USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot 156:sc= 2 USER MOD Set 1.2: A 128 TYR OH : rot -130:sc= 1.45 USER MOD Set 2.1: A 19 TYR OH : rot -145:sc= 0.895 USER MOD Set 2.2: A 102 THR OG1 : rot 21:sc= 1.94 USER MOD Set 3.1: A 82 SER OG : rot 169:sc= 1.28 USER MOD Set 3.2: A 93 HIS : no HD1:sc= 0.221 K(o=1.5,f=-7.2!) USER MOD Set 3.3: A 95 GLN : amide:sc= 0 K(o=1.5,f=-1.8) USER MOD Set 4.1: A 53 THR OG1 : rot -161:sc= 1.85 USER MOD Set 4.2: A 60 THR OG1 : rot 180:sc= 0.934 USER MOD Set 5.1: A 22 SER OG : rot 133:sc= 1.33 USER MOD Set 5.2: A 119 HIS : no HE2:sc= 0.556 K(o=1.9,f=-10!) USER MOD Set 6.1: A 9 LYS NZ :NH3+ 155:sc= 0.736 (180deg=-0.582) USER MOD Set 6.2: A 131 GLN : amide:sc= 0.934 K(o=1.7,f=-11!) USER MOD Single : A 1 VAL N :NH3+ -174:sc= -0.165 (180deg=-0.238) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -132:sc= 0.708 (180deg=-0.842!) USER MOD Single : A 15 ASN : amide:sc= 1.06 K(o=1.1,f=-0.8) USER MOD Single : A 20 MET CE :methyl 176:sc=-0.00792 (180deg=-0.037) USER MOD Single : A 21 LYS NZ :NH3+ -142:sc= 0.884 (180deg=-1.16!) USER MOD Single : A 29 THR OG1 : rot -160:sc=0.000733 USER MOD Single : A 31 GLN : amide:sc= 2.02 K(o=2,f=-0.26) USER MOD Single : A 34 ASN : amide:sc= 0.19 K(o=0.19,f=-6.8!) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -167:sc=-0.00567 (180deg=-0.118) USER MOD Single : A 39 THR OG1 : rot 63:sc= 0.788 USER MOD Single : A 45 ASN : amide:sc= 0.913 K(o=0.91,f=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.384 USER MOD Single : A 52 LYS NZ :NH3+ 165:sc= 1.17 (180deg=1.04) USER MOD Single : A 54 GLN : amide:sc= -1.16 K(o=-1.2,f=-2.7!) USER MOD Single : A 55 SER OG : rot 45:sc= 0.766 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.241 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0.651 K(o=0.65,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0.0709 USER MOD Single : A 65 LYS NZ :NH3+ -168:sc= 0.595 (180deg=-0.304) USER MOD Single : A 73 THR OG1 : rot 115:sc= 1.24 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0674 USER MOD Single : A 79 LYS NZ :NH3+ 172:sc= 0.964 (180deg=0.158) USER MOD Single : A 81 LYS NZ :NH3+ -141:sc= 1.04 (180deg=-0.0478!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.224 USER MOD Single : A 90 LYS NZ :NH3+ 171:sc= -0.814! (180deg=-1.3!) USER MOD Single : A 96 LYS NZ :NH3+ -171:sc= 0.983 (180deg=0.0365) USER MOD Single : A 98 ASN : amide:sc= -1.59 K(o=-1.6,f=-2.8!) USER MOD Single : A 100 GLN : amide:sc= 0.211 K(o=0.21,f=-3.8!) USER MOD Single : A 103 SER OG : rot 180:sc= -0.35 USER MOD Single : A 108 MET CE :methyl 173:sc= 0 (180deg=-0.103) USER MOD Single : A 112 LYS NZ :NH3+ -158:sc= 0.46 (180deg=0.139!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 60:sc= 1.02 USER MOD Single : A 125 THR OG1 : rot 27:sc= 0.17 USER MOD Single : A 127 THR OG1 : rot 18:sc= 1.19 USER MOD Single : A 130 LYS NZ :NH3+ -174:sc= 2.4 (180deg=2.04) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.281 -12.755 -5.740 1.00 0.00 N ATOM 2 CA VAL A 1 10.235 -11.807 -4.637 1.00 0.00 C ATOM 3 C VAL A 1 11.592 -11.116 -4.446 1.00 0.00 C ATOM 4 O VAL A 1 11.636 -9.924 -4.125 1.00 0.00 O ATOM 5 CB VAL A 1 9.703 -12.507 -3.372 1.00 0.00 C ATOM 6 CG1 VAL A 1 10.606 -13.628 -2.850 1.00 0.00 C ATOM 7 CG2 VAL A 1 9.437 -11.514 -2.235 1.00 0.00 C ATOM 0 H1 VAL A 1 9.328 -13.133 -5.913 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.624 -12.275 -6.596 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.924 -13.536 -5.500 1.00 0.00 H new ATOM 0 HA VAL A 1 9.536 -11.003 -4.867 1.00 0.00 H new ATOM 0 HB VAL A 1 8.766 -12.962 -3.694 1.00 0.00 H new ATOM 0 HG11 VAL A 1 10.160 -14.069 -1.958 1.00 0.00 H new ATOM 0 HG12 VAL A 1 10.716 -14.394 -3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.586 -13.220 -2.602 1.00 0.00 H new ATOM 0 HG21 VAL A 1 9.063 -12.051 -1.363 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.363 -11.001 -1.976 1.00 0.00 H new ATOM 0 HG23 VAL A 1 8.695 -10.783 -2.556 1.00 0.00 H new ATOM 19 N ASP A 2 12.686 -11.861 -4.661 1.00 0.00 N ATOM 20 CA ASP A 2 14.091 -11.496 -4.485 1.00 0.00 C ATOM 21 C ASP A 2 14.525 -10.413 -5.480 1.00 0.00 C ATOM 22 O ASP A 2 15.392 -10.608 -6.330 1.00 0.00 O ATOM 23 CB ASP A 2 14.959 -12.758 -4.639 1.00 0.00 C ATOM 24 CG ASP A 2 14.417 -13.943 -3.855 1.00 0.00 C ATOM 25 OD1 ASP A 2 13.342 -14.424 -4.281 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.054 -14.315 -2.848 1.00 0.00 O ATOM 0 H ASP A 2 12.597 -12.821 -4.993 1.00 0.00 H new ATOM 0 HA ASP A 2 14.222 -11.079 -3.487 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.022 -13.024 -5.694 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.973 -12.539 -4.304 1.00 0.00 H new ATOM 31 N ALA A 3 13.902 -9.248 -5.356 1.00 0.00 N ATOM 32 CA ALA A 3 13.983 -8.119 -6.262 1.00 0.00 C ATOM 33 C ALA A 3 13.257 -6.956 -5.595 1.00 0.00 C ATOM 34 O ALA A 3 13.802 -5.856 -5.502 1.00 0.00 O ATOM 35 CB ALA A 3 13.324 -8.465 -7.603 1.00 0.00 C ATOM 0 H ALA A 3 13.286 -9.058 -4.565 1.00 0.00 H new ATOM 0 HA ALA A 3 15.022 -7.858 -6.465 1.00 0.00 H new ATOM 0 HB1 ALA A 3 13.392 -7.608 -8.274 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.835 -9.318 -8.050 1.00 0.00 H new ATOM 0 HB3 ALA A 3 12.276 -8.715 -7.439 1.00 0.00 H new ATOM 41 N PHE A 4 12.049 -7.227 -5.093 1.00 0.00 N ATOM 42 CA PHE A 4 11.158 -6.268 -4.457 1.00 0.00 C ATOM 43 C PHE A 4 11.846 -5.542 -3.304 1.00 0.00 C ATOM 44 O PHE A 4 11.702 -4.332 -3.170 1.00 0.00 O ATOM 45 CB PHE A 4 9.911 -7.020 -3.966 1.00 0.00 C ATOM 46 CG PHE A 4 9.060 -7.700 -5.027 1.00 0.00 C ATOM 47 CD1 PHE A 4 9.240 -7.434 -6.400 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.062 -8.608 -4.627 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.473 -8.113 -7.357 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.292 -9.286 -5.589 1.00 0.00 C ATOM 51 CZ PHE A 4 7.507 -9.043 -6.956 1.00 0.00 C ATOM 0 H PHE A 4 11.652 -8.166 -5.123 1.00 0.00 H new ATOM 0 HA PHE A 4 10.873 -5.505 -5.181 1.00 0.00 H new ATOM 0 HB2 PHE A 4 10.231 -7.777 -3.250 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.280 -6.315 -3.424 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.971 -6.705 -6.715 1.00 0.00 H new ATOM 0 HD2 PHE A 4 7.887 -8.785 -3.576 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.628 -7.918 -8.408 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.537 -9.992 -5.277 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.927 -9.573 -7.697 1.00 0.00 H new ATOM 61 N VAL A 5 12.590 -6.289 -2.489 1.00 0.00 N ATOM 62 CA VAL A 5 13.272 -5.820 -1.289 1.00 0.00 C ATOM 63 C VAL A 5 13.935 -4.447 -1.488 1.00 0.00 C ATOM 64 O VAL A 5 14.951 -4.362 -2.185 1.00 0.00 O ATOM 65 CB VAL A 5 14.309 -6.884 -0.875 1.00 0.00 C ATOM 66 CG1 VAL A 5 15.111 -6.439 0.357 1.00 0.00 C ATOM 67 CG2 VAL A 5 13.623 -8.213 -0.540 1.00 0.00 C ATOM 0 H VAL A 5 12.739 -7.284 -2.658 1.00 0.00 H new ATOM 0 HA VAL A 5 12.536 -5.683 -0.497 1.00 0.00 H new ATOM 0 HB VAL A 5 14.983 -7.011 -1.723 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.832 -7.213 0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.639 -5.512 0.132 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.432 -6.276 1.194 1.00 0.00 H new ATOM 0 HG21 VAL A 5 14.375 -8.948 -0.251 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.925 -8.065 0.284 1.00 0.00 H new ATOM 0 HG23 VAL A 5 13.081 -8.573 -1.414 1.00 0.00 H new ATOM 77 N GLY A 6 13.398 -3.399 -0.851 1.00 0.00 N ATOM 78 CA GLY A 6 14.073 -2.120 -0.651 1.00 0.00 C ATOM 79 C GLY A 6 13.189 -0.904 -0.941 1.00 0.00 C ATOM 80 O GLY A 6 11.971 -1.014 -1.082 1.00 0.00 O ATOM 0 H GLY A 6 12.459 -3.422 -0.453 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.427 -2.063 0.378 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.953 -2.080 -1.293 1.00 0.00 H new ATOM 84 N THR A 7 13.827 0.270 -1.005 1.00 0.00 N ATOM 85 CA THR A 7 13.198 1.560 -1.259 1.00 0.00 C ATOM 86 C THR A 7 13.185 1.862 -2.757 1.00 0.00 C ATOM 87 O THR A 7 14.243 1.922 -3.388 1.00 0.00 O ATOM 88 CB THR A 7 13.951 2.662 -0.500 1.00 0.00 C ATOM 89 OG1 THR A 7 14.232 2.218 0.813 1.00 0.00 O ATOM 90 CG2 THR A 7 13.153 3.970 -0.456 1.00 0.00 C ATOM 0 H THR A 7 14.836 0.345 -0.875 1.00 0.00 H new ATOM 0 HA THR A 7 12.167 1.526 -0.907 1.00 0.00 H new ATOM 0 HB THR A 7 14.881 2.866 -1.030 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.714 2.919 1.299 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.720 4.724 0.090 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.970 4.319 -1.472 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.201 3.799 0.046 1.00 0.00 H new ATOM 98 N TRP A 8 11.993 2.083 -3.306 1.00 0.00 N ATOM 99 CA TRP A 8 11.755 2.466 -4.682 1.00 0.00 C ATOM 100 C TRP A 8 11.307 3.920 -4.759 1.00 0.00 C ATOM 101 O TRP A 8 10.770 4.474 -3.801 1.00 0.00 O ATOM 102 CB TRP A 8 10.693 1.551 -5.291 1.00 0.00 C ATOM 103 CG TRP A 8 11.038 0.097 -5.322 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.965 -0.740 -4.265 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.546 -0.705 -6.432 1.00 0.00 C ATOM 106 NE1 TRP A 8 11.365 -1.999 -4.645 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.748 -2.036 -5.968 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.865 -0.446 -7.782 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.246 -3.052 -6.793 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.434 -1.439 -8.601 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.627 -2.742 -8.105 1.00 0.00 C ATOM 0 H TRP A 8 11.129 1.994 -2.771 1.00 0.00 H new ATOM 0 HA TRP A 8 12.682 2.363 -5.246 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.767 1.675 -4.730 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.495 1.881 -6.311 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.642 -0.463 -3.273 1.00 0.00 H new ATOM 0 HE1 TRP A 8 11.377 -2.807 -4.023 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.669 0.533 -8.194 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.335 -4.062 -6.422 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.724 -1.200 -9.614 1.00 0.00 H new ATOM 0 HH2 TRP A 8 13.068 -3.501 -8.734 1.00 0.00 H new ATOM 122 N LYS A 9 11.516 4.538 -5.919 1.00 0.00 N ATOM 123 CA LYS A 9 11.105 5.904 -6.184 1.00 0.00 C ATOM 124 C LYS A 9 10.591 5.974 -7.619 1.00 0.00 C ATOM 125 O LYS A 9 11.177 5.366 -8.515 1.00 0.00 O ATOM 126 CB LYS A 9 12.305 6.811 -5.898 1.00 0.00 C ATOM 127 CG LYS A 9 12.085 8.297 -6.210 1.00 0.00 C ATOM 128 CD LYS A 9 12.544 8.692 -7.624 1.00 0.00 C ATOM 129 CE LYS A 9 14.035 9.059 -7.726 1.00 0.00 C ATOM 130 NZ LYS A 9 14.943 7.919 -7.475 1.00 0.00 N ATOM 0 H LYS A 9 11.983 4.093 -6.709 1.00 0.00 H new ATOM 0 HA LYS A 9 10.289 6.243 -5.546 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.573 6.712 -4.846 1.00 0.00 H new ATOM 0 HB3 LYS A 9 13.156 6.456 -6.479 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.026 8.532 -6.099 1.00 0.00 H new ATOM 0 HG3 LYS A 9 12.624 8.899 -5.478 1.00 0.00 H new ATOM 0 HD2 LYS A 9 12.338 7.866 -8.304 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.949 9.540 -7.963 1.00 0.00 H new ATOM 0 HE2 LYS A 9 14.235 9.460 -8.720 1.00 0.00 H new ATOM 0 HE3 LYS A 9 14.255 9.852 -7.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.853 8.089 -7.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.100 7.819 -6.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 14.516 7.047 -7.847 1.00 0.00 H new ATOM 144 N LEU A 10 9.460 6.657 -7.811 1.00 0.00 N ATOM 145 CA LEU A 10 8.768 6.743 -9.089 1.00 0.00 C ATOM 146 C LEU A 10 9.616 7.441 -10.149 1.00 0.00 C ATOM 147 O LEU A 10 10.365 8.362 -9.826 1.00 0.00 O ATOM 148 CB LEU A 10 7.465 7.506 -8.867 1.00 0.00 C ATOM 149 CG LEU A 10 6.586 7.583 -10.127 1.00 0.00 C ATOM 150 CD1 LEU A 10 5.139 7.296 -9.753 1.00 0.00 C ATOM 151 CD2 LEU A 10 6.658 8.958 -10.796 1.00 0.00 C ATOM 0 H LEU A 10 8.995 7.174 -7.065 1.00 0.00 H new ATOM 0 HA LEU A 10 8.570 5.737 -9.457 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.901 7.025 -8.068 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.696 8.517 -8.531 1.00 0.00 H new ATOM 0 HG LEU A 10 6.960 6.841 -10.833 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.515 7.350 -10.645 1.00 0.00 H new ATOM 0 HD12 LEU A 10 5.066 6.299 -9.319 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.798 8.033 -9.026 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.022 8.966 -11.681 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.316 9.721 -10.097 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.687 9.168 -11.087 1.00 0.00 H new ATOM 163 N VAL A 11 9.452 7.039 -11.414 1.00 0.00 N ATOM 164 CA VAL A 11 10.058 7.715 -12.555 1.00 0.00 C ATOM 165 C VAL A 11 9.079 7.925 -13.728 1.00 0.00 C ATOM 166 O VAL A 11 9.373 8.748 -14.592 1.00 0.00 O ATOM 167 CB VAL A 11 11.373 7.006 -12.930 1.00 0.00 C ATOM 168 CG1 VAL A 11 11.131 5.604 -13.491 1.00 0.00 C ATOM 169 CG2 VAL A 11 12.218 7.820 -13.917 1.00 0.00 C ATOM 0 H VAL A 11 8.889 6.228 -11.672 1.00 0.00 H new ATOM 0 HA VAL A 11 10.313 8.735 -12.268 1.00 0.00 H new ATOM 0 HB VAL A 11 11.932 6.916 -11.999 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.086 5.142 -13.741 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.619 4.997 -12.744 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.515 5.672 -14.388 1.00 0.00 H new ATOM 0 HG21 VAL A 11 13.133 7.275 -14.148 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.651 7.982 -14.834 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.471 8.782 -13.472 1.00 0.00 H new ATOM 179 N ASP A 12 7.918 7.248 -13.768 1.00 0.00 N ATOM 180 CA ASP A 12 6.879 7.528 -14.766 1.00 0.00 C ATOM 181 C ASP A 12 5.488 7.319 -14.165 1.00 0.00 C ATOM 182 O ASP A 12 5.342 6.562 -13.201 1.00 0.00 O ATOM 183 CB ASP A 12 7.059 6.655 -16.018 1.00 0.00 C ATOM 184 CG ASP A 12 6.198 7.092 -17.193 1.00 0.00 C ATOM 185 OD1 ASP A 12 5.555 8.162 -17.144 1.00 0.00 O ATOM 186 OD2 ASP A 12 6.109 6.345 -18.188 1.00 0.00 O ATOM 0 H ASP A 12 7.678 6.501 -13.116 1.00 0.00 H new ATOM 0 HA ASP A 12 6.977 8.571 -15.067 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.107 6.676 -16.318 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.820 5.621 -15.768 1.00 0.00 H new ATOM 191 N SER A 13 4.486 7.986 -14.745 1.00 0.00 N ATOM 192 CA SER A 13 3.085 8.011 -14.347 1.00 0.00 C ATOM 193 C SER A 13 2.283 8.787 -15.390 1.00 0.00 C ATOM 194 O SER A 13 2.683 9.884 -15.770 1.00 0.00 O ATOM 195 CB SER A 13 2.933 8.691 -12.979 1.00 0.00 C ATOM 196 OG SER A 13 1.609 8.567 -12.481 1.00 0.00 O ATOM 0 H SER A 13 4.651 8.566 -15.568 1.00 0.00 H new ATOM 0 HA SER A 13 2.715 6.988 -14.276 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.632 8.247 -12.271 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.193 9.746 -13.065 1.00 0.00 H new ATOM 0 HG SER A 13 1.545 9.008 -11.608 1.00 0.00 H new ATOM 202 N LYS A 14 1.128 8.262 -15.810 1.00 0.00 N ATOM 203 CA LYS A 14 0.120 9.042 -16.521 1.00 0.00 C ATOM 204 C LYS A 14 -1.261 8.439 -16.276 1.00 0.00 C ATOM 205 O LYS A 14 -1.368 7.334 -15.738 1.00 0.00 O ATOM 206 CB LYS A 14 0.446 9.184 -18.016 1.00 0.00 C ATOM 207 CG LYS A 14 0.549 7.840 -18.755 1.00 0.00 C ATOM 208 CD LYS A 14 1.801 7.766 -19.640 1.00 0.00 C ATOM 209 CE LYS A 14 3.070 7.663 -18.779 1.00 0.00 C ATOM 210 NZ LYS A 14 4.310 7.641 -19.575 1.00 0.00 N ATOM 0 H LYS A 14 0.869 7.286 -15.665 1.00 0.00 H new ATOM 0 HA LYS A 14 0.122 10.058 -16.126 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.324 9.792 -18.491 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.388 9.721 -18.124 1.00 0.00 H new ATOM 0 HG2 LYS A 14 0.570 7.027 -18.029 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.339 7.695 -19.370 1.00 0.00 H new ATOM 0 HD2 LYS A 14 1.734 6.903 -20.302 1.00 0.00 H new ATOM 0 HD3 LYS A 14 1.857 8.651 -20.274 1.00 0.00 H new ATOM 0 HE2 LYS A 14 3.103 8.507 -18.089 1.00 0.00 H new ATOM 0 HE3 LYS A 14 3.018 6.758 -18.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 4.920 6.865 -19.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 4.076 7.496 -20.