 56 -12.449 13.503 2.385 1.00 0.00 C ATOM 89 CG2 VAL A 56 -13.601 12.075 4.038 1.00 0.00 C ATOM 0 H VAL A 56 -12.299 9.323 3.605 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.385 10.840 1.953 1.00 0.00 H new ATOM 0 HB VAL A 56 -11.501 12.652 4.132 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -12.859 14.369 2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -11.495 13.770 1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -13.143 13.184 1.608 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -13.982 12.988 4.496 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -14.303 11.729 3.279 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -13.486 11.307 4.802 1.00 0.00 H new ATOM 99 N PRO A 57 -10.002 10.374 1.069 1.00 0.00 N ATOM 100 CA PRO A 57 -8.629 9.992 0.735 1.00 0.00 C ATOM 101 C PRO A 57 -8.018 10.815 -0.417 1.00 0.00 C ATOM 102 O PRO A 57 -8.649 11.720 -0.968 1.00 0.00 O ATOM 103 CB PRO A 57 -8.799 8.504 0.427 1.00 0.00 C ATOM 104 CG PRO A 57 -10.095 8.492 -0.384 1.00 0.00 C ATOM 105 CD PRO A 57 -10.940 9.414 0.488 1.00 0.00 C ATOM 0 HA PRO A 57 -7.909 10.189 1.529 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -7.958 8.107 -0.142 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.881 7.906 1.335 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -9.961 8.877 -1.395 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -10.523 7.494 -0.477 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -11.704 9.920 -0.102 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -11.458 8.852 1.265 1.00 0.00 H new ATOM 113 N SER A 58 -6.771 10.498 -0.772 1.00 0.00 N ATOM 114 CA SER A 58 -5.988 11.115 -1.856 1.00 0.00 C ATOM 115 C SER A 58 -5.337 10.042 -2.743 1.00 0.00 C ATOM 116 O SER A 58 -5.542 8.844 -2.537 1.00 0.00 O ATOM 117 CB SER A 58 -4.957 12.074 -1.245 1.00 0.00 C ATOM 118 OG SER A 58 -4.237 12.799 -2.228 1.00 0.00 O ATOM 0 H SER A 58 -6.249 9.767 -0.289 1.00 0.00 H new ATOM 0 HA SER A 58 -6.647 11.690 -2.507 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.466 12.774 -0.582 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.257 11.506 -0.632 1.00 0.00 H new ATOM 0 HG SER A 58 -3.595 13.396 -1.790 1.00 0.00 H new ATOM 124 N ARG A 59 -4.558 10.459 -3.748 1.00 0.00 N ATOM 125 CA ARG A 59 -3.972 9.613 -4.800 1.00 0.00 C ATOM 126 C ARG A 59 -2.971 8.539 -4.332 1.00 0.00 C ATOM 127 O ARG A 59 -2.535 7.763 -5.185 1.00 0.00 O ATOM 128 CB ARG A 59 -3.316 10.460 -5.909 1.00 0.00 C ATOM 129 CG ARG A 59 -4.077 11.690 -6.446 1.00 0.00 C ATOM 130 CD ARG A 59 -3.820 13.028 -5.726 1.00 0.00 C ATOM 131 NE ARG A 59 -2.402 13.439 -5.795 1.00 0.00 N ATOM 132 CZ ARG A 59 -1.431 13.130 -4.951 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.646 12.602 -3.785 1.00 0.00 N ATOM 134 NH2 ARG A 59 -0.183 13.303 -5.266 1.00 0.00 N ATOM 0 H ARG A 59 -4.306 11.441 -3.857 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.835 9.068 -5.182 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.352 10.804 -5.536 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -3.114 9.801 -6.753 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.823 11.815 -7.499 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.145 11.477 -6.399 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -4.443 13.803 -6.172 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.120 12.940 -4.682 1.00 0.00 H new ATOM 0 HE ARG A 59 -2.142 14.029 -6.585 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.600 12.406 -3.482 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.861 12.383 -3.172 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.064 13.684 -6.179 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.550 13.058 -4.600 1.00 0.00 H new ATOM 148 N VAL A 60 -2.602 8.446 -3.041 1.00 0.00 N ATOM 149 CA VAL A 60 -1.880 7.268 -2.529 1.00 0.00 C ATOM 150 C VAL A 60 -2.809 6.101 -2.216 1.00 0.00 C ATOM 151 O VAL A 60 -3.808 6.231 -1.514 1.00 0.00 O ATOM 152 CB VAL A 60 -0.824 7.537 -1.440 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.218 8.177 -0.109 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.060 6.244 -1.165 1.00 0.00 C ATOM 0 H VAL A 60 -2.789 9.164 -2.341 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.262 6.957 -3.372 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.238 8.335 -1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.334 8.282 0.520 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.652 9.160 -0.292 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.950 7.546 0.396 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.691 6.422 -0.395 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.755 5.476 -0.824 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.430 5.909 -2.079 1.00 0.00 H new ATOM 164 N ILE A 61 -2.455 4.946 -2.762 1.00 0.00 N ATOM 165 CA ILE A 61 -3.051 3.621 -2.577 1.00 0.00 C ATOM 166 C ILE A 61 -2.013 2.745 -1.863 1.00 0.00 C ATOM 167 O ILE A 61 -0.818 2.993 -1.985 1.00 0.00 O ATOM 168 CB ILE A 61 -3.430 3.113 -3.985 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.595 3.934 -4.579 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.766 1.616 -4.060 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.485 4.030 -6.104 1.00 0.00 C ATOM 0 H ILE A 61 -1.668 4.904 -3.409 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.951 3.616 -1.962 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.527 3.254 -4.579 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.544 3.471 -4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.594 4.935 -4.148 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.020 1.351 -5.086 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.903 1.033 -3.737 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.614 1.400 -3.410 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.319 4.614 -6.493 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.546 4.516 -6.371 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.511 3.029 -6.534 1.00 0.00 H new ATOM 183 N HIS A 62 -2.438 1.723 -1.122 1.00 0.00 N ATOM 184 CA HIS A 62 -1.578 0.781 -0.401 1.00 0.00 C ATOM 185 C HIS A 62 -1.878 -0.663 -0.824 1.00 0.00 C ATOM 186 O HIS A 62 -3.037 -1.038 -1.008 1.00 0.00 O ATOM 187 CB HIS A 62 -1.724 1.019 1.113 1.00 0.00 C ATOM 188 CG HIS A 62 -1.248 -0.116 2.008 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.737 -1.407 2.047 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.282 -0.028 2.972 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.038 -2.088 2.971 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.136 -1.289 3.565 1.00 0.00 N ATOM 0 H HIS A 62 -3.430 1.519 -1.002 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.533 0.952 -0.658 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.171 1.921 1.375 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.774 1.214 1.332 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.495 -1.778 1.475 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.273 0.861 3.232 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.182 -3.133 3.204 1.00 0.00 H new ATOM 200 N ILE A 63 -0.824 -1.478 -0.918 1.00 0.00 N ATOM 201 CA ILE A 63 -0.791 -2.853 -1.437 1.00 0.00 C ATOM 202 C ILE A 63 -0.316 -3.819 -0.331 1.00 0.00 C ATOM 203 O ILE A 63 0.629 -3.483 0.387 1.00 0.00 O ATOM 204 CB ILE A 63 0.167 -2.941 -2.661 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.191 -1.671 -3.555 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.200 -4.185 -3.483 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.128 -1.757 -4.767 1.00 0.00 C ATOM 0 H ILE A 63 0.100 -1.173 -0.611 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.795 -3.135 -1.753 1.00 0.00 H new ATOM 0 HB ILE A 63 1.181 -3.018 -2.269 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.821 -1.473 -3.909 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.487 -0.819 -2.944 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.463 -4.260 -4.345 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.092 -5.075 -2.863 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.232 -4.104 -3.825 1.00 0.00 H new ATOM 0 HD11 ILE A 63 1.079 -0.826 -5.332 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.150 -1.921 -4.426 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.822 -2.585 -5.406 1.00 0.00 H new ATOM 219 N ARG A 64 -0.928 -5.010 -0.183 1.00 0.00 N ATOM 220 CA ARG A 64 -0.438 -6.090 0.712 1.00 0.00 C ATOM 221 C ARG A 64 0.388 -7.116 -0.083 1.00 0.00 C ATOM 222 O ARG A 64 0.489 -7.027 -1.307 1.00 0.00 O ATOM 223 CB ARG A 64 -1.599 -6.757 1.516 1.00 0.00 C ATOM 224 CG ARG A 64 -2.696 -5.759 1.918 1.00 0.00 C ATOM 225 CD ARG A 64 -3.733 -6.244 2.936 1.00 0.00 C ATOM 226 NE ARG A 64 -4.697 -5.160 3.215 1.00 0.00 N ATOM 227 CZ ARG A 64 -6.006 -5.152 3.033 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.685 -6.233 2.790 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.660 -4.026 3.094 1.00 0.00 N ATOM 0 H ARG A 64 -1.783 -5.257 -0.682 1.00 0.00 H new ATOM 0 HA ARG A 64 0.221 -5.639 1.454 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.040 -7.552 0.915 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -1.192 -7.223 2.413 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.214 -4.869 2.322 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.224 -5.453 1.015 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -4.256 -7.119 2.549 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.238 -6.550 3.857 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.299 -4.303 3.600 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -6.208 -7.133 2.733 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.695 -6.182 2.656 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.161 -3.156 3.281 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.670 -4.015 2.954 1.00 0.00 H new ATOM 243 N LYS A 65 0.957 -8.108 0.610 1.00 0.00 N ATOM 244 CA LYS A 65 1.401 -9.422 0.085 1.00 0.00 C ATOM 245 C LYS A 65 2.167 -9.399 -1.241 1.00 0.00 C ATOM 246 O LYS A 65 2.008 -10.252 -2.118 1.00 0.00 O ATOM 247 CB LYS A 65 0.189 -10.343 0.002 1.00 0.00 C ATOM 248 CG LYS A 65 -0.465 -10.493 1.380 1.00 0.00 C ATOM 249 CD LYS A 65 -1.845 -11.061 1.181 1.00 0.00 C ATOM 250 CE LYS A 65 -1.884 -12.509 0.669 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.297 -13.484 1.626 1.00 0.00 N ATOM 0 H LYS A 65 1.134 -8.019 1.611 1.00 0.00 H new ATOM 0 HA LYS A 65 2.143 -9.793 0.792 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.533 -9.941 -0.708 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.493 -11.321 -0.372 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.130 -11.150 2.014 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.519 -9.528 1.883 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.382 -11.012 2.128 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.384 -10.428 0.476 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.918 -12.788 0.464 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.345 -12.568 -0.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.009 -14.342 1.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.466 -13.061 2.