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 132 ASN : amide:sc= 0.695 K(o=3.1,f=1.5) USER MOD Set 1.2: A 133 HIS : no HE2:sc= 0.634 K(o=3.1,f=0.95) USER MOD Set 1.3: B 149 C O2' : rot 74:sc= 1.78 USER MOD Set 2.1: A 87 ASN : amide:sc= 0.51 K(o=1,f=0.49) USER MOD Set 2.2: A 138 THR OG1 : rot 160:sc= 0.495 USER MOD Set 3.1: A 65 LYS NZ :NH3+ 162:sc= 1.74 (180deg=1.17) USER MOD Set 3.2: B 147 C O2' : rot 20:sc= 0.749 USER MOD Set 4.1: A 62 HIS : no HE2:sc= -2.02 K(o=-2.2,f=-3.8) USER MOD Set 4.2: A 96 GLN : amide:sc= -0.173 K(o=-2.2,f=-5.1) USER MOD Single : A 51 SER OG : rot -158:sc= 0.00115 USER MOD Single : A 53 SER OG : rot 180:sc= 0.145 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 87:sc= 1.14 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.0104 USER MOD Single : A 90 MET CE :methyl 169:sc= -0.0538 (180deg=-0.182) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 157:sc= 1.24 (180deg=1.23) USER MOD Single : A 95 ASN : amide:sc= 0.796 K(o=0.8,f=0) USER MOD Single : A 101 MET CE :methyl 171:sc= -3.97! (180deg=-4.61!) USER MOD Single : A 102 ASN :FLIP amide:sc= -5.13! C(o=-6.1!,f=-5.1!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.211 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -174:sc= -1.77 (180deg=-1.83) USER MOD Single : A 112 ASN : amide:sc= 0.283 X(o=0.28,f=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 125:sc= -0.0649 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 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 124 GLN : amide:sc= -0.636 K(o=-0.64,f=-2.1) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.47 K(o=0.47,f=-0.044) USER MOD Single : A 131 SER OG : rot 61:sc= 1.3 USER MOD Single : A 134 LYS NZ :NH3+ -139:sc= 0.988 (180deg=-0.385) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0.00814 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 147 C O5' : rot 24:sc= 0.722 USER MOD Single : B 148 U O2' : rot -24:sc= 1.2 USER MOD Single : B 150 U O2' : rot -14:sc= 0.0636 USER MOD Single : B 151 C O2' : rot 20:sc= 0.062 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 133:sc= 0.0483 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -10.302 -0.680 13.488 1.00 0.00 N ATOM 2 CA GLY A 49 -10.304 0.109 12.237 1.00 0.00 C ATOM 3 C GLY A 49 -11.716 0.361 11.725 1.00 0.00 C ATOM 4 O GLY A 49 -12.681 -0.229 12.209 1.00 0.00 O ATOM 0 HA2 GLY A 49 -9.805 1.063 12.409 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -9.730 -0.418 11.475 1.00 0.00 H new ATOM 8 N ASP A 50 -11.846 1.241 10.729 1.00 0.00 N ATOM 9 CA ASP A 50 -13.120 1.635 10.096 1.00 0.00 C ATOM 10 C ASP A 50 -12.999 1.622 8.556 1.00 0.00 C ATOM 11 O ASP A 50 -13.243 2.617 7.872 1.00 0.00 O ATOM 12 CB ASP A 50 -13.577 2.986 10.677 1.00 0.00 C ATOM 13 CG ASP A 50 -15.006 3.370 10.250 1.00 0.00 C ATOM 14 OD1 ASP A 50 -15.909 2.499 10.304 1.00 0.00 O ATOM 15 OD2 ASP A 50 -15.244 4.554 9.905 1.00 0.00 O ATOM 0 H ASP A 50 -11.042 1.719 10.322 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.899 0.908 10.326 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.528 2.943 11.765 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.886 3.766 10.357 1.00 0.00 H new ATOM 20 N SER A 51 -12.576 0.478 8.008 1.00 0.00 N ATOM 21 CA SER A 51 -12.147 0.267 6.612 1.00 0.00 C ATOM 22 C SER A 51 -13.201 0.537 5.523 1.00 0.00 C ATOM 23 O SER A 51 -12.858 0.554 4.338 1.00 0.00 O ATOM 24 CB SER A 51 -11.623 -1.168 6.451 1.00 0.00 C ATOM 25 OG SER A 51 -10.624 -1.451 7.424 1.00 0.00 O ATOM 0 H SER A 51 -12.519 -0.380 8.556 1.00 0.00 H new ATOM 0 HA SER A 51 -11.374 1.018 6.449 1.00 0.00 H new ATOM 0 HB2 SER A 51 -12.447 -1.875 6.552 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.211 -1.300 5.451 1.00 0.00 H new ATOM 0 HG SER A 51 -10.071 -2.199 7.117 1.00 0.00 H new ATOM 31 N ARG A 52 -14.466 0.789 5.895 1.00 0.00 N ATOM 32 CA ARG A 52 -15.577 1.207 5.010 1.00 0.00 C ATOM 33 C ARG A 52 -15.327 2.516 4.240 1.00 0.00 C ATOM 34 O ARG A 52 -15.996 2.766 3.235 1.00 0.00 O ATOM 35 CB ARG A 52 -16.887 1.274 5.820 1.00 0.00 C ATOM 36 CG ARG A 52 -16.917 2.399 6.874 1.00 0.00 C ATOM 37 CD ARG A 52 -18.162 2.319 7.774 1.00 0.00 C ATOM 38 NE ARG A 52 -19.412 2.603 7.038 1.00 0.00 N ATOM 39 CZ ARG A 52 -20.014 3.769 6.891 1.00 0.00 C ATOM 40 NH1 ARG A 52 -19.529 4.874 7.387 1.00 0.00 N ATOM 41 NH2 ARG A 52 -21.134 3.852 6.229 1.00 0.00 N ATOM 0 H ARG A 52 -14.761 0.704 6.868 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.656 0.445 4.234 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -17.721 1.413 5.132 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -17.042 0.318 6.320 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -16.020 2.340 7.491 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -16.896 3.366 6.371 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -18.223 1.325 8.217 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -18.059 3.028 8.595 1.00 0.00 H new ATOM 0 HE ARG A 52 -19.863 1.804 6.591 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.654 4.857 7.911 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -20.025 5.755 7.251 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.549 3.014 5.822 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -21.595 4.755 6.118 1.00 0.00 H new ATOM 55 N SER A 53 -14.359 3.324 4.675 1.00 0.00 N ATOM 56 CA SER A 53 -13.809 4.478 3.951 1.00 0.00 C ATOM 57 C SER A 53 -12.285 4.551 4.094 1.00 0.00 C ATOM 58 O SER A 53 -11.712 4.108 5.094 1.00 0.00 O ATOM 59 CB SER A 53 -14.456 5.770 4.466 1.00 0.00 C ATOM 60 OG SER A 53 -13.958 6.892 3.751 1.00 0.00 O ATOM 0 H SER A 53 -13.915 3.188 5.583 1.00 0.00 H new ATOM 0 HA SER A 53 -14.037 4.358 2.892 1.00 0.00 H new ATOM 0 HB2 SER A 53 -15.539 5.711 4.355 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.251 5.888 5.530 1.00 0.00 H new ATOM 0 HG SER A 53 -14.381 7.709 4.089 1.00 0.00 H new ATOM 66 N ALA A 54 -11.617 5.145 3.103 1.00 0.00 N ATOM 67 CA ALA A 54 -10.189 5.468 3.135 1.00 0.00 C ATOM 68 C ALA A 54 -9.867 6.773 3.908 1.00 0.00 C ATOM 69 O ALA A 54 -8.699 7.037 4.200 1.00 0.00 O ATOM 70 CB ALA A 54 -9.705 5.542 1.682 1.00 0.00 C ATOM 0 H ALA A 54 -12.068 5.423 2.231 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.662 4.688 3.684 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -8.642 5.782 1.664 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.869 4.581 1.195 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.260 6.316 1.153 1.00 0.00 H new ATOM 76 N GLY A 55 -10.876 7.584 4.263 1.00 0.00 N ATOM 77 CA GLY A 55 -10.713 8.813 5.053 1.00 0.00 C ATOM 78 C GLY A 55 -10.268 10.023 4.220 1.00 0.00 C ATOM 79 O GLY A 55 -9.383 10.770 4.646 1.00 0.00 O ATOM 0 H GLY A 55 -11.845 7.400 4.004 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.658 9.048 5.544 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -9.980 8.635 5.840 1.00 0.00 H new ATOM 83 N VAL A 56 -10.873 10.202 3.038 1.00 0.00 N ATOM 84 CA VAL A 56 -10.526 11.170 1.977 1.00 0.00 C ATOM 85 C VAL A 56 -9.030 11.071 1.612 1.00 0.00 C ATOM 86 O VAL A 56 -8.200 11.761 2.206 1.00 0.00 O ATOM 87 CB VAL A 56 -10.988 12.581 2.345 1.00 0.00 C ATOM 88 CG1 VAL A 56 -10.654 13.610 1.256 1.00 0.00 C ATOM 89 CG2 VAL A 56 -12.510 12.628 2.562 1.00 0.00 C ATOM 0 H VAL A 56 -11.678 9.634 2.774 1.00 0.00 H new ATOM 0 HA VAL A 56 -11.071 10.914 1.068 1.00 0.00 H new ATOM 0 HB VAL A 56 -10.455 12.832 3.262 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.003 14.595 1.567 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -9.575 13.639 1.102 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.146 13.328 0.325 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -12.809 13.643 2.822 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -13.018 12.323 1.647 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -12.783 11.951 3.371 1.00 0.00 H new ATOM 99 N PRO A 57 -8.655 10.144 0.714 1.00 0.00 N ATOM 100 CA PRO A 57 -7.338 9.493 0.723 1.00 0.00 C ATOM 101 C PRO A 57 -6.356 9.931 -0.385 1.00 0.00 C ATOM 102 O PRO A 57 -5.309 9.308 -0.562 1.00 0.00 O ATOM 103 CB PRO A 57 -7.741 8.034 0.580 1.00 0.00 C ATOM 104 CG PRO A 57 -8.795 8.109 -0.525 1.00 0.00 C ATOM 105 CD PRO A 57 -9.596 9.306 -0.030 1.00 0.00 C ATOM 0 HA PRO A 57 -6.765 9.747 1.615 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -6.898 7.402 0.299 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.148 7.629 1.507 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -8.358 8.276 -1.510 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -9.396 7.202 -0.593 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -10.032 9.855 -0.865 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -10.421 8.987 0.607 1.00 0.00 H new ATOM 113 N SER A 58 -6.697 10.984 -1.135 1.00 0.00 N ATOM 114 CA SER A 58 -5.988 11.630 -2.260 1.00 0.00 C ATOM 115 C SER A 58 -4.578 11.112 -2.618 1.00 0.00 C ATOM 116 O SER A 58 -3.589 11.419 -1.948 1.00 0.00 O ATOM 117 CB SER A 58 -5.929 13.149 -2.048 1.00 0.00 C ATOM 118 OG SER A 58 -7.225 13.675 -1.788 1.00 0.00 O ATOM 0 H SER A 58 -7.578 11.464 -0.952 1.00 0.00 H new ATOM 0 HA SER A 58 -6.596 11.350 -3.120 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.265 13.379 -1.215 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.508 13.628 -2.932 1.00 0.00 H new ATOM 0 HG SER A 58 -7.164 14.644 -1.654 1.00 0.00 H new ATOM 124 N ARG A 59 -4.501 10.401 -3.753 1.00 0.00 N ATOM 125 CA ARG A 59 -3.339 10.232 -4.654 1.00 0.00 C ATOM 126 C ARG A 59 -2.280 9.184 -4.260 1.00 0.00 C ATOM 127 O ARG A 59 -1.474 8.837 -5.124 1.00 0.00 O ATOM 128 CB ARG A 59 -2.740 11.608 -5.041 1.00 0.00 C ATOM 129 CG ARG A 59 -3.641 12.355 -6.048 1.00 0.00 C ATOM 130 CD ARG A 59 -3.047 13.663 -6.586 1.00 0.00 C ATOM 131 NE ARG A 59 -2.927 14.735 -5.574 1.00 0.00 N ATOM 132 CZ ARG A 59 -3.512 15.921 -5.580 1.00 0.00 C ATOM 133 NH1 ARG A 59 -4.447 16.266 -6.419 1.00 0.00 N ATOM 134 NH2 ARG A 59 -3.152 16.829 -4.724 1.00 0.00 N ATOM 0 H ARG A 59 -5.312 9.886 -4.097 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.758 9.765 -5.546 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.613 12.215 -4.145 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.749 11.466 -5.473 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.851 11.693 -6.889 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.595 12.574 -5.569 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -2.060 13.458 -7.000 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.669 14.021 -7.406 1.00 0.00 H new ATOM 0 HE ARG A 59 -2.322 14.536 -4.778 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.768 15.604 -7.125 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -4.858 17.198 -6.370 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.417 16.628 -4.046 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.604 17.743 -4.730 1.00 0.00 H new ATOM 148 N VAL A 60 -2.356 8.558 -3.079 1.00 0.00 N ATOM 149 CA VAL A 60 -1.623 7.305 -2.760 1.00 0.00 C ATOM 150 C VAL A 60 -2.553 6.129 -2.435 1.00 0.00 C ATOM 151 O VAL A 60 -3.521 6.273 -1.690 1.00 0.00 O ATOM 152 CB VAL A 60 -0.491 7.487 -1.732 1.00 0.00 C ATOM 153 CG1 VAL A 60 -0.775 8.249 -0.437 1.00 0.00 C ATOM 154 CG2 VAL A 60 0.178 6.168 -1.392 1.00 0.00 C ATOM 0 H VAL A 60 -2.928 8.900 -2.307 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.116 7.034 -3.686 1.00 0.00 H new ATOM 0 HB VAL A 60 0.167 8.157 -2.285 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.129 8.283 0.171 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.091 9.265 -0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.566 7.743 0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.971 6.339 -0.664 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.559 5.484 -0.972 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.604 5.732 -2.296 1.00 0.00 H new ATOM 164 N ILE A 61 -2.242 4.949 -2.976 1.00 0.00 N ATOM 165 CA ILE A 61 -2.821 3.635 -2.634 1.00 0.00 C ATOM 166 C ILE A 61 -1.754 2.794 -1.933 1.00 0.00 C ATOM 167 O ILE A 61 -0.579 2.901 -2.264 1.00 0.00 O ATOM 168 CB ILE A 61 -3.320 2.943 -3.921 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.545 3.693 -4.487 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.667 1.443 -3.784 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.513 3.652 -6.009 1.00 0.00 C ATOM 0 H ILE A 61 -1.537 4.874 -3.710 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.671 3.755 -1.962 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.469 2.988 -4.601 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.464 3.236 -4.120 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.542 4.727 -4.141 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.006 1.059 -4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.782 0.892 -3.465 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.458 1.319 -3.044 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.379 4.182 -6.406 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.600 4.129 -6.367 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.537 2.616 -6.346 1.00 0.00 H new ATOM 183 N HIS A 62 -2.158 1.933 -1.004 1.00 0.00 N ATOM 184 CA HIS A 62 -1.299 0.983 -0.304 1.00 0.00 C ATOM 185 C HIS A 62 -1.620 -0.458 -0.737 1.00 0.00 C ATOM 186 O HIS A 62 -2.723 -0.975 -0.524 1.00 0.00 O ATOM 187 CB HIS A 62 -1.388 1.239 1.209 1.00 0.00 C ATOM 188 CG HIS A 62 -0.919 0.114 2.106 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.462 -1.151 2.172 1.00 0.00 N ATOM 190 CD2 HIS A 62 0.005 0.206 3.113 1.00 0.00 C ATOM 191 CE1 HIS A 62 -0.866 -1.808 3.182 1.00 0.00 C ATOM 192 NE2 HIS A 62 0.047 -1.027 3.779 1.00 0.00 N ATOM 0 H HIS A 62 -3.132 1.876 -0.706 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.254 1.129 -0.577 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -0.803 2.129 1.441 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.425 1.466 1.458 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.189 -1.524 1.561 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.598 1.077 3.352 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.091 -2.824 3.473 1.00 0.00 H new ATOM 200 N ILE A 63 -0.635 -1.107 -1.355 1.00 0.00 N ATOM 201 CA ILE A 63 -0.645 -2.514 -1.776 1.00 0.00 C ATOM 202 C ILE A 63 -0.106 -3.371 -0.619 1.00 0.00 C ATOM 203 O ILE A 63 0.934 -3.029 -0.066 1.00 0.00 O ATOM 204 CB ILE A 63 0.249 -2.725 -3.028 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.121 -1.597 -4.085 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.082 -4.099 -3.645 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.084 -1.733 -5.274 1.00 0.00 C ATOM 0 H ILE A 63 0.242 -0.643 -1.590 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.665 -2.803 -2.031 1.00 0.00 H new ATOM 0 HB ILE A 63 1.288 -2.692 -2.700 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.902 -1.582 -4.461 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.296 -0.637 -3.598 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.539 -4.261 -4.526 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.114 -4.883 -2.914 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.133 -4.125 -3.932 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.928 -0.904 -5.965 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.112 -1.716 -4.913 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.896 -2.675 -5.789 1.00 0.00 H new ATOM 219 N ARG A 64 -0.759 -4.493 -0.282 1.00 0.00 N ATOM 220 CA ARG A 64 -0.294 -5.529 0.667 1.00 0.00 C ATOM 221 C ARG A 64 -0.234 -6.921 0.024 1.00 0.00 C ATOM 222 O ARG A 64 -0.731 -7.144 -1.079 1.00 0.00 O ATOM 223 CB ARG A 64 -1.090 -5.532 1.998 1.00 0.00 C ATOM 224 CG ARG A 64 -2.508 -4.944 1.980 1.00 0.00 C ATOM 225 CD ARG A 64 -3.225 -5.343 3.279 1.00 0.00 C ATOM 226 NE ARG A 64 -4.683 -5.184 3.209 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.416 -4.092 3.117 1.00 0.00 C ATOM 228 NH1 ARG A 64 -4.900 -2.897 3.080 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.713 -4.193 3.074 1.00 0.00 N ATOM 0 H ARG A 64 -1.671 -4.718 -0.680 1.00 0.00 H new ATOM 0 HA ARG A 64 0.729 -5.258 0.929 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.158 -6.563 2.346 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.508 -4.983 2.739 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.466 -3.859 1.890 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.059 -5.314 1.115 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.990 -6.382 3.511 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -2.839 -4.738 4.100 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.212 -6.056 3.236 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -3.888 -2.777 3.123 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -5.508 -2.081 3.008 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.155 -5.112 3.111 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.288 -3.353 3.003 1.00 0.00 H new ATOM 243 N LYS A 65 0.393 -7.858 0.744 1.00 0.00 N ATOM 244 CA LYS A 65 0.748 -9.233 0.326 1.00 0.00 C ATOM 245 C LYS A 65 1.397 -9.326 -1.055 1.00 0.00 C ATOM 246 O LYS A 65 1.186 -10.280 -1.805 1.00 0.00 O ATOM 247 CB LYS A 65 -0.437 -10.193 0.513 1.00 0.00 C ATOM 248 CG LYS A 65 -1.146 -10.022 1.856 1.00 0.00 C ATOM 249 CD LYS A 65 -0.260 -9.965 3.110 1.00 0.00 C ATOM 250 CE LYS A 65 -0.856 -10.763 4.267 1.00 0.00 C ATOM 251 NZ LYS A 65 -0.106 -10.516 5.522 1.00 0.00 N ATOM 0 H LYS A 65 0.689 -7.670 1.702 1.00 0.00 H new ATOM 0 HA LYS A 65 1.539 -9.561 1.000 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.155 -10.035 -0.292 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.081 -11.220 0.426 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.734 -9.105 1.814 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.849 -10.846 1.975 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.730 -10.355 2.873 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.129 -8.927 3.415 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.902 -10.487 4.403 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.835 -11.827 4.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.685 -10.808 6.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.778 -11.064 5.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.115 -9.503 5.600 1.00 0.00 H new ATOM 265 N LEU A 66 2.253 -8.349 -1.334 1.00 0.00 N ATOM 266 CA LEU A 66 3.321 -8.414 -2.337 1.00 0.00 C ATOM 267 C LEU A 66 4.329 -9.553 -2.007 1.00 0.00 C ATOM 268 O LEU A 66 4.267 -10.158 -0.930 1.00 0.00 O ATOM 269 CB LEU A 66 4.050 -7.045 -2.336 1.00 0.00 C ATOM 270 CG LEU A 66 3.300 -5.880 -2.999 1.00 0.00 C ATOM 271 CD1 LEU A 66 4.204 -4.657 -3.040 1.00 0.00 C ATOM 272 CD2 LEU A 66 2.999 -6.160 -4.463 1.00 0.00 C ATOM 0 H LEU A 66 2.224 -7.452 -0.850 1.00 0.00 H new ATOM 0 HA LEU A 66 2.895 -8.627 -3.317 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.265 -6.771 -1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.009 -7.167 -2.839 1.00 0.00 H new ATOM 0 HG LEU A 66 2.386 -5.737 -2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.674 -3.829 -3.510 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.485 -4.378 -2.024 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.101 -4.887 -3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.468 -5.311 -4.894 1.00 0.00 H new ATOM 0 HD22 LEU A 66 3.933 -6.316 -5.003 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.380 -7.054 -4.543 1.00 0.00 H new ATOM 284 N PRO A 67 5.307 -9.824 -2.896 1.00 0.00 N ATOM 285 CA PRO A 67 6.616 -10.387 -2.547 1.00 0.00 C ATOM 286 C PRO A 67 7.373 -9.624 -1.437 1.00 0.00 C ATOM 287 O PRO A 67 6.835 -8.753 -0.753 1.00 0.00 O ATOM 288 CB PRO A 67 7.415 -10.401 -3.858 1.00 0.00 C ATOM 289 CG PRO A 67 6.336 -10.451 -4.930 1.00 0.00 C ATOM 290 CD PRO A 67 5.214 -9.609 -4.329 1.00 0.00 C ATOM 0 HA PRO A 67 6.481 -11.381 -2.120 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.039 -9.513 -3.957 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.078 -11.264 -3.915 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.688 -10.039 -5.876 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.012 -11.473 -5.129 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.335 -8.555 -4.578 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.241 -9.917 -4.712 1.00 0.00 H new ATOM 298 N ILE A 68 8.644 -9.970 -1.233 1.00 0.00 N ATOM 299 CA ILE A 68 9.513 -9.437 -0.163 1.00 0.00 C ATOM 300 C ILE A 68 9.670 -7.910 -0.234 1.00 0.00 C ATOM 301 O ILE A 68 9.406 -7.201 0.738 1.00 0.00 O ATOM 302 CB ILE A 68 10.873 -10.178 -0.118 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.613 -10.256 -1.479 1.00 0.00 C ATOM 304 CG2 ILE A 68 10.610 -11.591 0.421 1.00 0.00 C ATOM 305 CD1 ILE A 68 13.000 -10.905 -1.409 1.00 0.00 C ATOM 0 H ILE A 68 9.121 -10.651 -1.823 1.00 0.00 H new ATOM 0 HA ILE A 68 9.012 -9.635 0.785 1.00 0.00 H new ATOM 0 HB ILE A 68 11.538 -9.605 0.528 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.998 -10.818 -2.182 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.717 -9.248 -1.881 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.548 -12.144 0.467 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.179 -11.525 1.420 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.916 -12.109 -0.240 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.446 -10.919 -2.404 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.636 -10.332 -0.734 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.906 -11.926 -1.040 1.00 0.00 H new ATOM 317 N ASP A 69 10.053 -7.410 -1.405 1.00 0.00 N ATOM 318 CA ASP A 69 10.125 -5.993 -1.782 1.00 0.00 C ATOM 319 C ASP A 69 9.859 -5.757 -3.285 1.00 0.00 C ATOM 320 O ASP A 69 10.034 -4.642 -3.775 1.00 0.00 O ATOM 321 CB ASP A 69 11.483 -5.412 -1.340 1.00 0.00 C ATOM 322 CG ASP A 69 12.688 -5.765 -2.237 1.00 0.00 C ATOM 323 OD1 ASP A 69 12.789 -6.919 -2.719 1.00 0.00 O ATOM 324 OD2 ASP A 69 13.577 -4.898 -2.405 1.00 0.00 O ATOM 0 H ASP A 69 10.341 -8.020 -2.170 1.00 0.00 H new ATOM 0 HA ASP A 69 9.326 -5.465 -1.261 1.00 0.00 H new ATOM 0 HB2 ASP A 69 11.395 -4.327 -1.293 1.00 0.00 H new ATOM 0 HB3 ASP A 69 11.693 -5.759 -0.328 1.00 0.00 H new ATOM 329 N VAL A 70 9.428 -6.807 -4.004 1.00 0.00 N ATOM 330 CA VAL A 70 9.302 -6.924 -5.469 1.00 0.00 C ATOM 331 C VAL A 70 10.349 -6.087 -6.242 1.00 0.00 C ATOM 332 O VAL A 70 11.548 -6.269 -6.015 1.00 0.00 O ATOM 333 CB VAL A 70 7.815 -6.788 -5.855 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.173 -5.412 -5.633 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.558 -7.284 -7.276 1.00 0.00 C ATOM 0 H VAL A 70 9.135 -7.666 -3.539 1.00 0.00 H new ATOM 0 HA VAL A 70 9.586 -7.919 -5.811 1.00 0.00 H new ATOM 0 HB VAL A 70 7.310 -7.435 -5.138 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.128 -5.444 -5.942 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.231 -5.149 -4.577 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.703 -4.664 -6.223 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.500 -7.173 -7.514 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.151 -6.699 -7.979 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.839 -8.335 -7.351 1.00 0.00 H new ATOM 345 N THR A 71 9.957 -5.206 -7.165 1.00 0.00 N ATOM 346 CA THR A 71 10.816 -4.174 -7.764 1.00 0.00 C ATOM 347 C THR A 71 9.974 -2.999 -8.239 1.00 0.00 C ATOM 348 O THR A 71 8.849 -3.155 -8.728 1.00 0.00 O ATOM 349 CB THR A 71 11.699 -4.746 -8.889 1.00 0.00 C ATOM 350 OG1 THR A 71 12.428 -3.705 -9.507 1.00 0.00 O ATOM 351 CG2 THR A 71 10.925 -5.480 -9.981 1.00 0.00 C ATOM 0 H THR A 71 9.004 -5.188 -7.529 1.00 0.00 H new ATOM 0 HA THR A 71 11.498 -3.810 -6.996 1.00 0.00 H new ATOM 0 HB THR A 71 12.351 -5.471 -8.401 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.988 -4.077 -10.220 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.621 -5.851 -10.733 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.384 -6.318 -9.542 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.217 -4.795 -10.448 1.00 0.00 H new ATOM 359 N GLU A 72 10.523 -1.795 -8.080 1.00 0.00 N ATOM 360 CA GLU A 72 9.872 -0.546 -8.454 1.00 0.00 C ATOM 361 C GLU A 72 9.450 -0.528 -9.925 1.00 0.00 C ATOM 362 O GLU A 72 8.331 -0.124 -10.235 1.00 0.00 O ATOM 363 CB GLU A 72 10.793 0.630 -8.085 1.00 0.00 C ATOM 364 CG GLU A 72 10.408 1.946 -8.767 1.00 0.00 C ATOM 365 CD GLU A 72 11.342 3.133 -8.436 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.212 3.029 -7.535 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.227 4.188 -9.108 1.00 0.00 O ATOM 0 H GLU A 72 11.451 -1.661 -7.679 1.00 0.00 H new ATOM 0 HA GLU A 72 8.943 -0.448 -7.893 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.773 0.771 -7.004 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.818 0.377 -8.355 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.402 1.794 -9.846 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.391 2.208 -8.476 1.00 0.00 H new ATOM 374 N GLY A 73 10.316 -1.001 -10.822 1.00 0.00 N ATOM 375 CA GLY A 73 10.048 -1.078 -12.261 1.00 0.00 C ATOM 376 C GLY A 73 8.743 -1.811 -12.586 1.00 0.00 C ATOM 377 O GLY A 73 7.953 -1.342 -13.406 1.00 0.00 O ATOM 0 H GLY A 73 11.240 -1.348 -10.566 1.00 0.00 H new ATOM 0 HA2 GLY A 73 10.004 -0.069 -12.672 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.877 -1.587 -12.753 1.00 0.00 H new ATOM 381 N GLU A 74 8.481 -2.930 -11.903 1.00 0.00 N ATOM 382 CA GLU A 74 7.207 -3.654 -11.983 1.00 0.00 C ATOM 383 C GLU A 74 6.046 -2.827 -11.432 1.00 0.00 C ATOM 384 O GLU A 74 5.055 -2.627 -12.134 1.00 0.00 O ATOM 385 CB GLU A 74 7.301 -5.022 -11.285 1.00 0.00 C ATOM 386 CG GLU A 74 7.912 -6.051 -12.245 1.00 0.00 C ATOM 387 CD GLU A 74 7.869 -7.478 -11.665 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.770 -8.079 -11.615 1.00 0.00 O ATOM 389 OE2 GLU A 74 8.938 -8.027 -11.300 1.00 0.00 O ATOM 0 H GLU A 74 9.155 -3.364 -11.272 1.00 0.00 H new ATOM 0 HA GLU A 74 7.001 -3.831 -13.039 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.912 -4.941 -10.386 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.310 -5.349 -10.969 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.373 -6.028 -13.192 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.945 -5.778 -12.460 1.00 0.00 H new ATOM 396 N VAL A 75 6.163 -2.323 -10.202 1.00 0.00 N ATOM 397 CA VAL A 75 5.085 -1.585 -9.519 1.00 0.00 C ATOM 398 C VAL A 75 4.651 -0.328 -10.294 1.00 0.00 C ATOM 399 O VAL A 75 3.459 -0.130 -10.550 1.00 0.00 O ATOM 400 CB VAL A 75 5.483 -1.274 -8.065 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.405 -0.485 -7.315 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.703 -2.594 -7.312 1.00 0.00 C ATOM 0 H VAL A 75 7.012 -2.413 -9.643 1.00 0.00 H new ATOM 0 HA VAL A 75 4.206 -2.229 -9.491 1.00 0.00 H new ATOM 0 HB VAL A 75 6.389 -0.669 -8.104 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.738 -0.293 -6.295 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.228 0.463 -7.823 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.481 -1.063 -7.292 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.985 -2.382 -6.281 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.782 -3.177 -7.323 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.498 -3.161 -7.796 1.00 0.00 H new ATOM 412 N ILE A 76 5.590 0.515 -10.730 1.00 0.00 N ATOM 413 CA ILE A 76 5.269 1.714 -11.506 1.00 0.00 C ATOM 414 C ILE A 76 4.779 1.383 -12.910 1.00 0.00 C ATOM 415 O ILE A 76 3.870 2.061 -13.383 1.00 0.00 O ATOM 416 CB ILE A 76 6.426 2.730 -11.536 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.626 2.343 -12.428 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.894 3.002 -10.111 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.482 2.915 -13.840 1.00 0.00 C ATOM 0 H ILE A 76 6.587 0.387 -10.557 1.00 0.00 H new ATOM 0 HA ILE A 76 4.442 2.194 -10.982 1.00 0.00 H new ATOM 0 HB ILE A 76 6.018 3.628 -11.999 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.549 2.710 -11.978 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.707 1.257 -12.480 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.713 3.721 -10.128 1.00 0.00 H new ATOM 0 HG22 ILE A 76 6.067 3.408 -9.528 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.237 2.072 -9.657 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.344 2.623 -14.440 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.572 2.527 -14.299 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.427 4.002 -13.788 1.00 0.00 H new ATOM 431 N SER A 77 5.299 0.334 -13.566 1.00 0.00 N ATOM 432 CA SER A 77 4.771 -0.069 -14.886 1.00 0.00 C ATOM 433 C SER A 77 3.371 -0.656 -14.780 1.00 0.00 C ATOM 434 O SER A 77 2.606 -0.627 -15.749 1.00 0.00 O ATOM 435 CB SER A 77 5.683 -1.053 -15.621 1.00 0.00 C ATOM 436 OG SER A 77 6.975 -0.496 -15.816 1.00 0.00 O ATOM 0 H SER A 77 6.066 -0.241 -13.218 1.00 0.00 H new ATOM 0 HA SER A 77 4.730 0.849 -15.472 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.763 -1.977 -15.049 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.244 -1.311 -16.585 1.00 0.00 H new ATOM 0 HG SER A 77 7.534 -0.683 -15.033 1.00 0.00 H new ATOM 442 N LEU A 78 3.004 -1.119 -13.584 1.00 0.00 N ATOM 443 CA LEU A 78 1.648 -1.533 -13.261 1.00 0.00 C ATOM 444 C LEU A 78 0.712 -0.355 -12.957 1.00 0.00 C ATOM 445 O LEU A 78 -0.494 -0.480 -13.177 1.00 0.00 O ATOM 446 CB LEU A 78 1.706 -2.540 -12.097 1.00 0.00 C ATOM 447 CG LEU A 78 1.802 -3.990 -12.586 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.297 -4.890 -11.454 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.437 -4.489 -13.071 1.00 0.00 C ATOM 0 H LEU A 78 3.654 -1.216 -12.804 1.00 0.00 H new ATOM 0 HA LEU A 78 1.215 -2.011 -14.140 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.566 -2.314 -11.466 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.817 -2.426 -11.477 1.00 0.00 H new ATOM 0 HG LEU A 78 2.506 -4.025 -13.417 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.363 -5.918 -11.809 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.282 -4.555 -11.127 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.600 -4.839 -10.617 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.527 -5.520 -13.414 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.280 -4.440 -12.252 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.092 -3.862 -13.893 1.00 0.00 H new ATOM 461 N GLY A 79 1.238 0.800 -12.525 1.00 0.00 N ATOM 462 CA GLY A 79 0.430 2.011 -12.318 1.00 0.00 C ATOM 463 C GLY A 79 0.395 2.981 -13.503 1.00 0.00 C ATOM 464 O GLY A 79 -0.520 3.795 -13.617 1.00 0.00 O ATOM 0 H GLY A 79 2.228 0.921 -12.311 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.592 1.711 -12.084 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.815 2.541 -11.446 1.00 0.00 H new ATOM 468 N LEU A 80 1.376 2.919 -14.401 1.00 0.00 N ATOM 469 CA LEU A 80 1.589 3.908 -15.447 1.00 0.00 C ATOM 470 C LEU A 80 0.445 4.122 -16.453 1.00 0.00 C ATOM 471 O LEU A 80 0.148 5.283 -16.738 1.00 0.00 O ATOM 472 CB LEU A 80 2.917 3.616 -16.165 1.00 0.00 C ATOM 473 CG LEU A 80 3.989 4.672 -15.885 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.270 4.302 -16.637 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.502 6.048 -16.339 1.00 0.00 C ATOM 0 H LEU A 80 2.059 2.161 -14.419 1.00 0.00 H new ATOM 0 HA LEU A 80 1.623 4.862 -14.922 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.286 2.639 -15.853 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.739 3.561 -17.239 1.00 0.00 H new ATOM 0 HG LEU A 80 4.190 4.707 -14.814 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.037 5.052 -16.441 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.621 3.327 -16.300 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.066 4.264 -17.707 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.272 6.792 -16.135 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.293 6.025 -17.409 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.593 6.309 -15.797 1.00 0.00 H new ATOM 487 N PRO A 81 -0.230 3.075 -16.976 1.00 0.00 N ATOM 488 CA PRO A 81 -1.407 3.211 -17.846 1.00 0.00 C ATOM 489 C PRO A 81 -2.589 4.002 -17.293 1.00 0.00 C ATOM 490 O PRO A 81 -3.547 4.250 -18.033 1.00 0.00 O ATOM 491 CB PRO A 81 -1.827 1.780 -18.213 1.00 0.00 C ATOM 492 CG PRO A 81 -0.542 0.975 -18.048 1.00 0.00 C ATOM 493 CD PRO A 81 0.150 1.670 -16.881 1.00 0.00 C ATOM 0 HA PRO A 81 -1.111 3.817 -18.702 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.617 1.413 -17.557 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.208 1.723 -19.233 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.747 -0.073 -17.829 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.068 0.999 -18.951 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.165 1.243 -15.929 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.232 1.552 -16.941 1.00 0.00 H new ATOM 501 N PHE A 82 -2.540 4.411 -16.025 1.00 0.00 N ATOM 502 CA PHE A 82 -3.702 4.923 -15.324 1.00 0.00 C ATOM 503 C PHE A 82 -3.694 6.444 -15.171 1.00 0.00 C ATOM 504 O PHE A 82 -4.748 7.074 -15.275 1.00 0.00 O ATOM 505 CB PHE A 82 -3.824 4.213 -13.969 1.00 0.00 C ATOM 506 CG PHE A 82 -4.015 2.719 -14.128 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.968 1.866 -14.548 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.302 2.195 -13.956 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.234 0.511 -14.825 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.578 0.860 -14.267 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.543 0.020 -14.703 1.00 0.00 C ATOM 0 H PHE A 82 -1.690 4.394 -15.461 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.582 4.706 -15.929 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.928 4.403 -13.378 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.666 4.630 -13.416 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.966 2.253 -14.656 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.091 2.829 -13.579 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.434 -0.147 -15.130 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.584 0.478 -14.172 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.755 -1.011 -14.946 1.00 0.00 H new ATOM 521 N GLY A 83 -2.515 7.037 -14.965 1.00 0.00 N ATOM 522 CA GLY A 83 -2.326 8.478 -14.952 1.00 0.00 C ATOM 523 C GLY A 83 -0.910 8.867 -15.351 1.00 0.00 C ATOM 524 O GLY A 83 -0.485 8.748 -16.501 1.00 0.00 O ATOM 0 H GLY A 83 -1.655 6.515 -14.800 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.037 8.944 -15.635 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.542 8.864 -13.956 1.00 0.00 H new ATOM 528 N LYS A 84 -0.186 9.315 -14.334 1.00 0.00 N ATOM 529 CA LYS A 84 1.214 9.703 -14.272 1.00 0.00 C ATOM 530 C LYS A 84 1.639 9.377 -12.842 1.00 0.00 C ATOM 531 O LYS A 84 0.923 9.759 -11.919 1.00 0.00 O ATOM 532 CB LYS A 84 1.279 11.210 -14.609 1.00 0.00 C ATOM 533 CG LYS A 84 2.578 11.656 -15.282 1.00 0.00 C ATOM 534 CD LYS A 84 2.907 10.904 -16.581 1.00 0.00 C ATOM 535 CE LYS A 84 1.807 11.085 -17.639 1.00 0.00 C ATOM 536 NZ LYS A 84 2.111 10.329 -18.881 1.00 0.00 N ATOM 0 H LYS A 84 -0.624 9.428 -13.420 1.00 0.00 H new ATOM 0 HA LYS A 84 1.877 9.192 -14.970 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.443 11.459 -15.262 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.147 11.781 -13.690 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.514 12.722 -15.499 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.401 11.523 -14.580 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.856 11.263 -16.978 1.00 0.00 H new ATOM 0 HD3 LYS A 84 3.033 9.843 -16.365 1.00 0.00 H new ATOM 0 HE2 LYS A 84 0.853 10.750 -17.233 1.00 0.00 H new ATOM 0 HE3 LYS A 84 1.699 12.144 -17.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 1.347 10.475 -19.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.009 10.666 -19.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 2.189 9.316 -18.660 1.00 0.00 H new ATOM 550 N VAL A 85 2.652 8.542 -12.622 1.00 0.00 N ATOM 551 CA VAL A 85 2.842 7.867 -11.312 1.00 0.00 C ATOM 552 C VAL A 85 4.273 8.080 -10.842 1.00 0.00 C ATOM 553 O VAL A 85 5.195 7.324 -11.142 1.00 0.00 O ATOM 554 CB VAL A 85 2.289 6.424 -11.270 1.00 0.00 C ATOM 555 CG1 VAL A 85 2.301 5.777 -9.873 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.089 6.282 -12.199 1.00 0.00 C ATOM 0 H VAL A 85 3.357 8.309 -13.321 1.00 0.00 H new ATOM 0 HA VAL A 85 2.212 8.337 -10.557 1.00 0.00 H new ATOM 0 HB VAL A 85 2.992 5.724 -11.721 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.896 4.767 -9.936 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.324 5.735 -9.500 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.691 6.370 -9.192 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.714 5.259 -12.155 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.304 6.970 -11.887 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.390 6.515 -13.220 1.00 0.00 H new ATOM 566 N THR A 86 4.441 9.235 -10.199 1.00 0.00 N ATOM 567 CA THR A 86 5.704 9.928 -9.922 1.00 0.00 C ATOM 568 C THR A 86 6.419 9.392 -8.689 1.00 0.00 C ATOM 569 O THR A 86 7.620 9.623 -8.538 1.00 0.00 O ATOM 570 CB THR A 86 5.438 11.428 -9.710 1.00 0.00 C ATOM 571 OG1 THR A 86 4.459 11.615 -8.709 1.00 0.00 O ATOM 572 CG2 THR A 86 4.904 12.083 -10.985 1.00 0.00 C ATOM 0 H THR A 86 3.642 9.750 -9.830 1.00 0.00 H new ATOM 0 HA THR A 86 6.346 9.756 -10.786 1.00 0.00 H new ATOM 0 HB THR A 86 6.387 11.881 -9.423 1.00 0.00 H new ATOM 0 HG1 THR A 86 4.300 12.574 -8.582 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.726 13.143 -10.803 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.635 11.970 -11.786 1.00 0.00 H new ATOM 0 HG23 THR A 86 3.970 11.603 -11.277 1.00 0.00 H new ATOM 580 N ASN A 87 5.710 8.653 -7.824 1.00 0.00 N ATOM 581 CA ASN A 87 6.316 7.987 -6.677 1.00 0.00 C ATOM 582 C ASN A 87 5.750 6.597 -6.373 1.00 0.00 C ATOM 583 O ASN A 87 4.624 6.246 -6.719 1.00 0.00 O ATOM 584 CB ASN A 87 6.211 8.901 -5.430 1.00 0.00 C ATOM 585 CG ASN A 87 7.473 9.677 -5.105 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.590 9.223 -5.310 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.338 10.839 -4.508 1.00 0.00 N ATOM 0 H ASN A 87 4.704 8.504 -7.905 1.00 0.00 H new ATOM 0 HA ASN A 87 7.360 7.817 -6.942 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.395 9.608 -5.582 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.946 8.288 -4.569 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.164 11.361 -4.216 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.407 11.219 -4.336 1.00 0.00 H new ATOM 594 N LEU A 88 6.543 5.832 -5.629 1.00 0.00 N ATOM 595 CA LEU A 88 6.138 4.691 -4.820 1.00 0.00 C ATOM 596 C LEU A 88 7.003 4.587 -3.551 1.00 0.00 C ATOM 597 O LEU A 88 7.966 5.332 -3.369 1.00 0.00 O ATOM 598 CB LEU A 88 6.204 3.438 -5.703 1.00 0.00 C ATOM 599 CG LEU A 88 7.584 2.749 -5.713 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.442 1.498 -6.541 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.736 3.569 -6.288 1.00 0.00 C ATOM 0 H LEU A 88 7.547 6.004 -5.573 1.00 0.00 H new ATOM 0 HA LEU A 88 5.114 4.808 -4.464 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.455 2.724 -5.359 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.938 3.711 -6.724 1.00 0.00 H new ATOM 0 HG LEU A 88 7.850 2.575 -4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.398 0.975 -6.577 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.690 0.849 -6.093 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.136 1.764 -7.553 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.656 2.985 -6.244 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.518 3.825 -7.325 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.858 4.483 -5.706 1.00 0.00 H new ATOM 613 N LEU A 89 6.665 3.630 -2.689 1.00 0.00 N ATOM 614 CA LEU A 89 7.368 3.313 -1.445 1.00 0.00 C ATOM 615 C LEU A 89 7.181 1.834 -1.112 1.00 0.00 C ATOM 616 O LEU A 89 6.194 1.237 -1.531 1.00 0.00 O ATOM 617 CB LEU A 89 6.882 4.337 -0.409 1.00 0.00 C ATOM 618 CG LEU A 89 6.682 3.947 1.053 1.00 0.00 C ATOM 619 CD1 LEU A 89 6.095 5.204 1.684 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.707 2.841 1.364 1.00 0.00 C ATOM 0 H LEU A 89 5.857 3.027 -2.845 1.00 0.00 H new ATOM 0 HA LEU A 89 8.452 3.413 -1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.590 