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 4.810 8.546 -19.463 1.00 0.00 H new ATOM 224 N ASN A 15 -2.305 9.192 -16.630 1.00 0.00 N ATOM 225 CA ASN A 15 -3.715 8.816 -16.534 1.00 0.00 C ATOM 226 C ASN A 15 -4.160 8.585 -15.087 1.00 0.00 C ATOM 227 O ASN A 15 -5.218 8.011 -14.864 1.00 0.00 O ATOM 228 CB ASN A 15 -4.036 7.560 -17.367 1.00 0.00 C ATOM 229 CG ASN A 15 -3.503 7.563 -18.796 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.095 8.590 -19.329 1.00 0.00 O ATOM 231 ND2 ASN A 15 -3.475 6.391 -19.422 1.00 0.00 N ATOM 0 H ASN A 15 -2.182 10.130 -17.011 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.270 9.662 -16.938 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.632 6.690 -16.850 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.118 7.436 -17.402 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.107 6.329 -20.371 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -3.821 5.554 -18.953 1.00 0.00 H new ATOM 238 N PHE A 16 -3.361 8.972 -14.086 1.00 0.00 N ATOM 239 CA PHE A 16 -3.617 8.577 -12.704 1.00 0.00 C ATOM 240 C PHE A 16 -4.878 9.275 -12.188 1.00 0.00 C ATOM 241 O PHE A 16 -5.808 8.644 -11.690 1.00 0.00 O ATOM 242 CB PHE A 16 -2.379 8.892 -11.846 1.00 0.00 C ATOM 243 CG PHE A 16 -2.250 8.202 -10.493 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.837 6.946 -10.227 1.00 0.00 C ATOM 245 CD2 PHE A 16 -1.369 8.758 -9.546 1.00 0.00 C ATOM 246 CE1 PHE A 16 -2.473 6.225 -9.076 1.00 0.00 C ATOM 247 CE2 PHE A 16 -1.057 8.063 -8.367 1.00 0.00 C ATOM 248 CZ PHE A 16 -1.582 6.781 -8.146 1.00 0.00 C ATOM 0 H PHE A 16 -2.535 9.557 -14.211 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.797 7.504 -12.644 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.495 8.644 -12.433 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -2.357 9.968 -11.675 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.568 6.538 -10.909 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.929 9.728 -9.728 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.881 5.239 -8.907 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.412 8.516 -7.629 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.301 6.225 -7.264 1.00 0.00 H new ATOM 258 N ASP A 17 -4.894 10.593 -12.344 1.00 0.00 N ATOM 259 CA ASP A 17 -6.004 11.489 -12.089 1.00 0.00 C ATOM 260 C ASP A 17 -7.247 11.011 -12.837 1.00 0.00 C ATOM 261 O ASP A 17 -8.326 10.869 -12.259 1.00 0.00 O ATOM 262 CB ASP A 17 -5.570 12.888 -12.548 1.00 0.00 C ATOM 263 CG ASP A 17 -4.274 13.327 -11.874 1.00 0.00 C ATOM 264 OD1 ASP A 17 -3.253 12.615 -12.055 1.00 0.00 O ATOM 265 OD2 ASP A 17 -4.329 14.339 -11.149 1.00 0.00 O ATOM 0 H ASP A 17 -4.070 11.095 -12.676 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.262 11.511 -11.030 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.436 12.891 -13.630 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.359 13.606 -12.322 1.00 0.00 H new ATOM 270 N ASP A 18 -7.084 10.753 -14.137 1.00 0.00 N ATOM 271 CA ASP A 18 -8.174 10.322 -14.993 1.00 0.00 C ATOM 272 C ASP A 18 -8.762 8.989 -14.536 1.00 0.00 C ATOM 273 O ASP A 18 -9.977 8.828 -14.508 1.00 0.00 O ATOM 274 CB ASP A 18 -7.725 10.259 -16.450 1.00 0.00 C ATOM 275 CG ASP A 18 -8.924 9.918 -17.318 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.847 10.762 -17.328 1.00 0.00 O ATOM 277 OD2 ASP A 18 -8.904 8.822 -17.915 1.00 0.00 O ATOM 0 H ASP A 18 -6.189 10.839 -14.619 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.968 11.065 -14.914 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.298 11.214 -16.755 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.945 9.508 -16.572 1.00 0.00 H new ATOM 282 N TYR A 19 -7.913 8.058 -14.103 1.00 0.00 N ATOM 283 CA TYR A 19 -8.341 6.796 -13.517 1.00 0.00 C ATOM 284 C TYR A 19 -9.429 7.025 -12.463 1.00 0.00 C ATOM 285 O TYR A 19 -10.485 6.390 -12.485 1.00 0.00 O ATOM 286 CB TYR A 19 -7.124 6.099 -12.903 1.00 0.00 C ATOM 287 CG TYR A 19 -7.243 4.603 -12.799 1.00 0.00 C ATOM 288 CD1 TYR A 19 -6.816 3.807 -13.874 1.00 0.00 C ATOM 289 CD2 TYR A 19 -7.602 4.008 -11.577 1.00 0.00 C ATOM 290 CE1 TYR A 19 -6.668 2.427 -13.696 1.00 0.00 C ATOM 291 CE2 TYR A 19 -7.461 2.623 -11.407 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.926 1.851 -12.448 1.00 0.00 C ATOM 293 OH TYR A 19 -6.663 0.536 -12.267 1.00 0.00 O ATOM 0 H TYR A 19 -6.900 8.163 -14.151 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.769 6.162 -14.293 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.245 6.339 -13.501 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.953 6.507 -11.907 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.603 4.257 -14.832 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.985 4.616 -10.771 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.354 1.807 -14.523 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -7.762 2.155 -10.482 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.335 0.147 -11.668 1.00 0.00 H new ATOM 303 N MET A 20 -9.171 7.962 -11.544 1.00 0.00 N ATOM 304 CA MET A 20 -10.125 8.350 -10.520 1.00 0.00 C ATOM 305 C MET A 20 -11.385 8.977 -11.118 1.00 0.00 C ATOM 306 O MET A 20 -12.432 8.930 -10.472 1.00 0.00 O ATOM 307 CB MET A 20 -9.446 9.262 -9.483 1.00 0.00 C ATOM 308 CG MET A 20 -10.433 9.977 -8.548 1.00 0.00 C ATOM 309 SD MET A 20 -11.234 11.456 -9.248 1.00 0.00 S ATOM 310 CE MET A 20 -12.584 11.708 -8.072 1.00 0.00 C ATOM 0 H MET A 20 -8.288 8.470 -11.496 1.00 0.00 H new ATOM 0 HA MET A 20 -10.460 7.451 -10.004 1.00 0.00 H new ATOM 0 HB2 MET A 20 -8.758 8.666 -8.883 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.848 10.009 -10.005 1.00 0.00 H new ATOM 0 HG2 MET A 20 -11.208 9.269 -8.254 1.00 0.00 H new ATOM 0 HG3 MET A 20 -9.904 10.266 -7.640 1.00 0.00 H new ATOM 0 HE1 MET A 20 -13.123 12.620 -8.327 1.00 0.00 H new ATOM 0 HE2 MET A 20 -13.267 10.859 -8.114 1.00 0.00 H new ATOM 0 HE3 MET A 20 -12.177 11.796 -7.065 1.00 0.00 H new ATOM 320 N LYS A 21 -11.308 9.625 -12.283 1.00 0.00 N ATOM 321 CA LYS A 21 -12.433 10.282 -12.946 1.00 0.00 C ATOM 322 C LYS A 21 -13.380 9.238 -13.562 1.00 0.00 C ATOM 323 O LYS A 21 -13.638 9.235 -14.761 1.00 0.00 O ATOM 324 CB LYS A 21 -11.892 11.311 -13.959 1.00 0.00 C ATOM 325 CG LYS A 21 -12.977 12.262 -14.487 1.00 0.00 C ATOM 326 CD LYS A 21 -12.437 13.652 -14.866 1.00 0.00 C ATOM 327 CE LYS A 21 -11.693 13.739 -16.210 1.00 0.00 C ATOM 328 NZ LYS A 21 -10.439 12.959 -16.254 1.00 0.00 N ATOM 0 H LYS A 21 -10.435 9.708 -12.805 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.036 10.833 -12.224 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.102 11.896 -13.488 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.440 10.783 -14.798 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.450 11.813 -15.361 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.751 12.375 -13.728 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.273 14.351 -14.889 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.763 13.986 -14.077 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.354 13.390 -17.003 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.466 14.784 -16.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -9.721 13.485 -16.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.096 12.798 -15.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -10.615 12.044 -16.715 1.00 0.00 H new ATOM 342 N SER A 22 -13.901 8.363 -12.700 1.00 0.00 N ATOM 343 CA SER A 22 -14.830 7.264 -12.929 1.00 0.00 C ATOM 344 C SER A 22 -14.845 6.425 -11.645 1.00 0.00 C ATOM 345 O SER A 22 -15.902 6.108 -11.110 1.00 0.00 O ATOM 346 CB SER A 22 -14.444 6.412 -14.146 1.00 0.00 C ATOM 347 OG SER A 22 -13.136 5.885 -14.003 1.00 0.00 O ATOM 0 H SER A 22 -13.651 8.418 -11.713 1.00 0.00 H new ATOM 0 HA SER A 22 -15.821 7.656 -13.156 1.00 0.00 H new ATOM 0 HB2 SER A 22 -15.157 5.597 -14.265 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.499 7.018 -15.051 1.00 0.00 H new ATOM 0 HG SER A 22 -13.142 4.931 -14.226 1.00 0.00 H new ATOM 353 N LEU A 23 -13.653 6.088 -11.135 1.00 0.00 N ATOM 354 CA LEU A 23 -13.490 5.323 -9.903 1.00 0.00 C ATOM 355 C LEU A 23 -14.046 6.068 -8.684 1.00 0.00 C ATOM 356 O LEU A 23 -14.561 5.445 -7.758 1.00 0.00 O ATOM 357 CB LEU A 23 -12.009 4.960 -9.704 1.00 0.00 C ATOM 358 CG LEU A 23 -11.807 3.542 -9.150 1.00 0.00 C ATOM 359 CD1 LEU A 23 -12.005 2.512 -10.265 1.00 0.00 C ATOM 360 CD2 LEU A 23 -10.379 3.378 -8.623 1.00 0.00 C ATOM 0 H LEU A 23 -12.769 6.344 -11.575 1.00 0.00 H new ATOM 0 HA LEU A 23 -14.070 4.405 -9.998 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.488 5.049 -10.657 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.553 5.678 -9.023 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.530 3.388 -8.349 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.860 1.509 -9.864 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.015 2.600 -10.666 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.282 2.693 -11.060 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.249 2.369 -8.233 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.670 3.548 -9.433 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.200 4.100 -7.827 1.00 0.00 H new ATOM 372 N GLY A 24 -13.922 7.397 -8.655 1.00 0.00 N ATOM 373 CA GLY A 24 -14.514 8.232 -7.616 1.00 0.00 C ATOM 374 C GLY A 24 -13.551 8.541 -6.465 1.00 0.00 C ATOM 375 O GLY A 24 -13.800 9.471 -5.704 1.00 0.00 O ATOM 0 H GLY A 24 -13.404 7.924 -9.358 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.851 9.169 -8.060 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -15.397 7.733 -7.218 1.00 0.00 H new ATOM 379 N VAL A 25 -12.440 7.804 -6.348 1.00 0.00 N ATOM 380 CA VAL A 25 -11.641 7.698 -5.125 1.00 0.00 C ATOM 381 C VAL A 25 -10.746 8.916 -4.813 1.00 0.00 C ATOM 382 O VAL A 25 -9.609 8.743 -4.387 1.00 0.00 O ATOM 383 CB VAL A 25 -10.814 6.395 -5.173 1.00 0.00 C ATOM 384 CG1 VAL A 25 -11.699 5.150 -5.328 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.767 6.389 -6.298 1.00 0.00 C ATOM 0 H VAL A 25 -12.064 7.253 -7.120 1.00 0.00 H new ATOM 0 HA VAL A 25 -12.351 7.676 -4.298 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.298 6.360 -4.213 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.072 4.259 -5.357 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.385 5.084 -4.483 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.270 5.222 -6.254 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -9.219 5.447 -6.280 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.267 6.499 -7.261 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.072 7.216 -6.153 1.00 0.00 H new ATOM 395 N GLY A 26 -11.236 10.146 -4.990 1.00 0.00 N ATOM 396 CA GLY A 26 -10.556 11.347 -4.507 1.00 0.00 C ATOM 397 C GLY A 26 -9.259 11.664 -5.265 1.00 0.00 C ATOM 398 O GLY A 26 -8.185 11.154 -4.947 1.00 0.00 O ATOM 0 H GLY A 26 -12.115 10.335 -5.472 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -11.233 12.197 -4.591 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.328 11.225 -3.448 1.00 0.00 H new ATOM 402 N PHE A 27 -9.327 12.559 -6.261 1.00 0.00 N ATOM 403 CA PHE A 27 -8.137 12.932 -7.024 1.00 0.00 C ATOM 404 C PHE A 27 -7.063 13.603 -6.159 1.00 0.00 C ATOM 405 O PHE A 27 -5.904 13.625 -6.565 1.00 0.00 O ATOM 406 CB PHE A 27 -8.465 13.764 -8.271 1.00 0.00 C ATOM 407 CG PHE A 27 -9.200 15.069 -8.037 1.00 0.00 C ATOM 408 CD1 PHE A 27 -10.606 15.095 -7.969 1.00 0.00 C ATOM 409 CD2 PHE A 27 -8.486 16.281 -8.074 1.00 0.00 C ATOM 410 CE1 PHE A 27 -11.290 16.320 -7.929 1.00 0.00 C ATOM 411 CE2 PHE A 27 -9.171 17.506 -8.041 1.00 0.00 C ATOM 412 CZ PHE A 27 -10.573 17.526 -7.975 1.00 0.00 C ATOM 0 H PHE A 27 -10.184 13.030 -6.551 1.00 0.00 H new ATOM 0 HA PHE A 27 -7.713 11.993 -7.378 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -7.532 13.986 -8.789 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.064 13.150 -8.943 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -11.161 14.169 -7.948 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -7.407 16.269 -8.128 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -12.368 16.335 -7.863 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.619 18.434 -8.066 1.00 0.00 H new ATOM 0 HZ PHE A 27 -11.100 18.469 -7.960 1.00 0.00 H new ATOM 422 N ALA A 28 -7.410 14.106 -4.969 1.00 0.00 N ATOM 423 CA ALA A 28 -6.459 14.603 -3.975 1.00 0.00 C ATOM 424 C ALA A 28 -5.229 13.692 -3.862 1.00 0.00 C ATOM 425 O ALA A 28 -4.089 14.133 -4.013 1.00 0.00 O ATOM 426 CB ALA A 28 -7.166 14.723 -2.620 1.00 0.00 C ATOM 0 H ALA A 28 -8.381 14.179 -4.666 1.00 0.00 H new ATOM 0 HA ALA A 28 -6.104 15.583 -4.294 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.463 15.093 -1.874 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.002 15.417 -2.706 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.537 13.744 -2.315 1.00 0.00 H new ATOM 432 N THR A 29 -5.462 12.398 -3.632 1.00 0.00 N ATOM 433 CA THR A 29 -4.389 11.431 -3.474 1.00 0.00 C ATOM 434 C THR A 29 -3.610 11.260 -4.783 1.00 0.00 C ATOM 435 O THR A 29 -2.414 10.978 -4.759 1.00 0.00 O ATOM 436 CB THR A 29 -4.982 10.107 -2.975 1.00 0.00 C ATOM 437 OG1 THR A 29 -5.941 10.380 -1.973 1.00 0.00 O ATOM 438 CG2 THR A 29 -3.904 9.184 -2.397 1.00 0.00 C ATOM 0 H THR A 29 -6.397 11.999 -3.551 1.00 0.00 H new ATOM 0 HA THR A 29 -3.673 11.790 -2.734 1.00 0.00 H new ATOM 0 HB THR A 29 -5.441 9.601 -3.824 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.091 9.575 -1.435 1.00 0.00 H new ATOM 0 HG21 THR A 29 -4.364 8.257 -2.055 1.00 0.00 H new ATOM 0 HG22 THR A 29 -3.166 8.960 -3.167 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.414 9.678 -1.558 1.00 0.00 H new ATOM 446 N ARG A 30 -4.272 11.421 -5.932 1.00 0.00 N ATOM 447 CA ARG A 30 -3.588 11.409 -7.217 1.00 0.00 C ATOM 448 C ARG A 30 -2.689 12.644 -7.307 1.00 0.00 C ATOM 449 O ARG A 30 -1.567 12.519 -7.781 1.00 0.00 O ATOM 450 CB ARG A 30 -4.568 11.324 -8.400 1.00 0.00 C ATOM 451 CG ARG A 30 -5.207 9.941 -8.625 1.00 0.00 C ATOM 452 CD ARG A 30 -5.940 9.352 -7.414 1.00 0.00 C ATOM 453 NE ARG A 30 -5.054 8.487 -6.617 1.00 0.00 N ATOM 454 CZ ARG A 30 -4.915 7.162 -6.791 1.00 0.00 C ATOM 455 NH1 ARG A 30 -5.470 6.569 -7.855 1.00 0.00 N ATOM 456 NH2 ARG A 30 -4.231 6.436 -5.899 1.00 0.00 N ATOM 0 H ARG A 30 -5.281 11.561 -5.993 1.00 0.00 H new ATOM 0 HA ARG A 30 -2.974 10.511 -7.282 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -5.363 12.053 -8.245 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -4.041 11.615 -9.309 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.911 10.015 -9.454 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -4.427 9.244 -8.931 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -6.320 10.160 -6.789 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -6.802 8.778 -7.753 1.00 0.00 H new ATOM 0 HE ARG A 30 -4.505 8.926 -5.878 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -5.996 7.123 -8.531 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.366 5.563 -7.990 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.814 6.888 -5.085 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -4.126 5.430 -6.033 1.00 0.00 H new ATOM 470 N GLN A 31 -3.131 13.810 -6.813 1.00 0.00 N ATOM 471 CA GLN A 31 -2.310 15.017 -6.849 1.00 0.00 C ATOM 472 C GLN A 31 -1.011 14.755 -6.098 1.00 0.00 C ATOM 473 O GLN A 31 0.076 14.863 -6.661 1.00 0.00 O ATOM 474 CB GLN A 31 -3.013 16.255 -6.255 1.00 0.00 C ATOM 475 CG GLN A 31 -4.404 16.576 -6.813 1.00 0.00 C ATOM 476 CD GLN A 31 -4.479 16.368 -8.317 1.00 0.00 C ATOM 477 OE1 GLN A 31 -4.075 17.232 -9.087 1.00 0.00 O ATOM 478 NE2 GLN A 31 -4.984 15.212 -8.727 1.00 0.00 N ATOM 0 H GLN A 31 -4.049 13.937 -6.387 1.00 0.00 H new ATOM 0 HA GLN A 31 -2.118 15.245 -7.898 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -3.100 16.116 -5.177 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -2.372 17.122 -6.413 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -5.145 15.945 -6.323 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.659 17.609 -6.577 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.307 14.526 -8.045 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.050 15.009 -9.724 1.00 0.00 H new ATOM 487 N VAL A 32 -1.113 14.383 -4.820 1.00 0.00 N ATOM 488 CA VAL A 32 0.086 14.121 -4.034 1.00 0.00 C ATOM 489 C VAL A 32 0.895 13.007 -4.715 1.00 0.00 C ATOM 490 O VAL A 32 2.101 13.140 -4.927 1.00 0.00 O ATOM 491 CB VAL A 32 -0.275 13.874 -2.550 1.00 0.00 C ATOM 492 CG1 VAL A 32 -0.410 12.396 -2.160 1.00 0.00 C ATOM 493 CG2 VAL A 32 0.743 14.543 -1.619 1.00 0.00 C ATOM 0 H VAL A 32 -1.993 14.260 -4.320 1.00 0.00 H new ATOM 0 HA VAL A 32 0.740 14.992 -4.005 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.262 14.322 -2.431 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -0.664 