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -2.004 -13.732 2.347 1.00 0.00 H new ATOM 265 N LEU A 66 3.066 -8.432 -1.331 1.00 0.00 N ATOM 266 CA LEU A 66 4.192 -8.435 -2.281 1.00 0.00 C ATOM 267 C LEU A 66 5.051 -9.723 -2.104 1.00 0.00 C ATOM 268 O LEU A 66 4.977 -10.371 -1.056 1.00 0.00 O ATOM 269 CB LEU A 66 5.026 -7.143 -2.109 1.00 0.00 C ATOM 270 CG LEU A 66 4.717 -6.068 -3.164 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.320 -5.477 -3.021 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.726 -4.933 -3.028 1.00 0.00 C ATOM 0 H LEU A 66 3.042 -7.602 -0.739 1.00 0.00 H new ATOM 0 HA LEU A 66 3.809 -8.447 -3.302 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.842 -6.731 -1.117 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.085 -7.395 -2.158 1.00 0.00 H new ATOM 0 HG LEU A 66 4.778 -6.553 -4.138 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.162 -4.725 -3.794 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.578 -6.268 -3.128 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.219 -5.015 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.514 -4.166 -3.773 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.654 -4.500 -2.030 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.733 -5.321 -3.183 1.00 0.00 H new ATOM 284 N PRO A 67 5.880 -10.105 -3.098 1.00 0.00 N ATOM 285 CA PRO A 67 6.633 -11.367 -3.093 1.00 0.00 C ATOM 286 C PRO A 67 7.603 -11.512 -1.908 1.00 0.00 C ATOM 287 O PRO A 67 7.442 -12.377 -1.048 1.00 0.00 O ATOM 288 CB PRO A 67 7.383 -11.416 -4.441 1.00 0.00 C ATOM 289 CG PRO A 67 7.239 -10.025 -5.045 1.00 0.00 C ATOM 290 CD PRO A 67 6.009 -9.421 -4.376 1.00 0.00 C ATOM 0 HA PRO A 67 5.944 -12.203 -2.972 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.432 -11.673 -4.296 1.00 0.00 H new ATOM 0 HB3 PRO A 67 6.957 -12.174 -5.098 1.00 0.00 H new ATOM 0 HG2 PRO A 67 8.126 -9.420 -4.856 1.00 0.00 H new ATOM 0 HG3 PRO A 67 7.113 -10.077 -6.126 1.00 0.00 H new ATOM 0 HD2 PRO A 67 6.128 -8.347 -4.235 1.00 0.00 H new ATOM 0 HD3 PRO A 67 5.119 -9.565 -4.989 1.00 0.00 H new ATOM 298 N ILE A 68 8.641 -10.680 -1.940 1.00 0.00 N ATOM 299 CA ILE A 68 9.852 -10.616 -1.101 1.00 0.00 C ATOM 300 C ILE A 68 10.520 -9.252 -1.301 1.00 0.00 C ATOM 301 O ILE A 68 11.025 -8.646 -0.356 1.00 0.00 O ATOM 302 CB ILE A 68 10.892 -11.716 -1.453 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.061 -11.995 -2.968 1.00 0.00 C ATOM 304 CG2 ILE A 68 10.524 -13.014 -0.737 1.00 0.00 C ATOM 305 CD1 ILE A 68 12.243 -12.894 -3.331 1.00 0.00 C ATOM 0 H ILE A 68 8.662 -9.939 -2.640 1.00 0.00 H new ATOM 0 HA ILE A 68 9.536 -10.771 -0.070 1.00 0.00 H new ATOM 0 HB ILE A 68 11.853 -11.330 -1.114 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.146 -12.455 -3.342 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.175 -11.043 -3.487 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.254 -13.785 -0.984 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.523 -12.848 0.340 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.533 -13.337 -1.055 1.00 0.00 H new ATOM 0 HD11 ILE A 68 12.278 -13.031 -4.412 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.170 -12.430 -2.994 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.125 -13.863 -2.846 1.00 0.00 H new ATOM 317 N ASP A 69 10.510 -8.787 -2.556 1.00 0.00 N ATOM 318 CA ASP A 69 11.142 -7.514 -2.959 1.00 0.00 C ATOM 319 C ASP A 69 10.499 -6.813 -4.177 1.00 0.00 C ATOM 320 O ASP A 69 10.539 -5.584 -4.254 1.00 0.00 O ATOM 321 CB ASP A 69 12.633 -7.791 -3.240 1.00 0.00 C ATOM 322 CG ASP A 69 13.478 -6.507 -3.359 1.00 0.00 C ATOM 323 OD1 ASP A 69 13.460 -5.678 -2.416 1.00 0.00 O ATOM 324 OD2 ASP A 69 14.219 -6.358 -4.360 1.00 0.00 O ATOM 0 H ASP A 69 10.063 -9.282 -3.328 1.00 0.00 H new ATOM 0 HA ASP A 69 10.997 -6.818 -2.133 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.037 -8.411 -2.440 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.722 -8.363 -4.163 1.00 0.00 H new ATOM 329 N VAL A 70 9.900 -7.573 -5.112 1.00 0.00 N ATOM 330 CA VAL A 70 9.478 -7.154 -6.472 1.00 0.00 C ATOM 331 C VAL A 70 10.511 -6.222 -7.142 1.00 0.00 C ATOM 332 O VAL A 70 11.714 -6.345 -6.900 1.00 0.00 O ATOM 333 CB VAL A 70 7.988 -6.698 -6.482 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.683 -5.262 -6.060 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.321 -6.965 -7.836 1.00 0.00 C ATOM 0 H VAL A 70 9.683 -8.553 -4.934 1.00 0.00 H new ATOM 0 HA VAL A 70 9.482 -8.015 -7.140 1.00 0.00 H new ATOM 0 HB VAL A 70 7.566 -7.320 -5.693 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.609 -5.087 -6.116 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.024 -5.103 -5.037 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.198 -4.570 -6.726 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.283 -6.633 -7.802 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.851 -6.419 -8.617 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.354 -8.033 -8.053 1.00 0.00 H new ATOM 345 N THR A 71 10.090 -5.325 -8.026 1.00 0.00 N ATOM 346 CA THR A 71 10.821 -4.097 -8.358 1.00 0.00 C ATOM 347 C THR A 71 9.837 -2.954 -8.562 1.00 0.00 C ATOM 348 O THR A 71 8.744 -3.121 -9.114 1.00 0.00 O ATOM 349 CB THR A 71 11.775 -4.285 -9.551 1.00 0.00 C ATOM 350 OG1 THR A 71 12.310 -3.038 -9.941 1.00 0.00 O ATOM 351 CG2 THR A 71 11.131 -4.923 -10.781 1.00 0.00 C ATOM 0 H THR A 71 9.217 -5.428 -8.544 1.00 0.00 H new ATOM 0 HA THR A 71 11.467 -3.841 -7.518 1.00 0.00 H new ATOM 0 HB THR A 71 12.546 -4.969 -9.195 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.917 -3.165 -10.699 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.874 -5.018 -11.573 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.750 -5.910 -10.521 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.309 -4.296 -11.128 1.00 0.00 H new ATOM 359 N GLU A 72 10.224 -1.767 -8.103 1.00 0.00 N ATOM 360 CA GLU A 72 9.435 -0.558 -8.295 1.00 0.00 C ATOM 361 C GLU A 72 9.152 -0.262 -9.772 1.00 0.00 C ATOM 362 O GLU A 72 8.061 0.195 -10.107 1.00 0.00 O ATOM 363 CB GLU A 72 10.095 0.649 -7.610 1.00 0.00 C ATOM 364 CG GLU A 72 11.610 0.742 -7.737 1.00 0.00 C ATOM 365 CD GLU A 72 12.134 2.095 -7.214 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.355 2.230 -5.986 1.00 0.00 O ATOM 367 OE2 GLU A 72 12.345 3.027 -8.029 1.00 0.00 O ATOM 0 H GLU A 72 11.092 -1.618 -7.589 1.00 0.00 H new ATOM 0 HA GLU A 72 8.470 -0.740 -7.821 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.659 1.559 -8.022 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.840 0.625 -6.551 1.00 0.00 H new ATOM 0 HG2 GLU A 72 12.074 -0.071 -7.179 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.898 0.617 -8.781 1.00 0.00 H new ATOM 374 N GLY A 73 10.091 -0.621 -10.653 1.00 0.00 N ATOM 375 CA GLY A 73 9.929 -0.607 -12.110 1.00 0.00 C ATOM 376 C GLY A 73 8.691 -1.376 -12.592 1.00 0.00 C ATOM 377 O GLY A 73 7.964 -0.907 -13.466 1.00 0.00 O ATOM 0 H GLY A 73 11.015 -0.940 -10.362 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.862 0.426 -12.451 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.818 -1.038 -12.571 1.00 0.00 H new ATOM 381 N GLU A 74 8.407 -2.539 -11.999 1.00 0.00 N ATOM 382 CA GLU A 74 7.177 -3.300 -12.250 1.00 0.00 C ATOM 383 C GLU A 74 5.958 -2.578 -11.681 1.00 0.00 C ATOM 384 O GLU A 74 4.973 -2.391 -12.392 1.00 0.00 O ATOM 385 CB GLU A 74 7.269 -4.738 -11.705 1.00 0.00 C ATOM 386 CG GLU A 74 7.929 -5.666 -12.732 1.00 0.00 C ATOM 387 CD GLU A 74 7.860 -7.138 -12.282 1.00 0.00 C ATOM 388 OE1 GLU A 74 8.737 -7.591 -11.507 1.00 0.00 O ATOM 389 OE2 GLU A 74 6.932 -7.862 -12.722 1.00 0.00 O ATOM 0 H GLU A 74 9.030 -2.984 -11.325 1.00 0.00 H new ATOM 0 HA GLU A 74 7.058 -3.370 -13.331 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.844 -4.745 -10.779 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.271 -5.105 -11.464 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.434 -5.555 -13.697 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.970 -5.375 -12.872 1.00 0.00 H new ATOM 396 N VAL A 75 6.025 -2.139 -10.422 1.00 0.00 N ATOM 397 CA VAL A 75 4.896 -1.493 -9.734 1.00 0.00 C ATOM 398 C VAL A 75 4.409 -0.227 -10.462 1.00 0.00 C ATOM 399 O VAL A 75 3.219 -0.117 -10.769 1.00 0.00 O ATOM 400 CB VAL A 75 5.214 -1.270 -8.249 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.055 -0.607 -7.500 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.489 -2.626 -7.583 1.00 0.00 C ATOM 0 H VAL A 75 6.863 -2.220 -9.847 1.00 0.00 H new ATOM 0 HA VAL A 75 4.047 -2.175 -9.769 1.00 0.00 H new ATOM 0 HB VAL A 75 6.082 -0.612 -8.200 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.329 -0.471 -6.454 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.840 0.363 -7.948 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.170 -1.241 -7.564 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.716 -2.474 -6.528 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.609 -3.263 -7.677 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.338 -3.105 -8.071 1.00 0.00 H new ATOM 412 N ILE A 76 5.287 0.720 -10.823 1.00 0.00 N ATOM 413 CA ILE A 76 4.851 1.910 -11.573 1.00 0.00 C ATOM 414 C ILE A 76 4.583 1.644 -13.054 1.00 0.00 C ATOM 415 O ILE A 76 3.703 2.285 -13.613 1.00 0.00 O ATOM 416 CB ILE A 76 5.752 3.142 -11.378 1.00 0.00 C ATOM 417 CG1 ILE A 76 6.862 3.403 -12.412 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.263 3.252 -9.938 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.893 2.288 -12.477 1.00 0.00 C ATOM 0 H ILE A 76 6.285 0.689 -10.614 1.00 0.00 H new ATOM 0 HA ILE A 76 3.891 2.157 -11.120 1.00 0.00 H new ATOM 0 HB ILE A 76 5.064 3.962 -11.585 1.00 0.00 H new ATOM 0 HG12 ILE A 76 6.411 3.530 -13.396 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.364 4.339 -12.168 1.00 0.00 H new ATOM 0 HG21 ILE A 76 6.895 4.135 -9.843 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.416 3.337 -9.257 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.842 2.363 -9.688 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.647 2.533 -13.225 1.00 0.00 H new ATOM 0 HD12 ILE A 76 8.370 2.176 -11.503 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.402 1.354 -12.750 1.00 0.00 H new ATOM 431 N SER A 77 5.235 0.663 -13.686 1.00 0.00 N ATOM 432 CA SER A 77 4.855 0.221 -15.045 1.00 0.00 C ATOM 433 C SER A 77 3.439 -0.350 -15.054 1.00 0.00 C ATOM 434 O SER A 77 2.714 -0.227 -16.042 1.00 0.00 O ATOM 435 CB SER A 77 5.865 -0.787 -15.602 1.00 0.00 C ATOM 436 OG SER A 77 5.554 -1.150 -16.940 1.00 0.00 O ATOM 0 H SER A 77 6.026 0.158 -13.286 1.00 0.00 H new ATOM 0 HA SER A 77 4.868 1.093 -15.699 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.867 -0.359 -15.563 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.875 -1.678 -14.975 1.00 0.00 H new ATOM 0 HG SER A 77 6.217 -1.793 -17.267 1.00 0.00 H new ATOM 442 N LEU A 78 3.002 -0.874 -13.904 1.00 0.00 N ATOM 443 CA LEU A 78 1.622 -1.273 -13.676 1.00 0.00 C ATOM 444 C LEU A 78 0.694 -0.125 -13.248 1.00 0.00 C ATOM 445 O LEU A 78 -0.517 -0.249 -13.428 1.00 0.00 O ATOM 446 CB LEU A 78 1.591 -2.426 -12.661 1.00 0.00 C ATOM 447 CG LEU A 78 1.999 -3.768 -13.277 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.367 -4.766 -12.183 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.830 -4.317 -14.098 1.00 0.00 C ATOM 0 H LEU A 78 3.609 -1.032 -13.100 1.00 0.00 H new ATOM 0 HA LEU A 78 1.224 -1.605 -14.635 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.260 -2.193 -11.832 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.587 -2.512 -12.246 1.00 0.00 H new ATOM 0 HG LEU A 78 2.867 -3.617 -13.918 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.654 -5.714 -12.637 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.201 -4.375 -11.600 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.509 -4.922 -11.529 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.113 -5.272 -14.540 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.035 -4.459 -13.450 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.578 -3.611 -14.890 1.00 0.00 H new ATOM 461 N GLY A 79 1.226 1.004 -12.766 1.00 0.00 N ATOM 462 CA GLY A 79 0.451 2.224 -12.524 1.00 0.00 C ATOM 463 C GLY A 79 0.350 3.148 -13.747 1.00 0.00 C ATOM 464 O GLY A 79 -0.521 4.017 -13.807 1.00 0.00 O ATOM 0 H GLY A 79 2.214 1.096 -12.531 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.554 1.947 -12.205 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.906 2.775 -11.701 1.00 0.00 H new ATOM 468 N LEU A 80 1.226 3.000 -14.743 1.00 0.00 N ATOM 469 CA LEU A 80 1.282 3.899 -15.894 1.00 0.00 C ATOM 470 C LEU A 80 0.184 3.803 -16.973 1.00 0.00 C ATOM 471 O LEU A 80 0.023 4.797 -17.692 1.00 0.00 O ATOM 472 CB LEU A 80 2.686 3.885 -16.520 1.00 0.00 C ATOM 473 CG LEU A 80 3.686 4.792 -15.777 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.033 4.755 -16.496 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.205 6.243 -15.691 1.00 0.00 C ATOM 0 H LEU A 80 1.918 2.251 -14.773 1.00 0.00 H new ATOM 0 HA LEU A 80 1.052 4.865 -15.445 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.065 2.863 -16.525 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.617 4.205 -17.560 1.00 0.00 H new ATOM 0 HG LEU A 80 3.778 4.412 -14.760 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.743 5.396 -15.973 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.410 3.732 -16.510 1.00 0.00 H new ATOM 0 HD13 LEU A 80 4.909 5.110 -17.519 1.00 0.00 H new ATOM 0 HD21 LEU A 80 3.945 6.841 -15.159 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.072 6.642 -16.696 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.256 6.281 -15.157 1.00 0.00 H new ATOM 487 N PRO A 81 -0.635 2.740 -17.096 1.00 0.00 N ATOM 488 CA PRO A 81 -1.819 2.751 -17.961 1.00 0.00 C ATOM 489 C PRO A 81 -2.885 3.806 -17.657 1.00 0.00 C ATOM 490 O PRO A 81 -3.836 3.934 -18.435 1.00 0.00 O ATOM 491 CB PRO A 81 -2.398 