5.165 -0.424 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.929 4.726 -0.768 1.00 0.00 H new ATOM 0 HG LEU A 89 7.642 3.578 1.413 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.913 5.028 2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.796 6.030 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.156 5.454 1.191 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.673 2.678 2.441 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.715 3.119 1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.026 1.924 0.868 1.00 0.00 H new ATOM 632 N MET A 90 8.122 1.228 -0.380 1.00 0.00 N ATOM 633 CA MET A 90 8.202 -0.233 -0.205 1.00 0.00 C ATOM 634 C MET A 90 8.450 -0.615 1.263 1.00 0.00 C ATOM 635 O MET A 90 9.586 -0.618 1.742 1.00 0.00 O ATOM 636 CB MET A 90 9.245 -0.835 -1.170 1.00 0.00 C ATOM 637 CG MET A 90 9.139 -0.233 -2.580 1.00 0.00 C ATOM 638 SD MET A 90 9.859 -1.201 -3.924 1.00 0.00 S ATOM 639 CE MET A 90 8.302 -1.688 -4.713 1.00 0.00 C ATOM 0 H MET A 90 8.856 1.737 0.112 1.00 0.00 H new ATOM 0 HA MET A 90 7.237 -0.668 -0.465 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.246 -0.661 -0.776 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.107 -1.915 -1.225 1.00 0.00 H new ATOM 0 HG2 MET A 90 8.085 -0.070 -2.803 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.618 0.746 -2.570 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.511 -2.136 -5.685 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.786 -2.412 -4.083 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.671 -0.809 -4.847 1.00 0.00 H new ATOM 649 N LEU A 91 7.378 -0.922 2.002 1.00 0.00 N ATOM 650 CA LEU A 91 7.419 -1.434 3.377 1.00 0.00 C ATOM 651 C LEU A 91 7.845 -2.917 3.401 1.00 0.00 C ATOM 652 O LEU A 91 7.023 -3.838 3.335 1.00 0.00 O ATOM 653 CB LEU A 91 6.063 -1.249 4.097 1.00 0.00 C ATOM 654 CG LEU A 91 5.441 0.153 4.275 1.00 0.00 C ATOM 655 CD1 LEU A 91 6.471 1.263 4.432 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.409 0.441 3.186 1.00 0.00 C ATOM 0 H LEU A 91 6.427 -0.818 1.648 1.00 0.00 H new ATOM 0 HA LEU A 91 8.164 -0.850 3.917 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.333 -1.857 3.563 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.169 -1.680 5.093 1.00 0.00 H new ATOM 0 HG LEU A 91 4.911 0.140 5.227 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.961 2.219 4.552 1.00 0.00 H new ATOM 0 HD12 LEU A 91 7.086 1.067 5.310 1.00 0.00 H new ATOM 0 HD13 LEU A 91 7.105 1.299 3.546 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.988 1.435 3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.889 0.395 2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.612 -0.301 3.234 1.00 0.00 H new ATOM 668 N LYS A 92 9.151 -3.164 3.526 1.00 0.00 N ATOM 669 CA LYS A 92 9.753 -4.512 3.569 1.00 0.00 C ATOM 670 C LYS A 92 9.328 -5.360 4.783 1.00 0.00 C ATOM 671 O LYS A 92 9.483 -6.581 4.762 1.00 0.00 O ATOM 672 CB LYS A 92 11.287 -4.399 3.509 1.00 0.00 C ATOM 673 CG LYS A 92 11.785 -3.688 2.239 1.00 0.00 C ATOM 674 CD LYS A 92 13.314 -3.749 2.131 1.00 0.00 C ATOM 675 CE LYS A 92 13.776 -3.032 0.856 1.00 0.00 C ATOM 676 NZ LYS A 92 15.255 -3.082 0.702 1.00 0.00 N ATOM 0 H LYS A 92 9.842 -2.418 3.603 1.00 0.00 H new ATOM 0 HA LYS A 92 9.373 -5.041 2.695 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.641 -3.857 4.386 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.722 -5.397 3.555 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.337 -4.152 1.360 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.460 -2.648 2.251 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.768 -3.283 3.006 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.645 -4.787 2.115 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.304 -3.492 -0.012 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.448 -1.993 0.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.530 -2.587 -0.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.705 -2.620 1.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.565 -4.073 0.651 1.00 0.00 H new ATOM 690 N GLY A 93 8.780 -4.735 5.831 1.00 0.00 N ATOM 691 CA GLY A 93 8.426 -5.368 7.111 1.00 0.00 C ATOM 692 C GLY A 93 7.311 -6.422 7.032 1.00 0.00 C ATOM 693 O GLY A 93 7.476 -7.533 7.541 1.00 0.00 O ATOM 0 H GLY A 93 8.562 -3.739 5.813 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.319 -5.837 7.526 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.120 -4.590 7.811 1.00 0.00 H new ATOM 697 N LYS A 94 6.167 -6.080 6.424 1.00 0.00 N ATOM 698 CA LYS A 94 4.926 -6.893 6.392 1.00 0.00 C ATOM 699 C LYS A 94 4.408 -7.138 4.962 1.00 0.00 C ATOM 700 O LYS A 94 3.227 -7.424 4.768 1.00 0.00 O ATOM 701 CB LYS A 94 3.863 -6.249 7.314 1.00 0.00 C ATOM 702 CG LYS A 94 4.253 -6.247 8.807 1.00 0.00 C ATOM 703 CD LYS A 94 3.605 -5.089 9.578 1.00 0.00 C ATOM 704 CE LYS A 94 4.284 -3.750 9.246 1.00 0.00 C ATOM 705 NZ LYS A 94 3.754 -2.658 10.097 1.00 0.00 N ATOM 0 H LYS A 94 6.068 -5.199 5.920 1.00 0.00 H new ATOM 0 HA LYS A 94 5.157 -7.887 6.776 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.690 -5.222 6.992 1.00 0.00 H new ATOM 0 HB3 LYS A 94 2.920 -6.783 7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.955 -7.193 9.259 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.337 -6.178 8.897 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.545 -5.033 9.331 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.674 -5.279 10.649 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.361 -3.839 9.391 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.123 -3.508 8.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.452 -1.889 10.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.870 -2.296 9.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.568 -3.022 11.053 1.00 0.00 H new ATOM 719 N ASN A 95 5.292 -7.045 3.962 1.00 0.00 N ATOM 720 CA ASN A 95 5.019 -7.230 2.528 1.00 0.00 C ATOM 721 C ASN A 95 4.025 -6.205 1.952 1.00 0.00 C ATOM 722 O ASN A 95 3.058 -6.578 1.276 1.00 0.00 O ATOM 723 CB ASN A 95 4.593 -8.679 2.230 1.00 0.00 C ATOM 724 CG ASN A 95 5.611 -9.714 2.662 1.00 0.00 C ATOM 725 OD1 ASN A 95 5.539 -10.290 3.738 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.598 -9.978 1.840 1.00 0.00 N ATOM 0 H ASN A 95 6.272 -6.827 4.139 1.00 0.00 H new ATOM 0 HA ASN A 95 5.958 -7.039 2.009 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.647 -8.881 2.733 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.414 -8.783 1.160 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.307 -10.665 2.098 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.657 -9.497 0.943 1.00 0.00 H new ATOM 733 N GLN A 96 4.253 -4.912 2.214 1.00 0.00 N ATOM 734 CA GLN A 96 3.417 -3.836 1.674 1.00 0.00 C ATOM 735 C GLN A 96 4.207 -2.713 0.974 1.00 0.00 C ATOM 736 O GLN A 96 5.436 -2.695 0.959 1.00 0.00 O ATOM 737 CB GLN A 96 2.339 -3.350 2.678 1.00 0.00 C ATOM 738 CG GLN A 96 2.301 -3.975 4.077 1.00 0.00 C ATOM 739 CD GLN A 96 3.385 -3.369 4.939 1.00 0.00 C ATOM 740 OE1 GLN A 96 4.470 -3.896 5.119 1.00 0.00 O ATOM 741 NE2 GLN A 96 3.145 -2.188 5.449 1.00 0.00 N ATOM 0 H GLN A 96 5.018 -4.585 2.803 1.00 0.00 H new ATOM 0 HA GLN A 96 2.852 -4.284 0.857 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.462 -2.274 2.800 1.00 0.00 H new ATOM 0 HB3 GLN A 96 1.364 -3.509 2.218 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.325 -3.808 4.533 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.440 -5.054 4.007 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.239 -1.743 5.301 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.864 -1.712 5.994 1.00 0.00 H new ATOM 750 N ALA A 97 3.497 -1.790 0.332 1.00 0.00 N ATOM 751 CA ALA A 97 4.013 -0.685 -0.481 1.00 0.00 C ATOM 752 C ALA A 97 2.961 0.425 -0.567 1.00 0.00 C ATOM 753 O ALA A 97 1.778 0.184 -0.349 1.00 0.00 O ATOM 754 CB ALA A 97 4.266 -1.242 -1.897 1.00 0.00 C ATOM 0 H ALA A 97 2.478 -1.791 0.366 1.00 0.00 H new ATOM 0 HA ALA A 97 4.925 -0.278 -0.044 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.652 -0.448 -2.537 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.993 -2.052 -1.845 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.331 -1.620 -2.312 1.00 0.00 H new ATOM 760 N PHE A 98 3.387 1.621 -0.967 1.00 0.00 N ATOM 761 CA PHE A 98 2.527 2.693 -1.469 1.00 0.00 C ATOM 762 C PHE A 98 2.759 2.814 -2.987 1.00 0.00 C ATOM 763 O PHE A 98 3.875 2.570 -3.448 1.00 0.00 O ATOM 764 CB PHE A 98 2.919 4.041 -0.856 1.00 0.00 C ATOM 765 CG PHE A 98 2.534 4.361 0.579 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.200 3.356 1.511 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.558 5.706 1.003 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.933 3.695 2.843 1.00 0.00 C ATOM 769 CE2 PHE A 98 2.246 6.052 2.316 1.00 0.00 C ATOM 770 CZ PHE A 98 1.955 5.039 3.224 1.00 0.00 C ATOM 0 H PHE A 98 4.373 1.880 -0.950 1.00 0.00 H new ATOM 0 HA PHE A 98 1.493 2.458 -1.217 1.00 0.00 H new ATOM 0 HB2 PHE A 98 4.003 4.128 -0.928 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.494 4.821 -1.488 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.150 2.324 1.197 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.823 6.480 0.298 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.712 2.926 3.568 1.00 0.00 H new ATOM 0 HE2 PHE A 98 2.230 7.087 2.623 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.740 5.298 4.250 1.00 0.00 H new ATOM 780 N ILE A 99 1.782 3.319 -3.742 1.00 0.00 N ATOM 781 CA ILE A 99 1.959 3.792 -5.118 1.00 0.00 C ATOM 782 C ILE A 99 1.245 5.145 -5.268 1.00 0.00 C ATOM 783 O ILE A 99 0.068 5.277 -4.922 1.00 0.00 O ATOM 784 CB ILE A 99 1.541 2.693 -6.122 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.769 3.181 -7.566 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.107 2.185 -5.895 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.646 2.068 -8.618 1.00 0.00 C ATOM 0 H ILE A 99 0.823 3.413 -3.407 1.00 0.00 H new ATOM 0 HA ILE A 99 3.007 3.980 -5.353 1.00 0.00 H new ATOM 0 HB ILE A 99 2.180 1.827 -5.948 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.048 3.966 -7.794 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.760 3.629 -7.637 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.127 1.416 -6.631 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.024 1.766 -4.892 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.593 3.013 -6.001 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.819 2.485 -9.610 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.386 1.293 -8.416 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.646 1.636 -8.575 1.00 0.00 H new ATOM 799 N GLU A 100 1.986 6.168 -5.694 1.00 0.00 N ATOM 800 CA GLU A 100 1.626 7.592 -5.639 1.00 0.00 C ATOM 801 C GLU A 100 1.618 8.223 -7.016 1.00 0.00 C ATOM 802 O GLU A 100 2.606 8.235 -7.758 1.00 0.00 O ATOM 803 CB GLU A 100 2.583 8.342 -4.716 1.00 0.00 C ATOM 804 CG GLU A 100 2.648 9.883 -4.852 1.00 0.00 C ATOM 805 CD GLU A 100 1.389 10.632 -4.381 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.822 10.265 -3.329 1.00 0.00 O ATOM 807 OE2 GLU A 100 1.010 11.636 -5.029 1.00 0.00 O ATOM 0 H GLU A 100 2.905 6.021 -6.111 1.00 0.00 H new ATOM 0 HA GLU A 100 0.614 7.663 -5.240 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.311 8.106 -3.687 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.586 7.947 -4.879 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.503 10.247 -4.283 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.831 10.133 -5.897 1.00 0.00 H new ATOM 814 N MET A 101 0.453 8.763 -7.331 1.00 0.00 N ATOM 815 CA MET A 101 0.092 9.135 -8.682 1.00 0.00 C ATOM 816 C MET A 101 -0.624 10.475 -8.765 1.00 0.00 C ATOM 817 O MET A 101 -1.313 10.932 -7.859 1.00 0.00 O ATOM 818 CB MET A 101 -0.672 8.003 -9.353 1.00 0.00 C ATOM 819 CG MET A 101 -1.542 7.146 -8.446 1.00 0.00 C ATOM 820 SD MET A 101 -2.608 6.031 -9.375 1.00 0.00 S ATOM 821 CE MET A 101 -1.606 5.634 -10.828 1.00 0.00 C ATOM 0 H MET A 101 -0.276 8.957 -6.644 1.00 0.00 H new ATOM 0 HA MET A 101 1.015 9.289 -9.241 1.00 0.00 H new ATOM 0 HB2 MET A 101 -1.306 8.431 -10.130 1.00 0.00 H new ATOM 0 HB3 MET A 101 0.047 7.353 -9.851 1.00 0.00 H new ATOM 0 HG2 MET A 101 -0.905 6.565 -7.779 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.155 7.792 -7.818 1.00 0.00 H new ATOM 0 HE1 MET A 101 -2.086 4.835 -11.393 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.512 6.519 -11.458 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.616 5.309 -10.509 1.00 0.00 H new ATOM 831 N ASN A 102 -0.410 11.107 -9.909 1.00 0.00 N ATOM 832 CA ASN A 102 -0.508 12.548 -10.114 1.00 0.00 C ATOM 833 C ASN A 102 -1.942 13.107 -10.028 1.00 0.00 C ATOM 834 O ASN A 102 -2.112 14.312 -9.837 1.00 0.00 O ATOM 835 CB ASN A 102 0.143 12.836 -11.478 1.00 0.00 C ATOM 836 CG ASN A 102 -0.779 12.647 -12.666 1.00 0.00 C ATOM 837 OD1 ASN A 102 -1.435 11.511 -12.775 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.882 13.506 -13.530 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.151 10.608 -10.760 1.00 0.00 H new ATOM 0 HA ASN A 102 0.009 13.062 -9.304 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.513 13.861 -11.481 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.008 12.184 -11.598 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.371 14.384 -13.440 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.479 13.344 -14.341 1.00 0.00 H new ATOM 