12.320 -1.103 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -1.196 11.933 -2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.534 11.884 -2.344 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.466 14.354 -0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.735 14.134 -1.810 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.752 15.617 -1.802 1.00 0.00 H new ATOM 503 N GLY A 33 0.197 11.942 -5.122 1.00 0.00 N ATOM 504 CA GLY A 33 0.771 10.745 -5.701 1.00 0.00 C ATOM 505 C GLY A 33 1.347 10.921 -7.106 1.00 0.00 C ATOM 506 O GLY A 33 2.043 10.008 -7.553 1.00 0.00 O ATOM 0 H GLY A 33 -0.820 11.898 -5.050 1.00 0.00 H new ATOM 0 HA2 GLY A 33 1.561 10.384 -5.043 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.004 9.971 -5.733 1.00 0.00 H new ATOM 510 N ASN A 34 1.047 12.022 -7.808 1.00 0.00 N ATOM 511 CA ASN A 34 1.608 12.359 -9.118 1.00 0.00 C ATOM 512 C ASN A 34 2.686 13.440 -8.985 1.00 0.00 C ATOM 513 O ASN A 34 3.706 13.372 -9.667 1.00 0.00 O ATOM 514 CB ASN A 34 0.519 12.662 -10.181 1.00 0.00 C ATOM 515 CG ASN A 34 -0.275 13.970 -10.048 1.00 0.00 C ATOM 516 OD1 ASN A 34 0.204 14.955 -9.502 1.00 0.00 O ATOM 517 ND2 ASN A 34 -1.493 14.020 -10.580 1.00 0.00 N ATOM 0 H ASN A 34 0.387 12.722 -7.468 1.00 0.00 H new ATOM 0 HA ASN A 34 2.111 11.475 -9.509 1.00 0.00 H new ATOM 0 HB2 ASN A 34 0.998 12.661 -11.160 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -0.193 11.837 -10.174 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -2.034 14.883 -10.535 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -1.886 13.195 -11.033 1.00 0.00 H new ATOM 524 N MET A 35 2.488 14.416 -8.095 1.00 0.00 N ATOM 525 CA MET A 35 3.322 15.605 -7.996 1.00 0.00 C ATOM 526 C MET A 35 4.487 15.405 -7.024 1.00 0.00 C ATOM 527 O MET A 35 5.615 15.807 -7.308 1.00 0.00 O ATOM 528 CB MET A 35 2.425 16.771 -7.554 1.00 0.00 C ATOM 529 CG MET A 35 3.120 18.135 -7.589 1.00 0.00 C ATOM 530 SD MET A 35 1.990 19.505 -7.216 1.00 0.00 S ATOM 531 CE MET A 35 3.136 20.902 -7.331 1.00 0.00 C ATOM 0 H MET A 35 1.729 14.397 -7.414 1.00 0.00 H new ATOM 0 HA MET A 35 3.771 15.819 -8.966 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.546 16.805 -8.198 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.071 16.580 -6.541 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.940 18.139 -6.870 1.00 0.00 H new ATOM 0 HG3 MET A 35 3.559 18.289 -8.575 1.00 0.00 H new ATOM 0 HE1 MET A 35 2.601 21.829 -7.128 1.00 0.00 H new ATOM 0 HE2 MET A 35 3.936 20.777 -6.601 1.00 0.00 H new ATOM 0 HE3 MET A 35 3.562 20.941 -8.333 1.00 0.00 H new ATOM 541 N THR A 36 4.207 14.871 -5.835 1.00 0.00 N ATOM 542 CA THR A 36 5.106 14.993 -4.694 1.00 0.00 C ATOM 543 C THR A 36 5.930 13.715 -4.548 1.00 0.00 C ATOM 544 O THR A 36 5.475 12.789 -3.881 1.00 0.00 O ATOM 545 CB THR A 36 4.264 15.319 -3.451 1.00 0.00 C ATOM 546 OG1 THR A 36 3.524 16.496 -3.708 1.00 0.00 O ATOM 547 CG2 THR A 36 5.115 15.541 -2.197 1.00 0.00 C ATOM 0 H THR A 36 3.355 14.345 -5.639 1.00 0.00 H new ATOM 0 HA THR A 36 5.822 15.803 -4.834 1.00 0.00 H new ATOM 0 HB THR A 36 3.616 14.464 -3.259 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.979 16.717 -2.924 1.00 0.00 H new ATOM 0 HG21 THR A 36 4.465 15.768 -1.352 1.00 0.00 H new ATOM 0 HG22 THR A 36 5.689 14.639 -1.982 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.798 16.374 -2.363 1.00 0.00 H new ATOM 555 N LYS A 37 7.114 13.676 -5.191 1.00 0.00 N ATOM 556 CA LYS A 37 8.068 12.557 -5.239 1.00 0.00 C ATOM 557 C LYS A 37 7.538 11.274 -4.580 1.00 0.00 C ATOM 558 O LYS A 37 7.954 10.943 -3.468 1.00 0.00 O ATOM 559 CB LYS A 37 9.422 12.933 -4.608 1.00 0.00 C ATOM 560 CG LYS A 37 10.320 13.856 -5.445 1.00 0.00 C ATOM 561 CD LYS A 37 10.171 15.338 -5.068 1.00 0.00 C ATOM 562 CE LYS A 37 11.322 16.191 -5.627 1.00 0.00 C ATOM 563 NZ LYS A 37 12.614 15.921 -4.956 1.00 0.00 N ATOM 0 H LYS A 37 7.448 14.479 -5.724 1.00 0.00 H new ATOM 0 HA LYS A 37 8.207 12.350 -6.300 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.232 13.415 -3.649 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.971 12.015 -4.400 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.360 13.557 -5.317 1.00 0.00 H new ATOM 0 HG3 LYS A 37 10.080 13.729 -6.501 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.222 15.716 -5.448 1.00 0.00 H new ATOM 0 HD3 LYS A 37 10.141 15.435 -3.983 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.425 15.999 -6.695 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.073 17.246 -5.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 13.298 16.663 -5.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 12.475 15.915 -3.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 12.978 14.996 -5.262 1.00 0.00 H new ATOM 577 N PRO A 38 6.618 10.557 -5.242 1.00 0.00 N ATOM 578 CA PRO A 38 5.924 9.438 -4.637 1.00 0.00 C ATOM 579 C PRO A 38 6.911 8.296 -4.404 1.00 0.00 C ATOM 580 O PRO A 38 7.192 7.493 -5.295 1.00 0.00 O ATOM 581 CB PRO A 38 4.766 9.102 -5.575 1.00 0.00 C ATOM 582 CG PRO A 38 5.253 9.620 -6.922 1.00 0.00 C ATOM 583 CD PRO A 38 6.100 10.835 -6.570 1.00 0.00 C ATOM 0 HA PRO A 38 5.512 9.657 -3.652 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.567 8.031 -5.603 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.842 9.590 -5.266 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.837 8.867 -7.451 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.419 9.890 -7.570 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.908 10.975 -7.288 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.504 11.748 -6.579 1.00 0.00 H new ATOM 591 N THR A 39 7.465 8.273 -3.193 1.00 0.00 N ATOM 592 CA THR A 39 8.492 7.347 -2.772 1.00 0.00 C ATOM 593 C THR A 39 7.804 6.111 -2.205 1.00 0.00 C ATOM 594 O THR A 39 6.660 6.159 -1.747 1.00 0.00 O ATOM 595 CB THR A 39 9.409 8.064 -1.772 1.00 0.00 C ATOM 596 OG1 THR A 39 9.914 9.236 -2.378 1.00 0.00 O ATOM 597 CG2 THR A 39 10.612 7.213 -1.372 1.00 0.00 C ATOM 0 H THR A 39 7.195 8.926 -2.458 1.00 0.00 H new ATOM 0 HA THR A 39 9.125 7.014 -3.594 1.00 0.00 H new ATOM 0 HB THR A 39 8.814 8.276 -0.883 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.173 9.842 -2.587 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.229 7.766 -0.663 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.266 6.289 -0.909 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.201 6.976 -2.258 1.00 0.00 H new ATOM 605 N THR A 40 8.446 4.954 -2.306 1.00 0.00 N ATOM 606 CA THR A 40 7.808 3.693 -1.995 1.00 0.00 C ATOM 607 C THR A 40 8.812 2.803 -1.277 1.00 0.00 C ATOM 608 O THR A 40 9.996 2.826 -1.594 1.00 0.00 O ATOM 609 CB THR A 40 7.193 3.136 -3.283 1.00 0.00 C ATOM 610 OG1 THR A 40 6.101 3.977 -3.637 1.00 0.00 O ATOM 611 CG2 THR A 40 6.664 1.710 -3.151 1.00 0.00 C ATOM 0 H THR A 40 9.418 4.869 -2.604 1.00 0.00 H new ATOM 0 HA THR A 40 6.974 3.785 -1.299 1.00 0.00 H new ATOM 0 HB THR A 40 7.982 3.113 -4.034 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.935 3.909 -4.600 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.245 1.388 -4.104 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.480 1.044 -2.870 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.889 1.679 -2.385 1.00 0.00 H new ATOM 619 N ILE A 41 8.360 2.058 -0.271 1.00 0.00 N ATOM 620 CA ILE A 41 9.198 1.144 0.492 1.00 0.00 C ATOM 621 C ILE A 41 8.558 -0.224 0.316 1.00 0.00 C ATOM 622 O ILE A 41 7.332 -0.304 0.394 1.00 0.00 O ATOM 623 CB ILE A 41 9.305 1.631 1.958 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.767 1.822 2.398 1.00 0.00 C ATOM 625 CG2 ILE A 41 8.549 0.772 2.977 1.00 0.00 C ATOM 626 CD1 ILE A 41 11.562 0.519 2.527 1.00 0.00 C ATOM 0 H ILE A 41 7.388 2.074 0.039 1.00 0.00 H new ATOM 0 HA ILE A 41 10.232 1.097 0.150 1.00 0.00 H new ATOM 0 HB ILE A 41 8.805 2.600 1.953 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.269 2.470 1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.781 2.339 3.358 1.00 0.00 H new ATOM 0 HG21 ILE A 41 8.682 1.190 3.975 1.00 0.00 H new ATOM 0 HG22 ILE A 41 7.488 0.760 2.727 1.00 0.00 H new ATOM 0 HG23 ILE A 41 8.939 -0.246 2.955 1.00 0.00 H new ATOM 0 HD11 ILE A 41 12.581 0.744 2.841 1.00 0.00 H new ATOM 0 HD12 ILE A 41 11.088 -0.125 3.268 1.00 0.00 H new ATOM 0 HD13 ILE A 41 11.583 0.009 1.564 1.00 0.00 H new ATOM 638 N ILE A 42 9.346 -1.258 0.001 1.00 0.00 N ATOM 639 CA ILE A 42 8.851 -2.616 -0.170 1.00 0.00 C ATOM 640 C ILE A 42 9.693 -3.556 0.699 1.00 0.00 C ATOM 641 O ILE A 42 10.863 -3.804 0.401 1.00 0.00 O ATOM 642 CB ILE A 42 8.819 -3.016 -1.657 1.00 0.00 C ATOM 643 CG1 ILE A 42 8.047 -1.972 -2.484 1.00 0.00 C ATOM 644 CG2 ILE A 42 8.137 -4.384 -1.773 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.876 -2.337 -3.963 1.00 0.00 C ATOM 0 H ILE A 42 10.352 -1.168 -0.142 1.00 0.00 H new ATOM 0 HA ILE A 42 7.816 -2.687 0.165 1.00 0.00 H new ATOM 0 HB ILE A 42 9.837 -3.066 -2.045 1.00 0.00 H new ATOM 0 HG12 ILE A 42 7.061 -1.832 -2.041 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.566 -1.016 -2.416 1.00 0.00 H new ATOM 0 HG21 ILE A 42 8.104 -4.686 -2.820 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.700 -5.121 -1.200 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.122 -4.319 -1.382 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.322 -1.548 -4.471 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.856 -2.447 -4.426 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.328 -3.276 -4.045 1.00 0.00 H new ATOM 657 N GLU A 43 9.094 -4.043 1.788 1.00 0.00 N ATOM 658 CA GLU A 43 9.737 -4.787 2.860 1.00 0.00 C ATOM 659 C GLU A 43 9.242 -6.233 2.838 1.00 0.00 C ATOM 660 O GLU A 43 8.102 -6.496 3.235 1.00 0.00 O ATOM 661 CB GLU A 43 9.369 -4.124 4.197 1.00 0.00 C ATOM 662 CG GLU A 43 9.941 -2.706 4.308 1.00 0.00 C ATOM 663 CD GLU A 43 9.233 -1.894 5.390 1.00 0.00 C ATOM 664 OE1 GLU A 43 8.019 -1.645 5.215 1.00 0.00 O ATOM 665 OE2 GLU A 43 9.918 -1.533 6.370 1.00 0.00 O ATOM 0 H GLU A 43 8.094 -3.919 1.949 1.00 0.00 H new ATOM 0 HA GLU A 43 10.819 -4.784 2.732 1.00 0.00 H new ATOM 0 HB2 GLU A 43 8.284 -4.087 4.297 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.745 -4.733 5.020 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.006 -2.760 4.532 1.00 0.00 H new ATOM 0 HG3 GLU A 43 9.842 -2.198 3.349 1.00 0.00 H new ATOM 672 N VAL A 44 10.087 -7.176 2.401 1.00 0.00 N ATOM 673 CA VAL A 44 9.765 -8.594 2.503 1.00 0.00 C ATOM 674 C VAL A 44 9.734 -8.984 3.983 1.00 0.00 C ATOM 675 O VAL A 44 10.756 -9.019 4.663 1.00 0.00 O ATOM 676 CB VAL A 44 10.692 -9.470 1.637 1.00 0.00 C ATOM 677 CG1 VAL A 44 12.111 -9.652 2.195 1.00 0.00 C ATOM 678 CG2 VAL A 44 10.059 -10.853 1.428 1.00 0.00 C ATOM 0 H VAL A 44 10.993 -6.978 1.976 1.00 0.00 H new ATOM 0 HA VAL A 44 8.774 -8.779 2.089 1.00 0.00 H new ATOM 0 HB VAL A 44 10.799 -8.932 0.695 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.690 -10.282 1.519 1.00 0.00 H new ATOM 0 HG12 VAL A 44 12.594 -8.679 2.286 1.00 0.00 H new ATOM 0 HG13 VAL A 44 12.058 -10.125 3.176 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.719 -11.467 0.815 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.909 -11.334 2.394 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.098 -10.741 0.926 1.00 0.00 H new ATOM 688 N ASN A 45 8.540 -9.252 4.494 1.00 0.00 N ATOM 689 CA ASN A 45 8.316 -9.669 5.866 1.00 0.00 C ATOM 690 C ASN A 45 8.295 -11.198 5.862 1.00 0.00 C ATOM 691 O ASN A 45 7.280 -11.843 6.113 1.00 0.00 O ATOM 692 CB ASN A 45 7.029 -9.017 6.388 1.00 0.00 C ATOM 693 CG ASN A 45 7.251 -7.591 6.883 1.00 0.00 C ATOM 694 OD1 ASN A 45 7.134 -7.322 8.074 1.00 0.00 O ATOM 695 ND2 ASN A 45 7.554 -6.655 5.988 1.00 0.00 N ATOM 0 H ASN A 45 7.680 -9.183 3.949 1.00 0.00 H new ATOM 0 HA ASN A 45 9.101 -9.346 6.549 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.282 -9.010 5.594 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.624 -9.621 7.200 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.694 -5.690 6.287 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.646 -6.902 5.003 1.00 0.00 H new ATOM 702 N GLY A 46 9.448 -11.787 5.539 1.00 0.00 N ATOM 703 CA GLY A 46 9.612 -13.229 5.454 1.00 0.00 C ATOM 704 C GLY A 46 8.769 -13.818 4.323 1.00 0.00 C ATOM 705 O GLY A 46 9.270 -13.970 3.211 1.00 0.00 O ATOM 0 H GLY A 46 10.299 -11.266 5.328 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.663 -13.469 5.290 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.325 -13.686 6.401 1.00 0.00 H new ATOM 709 N ASP A 47 7.508 -14.157 4.615 1.00 0.00 N ATOM 710 CA ASP A 47 6.562 -14.729 3.659 1.00 0.00 C ATOM 711 C ASP A 47 5.437 -13.750 3.296 1.00 0.00 C ATOM 712 O ASP A 47 4.645 -14.032 2.395 1.00 0.00 O ATOM 713 CB ASP A 47 6.058 -16.101 4.144 1.00 0.00 C ATOM 714 CG ASP A 47 4.880 -16.071 5.106 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.446 -14.981 5.540 1.00 0.00 O ATOM 716 OD2 ASP A 47 4.302 -17.150 5.366 1.00 0.00 O ATOM 0 H ASP A 47 7.111 -14.037 5.547 1.00 0.00 H new ATOM 0 HA ASP A 47 7.090 -14.906 2.722 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.776 -16.692 3.273 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.885 -16.620 4.628 1.00 0.00 H new ATOM 721 N THR A 48 5.377 -12.591 3.959 1.00 0.00 N ATOM 722 CA THR A 48 4.571 -11.463 3.530 1.00 0.00 C ATOM 723 C THR A 48 5.494 -10.441 2.872 1.00 0.00 C ATOM 724 O THR A 48 6.718 -10.550 2.952 1.00 0.00 O ATOM 725 CB THR A 48 3.816 -10.871 4.733 1.00 0.00 C ATOM 726 OG1 THR A 48 4.663 -10.750 5.849 1.00 0.00 O ATOM 727 CG2 THR A 48 2.662 -11.780 5.144 1.00 0.00 C ATOM 0 H THR A 48 5.897 -12.416 4.819 1.00 0.00 H new ATOM 0 HA THR A 48 3.819 -11.774 2.804 1.00 0.00 H new ATOM 0 HB THR A 48 3.448 -9.892 4.425 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.162 -10.370 6.601 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.141 -11.344 5.996 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.968 -11.887 4.310 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.051 -12.760 5.420 1.00 0.00 H new ATOM 735 N VAL A 49 4.921 -9.433 2.220 1.00 0.00 N ATOM 736 CA VAL A 49 5.662 -8.289 1.729 1.00 0.00 C ATOM 737 C VAL A 49 4.782 -7.051 1.872 1.00 0.00 C ATOM 738 O VAL A 49 3.693 -6.970 1.303 1.00 0.00 O ATOM 739 CB VAL A 49 6.233 -8.550 0.325 1.00 0.00 C ATOM 740 CG1 VAL A 49 5.193 -8.918 -0.731 1.00 0.00 C ATOM 741 CG2 VAL A 49 7.029 -7.347 -0.190 1.00 0.00 C ATOM 0 H VAL A 49 3.922 -9.393 2.019 1.00 0.00 H new ATOM 0 HA VAL A 49 6.555 -8.105 2.327 1.00 0.00 H new ATOM 0 HB VAL A 49 6.879 -9.417 0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.689 -9.083 -1.688 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.674 -9.828 -0.429 1.00 0.00 H new ATOM 0 HG13 VAL A 49 4.473 -8.106 -0.831 1.00 0.00 H new ATOM 0 HG21 VAL A 49 7.418 -7.567 -1.184 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.378 -6.474 -0.240 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.859 -7.143 0.487 1.00 0.00 H new ATOM 751 N ILE A 50 5.244 -6.109 2.692 1.00 0.00 N ATOM 752 CA ILE A 50 4.575 -4.841 2.909 1.00 0.00 C ATOM 753 C ILE A 50 5.096 -3.882 1.849 1.00 0.00 C ATOM 754 O ILE A 50 6.306 -3.809 1.648 1.00 0.00 O ATOM 755 CB ILE A 50 4.844 -4.369 4.352 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.791 -5.001 5.280 1.00 0.00 C ATOM 757 CG2 ILE A 50 4.811 -2.843 4.488 1.00 0.00 C ATOM 758 CD1 ILE A 50 4.148 -4.906 6.766 1.00 0.00 C ATOM 0 H ILE A 50 6.105 -6.213 3.228 1.00 0.00 H new ATOM 0 HA ILE A 50 3.492 -4.910 2.810 1.00 0.00 H new ATOM 0 HB ILE A 50 5.848 -4.688 4.631 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.831 -4.512 5.113 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.665 -6.050 5.011 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.006 -2.566 5.524 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.573 -2.404 3.845 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.829 -2.473 4.192 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.361 -5.372 7.360 1.00 0.00 H new ATOM 0 HD12 ILE A 50 5.092 -5.420 6.947 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.245 -3.858 7.051 1.00 0.00 H new ATOM 770 N ILE A 51 4.194 -3.156 1.183 1.00 0.00 N ATOM 771 CA ILE A 51 4.540 -2.005 0.365 1.00 0.00 C ATOM 772 C ILE A 51 3.889 -0.769 0.987 1.00 0.00 C ATOM 773 O ILE A 51 2.715 -0.815 1.357 1.00 0.00 O ATOM 774 CB ILE A 51 4.188 -2.224 -1.120 1.00 0.00 C ATOM 775 CG1 ILE A 51 4.379 -0.913 -1.906 1.00 0.00 C ATOM 776 CG2 ILE A 51 2.766 -2.750 -1.321 1.00 0.00 C ATOM 777 CD1 ILE A 51 4.347 -1.118 -3.424 1.00 0.00 C ATOM 0 H ILE A 51 3.194 -3.358 1.201 1.00 0.00 H new ATOM 0 HA ILE A 51 5.619 -1.853 0.357 1.00 0.00 H new ATOM 0 HB ILE A 51 4.867 -2.988 -1.498 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.597 -0.208 -1.623 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.331 -0.462 -1.625 1.00 0.00 H new ATOM 0 HG21 ILE A 51 2.575 -2.885 -2.386 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.656 -3.706 -0.809 1.00 0.00 H new ATOM 0 HG23 ILE A 51 2.052 -2.035 -0.912 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.487 -0.159 -3.924 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.146 -1.799 -3.716 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.385 -1.541 -3.714 1.00 0.00 H new ATOM 789 N LYS A 52 4.653 0.320 1.121 1.00 0.00 N ATOM 790 CA LYS A 52 4.177 1.604 1.623 1.00 0.00 C ATOM 791 C LYS A 52 4.433 2.671 0.575 1.00 0.00 C ATOM 792 O LYS A 52 5.516 2.680 -0.009 1.00 0.00 O ATOM 793 CB LYS A 52 4.892 1.989 2.918 1.00 0.00 C ATOM 794 CG LYS A 52 4.807 0.831 3.906 1.00 0.00 C ATOM 795 CD LYS A 52 5.178 1.249 5.336 1.00 0.00 C ATOM 796 CE LYS A 52 4.151 0.529 6.210 1.00 0.00 C ATOM 797 NZ LYS A 52 4.333 0.631 7.665 1.00 0.00 N ATOM 0 H LYS A 52 5.643 0.329 0.876 1.00 0.00 H new ATOM 0 HA LYS A 52 3.110 1.521 1.831 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.935 2.231 2.713 1.00 0.00 H new ATOM 0 HB3 LYS A 52 4.436 2.882 3.347 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.795 0.427 3.900 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.472 0.031 3.581 1.00 0.00 H new ATOM 0 HD2 LYS A 52 6.196 0.951 5.588 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.122 2.330 5.463 1.00 0.00 H new ATOM 0 HE2 LYS A 52 3.163 0.917 5.963 1.00 0.00 H new ATOM 0 HE3 LYS A 52 4.156 -0.527 5.