1.332 -17.914 1.00 0.00 C ATOM 492 CG PRO A 81 -1.216 0.471 -17.486 1.00 0.00 C ATOM 493 CD PRO A 81 -0.441 1.403 -16.559 1.00 0.00 C ATOM 0 HA PRO A 81 -1.494 3.048 -18.958 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -3.223 1.260 -17.205 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.785 1.025 -18.886 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.539 -0.434 -16.972 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.615 0.156 -18.339 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.811 1.334 -15.536 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.617 1.140 -16.534 1.00 0.00 H new ATOM 501 N PHE A 82 -2.727 4.575 -16.575 1.00 0.00 N ATOM 502 CA PHE A 82 -3.803 5.397 -16.040 1.00 0.00 C ATOM 503 C PHE A 82 -3.518 6.899 -15.978 1.00 0.00 C ATOM 504 O PHE A 82 -4.423 7.709 -16.186 1.00 0.00 O ATOM 505 CB PHE A 82 -4.138 4.872 -14.642 1.00 0.00 C ATOM 506 CG PHE A 82 -4.310 3.371 -14.608 1.00 0.00 C ATOM 507 CD1 PHE A 82 -5.292 2.748 -15.400 1.00 0.00 C ATOM 508 CD2 PHE A 82 -3.400 2.591 -13.882 1.00 0.00 C ATOM 509 CE1 PHE A 82 -5.394 1.349 -15.427 1.00 0.00 C ATOM 510 CE2 PHE A 82 -3.498 1.193 -13.910 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.484 0.576 -14.692 1.00 0.00 C ATOM 0 H PHE A 82 -1.854 4.641 -16.052 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.639 5.309 -16.734 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.345 5.158 -13.951 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -5.054 5.347 -14.290 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -5.969 3.349 -15.989 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -2.624 3.067 -13.301 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.168 0.871 -16.010 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.814 0.592 -13.329 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.543 -0.502 -14.729 1.00 0.00 H new ATOM 521 N GLY A 83 -2.273 7.279 -15.682 1.00 0.00 N ATOM 522 CA GLY A 83 -1.859 8.670 -15.563 1.00 0.00 C ATOM 523 C GLY A 83 -0.345 8.817 -15.634 1.00 0.00 C ATOM 524 O GLY A 83 0.229 8.781 -16.724 1.00 0.00 O ATOM 0 H GLY A 83 -1.516 6.615 -15.517 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.319 9.256 -16.359 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.220 9.077 -14.619 1.00 0.00 H new ATOM 528 N LYS A 84 0.300 8.994 -14.472 1.00 0.00 N ATOM 529 CA LYS A 84 1.748 9.259 -14.388 1.00 0.00 C ATOM 530 C LYS A 84 2.494 8.717 -13.161 1.00 0.00 C ATOM 531 O LYS A 84 3.718 8.734 -13.156 1.00 0.00 O ATOM 532 CB LYS A 84 1.970 10.770 -14.583 1.00 0.00 C ATOM 533 CG LYS A 84 3.357 11.184 -15.105 1.00 0.00 C ATOM 534 CD LYS A 84 3.780 10.450 -16.388 1.00 0.00 C ATOM 535 CE LYS A 84 5.047 11.088 -16.972 1.00 0.00 C ATOM 536 NZ LYS A 84 5.466 10.417 -18.231 1.00 0.00 N ATOM 0 H LYS A 84 -0.164 8.958 -13.564 1.00 0.00 H new ATOM 0 HA LYS A 84 2.205 8.676 -15.188 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.216 11.142 -15.277 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.798 11.269 -13.629 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.358 12.257 -15.294 1.00 0.00 H new ATOM 0 HG3 LYS A 84 4.098 10.996 -14.328 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.962 9.398 -16.170 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.974 10.489 -17.120 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.867 12.146 -17.165 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.854 11.030 -16.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 6.325 10.873 -18.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 5.661 9.413 -18.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.705 10.494 -18.935 1.00 0.00 H new ATOM 550 N VAL A 85 1.759 8.223 -12.155 1.00 0.00 N ATOM 551 CA VAL A 85 2.205 7.723 -10.837 1.00 0.00 C ATOM 552 C VAL A 85 3.460 8.450 -10.288 1.00 0.00 C ATOM 553 O VAL A 85 4.610 8.073 -10.524 1.00 0.00 O ATOM 554 CB VAL A 85 2.313 6.189 -10.747 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.693 5.444 -9.566 1.00 0.00 C ATOM 556 CG2 VAL A 85 2.378 5.442 -12.080 1.00 0.00 C ATOM 0 H VAL A 85 0.745 8.155 -12.246 1.00 0.00 H new ATOM 0 HA VAL A 85 1.391 7.989 -10.162 1.00 0.00 H new ATOM 0 HB VAL A 85 3.337 6.142 -10.376 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.871 4.374 -9.677 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.145 5.793 -8.638 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.620 5.633 -9.540 1.00 0.00 H new ATOM 0 HG21 VAL A 85 2.452 4.371 -11.893 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.476 5.648 -12.657 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.252 5.774 -12.641 1.00 0.00 H new ATOM 566 N THR A 86 3.210 9.536 -9.558 1.00 0.00 N ATOM 567 CA THR A 86 4.193 10.471 -8.993 1.00 0.00 C ATOM 568 C THR A 86 5.218 9.768 -8.111 1.00 0.00 C ATOM 569 O THR A 86 6.404 10.115 -8.160 1.00 0.00 O ATOM 570 CB THR A 86 3.472 11.539 -8.157 1.00 0.00 C ATOM 571 OG1 THR A 86 2.477 12.155 -8.936 1.00 0.00 O ATOM 572 CG2 THR A 86 4.366 12.660 -7.632 1.00 0.00 C ATOM 0 H THR A 86 2.254 9.808 -9.328 1.00 0.00 H new ATOM 0 HA THR A 86 4.721 10.927 -9.830 1.00 0.00 H new ATOM 0 HB THR A 86 3.077 10.996 -7.298 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.017 12.835 -8.401 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.766 13.364 -7.055 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.143 12.238 -6.995 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.828 13.180 -8.471 1.00 0.00 H new ATOM 580 N ASN A 87 4.778 8.799 -7.296 1.00 0.00 N ATOM 581 CA ASN A 87 5.671 8.055 -6.419 1.00 0.00 C ATOM 582 C ASN A 87 5.183 6.635 -6.069 1.00 0.00 C ATOM 583 O ASN A 87 4.029 6.269 -6.269 1.00 0.00 O ATOM 584 CB ASN A 87 5.902 8.913 -5.144 1.00 0.00 C ATOM 585 CG ASN A 87 7.280 8.777 -4.512 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.133 8.014 -4.945 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.524 9.536 -3.471 1.00 0.00 N ATOM 0 H ASN A 87 3.800 8.516 -7.232 1.00 0.00 H new ATOM 0 HA ASN A 87 6.606 7.885 -6.952 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.737 9.961 -5.396 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.151 8.642 -4.402 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.434 9.495 -3.012 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.804 10.168 -3.120 1.00 0.00 H new ATOM 594 N LEU A 88 6.060 5.838 -5.467 1.00 0.00 N ATOM 595 CA LEU A 88 5.732 4.670 -4.656 1.00 0.00 C ATOM 596 C LEU A 88 6.662 4.526 -3.434 1.00 0.00 C ATOM 597 O LEU A 88 7.638 5.263 -3.277 1.00 0.00 O ATOM 598 CB LEU A 88 5.737 3.436 -5.570 1.00 0.00 C ATOM 599 CG LEU A 88 7.092 2.731 -5.726 1.00 0.00 C ATOM 600 CD1 LEU A 88 6.804 1.491 -6.543 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.175 3.557 -6.422 1.00 0.00 C ATOM 0 H LEU A 88 7.065 5.996 -5.534 1.00 0.00 H new ATOM 0 HA LEU A 88 4.737 4.786 -4.227 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.016 2.716 -5.183 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.388 3.737 -6.558 1.00 0.00 H new ATOM 0 HG LEU A 88 7.497 2.532 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.728 0.934 -6.696 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.086 0.865 -6.013 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.390 1.780 -7.509 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.094 2.974 -6.484 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.843 3.820 -7.426 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.361 4.467 -5.852 1.00 0.00 H new ATOM 613 N LEU A 89 6.354 3.565 -2.564 1.00 0.00 N ATOM 614 CA LEU A 89 7.091 3.250 -1.335 1.00 0.00 C ATOM 615 C LEU A 89 6.956 1.764 -1.022 1.00 0.00 C ATOM 616 O LEU A 89 5.965 1.148 -1.407 1.00 0.00 O ATOM 617 CB LEU A 89 6.599 4.229 -0.252 1.00 0.00 C ATOM 618 CG LEU A 89 6.448 3.780 1.203 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.871 4.994 1.927 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.467 2.668 1.483 1.00 0.00 C ATOM 0 H LEU A 89 5.548 2.956 -2.700 1.00 0.00 H new ATOM 0 HA LEU A 89 8.168 3.397 -1.419 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.282 5.079 -0.255 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.626 4.600 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 89 7.426 3.410 1.509 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.731 4.756 2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.559 5.835 1.833 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.911 5.259 1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.460 2.450 2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.470 2.975 1.168 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.762 1.775 0.932 1.00 0.00 H new ATOM 632 N MET A 90 7.916 1.191 -0.290 1.00 0.00 N ATOM 633 CA MET A 90 7.918 -0.228 0.095 1.00 0.00 C ATOM 634 C MET A 90 8.153 -0.420 1.592 1.00 0.00 C ATOM 635 O MET A 90 9.250 -0.189 2.102 1.00 0.00 O ATOM 636 CB MET A 90 8.909 -1.026 -0.767 1.00 0.00 C ATOM 637 CG MET A 90 8.471 -0.882 -2.224 1.00 0.00 C ATOM 638 SD MET A 90 8.976 -2.167 -3.379 1.00 0.00 S ATOM 639 CE MET A 90 7.662 -1.777 -4.553 1.00 0.00 C ATOM 0 H MET A 90 8.726 1.705 0.058 1.00 0.00 H new ATOM 0 HA MET A 90 6.923 -0.628 -0.101 1.00 0.00 H new ATOM 0 HB2 MET A 90 9.923 -0.650 -0.633 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.916 -2.075 -0.471 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.383 -0.822 -2.243 1.00 0.00 H new ATOM 0 HG3 MET A 90 8.849 0.071 -2.595 1.00 0.00 H new ATOM 0 HE1 MET A 90 7.793 -2.372 -5.457 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.695 -2.005 -4.105 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.704 -0.718 -4.807 1.00 0.00 H new ATOM 649 N LEU A 91 7.109 -0.864 2.295 1.00 0.00 N ATOM 650 CA LEU A 91 7.178 -1.317 3.690 1.00 0.00 C ATOM 651 C LEU A 91 7.828 -2.713 3.753 1.00 0.00 C ATOM 652 O LEU A 91 7.169 -3.747 3.928 1.00 0.00 O ATOM 653 CB LEU A 91 5.787 -1.322 4.358 1.00 0.00 C ATOM 654 CG LEU A 91 4.961 -0.024 4.473 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.817 1.189 4.794 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.064 0.208 3.260 1.00 0.00 C ATOM 0 H LEU A 91 6.169 -0.921 1.903 1.00 0.00 H new ATOM 0 HA LEU A 91 7.795 -0.613 4.248 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.175 -2.044 3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.919 -1.708 5.369 1.00 0.00 H new ATOM 0 HG LEU A 91 4.298 -0.166 5.326 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.184 2.073 4.863 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.327 1.033 5.744 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.555 1.332 4.005 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.505 1.134 3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.678 0.280 2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.368 -0.624 3.158 1.00 0.00 H new ATOM 668 N LYS A 92 9.157 -2.732 3.614 1.00 0.00 N ATOM 669 CA LYS A 92 10.005 -3.939 3.568 1.00 0.00 C ATOM 670 C LYS A 92 9.929 -4.844 4.810 1.00 0.00 C ATOM 671 O LYS A 92 10.343 -6.000 4.746 1.00 0.00 O ATOM 672 CB LYS A 92 11.448 -3.539 3.200 1.00 0.00 C ATOM 673 CG LYS A 92 12.194 -2.645 4.215 1.00 0.00 C ATOM 674 CD LYS A 92 12.970 -3.393 5.313 1.00 0.00 C ATOM 675 CE LYS A 92 14.169 -4.165 4.741 1.00 0.00 C ATOM 676 NZ LYS A 92 14.978 -4.799 5.815 1.00 0.00 N ATOM 0 H LYS A 92 9.700 -1.873 3.526 1.00 0.00 H new ATOM 0 HA LYS A 92 9.598 -4.578 2.784 1.00 0.00 H new ATOM 0 HB2 LYS A 92 12.029 -4.450 3.056 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.425 -3.021 2.241 1.00 0.00 H new ATOM 0 HG2 LYS A 92 12.892 -2.011 3.669 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.470 -1.985 4.692 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.320 -2.681 6.060 1.00 0.00 H new ATOM 0 HD3 LYS A 92 12.301 -4.087 5.822 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.813 -4.932 4.053 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.798 -3.486 4.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.778 -5.311 5.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.338 -4.065 6.