845 N THR A 103 -2.958 12.247 -10.168 1.00 0.00 N ATOM 846 CA THR A 103 -4.372 12.619 -10.201 1.00 0.00 C ATOM 847 C THR A 103 -5.237 11.652 -9.404 1.00 0.00 C ATOM 848 O THR A 103 -5.059 10.427 -9.398 1.00 0.00 O ATOM 849 CB THR A 103 -4.925 12.755 -11.634 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.034 11.511 -12.292 1.00 0.00 O ATOM 851 CG2 THR A 103 -4.073 13.657 -12.520 1.00 0.00 C ATOM 0 H THR A 103 -2.811 11.242 -10.264 1.00 0.00 H new ATOM 0 HA THR A 103 -4.421 13.601 -9.731 1.00 0.00 H new ATOM 0 HB THR A 103 -5.911 13.198 -11.496 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.390 11.648 -13.195 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.515 13.712 -13.515 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.029 14.656 -12.087 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.065 13.249 -12.593 1.00 0.00 H new ATOM 859 N GLU A 104 -6.217 12.242 -8.729 1.00 0.00 N ATOM 860 CA GLU A 104 -7.242 11.556 -7.950 1.00 0.00 C ATOM 861 C GLU A 104 -8.020 10.567 -8.827 1.00 0.00 C ATOM 862 O GLU A 104 -8.344 9.472 -8.380 1.00 0.00 O ATOM 863 CB GLU A 104 -8.221 12.566 -7.316 1.00 0.00 C ATOM 864 CG GLU A 104 -7.561 13.767 -6.616 1.00 0.00 C ATOM 865 CD GLU A 104 -7.288 14.934 -7.582 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.170 15.803 -7.770 1.00 0.00 O ATOM 867 OE2 GLU A 104 -6.168 14.978 -8.149 1.00 0.00 O ATOM 0 H GLU A 104 -6.324 13.256 -8.709 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.739 11.006 -7.154 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.886 12.940 -8.094 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.842 12.040 -6.591 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.206 14.112 -5.808 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.623 13.448 -6.162 1.00 0.00 H new ATOM 874 N GLU A 105 -8.278 10.928 -10.088 1.00 0.00 N ATOM 875 CA GLU A 105 -9.010 10.093 -11.041 1.00 0.00 C ATOM 876 C GLU A 105 -8.213 8.891 -11.542 1.00 0.00 C ATOM 877 O GLU A 105 -8.778 7.800 -11.618 1.00 0.00 O ATOM 878 CB GLU A 105 -9.477 10.909 -12.255 1.00 0.00 C ATOM 879 CG GLU A 105 -10.523 11.980 -11.919 1.00 0.00 C ATOM 880 CD GLU A 105 -11.848 11.367 -11.422 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.668 10.916 -12.260 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.082 11.332 -10.191 1.00 0.00 O ATOM 0 H GLU A 105 -7.979 11.821 -10.479 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.867 9.717 -10.483 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.612 11.390 -12.711 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.893 10.230 -12.999 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.124 12.647 -11.155 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.715 12.587 -12.803 1.00 0.00 H new ATOM 889 N ALA A 106 -6.917 9.045 -11.843 1.00 0.00 N ATOM 890 CA ALA A 106 -6.054 7.903 -12.122 1.00 0.00 C ATOM 891 C ALA A 106 -6.105 6.920 -10.969 1.00 0.00 C ATOM 892 O ALA A 106 -6.379 5.751 -11.185 1.00 0.00 O ATOM 893 CB ALA A 106 -4.603 8.319 -12.329 1.00 0.00 C ATOM 0 H ALA A 106 -6.449 9.950 -11.898 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.422 7.444 -13.040 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.997 7.436 -12.534 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.538 9.007 -13.172 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.234 8.812 -11.429 1.00 0.00 H new ATOM 899 N ALA A 107 -5.872 7.371 -9.742 1.00 0.00 N ATOM 900 CA ALA A 107 -5.877 6.448 -8.619 1.00 0.00 C ATOM 901 C ALA A 107 -7.252 5.866 -8.276 1.00 0.00 C ATOM 902 O ALA A 107 -7.343 4.682 -7.967 1.00 0.00 O ATOM 903 CB ALA A 107 -5.300 7.176 -7.443 1.00 0.00 C ATOM 0 H ALA A 107 -5.682 8.345 -9.505 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.280 5.579 -8.896 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.286 6.515 -6.577 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.283 7.492 -7.674 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.911 8.051 -7.222 1.00 0.00 H new ATOM 909 N ASN A 108 -8.329 6.647 -8.392 1.00 0.00 N ATOM 910 CA ASN A 108 -9.696 6.148 -8.290 1.00 0.00 C ATOM 911 C ASN A 108 -9.934 5.018 -9.305 1.00 0.00 C ATOM 912 O ASN A 108 -10.356 3.927 -8.922 1.00 0.00 O ATOM 913 CB ASN A 108 -10.668 7.320 -8.493 1.00 0.00 C ATOM 914 CG ASN A 108 -12.118 6.865 -8.463 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.713 6.533 -9.477 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.726 6.812 -7.298 1.00 0.00 N ATOM 0 H ASN A 108 -8.273 7.651 -8.561 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.868 5.723 -7.301 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.505 8.066 -7.715 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.459 7.804 -9.447 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.693 6.494 -7.242 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.230 7.089 -6.451 1.00 0.00 H new ATOM 923 N THR A 109 -9.599 5.241 -10.578 1.00 0.00 N ATOM 924 CA THR A 109 -9.679 4.200 -11.597 1.00 0.00 C ATOM 925 C THR A 109 -8.716 3.054 -11.292 1.00 0.00 C ATOM 926 O THR A 109 -9.091 1.911 -11.510 1.00 0.00 O ATOM 927 CB THR A 109 -9.510 4.775 -13.020 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.513 4.241 -13.864 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.181 4.483 -13.712 1.00 0.00 C ATOM 0 H THR A 109 -9.268 6.141 -10.926 1.00 0.00 H new ATOM 0 HA THR A 109 -10.683 3.776 -11.567 1.00 0.00 H new ATOM 0 HB THR A 109 -9.570 5.853 -12.873 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.409 4.606 -14.767 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.179 4.937 -14.703 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.364 4.898 -13.121 1.00 0.00 H new ATOM 0 HG23 THR A 109 -8.049 3.405 -13.806 1.00 0.00 H new ATOM 937 N MET A 110 -7.526 3.316 -10.728 1.00 0.00 N ATOM 938 CA MET A 110 -6.500 2.310 -10.453 1.00 0.00 C ATOM 939 C MET A 110 -6.972 1.333 -9.371 1.00 0.00 C ATOM 940 O MET A 110 -6.949 0.117 -9.542 1.00 0.00 O ATOM 941 CB MET A 110 -5.134 2.939 -10.061 1.00 0.00 C ATOM 942 CG MET A 110 -4.063 1.937 -10.520 1.00 0.00 C ATOM 943 SD MET A 110 -2.327 2.339 -10.236 1.00 0.00 S ATOM 944 CE MET A 110 -2.374 2.781 -8.497 1.00 0.00 C ATOM 0 H MET A 110 -7.249 4.256 -10.446 1.00 0.00 H new ATOM 0 HA MET A 110 -6.343 1.762 -11.382 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.996 3.907 -10.544 1.00 0.00 H new ATOM 0 HB3 MET A 110 -5.076 3.108 -8.986 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.267 0.986 -10.029 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.195 1.778 -11.590 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.398 3.158 -8.191 1.00 0.00 H new ATOM 0 HE2 MET A 110 -3.127 3.553 -8.338 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.625 1.901 -7.905 1.00 0.00 H new ATOM 954 N VAL A 111 -7.440 1.873 -8.248 1.00 0.00 N ATOM 955 CA VAL A 111 -7.954 1.110 -7.107 1.00 0.00 C ATOM 956 C VAL A 111 -9.205 0.304 -7.479 1.00 0.00 C ATOM 957 O VAL A 111 -9.325 -0.858 -7.089 1.00 0.00 O ATOM 958 CB VAL A 111 -8.172 2.063 -5.913 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.575 2.622 -5.771 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.796 1.393 -4.595 1.00 0.00 C ATOM 0 H VAL A 111 -7.474 2.882 -8.100 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.217 0.365 -6.806 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.516 2.904 -6.138 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.619 3.278 -4.902 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.834 3.187 -6.666 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.282 1.802 -5.643 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.961 2.090 -3.773 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.413 0.506 -4.449 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.745 1.104 -4.621 1.00 0.00 H new ATOM 970 N ASN A 112 -10.106 0.876 -8.289 1.00 0.00 N ATOM 971 CA ASN A 112 -11.309 0.193 -8.769 1.00 0.00 C ATOM 972 C ASN A 112 -10.949 -0.910 -9.779 1.00 0.00 C ATOM 973 O ASN A 112 -11.388 -2.051 -9.640 1.00 0.00 O ATOM 974 CB ASN A 112 -12.298 1.221 -9.342 1.00 0.00 C ATOM 975 CG ASN A 112 -13.088 1.928 -8.249 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.266 1.673 -8.050 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.480 2.809 -7.489 1.00 0.00 N ATOM 0 H ASN A 112 -10.017 1.833 -8.631 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.800 -0.305 -7.933 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.753 1.959 -9.930 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.988 0.720 -10.021 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.991 3.275 -6.739 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.497 3.028 -7.648 1.00 0.00 H new ATOM 984 N TYR A 113 -10.060 -0.614 -10.729 1.00 0.00 N ATOM 985 CA TYR A 113 -9.418 -1.595 -11.602 1.00 0.00 C ATOM 986 C TYR A 113 -8.800 -2.767 -10.819 1.00 0.00 C ATOM 987 O TYR A 113 -8.898 -3.907 -11.256 1.00 0.00 O ATOM 988 CB TYR A 113 -8.374 -0.874 -12.471 1.00 0.00 C ATOM 989 CG TYR A 113 -7.363 -1.779 -13.133 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.680 -2.420 -14.340 1.00 0.00 C ATOM 991 CD2 TYR A 113 -6.109 -1.972 -12.530 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.768 -3.320 -14.922 1.00 0.00 C ATOM 993 CE2 TYR A 113 -5.206 -2.885 -13.094 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.529 -3.567 -14.290 1.00 0.00 C ATOM 995 OH TYR A 113 -4.645 -4.436 -14.853 1.00 0.00 O ATOM 0 H TYR A 113 -9.759 0.342 -10.916 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.177 -2.043 -12.243 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.894 -0.308 -13.244 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.843 -0.152 -11.851 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.625 -2.222 -14.823 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.842 -1.422 -11.640 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -7.014 -3.819 -15.847 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -4.257 -3.068 -12.612 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.842 -4.493 -14.295 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.272 -2.560 -9.610 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.627 -3.598 -8.825 1.00 0.00 C ATOM 1007 C TYR A 114 -8.569 -4.314 -7.871 1.00 0.00 C ATOM 1008 O TYR A 114 -8.222 -5.397 -7.401 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.421 -3.029 -8.080 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.191 -2.838 -8.934 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.723 -3.909 -9.717 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.463 -1.639 -8.857 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.486 -3.806 -10.369 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.246 -1.516 -9.549 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.756 -2.602 -10.303 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.613 -2.474 -11.020 1.00 0.00 O ATOM 0 H TYR A 114 -8.284 -1.651 -9.148 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.290 -4.356 -9.532 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.698 -2.069 -7.645 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.174 -3.694 -7.253 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.314 -4.807 -9.816 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.837 -0.815 -8.268 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -3.093 -4.647 -10.921 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.688 -0.593 -9.503 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.671 -1.678 -11.588 1.00 0.00 H new ATOM 1026 N THR A 115 -9.782 -3.788 -7.668 1.00 0.00 N ATOM 1027 CA THR A 115 -10.847 -4.567 -7.035 1.00 0.00 C ATOM 1028 C THR A 115 -11.618 -5.414 -8.063 1.00 0.00 C ATOM 1029 O THR A 115 -12.304 -6.382 -7.728 1.00 0.00 O ATOM 1030 CB THR A 115 -11.730 -3.725 -6.097 1.00 0.00 C ATOM 1031 OG1 THR A 115 -12.264 -4.555 -5.088 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.898 -2.984 -6.738 1.00 0.00 C ATOM 0 H THR A 115 -10.047 -2.838 -7.930 1.00 0.00 H new ATOM 0 HA THR A 115 -10.375 -5.287 -6.367 1.00 0.00 H new ATOM 0 HB THR A 115 -11.054 -2.956 -5.724 1.00 0.00 H new ATOM 0 HG1 THR A 115 -12.826 -4.021 -4.488 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.441 -2.429 -5.973 1.00 0.00 H new ATOM 0 HG22 THR A 115 -12.521 -2.291 -7.490 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.569 -3.702 -7.210 1.00 0.00 H new ATOM 1040 N SER A 116 -11.416 -5.091 -9.345 1.00 0.00 N ATOM 1041 CA SER A 116 -11.792 -5.842 -10.542 1.00 0.00 C ATOM 1042 C SER A 116 -10.835 -7.012 -10.793 1.00 0.00 C ATOM 1043 O SER A 116 -11.263 -8.166 -10.897 1.00 0.00 O ATOM 1044 CB SER A 116 -11.721 -4.884 -11.749 1.00 0.00 C ATOM 1045 OG SER A 116 -12.969 -4.780 -12.419 1.00 0.00 O ATOM 0 H SER A 116 -10.944 -4.221 -9.590 1.00 0.00 H new ATOM 0 HA SER A 116 -12.796 -6.243 -10.404 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.408 -3.896 -11.410 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.962 -5.237 -12.448 1.00 0.00 H new ATOM 0 HG SER A 116 -12.884 -4.163 -13.176 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.543 -6.698 -10.953 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.587 -7.533 -11.690 1.00 0.00 C ATOM 1053 C VAL A 117 -7.844 -8.525 -10.784 1.00 0.00 C ATOM 1054 O VAL A 117 -7.771 -9.719 -11.078 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.624 -6.612 -12.492 