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 3.461 0.332 8.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.119 0.018 7.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.548 1.616 7.920 1.00 0.00 H new ATOM 811 N THR A 53 3.457 3.555 0.355 1.00 0.00 N ATOM 812 CA THR A 53 3.396 4.471 -0.780 1.00 0.00 C ATOM 813 C THR A 53 3.724 5.924 -0.398 1.00 0.00 C ATOM 814 O THR A 53 3.372 6.844 -1.134 1.00 0.00 O ATOM 815 CB THR A 53 1.964 4.369 -1.325 1.00 0.00 C ATOM 816 OG1 THR A 53 1.074 4.514 -0.234 1.00 0.00 O ATOM 817 CG2 THR A 53 1.707 3.002 -1.967 1.00 0.00 C ATOM 0 H THR A 53 2.661 3.654 0.986 1.00 0.00 H new ATOM 0 HA THR A 53 4.145 4.194 -1.522 1.00 0.00 H new ATOM 0 HB THR A 53 1.819 5.142 -2.080 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.194 4.161 -0.481 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.684 2.963 -2.343 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.403 2.851 -2.792 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.851 2.218 -1.223 1.00 0.00 H new ATOM 825 N GLN A 54 4.343 6.140 0.769 1.00 0.00 N ATOM 826 CA GLN A 54 4.596 7.450 1.358 1.00 0.00 C ATOM 827 C GLN A 54 5.117 8.502 0.367 1.00 0.00 C ATOM 828 O GLN A 54 6.269 8.476 -0.062 1.00 0.00 O ATOM 829 CB GLN A 54 5.462 7.347 2.629 1.00 0.00 C ATOM 830 CG GLN A 54 6.901 6.826 2.478 1.00 0.00 C ATOM 831 CD GLN A 54 6.954 5.329 2.210 1.00 0.00 C ATOM 832 OE1 GLN A 54 7.007 4.529 3.137 1.00 0.00 O ATOM 833 NE2 GLN A 54 6.884 4.929 0.946 1.00 0.00 N ATOM 0 H GLN A 54 4.692 5.375 1.346 1.00 0.00 H new ATOM 0 HA GLN A 54 3.619 7.827 1.659 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.511 8.337 3.082 1.00 0.00 H new ATOM 0 HB3 GLN A 54 4.944 6.698 3.335 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.392 7.356 1.661 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.462 7.049 3.386 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.841 5.618 0.195 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.873 3.933 0.726 1.00 0.00 H new ATOM 842 N SER A 55 4.262 9.476 0.048 1.00 0.00 N ATOM 843 CA SER A 55 4.647 10.644 -0.727 1.00 0.00 C ATOM 844 C SER A 55 5.627 11.513 0.067 1.00 0.00 C ATOM 845 O SER A 55 6.611 12.012 -0.478 1.00 0.00 O ATOM 846 CB SER A 55 3.380 11.399 -1.128 1.00 0.00 C ATOM 847 OG SER A 55 3.684 12.549 -1.873 1.00 0.00 O ATOM 0 H SER A 55 3.280 9.471 0.324 1.00 0.00 H new ATOM 0 HA SER A 55 5.170 10.347 -1.636 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.734 10.744 -1.713 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.823 11.679 -0.234 1.00 0.00 H new ATOM 0 HG SER A 55 4.364 12.333 -2.545 1.00 0.00 H new ATOM 853 N THR A 56 5.372 11.684 1.367 1.00 0.00 N ATOM 854 CA THR A 56 6.315 12.330 2.270 1.00 0.00 C ATOM 855 C THR A 56 6.142 11.736 3.667 1.00 0.00 C ATOM 856 O THR A 56 6.935 10.894 4.075 1.00 0.00 O ATOM 857 CB THR A 56 6.179 13.865 2.214 1.00 0.00 C ATOM 858 OG1 THR A 56 6.030 14.300 0.884 1.00 0.00 O ATOM 859 CG2 THR A 56 7.439 14.541 2.743 1.00 0.00 C ATOM 0 H THR A 56 4.509 11.379 1.817 1.00 0.00 H new ATOM 0 HA THR A 56 7.341 12.133 1.958 1.00 0.00 H new ATOM 0 HB THR A 56 5.310 14.126 2.818 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.944 15.276 0.867 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.319 15.623 2.694 1.00 0.00 H new ATOM 0 HG22 THR A 56 7.606 14.241 3.778 1.00 0.00 H new ATOM 0 HG23 THR A 56 8.294 14.242 2.137 1.00 0.00 H new ATOM 867 N PHE A 57 5.080 12.120 4.385 1.00 0.00 N ATOM 868 CA PHE A 57 4.800 11.551 5.697 1.00 0.00 C ATOM 869 C PHE A 57 4.317 10.107 5.561 1.00 0.00 C ATOM 870 O PHE A 57 4.840 9.209 6.214 1.00 0.00 O ATOM 871 CB PHE A 57 3.757 12.396 6.442 1.00 0.00 C ATOM 872 CG PHE A 57 4.299 13.666 7.064 1.00 0.00 C ATOM 873 CD1 PHE A 57 5.009 13.591 8.277 1.00 0.00 C ATOM 874 CD2 PHE A 57 4.036 14.922 6.487 1.00 0.00 C ATOM 875 CE1 PHE A 57 5.438 14.764 8.919 1.00 0.00 C ATOM 876 CE2 PHE A 57 4.472 16.095 7.128 1.00 0.00 C ATOM 877 CZ PHE A 57 5.167 16.017 8.346 1.00 0.00 C ATOM 0 H PHE A 57 4.406 12.820 4.076 1.00 0.00 H new ATOM 0 HA PHE A 57 5.723 11.555 6.276 1.00 0.00 H new ATOM 0 HB2 PHE A 57 2.959 12.659 5.747 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.308 11.786 7.226 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.225 12.628 8.716 1.00 0.00 H new ATOM 0 HD2 PHE A 57 3.499 14.985 5.552 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.976 14.702 9.853 1.00 0.00 H new ATOM 0 HE2 PHE A 57 4.272 17.058 6.683 1.00 0.00 H new ATOM 0 HZ PHE A 57 5.493 16.920 8.841 1.00 0.00 H new ATOM 887 N LYS A 58 3.269 9.899 4.759 1.00 0.00 N ATOM 888 CA LYS A 58 2.537 8.643 4.671 1.00 0.00 C ATOM 889 C LYS A 58 1.510 8.780 3.551 1.00 0.00 C ATOM 890 O LYS A 58 1.149 9.904 3.204 1.00 0.00 O ATOM 891 CB LYS A 58 1.876 8.294 6.020 1.00 0.00 C ATOM 892 CG LYS A 58 1.020 9.426 6.615 1.00 0.00 C ATOM 893 CD LYS A 58 0.835 9.214 8.125 1.00 0.00 C ATOM 894 CE LYS A 58 0.130 10.420 8.767 1.00 0.00 C ATOM 895 NZ LYS A 58 0.022 10.287 10.236 1.00 0.00 N ATOM 0 H LYS A 58 2.901 10.621 4.139 1.00 0.00 H new ATOM 0 HA LYS A 58 3.216 7.821 4.443 1.00 0.00 H new ATOM 0 HB2 LYS A 58 1.250 7.412 5.887 1.00 0.00 H new ATOM 0 HB3 LYS A 58 2.654 8.028 6.735 1.00 0.00 H new ATOM 0 HG2 LYS A 58 1.498 10.388 6.431 1.00 0.00 H new ATOM 0 HG3 LYS A 58 0.048 9.454 6.123 1.00 0.00 H new ATOM 0 HD2 LYS A 58 0.251 8.311 8.300 1.00 0.00 H new ATOM 0 HD3 LYS A 58 1.806 9.062 8.596 1.00 0.00 H new ATOM 0 HE2 LYS A 58 0.679 11.330 8.526 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -0.867 10.526 8.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -0.460 11.122 10.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -0.524 9.433 10.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.974 10.212 10.649 1.00 0.00 H new ATOM 909 N ASN A 59 1.073 7.660 2.971 1.00 0.00 N ATOM 910 CA ASN A 59 -0.031 7.590 2.013 1.00 0.00 C ATOM 911 C ASN A 59 -0.876 6.379 2.406 1.00 0.00 C ATOM 912 O ASN A 59 -1.902 6.540 3.061 1.00 0.00 O ATOM 913 CB ASN A 59 0.481 7.473 0.564 1.00 0.00 C ATOM 914 CG ASN A 59 0.569 8.785 -0.219 1.00 0.00 C ATOM 915 OD1 ASN A 59 0.322 8.808 -1.420 1.00 0.00 O ATOM 916 ND2 ASN A 59 0.907 9.899 0.423 1.00 0.00 N ATOM 0 H ASN A 59 1.491 6.749 3.161 1.00 0.00 H new ATOM 0 HA ASN A 59 -0.625 8.503 2.045 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.471 7.017 0.584 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.174 6.791 0.021 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.963 10.783 -0.083 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.111 9.870 1.422 1.00 0.00 H new ATOM 923 N THR A 60 -0.435 5.170 2.044 1.00 0.00 N ATOM 924 CA THR A 60 -1.085 3.916 2.406 1.00 0.00 C ATOM 925 C THR A 60 -0.015 2.855 2.693 1.00 0.00 C ATOM 926 O THR A 60 1.125 2.979 2.235 1.00 0.00 O ATOM 927 CB THR A 60 -2.044 3.465 1.284 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.517 3.795 0.012 1.00 0.00 O ATOM 929 CG2 THR A 60 -3.419 4.132 1.402 1.00 0.00 C ATOM 0 H THR A 60 0.403 5.038 1.478 1.00 0.00 H new ATOM 0 HA THR A 60 -1.682 4.058 3.307 1.00 0.00 H new ATOM 0 HB THR A 60 -2.152 2.386 1.390 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.138 3.500 -0.686 1.00 0.00 H new ATOM 0 HG21 THR A 60 -4.062 3.786 0.593 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.869 3.871 2.360 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.305 5.214 1.338 1.00 0.00 H new ATOM 937 N GLU A 61 -0.402 1.827 3.458 1.00 0.00 N ATOM 938 CA GLU A 61 0.317 0.580 3.656 1.00 0.00 C ATOM 939 C GLU A 61 -0.543 -0.486 2.981 1.00 0.00 C ATOM 940 O GLU A 61 -1.756 -0.475 3.180 1.00 0.00 O ATOM 941 CB GLU A 61 0.441 0.293 5.165 1.00 0.00 C ATOM 942 CG GLU A 61 1.190 -1.022 5.439 1.00 0.00 C ATOM 943 CD GLU A 61 1.421 -1.304 6.925 1.00 0.00 C ATOM 944 OE1 GLU A 61 1.958 -0.405 7.615 1.00 0.00 O ATOM 945 OE2 GLU A 61 1.112 -2.440 7.336 1.00 0.00 O ATOM 0 H GLU A 61 -1.277 1.853 3.982 1.00 0.00 H new ATOM 0 HA GLU A 61 1.325 0.607 3.243 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.965 1.117 5.649 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.554 0.243 5.608 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.626 -1.848 5.006 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.154 -0.993 4.930 1.00 0.00 H new ATOM 952 N ILE A 62 0.057 -1.372 2.183 1.00 0.00 N ATOM 953 CA ILE A 62 -0.622 -2.526 1.611 1.00 0.00 C ATOM 954 C ILE A 62 0.251 -3.744 1.938 1.00 0.00 C ATOM 955 O ILE A 62 1.422 -3.797 1.557 1.00 0.00 O ATOM 956 CB ILE A 62 -0.876 -2.314 0.105 1.00 0.00 C ATOM 957 CG1 ILE A 62 -1.767 -1.078 -0.131 1.00 0.00 C ATOM 958 CG2 ILE A 62 -1.506 -3.566 -0.517 1.00 0.00 C ATOM 959 CD1 ILE A 62 -1.983 -0.756 -1.614 1.00 0.00 C ATOM 0 H ILE A 62 1.039 -1.303 1.916 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.615 -2.681 2.034 1.00 0.00 H new ATOM 0 HB ILE A 62 0.083 -2.137 -0.382 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.735 -1.242 0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.315 -0.215 0.358 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.678 -3.397 -1.580 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.833 -4.414 -0.388 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.455 -3.778 -0.025 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.619 0.125 -1.706 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.021 -0.560 -2.088 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.463 -1.603 -2.104 1.00 0.00 H new ATOM 971 N SER A 63 -0.301 -4.681 2.711 1.00 0.00 N ATOM 972 CA SER A 63 0.402 -5.750 3.396 1.00 0.00 C ATOM 973 C SER A 63 0.146 -7.092 2.703 1.00 0.00 C ATOM 974 O SER A 63 -0.692 -7.879 3.136 1.00 0.00 O ATOM 975 CB SER A 63 -0.100 -5.718 4.847 1.00 0.00 C ATOM 976 OG SER A 63 -1.476 -5.365 4.864 1.00 0.00 O ATOM 0 H SER A 63 -1.306 -4.710 2.881 1.00 0.00 H new ATOM 0 HA SER A 63 1.484 -5.619 3.373 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.042 -6.693 5.314 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.478 -4.999 5.427 1.00 0.00 H new ATOM 0 HG SER A 63 -1.797 -5.346 5.790 1.00 0.00 H new ATOM 982 N PHE A 64 0.874 -7.377 1.621 1.00 0.00 N ATOM 983 CA PHE A 64 0.630 -8.578 0.833 1.00 0.00 C ATOM 984 C PHE A 64 1.091 -9.837 1.567 1.00 0.00 C ATOM 985 O PHE A 64 2.158 -9.840 2.177 1.00 0.00 O ATOM 986 CB PHE A 64 1.367 -8.482 -0.511 1.00 0.00 C ATOM 987 CG PHE A 64 0.982 -7.316 -1.400 1.00 0.00 C ATOM 988 CD1 PHE A 64 -0.370 -7.063 -1.682 1.00 0.00 C ATOM 989 CD2 PHE A 64 1.976 -6.565 -2.055 1.00 0.00 C ATOM 990 CE1 PHE A 64 -0.730 -6.053 -2.582 1.00 0.00 C ATOM 991 CE2 PHE A 64 1.619 -5.602 -3.012 1.00 0.00 C ATOM 992 CZ PHE A 64 0.263 -5.343 -3.274 1.00 0.00 C ATOM 0 H PHE A 64 1.634 -6.792 1.275 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.445 -8.650 0.668 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.437 -8.423 -0.312 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.196 -9.406 -1.063 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.137 -7.652 -1.201 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.017 -6.730 -1.820 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.772 -5.820 -2.744 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.386 -5.061 -3.546 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.014 -4.599 -4.006 1.00 0.00 H new ATOM 1002 N LYS A 65 0.338 -10.931 1.415 1.00 0.00 N ATOM 1003 CA LYS A 65 0.844 -12.286 1.574 1.00 0.00 C ATOM 1004 C LYS A 65 0.589 -12.992 0.248 1.00 0.00 C ATOM 1005 O LYS A 65 -0.564 -13.177 -0.129 1.00 0.00 O ATOM 1006 CB LYS A 65 0.146 -13.011 2.733 1.00 0.00 C ATOM 1007 CG LYS A 65 0.929 -14.271 3.130 1.00 0.00 C ATOM 1008 CD LYS A 65 0.288 -14.936 4.356 1.00 0.00 C ATOM 1009 CE LYS A 65 1.064 -16.197 4.767 1.00 0.00 C ATOM 1010 NZ LYS A 65 2.081 -15.939 5.807 1.00 0.00 N ATOM 0 H LYS A 65 -0.653 -10.893 1.175 1.00 0.00 H new ATOM 0 HA LYS A 65 1.906 -12.281 1.820 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.063 -12.343 3.590 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.868 -13.283 2.441 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.948 -14.973 2.296 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.964 -14.009 3.350 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.266 -14.231 5.187 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.746 -15.198 4.133 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.361 -16.946 5.133 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.551 -16.619 3.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.703 -16.767 5.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.647 -15.108 5.