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.385 -5.466 6.349 1.00 0.00 H new ATOM 690 N GLY A 93 9.353 -4.350 5.910 1.00 0.00 N ATOM 691 CA GLY A 93 9.011 -5.115 7.114 1.00 0.00 C ATOM 692 C GLY A 93 8.061 -6.295 6.875 1.00 0.00 C ATOM 693 O GLY A 93 8.228 -7.353 7.491 1.00 0.00 O ATOM 0 H GLY A 93 9.102 -3.365 5.990 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.931 -5.491 7.562 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.556 -4.441 7.839 1.00 0.00 H new ATOM 697 N LYS A 94 7.038 -6.107 6.023 1.00 0.00 N ATOM 698 CA LYS A 94 5.836 -6.970 5.946 1.00 0.00 C ATOM 699 C LYS A 94 5.376 -7.315 4.518 1.00 0.00 C ATOM 700 O LYS A 94 4.286 -7.855 4.345 1.00 0.00 O ATOM 701 CB LYS A 94 4.699 -6.304 6.752 1.00 0.00 C ATOM 702 CG LYS A 94 4.962 -6.296 8.271 1.00 0.00 C ATOM 703 CD LYS A 94 4.064 -5.309 9.028 1.00 0.00 C ATOM 704 CE LYS A 94 4.542 -3.874 8.789 1.00 0.00 C ATOM 705 NZ LYS A 94 3.689 -2.904 9.520 1.00 0.00 N ATOM 0 H LYS A 94 7.019 -5.337 5.354 1.00 0.00 H new ATOM 0 HA LYS A 94 6.109 -7.933 6.378 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.568 -5.279 6.406 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.765 -6.829 6.553 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.805 -7.299 8.667 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.006 -6.042 8.452 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.031 -5.417 8.696 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.081 -5.534 10.094 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.577 -3.772 9.115 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.520 -3.652 7.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.166 -1.981 9.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.778 -2.804 9.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.524 -3.247 10.488 1.00 0.00 H new ATOM 719 N ASN A 95 6.180 -7.013 3.493 1.00 0.00 N ATOM 720 CA ASN A 95 5.785 -7.035 2.073 1.00 0.00 C ATOM 721 C ASN A 95 4.515 -6.210 1.789 1.00 0.00 C ATOM 722 O ASN A 95 3.584 -6.664 1.115 1.00 0.00 O ATOM 723 CB ASN A 95 5.665 -8.475 1.548 1.00 0.00 C ATOM 724 CG ASN A 95 6.991 -9.194 1.428 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.921 -8.723 0.791 1.00 0.00 O ATOM 726 ND2 ASN A 95 7.120 -10.357 2.023 1.00 0.00 N ATOM 0 H ASN A 95 7.153 -6.738 3.628 1.00 0.00 H new ATOM 0 HA ASN A 95 6.587 -6.547 1.520 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.014 -9.042 2.214 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.183 -8.456 0.571 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.999 -10.870 1.954 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.342 -10.747 2.554 1.00 0.00 H new ATOM 733 N GLN A 96 4.493 -4.973 2.279 1.00 0.00 N ATOM 734 CA GLN A 96 3.470 -3.989 1.938 1.00 0.00 C ATOM 735 C GLN A 96 4.095 -2.826 1.138 1.00 0.00 C ATOM 736 O GLN A 96 5.318 -2.695 1.083 1.00 0.00 O ATOM 737 CB GLN A 96 2.779 -3.536 3.213 1.00 0.00 C ATOM 738 CG GLN A 96 2.019 -4.654 3.938 1.00 0.00 C ATOM 739 CD GLN A 96 1.743 -4.234 5.368 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.842 -4.999 6.312 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.394 -2.996 5.597 1.00 0.00 N ATOM 0 H GLN A 96 5.194 -4.622 2.932 1.00 0.00 H new ATOM 0 HA GLN A 96 2.711 -4.429 1.291 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.524 -3.118 3.890 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.082 -2.733 2.972 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.082 -4.865 3.422 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.604 -5.574 3.924 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.305 -2.339 4.822 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.210 -2.686 6.551 1.00 0.00 H new ATOM 750 N ALA A 97 3.290 -1.967 0.516 1.00 0.00 N ATOM 751 CA ALA A 97 3.761 -0.836 -0.297 1.00 0.00 C ATOM 752 C ALA A 97 2.707 0.273 -0.372 1.00 0.00 C ATOM 753 O ALA A 97 1.525 0.028 -0.127 1.00 0.00 O ATOM 754 CB ALA A 97 4.045 -1.385 -1.708 1.00 0.00 C ATOM 0 H ALA A 97 2.273 -2.034 0.561 1.00 0.00 H new ATOM 0 HA ALA A 97 4.655 -0.400 0.150 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.398 -0.577 -2.348 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.808 -2.162 -1.650 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.130 -1.805 -2.126 1.00 0.00 H new ATOM 760 N PHE A 98 3.128 1.471 -0.773 1.00 0.00 N ATOM 761 CA PHE A 98 2.268 2.556 -1.262 1.00 0.00 C ATOM 762 C PHE A 98 2.475 2.710 -2.774 1.00 0.00 C ATOM 763 O PHE A 98 3.564 2.432 -3.276 1.00 0.00 O ATOM 764 CB PHE A 98 2.620 3.907 -0.627 1.00 0.00 C ATOM 765 CG PHE A 98 2.225 4.191 0.812 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.852 3.170 1.708 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.255 5.524 1.269 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.545 3.480 3.039 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.909 5.843 2.580 1.00 0.00 C ATOM 770 CZ PHE A 98 1.570 4.812 3.454 1.00 0.00 C ATOM 0 H PHE A 98 4.116 1.726 -0.767 1.00 0.00 H new ATOM 0 HA PHE A 98 1.242 2.294 -1.004 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.701 4.027 -0.697 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.172 4.684 -1.246 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.803 2.146 1.368 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.551 6.311 0.591 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.291 2.696 3.737 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.904 6.870 2.913 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.321 5.050 4.478 1.00 0.00 H new ATOM 780 N ILE A 99 1.492 3.258 -3.485 1.00 0.00 N ATOM 781 CA ILE A 99 1.585 3.703 -4.873 1.00 0.00 C ATOM 782 C ILE A 99 0.771 5.007 -5.019 1.00 0.00 C ATOM 783 O ILE A 99 -0.450 5.026 -4.881 1.00 0.00 O ATOM 784 CB ILE A 99 1.220 2.525 -5.819 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.487 2.923 -7.278 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.187 1.945 -5.595 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.178 1.828 -8.310 1.00 0.00 C ATOM 0 H ILE A 99 0.564 3.411 -3.089 1.00 0.00 H new ATOM 0 HA ILE A 99 2.597 3.970 -5.176 1.00 0.00 H new ATOM 0 HB ILE A 99 1.877 1.694 -5.565 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.891 3.804 -7.515 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.534 3.210 -7.376 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.360 1.128 -6.296 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.268 1.571 -4.575 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.932 2.725 -5.756 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.397 2.199 -9.311 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.793 0.952 -8.106 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.125 1.555 -8.246 1.00 0.00 H new ATOM 799 N GLU A 100 1.482 6.129 -5.149 1.00 0.00 N ATOM 800 CA GLU A 100 1.033 7.532 -5.134 1.00 0.00 C ATOM 801 C GLU A 100 0.983 8.098 -6.546 1.00 0.00 C ATOM 802 O GLU A 100 1.982 8.060 -7.265 1.00 0.00 O ATOM 803 CB GLU A 100 2.032 8.346 -4.298 1.00 0.00 C ATOM 804 CG GLU A 100 2.068 9.877 -4.495 1.00 0.00 C ATOM 805 CD GLU A 100 0.938 10.629 -3.797 1.00 0.00 C ATOM 806 OE1 GLU A 100 -0.201 10.132 -3.726 1.00 0.00 O ATOM 807 OE2 GLU A 100 1.161 11.777 -3.357 1.00 0.00 O ATOM 0 H GLU A 100 2.492 6.077 -5.281 1.00 0.00 H new ATOM 0 HA GLU A 100 0.032 7.587 -4.707 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.824 8.150 -3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.031 7.960 -4.503 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.022 10.256 -4.128 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.028 10.095 -5.562 1.00 0.00 H new ATOM 814 N MET A 101 -0.147 8.681 -6.946 1.00 0.00 N ATOM 815 CA MET A 101 -0.325 9.070 -8.347 1.00 0.00 C ATOM 816 C MET A 101 -0.676 10.533 -8.655 1.00 0.00 C ATOM 817 O MET A 101 -1.101 11.308 -7.805 1.00 0.00 O ATOM 818 CB MET A 101 -1.133 7.947 -9.018 1.00 0.00 C ATOM 819 CG MET A 101 -2.103 8.311 -10.139 1.00 0.00 C ATOM 820 SD MET A 101 -1.383 8.240 -11.779 1.00 0.00 S ATOM 821 CE MET A 101 -1.053 6.460 -11.781 1.00 0.00 C ATOM 0 H MET A 101 -0.937 8.891 -6.336 1.00 0.00 H new ATOM 0 HA MET A 101 0.646 9.136 -8.837 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.423 7.222 -9.417 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.703 7.439 -8.240 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.958 7.636 -10.099 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.483 9.317 -9.964 1.00 0.00 H new ATOM 0 HE1 MET A 101 -0.847 6.129 -12.799 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.190 6.249 -11.149 1.00 0.00 H new ATOM 0 HE3 MET A 101 -1.923 5.928 -11.396 1.00 0.00 H new ATOM 831 N ASN A 102 -0.391 10.925 -9.902 1.00 0.00 N ATOM 832 CA ASN A 102 -0.367 12.310 -10.373 1.00 0.00 C ATOM 833 C ASN A 102 -1.759 12.960 -10.484 1.00 0.00 C ATOM 834 O ASN A 102 -1.862 14.186 -10.445 1.00 0.00 O ATOM 835 CB ASN A 102 0.422 12.253 -11.693 1.00 0.00 C ATOM 836 CG ASN A 102 0.042 13.244 -12.778 1.00 0.00 C ATOM 837 OD1 ASN A 102 0.269 14.441 -12.694 1.00 0.00 O ATOM 838 ND2 ASN A 102 -0.491 12.729 -13.866 1.00 0.00 N ATOM 0 H ASN A 102 -0.162 10.257 -10.638 1.00 0.00 H new ATOM 0 HA ASN A 102 0.114 12.974 -9.655 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.477 12.396 -11.461 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.319 11.248 -12.104 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.721 13.332 -14.656 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.674 11.727 -13.919 1.00 0.00 H new ATOM 845 N THR A 103 -2.828 12.161 -10.586 1.00 0.00 N ATOM 846 CA THR A 103 -4.200 12.675 -10.739 1.00 0.00 C ATOM 847 C THR A 103 -5.184 11.858 -9.912 1.00 0.00 C ATOM 848 O THR A 103 -5.013 10.650 -9.714 1.00 0.00 O ATOM 849 CB THR A 103 -4.649 12.811 -12.216 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.533 11.795 -12.625 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.507 12.819 -13.234 1.00 0.00 C ATOM 0 H THR A 103 -2.770 11.143 -10.565 1.00 0.00 H new ATOM 0 HA THR A 103 -4.194 13.693 -10.348 1.00 0.00 H new ATOM 0 HB THR A 103 -5.142 13.783 -12.212 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.781 11.935 -13.563 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.916 12.918 -14.239 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.843 13.658 -13.029 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.947 11.887 -13.160 1.00 0.00 H new ATOM 859 N GLU A 104 -6.220 12.527 -9.405 1.00 0.00 N ATOM 860 CA GLU A 104 -7.275 11.905 -8.600 1.00 0.00 C ATOM 861 C GLU A 104 -8.057 10.867 -9.408 1.00 0.00 C ATOM 862 O GLU A 104 -8.390 9.806 -8.884 1.00 0.00 O ATOM 863 CB GLU A 104 -8.218 12.983 -8.042 1.00 0.00 C ATOM 864 CG GLU A 104 -7.487 13.954 -7.100 1.00 0.00 C ATOM 865 CD GLU A 104 -8.464 14.987 -6.504 1.00 0.00 C ATOM 866 OE1 GLU A 104 -9.076 14.709 -5.445 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.626 16.082 -7.094 1.00 0.00 O ATOM 0 H GLU A 104 -6.353 13.529 -9.543 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.803 11.383 -7.767 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.659 13.542 -8.867 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.038 12.505 -7.506 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.008 13.395 -6.296 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.696 14.469 -7.645 1.00 0.00 H new ATOM 874 N GLU A 105 -8.309 11.132 -10.692 1.00 0.00 N ATOM 875 CA GLU A 105 -9.015 10.199 -11.574 1.00 0.00 C ATOM 876 C GLU A 105 -8.148 9.030 -12.033 1.00 0.00 C ATOM 877 O GLU A 105 -8.643 7.907 -12.090 1.00 0.00 O ATOM 878 CB GLU A 105 -9.562 10.922 -12.811 1.00 0.00 C ATOM 879 CG GLU A 105 -10.728 11.857 -12.459 1.00 0.00 C ATOM 880 CD GLU A 105 -11.288 12.542 -13.721 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.211 11.983 -14.361 1.00 0.00 O ATOM 882 OE2 GLU A 105 -10.818 13.651 -14.079 1.00 0.00 O ATOM 0 H GLU A 105 -8.029 12.000 -11.150 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.833 9.795 -10.978 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.763 11.498 -13.278 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.895 10.187 -13.544 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.518 11.289 -11.968 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.391 12.613 -11.750 1.00 0.00 H new ATOM 889 N ALA A 106 -6.862 9.256 -12.315 1.00 0.00 N ATOM 890 CA ALA A 106 -5.920 8.180 -12.586 1.00 0.00 C ATOM 891 C ALA A 106 -5.831 7.234 -11.395 1.00 0.00 C ATOM 892 O ALA A 106 -5.951 6.033 -11.575 1.00 0.00 O ATOM 893 CB ALA A 106 -4.537 8.733 -12.910 1.00 0.00 C ATOM 0 H ALA A 106 -6.451 10.188 -12.360 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.285 7.628 -13.452 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.853 7.908 -13.108 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.598 9.373 -13.790 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.170 9.314 -12.064 1.00 0.00 H new ATOM 899 N ALA A 107 -5.664 7.740 -10.173 1.00 0.00 N ATOM 900 CA ALA A 