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.373 -6.177 -11.782 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -7.255 -7.220 -13.837 1.00 0.00 C ATOM 0 H VAL A 117 -9.128 -5.848 -10.570 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.137 -8.160 -12.392 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.213 -5.705 -12.627 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.783 -5.540 -12.441 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.639 -5.621 -10.883 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.788 -7.054 -11.506 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.581 -6.547 -14.368 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.761 -8.179 -13.680 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -8.158 -7.370 -14.429 1.00 0.00 H new ATOM 1067 N THR A 118 -7.312 -7.991 -9.683 1.00 0.00 N ATOM 1068 CA THR A 118 -6.139 -8.408 -8.883 1.00 0.00 C ATOM 1069 C THR A 118 -4.893 -8.759 -9.739 1.00 0.00 C ATOM 1070 O THR A 118 -4.995 -9.574 -10.656 1.00 0.00 O ATOM 1071 CB THR A 118 -6.482 -9.521 -7.879 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.754 -9.316 -7.293 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.480 -9.496 -6.726 1.00 0.00 C ATOM 0 H THR A 118 -7.737 -7.158 -9.276 1.00 0.00 H new ATOM 0 HA THR A 118 -5.859 -7.528 -8.304 1.00 0.00 H new ATOM 0 HB THR A 118 -6.461 -10.463 -8.428 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.944 -10.041 -6.661 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.724 -10.285 -6.015 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.474 -9.656 -7.115 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.526 -8.529 -6.225 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.698 -8.164 -9.509 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.554 -8.350 -10.413 1.00 0.00 C ATOM 1083 C PRO A 119 -1.813 -9.689 -10.285 1.00 0.00 C ATOM 1084 O PRO A 119 -1.029 -10.021 -11.172 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.606 -7.177 -10.142 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.935 -6.730 -8.722 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.365 -7.208 -8.463 1.00 0.00 C ATOM 0 HA PRO A 119 -2.931 -8.374 -11.435 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.563 -7.483 -10.229 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.762 -6.369 -10.857 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.240 -7.164 -8.003 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.860 -5.647 -8.624 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.443 -7.672 -7.480 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.059 -6.368 -8.475 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.071 -10.436 -9.203 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.598 -11.793 -8.848 1.00 0.00 C ATOM 1097 C VAL A 120 -0.217 -12.144 -9.401 1.00 0.00 C ATOM 1098 O VAL A 120 -0.024 -12.610 -10.524 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.619 -12.866 -9.200 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.295 -14.140 -8.437 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -4.039 -12.450 -8.817 1.00 0.00 C ATOM 0 H VAL A 120 -2.682 -10.070 -8.472 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.485 -11.770 -7.764 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.569 -13.018 -10.278 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.025 -14.910 -8.688 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.297 -14.484 -8.710 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.330 -13.942 -7.366 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.736 -13.244 -9.086 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.089 -12.272 -7.743 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.307 -11.537 -9.349 1.00 0.00 H new ATOM 1111 N LEU A 121 0.771 -11.866 -8.567 1.00 0.00 N ATOM 1112 CA LEU A 121 1.955 -11.128 -9.026 1.00 0.00 C ATOM 1113 C LEU A 121 3.121 -12.107 -9.226 1.00 0.00 C ATOM 1114 O LEU A 121 3.625 -12.263 -10.340 1.00 0.00 O ATOM 1115 CB LEU A 121 2.152 -9.953 -8.040 1.00 0.00 C ATOM 1116 CG LEU A 121 3.410 -9.068 -8.176 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.326 -7.948 -7.133 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.709 -9.829 -7.932 1.00 0.00 C ATOM 0 H LEU A 121 0.786 -12.131 -7.582 1.00 0.00 H new ATOM 0 HA LEU A 121 1.858 -10.671 -10.011 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.281 -9.303 -8.124 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.146 -10.365 -7.031 1.00 0.00 H new ATOM 0 HG LEU A 121 3.430 -8.692 -9.199 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.206 -7.310 -7.212 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.430 -7.353 -7.309 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.282 -8.383 -6.135 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.555 -9.150 -8.043 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.705 -10.242 -6.923 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.797 -10.640 -8.655 1.00 0.00 H new ATOM 1130 N ARG A 122 3.478 -12.837 -8.161 1.00 0.00 N ATOM 1131 CA ARG A 122 4.348 -14.032 -8.179 1.00 0.00 C ATOM 1132 C ARG A 122 3.576 -15.355 -8.348 1.00 0.00 C ATOM 1133 O ARG A 122 4.153 -16.438 -8.226 1.00 0.00 O ATOM 1134 CB ARG A 122 5.287 -14.016 -6.957 1.00 0.00 C ATOM 1135 CG ARG A 122 4.729 -14.490 -5.604 1.00 0.00 C ATOM 1136 CD ARG A 122 3.425 -13.812 -5.158 1.00 0.00 C ATOM 1137 NE ARG A 122 3.254 -13.907 -3.693 1.00 0.00 N ATOM 1138 CZ ARG A 122 2.456 -13.159 -2.954 1.00 0.00 C ATOM 1139 NH1 ARG A 122 1.425 -12.542 -3.449 1.00 0.00 N ATOM 1140 NH2 ARG A 122 2.680 -12.992 -1.687 1.00 0.00 N ATOM 0 H ARG A 122 3.157 -12.605 -7.221 1.00 0.00 H new ATOM 0 HA ARG A 122 4.967 -13.981 -9.075 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.153 -14.634 -7.195 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.649 -12.996 -6.829 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.561 -15.566 -5.656 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.487 -14.323 -4.838 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.434 -12.765 -5.460 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.577 -14.281 -5.658 1.00 0.00 H new ATOM 0 HE ARG A 122 3.804 -14.616 -3.208 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.208 -12.627 -4.442 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.832 -11.973 -2.844 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.483 -13.442 -1.247 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.053 -12.411 -1.131 1.00 0.00 H new ATOM 1154 N GLY A 123 2.268 -15.258 -8.593 1.00 0.00 N ATOM 1155 CA GLY A 123 1.334 -16.377 -8.749 1.00 0.00 C ATOM 1156 C GLY A 123 0.433 -16.648 -7.536 1.00 0.00 C ATOM 1157 O GLY A 123 -0.089 -17.755 -7.408 1.00 0.00 O ATOM 0 H GLY A 123 1.808 -14.353 -8.693 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.702 -16.184 -9.616 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.906 -17.279 -8.966 1.00 0.00 H new ATOM 1161 N GLN A 124 0.244 -15.666 -6.643 1.00 0.00 N ATOM 1162 CA GLN A 124 -0.592 -15.761 -5.451 1.00 0.00 C ATOM 1163 C GLN A 124 -1.239 -14.400 -5.145 1.00 0.00 C ATOM 1164 O GLN A 124 -0.571 -13.397 -5.408 1.00 0.00 O ATOM 1165 CB GLN A 124 0.308 -16.277 -4.318 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.338 -16.389 -2.935 1.00 0.00 C ATOM 1167 CD GLN A 124 -1.261 -17.599 -2.755 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -1.738 -18.223 -3.694 1.00 0.00 O ATOM 1169 NE2 GLN A 124 -1.570 -17.974 -1.532 1.00 0.00 N ATOM 0 H GLN A 124 0.688 -14.753 -6.740 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.423 -16.453 -5.586 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.684 -17.260 -4.601 1.00 0.00 H new ATOM 0 HB3 GLN A 124 1.172 -15.617 -4.240 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.450 -16.436 -2.184 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -0.910 -15.481 -2.741 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -1.186 -17.471 -0.732 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -2.193 -18.768 -1.384 1.00 0.00 H new ATOM 1178 N PRO A 125 -2.511 -14.334 -4.683 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.308 -13.102 -4.604 1.00 0.00 C ATOM 1180 C PRO A 125 -2.653 -11.920 -3.881 1.00 0.00 C ATOM 1181 O PRO A 125 -1.903 -12.082 -2.915 1.00 0.00 O ATOM 1182 CB PRO A 125 -4.620 -13.495 -3.920 1.00 0.00 C ATOM 1183 CG PRO A 125 -4.811 -14.936 -4.377 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.377 -15.465 -4.364 1.00 0.00 C ATOM 0 HA PRO A 125 -3.440 -12.723 -5.617 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -4.551 -13.419 -2.835 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -5.447 -12.857 -4.232 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.459 -15.496 -3.702 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.258 -14.994 -5.369 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.127 -15.881 -3.388 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.253 -16.265 -5.093 1.00 0.00 H new ATOM 1192 N ILE A 126 -2.989 -10.717 -4.361 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.475 -9.411 -3.904 1.00 0.00 C ATOM 1194 C ILE A 126 -3.645 -8.589 -3.358 1.00 0.00 C ATOM 1195 O ILE A 126 -4.784 -8.766 -3.788 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.765 -8.634 -5.046 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.034 -9.516 -6.075 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.747 -7.632 -4.494 1.00 0.00 C ATOM 1199 CD1 ILE A 126 0.007 -10.442 -5.474 1.00 0.00 C ATOM 0 H ILE A 126 -3.663 -10.618 -5.120 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.733 -9.584 -3.125 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.584 -8.131 -5.559 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.770 -10.115 -6.611 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.550 -8.872 -6.810 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.269 -7.106 -5.321 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.256 -6.913 -3.852 1.00 0.00 H new ATOM 0 HG23 ILE A 126 0.009 -8.163 -3.916 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.474 -11.027 -6.266 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.767 -9.852 -4.962 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.472 -11.113 -4.761 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.377 -7.673 -2.436 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.395 -6.873 -1.760 1.00 0.00 C ATOM 1213 C TYR A 127 -4.122 -5.375 -1.974 1.00 0.00 C ATOM 1214 O TYR A 127 -2.973 -4.943 -1.931 1.00 0.00 O ATOM 1215 CB TYR A 127 -4.332 -7.202 -0.267 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.654 -8.597 0.235 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -5.303 -9.584 -0.538 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.249 -8.902 1.544 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -5.534 -10.866 0.002 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.465 -10.180 2.087 1.00 0.00 C ATOM 1221 CZ TYR A 127 -5.118 -11.166 1.319 1.00 0.00 C ATOM 1222 OH TYR A 127 -5.321 -12.403 1.848 1.00 0.00 O ATOM 0 H TYR A 127 -2.428 -7.460 -2.130 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.382 -7.101 -2.163 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.323 -6.965 0.071 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -5.008 -6.515 0.241 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -5.623 -9.357 -1.544 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -3.765 -8.144 2.142 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -6.030 -11.620 -0.592 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -4.132 -10.406 3.089 1.00 0.00 H new ATOM 0 HH TYR A 127 -4.970 -12.429 2.763 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.168 -4.567 -2.148 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.099 -3.100 -2.214 1.00 0.00 C ATOM 1234 C ILE A 128 -6.153 -2.441 -1.306 1.00 0.00 C ATOM 1235 O ILE A 128 -7.275 -2.937 -1.177 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.199 -2.672 -3.709 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.795 -2.252 -4.185 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.242 -1.577 -3.995 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.712 -1.910 -5.676 1.00 0.00 C ATOM 0 H ILE A 128 -6.118 -4.923 -2.251 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.144 -2.746 -1.825 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.560 -3.532 -4.273 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.472 -1.386 -3.607 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.094 -3.059 -3.970 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.241 -1.343 -5.060 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.230 -1.931 -3.702 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -5.994 -0.681 -3.427 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.690 -1.625 -5.928 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -4.002 -2.780 -6.265 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.385 -1.081 -5.897 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.820 -1.269 -0.759 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.780 -0.180 -0.504 1.00 0.00 C ATOM 1253 C GLN A 129 -6.085 1.178 -0.659 1.00 0.00 C ATOM 1254 O GLN A 129 -4.863 1.274 -0.599 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.423 -0.292 0.898 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.937 -0.554 