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 1.610 -15.759 6.716 1.00 0.00 H new ATOM 1024 N LEU A 66 1.655 -13.330 -0.477 1.00 0.00 N ATOM 1025 CA LEU A 66 1.577 -13.993 -1.771 1.00 0.00 C ATOM 1026 C LEU A 66 0.674 -15.232 -1.719 1.00 0.00 C ATOM 1027 O LEU A 66 1.083 -16.280 -1.227 1.00 0.00 O ATOM 1028 CB LEU A 66 2.992 -14.325 -2.277 1.00 0.00 C ATOM 1029 CG LEU A 66 3.889 -15.016 -1.228 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.508 -16.296 -1.787 1.00 0.00 C ATOM 1031 CD2 LEU A 66 5.033 -14.101 -0.784 1.00 0.00 C ATOM 0 H LEU A 66 2.611 -13.146 -0.173 1.00 0.00 H new ATOM 0 HA LEU A 66 1.115 -13.310 -2.484 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.912 -14.970 -3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.475 -13.404 -2.603 1.00 0.00 H new ATOM 0 HG LEU A 66 3.247 -15.249 -0.379 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.134 -16.760 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.716 -16.987 -2.076 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.116 -16.055 -2.659 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.646 -14.617 -0.045 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.646 -13.841 -1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.622 -13.192 -0.344 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.552 -15.111 -2.239 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.529 -16.186 -2.270 1.00 0.00 C ATOM 1045 C GLY A 67 -2.489 -16.069 -1.092 1.00 0.00 C ATOM 1046 O GLY A 67 -2.660 -17.024 -0.337 1.00 0.00 O ATOM 0 H GLY A 67 -0.892 -14.244 -2.656 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.087 -16.152 -3.206 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.020 -17.149 -2.237 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.135 -14.910 -0.941 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.168 -14.702 0.067 1.00 0.00 C ATOM 1052 C VAL A 68 -5.028 -13.510 -0.349 1.00 0.00 C ATOM 1053 O VAL A 68 -4.663 -12.792 -1.283 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.530 -14.549 1.474 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -3.425 -13.101 1.976 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -4.275 -15.375 2.530 1.00 0.00 C ATOM 0 H VAL A 68 -2.953 -14.089 -1.518 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.824 -15.570 0.135 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.515 -14.923 1.340 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.968 -13.091 2.965 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.811 -12.521 1.287 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.421 -12.662 2.032 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.797 -15.241 3.501 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.312 -15.043 2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.246 -16.429 2.254 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.144 -13.288 0.355 1.00 0.00 N ATOM 1067 CA GLU A 69 -6.863 -12.027 0.318 1.00 0.00 C ATOM 1068 C GLU A 69 -6.938 -11.416 1.716 1.00 0.00 C ATOM 1069 O GLU A 69 -6.952 -12.146 2.707 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.244 -12.190 -0.328 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.155 -13.222 0.352 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.596 -13.090 -0.128 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -10.799 -12.560 -1.239 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.495 -13.440 0.668 1.00 0.00 O ATOM 0 H GLU A 69 -6.568 -13.986 0.966 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.311 -11.330 -0.312 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.748 -11.223 -0.324 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.110 -12.476 -1.371 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.790 -14.227 0.141 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.116 -13.089 1.433 1.00 0.00 H new ATOM 1081 N PHE A 70 -6.962 -10.084 1.793 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.090 -9.334 3.036 1.00 0.00 C ATOM 1083 C PHE A 70 -7.978 -8.114 2.799 1.00 0.00 C ATOM 1084 O PHE A 70 -8.082 -7.636 1.668 1.00 0.00 O ATOM 1085 CB PHE A 70 -5.705 -8.939 3.577 1.00 0.00 C ATOM 1086 CG PHE A 70 -4.825 -8.157 2.617 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.126 -8.835 1.604 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -4.654 -6.768 2.769 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.290 -8.126 0.729 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -3.798 -6.062 1.906 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.105 -6.744 0.893 1.00 0.00 C ATOM 0 H PHE A 70 -6.891 -9.486 0.970 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.560 -9.959 3.795 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -5.843 -8.345 4.481 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.176 -9.846 3.869 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.233 -9.905 1.499 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.182 -6.243 3.551 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.787 -8.645 -0.074 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -3.673 -4.996 2.022 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.431 -6.207 0.242 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.640 -7.639 3.860 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.459 -6.435 3.815 1.00 0.00 C ATOM 1103 C ASP A 71 -8.570 -5.231 3.504 1.00 0.00 C ATOM 1104 O ASP A 71 -7.406 -5.208 3.902 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.195 -6.252 5.144 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.158 -5.074 5.076 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -12.281 -5.293 4.573 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -10.763 -3.979 5.529 1.00 0.00 O ATOM 0 H ASP A 71 -8.619 -8.086 4.777 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.208 -6.526 3.028 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.744 -7.162 5.388 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.473 -6.091 5.945 1.00 0.00 H new ATOM 1113 N GLU A 72 -9.098 -4.274 2.745 1.00 0.00 N ATOM 1114 CA GLU A 72 -8.350 -3.188 2.143 1.00 0.00 C ATOM 1115 C GLU A 72 -9.225 -1.935 2.138 1.00 0.00 C ATOM 1116 O GLU A 72 -10.454 -2.028 2.197 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.950 -3.640 0.729 1.00 0.00 C ATOM 1118 CG GLU A 72 -7.270 -2.557 -0.120 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.932 -2.208 0.497 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.955 -1.328 1.383 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.950 -2.882 0.109 1.00 0.00 O ATOM 0 H GLU A 72 -10.094 -4.238 2.528 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.444 -2.944 2.698 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -7.278 -4.494 0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.842 -3.986 0.207 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -7.132 -2.912 -1.141 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.902 -1.670 -0.174 1.00 0.00 H new ATOM 1128 N THR A 73 -8.595 -0.762 2.050 1.00 0.00 N ATOM 1129 CA THR A 73 -9.283 0.520 2.007 1.00 0.00 C ATOM 1130 C THR A 73 -8.628 1.420 0.958 1.00 0.00 C ATOM 1131 O THR A 73 -7.423 1.343 0.735 1.00 0.00 O ATOM 1132 CB THR A 73 -9.319 1.137 3.415 1.00 0.00 C ATOM 1133 OG1 THR A 73 -9.992 2.379 3.406 1.00 0.00 O ATOM 1134 CG2 THR A 73 -7.921 1.349 4.009 1.00 0.00 C ATOM 0 H THR A 73 -7.579 -0.680 2.006 1.00 0.00 H new ATOM 0 HA THR A 73 -10.321 0.391 1.700 1.00 0.00 H new ATOM 0 HB THR A 73 -9.853 0.419 4.038 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.808 2.313 3.944 1.00 0.00 H new ATOM 0 HG21 THR A 73 -8.011 1.787 5.003 1.00 0.00 H new ATOM 0 HG22 THR A 73 -7.407 0.391 4.080 1.00 0.00 H new ATOM 0 HG23 THR A 73 -7.351 2.020 3.367 1.00 0.00 H new ATOM 1142 N THR A 74 -9.419 2.265 0.294 1.00 0.00 N ATOM 1143 CA THR A 74 -8.916 3.323 -0.577 1.00 0.00 C ATOM 1144 C THR A 74 -9.566 4.642 -0.163 1.00 0.00 C ATOM 1145 O THR A 74 -10.451 4.649 0.682 1.00 0.00 O ATOM 1146 CB THR A 74 -9.101 2.948 -2.058 1.00 0.00 C ATOM 1147 OG1 THR A 74 -8.576 3.951 -2.908 1.00 0.00 O ATOM 1148 CG2 THR A 74 -10.555 2.687 -2.451 1.00 0.00 C ATOM 0 H THR A 74 -10.437 2.232 0.348 1.00 0.00 H new ATOM 0 HA THR A 74 -7.839 3.450 -0.462 1.00 0.00 H new ATOM 0 HB THR A 74 -8.552 2.015 -2.183 1.00 0.00 H new ATOM 0 HG1 THR A 74 -8.705 3.688 -3.843 1.00 0.00 H new ATOM 0 HG21 THR A 74 -10.605 2.429 -3.509 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.950 1.863 -1.857 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.148 3.583 -2.268 1.00 0.00 H new ATOM 1156 N ALA A 75 -9.086 5.761 -0.712 1.00 0.00 N ATOM 1157 CA ALA A 75 -9.212 7.087 -0.110 1.00 0.00 C ATOM 1158 C ALA A 75 -10.647 7.574 0.164 1.00 0.00 C ATOM 1159 O ALA A 75 -10.816 8.534 0.913 1.00 0.00 O ATOM 1160 CB ALA A 75 -8.449 8.104 -0.964 1.00 0.00 C ATOM 0 H ALA A 75 -8.590 5.769 -1.603 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.775 6.995 0.885 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -8.540 9.095 -0.519 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.397 7.823 -1.011 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -8.866 8.119 -1.971 1.00 0.00 H new ATOM 1166 N ASP A 76 -11.671 6.946 -0.421 1.00 0.00 N ATOM 1167 CA ASP A 76 -13.087 7.223 -0.175 1.00 0.00 C ATOM 1168 C ASP A 76 -13.676 6.267 0.883 1.00 0.00 C ATOM 1169 O ASP A 76 -14.895 6.166 1.013 1.00 0.00 O ATOM 1170 CB ASP A 76 -13.845 7.089 -1.508 1.00 0.00 C ATOM 1171 CG ASP A 76 -13.762 5.687 -2.105 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -12.977 4.881 -1.550 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -14.441 5.449 -3.134 1.00 0.00 O ATOM 0 H ASP A 76 -11.530 6.203 -1.105 1.00 0.00 H new ATOM 0 HA ASP A 76 -13.192 8.234 0.218 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -14.892 7.350 -1.352 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -13.441 7.806 -2.223 1.00 0.00 H new ATOM 1178 N ASP A 77 -12.809 5.550 1.606 1.00 0.00 N ATOM 1179 CA ASP A 77 -13.070 4.295 2.295 1.00 0.00 C ATOM 1180 C ASP A 77 -14.120 3.427 1.609 1.00 0.00 C ATOM 1181 O ASP A 77 -15.078 2.981 2.243 1.00 0.00 O ATOM 1182 CB ASP A 77 -13.297 4.451 3.808 1.00 0.00 C ATOM 1183 CG ASP A 77 -13.223 3.095 4.514 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -12.564 2.167 3.985 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -13.781 2.947 5.626 1.00 0.00 O ATOM 0 H ASP A 77 -11.844 5.857 1.730 1.00 0.00 H new ATOM 0 HA ASP A 77 -12.139 3.735 2.209 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -12.548 5.124 4.225 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -14.270 4.907 3.989 1.00 0.00 H new ATOM 1190 N ARG A 78 -13.897 3.078 0.335 1.00 0.00 N ATOM 1191 CA ARG A 78 -14.439 1.794 -0.086 1.00 0.00 C ATOM 1192 C ARG A 78 -13.762 0.733 0.776 1.00 0.00 C ATOM 1193 O ARG A 78 -12.535 0.651 0.774 1.00 0.00 O ATOM 1194 CB ARG A 78 -14.180 1.452 -1.556 1.00 0.00 C ATOM 1195 CG ARG A 78 -14.635 2.524 -2.538 1.00 0.00 C ATOM 1196 CD ARG A 78 -15.299 1.905 -3.765 1.00 0.00 C ATOM 1197 NE ARG A 78 -15.518 2.929 -4.797 1.00 0.00 N ATOM 1198 CZ ARG A 78 -16.105 2.660 -5.975 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -16.585 1.433 -6.210 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -16.209 3.590 -6.925 1.00 0.00 N ATOM 0 H ARG A 78 -13.389 3.618 -0.365 1.00 0.00 H new ATOM 0 HA ARG A 78 -15.522 1.835 0.030 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -13.113 1.279 -1.694 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -14.688 0.518 -1.795 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -15.334 3.199 -2.045 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -13.779 3.123 -2.848 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.672 1.107 -4.162 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -16.250 1.453 -3.483 1.00 0.00 H new ATOM 0 HE ARG A 78 -15.211 3.884 -4.611 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.504 0.708 -5.497 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -17.032 1.222 -7.102 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -15.839 4.527 -6.764 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -16.659 3.365 -7.812 1.00 0.00 H new ATOM 1214 N LYS A 79 -14.544 -0.084 1.481 1.00 0.00 N ATOM 1215 CA LYS A 79 -14.037 -1.298 2.093 1.00 0.00 C ATOM 1216 C LYS A 79 -13.941 -2.327 0.969 1.00 0.00 C ATOM 1217 O LYS A 79 -14.967 -2.684 0.390 1.00 0.00 O ATOM 1218 CB LYS A 79 -14.993 -1.742 3.212 1.00 0.00 C ATOM 1219 CG LYS A 79 -14.316 -2.614 4.285 1.00 0.00 C ATOM 1220 CD LYS A 79 -13.274 -1.888 5.156 1.00 0.00 C ATOM 1221 CE LYS A 79 -13.855 -0.719 5.977 1.00 0.00 C ATOM 1222 NZ LYS A 79 -13.024 0.496 5.876 1.00 0.00 N ATOM 0 H LYS A 79 -15.538 0.081 1.640 1.00 0.00 H new ATOM 0 HA LYS A 79 -13.059 -1.162 2.556 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -15.418 -0.858 3.688 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.821 -2.298 2.773 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -15.087 -3.026 4.936 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -13.831 -3.457 3.793 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.819 -2.607 5.837 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -12.478 -1.509 4.514 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -14.864 -0.498 5.629 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -13.937 -1.016 7.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.517 1.292 6.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.114 0.335 6.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.854 0.718 4.874 1.00 0.00 H new ATOM 1236 N VAL A 80 -12.728 -2.735 0.598 1.00 0.00 N ATOM 1237 CA VAL A 80 -12.497 -3.627 -0.532 1.00 0.00 C ATOM 1238 C VAL A 80 -11.670 -4.814 -0.041 1.00 0.00 C ATOM 1239 O VAL A 80 -11.203 -4.805 1.095 1.00 0.00 O ATOM 1240 CB VAL A 80 -11.849 -2.846 -1.699 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -12.468 -1.451 -1.851 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -10.340 -2.658 -1.537 1.00 0.00 C ATOM 0 H VAL A 80 -11.874 -2.453 1.078 1.00 0.00 H new ATOM 0 HA VAL A 80 -13.431 -4.023 -0.930 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.039 -3.457 -2.581 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.990 -0.929 -2.680 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -13.536 -1.546 -2.050 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.319 -0.885 -0.932 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.949 -2.103 -2.390 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -10.139 -2.104 -0.620 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -9.855 -3.633 -1.486 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.472 -5.832 -0.879 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.514 -6.892 -0.619 1.00 0.00 C ATOM 1254 C LYS A 81 -9.336 -6.751 -1.571 1.00 0.00 C ATOM 1255 O LYS A 81 -9.526 -6.649 -2.784 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.145 -8.276 -0.783 1.00 0.00 C ATOM 1257 CG LYS A 81 -12.129 -8.590 0.351 1.00 0.00 C ATOM 1258 CD LYS A 81 -12.101 -10.100 0.611 1.00 0.00 C ATOM 1259 CE LYS A 81 -13.121 -10.518 1.677 1.00 0.00 C ATOM 1260 NZ LYS A 81 -12.878 -11.902 2.130 1.00 0.00 N ATOM 0 H LYS A 81 -11.977 -5.939 -1.759 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.177 -6.799 0.413 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.664 -8.328 -1.740 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -10.361 -9.033 -0.804 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.854 -8.045 1.254 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.135 -8.270 0.080 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -12.308 -10.632 -0.318 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.101 -10.394 0.930 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.063 -9.838 2.527 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.130 -10.436 1.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.788 -12.386 2.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.324 -12.410 1.