107 -5.611 6.883 -8.999 1.00 0.00 C ATOM 901 C ALA A 107 -6.952 6.237 -8.634 1.00 0.00 C ATOM 902 O ALA A 107 -6.978 5.058 -8.293 1.00 0.00 O ATOM 903 CB ALA A 107 -5.079 7.704 -7.857 1.00 0.00 C ATOM 0 H ALA A 107 -5.564 8.736 -9.975 1.00 0.00 H new ATOM 0 HA ALA A 107 -4.954 6.042 -9.223 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.027 7.088 -6.959 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.082 8.069 -8.105 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.742 8.551 -7.678 1.00 0.00 H new ATOM 909 N ASN A 108 -8.072 6.951 -8.768 1.00 0.00 N ATOM 910 CA ASN A 108 -9.399 6.350 -8.642 1.00 0.00 C ATOM 911 C ASN A 108 -9.588 5.208 -9.648 1.00 0.00 C ATOM 912 O ASN A 108 -9.978 4.109 -9.260 1.00 0.00 O ATOM 913 CB ASN A 108 -10.476 7.434 -8.771 1.00 0.00 C ATOM 914 CG ASN A 108 -11.867 6.845 -8.608 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.240 6.352 -7.553 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.672 6.858 -9.644 1.00 0.00 N ATOM 0 H ASN A 108 -8.084 7.952 -8.965 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.497 5.903 -7.653 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.313 8.204 -8.017 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.394 7.918 -9.744 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.607 6.457 -9.568 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.363 7.269 -10.525 1.00 0.00 H new ATOM 923 N THR A 109 -9.236 5.402 -10.922 1.00 0.00 N ATOM 924 CA THR A 109 -9.232 4.287 -11.872 1.00 0.00 C ATOM 925 C THR A 109 -8.173 3.244 -11.509 1.00 0.00 C ATOM 926 O THR A 109 -8.413 2.077 -11.766 1.00 0.00 O ATOM 927 CB THR A 109 -9.118 4.749 -13.339 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.055 4.040 -14.122 1.00 0.00 O ATOM 929 CG2 THR A 109 -7.748 4.542 -13.984 1.00 0.00 C ATOM 0 H THR A 109 -8.956 6.301 -11.313 1.00 0.00 H new ATOM 0 HA THR A 109 -10.205 3.804 -11.789 1.00 0.00 H new ATOM 0 HB THR A 109 -9.300 5.823 -13.310 1.00 0.00 H new ATOM 0 HG1 THR A 109 -9.988 4.331 -15.055 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.773 4.899 -15.014 1.00 0.00 H new ATOM 0 HG22 THR A 109 -6.995 5.098 -13.425 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.498 3.481 -13.974 1.00 0.00 H new ATOM 937 N MET A 110 -7.048 3.607 -10.875 1.00 0.00 N ATOM 938 CA MET A 110 -5.948 2.693 -10.555 1.00 0.00 C ATOM 939 C MET A 110 -6.392 1.704 -9.473 1.00 0.00 C ATOM 940 O MET A 110 -6.278 0.491 -9.629 1.00 0.00 O ATOM 941 CB MET A 110 -4.646 3.443 -10.152 1.00 0.00 C ATOM 942 CG MET A 110 -3.448 2.530 -10.417 1.00 0.00 C ATOM 943 SD MET A 110 -1.823 3.311 -10.237 1.00 0.00 S ATOM 944 CE MET A 110 -1.997 3.918 -8.552 1.00 0.00 C ATOM 0 H MET A 110 -6.877 4.564 -10.565 1.00 0.00 H new ATOM 0 HA MET A 110 -5.702 2.136 -11.459 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.550 4.366 -10.723 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.682 3.722 -9.099 1.00 0.00 H new ATOM 0 HG2 MET A 110 -3.502 1.681 -9.736 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.532 2.133 -11.429 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.045 4.325 -8.212 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.757 4.699 -8.523 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.295 3.098 -7.899 1.00 0.00 H new ATOM 954 N VAL A 111 -6.974 2.223 -8.391 1.00 0.00 N ATOM 955 CA VAL A 111 -7.553 1.426 -7.308 1.00 0.00 C ATOM 956 C VAL A 111 -8.735 0.584 -7.793 1.00 0.00 C ATOM 957 O VAL A 111 -8.847 -0.580 -7.421 1.00 0.00 O ATOM 958 CB VAL A 111 -7.925 2.341 -6.125 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.321 2.932 -6.147 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.777 1.600 -4.798 1.00 0.00 C ATOM 0 H VAL A 111 -7.058 3.228 -8.240 1.00 0.00 H new ATOM 0 HA VAL A 111 -6.805 0.715 -6.958 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.225 3.170 -6.229 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.466 3.556 -5.265 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.446 3.537 -7.045 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.057 2.128 -6.147 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.045 2.266 -3.978 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.436 0.732 -4.791 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.744 1.273 -4.677 1.00 0.00 H new ATOM 970 N ASN A 112 -9.595 1.130 -8.662 1.00 0.00 N ATOM 971 CA ASN A 112 -10.761 0.417 -9.193 1.00 0.00 C ATOM 972 C ASN A 112 -10.335 -0.692 -10.161 1.00 0.00 C ATOM 973 O ASN A 112 -10.796 -1.822 -10.019 1.00 0.00 O ATOM 974 CB ASN A 112 -11.740 1.408 -9.839 1.00 0.00 C ATOM 975 CG ASN A 112 -12.641 2.079 -8.810 1.00 0.00 C ATOM 976 OD1 ASN A 112 -13.840 1.841 -8.758 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.116 2.912 -7.943 1.00 0.00 N ATOM 0 H ASN A 112 -9.500 2.082 -9.017 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.281 -0.070 -8.369 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.179 2.170 -10.380 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.355 0.884 -10.571 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.706 3.352 -7.237 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.118 3.119 -7.975 1.00 0.00 H new ATOM 984 N TYR A 113 -9.382 -0.422 -11.057 1.00 0.00 N ATOM 985 CA TYR A 113 -8.649 -1.400 -11.867 1.00 0.00 C ATOM 986 C TYR A 113 -8.106 -2.549 -11.012 1.00 0.00 C ATOM 987 O TYR A 113 -8.225 -3.710 -11.396 1.00 0.00 O ATOM 988 CB TYR A 113 -7.503 -0.690 -12.624 1.00 0.00 C ATOM 989 CG TYR A 113 -6.355 -1.595 -13.024 1.00 0.00 C ATOM 990 CD1 TYR A 113 -6.538 -2.534 -14.054 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.124 -1.516 -12.334 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.512 -3.450 -14.362 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.109 -2.452 -12.627 1.00 0.00 C ATOM 994 CZ TYR A 113 -4.301 -3.418 -13.636 1.00 0.00 C ATOM 995 OH TYR A 113 -3.310 -4.310 -13.907 1.00 0.00 O ATOM 0 H TYR A 113 -9.085 0.535 -11.247 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.340 -1.836 -12.588 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -7.911 -0.225 -13.521 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.114 0.113 -11.998 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -7.464 -2.554 -14.609 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -4.962 -0.749 -11.591 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -5.651 -4.174 -15.151 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.181 -2.428 -12.076 1.00 0.00 H new ATOM 0 HH TYR A 113 -2.548 -4.143 -13.314 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.597 -2.281 -9.811 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.028 -3.301 -8.950 1.00 0.00 C ATOM 1007 C TYR A 114 -8.063 -4.010 -8.100 1.00 0.00 C ATOM 1008 O TYR A 114 -7.863 -5.163 -7.709 1.00 0.00 O ATOM 1009 CB TYR A 114 -5.943 -2.688 -8.081 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.606 -2.579 -8.764 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.043 -3.713 -9.389 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -3.893 -1.369 -8.680 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -2.706 -3.648 -9.821 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -2.564 -1.307 -9.122 1.00 0.00 C ATOM 1015 CZ TYR A 114 -1.957 -2.460 -9.659 1.00 0.00 C ATOM 1016 OH TYR A 114 -0.647 -2.425 -10.014 1.00 0.00 O ATOM 0 H TYR A 114 -7.570 -1.343 -9.411 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.596 -4.065 -9.596 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.261 -1.694 -7.766 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.831 -3.288 -7.178 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -4.626 -4.611 -9.532 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.369 -0.488 -8.275 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.248 -4.512 -10.280 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.010 -0.383 -9.052 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.284 -1.532 -9.838 1.00 0.00 H new ATOM 1026 N THR A 115 -9.198 -3.347 -7.902 1.00 0.00 N ATOM 1027 CA THR A 115 -10.369 -3.919 -7.256 1.00 0.00 C ATOM 1028 C THR A 115 -11.106 -4.858 -8.228 1.00 0.00 C ATOM 1029 O THR A 115 -11.832 -5.768 -7.829 1.00 0.00 O ATOM 1030 CB THR A 115 -11.249 -2.795 -6.673 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.509 -2.089 -5.699 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.525 -3.279 -5.983 1.00 0.00 C ATOM 0 H THR A 115 -9.330 -2.378 -8.193 1.00 0.00 H new ATOM 0 HA THR A 115 -10.073 -4.540 -6.411 1.00 0.00 H new ATOM 0 HB THR A 115 -11.540 -2.184 -7.527 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.874 -1.489 -6.142 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.081 -2.422 -5.604 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.141 -3.824 -6.698 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.263 -3.937 -5.154 1.00 0.00 H new ATOM 1040 N SER A 116 -10.826 -4.685 -9.525 1.00 0.00 N ATOM 1041 CA SER A 116 -11.196 -5.507 -10.672 1.00 0.00 C ATOM 1042 C SER A 116 -10.279 -6.723 -10.801 1.00 0.00 C ATOM 1043 O SER A 116 -10.731 -7.870 -10.791 1.00 0.00 O ATOM 1044 CB SER A 116 -11.031 -4.642 -11.936 1.00 0.00 C ATOM 1045 OG SER A 116 -12.214 -4.619 -12.715 1.00 0.00 O ATOM 0 H SER A 116 -10.276 -3.879 -9.823 1.00 0.00 H new ATOM 0 HA SER A 116 -12.220 -5.858 -10.546 1.00 0.00 H new ATOM 0 HB2 SER A 116 -10.765 -3.625 -11.648 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.208 -5.029 -12.536 1.00 0.00 H new ATOM 0 HG SER A 116 -12.073 -4.060 -13.507 1.00 0.00 H new ATOM 1051 N VAL A 117 -8.980 -6.452 -10.979 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.014 -7.381 -11.570 1.00 0.00 C ATOM 1053 C VAL A 117 -7.535 -8.444 -10.571 1.00 0.00 C ATOM 1054 O VAL A 117 -7.542 -9.638 -10.869 1.00 0.00 O ATOM 1055 CB VAL A 117 -6.847 -6.568 -12.194 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -5.763 -6.113 -11.255 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -6.216 -7.317 -13.362 1.00 0.00 C ATOM 0 H VAL A 117 -8.564 -5.560 -10.710 1.00 0.00 H new ATOM 0 HA VAL A 117 -8.505 -7.946 -12.362 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.338 -5.654 -12.527 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.009 -5.557 -11.812 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.193 -5.471 -10.487 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.301 -6.981 -10.785 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.402 -6.723 -13.778 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.826 -8.273 -13.013 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -6.968 -7.491 -14.131 1.00 0.00 H new ATOM 1067 N THR A 118 -7.150 -7.968 -9.382 1.00 0.00 N ATOM 1068 CA THR A 118 -5.997 -8.368 -8.549 1.00 0.00 C ATOM 1069 C THR A 118 -4.746 -8.795 -9.357 1.00 0.00 C ATOM 1070 O THR A 118 -4.848 -9.640 -10.244 1.00 0.00 O ATOM 1071 CB THR A 118 -6.373 -9.416 -7.492 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.604 -9.098 -6.871 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.332 -9.387 -6.379 1.00 0.00 C ATOM 0 H THR A 118 -7.683 -7.224 -8.932 1.00 0.00 H new ATOM 0 HA THR A 118 -5.709 -7.458 -8.024 1.00 0.00 H new ATOM 0 HB THR A 118 -6.433 -10.382 -7.993 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.820 -9.782 -6.204 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.588 -10.128 -5.622 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.350 -9.616 -6.793 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.312 -8.396 -5.925 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.544 -8.216 -9.129 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.399 -8.459 -10.014 1.00 0.00 C ATOM 1083 C PRO A 119 -1.716 -9.823 -9.833 1.00 0.00 C ATOM 1084 O PRO A 119 -0.900 -10.191 -10.676 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.426 -7.303 -9.766 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.739 -6.834 -8.347 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.188 -7.249 -8.101 1.00 0.00 C ATOM 0 HA PRO A 119 -2.749 -8.497 -11.045 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.390 -7.630 -9.856 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.571 -6.501 -10.490 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.068 -7.296 -7.622 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.617 -5.755 -8.252 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.299 -7.686 -7.108 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -3.848 -6.383 -8.144 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.068 -10.562 -8.768 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.652 -11.930 -8.377 1.00 0.00 C ATOM 1097 C VAL A 120 -0.240 -12.285 -8.846 1.00 0.00 C ATOM 1098 O VAL A 120 0.025 -12.789 -9.938 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.649 -12.995 -8.800 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.391 -14.286 -8.028 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -4.099 -12.573 -8.558 1.00 0.00 C ATOM 0 H VAL A 120 -2.720 -10.180 -8.083 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.634 -11.917 -7.287 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.510 -13.144 -9.871 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.110 -15.045 -8.337 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.380 -14.638 -8.235 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.498 -14.099 -6.960 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.769 -13.371 -8.878 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.249 -12.378 -7.496 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.315 -11.669 -9.127 1.00 0.00 H new ATOM 1111 N LEU A 121 0.680 -11.952 -7.961 1.00 0.00 N ATOM 1112 CA LEU A 121 1.956 -11.343 -8.326 1.00 0.00 C ATOM 1113 C LEU A 121 3.045 -12.410 -8.206 1.00 0.00 C ATOM 1114 O LEU A 121 3.566 -12.892 -9.214 1.00 0.00 O ATOM 1115 CB LEU A 121 2.114 -10.085 -7.442 1.00 0.00 C ATOM 1116 CG LEU A 121 3.356 -9.198 -7.651 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.325 -8.093 -6.592 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.700 -9.929 -7.602 1.00 0.00 C ATOM 0 H LEU A 121 0.567 -12.096 -6.958 1.00 0.00 H new ATOM 0 HA LEU A 121 2.024 -10.998 -9.358 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.232 -9.462 -7.589 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.107 -10.407 -6.401 1.00 0.00 H new ATOM 0 HG LEU A 121 3.295 -8.806 -8.666 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.194 -7.447 -6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.416 -7.503 -6.708 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.343 -8.541 -5.598 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.508 -9.215 -7.760 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.821 -10.404 -6.628 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.729 -10.689 -8.383 1.00 0.00 H new ATOM 1130 N ARG A 122 3.334 -12.830 -6.968 1.00 0.00 N ATOM 1131 CA ARG A 122 4.151 -14.015 -6.669 1.00 0.00 C ATOM 1132 C ARG A 122 3.429 -15.290 -7.115 1.00 0.00 C ATOM 1133 O ARG A 122 4.023 -16.170 -7.735 1.00 0.00 O ATOM 1134 CB ARG A 122 4.488 -14.003 -5.167 1.00 0.00 C ATOM 1135 CG ARG A 122 5.674 -14.908 -4.799 1.00 0.00 C ATOM 1136 CD ARG A 122 5.267 -16.368 -4.554 1.00 0.00 C ATOM 1137 NE ARG A 122 6.445 -17.217 -4.287 1.00 0.00 N ATOM 1138 CZ ARG A 122 6.468 -18.534 -4.163 1.00 0.00 C ATOM 1139 NH1 ARG A 122 5.393 -19.262 -4.248 1.00 0.00 N ATOM 1140 NH2 ARG A 122 7.594 -19.152 -3.942 1.00 0.00 N ATOM 0 H ARG A 122 3.002 -12.349 -6.132 1.00 0.00 H new ATOM 0 HA ARG A 122 5.087 -13.993 -7.226 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.712 -12.981 -4.861 1.00 0.00 H new ATOM 0 HB3 ARG A 122 3.611 -14.320 -4.603 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.412 -14.873 -5.600 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.157 -14.517 -3.904 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.580 -16.419 -3.709 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.731 -16.749 -5.423 1.00 0.00 H new ATOM 0 HE ARG A 122 7.339 -16.736 -4.187 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.489 -18.820 -4.416 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.454 -20.275 -4.147 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.461 -18.620 -3.864 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.608 -20.167 -3.847 1.00 0.00 H new ATOM 1154 N GLY A 123 2.135 -15.357 -6.800 1.00 0.00 N ATOM 1155 CA GLY A 123 1.234 -16.461 -7.147 1.00 0.00 C ATOM 1156 C GLY A 123 -0.041 -16.565 -6.300 1.00 0.00 C ATOM 1157 O GLY A 123 -0.704 -17.604 -6.347 1.00 0.00 O ATOM 0 H GLY A 123 1.666 -14.617 -6.277 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.947 -16.357 -8.193 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.785 -17.398 -7.059 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.387 -15.546 -5.500 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.561 -15.533 -4.634 1.00 0.00 C ATOM 1163 C GLN A 124 -2.151 -14.122 -4.485 1.00 0.00 C ATOM 1164 O GLN A 124 -1.516 -13.180 -4.961 1.00 0.00 O ATOM 1165 CB GLN A 124 -1.190 -16.182 -3.285 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.281 -15.300 -2.407 1.00 0.00 C ATOM 1167 CD GLN A 124 0.041 -15.965 -1.071 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -0.517 -15.634 -0.034 1.00 0.00 O ATOM 1169 NE2 GLN A 124 0.953 -16.913 -1.037 1.00 0.00 N ATOM 0 H GLN A 124 0.161 -14.688 -5.440 1.00 0.00 H new ATOM 0 HA GLN A 124 -2.358 -16.121 -5.089 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -2.104 -16.407 -2.736 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -0.689 -17.132 -3.473 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.646 -15.090 -2.941 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -0.769 -14.342 -2.227 1.00 0.00 H new ATOM 0 HE21 GLN A 124 1.425 -17.198 -1.895 1.00 0.00 H new ATOM 0 HE22 GLN A 124 1.188 -17.363 -0.152 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.360 -13.949 -3.914 1.00 0.00 N ATOM 1179 CA PRO A 125 -4.017 -12.649 -3.823 1.00 0.00 C ATOM 1180 C PRO A 125 -3.173 -11.564 -3.148 1.00 0.00 C ATOM 1181 O PRO A 125 -2.445 -11.824 -2.190 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.320 -12.900 -3.063 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.652 -14.342 -3.438 1.00 0.00 C ATOM 1184 CD PRO A 125 -4.271 -14.993 -3.472 1.00 0.00 C ATOM 0 HA PRO A 125 -4.188 -12.253 -4.824 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.191 -12.780 -1.987 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.107 -12.210 -3.369 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.306 -14.813 -2.704 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -6.156 -14.406 -4.402 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.990 -15.368 -2.488 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -4.254 -15.843 -4.154 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.282 -10.336 -3.656 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.387 -9.213 -3.334 1.00 0.00 C ATOM 1194 C ILE A 126 -3.057 -8.172 -2.433 1.00 0.00 C ATOM 1195 O ILE A 126 -2.448 -7.726 -1.465 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.856 -8.598 -4.653 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.154 -9.613 -5.586 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.927 -7.419 -4.400 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.147 -10.539 -4.925 1.00 0.00 C ATOM 0 H ILE A 126 -4.013 -10.083 -4.321 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.543 -9.590 -2.756 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.752 -8.252 -5.168 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.918 -10.224 -6.067 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.645 -9.059 -6.375 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.579 -7.019 -5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.464 -6.643 -3.855 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.072 -7.750 -3.811 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.281 -11.205 -5.674 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.647 -9.947 -4.470 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.646 -11.130 -4.156 1.00 0.00 H new ATOM 1211 N TYR A 127 -4.315 -7.833 -2.725 1.00 0.00 N ATOM 1212 CA TYR A 127 -5.139 -6.779 -2.112 1.00 0.00 C ATOM 1213 C TYR A 127 -4.587 -5.351 -2.259 1.00 0.00 C ATOM 1214 O TYR A 127 -3.394 -5.072 -2.095 1.00 0.00 O ATOM 1215 CB TYR A 127 -5.380 -7.046 -0.625 1.00 0.00 C ATOM 1216 CG TYR A 127 -5.788 -8.449 -0.245 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -7.076 -8.944 -0.520 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.855 -9.239 0.438 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -7.430 -10.241 -0.105 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.209 -10.523 0.868 1.00 0.00 C ATOM 1221 CZ TYR A 127 -6.495 -11.037 0.599 1.00 0.00 C ATOM 1222 OH TYR A 127 -6.824 -12.285 1.032 1.00 0.00 O ATOM 0 H TYR A 127 -4.829 -8.326 -3.455 1.00 0.00 H new ATOM 0 HA TYR A 127 -6.071 -6.825 -2.675 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -4.467 -6.798 -0.083 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -6.153 -6.361 -0.277 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -7.791 -8.330 -1.048 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -3.863 -8.858 0.633 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -8.414 -10.629 -0.323 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -4.493 -11.124 1.409 1.00 0.00 H new ATOM 0 HH TYR A 127 -6.057 -12.683 1.495 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.513 -4.419 -2.483 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.299 -2.976 -2.498 1.00 0.00 C ATOM 1234 C ILE A 128 -6.436 -2.232 -1.764 1.00 0.00 C ATOM 1235 O ILE A 128 -7.569 -2.715 -1.710 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.114 -2.542 -3.977 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.763 -1.830 -4.096 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.289 -1.705 -4.513 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.385 -1.443 -5.525 1.00 0.00 C ATOM 0 H ILE A 128 -6.485 -4.666 -2.669 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.398 -2.707 -1.947 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.113 -3.426 -4.615 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.783 -0.930 -3.481 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.986 -2.477 -3.689 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.098 -1.433 -5.551 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.208 -2.288 -4.453 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.394 -0.800 -3.915 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.416 -0.944 -5.523 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.330 -2.340 -6.142 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.139 -0.769 -5.931 1.00 0.00 H new ATOM 1251 N GLN A 129 -6.149 -1.027 -1.267 1.00 0.00 N ATOM 1252 CA GLN A 129 -7.119 0.033 -0.927 1.00 0.00 C ATOM 1253 C GLN A 129 -6.445 1.404 -1.080 1.00 0.00 C ATOM 1254 O GLN A 129 -5.221 1.495 -1.038 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.608 -0.119 0.534 1.00 0.00 C ATOM 1256 CG GLN A 129 -9.009 -0.734 0.661 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.311 -1.148 2.099 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.017 -2.258 2.529 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -9.903 -0.289 2.902 1.00 0.00 N ATOM 0 H GLN A 129 -5.187 -0.743 -1.079 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.973 -0.051 -1.599 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.899 -0.740 1.081 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.608 0.861 1.011 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.755 -0.014 0.324 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.087 -1.603 0.007 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.154 0.639 2.560 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.110 -0.551 3.866 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.216 2.489 -1.174 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.688 3.830 -0.900 1.00 0.00 C ATOM 1270 C PHE A 130 -5.986 3.882 0.473 1.00 0.00 C ATOM 1271 O PHE A 130 -6.408 3.235 1.436 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.798 4.882 -0.981 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.085 5.433 -2.363 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.068 6.089 -3.083 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.380 5.358 -2.907 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.339 6.653 -4.340 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.657 5.948 -4.156 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.637 6.593 -4.873 1.00 0.00 C ATOM 0 H PHE A 130 -8.202 2.468 -1.436 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.946 4.058 -1.666 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.716 4.446 -0.587 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.534 5.713 -0.327 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.074 6.159 -2.666 