0.811 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.634 -0.456 2.171 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.193 -1.008 3.175 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -10.757 0.230 2.248 1.00 0.00 N ATOM 0 H GLN A 129 -4.867 -1.042 -0.476 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.580 -0.266 -1.239 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.945 -1.099 1.454 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.244 0.628 1.455 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.387 0.163 0.125 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.106 -1.546 0.391 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -11.130 0.692 1.419 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.252 0.299 3.137 1.00 0.00 H new ATOM 1268 N PHE A 130 -6.867 2.247 -0.816 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.375 3.627 -0.743 1.00 0.00 C ATOM 1270 C PHE A 130 -5.595 3.901 0.567 1.00 0.00 C ATOM 1271 O PHE A 130 -5.904 3.335 1.623 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.575 4.573 -0.869 1.00 0.00 C ATOM 1273 CG PHE A 130 -7.800 5.227 -2.220 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -6.817 6.071 -2.769 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.042 5.100 -2.870 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.057 6.755 -3.974 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.289 5.801 -4.065 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.294 6.622 -4.626 1.00 0.00 C ATOM 0 H PHE A 130 -7.868 2.181 -0.999 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.672 3.795 -1.559 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.475 4.015 -0.609 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.463 5.362 -0.125 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -5.872 6.194 -2.261 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -9.807 4.463 -2.451 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.289 7.384 -4.399 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.247 5.708 -4.554 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.480 7.146 -5.552 1.00 0.00 H new ATOM 1288 N SER A 131 -4.588 4.779 0.514 1.00 0.00 N ATOM 1289 CA SER A 131 -3.796 5.158 1.694 1.00 0.00 C ATOM 1290 C SER A 131 -4.564 6.095 2.630 1.00 0.00 C ATOM 1291 O SER A 131 -5.148 7.086 2.193 1.00 0.00 O ATOM 1292 CB SER A 131 -2.473 5.813 1.295 1.00 0.00 C ATOM 1293 OG SER A 131 -1.800 6.328 2.430 1.00 0.00 O ATOM 0 H SER A 131 -4.298 5.247 -0.345 1.00 0.00 H new ATOM 0 HA SER A 131 -3.589 4.231 2.229 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.839 5.083 0.792 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.661 6.617 0.583 1.00 0.00 H new ATOM 0 HG SER A 131 -1.597 5.597 3.050 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.532 5.817 3.936 1.00 0.00 N ATOM 1300 CA ASN A 132 -5.171 6.680 4.934 1.00 0.00 C ATOM 1301 C ASN A 132 -4.490 8.063 5.091 1.00 0.00 C ATOM 1302 O ASN A 132 -5.130 9.004 5.571 1.00 0.00 O ATOM 1303 CB ASN A 132 -5.296 5.923 6.269 1.00 0.00 C ATOM 1304 CG ASN A 132 -3.971 5.735 6.985 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -3.442 6.643 7.612 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.394 4.558 6.930 1.00 0.00 N ATOM 0 H ASN A 132 -4.068 4.998 4.328 1.00 0.00 H new ATOM 0 HA ASN A 132 -6.171 6.917 4.572 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -5.979 6.465 6.922 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -5.741 4.946 6.083 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -2.507 4.402 7.409 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -3.832 3.799 6.408 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.227 8.218 4.668 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.471 9.470 4.808 1.00 0.00 C ATOM 1315 C HIS A 133 -2.984 10.602 3.908 1.00 0.00 C ATOM 1316 O HIS A 133 -3.204 11.707 4.407 1.00 0.00 O ATOM 1317 CB HIS A 133 -0.987 9.245 4.483 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.267 8.366 5.464 1.00 0.00 C ATOM 1319 ND1 HIS A 133 0.136 8.701 6.739 1.00 0.00 N ATOM 1320 CD2 HIS A 133 0.173 7.100 5.206 1.00 0.00 C ATOM 1321 CE1 HIS A 133 0.807 7.651 7.246 1.00 0.00 C ATOM 1322 NE2 HIS A 133 0.863 6.657 6.342 1.00 0.00 N ATOM 0 H HIS A 133 -2.698 7.472 4.216 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.607 9.773 5.846 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.907 8.803 3.490 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.485 10.212 4.443 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -0.043 9.586 7.213 1.00 0.00 H new ATOM 0 HD2 HIS A 133 0.018 6.542 4.294 1.00 0.00 H new ATOM 0 HE1 HIS A 133 1.238 7.612 8.235 1.00 0.00 H new ATOM 1330 N LYS A 134 -3.112 10.313 2.601 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.966 11.215 1.432 1.00 0.00 C ATOM 1332 C LYS A 134 -1.487 11.455 1.088 1.00 0.00 C ATOM 1333 O LYS A 134 -0.632 11.444 1.970 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.661 12.586 1.616 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.181 12.482 1.796 1.00 0.00 C ATOM 1336 CD LYS A 134 -5.784 13.712 2.497 1.00 0.00 C ATOM 1337 CE LYS A 134 -5.828 13.598 4.031 1.00 0.00 C ATOM 1338 NZ LYS A 134 -6.627 12.427 4.492 1.00 0.00 N ATOM 0 H LYS A 134 -3.339 9.364 2.304 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.463 10.695 0.613 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.234 13.087 2.484 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -3.448 13.212 0.749 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -5.650 12.359 0.820 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.413 11.589 2.376 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -5.204 14.594 2.225 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -6.796 13.870 2.125 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -4.811 13.515 4.416 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -6.253 14.511 4.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.201 12.701 5.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -7.252 12.109 3.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -5.986 11.653 4.759 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.231 11.740 -0.188 1.00 0.00 N ATOM 1353 CA GLU A 135 -0.012 12.311 -0.794 1.00 0.00 C ATOM 1354 C GLU A 135 1.348 11.880 -0.192 1.00 0.00 C ATOM 1355 O GLU A 135 1.856 12.480 0.761 1.00 0.00 O ATOM 1356 CB GLU A 135 -0.123 13.842 -0.846 1.00 0.00 C ATOM 1357 CG GLU A 135 -1.341 14.318 -1.646 1.00 0.00 C ATOM 1358 CD GLU A 135 -1.289 15.833 -1.871 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -1.489 16.610 -0.908 1.00 0.00 O ATOM 1360 OE2 GLU A 135 -1.076 16.254 -3.032 1.00 0.00 O ATOM 0 H GLU A 135 -1.938 11.562 -0.901 1.00 0.00 H new ATOM 0 HA GLU A 135 0.014 11.878 -1.794 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.185 14.233 0.170 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.783 14.253 -1.291 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -1.373 13.804 -2.607 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -2.256 14.056 -1.114 1.00 0.00 H new ATOM 1367 N LEU A 136 1.982 10.867 -0.797 1.00 0.00 N ATOM 1368 CA LEU A 136 3.337 10.394 -0.495 1.00 0.00 C ATOM 1369 C LEU A 136 4.395 11.464 -0.816 1.00 0.00 C ATOM 1370 O LEU A 136 4.659 11.755 -1.989 1.00 0.00 O ATOM 1371 CB LEU A 136 3.565 9.100 -1.295 1.00 0.00 C ATOM 1372 CG LEU A 136 4.981 8.510 -1.354 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.542 8.258 0.034 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.965 7.160 -2.069 1.00 0.00 C ATOM 0 H LEU A 136 1.543 10.331 -1.545 1.00 0.00 H new ATOM 0 HA LEU A 136 3.437 10.192 0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.906 8.336 -0.883 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.240 9.283 -2.319 1.00 0.00 H new ATOM 0 HG LEU A 136 5.597 9.237 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.545 7.840 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.585 9.197 0.585 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.899 7.555 0.564 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.976 6.754 -2.103 1.00 0.00 H new ATOM 0 HD22 LEU A 136 4.315 6.471 -1.530 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.592 7.291 -3.085 1.00 0.00 H new ATOM 1386 N LYS A 137 5.018 12.029 0.219 1.00 0.00 N ATOM 1387 CA LYS A 137 6.165 12.948 0.122 1.00 0.00 C ATOM 1388 C LYS A 137 7.479 12.193 0.346 1.00 0.00 C ATOM 1389 O LYS A 137 7.558 11.288 1.181 1.00 0.00 O ATOM 1390 CB LYS A 137 6.003 14.106 1.121 1.00 0.00 C ATOM 1391 CG LYS A 137 4.781 14.980 0.776 1.00 0.00 C ATOM 1392 CD LYS A 137 4.641 16.216 1.678 1.00 0.00 C ATOM 1393 CE LYS A 137 5.726 17.265 1.390 1.00 0.00 C ATOM 1394 NZ LYS A 137 5.537 18.495 2.202 1.00 0.00 N ATOM 0 H LYS A 137 4.732 11.857 1.183 1.00 0.00 H new ATOM 0 HA LYS A 137 6.196 13.372 -0.882 1.00 0.00 H new ATOM 0 HB2 LYS A 137 5.893 13.706 2.129 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.904 14.720 1.118 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.856 15.304 -0.262 1.00 0.00 H new ATOM 0 HG3 LYS A 137 3.877 14.376 0.857 1.00 0.00 H new ATOM 0 HD2 LYS A 137 3.657 16.662 1.531 1.00 0.00 H new ATOM 0 HD3 LYS A 137 4.700 15.911 2.723 1.00 0.00 H new ATOM 0 HE2 LYS A 137 6.707 16.839 1.599 1.00 0.00 H new ATOM 0 HE3 LYS A 137 5.710 17.523 0.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 6.289 19.178 1.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 4.611 18.916 1.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 5.578 18.253 3.213 1.00 0.00 H new ATOM 1408 N THR A 138 8.507 12.568 -0.413 1.00 0.00 N ATOM 1409 CA THR A 138 9.820 11.896 -0.469 1.00 0.00 C ATOM 1410 C THR A 138 10.974 12.908 -0.476 1.00 0.00 C ATOM 1411 O THR A 138 10.799 14.063 -0.870 1.00 0.00 O ATOM 1412 CB THR A 138 9.902 10.971 -1.700 1.00 0.00 C ATOM 1413 OG1 THR A 138 9.624 11.679 -2.898 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.896 9.817 -1.615 1.00 0.00 C ATOM 0 H THR A 138 8.455 13.377 -1.032 1.00 0.00 H new ATOM 0 HA THR A 138 9.920 11.290 0.432 1.00 0.00 H new ATOM 0 HB THR A 138 10.920 10.582 -1.711 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.984 11.183 -3.662 1.00 0.00 H new ATOM 0 HG21 THR A 138 8.987 9.189 -2.502 1.00 0.00 H new ATOM 0 HG22 THR A 138 9.101 9.221 -0.726 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.885 10.219 -1.557 1.00 0.00 H new ATOM 1422 N ASP A 139 12.156 12.496 -0.010 1.00 0.00 N ATOM 1423 CA ASP A 139 13.302 13.385 0.238 1.00 0.00 C ATOM 1424 C ASP A 139 14.027 13.820 -1.053 1.00 0.00 C ATOM 1425 O ASP A 139 14.056 15.012 -1.379 1.00 0.00 O ATOM 1426 CB ASP A 139 14.279 12.699 1.207 1.00 0.00 C ATOM 1427 CG ASP A 139 13.663 12.520 2.603 1.00 0.00 C ATOM 1428 OD1 ASP A 139 13.651 13.496 3.391 1.00 0.00 O ATOM 1429 OD2 ASP A 139 13.192 11.400 2.917 1.00 0.00 O ATOM 0 H ASP A 139 12.350 11.519 0.210 1.00 0.00 H new ATOM 0 HA ASP A 139 12.913 14.300 0.684 1.00 0.00 H new ATOM 0 HB2 ASP A 139 14.564 11.726 0.808 1.00 0.00 H new ATOM 0 HB3 ASP A 139 15.191 13.291 1.285 1.00 0.00 H new ATOM 1434 N SER A 140 14.647 12.877 -1.769 1.00 0.00 N ATOM 1435 CA SER A 140 15.436 13.108 -2.985 1.00 0.00 C ATOM 1436 C SER A 140 14.581 13.402 -4.231 1.00 0.00 C ATOM 1437 O SER A 140 13.394 13.063 -4.297 1.00 0.00 O ATOM 1438 CB SER A 140 16.349 11.900 -3.235 1.00 0.00 C ATOM 1439 OG SER A 140 15.609 10.686 -3.255 1.00 0.00 O ATOM 0 H SER A 140 14.612 11.892 -1.507 1.00 0.00 H new ATOM 0 HA SER A 140 16.030 14.006 -2.814 1.00 0.00 H new ATOM 0 HB2 SER A 140 16.870 12.026 -4.184 1.00 0.00 H new ATOM 0 HB3 SER A 140 17.111 11.851 -2.457 1.00 0.00 H new ATOM 0 HG SER A 140 16.217 9.935 -3.418 1.00 0.00 H new ATOM 1445 N SER A 141 15.196 14.017 -5.248 1.00 0.00 N ATOM 1446 CA SER A 141 14.624 14.192 -6.595 1.00 0.00 C ATOM 1447 C SER A 141 14.729 12.903 -7.444 1.00 0.00 C ATOM 1448 O SER A 141 15.552 12.030 -7.134 1.00 0.00 O ATOM 1449 CB SER A 141 15.342 15.349 -7.308 1.00 0.00 C ATOM 1450 OG SER A 141 16.744 15.118 -7.381 1.00 0.00 O ATOM 0 H SER A 141 16.129 14.418 -5.158 1.00 0.00 H new ATOM 0 HA SER A 141 13.564 14.421 -6.482 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.937 15.467 -8.313 1.00 0.00 H new ATOM 0 HB3 SER A 141 15.152 16.281 -6.776 1.00 0.00 H new ATOM 0 HG SER A 141 17.176 15.868 -7.841 1.00 0.00 H new ATOM 1456 N PRO A 142 13.936 12.756 -8.529 1.00 0.00 N ATOM 1457 CA PRO A 142 14.035 11.622 -9.457 1.00 0.00 C ATOM 1458 C PRO A 142 15.431 11.456 -10.084 1.00 0.00 C ATOM 1459 O PRO A 142 15.964 10.344 -10.132 1.00 0.00 O ATOM 1460 CB PRO A 142 12.968 11.870 -10.534 1.00 0.00 C ATOM 1461 CG PRO A 142 11.944 12.752 -9.829 1.00 0.00 C ATOM 1462 CD PRO A 142 12.805 13.601 -8.896 1.00 0.00 C ATOM 0 HA PRO A 142 13.871 10.689 -8.918 1.00 0.00 H new ATOM 0 HB2 PRO A 142 13.389 12.366 -11.409 1.00 0.00 H new ATOM 0 HB3 PRO A 142 12.523 10.937 -10.880 1.00 0.00 H new ATOM 0 HG2 PRO A 142 11.387 13.367 -10.536 1.00 0.00 H new ATOM 0 HG3 PRO A 142 11.214 12.160 -9.277 1.00 0.00 H new ATOM 0 HD2 PRO A 142 13.141 14.511 -9.393 1.00 0.00 H new ATOM 0 HD3 PRO A 142 12.242 13.908 -8.014 1.00 0.00 H new ATOM 1470 N ASN A 143 16.019 12.553 -10.579 1.00 0.00 N ATOM 1471 CA ASN A 143 17.333 12.603 -11.229 1.00 0.00 C ATOM 1472 C ASN A 143 17.919 14.032 -11.195 1.00 0.00 C ATOM 1473 O ASN A 143 17.184 15.014 -11.335 1.00 0.00 O ATOM 1474 CB ASN A 143 17.152 12.131 -12.687 1.00 0.00 C