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.351 -11.886 3.026 1.00 0.00 H new ATOM 1274 N SER A 82 -8.130 -6.790 -1.006 1.00 0.00 N ATOM 1275 CA SER A 82 -6.887 -6.994 -1.719 1.00 0.00 C ATOM 1276 C SER A 82 -6.637 -8.490 -1.789 1.00 0.00 C ATOM 1277 O SER A 82 -6.188 -9.074 -0.807 1.00 0.00 O ATOM 1278 CB SER A 82 -5.755 -6.295 -0.960 1.00 0.00 C ATOM 1279 OG SER A 82 -5.801 -4.926 -1.289 1.00 0.00 O ATOM 0 H SER A 82 -7.996 -6.675 -0.001 1.00 0.00 H new ATOM 0 HA SER A 82 -6.935 -6.579 -2.726 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.872 -6.434 0.115 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.790 -6.722 -1.234 1.00 0.00 H new ATOM 0 HG SER A 82 -5.204 -4.426 -0.694 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.909 -9.092 -2.946 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.480 -10.437 -3.280 1.00 0.00 C ATOM 1287 C ILE A 83 -5.101 -10.306 -3.921 1.00 0.00 C ATOM 1288 O ILE A 83 -4.904 -9.425 -4.759 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.490 -11.100 -4.234 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -8.938 -11.011 -3.714 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.107 -12.569 -4.468 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -9.749 -9.937 -4.445 1.00 0.00 C ATOM 0 H ILE A 83 -7.445 -8.643 -3.689 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.427 -11.073 -2.396 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.450 -10.552 -5.176 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.426 -11.978 -3.835 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.926 -10.791 -2.646 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.827 -13.030 -5.144 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -6.112 -12.620 -4.909 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.110 -13.102 -3.517 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.763 -9.911 -4.045 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.277 -8.965 -4.302 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.785 -10.170 -5.509 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.134 -11.138 -3.533 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.801 -11.082 -4.110 1.00 0.00 C ATOM 1306 C VAL A 84 -2.214 -12.480 -4.290 1.00 0.00 C ATOM 1307 O VAL A 84 -2.345 -13.343 -3.421 1.00 0.00 O ATOM 1308 CB VAL A 84 -1.899 -10.152 -3.280 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -1.755 -10.647 -1.840 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -0.512 -10.019 -3.922 1.00 0.00 C ATOM 0 H VAL A 84 -4.254 -11.858 -2.820 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.867 -10.655 -5.111 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.378 -9.173 -3.261 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -1.111 -9.966 -1.284 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -2.737 -10.685 -1.368 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.314 -11.644 -1.840 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.107 -9.357 -3.317 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.043 -11.001 -3.981 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.614 -9.605 -4.925 1.00 0.00 H new ATOM 1320 N THR A 85 -1.537 -12.680 -5.422 1.00 0.00 N ATOM 1321 CA THR A 85 -0.714 -13.840 -5.708 1.00 0.00 C ATOM 1322 C THR A 85 0.382 -13.403 -6.684 1.00 0.00 C ATOM 1323 O THR A 85 0.526 -12.206 -6.945 1.00 0.00 O ATOM 1324 CB THR A 85 -1.575 -15.008 -6.221 1.00 0.00 C ATOM 1325 OG1 THR A 85 -0.777 -16.171 -6.332 1.00 0.00 O ATOM 1326 CG2 THR A 85 -2.233 -14.719 -7.575 1.00 0.00 C ATOM 0 H THR A 85 -1.552 -12.008 -6.190 1.00 0.00 H new ATOM 0 HA THR A 85 -0.235 -14.220 -4.806 1.00 0.00 H new ATOM 0 HB THR A 85 -2.376 -15.153 -5.496 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.326 -16.915 -6.657 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.826 -15.580 -7.882 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.880 -13.846 -7.486 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.462 -14.525 -8.320 1.00 0.00 H new ATOM 1334 N LEU A 86 1.150 -14.364 -7.198 1.00 0.00 N ATOM 1335 CA LEU A 86 2.309 -14.161 -8.053 1.00 0.00 C ATOM 1336 C LEU A 86 2.261 -15.189 -9.181 1.00 0.00 C ATOM 1337 O LEU A 86 2.363 -16.383 -8.906 1.00 0.00 O ATOM 1338 CB LEU A 86 3.576 -14.265 -7.186 1.00 0.00 C ATOM 1339 CG LEU A 86 4.827 -13.609 -7.791 1.00 0.00 C ATOM 1340 CD1 LEU A 86 5.940 -13.564 -6.738 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.355 -14.355 -9.021 1.00 0.00 C ATOM 0 H LEU A 86 0.968 -15.351 -7.018 1.00 0.00 H new ATOM 0 HA LEU A 86 2.314 -13.174 -8.515 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.375 -13.807 -6.218 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.788 -15.318 -7.002 1.00 0.00 H new ATOM 0 HG LEU A 86 4.536 -12.607 -8.106 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.828 -13.099 -7.167 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.605 -12.983 -5.879 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.180 -14.578 -6.419 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.239 -13.845 -9.404 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.617 -15.376 -8.743 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.585 -14.376 -9.792 1.00 0.00 H new ATOM 1353 N ASP A 87 2.066 -14.743 -10.429 1.00 0.00 N ATOM 1354 CA ASP A 87 1.850 -15.626 -11.571 1.00 0.00 C ATOM 1355 C ASP A 87 3.005 -15.510 -12.578 1.00 0.00 C ATOM 1356 O ASP A 87 3.155 -14.524 -13.308 1.00 0.00 O ATOM 1357 CB ASP A 87 0.453 -15.408 -12.180 1.00 0.00 C ATOM 1358 CG ASP A 87 0.371 -14.170 -13.046 1.00 0.00 C ATOM 1359 OD1 ASP A 87 0.852 -13.109 -12.603 1.00 0.00 O ATOM 1360 OD2 ASP A 87 -0.012 -14.291 -14.235 1.00 0.00 O ATOM 0 H ASP A 87 2.055 -13.752 -10.671 1.00 0.00 H new ATOM 0 HA ASP A 87 1.860 -16.662 -11.233 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.183 -16.280 -12.776 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.279 -15.331 -11.376 1.00 0.00 H new ATOM 1365 N GLY A 88 3.858 -16.537 -12.602 1.00 0.00 N ATOM 1366 CA GLY A 88 4.977 -16.648 -13.526 1.00 0.00 C ATOM 1367 C GLY A 88 6.144 -15.755 -13.112 1.00 0.00 C ATOM 1368 O GLY A 88 7.236 -16.246 -12.836 1.00 0.00 O ATOM 0 H GLY A 88 3.784 -17.329 -11.964 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.310 -17.685 -13.570 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.649 -16.376 -14.529 1.00 0.00 H new ATOM 1372 N GLY A 89 5.916 -14.442 -13.084 1.00 0.00 N ATOM 1373 CA GLY A 89 6.939 -13.452 -12.800 1.00 0.00 C ATOM 1374 C GLY A 89 6.292 -12.075 -12.784 1.00 0.00 C ATOM 1375 O GLY A 89 6.466 -11.303 -13.724 1.00 0.00 O ATOM 0 H GLY A 89 4.997 -14.036 -13.262 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.410 -13.660 -11.839 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.724 -13.492 -13.555 1.00 0.00 H new ATOM 1379 N LYS A 90 5.478 -11.839 -11.753 1.00 0.00 N ATOM 1380 CA LYS A 90 4.866 -10.572 -11.374 1.00 0.00 C ATOM 1381 C LYS A 90 3.909 -10.878 -10.236 1.00 0.00 C ATOM 1382 O LYS A 90 3.271 -11.931 -10.277 1.00 0.00 O ATOM 1383 CB LYS A 90 4.120 -9.892 -12.540 1.00 0.00 C ATOM 1384 CG LYS A 90 3.048 -10.798 -13.151 1.00 0.00 C ATOM 1385 CD LYS A 90 2.733 -10.366 -14.590 1.00 0.00 C ATOM 1386 CE LYS A 90 1.587 -11.202 -15.175 1.00 0.00 C ATOM 1387 NZ LYS A 90 1.805 -12.647 -14.976 1.00 0.00 N ATOM 0 H LYS A 90 5.212 -12.589 -11.115 1.00 0.00 H new ATOM 0 HA LYS A 90 5.642 -9.867 -11.076 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.656 -8.972 -12.184 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.837 -9.609 -13.311 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.391 -11.833 -13.143 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.142 -10.757 -12.547 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.463 -9.310 -14.606 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.623 -10.477 -15.210 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.647 -10.908 -14.707 1.00 0.00 H new ATOM 0 HE3 LYS A 90 1.491 -10.992 -16.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.946 -13.168 -15.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.601 -12.963 -15.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.022 -12.831 -13.976 1.00 0.00 H new ATOM 1401 N LEU A 91 3.797 -9.987 -9.242 1.00 0.00 N ATOM 1402 CA LEU A 91 2.718 -10.102 -8.268 1.00 0.00 C ATOM 1403 C LEU A 91 1.509 -9.341 -8.791 1.00 0.00 C ATOM 1404 O LEU A 91 1.654 -8.257 -9.362 1.00 0.00 O ATOM 1405 CB LEU A 91 3.136 -9.852 -6.804 1.00 0.00 C ATOM 1406 CG LEU A 91 3.063 -8.442 -6.201 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.999 -7.485 -6.921 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.650 -7.851 -6.141 1.00 0.00 C ATOM 0 H LEU A 91 4.427 -9.198 -9.097 1.00 0.00 H new ATOM 0 HA LEU A 91 2.414 -11.145 -8.179 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.522 -10.501 -6.179 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.166 -10.192 -6.701 1.00 0.00 H new ATOM 0 HG LEU A 91 3.386 -8.563 -5.167 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.924 -6.495 -6.471 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.024 -7.846 -6.836 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.721 -7.427 -7.973 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.691 -6.854 -5.702 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.239 -7.787 -7.149 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.014 -8.491 -5.530 1.00 0.00 H new ATOM 1420 N VAL A 92 0.331 -9.947 -8.650 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.925 -9.436 -9.165 1.00 0.00 C ATOM 1422 C VAL A 92 -1.823 -9.129 -7.977 1.00 0.00 C ATOM 1423 O VAL A 92 -2.454 -10.019 -7.412 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.531 -10.406 -10.198 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.525 -10.630 -11.334 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -1.943 -11.770 -9.622 1.00 0.00 C ATOM 0 H VAL A 92 0.228 -10.834 -8.158 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.785 -8.508 -9.720 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.446 -9.933 -10.555 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.950 -11.316 -12.067 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.302 -9.678 -11.815 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.393 -11.056 -10.929 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.359 -12.390 -10.416 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.070 -12.264 -9.196 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.693 -11.625 -8.844 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.848 -7.859 -7.568 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.772 -7.397 -6.552 1.00 0.00 C ATOM 1438 C HIS A 93 -4.086 -7.086 -7.257 1.00 0.00 C ATOM 1439 O HIS A 93 -4.200 -6.059 -7.921 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.180 -6.183 -5.830 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.173 -5.375 -5.026 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -3.111 -4.008 -4.816 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.248 -5.860 -4.332 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -4.126 -3.667 -4.003 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.830 -4.773 -3.711 1.00 0.00 N ATOM 0 H HIS A 93 -1.231 -7.134 -7.933 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.951 -8.149 -5.784 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.388 -6.525 -5.164 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.715 -5.530 -6.569 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.576 -6.888 -4.280 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.340 -2.671 -3.645 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.663 -4.805 -3.123 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.070 -7.967 -7.110 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.423 -7.735 -7.571 1.00 0.00 C ATOM 1456 C VAL A 94 -7.181 -7.099 -6.406 1.00 0.00 C ATOM 1457 O VAL A 94 -7.141 -7.608 -5.288 1.00 0.00 O ATOM 1458 CB VAL A 94 -7.034 -9.058 -8.048 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.452 -8.852 -8.561 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.210 -9.674 -9.181 1.00 0.00 C ATOM 0 H VAL A 94 -4.942 -8.873 -6.660 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.467 -7.061 -8.426 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.040 -9.727 -7.187 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.861 -9.806 -8.893 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -9.073 -8.449 -7.761 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.438 -8.153 -9.397 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.669 -10.611 -9.497 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.177 -8.984 -10.024 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.196 -9.867 -8.830 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.804 -5.947 -6.641 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.479 -5.159 -5.625 1.00 0.00 C ATOM 1472 C GLN A 95 -9.966 -5.120 -5.980 1.00 0.00 C ATOM 1473 O GLN A 95 -10.347 -4.445 -6.938 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.814 -3.781 -5.585 1.00 0.00 C ATOM 1475 CG GLN A 95 -8.380 -2.869 -4.494 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.589 -1.566 -4.399 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -6.379 -1.548 -4.615 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -8.257 -0.460 -4.086 1.00 0.00 N ATOM 0 H GLN A 95 -7.852 -5.528 -7.570 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.398 -5.583 -4.624 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.743 -3.906 -5.425 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.937 -3.297 -6.554 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.426 -2.648 -4.707 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.353 -3.385 -3.534 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -9.261 -0.503 -3.912 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.765 0.431 -4.020 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.786 -5.876 -5.241 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.204 -6.068 -5.525 1.00 0.00 C ATOM 1489 C LYS A 96 -13.055 -5.398 -4.456 1.00 0.00 C ATOM 1490 O LYS A 96 -12.892 -5.693 -3.276 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.520 -7.571 -5.626 1.00 0.00 C ATOM 1492 CG LYS A 96 -14.036 -7.841 -5.681 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.459 -9.074 -6.492 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.690 -10.371 -6.179 1.00 0.00 C ATOM 1495 NZ LYS A 96 -12.786 -10.758 -7.283 1.00 0.00 N ATOM 0 H LYS A 96 -10.471 -6.380 -4.412 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.443 -5.603 -6.481 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -12.046 -7.982 -6.518 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.090 -8.090 -4.769 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.404 -7.955 -4.661 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.528 -6.964 -6.102 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -15.521 -9.252 -6.322 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.339 -8.848 -7.552 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.110 -10.238 -5.266 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.399 -11.177 -5.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.404 -11.708 -7.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.314 -10.762 -8.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -12.003 -10.076 -7.346 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.992 -4.540 -4.873 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.984 -3.956 -3.981 1.00 0.00 C ATOM 1511 C TRP A 97 -16.302 -4.710 -4.113 1.00 0.00 C ATOM 1512 O TRP A 97 -16.765 -5.314 -3.150 1.00 0.00 O ATOM 1513 CB TRP A 97 -15.134 -2.455 -4.244 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.895 -1.980 -5.639 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.836 -1.810 -6.588 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.632 -1.574 -6.247 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.255 -1.289 -7.717 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.897 -1.124 -7.570 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.290 -1.535 -5.815 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.894 -0.639 -8.416 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.285 -0.981 -6.626 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.586 -0.529 -7.922 1.00 0.00 C ATOM 0 H TRP A 97 -14.079 -4.234 -5.842 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.650 -4.056 -2.948 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -16.143 -2.160 -3.955 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.446 -1.926 -3.584 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.884 -2.047 -6.478 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.769 -1.052 -8.565 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -12.031 -1.937 -4.847 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -13.123 -0.354 -9.