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.163 4.847 -2.366 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.549 7.133 -4.897 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.656 5.904 -4.563 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.850 7.042 -5.832 1.00 0.00 H new ATOM 1288 N SER A 131 -4.900 4.648 0.554 1.00 0.00 N ATOM 1289 CA SER A 131 -4.093 4.806 1.763 1.00 0.00 C ATOM 1290 C SER A 131 -4.856 5.536 2.878 1.00 0.00 C ATOM 1291 O SER A 131 -5.736 6.360 2.614 1.00 0.00 O ATOM 1292 CB SER A 131 -2.803 5.543 1.401 1.00 0.00 C ATOM 1293 OG SER A 131 -2.026 5.886 2.527 1.00 0.00 O ATOM 0 H SER A 131 -4.548 5.188 -0.236 1.00 0.00 H new ATOM 0 HA SER A 131 -3.854 3.818 2.156 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.209 4.917 0.734 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.052 6.450 0.849 1.00 0.00 H new ATOM 0 HG SER A 131 -2.087 5.173 3.196 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.482 5.269 4.134 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.910 6.031 5.310 1.00 0.00 C ATOM 1301 C ASN A 132 -4.393 7.486 5.287 1.00 0.00 C ATOM 1302 O ASN A 132 -4.998 8.371 5.899 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.391 5.328 6.580 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.937 3.924 6.786 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -6.093 3.628 6.530 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -4.126 3.024 7.293 1.00 0.00 N ATOM 0 H ASN A 132 -3.857 4.497 4.366 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.999 6.069 5.303 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.303 5.279 6.535 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.647 5.936 7.448 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.462 2.078 7.473 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -3.160 3.271 7.507 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.275 7.738 4.598 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.630 9.046 4.471 1.00 0.00 C ATOM 1315 C HIS A 133 -3.116 9.787 3.217 1.00 0.00 C ATOM 1316 O HIS A 133 -3.784 9.227 2.341 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.098 8.877 4.437 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.590 7.962 5.527 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.352 8.273 6.851 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.392 6.620 5.381 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.003 7.135 7.482 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.007 6.106 6.623 1.00 0.00 N ATOM 0 H HIS A 133 -2.776 7.005 4.094 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.903 9.647 5.339 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.802 8.479 3.466 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.626 9.854 4.539 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -0.427 9.198 7.275 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.511 6.055 4.468 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.245 7.062 8.531 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.751 11.067 3.123 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.021 11.938 1.976 1.00 0.00 C ATOM 1332 C LYS A 134 -1.705 12.563 1.507 1.00 0.00 C ATOM 1333 O LYS A 134 -1.088 13.334 2.241 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.142 12.952 2.304 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.540 12.297 2.425 1.00 0.00 C ATOM 1336 CD LYS A 134 -5.916 11.776 3.831 1.00 0.00 C ATOM 1337 CE LYS A 134 -6.534 12.856 4.730 1.00 0.00 C ATOM 1338 NZ LYS A 134 -8.009 12.951 4.553 1.00 0.00 N ATOM 0 H LYS A 134 -2.242 11.542 3.868 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.411 11.364 1.135 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.903 13.458 3.239 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.172 13.715 1.527 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -6.290 13.024 2.115 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.593 11.465 1.723 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.620 10.950 3.729 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -5.024 11.377 4.314 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -6.307 12.633 5.773 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -6.079 13.820 4.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.355 13.831 4.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.238 12.952 3.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.467 12.137 5.011 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.264 12.153 0.312 1.00 0.00 N ATOM 1353 CA GLU A 135 0.040 12.423 -0.327 1.00 0.00 C ATOM 1354 C GLU A 135 1.205 11.611 0.279 1.00 0.00 C ATOM 1355 O GLU A 135 1.262 11.385 1.491 1.00 0.00 O ATOM 1356 CB GLU A 135 0.406 13.922 -0.374 1.00 0.00 C ATOM 1357 CG GLU A 135 -0.663 14.816 -1.017 1.00 0.00 C ATOM 1358 CD GLU A 135 -0.212 16.288 -1.014 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -0.472 17.010 -0.020 1.00 0.00 O ATOM 1360 OE2 GLU A 135 0.404 16.748 -2.009 1.00 0.00 O ATOM 0 H GLU A 135 -1.855 11.576 -0.287 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.101 12.084 -1.353 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.590 14.270 0.642 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.339 14.039 -0.925 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -0.850 14.490 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.603 14.717 -0.474 1.00 0.00 H new ATOM 1367 N LEU A 136 2.169 11.229 -0.563 1.00 0.00 N ATOM 1368 CA LEU A 136 3.384 10.476 -0.226 1.00 0.00 C ATOM 1369 C LEU A 136 4.642 11.341 -0.425 1.00 0.00 C ATOM 1370 O LEU A 136 5.024 11.668 -1.553 1.00 0.00 O ATOM 1371 CB LEU A 136 3.412 9.185 -1.064 1.00 0.00 C ATOM 1372 CG LEU A 136 4.725 8.384 -1.035 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.142 8.025 0.385 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.573 7.079 -1.809 1.00 0.00 C ATOM 0 H LEU A 136 2.121 11.449 -1.558 1.00 0.00 H new ATOM 0 HA LEU A 136 3.375 10.201 0.829 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.607 8.536 -0.720 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.192 9.444 -2.100 1.00 0.00 H new ATOM 0 HG LEU A 136 5.484 9.022 -1.488 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.074 7.460 0.359 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.287 8.937 0.963 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.364 7.420 0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.512 6.526 -1.778 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.783 6.479 -1.358 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.316 7.298 -2.845 1.00 0.00 H new ATOM 1386 N LYS A 137 5.295 11.681 0.688 1.00 0.00 N ATOM 1387 CA LYS A 137 6.491 12.525 0.813 1.00 0.00 C ATOM 1388 C LYS A 137 7.671 11.710 1.363 1.00 0.00 C ATOM 1389 O LYS A 137 7.952 11.693 2.562 1.00 0.00 O ATOM 1390 CB LYS A 137 6.174 13.818 1.605 1.00 0.00 C ATOM 1391 CG LYS A 137 5.379 13.652 2.918 1.00 0.00 C ATOM 1392 CD LYS A 137 3.851 13.686 2.722 1.00 0.00 C ATOM 1393 CE LYS A 137 3.130 13.192 3.983 1.00 0.00 C ATOM 1394 NZ LYS A 137 1.665 13.062 3.760 1.00 0.00 N ATOM 0 H LYS A 137 4.978 11.348 1.599 1.00 0.00 H new ATOM 0 HA LYS A 137 6.806 12.865 -0.173 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.117 14.313 1.839 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.615 14.488 0.952 1.00 0.00 H new ATOM 0 HG2 LYS A 137 5.656 12.706 3.384 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.666 14.444 3.609 1.00 0.00 H new ATOM 0 HD2 LYS A 137 3.532 14.702 2.489 1.00 0.00 H new ATOM 0 HD3 LYS A 137 3.575 13.063 1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 137 3.540 12.228 4.283 1.00 0.00 H new ATOM 0 HE3 LYS A 137 3.314 13.886 4.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 1.221 12.646 4.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 1.256 14.001 3.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 1.492 12.447 2.939 1.00 0.00 H new ATOM 1408 N THR A 138 8.360 11.000 0.471 1.00 0.00 N ATOM 1409 CA THR A 138 9.551 10.171 0.762 1.00 0.00 C ATOM 1410 C THR A 138 10.808 10.983 1.124 1.00 0.00 C ATOM 1411 O THR A 138 11.758 10.430 1.681 1.00 0.00 O ATOM 1412 CB THR A 138 9.857 9.233 -0.421 1.00 0.00 C ATOM 1413 OG1 THR A 138 9.807 9.931 -1.653 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.817 8.116 -0.517 1.00 0.00 C ATOM 0 H THR A 138 8.102 10.979 -0.516 1.00 0.00 H new ATOM 0 HA THR A 138 9.296 9.590 1.648 1.00 0.00 H new ATOM 0 HB THR A 138 10.853 8.829 -0.242 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.301 9.428 -2.334 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.056 7.468 -1.360 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.824 7.532 0.403 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.828 8.551 -0.663 1.00 0.00 H new ATOM 1422 N ASP A 139 10.818 12.298 0.875 1.00 0.00 N ATOM 1423 CA ASP A 139 11.896 13.233 1.248 1.00 0.00 C ATOM 1424 C ASP A 139 12.026 13.482 2.770 1.00 0.00 C ATOM 1425 O ASP A 139 13.009 14.066 3.223 1.00 0.00 O ATOM 1426 CB ASP A 139 11.660 14.557 0.501 1.00 0.00 C ATOM 1427 CG ASP A 139 12.862 15.520 0.583 1.00 0.00 C ATOM 1428 OD1 ASP A 139 13.961 15.162 0.089 1.00 0.00 O ATOM 1429 OD2 ASP A 139 12.698 16.657 1.086 1.00 0.00 O ATOM 0 H ASP A 139 10.049 12.761 0.391 1.00 0.00 H new ATOM 0 HA ASP A 139 12.842 12.775 0.959 1.00 0.00 H new ATOM 0 HB2 ASP A 139 11.444 14.343 -0.546 1.00 0.00 H new ATOM 0 HB3 ASP A 139 10.779 15.049 0.914 1.00 0.00 H new ATOM 1434 N SER A 140 11.056 13.020 3.572 1.00 0.00 N ATOM 1435 CA SER A 140 11.003 13.153 5.044 1.00 0.00 C ATOM 1436 C SER A 140 11.100 14.601 5.559 1.00 0.00 C ATOM 1437 O SER A 140 11.752 14.883 6.569 1.00 0.00 O ATOM 1438 CB SER A 140 12.049 12.243 5.714 1.00 0.00 C ATOM 1439 OG SER A 140 11.903 10.886 5.323 1.00 0.00 O ATOM 0 H SER A 140 10.248 12.520 3.200 1.00 0.00 H new ATOM 0 HA SER A 140 10.006 12.821 5.333 1.00 0.00 H new ATOM 0 HB2 SER A 140 13.050 12.589 5.455 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.956 12.320 6.797 1.00 0.00 H new ATOM 0 HG SER A 140 12.742 10.567 4.930 1.00 0.00 H new ATOM 1445 N SER A 141 10.435 15.532 4.871 1.00 0.00 N ATOM 1446 CA SER A 141 10.304 16.936 5.293 1.00 0.00 C ATOM 1447 C SER A 141 9.553 17.079 6.638 1.00 0.00 C ATOM 1448 O SER A 141 8.674 16.263 6.943 1.00 0.00 O ATOM 1449 CB SER A 141 9.612 17.755 4.193 1.00 0.00 C ATOM 1450 OG SER A 141 8.358 17.187 3.838 1.00 0.00 O ATOM 0 H SER A 141 9.963 15.332 3.989 1.00 0.00 H new ATOM 0 HA SER A 141 11.310 17.326 5.451 1.00 0.00 H new ATOM 0 HB2 SER A 141 9.466 18.779 4.537 1.00 0.00 H new ATOM 0 HB3 SER A 141 10.254 17.803 3.314 1.00 0.00 H new ATOM 0 HG SER A 141 7.940 17.730 3.137 1.00 0.00 H new ATOM 1456 N PRO A 142 9.874 18.092 7.471 1.00 0.00 N ATOM 1457 CA PRO A 142 9.308 18.231 8.819 1.00 0.00 C ATOM 1458 C PRO A 142 7.883 18.810 8.845 1.00 0.00 C ATOM 1459 O PRO A 142 7.133 18.564 9.792 1.00 0.00 O ATOM 1460 CB PRO A 142 10.284 19.156 9.556 1.00 0.00 C ATOM 1461 CG PRO A 142 10.844 20.046 8.448 1.00 0.00 C ATOM 1462 CD PRO A 142 10.912 19.095 7.253 1.00 0.00 C ATOM 0 HA PRO A 142 9.202 17.251 9.284 1.00 0.00 H new ATOM 0 HB2 PRO A 142 9.778 19.742 10.324 1.00 0.00 H new ATOM 0 HB3 PRO A 142 11.073 18.592 10.054 1.00 0.00 H new ATOM 0 HG2 PRO A 142 10.197 20.900 8.249 1.00 0.00 H new ATOM 0 HG3 PRO A 142 11.826 20.443 8.705 1.00 0.00 H new ATOM 0 HD2 PRO A 142 10.745 19.631 6.319 1.00 0.00 H new ATOM 0 HD3 PRO A 142 11.895 18.629 7.182 1.00 0.00 H new ATOM 1470 N ASN A 143 7.507 19.586 7.823 1.00 0.00 N ATOM 1471 CA ASN A 143 6.210 20.258 7.699 1.00 0.00 C ATOM 1472 C ASN A 143 5.839 20.523 6.226 1.00 0.00 C ATOM 1473 O ASN A 143 4.767 20.120 5.772 1.00 0.00 O ATOM 1474 CB ASN A 143 6.265 21.570 8.510 1.00 0.00 C ATOM 1475 CG ASN A 143 4.977 22.373 8.399 1.00 0.00 C ATOM 1476 OD1 ASN A 143 4.883 23.327 7.640 1.00 0.00 O ATOM 1477 ND2 ASN A 143 3.951 22.013 9.136 1.00 0.00 N ATOM 0 H ASN A 143 8.121 19.770 7.030 1.00 0.00 H new ATOM 0 HA ASN A 143 5.428 19.610 8.096 1.00 0.00 H new ATOM 0 HB2 ASN A 143 6.457 21.339 9.558 1.00 0.00 H new ATOM 0 HB3 ASN A 143 7.100 22.177 8.159 1.00 0.00 H new ATOM 0 HD21 ASN A 143 3.074 22.530 9.076 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.032 21.217 9.768 1.00 0.00 H new ATOM 1484 N GLN A 144 6.727 21.203 5.492 1.00 0.00 N ATOM 1485 CA GLN A 144 6.539 21.627 4.098 1.00 0.00 C ATOM 1486 C GLN A 144 7.858 21.596 3.300 1.00 0.00 C ATOM 1487 O GLN A 144 8.933 21.337 3.849 1.00 0.00 O ATOM 1488 CB GLN A 144 5.861 23.016 4.087 1.00 0.00 