ATOM 1475 CG ASN A 143 18.429 12.208 -13.506 1.00 0.00 C ATOM 1476 OD1 ASN A 143 18.587 13.048 -14.378 1.00 0.00 O ATOM 1477 ND2 ASN A 143 19.391 11.351 -13.243 1.00 0.00 N ATOM 0 H ASN A 143 15.572 13.469 -10.535 1.00 0.00 H new ATOM 0 HA ASN A 143 18.033 11.957 -10.699 1.00 0.00 H new ATOM 0 HB2 ASN A 143 16.790 11.103 -12.687 1.00 0.00 H new ATOM 0 HB3 ASN A 143 16.384 12.739 -13.166 1.00 0.00 H new ATOM 0 HD21 ASN A 143 20.265 11.389 -13.767 1.00 0.00 H new ATOM 0 HD22 ASN A 143 19.263 10.648 -12.515 1.00 0.00 H new ATOM 1484 N GLN A 144 19.246 14.152 -11.076 1.00 0.00 N ATOM 1485 CA GLN A 144 19.988 15.399 -11.307 1.00 0.00 C ATOM 1486 C GLN A 144 20.216 15.606 -12.818 1.00 0.00 C ATOM 1487 O GLN A 144 21.157 15.061 -13.404 1.00 0.00 O ATOM 1488 CB GLN A 144 21.305 15.378 -10.510 1.00 0.00 C ATOM 1489 CG GLN A 144 22.032 16.730 -10.573 1.00 0.00 C ATOM 1490 CD GLN A 144 23.343 16.709 -9.785 1.00 0.00 C ATOM 1491 OE1 GLN A 144 24.424 16.500 -10.321 1.00 0.00 O ATOM 1492 NE2 GLN A 144 23.310 16.926 -8.486 1.00 0.00 N ATOM 0 H GLN A 144 19.847 13.371 -10.812 1.00 0.00 H new ATOM 0 HA GLN A 144 19.406 16.249 -10.951 1.00 0.00 H new ATOM 0 HB2 GLN A 144 21.097 15.126 -9.470 1.00 0.00 H new ATOM 0 HB3 GLN A 144 21.955 14.597 -10.903 1.00 0.00 H new ATOM 0 HG2 GLN A 144 22.237 16.984 -11.613 1.00 0.00 H new ATOM 0 HG3 GLN A 144 21.382 17.510 -10.177 1.00 0.00 H new ATOM 0 HE21 GLN A 144 22.419 17.102 -8.021 1.00 0.00 H new ATOM 0 HE22 GLN A 144 24.175 16.918 -7.945 1.00 0.00 H new ATOM 1501 N ALA A 145 19.324 16.364 -13.458 1.00 0.00 N ATOM 1502 CA ALA A 145 19.353 16.643 -14.895 1.00 0.00 C ATOM 1503 C ALA A 145 20.585 17.459 -15.353 1.00 0.00 C ATOM 1504 O ALA A 145 21.285 18.089 -14.550 1.00 0.00 O ATOM 1505 CB ALA A 145 18.051 17.371 -15.257 1.00 0.00 C ATOM 0 H ALA A 145 18.542 16.812 -12.980 1.00 0.00 H new ATOM 0 HA ALA A 145 19.437 15.692 -15.422 1.00 0.00 H new ATOM 0 HB1 ALA A 145 18.043 17.593 -16.324 1.00 0.00 H new ATOM 0 HB2 ALA A 145 17.199 16.737 -15.012 1.00 0.00 H new ATOM 0 HB3 ALA A 145 17.985 18.301 -14.692 1.00 0.00 H new ATOM 1511 N ARG A 146 20.821 17.476 -16.673 1.00 0.00 N ATOM 1512 CA ARG A 146 21.854 18.276 -17.357 1.00 0.00 C ATOM 1513 C ARG A 146 21.573 19.789 -17.256 1.00 0.00 C ATOM 1514 O ARG A 146 20.418 20.205 -17.115 1.00 0.00 O ATOM 1515 CB ARG A 146 21.923 17.791 -18.821 1.00 0.00 C ATOM 1516 CG ARG A 146 23.134 18.324 -19.606 1.00 0.00 C ATOM 1517 CD ARG A 146 23.236 17.706 -21.009 1.00 0.00 C ATOM 1518 NE ARG A 146 23.604 16.273 -20.970 1.00 0.00 N ATOM 1519 CZ ARG A 146 23.660 15.439 -21.993 1.00 0.00 C ATOM 1520 NH1 ARG A 146 23.384 15.814 -23.211 1.00 0.00 N ATOM 1521 NH2 ARG A 146 23.996 14.192 -21.814 1.00 0.00 N ATOM 1522 OXT ARG A 146 22.514 20.577 -17.318 1.00 0.00 O ATOM 0 H ARG A 146 20.276 16.910 -17.323 1.00 0.00 H new ATOM 0 HA ARG A 146 22.820 18.132 -16.874 1.00 0.00 H new ATOM 0 HB2 ARG A 146 21.950 16.701 -18.830 1.00 0.00 H new ATOM 0 HB3 ARG A 146 21.010 18.092 -19.335 1.00 0.00 H new ATOM 0 HG2 ARG A 146 23.059 19.408 -19.693 1.00 0.00 H new ATOM 0 HG3 ARG A 146 24.047 18.111 -19.050 1.00 0.00 H new ATOM 0 HD2 ARG A 146 22.281 17.819 -21.523 1.00 0.00 H new ATOM 0 HD3 ARG A 146 23.978 18.253 -21.591 1.00 0.00 H new ATOM 0 HE ARG A 146 23.840 15.888 -20.055 1.00 0.00 H new ATOM 0 HH11 ARG A 146 23.114 16.780 -23.399 1.00 0.00 H new ATOM 0 HH12 ARG A 146 23.438 15.142 -23.976 1.00 0.00 H new ATOM 0 HH21 ARG A 146 24.218 13.853 -20.878 1.00 0.00 H new ATOM 0 HH22 ARG A 146 24.036 13.555 -22.610 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -6.268 -7.251 4.584 1.00 0.00 O ATOM 1538 C5' C B 147 -5.208 -8.173 4.791 1.00 0.00 C ATOM 1539 C4' C B 147 -4.707 -8.159 6.242 1.00 0.00 C ATOM 1540 O4' C B 147 -5.508 -9.038 7.027 1.00 0.00 O ATOM 1541 C3' C B 147 -3.249 -8.631 6.356 1.00 0.00 C ATOM 1542 O3' C B 147 -2.630 -7.992 7.465 1.00 0.00 O ATOM 1543 C2' C B 147 -3.425 -10.126 6.633 1.00 0.00 C ATOM 1544 O2' C B 147 -2.331 -10.720 7.322 1.00 0.00 O ATOM 1545 C1' C B 147 -4.713 -10.132 7.465 1.00 0.00 C ATOM 1546 N1 C B 147 -5.460 -11.416 7.345 1.00 0.00 N ATOM 1547 C2 C B 147 -5.729 -12.167 8.499 1.00 0.00 C ATOM 1548 O2 C B 147 -5.394 -11.779 9.620 1.00 0.00 O ATOM 1549 N3 C B 147 -6.371 -13.361 8.411 1.00 0.00 N ATOM 1550 C4 C B 147 -6.728 -13.797 7.219 1.00 0.00 C ATOM 1551 N4 C B 147 -7.342 -14.948 7.207 1.00 0.00 N ATOM 1552 C5 C B 147 -6.482 -13.086 6.013 1.00 0.00 C ATOM 1553 C6 C B 147 -5.840 -11.896 6.114 1.00 0.00 C ATOM 0 H5' C B 147 -4.383 -7.933 4.121 1.00 0.00 H new ATOM 0 H5'' C B 147 -5.546 -9.177 4.534 1.00 0.00 H new ATOM 0 H4' C B 147 -4.773 -7.130 6.595 1.00 0.00 H new ATOM 0 H3' C B 147 -2.631 -8.415 5.484 1.00 0.00 H new ATOM 0 H2' C B 147 -3.472 -10.724 5.723 1.00 0.00 H new ATOM 0 HO2' C B 147 -1.811 -10.023 7.774 1.00 0.00 H new ATOM 0 HO5' C B 147 -6.219 -6.540 5.257 1.00 0.00 H new ATOM 0 H1' C B 147 -4.463 -10.032 8.521 1.00 0.00 H new ATOM 0 H41 C B 147 -7.650 -15.353 6.323 1.00 0.00 H new ATOM 0 H42 C B 147 -7.514 -15.443 8.082 1.00 0.00 H new ATOM 0 H5 C B 147 -6.794 -13.477 5.056 1.00 0.00 H new ATOM 0 H6 C B 147 -5.626 -11.323 5.224 1.00 0.00 H new ATOM 1566 P U B 148 -1.238 -7.222 7.303 1.00 0.00 P ATOM 1567 OP1 U B 148 -0.477 -7.857 6.203 1.00 0.00 O ATOM 1568 OP2 U B 148 -0.618 -7.105 8.641 1.00 0.00 O ATOM 1569 O5' U B 148 -1.696 -5.760 6.842 1.00 0.00 O ATOM 1570 C5' U B 148 -0.778 -4.892 6.195 1.00 0.00 C ATOM 1571 C4' U B 148 -1.161 -3.412 6.357 1.00 0.00 C ATOM 1572 O4' U B 148 -2.413 -3.124 5.744 1.00 0.00 O ATOM 1573 C3' U B 148 -1.232 -2.982 7.827 1.00 0.00 C ATOM 1574 O3' U B 148 -0.679 -1.679 7.882 1.00 0.00 O ATOM 1575 C2' U B 148 -2.736 -3.016 8.099 1.00 0.00 C ATOM 1576 O2' U B 148 -3.203 -2.195 9.166 1.00 0.00 O ATOM 1577 C1' U B 148 -3.280 -2.585 6.732 1.00 0.00 C ATOM 1578 N1 U B 148 -4.685 -3.014 6.510 1.00 0.00 N ATOM 1579 C2 U B 148 -5.624 -2.062 6.090 1.00 0.00 C ATOM 1580 O2 U B 148 -5.328 -0.935 5.690 1.00 0.00 O ATOM 1581 N3 U B 148 -6.950 -2.453 6.085 1.00 0.00 N ATOM 1582 C4 U B 148 -7.416 -3.707 6.404 1.00 0.00 C ATOM 1583 O4 U B 148 -8.621 -3.938 6.374 1.00 0.00 O ATOM 1584 C5 U B 148 -6.382 -4.662 6.746 1.00 0.00 C ATOM 1585 C6 U B 148 -5.070 -4.306 6.788 1.00 0.00 C ATOM 0 H5' U B 148 -0.733 -5.139 5.134 1.00 0.00 H new ATOM 0 H5'' U B 148 0.220 -5.053 6.602 1.00 0.00 H new ATOM 0 H4' U B 148 -0.369 -2.850 5.862 1.00 0.00 H new ATOM 0 H3' U B 148 -0.694 -3.588 8.556 1.00 0.00 H new ATOM 0 H2' U B 148 -3.070 -3.991 8.455 1.00 0.00 H new ATOM 0 HO2' U B 148 -2.470 -2.026 9.794 1.00 0.00 H new ATOM 0 H1' U B 148 -3.302 -1.497 6.678 1.00 0.00 H new ATOM 0 H3 U B 148 -7.642 -1.751 5.822 1.00 0.00 H new ATOM 0 H5 U B 148 -6.659 -5.681 6.973 1.00 0.00 H new ATOM 0 H6 U B 148 -4.323 -5.044 7.042 1.00 0.00 H new ATOM 1596 P C B 149 -0.031 -1.118 9.215 1.00 0.00 P ATOM 1597 OP1 C B 149 1.147 -1.949 9.554 1.00 0.00 O ATOM 1598 OP2 C B 149 -1.114 -0.927 10.205 1.00 0.00 O ATOM 1599 O5' C B 149 0.451 0.319 8.705 1.00 0.00 O ATOM 1600 C5' C B 149 1.710 0.485 8.074 1.00 0.00 C ATOM 1601 C4' C B 149 1.892 1.882 7.465 1.00 0.00 C ATOM 1602 O4' C B 149 1.325 1.929 6.156 1.00 0.00 O ATOM 1603 C3' C B 149 1.251 3.001 8.315 1.00 0.00 C ATOM 1604 O3' C B 149 1.998 4.207 8.338 1.00 0.00 O ATOM 1605 C2' C B 149 -0.057 3.233 7.566 1.00 0.00 C ATOM 1606 O2' C B 149 -0.630 4.517 7.755 1.00 0.00 O ATOM 1607 C1' C B 149 0.327 2.940 6.115 1.00 0.00 C ATOM 1608 N1 C B 149 -0.891 2.469 5.413 1.00 0.00 N ATOM 1609 C2 C B 149 -1.601 3.331 4.570 1.00 0.00 C ATOM 1610 O2 C B 149 -1.165 4.428 4.240 1.00 0.00 O ATOM 1611 N3 C B 149 -2.819 2.976 4.095 1.00 0.00 N ATOM 1612 C4 C B 149 -3.270 1.769 4.342 1.00 0.00 C ATOM 1613 N4 C B 149 -4.457 1.482 3.885 1.00 0.00 N ATOM 1614 C5 C B 149 -2.557 0.836 5.132 1.00 0.00 C ATOM 1615 C6 C B 149 -1.389 1.224 5.690 1.00 0.00 C ATOM 0 H5' C B 149 1.820 -0.265 7.290 1.00 0.00 H new ATOM 0 H5'' C B 149 2.502 0.305 8.801 1.00 0.00 H new ATOM 0 H4' C B 149 2.967 2.058 7.430 1.00 0.00 H new ATOM 0 H3' C B 149 1.165 2.717 9.364 1.00 0.00 H new ATOM 0 H2' C B 149 -0.859 2.594 7.935 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.110 5.183 7.259 1.00 0.00 H new ATOM 0 H1' C B 149 0.713 3.813 5.589 1.00 0.00 H new ATOM 0 H41 C B 149 -4.857 0.558 4.048 1.00 0.00 H new ATOM 0 H42 C B 149 -4.986 2.182 3.364 1.00 0.00 H new ATOM 0 H5 C B 149 -2.938 -0.163 5.285 1.00 0.00 H new ATOM 0 H6 C B 149 -0.853 0.557 6.349 1.00 0.00 H new ATOM 1627 P U B 150 3.350 4.349 9.174 1.00 0.00 P ATOM 1628 OP1 U B 150 3.307 3.426 10.335 1.00 0.00 O ATOM 1629 OP2 U B 150 3.595 5.793 9.402 1.00 0.00 O ATOM 1630 O5' U B 150 4.438 3.799 8.129 1.00 0.00 O ATOM 1631 C5' U B 150 4.502 4.318 6.811 1.00 0.00 C ATOM 1632 C4' U B 150 5.959 4.439 6.375 1.00 0.00 C ATOM 1633 O4' U B 150 6.004 4.829 5.016 1.00 0.00 O ATOM 1634 C3' U B 150 6.678 5.531 7.173 1.00 0.00 C ATOM 1635 O3' U B 150 7.295 5.074 8.373 1.00 0.00 O ATOM 1636 C2' U B 150 7.666 6.100 6.151 1.00 0.00 C ATOM 1637 O2' U B 150 8.930 5.440 6.154 1.00 0.00 O ATOM 1638 C1' U B 150 6.980 5.852 4.810 1.00 0.00 C ATOM 1639 N1 U B 150 6.388 7.129 4.290 1.00 0.00 N ATOM 1640 C2 U B 150 7.216 8.056 3.638 1.00 0.00 C ATOM 1641 O2 U B 150 8.429 7.897 3.492 1.00 0.00 O ATOM 1642 N3 U B 150 6.615 9.200 3.141 1.00 0.00 N ATOM 1643 C4 U B 150 5.268 9.480 3.185 1.00 0.00 C ATOM 1644 O4 U B 150 4.832 10.518 2.696 1.00 0.00 O ATOM 1645 C5 U B 150 4.468 8.461 3.825 1.00 0.00 C ATOM 1646 C6 U B 150 5.039 7.359 4.376 1.00 0.00 C ATOM 0 H5' U B 150 4.018 5.294 6.770 1.00 0.00 H new ATOM 0 H5'' U B 150 3.961 3.665 6.126 1.00 0.00 H new ATOM 0 H4' U B 150 6.440 3.475 6.538 1.00 0.00 H new ATOM 0 H3' U B 150 5.989 6.280 7.564 1.00 0.00 H new ATOM 0 H2' U B 150 7.884 7.145 6.370 1.00 0.00 H new ATOM 0 HO2' U B 150 9.012 4.894 6.964 1.00 0.00 H new ATOM 0 H1' U B 150 7.686 5.518 4.050 1.00 0.00 H new ATOM 0 H3 U B 150 7.222 9.894 2.705 1.00 0.00 H new ATOM 0 H5 U B 150 3.395 8.578 3.866 1.00 0.00 H new ATOM 0 H6 U B 150 4.415 6.646 4.895 1.00 0.00 H new ATOM 1657 P C B 151 7.798 6.097 9.502 1.00 0.00 P ATOM 1658 OP1 C B 151 7.501 5.491 10.825 1.00 0.00 O ATOM 1659 OP2 C B 151 7.302 7.465 9.204 1.00 0.00 O ATOM 1660 O5' C B 151 9.394 6.108 9.305 1.00 0.00 O ATOM 1661 C5' C B 151 10.226 6.626 10.336 1.00 0.00 C ATOM 1662 C4' C B 151 11.719 6.562 9.979 1.00 0.00 C ATOM 1663 O4' C B 151 12.040 7.546 8.992 1.00 0.00 O ATOM 1664 C3' C B 151 12.562 6.878 11.229 1.00 0.00 C ATOM 1665 O3' C B 151 13.831 6.227 11.180 1.00 0.00 O ATOM 1666 C2' C B 151 12.718 8.397 11.092 1.00 0.00 C ATOM 1667 O2' C B 151 13.809 8.920 11.841 1.00 0.00 O ATOM 1668 C1' C B 151 12.889 8.527 9.578 1.00 0.00 C ATOM 1669 N1 C B 151 12.553 9.900 9.104 1.00 0.00 N ATOM 1670 C2 C B 151 13.592 10.763 8.714 1.00 0.00 C ATOM 1671 O2 C B 151 14.772 10.403 8.699 1.00 0.00 O ATOM 1672 N3 C B 151 13.322 12.038 8.330 1.00 0.00 N ATOM 1673 C4 C B 151 12.066 12.443 8.324 1.00 0.00 C ATOM 1674 N4 C B 151 11.870 13.678 7.951 1.00 0.00 N ATOM 1675 C5 C B 151 10.971 11.618 8.706 1.00 0.00 C ATOM 1676 C6 C B 151 11.254 10.347 9.094 1.00 0.00 C ATOM 0 H5' C B 151 10.052 6.066 11.254 1.00 0.00 H new ATOM 0 H5'' C B 151 9.948 7.661 10.536 1.00 0.00 H new ATOM 0 H4' C B 151 11.933 5.562 9.601 1.00 0.00 H new ATOM 0 H3' C B 151 12.117 6.547 12.167 1.00 0.00 H new ATOM 0 H2' C B 151 11.885 8.974 11.493 1.00 0.00 H new ATOM 0 HO2' C B 151 14.443 8.200 12.041 1.00 0.00 H new ATOM 0 H1' C B 151 13.927 8.364 9.288 1.00 0.00 H new ATOM 0 H41 C B 151 10.924 14.058 7.923 1.00 0.00 H new ATOM 0 H42 C B 151 12.663 14.263 7.688 1.00 0.00 H new ATOM 0 H5 C B 151 9.956 11.987 8.688 1.00 0.00 H new ATOM 0 H6 C B 151 10.455 9.686 9.396 1.00 0.00 H new ATOM 1688 P U B 152 14.007 4.741 11.760 1.00 0.00 P ATOM 1689 OP1 U B 152 15.400 4.306 11.500 1.00 0.00 O ATOM 1690 OP2 U B 152 12.885 3.899 11.282 1.00 0.00 O ATOM 1691 O5' U B 152 13.808 4.971 13.341 1.00 0.00 O ATOM 1692 C5' U B 152 14.892 5.297 14.194 1.00 0.00 C ATOM 1693 C4' U B 152 14.398 5.647 15.604 1.00 0.00 C ATOM 1694 O4' U B 152 13.800 4.510 16.237 1.00 0.00 O ATOM 1695 C3' U B 152 15.567 6.087 16.502 1.00 0.00 C ATOM 1696 O3' U B 152 15.124 7.073 17.434 1.00 0.00 O ATOM 1697 C2' U B 152 15.931 4.776 17.206 1.00 0.00 C ATOM 1698 O2' U B 152 16.664 4.971 18.418 1.00 0.00 O ATOM 1699 C1' U B 152 14.535 4.182 17.412 1.00 0.00 C ATOM 1700 N1 U B 152 14.553 2.719 17.710 1.00 0.00 N ATOM 1701 C2 U B 152 14.906 1.794 16.711 1.00 0.00 C ATOM 1702 O2 U B 152 15.278 2.093 15.576 1.00 0.00 O ATOM 1703 N3 U B 152 14.848 0.456 17.051 1.00 0.00 N ATOM 1704 C4 U B 152 14.508 -0.049 18.285 1.00 0.00 C ATOM 1705 O4 U B 152 14.491 -1.262 18.473 1.00 0.00 O ATOM 1706 C5 U B 152 14.197 0.960 19.276 1.00 0.00 C ATOM 1707 C6 U B 152 14.233 2.288 18.980 1.00 0.00 C ATOM 0 H5' U B 152 15.445 6.140 13.779 1.00 0.00 H new ATOM 0 H5'' U B 152 15.584 4.456 14.246 1.00 0.00 H new ATOM 0 H4' U B 152 13.672 6.451 15.487 1.00 0.00 H new ATOM 0 H3' U B 152 16.404 6.540 15.971 1.00 0.00 H new ATOM 0 H2' U B 152 16.610 4.131 16.648 1.00 0.00 H new ATOM 0 HO2' U B 152 16.866 4.101 18.822 1.00 0.00 H new ATOM 0 HO3' U B 152 15.448 6.845 18.330 1.00 0.00 H new ATOM 0 H1' U B 152 14.060 4.603 18.298 1.00 0.00 H new ATOM 0 H3 U B 152 15.078 -0.218 16.321 1.00 0.00 H new ATOM 0 H5 U B 152 13.930 0.651 20.276 1.00 0.00 H new ATOM 0 H6 U B 152 14.008 3.013 19.749 1.00 0.00 H new TER 1719 U B 152