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.275 -0.902 -6.251 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.811 -0.097 -8.537 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.909 -4.687 -5.304 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.210 -5.309 -5.518 1.00 0.00 C ATOM 1535 C ASN A 98 -18.478 -5.538 -7.004 1.00 0.00 C ATOM 1536 O ASN A 98 -18.084 -6.571 -7.535 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.345 -4.578 -4.764 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.481 -3.085 -5.066 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.619 -2.283 -4.726 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.562 -2.688 -5.733 1.00 0.00 N ATOM 0 H ASN A 98 -16.515 -4.242 -6.133 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.187 -6.302 -5.069 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.290 -5.067 -5.003 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -19.184 -4.701 -3.693 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.683 -1.703 -5.969 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -21.270 -3.369 -6.008 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.136 -4.602 -7.694 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.555 -4.809 -9.072 1.00 0.00 C ATOM 1549 C GLY A 99 -18.392 -4.696 -10.053 1.00 0.00 C ATOM 1550 O GLY A 99 -18.553 -5.016 -11.227 1.00 0.00 O ATOM 0 H GLY A 99 -19.388 -3.690 -7.313 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.013 -5.794 -9.166 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.319 -4.076 -9.331 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.244 -4.184 -9.598 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.018 -4.139 -10.365 1.00 0.00 C ATOM 1556 C GLN A 100 -14.879 -4.525 -9.428 1.00 0.00 C ATOM 1557 O GLN A 100 -15.028 -4.476 -8.200 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.756 -2.749 -10.976 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.996 -1.936 -11.381 1.00 0.00 C ATOM 1560 CD GLN A 100 -17.618 -1.201 -10.193 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -17.011 -0.291 -9.634 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -18.814 -1.587 -9.762 1.00 0.00 N ATOM 0 H GLN A 100 -17.151 -3.783 -8.665 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.096 -4.831 -11.203 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.183 -2.163 -10.258 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.128 -2.876 -11.858 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.720 -1.213 -12.149 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.737 -2.602 -11.822 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.307 -2.344 -10.236 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -19.239 -1.126 -8.957 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.739 -4.851 -10.030 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.465 -5.003 -9.369 1.00 0.00 C ATOM 1573 C GLU A 101 -11.407 -4.441 -10.314 1.00 0.00 C ATOM 1574 O GLU A 101 -11.634 -4.396 -11.523 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.248 -6.470 -8.977 1.00 0.00 C ATOM 1576 CG GLU A 101 -12.350 -7.518 -10.093 1.00 0.00 C ATOM 1577 CD GLU A 101 -12.294 -8.903 -9.466 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -11.365 -9.152 -8.669 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -13.255 -9.690 -9.614 1.00 0.00 O ATOM 0 H GLU A 101 -13.685 -5.022 -11.034 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.410 -4.452 -8.430 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.261 -6.556 -8.523 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.976 -6.725 -8.207 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.280 -7.391 -10.647 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.535 -7.392 -10.806 1.00 0.00 H new ATOM 1586 N THR A 102 -10.300 -3.948 -9.761 1.00 0.00 N ATOM 1587 CA THR A 102 -9.197 -3.369 -10.518 1.00 0.00 C ATOM 1588 C THR A 102 -7.963 -4.235 -10.288 1.00 0.00 C ATOM 1589 O THR A 102 -7.808 -4.800 -9.206 1.00 0.00 O ATOM 1590 CB THR A 102 -8.995 -1.905 -10.090 1.00 0.00 C ATOM 1591 OG1 THR A 102 -7.991 -1.269 -10.837 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.554 -1.754 -8.639 1.00 0.00 C ATOM 0 H THR A 102 -10.144 -3.941 -8.753 1.00 0.00 H new ATOM 0 HA THR A 102 -9.404 -3.354 -11.588 1.00 0.00 H new ATOM 0 HB THR A 102 -9.976 -1.457 -10.249 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.852 -1.754 -11.677 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.430 -0.697 -8.404 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.309 -2.185 -7.982 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.606 -2.272 -8.491 1.00 0.00 H new ATOM 1600 N SER A 103 -7.081 -4.336 -11.284 1.00 0.00 N ATOM 1601 CA SER A 103 -5.854 -5.112 -11.181 1.00 0.00 C ATOM 1602 C SER A 103 -4.651 -4.174 -11.081 1.00 0.00 C ATOM 1603 O SER A 103 -4.563 -3.186 -11.810 1.00 0.00 O ATOM 1604 CB SER A 103 -5.762 -6.091 -12.357 1.00 0.00 C ATOM 1605 OG SER A 103 -6.242 -5.496 -13.545 1.00 0.00 O ATOM 0 H SER A 103 -7.203 -3.878 -12.187 1.00 0.00 H new ATOM 0 HA SER A 103 -5.859 -5.711 -10.270 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.727 -6.405 -12.495 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.340 -6.988 -12.135 1.00 0.00 H new ATOM 0 HG SER A 103 -6.173 -6.137 -14.283 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.747 -4.478 -10.145 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.486 -3.799 -9.915 1.00 0.00 C ATOM 1613 C LEU A 104 -1.389 -4.858 -10.027 1.00 0.00 C ATOM 1614 O LEU A 104 -1.039 -5.500 -9.033 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.455 -3.153 -8.518 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.556 -2.119 -8.251 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.862 -2.766 -7.764 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -3.080 -1.117 -7.189 1.00 0.00 C ATOM 0 H LEU A 104 -3.892 -5.250 -9.495 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.344 -3.000 -10.643 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.530 -3.941 -7.769 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.486 -2.673 -8.379 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.758 -1.617 -9.197 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.609 -1.991 -7.590 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.229 -3.460 -8.521 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.676 -3.307 -6.836 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.865 -0.384 -7.002 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.852 -1.648 -6.265 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.185 -0.607 -7.545 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.856 -5.061 -11.233 1.00 0.00 N ATOM 1631 CA VAL A 105 0.246 -5.994 -11.445 1.00 0.00 C ATOM 1632 C VAL A 105 1.569 -5.245 -11.281 1.00 0.00 C ATOM 1633 O VAL A 105 1.654 -4.094 -11.717 1.00 0.00 O ATOM 1634 CB VAL A 105 0.113 -6.705 -12.804 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -1.253 -7.394 -12.917 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.262 -5.760 -13.999 1.00 0.00 C ATOM 0 H VAL A 105 -1.173 -4.588 -12.080 1.00 0.00 H new ATOM 0 HA VAL A 105 0.218 -6.786 -10.697 1.00 0.00 H new ATOM 0 HB VAL A 105 0.926 -7.430 -12.837 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.331 -7.892 -13.884 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.356 -8.131 -12.120 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.044 -6.650 -12.828 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.158 -6.325 -14.925 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -0.510 -4.992 -13.954 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.245 -5.289 -13.970 1.00 0.00 H new ATOM 1646 N ARG A 106 2.572 -5.859 -10.633 1.00 0.00 N ATOM 1647 CA ARG A 106 3.916 -5.293 -10.524 1.00 0.00 C ATOM 1648 C ARG A 106 4.986 -6.366 -10.702 1.00 0.00 C ATOM 1649 O ARG A 106 4.785 -7.511 -10.298 1.00 0.00 O ATOM 1650 CB ARG A 106 4.165 -4.579 -9.183 1.00 0.00 C ATOM 1651 CG ARG A 106 3.147 -3.494 -8.822 1.00 0.00 C ATOM 1652 CD ARG A 106 1.882 -4.068 -8.154 1.00 0.00 C ATOM 1653 NE ARG A 106 1.802 -3.737 -6.720 1.00 0.00 N ATOM 1654 CZ ARG A 106 1.392 -2.556 -6.229 1.00 0.00 C ATOM 1655 NH1 ARG A 106 1.134 -1.547 -7.064 1.00 0.00 N ATOM 1656 NH2 ARG A 106 1.242 -2.382 -4.912 1.00 0.00 N ATOM 0 H ARG A 106 2.468 -6.763 -10.171 1.00 0.00 H new ATOM 0 HA ARG A 106 3.982 -4.556 -11.324 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.173 -5.325 -8.389 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.158 -4.129 -9.208 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.613 -2.773 -8.150 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.863 -2.952 -9.724 1.00 0.00 H new ATOM 0 HD2 ARG A 106 0.999 -3.681 -8.663 1.00 0.00 H new ATOM 0 HD3 ARG A 106 1.871 -5.151 -8.275 1.00 0.00 H new ATOM 0 HE ARG A 106 2.078 -4.457 -6.052 1.00 0.00 H new ATOM 0 HH11 ARG A 106 1.248 -1.675 -8.069 1.00 0.00 H new ATOM 0 HH12 ARG A 106 0.822 -0.648 -6.697 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.439 -3.150 -4.270 1.00 0.00 H new ATOM 0 HH22 ARG A 106 0.930 -1.481 -4.549 1.00 0.00 H new ATOM 1670 N GLU A 107 6.131 -5.962 -11.262 1.00 0.00 N ATOM 1671 CA GLU A 107 7.351 -6.748 -11.359 1.00 0.00 C ATOM 1672 C GLU A 107 8.498 -5.801 -11.692 1.00 0.00 C ATOM 1673 O GLU A 107 8.245 -4.757 -12.299 1.00 0.00 O ATOM 1674 CB GLU A 107 7.219 -7.801 -12.469 1.00 0.00 C ATOM 1675 CG GLU A 107 8.412 -8.767 -12.559 1.00 0.00 C ATOM 1676 CD GLU A 107 8.760 -9.392 -11.215 1.00 0.00 C ATOM 1677 OE1 GLU A 107 9.542 -8.732 -10.495 1.00 0.00 O ATOM 1678 OE2 GLU A 107 8.206 -10.470 -10.912 1.00 0.00 O ATOM 0 H GLU A 107 6.230 -5.035 -11.677 1.00 0.00 H new ATOM 0 HA GLU A 107 7.537 -7.261 -10.416 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.309 -8.378 -12.302 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.103 -7.293 -13.426 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.183 -9.557 -13.275 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.280 -8.232 -12.943 1.00 0.00 H new ATOM 1685 N MET A 108 9.732 -6.177 -11.336 1.00 0.00 N ATOM 1686 CA MET A 108 10.942 -5.607 -11.904 1.00 0.00 C ATOM 1687 C MET A 108 11.555 -6.607 -12.876 1.00 0.00 C ATOM 1688 O MET A 108 12.033 -7.663 -12.473 1.00 0.00 O ATOM 1689 CB MET A 108 11.957 -5.212 -10.820 1.00 0.00 C ATOM 1690 CG MET A 108 13.173 -4.482 -11.428 1.00 0.00 C ATOM 1691 SD MET A 108 14.829 -5.042 -10.935 1.00 0.00 S ATOM 1692 CE MET A 108 14.858 -6.743 -11.547 1.00 0.00 C ATOM 0 H MET A 108 9.912 -6.896 -10.635 1.00 0.00 H new ATOM 0 HA MET A 108 10.676 -4.692 -12.434 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.474 -4.568 -10.085 1.00 0.00 H new ATOM 0 HB3 MET A 108 12.293 -6.104 -10.291 1.00 0.00 H new ATOM 0 HG2 MET A 108 13.102 -4.559 -12.513 1.00 0.00 H new ATOM 0 HG3 MET A 108 13.089 -3.424 -11.178 1.00 0.00 H new ATOM 0 HE1 MET A 108 15.858 -7.158 -11.421 1.00 0.00 H new ATOM 0 HE2 MET A 108 14.142 -7.344 -10.986 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.591 -6.754 -12.604 1.00 0.00 H new ATOM 1702 N VAL A 109 11.644 -6.203 -14.139 1.00 0.00 N ATOM 1703 CA VAL A 109 12.626 -6.729 -15.072 1.00 0.00 C ATOM 1704 C VAL A 109 13.482 -5.534 -15.475 1.00 0.00 C ATOM 1705 O VAL A 109 13.171 -4.408 -15.078 1.00 0.00 O ATOM 1706 CB VAL A 109 11.955 -7.457 -16.247 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.242 -8.717 -15.741 1.00 0.00 C ATOM 1708 CG2 VAL A 109 10.961 -6.566 -16.999 1.00 0.00 C ATOM 0 H VAL A 109 11.031 -5.496 -14.544 1.00 0.00 H new ATOM 0 HA VAL A 109 13.257 -7.499 -14.629 1.00 0.00 H new ATOM 0 HB VAL A 109 12.743 -7.729 -16.950 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.768 -9.228 -16.579 1.00 0.00 H new ATOM 0 HG12 VAL A 109 11.967 -9.382 -15.273 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.483 -8.437 -15.011 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.516 -7.129 -17.819 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.177 -6.238 -16.316 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.482 -5.696 -17.398 1.00 0.00 H new ATOM 1718 N ASP A 110 14.590 -5.774 -16.181 1.00 0.00 N ATOM 1719 CA ASP A 110 15.620 -4.759 -16.343 1.00 0.00 C ATOM 1720 C ASP A 110 15.990 -4.241 -14.938 1.00 0.00 C ATOM 1721 O ASP A 110 16.285 -5.048 -14.053 1.00 0.00 O ATOM 1722 CB ASP A 110 15.133 -3.710 -17.361 1.00 0.00 C ATOM 1723 CG ASP A 110 16.145 -2.605 -17.610 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.087 -2.848 -18.390 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.959 -1.549 -16.963 1.00 0.00 O ATOM 0 H ASP A 110 14.791 -6.660 -16.645 1.00 0.00 H new ATOM 0 HA ASP A 110 16.548 -5.137 -16.771 1.00 0.00 H new ATOM 0 HB2 ASP A 110 14.907 -4.206 -18.305 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.203 -3.269 -17.002 1.00 0.00 H new ATOM 1730 N GLY A 111 15.904 -2.937 -14.684 1.00 0.00 N ATOM 1731 CA GLY A 111 16.267 -2.310 -13.426 1.00 0.00 C ATOM 1732 C GLY A 111 15.169 -1.377 -12.927 1.00 0.00 C ATOM 1733 O GLY A 111 15.445 -0.498 -12.114 1.00 0.00 O ATOM 0 H GLY A 111 15.567 -2.269 -15.377 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.460 -3.079 -12.678 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.193 -1.749 -13.552 1.00 0.00 H new ATOM 1737 N LYS A 112 13.925 -1.567 -13.382 1.00 0.00 N ATOM 1738 CA LYS A 112 12.800 -0.726 -13.001 1.00 0.00 C ATOM 1739 C LYS A 112 11.592 -1.616 -12.728 1.00 0.00 C ATOM 1740 O LYS A 112 11.398 -2.615 -13.418 1.00 0.00 O ATOM 1741 CB LYS A 112 12.501 0.298 -14.105 1.00 0.00 C ATOM 1742 CG LYS A 112 13.680 1.253 -14.348 1.00 0.00 C ATOM 1743 CD LYS A 112 13.272 2.318 -15.376 1.00 0.00 C ATOM 1744 CE LYS A 112 14.445 3.207 -15.823 1.00 0.00 C ATOM 1745 NZ LYS A 112 14.892 4.167 -14.793 1.00 0.00 N ATOM 0 H LYS A 112 13.676 -2.315 -14.029 1.00 0.00 H new ATOM 0 HA LYS A 112 13.041 -0.168 -12.096 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.265 -0.227 -15.030 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.618 0.876 -13.832 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.975 1.729 -13.413 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.545 0.696 -14.709 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.844 1.826 -16.249 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.490 2.946 -14.949 1.00 0.00 H new ATOM 0 HE2 LYS A 112 15.285 2.571 -16.102 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.151 3.758 -16.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 15.396 4.955 -15.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.066 4.535 -14.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 15.530 3.688 -14.125 1.00 0.00 H new ATOM 1759 N LEU A 113 10.813 -1.277 -11.698 1.00 0.00 N ATOM 1760 CA LEU A 113 9.580 -1.962 -11.357 1.00 0.00 C ATOM 1761 C LEU A 113 8.451 -1.280 -12.114 1.00 0.00 C ATOM 1762 O LEU A 113 8.257 -0.072 -11.968 1.00 0.00 O ATOM 1763 CB LEU A 113 9.381 -1.995 -9.835 1.00 0.00 C ATOM 1764 CG LEU A 113 8.056 -2.628 -9.371 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.285 -3.361 -8.046 1.00 0.00 C ATOM 1766 CD2 LEU A 113 6.975 -1.573 -9.121 1.00 0.00 C ATOM 0 H LEU A 113 11.032 -0.503 -11.071 1.00 0.00 H new ATOM 0 HA LEU A 113 9.606 -3.009 -11.658 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.208 -2.546 -9.386 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.434 -0.975 -9.454 1.00 0.00 H new ATOM 0 HG LEU A 113 7.726 -3.303 -10.161 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.350 -3.811 -7.713 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.033 -4.141 -8.186 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.635 -2.653 -7.294 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.057 -2.063 -8.795 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.312 -0.883 -8.348 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.785 -1.021 -10.042 1.00 0.00 H new ATOM 1778 N ILE A 114 7.724 -2.026 -12.943 1.00 0.00 N ATOM 1779 CA ILE A 114 6.556 -1.507 -13.641 1.00 0.00 C ATOM 1780 C ILE A 114 5.314 -1.720 -12.774 1.00 0.00 C ATOM 1781 O ILE A 114 5.278 -2.632 -11.949 1.00 0.00 O ATOM 1782 CB ILE A 114 6.452 -2.065 -15.078 1.00 0.00 C ATOM 1783 CG1 ILE A 114 6.726 -3.571 -15.253 1.00 0.00 C ATOM 1784 CG2 ILE A 114 7.449 -1.311 -15.969 1.00 0.00 C ATOM 1785 CD1 ILE A 114 5.683 -4.473 -14.595 1.00 0.00 C ATOM 0 H ILE A 114 7.929 -3.004 -13.148 1.00 0.00 H new ATOM 0 HA ILE A 114 6.653 -0.431 -13.787 1.00 0.00 H new ATOM 0 HB ILE A 114 5.408 -1.919 -15.354 1.00 0.00 H new ATOM 0 HG12 ILE A 114 6.770 -3.800 -16.318 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.706 -3.802 -14.836 1.00 0.00 H new ATOM 0 HG21 ILE A 114 7.388 -1.694 -16.988 1.00 0.00 H new ATOM 0 HG22 ILE A 114 7.208 -0.248 -15.965 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.460 -1.455 -15.587 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.947 -5.517 -14.763 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.654 -4.274 -13.524 1.00 0.00 H new ATOM 0 HD13 ILE A 114 4.703 -4.272 -15.028 1.00 0.00 H new ATOM 1797 N LEU A 115 4.319 -0.841 -12.921 1.00 0.00 N ATOM 1798 CA LEU A 115 3.014 -0.948 -12.293 1.00 0.00 C ATOM 1799 C LEU A 115 1.983 -0.563 -13.347 1.00 0.00 C ATOM 1800 O LEU A 115 1.987 0.565 -13.842 1.00 0.00 O ATOM 1801 CB LEU A 115 2.977 -0.071 -11.030 1.00 0.00 C ATOM 1802 CG LEU A 115 1.601 0.253 -10.407 1.00 0.00 C ATOM 1803 CD1 LEU A 115 0.900 1.429 -11.090 1.00 0.00 C ATOM 1804 CD2 LEU A 115 0.610 -0.912 -10.332 1.00 0.00 C ATOM 0 H LEU A 115 4.411 -0.008 -13.503 1.00 0.00 H new ATOM 0 HA LEU A 115 2.791 -1.959 -11.951 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.581 -0.561 -10.266 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.467 0.874 -11.266 1.00 0.00 H new ATOM 0 HG LEU A 115 1.875 0.511 -9.384 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -0.061 1.609 -10.609 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.521 2.321 -11.006 1.00 0.00 H new ATOM 0 HD13 LEU A 115 0.741 1.196 -12.143 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -0.320 -0.570 -9.878 1.00 0.00 H new ATOM 0 HD22 LEU A 115 0.408 -1.283 -11.337 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.035 -1.713 -9.728 1.00 0.00 H new ATOM 1816 N THR A 116 1.108 -1.508 -13.689 1.00 0.00 N ATOM 1817 CA THR A 116 -0.010 -1.276 -14.588 1.00 0.00 C ATOM 1818 C THR A 116 -1.291 -1.383 -13.765 1.00 0.00 C ATOM 1819 O THR A 116 -1.746 -2.485 -13.456 1.00 0.00 O ATOM 1820 CB THR A 116 0.047 -2.265 -15.759 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.335 -2.229 -16.335 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.960 -1.898 -16.851 1.00 0.00 C ATOM 0 H THR A 116 1.161 -2.466 -13.343 1.00 0.00 H new ATOM 0 HA THR A 116 0.027 -0.283 -15.036 1.00 0.00 H new ATOM 0 HB THR A 116 -0.189 -3.255 -15.369 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.377 -2.861 -17.083 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.893 -2.619 -17.665 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.968 -1.912 -16.436 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.738 -0.901 -17.231 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.847 -0.231 -13.385 1.00 0.00 N ATOM 1831 CA LEU A 117 -3.156 -0.136 -12.756 1.00 0.00 C ATOM 1832 C LEU A 117 -4.181 -0.260 -13.884 1.00 0.00 C ATOM 1833 O LEU A 117 -4.186 0.594 -14.768 1.00 0.00 O ATOM 1834 CB LEU A 117 -3.263 1.224 -12.033 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.224 1.115 -10.502 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -2.813 2.452 -9.881 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -4.612 0.772 -9.957 1.00 0.00 C ATOM 0 H LEU A 117 -1.390 0.672 -13.510 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.325 -0.915 -12.012 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.447 1.866 -12.363 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.192 1.711 -12.330 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.506 0.336 -10.248 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -2.790 2.357 -8.795 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.823 2.732 -10.242 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.532 3.221 -10.163 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.568 0.698 -8.870 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.317 1.554 -10.239 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.941 -0.181 -10.372 1.00 0.00 H new ATOM 1849 N THR A 118 -5.007 -1.311 -13.894 1.00 0.00 N ATOM 1850 CA THR A 118 -6.060 -1.514 -14.888 1.00 0.00 C ATOM 1851 C THR A 118 -7.428 -1.538 -14.203 1.00 0.00 C ATOM 1852 O THR A 118 -7.715 -2.451 -13.428 1.00 0.00 O ATOM 1853 CB THR A 118 -5.780 -2.810 -15.656 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.527 -2.700 -16.290 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.841 -3.118 -16.713 1.00 0.00 C ATOM 0 H THR A 118 -4.960 -2.056 -13.199 1.00 0.00 H new ATOM 0 HA THR A 118 -6.070 -0.690 -15.602 1.00 0.00 H new ATOM 0 HB THR A 118 -5.795 -3.626 -14.933 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.337 -3.525 -16.783 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.588 -4.047 -17.223 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.814 -3.221 -16.233 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.879 -2.305 -17.438 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.262 -0.532 -14.505 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.621 -0.373 -13.990 1.00 0.00 C ATOM 1865 C HIS A 119 -10.626 -0.918 -15.003 1.00 0.00 C ATOM 1866 O HIS A 119 -11.727 -1.307 -14.614 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.843 1.114 -13.646 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.232 1.711 -13.679 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.449 1.052 -13.646 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -11.485 3.055 -13.682 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.422 1.984 -13.656 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -12.853 3.208 -13.677 1.00 0.00 N ATOM 0 H HIS A 119 -7.993 0.220 -15.140 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.768 -0.948 -13.076 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.448 1.274 -12.643 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.226 1.698 -14.329 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -12.585 0.041 -13.619 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -10.750 3.847 -13.687 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.483 1.784 -13.648 1.00 0.00 H new ATOM 1881 N GLY A 120 -10.279 -0.896 -16.290 1.00 0.00 N ATOM 1882 CA GLY A 120 -11.102 -1.421 -17.366 1.00 0.00 C ATOM 1883 C GLY A 120 -11.019 -0.435 -18.518 1.00 0.00 C ATOM 1884 O GLY A 120 -10.078 -0.484 -19.302 1.00 0.00 O ATOM 0 H GLY A 120 -9.396 -0.502 -16.615 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -10.749 -2.405 -17.675 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -12.134 -1.542 -17.037 1.00 0.00 H new ATOM 1888 N THR A 121 -11.965 0.506 -18.570 1.00 0.00 N ATOM 1889 CA THR A 121 -11.909 1.607 -19.522 1.00 0.00 C ATOM 1890 C THR A 121 -10.615 2.410 -19.316 1.00 0.00 C ATOM 1891 O THR A 121 -9.919 2.736 -20.274 1.00 0.00 O ATOM 1892 CB THR A 121 -13.194 2.455 -19.431 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.202 3.427 -20.453 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.397 3.152 -18.079 1.00 0.00 C ATOM 0 H THR A 121 -12.781 0.523 -17.958 1.00 0.00 H new ATOM 0 HA THR A 121 -11.873 1.226 -20.542 1.00 0.00 H new ATOM 0 HB THR A 121 -14.018 1.751 -19.547 1.00 0.00 H new ATOM 0 HG1 THR A 121 -14.021 3.961 -20.390 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.323 3.726 -18.101 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.453 2.404 -17.289 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.559 3.822 -17.886 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.273 2.694 -18.053 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.070 3.433 -17.703 1.00 0.00 C ATOM 1904 C ALA A 122 -7.936 2.476 -17.331 1.00 0.00 C ATOM 1905 O ALA A 122 -8.155 1.463 -16.653 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.365 4.404 -16.560 1.00 0.00 C ATOM 0 H ALA A 122 -10.831 2.413 -17.247 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.748 4.009 -18.570 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.458 4.952 -16.305 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.139 5.106 -16.870 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.709 3.847 -15.689 1.00 0.00 H new ATOM 1912 N VAL A 123 -6.723 2.842 -17.757 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.471 2.172 -17.453 1.00 0.00 C ATOM 1914 C VAL A 123 -4.462 3.257 -17.069 1.00 0.00 C ATOM 1915 O VAL A 123 -4.311 4.237 -17.799 1.00 0.00 O ATOM 1916 CB VAL A 123 -4.988 1.364 -18.670 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -3.702 0.600 -18.339 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -6.037 0.344 -19.118 1.00 0.00 C ATOM 0 H VAL A 123 -6.590 3.658 -18.354 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.593 1.465 -16.632 1.00 0.00 H new ATOM 0 HB VAL A 123 -4.809 2.082 -19.471 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -3.379 0.036 -19.214 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -2.922 1.306 -18.054 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -3.889 -0.086 -17.513 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -5.662 -0.209 -19.980 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -6.241 -0.350 -18.303 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -6.956 0.863 -19.391 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.785 3.096 -15.930 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.708 3.960 -15.473 1.00 0.00 C ATOM 1930 C CYS A 124 -1.417 3.149 -15.403 1.00 0.00 C ATOM 1931 O CYS A 124 -1.199 2.417 -14.439 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.049 4.548 -14.098 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.578 5.369 -13.411 1.00 0.00 S ATOM 0 H CYS A 124 -3.983 2.333 -15.283 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.578 4.786 -16.172 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.868 5.261 -14.188 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.386 3.759 -13.426 1.00 0.00 H new ATOM 0 HG CYS A 124 -1.199 6.321 -14.211 1.00 0.00 H new ATOM 1939 N THR A 125 -0.525 3.356 -16.367 1.00 0.00 N ATOM 1940 CA THR A 125 0.860 2.943 -16.257 1.00 0.00 C ATOM 1941 C THR A 125 1.547 3.835 -15.224 1.00 0.00 C ATOM 1942 O THR A 125 1.256 5.036 -15.176 1.00 0.00 O ATOM 1943 CB THR A 125 1.514 3.164 -17.625 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.181 4.470 -18.060 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.002 2.155 -18.655 1.00 0.00 C ATOM 0 H THR A 125 -0.749 3.818 -17.249 1.00 0.00 H new ATOM 0 HA THR A 125 0.942 1.899 -15.955 1.00 0.00 H new ATOM 0 HB THR A 125 2.592 3.036 -17.530 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.020 5.043 -17.281 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.485 2.338 -19.615 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.233 1.144 -18.320 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.077 2.263 -18.765 1.00 0.00 H new ATOM 1953 N ARG A 126 2.468 3.278 -14.440 1.00 0.00 N ATOM 1954 CA ARG A 126 3.404 4.031 -13.623 1.00 0.00 C ATOM 1955 C ARG A 126 4.604 3.117 -13.363 1.00 0.00 C ATOM 1956 O ARG A 126 4.467 1.898 -13.468 1.00 0.00 O ATOM 1957 CB ARG A 126 2.665 4.592 -12.390 1.00 0.00 C ATOM 1958 CG ARG A 126 3.310 4.471 -11.002 1.00 0.00 C ATOM 1959 CD ARG A 126 2.367 5.216 -10.039 1.00 0.00 C ATOM 1960 NE ARG A 126 2.840 5.230 -8.642 1.00 0.00 N ATOM 1961 CZ ARG A 126 2.697 6.252 -7.776 1.00 0.00 C ATOM 1962 NH1 ARG A 126 2.178 7.421 -8.175 1.00 0.00 N ATOM 1963 NH2 ARG A 126 3.078 6.091 -6.507 1.00 0.00 N ATOM 0 H ARG A 126 2.583 2.268 -14.357 1.00 0.00 H new ATOM 0 HA ARG A 126 3.806 4.922 -14.105 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.481 5.651 -12.573 1.00 0.00 H new ATOM 0 HB3 ARG A 126 1.692 4.103 -12.342 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.421 3.426 -10.711 1.00 0.00 H new ATOM 0 HG3 ARG A 126 4.307 4.912 -10.993 1.00 0.00 H new ATOM 0 HD2 ARG A 126 2.247 6.243 -10.383 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.382 4.750 -10.076 1.00 0.00 H new ATOM 0 HE ARG A 126 3.316 4.394 -8.303 1.00 0.00 H new ATOM 0 HH11 ARG A 126 1.886 7.545 -9.144 1.00 0.00 H new ATOM 0 HH12 ARG A 126 2.075 8.187 -7.509 1.00 0.00 H new ATOM 0 HH21 ARG A 126 3.473 5.201 -6.202 1.00 0.00 H new ATOM 0 HH22 ARG A 126 2.975 6.858 -5.842 1.00 0.00 H new ATOM 1977 N THR A 127 5.793 3.673 -13.116 1.00 0.00 N ATOM 1978 CA THR A 127 6.989 2.851 -12.956 1.00 0.00 C ATOM 1979 C THR A 127 7.947 3.473 -11.952 1.00 0.00 C ATOM 1980 O THR A 127 7.906 4.680 -11.698 1.00 0.00 O ATOM 1981 CB THR A 127 7.650 2.551 -14.316 1.00 0.00 C ATOM 1982 OG1 THR A 127 8.508 1.429 -14.242 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.514 3.706 -14.821 1.00 0.00 C ATOM 0 H THR A 127 5.950 4.677 -13.024 1.00 0.00 H new ATOM 0 HA THR A 127 6.692 1.886 -12.545 1.00 0.00 H new ATOM 0 HB THR A 127 6.815 2.375 -14.994 1.00 0.00 H new ATOM 0 HG1 THR A 127 8.298 0.909 -13.438 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.954 3.438 -15.782 1.00 0.00 H new ATOM 0 HG22 THR A 127 7.897 4.597 -14.940 1.00 0.00 H new ATOM 0 HG23 THR A 127 9.308 3.908 -14.102 1.00 0.00 H new ATOM 1991 N TYR A 128 8.774 2.610 -11.369 1.00 0.00 N ATOM 1992 CA TYR A 128 9.571 2.833 -10.186 1.00 0.00 C ATOM 1993 C TYR A 128 10.986 2.330 -10.428 1.00 0.00 C ATOM 1994 O TYR A 128 11.196 1.414 -11.219 1.00 0.00 O ATOM 1995 CB TYR A 128 8.944 2.027 -9.048 1.00 0.00 C ATOM 1996 CG TYR A 128 7.761 2.682 -8.380 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.992 3.596 -7.339 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.444 2.287 -8.686 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.920 4.098 -6.593 1.00 0.00 C ATOM 2000 CE2 TYR A 128 5.375 2.742 -7.895 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.624 3.612 -6.820 1.00 0.00 C ATOM 2002 OH TYR A 128 4.624 3.936 -5.955 1.00 0.00 O ATOM 0 H TYR A 128 8.908 1.671 -11.745 1.00 0.00 H new ATOM 0 HA TYR A 128 9.604 3.894 -9.940 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.632 1.058 -9.438 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.708 1.836 -8.294 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.000 3.912 -7.114 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.256 1.636 -9.527 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.090 4.858 -5.844 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.366 2.424 -8.113 1.00 0.00 H new ATOM 0 HH TYR A 128 4.148 3.123 -5.686 1.00 0.00 H new ATOM 2012 N GLU A 129 11.945 2.904 -9.707 1.00 0.00 N ATOM 2013 CA GLU A 129 13.348 2.537 -9.748 1.00 0.00 C ATOM 2014 C GLU A 129 13.816 2.317 -8.312 1.00 0.00 C ATOM 2015 O GLU A 129 13.465 3.110 -7.434 1.00 0.00 O ATOM 2016 CB GLU A 129 14.090 3.683 -10.431 1.00 0.00 C ATOM 2017 CG GLU A 129 15.578 3.407 -10.631 1.00 0.00 C ATOM 2018 CD GLU A 129 16.158 4.528 -11.469 1.00 0.00 C ATOM 2019 OE1 GLU A 129 16.371 5.615 -10.892 1.00 0.00 O ATOM 2020 OE2 GLU A 129 16.268 4.300 -12.695 1.00 0.00 O ATOM 0 H GLU A 129 11.754 3.665 -9.056 1.00 0.00 H new ATOM 0 HA GLU A 129 13.534 1.619 -10.305 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.630 3.877 -11.400 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.973 4.588 -9.835 1.00 0.00 H new ATOM 0 HG2 GLU A 129 16.087 3.349 -9.669 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.724 2.447 -11.127 1.00 0.00 H new ATOM 2027 N LYS A 130 14.550 1.225 -8.057 1.00 0.00 N ATOM 2028 CA LYS A 130 15.034 0.913 -6.721 1.00 0.00 C ATOM 2029 C LYS A 130 16.248 1.778 -6.411 1.00 0.00 C ATOM 2030 O LYS A 130 17.264 1.677 -7.092 1.00 0.00 O ATOM 2031 CB LYS A 130 15.346 -0.581 -6.541 1.00 0.00 C ATOM 2032 CG LYS A 130 15.705 -0.844 -5.070 1.00 0.00 C ATOM 2033 CD LYS A 130 15.387 -2.265 -4.597 1.00 0.00 C ATOM 2034 CE LYS A 130 16.344 -3.323 -5.153 1.00 0.00 C ATOM 2035 NZ LYS A 130 16.022 -4.654 -4.601 1.00 0.00 N ATOM 0 H LYS A 130 14.818 0.545 -8.768 1.00 0.00 H new ATOM 0 HA LYS A 130 14.239 1.139 -6.010 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.485 -1.183 -6.832 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.173 -0.874 -7.188 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.769 -0.654 -4.926 1.00 0.00 H new ATOM 0 HG3 LYS A 130 15.166 -0.134 -4.442 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.421 -2.293 -3.508 1.00 0.00 H new ATOM 0 HD3 LYS A 130 14.368 -2.518 -4.891 1.00 0.00 H new ATOM 0 HE2 LYS A 130 16.276 -3.348 -6.241 1.00 0.00 H new ATOM 0 HE3 LYS A 130 17.372 -3.059 -4.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 16.741 -5.340 -4.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 16.010 -4.605 -3.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 15.087 -4.955 -4.944 1.00 0.00 H new ATOM 2049 N GLN A 131 16.143 2.596 -5.364 1.00 0.00 N ATOM 2050 CA GLN A 131 17.239 3.415 -4.867 1.00 0.00 C ATOM 2051 C GLN A 131 17.831 2.820 -3.587 1.00 0.00 C ATOM 2052 O GLN A 131 19.021 2.981 -3.331 1.00 0.00 O ATOM 2053 CB GLN A 131 16.789 4.871 -4.713 1.00 0.00 C ATOM 2054 CG GLN A 131 15.487 5.056 -3.924 1.00 0.00 C ATOM 2055 CD GLN A 131 15.127 6.534 -3.838 1.00 0.00 C ATOM 2056 OE1 GLN A 131 15.118 7.237 -4.850 1.00 0.00 O ATOM 2057 NE2 GLN A 131 14.823 7.024 -2.642 1.00 0.00 N ATOM 0 H GLN A 131 15.280 2.707 -4.832 1.00 0.00 H new ATOM 0 HA GLN A 131 18.048 3.416 -5.597 1.00 0.00 H new ATOM 0 HB2 GLN A 131 17.581 5.432 -4.218 1.00 0.00 H new ATOM 0 HB3 GLN A 131 16.663 5.305 -5.705 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.680 4.505 -4.407 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.599 4.643 -2.922 1.00 0.00 H new ATOM 0 HE21 GLN A 131 14.839 6.417 -1.823 1.00 0.00 H new ATOM 0 HE22 GLN A 131 14.573 8.008 -2.542 1.00 0.00 H new ATOM 2066 N ALA A 132 17.018 2.116 -2.789 1.00 0.00 N ATOM 2067 CA ALA A 132 17.447 1.526 -1.525 1.00 0.00 C ATOM 2068 C ALA A 132 18.203 2.547 -0.673 1.00 0.00 C ATOM 2069 O ALA A 132 17.651 3.601 -0.360 1.00 0.00 O ATOM 2070 CB ALA A 132 18.259 0.252 -1.780 1.00 0.00 C ATOM 2071 OXT ALA A 132 19.494 2.288 -0.259 1.00 0.00 O ATOM 0 H ALA A 132 16.037 1.941 -3.009 1.00 0.00 H new ATOM 0 HA ALA A 132 16.566 1.236 -0.952 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.572 -0.177 -0.828 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.644 -0.470 -2.318 1.00 0.00 H new ATOM 0 HB3 ALA A 132 19.139 0.495 -2.375 1.00 0.00 H new