C ATOM 1489 CG GLN A 144 6.710 24.137 4.712 1.00 0.00 C ATOM 1490 CD GLN A 144 5.929 25.443 4.839 1.00 0.00 C ATOM 1491 OE1 GLN A 144 6.050 26.356 4.030 1.00 0.00 O ATOM 1492 NE2 GLN A 144 5.100 25.587 5.851 1.00 0.00 N ATOM 0 H GLN A 144 7.633 21.485 5.867 1.00 0.00 H new ATOM 0 HA GLN A 144 5.885 20.919 3.589 1.00 0.00 H new ATOM 0 HB2 GLN A 144 5.626 23.285 3.057 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.914 22.950 4.624 1.00 0.00 H new ATOM 0 HG2 GLN A 144 7.055 23.824 5.697 1.00 0.00 H new ATOM 0 HG3 GLN A 144 7.597 24.303 4.101 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.990 24.835 6.531 1.00 0.00 H new ATOM 0 HE22 GLN A 144 4.567 26.451 5.955 1.00 0.00 H new ATOM 1501 N ALA A 145 7.775 21.866 1.991 1.00 0.00 N ATOM 1502 CA ALA A 145 8.883 21.775 1.032 1.00 0.00 C ATOM 1503 C ALA A 145 10.075 22.719 1.319 1.00 0.00 C ATOM 1504 O ALA A 145 11.207 22.394 0.952 1.00 0.00 O ATOM 1505 CB ALA A 145 8.317 22.025 -0.370 1.00 0.00 C ATOM 0 H ALA A 145 6.903 22.165 1.555 1.00 0.00 H new ATOM 0 HA ALA A 145 9.307 20.775 1.123 1.00 0.00 H new ATOM 0 HB1 ALA A 145 9.121 21.963 -1.103 1.00 0.00 H new ATOM 0 HB2 ALA A 145 7.561 21.273 -0.596 1.00 0.00 H new ATOM 0 HB3 ALA A 145 7.866 23.017 -0.409 1.00 0.00 H new ATOM 1511 N ARG A 146 9.844 23.843 2.015 1.00 0.00 N ATOM 1512 CA ARG A 146 10.866 24.778 2.521 1.00 0.00 C ATOM 1513 C ARG A 146 11.041 24.607 4.036 1.00 0.00 C ATOM 1514 O ARG A 146 10.093 24.809 4.798 1.00 0.00 O ATOM 1515 CB ARG A 146 10.480 26.219 2.137 1.00 0.00 C ATOM 1516 CG ARG A 146 11.588 27.220 2.502 1.00 0.00 C ATOM 1517 CD ARG A 146 11.210 28.646 2.086 1.00 0.00 C ATOM 1518 NE ARG A 146 12.268 29.607 2.460 1.00 0.00 N ATOM 1519 CZ ARG A 146 12.237 30.923 2.329 1.00 0.00 C ATOM 1520 NH1 ARG A 146 11.211 31.541 1.815 1.00 0.00 N ATOM 1521 NH2 ARG A 146 13.248 31.648 2.714 1.00 0.00 N ATOM 1522 OXT ARG A 146 12.135 24.267 4.481 1.00 99.99 O ATOM 0 H ARG A 146 8.897 24.140 2.252 1.00 0.00 H new ATOM 0 HA ARG A 146 11.830 24.557 2.062 1.00 0.00 H new ATOM 0 HB2 ARG A 146 10.282 26.270 1.066 1.00 0.00 H new ATOM 0 HB3 ARG A 146 9.557 26.496 2.646 1.00 0.00 H new ATOM 0 HG2 ARG A 146 11.770 27.189 3.576 1.00 0.00 H new ATOM 0 HG3 ARG A 146 12.518 26.931 2.013 1.00 0.00 H new ATOM 0 HD2 ARG A 146 11.045 28.682 1.009 1.00 0.00 H new ATOM 0 HD3 ARG A 146 10.271 28.930 2.562 1.00 0.00 H new ATOM 0 HE ARG A 146 13.117 29.212 2.864 1.00 0.00 H new ATOM 0 HH11 ARG A 146 10.400 31.008 1.500 1.00 0.00 H new ATOM 0 HH12 ARG A 146 11.219 32.557 1.728 1.00 0.00 H new ATOM 0 HH21 ARG A 146 14.071 31.202 3.120 1.00 0.00 H new ATOM 0 HH22 ARG A 146 13.217 32.662 2.610 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -5.712 -8.644 4.032 1.00 0.00 O ATOM 1538 C5' C B 147 -4.548 -9.447 3.946 1.00 0.00 C ATOM 1539 C4' C B 147 -3.722 -9.357 5.236 1.00 0.00 C ATOM 1540 O4' C B 147 -4.363 -10.116 6.260 1.00 0.00 O ATOM 1541 C3' C B 147 -2.320 -9.952 5.046 1.00 0.00 C ATOM 1542 O3' C B 147 -1.410 -9.374 5.971 1.00 0.00 O ATOM 1543 C2' C B 147 -2.578 -11.426 5.373 1.00 0.00 C ATOM 1544 O2' C B 147 -1.410 -12.127 5.780 1.00 0.00 O ATOM 1545 C1' C B 147 -3.638 -11.323 6.478 1.00 0.00 C ATOM 1546 N1 C B 147 -4.568 -12.496 6.531 1.00 0.00 N ATOM 1547 C2 C B 147 -4.778 -13.139 7.759 1.00 0.00 C ATOM 1548 O2 C B 147 -4.253 -12.743 8.804 1.00 0.00 O ATOM 1549 N3 C B 147 -5.577 -14.237 7.838 1.00 0.00 N ATOM 1550 C4 C B 147 -6.148 -14.681 6.737 1.00 0.00 C ATOM 1551 N4 C B 147 -6.898 -15.740 6.877 1.00 0.00 N ATOM 1552 C5 C B 147 -5.985 -14.067 5.464 1.00 0.00 C ATOM 1553 C6 C B 147 -5.189 -12.971 5.400 1.00 0.00 C ATOM 0 H5' C B 147 -3.942 -9.126 3.099 1.00 0.00 H new ATOM 0 H5'' C B 147 -4.830 -10.484 3.762 1.00 0.00 H new ATOM 0 H4' C B 147 -3.642 -8.303 5.502 1.00 0.00 H new ATOM 0 H3' C B 147 -1.881 -9.785 4.062 1.00 0.00 H new ATOM 0 H2' C B 147 -2.903 -12.009 4.511 1.00 0.00 H new ATOM 0 HO2' C B 147 -0.778 -11.500 6.189 1.00 0.00 H new ATOM 0 HO5' C B 147 -5.670 -8.093 4.842 1.00 0.00 H new ATOM 0 H1' C B 147 -3.132 -11.319 7.443 1.00 0.00 H new ATOM 0 H41 C B 147 -7.372 -16.140 6.067 1.00 0.00 H new ATOM 0 H42 C B 147 -7.010 -16.168 7.796 1.00 0.00 H new ATOM 0 H5 C B 147 -6.475 -14.458 4.585 1.00 0.00 H new ATOM 0 H6 C B 147 -5.042 -12.468 4.455 1.00 0.00 H new ATOM 1566 P U B 148 -0.272 -8.334 5.510 1.00 0.00 P ATOM 1567 OP1 U B 148 0.214 -8.721 4.167 1.00 0.00 O ATOM 1568 OP2 U B 148 0.697 -8.263 6.627 1.00 0.00 O ATOM 1569 O5' U B 148 -1.021 -6.909 5.367 1.00 0.00 O ATOM 1570 C5' U B 148 -1.389 -6.160 6.513 1.00 0.00 C ATOM 1571 C4' U B 148 -1.624 -4.673 6.219 1.00 0.00 C ATOM 1572 O4' U B 148 -2.868 -4.431 5.582 1.00 0.00 O ATOM 1573 C3' U B 148 -1.628 -3.916 7.554 1.00 0.00 C ATOM 1574 O3' U B 148 -1.056 -2.621 7.403 1.00 0.00 O ATOM 1575 C2' U B 148 -3.116 -3.906 7.898 1.00 0.00 C ATOM 1576 O2' U B 148 -3.509 -2.855 8.776 1.00 0.00 O ATOM 1577 C1' U B 148 -3.732 -3.786 6.507 1.00 0.00 C ATOM 1578 N1 U B 148 -5.079 -4.404 6.463 1.00 0.00 N ATOM 1579 C2 U B 148 -6.208 -3.586 6.382 1.00 0.00 C ATOM 1580 O2 U B 148 -6.155 -2.365 6.215 1.00 0.00 O ATOM 1581 N3 U B 148 -7.437 -4.211 6.459 1.00 0.00 N ATOM 1582 C4 U B 148 -7.640 -5.572 6.561 1.00 0.00 C ATOM 1583 O4 U B 148 -8.782 -6.017 6.612 1.00 0.00 O ATOM 1584 C5 U B 148 -6.427 -6.360 6.588 1.00 0.00 C ATOM 1585 C6 U B 148 -5.201 -5.772 6.539 1.00 0.00 C ATOM 0 H5' U B 148 -0.607 -6.255 7.266 1.00 0.00 H new ATOM 0 H5'' U B 148 -2.297 -6.586 6.940 1.00 0.00 H new ATOM 0 H4' U B 148 -0.831 -4.339 5.550 1.00 0.00 H new ATOM 0 H3' U B 148 -1.027 -4.362 8.346 1.00 0.00 H new ATOM 0 H2' U B 148 -3.435 -4.783 8.462 1.00 0.00 H new ATOM 0 HO2' U B 148 -2.734 -2.556 9.296 1.00 0.00 H new ATOM 0 H1' U B 148 -3.847 -2.733 6.251 1.00 0.00 H new ATOM 0 H3 U B 148 -8.265 -3.616 6.439 1.00 0.00 H new ATOM 0 H5 U B 148 -6.496 -7.436 6.648 1.00 0.00 H new ATOM 0 H6 U B 148 -4.313 -6.387 6.560 1.00 0.00 H new ATOM 1596 P C B 149 -0.233 -1.981 8.612 1.00 0.00 P ATOM 1597 OP1 C B 149 1.065 -2.695 8.656 1.00 0.00 O ATOM 1598 OP2 C B 149 -1.109 -1.985 9.801 1.00 0.00 O ATOM 1599 O5' C B 149 0.045 -0.463 8.186 1.00 0.00 O ATOM 1600 C5' C B 149 1.341 -0.036 7.799 1.00 0.00 C ATOM 1601 C4' C B 149 1.398 1.432 7.347 1.00 0.00 C ATOM 1602 O4' C B 149 0.835 1.549 6.051 1.00 0.00 O ATOM 1603 C3' C B 149 0.668 2.404 8.293 1.00 0.00 C ATOM 1604 O3' C B 149 1.310 3.671 8.404 1.00 0.00 O ATOM 1605 C2' C B 149 -0.665 2.586 7.575 1.00 0.00 C ATOM 1606 O2' C B 149 -1.356 3.794 7.858 1.00 0.00 O ATOM 1607 C1' C B 149 -0.262 2.445 6.112 1.00 0.00 C ATOM 1608 N1 C B 149 -1.427 1.915 5.366 1.00 0.00 N ATOM 1609 C2 C B 149 -2.183 2.770 4.563 1.00 0.00 C ATOM 1610 O2 C B 149 -1.849 3.934 4.358 1.00 0.00 O ATOM 1611 N3 C B 149 -3.318 2.343 3.971 1.00 0.00 N ATOM 1612 C4 C B 149 -3.671 1.088 4.129 1.00 0.00 C ATOM 1613 N4 C B 149 -4.772 0.739 3.524 1.00 0.00 N ATOM 1614 C5 C B 149 -2.923 0.158 4.896 1.00 0.00 C ATOM 1615 C6 C B 149 -1.818 0.613 5.532 1.00 0.00 C ATOM 0 H5' C B 149 1.696 -0.671 6.987 1.00 0.00 H new ATOM 0 H5'' C B 149 2.025 -0.176 8.636 1.00 0.00 H new ATOM 0 H4' C B 149 2.451 1.712 7.354 1.00 0.00 H new ATOM 0 H3' C B 149 0.617 2.022 9.312 1.00 0.00 H new ATOM 0 H2' C B 149 -1.407 1.859 7.905 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.887 4.545 7.438 1.00 0.00 H new ATOM 0 H1' C B 149 0.032 3.398 5.673 1.00 0.00 H new ATOM 0 H41 C B 149 -5.113 -0.219 3.598 1.00 0.00 H new ATOM 0 H42 C B 149 -5.292 1.424 2.976 1.00 0.00 H new ATOM 0 H5 C B 149 -3.224 -0.876 4.970 1.00 0.00 H new ATOM 0 H6 C B 149 -1.247 -0.048 6.168 1.00 0.00 H new ATOM 1627 P U B 150 2.618 3.881 9.295 1.00 0.00 P ATOM 1628 OP1 U B 150 2.582 2.926 10.430 1.00 0.00 O ATOM 1629 OP2 U B 150 2.743 5.333 9.579 1.00 0.00 O ATOM 1630 O5' U B 150 3.806 3.441 8.307 1.00 0.00 O ATOM 1631 C5' U B 150 3.960 4.054 7.039 1.00 0.00 C ATOM 1632 C4' U B 150 5.450 4.146 6.688 1.00 0.00 C ATOM 1633 O4' U B 150 5.600 4.530 5.328 1.00 0.00 O ATOM 1634 C3' U B 150 6.140 5.228 7.521 1.00 0.00 C ATOM 1635 O3' U B 150 6.646 4.772 8.771 1.00 0.00 O ATOM 1636 C2' U B 150 7.225 5.735 6.563 1.00 0.00 C ATOM 1637 O2' U B 150 8.449 5.006 6.657 1.00 0.00 O ATOM 1638 C1' U B 150 6.620 5.515 5.178 1.00 0.00 C ATOM 1639 N1 U B 150 6.098 6.817 4.652 1.00 0.00 N ATOM 1640 C2 U B 150 6.989 7.753 4.109 1.00 0.00 C ATOM 1641 O2 U B 150 8.206 7.572 4.027 1.00 0.00 O ATOM 1642 N3 U B 150 6.451 8.938 3.639 1.00 0.00 N ATOM 1643 C4 U B 150 5.109 9.245 3.602 1.00 0.00 C ATOM 1644 O4 U B 150 4.727 10.308 3.127 1.00 0.00 O ATOM 1645 C5 U B 150 4.244 8.222 4.140 1.00 0.00 C ATOM 1646 C6 U B 150 4.750 7.077 4.665 1.00 0.00 C ATOM 0 H5' U B 150 3.517 5.050 7.049 1.00 0.00 H new ATOM 0 H5'' U B 150 3.432 3.478 6.279 1.00 0.00 H new ATOM 0 H4' U B 150 5.892 3.169 6.884 1.00 0.00 H new ATOM 0 H3' U B 150 5.454 6.010 7.847 1.00 0.00 H new ATOM 0 H2' U B 150 7.484 6.769 6.790 1.00 0.00 H new ATOM 0 HO2' U B 150 8.527 4.611 7.550 1.00 0.00 H new ATOM 0 H1' U B 150 7.353 5.161 4.453 1.00 0.00 H new ATOM 0 H3 U B 150 7.102 9.642 3.291 1.00 0.00 H new ATOM 0 H5 U B 150 3.174 8.370 4.124 1.00 0.00 H new ATOM 0 H6 U B 150 4.077 6.354 5.103 1.00 0.00 H new ATOM 1657 P C B 151 7.182 5.805 9.877 1.00 0.00 P ATOM 1658 OP1 C B 151 6.641 5.388 11.192 1.00 0.00 O ATOM 1659 OP2 C B 151 6.951 7.194 9.417 1.00 0.00 O ATOM 1660 O5' C B 151 8.774 5.550 9.856 1.00 0.00 O ATOM 1661 C5' C B 151 9.386 4.479 10.566 1.00 0.00 C ATOM 1662 C4' C B 151 10.321 4.954 11.698 1.00 0.00 C ATOM 1663 O4' C B 151 11.472 5.579 11.134 1.00 0.00 O ATOM 1664 C3' C B 151 9.689 5.951 12.692 1.00 0.00 C ATOM 1665 O3' C B 151 10.285 5.793 13.979 1.00 0.00 O ATOM 1666 C2' C B 151 10.120 7.288 12.077 1.00 0.00 C ATOM 1667 O2' C B 151 10.113 8.378 12.994 1.00 0.00 O ATOM 1668 C1' C B 151 11.526 6.927 11.590 1.00 0.00 C ATOM 1669 N1 C B 151 12.026 7.819 10.509 1.00 0.00 N ATOM 1670 C2 C B 151 13.233 8.509 10.700 1.00 0.00 C ATOM 1671 O2 C B 151 13.881 8.421 11.748 1.00 0.00 O ATOM 1672 N3 C B 151 13.733 9.306 9.718 1.00 0.00 N ATOM 1673 C4 C B 151 13.057 9.416 8.594 1.00 0.00 C ATOM 1674 N4 C B 151 13.588 10.180 7.680 1.00 0.00 N ATOM 1675 C5 C B 151 11.828 8.751 8.342 1.00 0.00 C ATOM 1676 C6 C B 151 11.340 7.956 9.325 1.00 0.00 C ATOM 0 H5' C B 151 9.955 3.867 9.867 1.00 0.00 H new ATOM 0 H5'' C B 151 8.609 3.842 10.989 1.00 0.00 H new ATOM 0 H4' C B 151 10.563 4.053 12.261 1.00 0.00 H new ATOM 0 H3' C B 151 8.614 5.839 12.831 1.00 0.00 H new ATOM 0 H2' C B 151 9.446 7.653 11.302 1.00 0.00 H new ATOM 0 HO2' C B 151 10.205 8.037 13.908 1.00 0.00 H new ATOM 0 H1' C B 151 12.228 7.053 12.414 1.00 0.00 H new ATOM 0 H41 C B 151 13.116 10.309 6.785 1.00 0.00 H new ATOM 0 H42 C B 151 14.476 10.649 7.860 1.00 0.00 H new ATOM 0 H5 C B 151 11.304 8.874 7.406 1.00 0.00 H new ATOM 0 H6 C B 151 10.409 7.428 9.178 1.00 0.00 H new ATOM 1688 P U B 152 9.417 5.557 15.312 1.00 0.00 P ATOM 1689 OP1 U B 152 7.977 5.806 15.053 1.00 0.00 O ATOM 1690 OP2 U B 152 10.080 6.309 16.405 1.00 0.00 O ATOM 1691 O5' U B 152 9.614 3.992 15.619 1.00 0.00 O ATOM 1692 C5' U B 152 9.066 2.985 14.785 1.00 0.00 C ATOM 1693 C4' U B 152 9.539 1.594 15.234 1.00 0.00 C ATOM 1694 O4' U B 152 9.154 0.636 14.246 1.00 0.00 O ATOM 1695 C3' U B 152 11.071 1.493 15.380 1.00 0.00 C ATOM 1696 O3' U B 152 11.400 0.510 16.369 1.00 0.00 O ATOM 1697 C2' U B 152 11.456 1.036 13.969 1.00 0.00 C ATOM 1698 O2' U B 152 12.768 0.473 13.880 1.00 0.00 O ATOM 1699 C1' U B 152 10.322 0.050 13.681 1.00 0.00 C ATOM 1700 N1 U B 152 10.186 -0.228 12.223 1.00 0.00 N ATOM 1701 C2 U B 152 10.740 -1.412 11.719 1.00 0.00 C ATOM 1702 O2 U B 152 11.278 -2.274 12.417 1.00 0.00 O ATOM 1703 N3 U B 152 10.650 -1.617 10.358 1.00 0.00 N ATOM 1704 C4 U B 152 10.065 -0.762 9.453 1.00 0.00 C ATOM 1705 O4 U B 152 10.044 -1.054 8.261 1.00 0.00 O ATOM 1706 C5 U B 152 9.508 0.439 10.042 1.00 0.00 C ATOM 1707 C6 U B 152 9.570 0.673 11.380 1.00 0.00 C ATOM 0 H5' U B 152 9.364 3.160 13.751 1.00 0.00 H new ATOM 0 H5'' U B 152 7.977 3.032 14.816 1.00 0.00 H new ATOM 0 H4' U B 152 9.084 1.408 16.207 1.00 0.00 H new ATOM 0 H3' U B 152 11.578 2.403 15.702 1.00 0.00 H new ATOM 0 H2' U B 152 11.538 1.841 13.239 1.00 0.00 H new ATOM 0 HO2' U B 152 12.946 0.202 12.955 1.00 0.00 H new ATOM 0 HO3' U B 152 12.089 -0.091 16.016 1.00 0.00 H new ATOM 0 H1' U B 152 10.514 -0.928 14.123 1.00 0.00 H new ATOM 0 H3 U B 152 11.053 -2.479 9.990 1.00 0.00 H new ATOM 0 H5 U B 152 9.031 1.167 9.402 1.00 0.00 H new ATOM 0 H6 U B 152 9.133 1.573 11.786 1.00 0.00 H new TER 1719 U B 152